USER MOD reduce.3.24.130724 H: found=0, std=0, add=3689, rem=0, adj=163 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER HYDROLASE 05-OCT-12 4HFQ TITLE CRYSTAL STRUCTURE OF UDP-X DIPHOSPHATASE COMPND MOL_ID: 1; COMPND 2 MOLECULE: MUTT/NUDIX FAMILY PROTEIN; COMPND 3 CHAIN: A, B; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOCOCCUS PNEUMONIAE; SOURCE 3 ORGANISM_TAXID: 170187; SOURCE 4 STRAIN: TIGR4; SOURCE 5 GENE: SP1669, SP_1669; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 0 EXPRESSION_SYSTEM_PLASMID: PET-24A KEYWDS UDP-SUGAR DIPHOSPHATASE, NUDIX, HYDROLASE, RNA EXONUCLEASE, KEYWDS 2 PYROPHOSPHATASE, MUR PATHWAY EXPDTA X-RAY DIFFRACTION AUTHOR K.C.DUONG-LY,L.M.AMZEL,S.B.GABELLI REVDAT 1 07-AUG-13 4HFQ 0 JRNL AUTH K.C.DUONG-LY,H.N.WOO,C.A.DUNN,W.XU,A.BABIC,M.J.BESSMAN, JRNL AUTH 2 L.M.AMZEL,S.B.GABELLI JRNL TITL A UDP-X DIPHOSPHATASE FROM STREPTOCOCCUS PNEUMONIAE JRNL TITL 2 HYDROLYZES PRECURSORS OF PEPTIDOGLYCAN BIOSYNTHESIS. JRNL REF PLOS ONE V. 8 64241 2013 JRNL REFN ESSN 1932-6203 JRNL PMID 23691178 JRNL DOI 10.1371/JOURNAL.PONE.0064241 REMARK 2 REMARK 2 RESOLUTION. 1.39 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.6.0117 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.39 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 67.57 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.9 REMARK 3 NUMBER OF REFLECTIONS : 84088 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.174 REMARK 3 R VALUE (WORKING SET) : 0.172 REMARK 3 FREE R VALUE : 0.196 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 4437 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 1.39 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.43 REMARK 3 REFLECTION IN BIN (WORKING SET) : 6230 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 99.48 REMARK 3 BIN R VALUE (WORKING SET) : 0.2660 REMARK 3 BIN FREE R VALUE SET COUNT : 306 REMARK 3 BIN FREE R VALUE : 0.2550 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 3306 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 167 REMARK 3 SOLVENT ATOMS : 509 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 16.22 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.09000 REMARK 3 B22 (A**2) : -0.09000 REMARK 3 B33 (A**2) : 0.14000 REMARK 3 B12 (A**2) : -0.05000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.061 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.062 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.038 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 0.911 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.967 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.957 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 3756 ; 0.008 ; 0.020 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 5063 ; 1.359 ; 1.992 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 460 ; 5.492 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 190 ;33.287 ;25.368 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 671 ;11.302 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 21 ;19.709 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 543 ; 0.083 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 2837 ; 0.006 ; 0.021 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN USED IF PRESENT IN REMARK 3 THE INPUT U VALUES : REFINED INDIVIDUALLY REMARK 4 REMARK 4 4HFQ COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 11-OCT-12. REMARK 100 THE RCSB ID CODE IS RCSB075409. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 12-JUL-08 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 5.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 31-ID REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : NULL REMARK 200 WAVELENGTH OR RANGE (A) : 0.97929 REMARK 200 MONOCHROMATOR : KOHZU HLD-4 DOUBLE CRYSTAL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : RAYONIX MX-225 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 88640 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.390 REMARK 200 RESOLUTION RANGE LOW (A) : 67.570 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 100.0 REMARK 200 DATA REDUNDANCY : 5.300 REMARK 200 R MERGE (I) : 0.05700 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 7.9000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.39 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.44 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 3.90 REMARK 200 R MERGE FOR SHELL (I) : 0.49600 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SAD REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: SAD REMARK 200 SOFTWARE USED: SOLVE REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 49.13 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.42 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: BIS-TRIS, LI2SO4, PEG-3350, PH 5.5, REMARK 280 VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 298K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 31 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+1/3 REMARK 290 3555 -X+Y,-X,Z+2/3 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 21.56800 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 43.13600 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 300 REMARK: / REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 6230 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 18340 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -50.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B 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 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 ARG A 32 NE - CZ - NH2 ANGL. DEV. = -4.0 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 GLN A 137 67.49 -157.23 REMARK 500 LEU A 153 -127.86 -113.02 REMARK 500 GLN B 137 64.03 -155.91 REMARK 500 LEU B 153 -130.53 -112.07 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A 301 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A 302 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE TRS A 303 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 A 304 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 A 305 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 A 306 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PEG A 307 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A 308 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GOL A 309 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PEG A 310 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 A 311 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A 312 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PGE A 313 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GOL A 314 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GOL A 315 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PEG A 316 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A 317 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 B 301 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO B 302 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GOL B 303 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GOL B 304 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE TRS B 305 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO B 306 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE TRS B 307 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE GOL B 308 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO B 309 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO B 310 REMARK 800 REMARK 800 SITE_IDENTIFIER: DC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO B 311 REMARK 800 REMARK 800 SITE_IDENTIFIER: DC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO B 312 REMARK 800 REMARK 800 SITE_IDENTIFIER: DC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PEG B 313 DBREF 4HFQ A 1 203 UNP Q97PF7 Q97PF7_STRPN 1 203 DBREF 4HFQ B 1 203 UNP Q97PF7 Q97PF7_STRPN 1 203 SEQRES 1 A 203 MET LYS THR SER ASP PHE VAL LYS TYR LEU GLN ARG MET SEQRES 2 A 203 ILE ALA ILE THR ASP THR GLY LEU THR PHE THR LYS ASP SEQRES 3 A 203 PRO PHE ASP ARG GLU ARG TYR GLU ASP LEU ARG SER LEU SEQRES 4 A 203 LEU SER GLU MET LEU ASN GLN ALA SER ASP LEU ASP SER SEQRES 5 A 203 GLU GLU VAL ALA GLU VAL LEU LYS PRO THR SER ALA TYR SEQRES 6 A 203 ALA THR PRO LEU MET ASP VAL ARG ALA TRP ILE VAL GLU SEQRES 7 A 203 ASP GLU LYS ILE CYS LEU VAL ARG GLY GLN GLY GLU ASP SEQRES 8 A 203 SER TRP ALA LEU PRO GLY GLY PHE GLY GLU VAL GLY TYR SEQRES 9 A 203 SER PRO THR GLU ASN ILE LEU LYS GLU ILE GLU GLU GLU SEQRES 10 A 203 THR GLY PHE LYS ALA LYS VAL GLU ARG LEU LEU ALA VAL SEQRES 11 A 203 PHE ASP THR ASN ARG PHE GLN LEU GLN SER LYS GLN TYR SEQRES 12 A 203 THR LYS PHE VAL PHE GLY CYS LYS LEU LEU ASP GLY GLN SEQRES 13 A 203 PHE GLN GLU ASN GLN GLU ILE ALA ASP LEU GLN PHE PHE SEQRES 14 A 203 ALA ILE ASP GLN LEU PRO ASN LEU SER GLU LYS ARG ILE SEQRES 15 A 203 THR LYS GLU GLN ILE GLU LEU LEU TRP GLN VAL TYR GLN SEQRES 16 A 203 GLY HIS ARG GLY GLN TYR LEU ASP SEQRES 1 B 203 MET LYS THR SER ASP PHE VAL LYS TYR LEU GLN ARG MET SEQRES 2 B 203 ILE ALA ILE THR ASP THR GLY LEU THR PHE THR LYS ASP SEQRES 3 B 203 PRO PHE ASP ARG GLU ARG TYR GLU ASP LEU ARG SER LEU SEQRES 4 B 203 LEU SER GLU MET LEU ASN GLN ALA SER ASP LEU ASP SER SEQRES 5 B 203 GLU GLU VAL ALA GLU VAL LEU LYS PRO THR SER ALA TYR SEQRES 6 B 203 ALA THR PRO LEU MET ASP VAL ARG ALA TRP ILE VAL GLU SEQRES 7 B 203 ASP GLU LYS ILE CYS LEU VAL ARG GLY GLN GLY GLU ASP SEQRES 8 B 203 SER TRP ALA LEU PRO GLY GLY PHE GLY GLU VAL GLY TYR SEQRES 9 B 203 SER PRO THR GLU ASN ILE LEU LYS GLU ILE GLU GLU GLU SEQRES 10 B 203 THR GLY PHE LYS ALA LYS VAL GLU ARG LEU LEU ALA VAL SEQRES 11 B 203 PHE ASP THR ASN ARG PHE GLN LEU GLN SER LYS GLN TYR SEQRES 12 B 203 THR LYS PHE VAL PHE GLY CYS LYS LEU LEU ASP GLY GLN SEQRES 13 B 203 PHE GLN GLU ASN GLN GLU ILE ALA ASP LEU GLN PHE PHE SEQRES 14 B 203 ALA ILE ASP GLN LEU PRO ASN LEU SER GLU LYS ARG ILE SEQRES 15 B 203 THR LYS GLU GLN ILE GLU LEU LEU TRP GLN VAL TYR GLN SEQRES 16 B 203 GLY HIS ARG GLY GLN TYR LEU ASP HET EDO A 301 4 HET EDO A 302 4 HET TRS A 303 8 HET SO4 A 304 5 HET SO4 A 305 5 HET SO4 A 306 5 HET PEG A 307 7 HET EDO A 308 4 HET GOL A 309 6 HET PEG A 310 7 HET SO4 A 311 5 HET EDO A 312 4 HET PGE A 313 10 HET GOL A 314 6 HET GOL A 315 6 HET PEG A 316 7 HET EDO A 317 4 HET SO4 B 301 5 HET EDO B 302 4 HET GOL B 303 6 HET GOL B 304 6 HET TRS B 305 8 HET EDO B 306 4 HET TRS B 307 8 HET GOL B 308 6 HET EDO B 309 4 HET EDO B 310 4 HET EDO B 311 4 HET EDO B 312 4 HET PEG B 313 7 HETNAM EDO 1,2-ETHANEDIOL HETNAM TRS 2-AMINO-2-HYDROXYMETHYL-PROPANE-1,3-DIOL HETNAM SO4 SULFATE ION HETNAM PEG DI(HYDROXYETHYL)ETHER HETNAM GOL GLYCEROL HETNAM PGE TRIETHYLENE GLYCOL HETSYN EDO ETHYLENE GLYCOL HETSYN TRS TRIS BUFFER HETSYN GOL GLYCERIN; PROPANE-1,2,3-TRIOL FORMUL 3 EDO 11(C2 H6 O2) FORMUL 5 TRS 3(C4 H12 N O3 1+) FORMUL 6 SO4 5(O4 S 2-) FORMUL 9 PEG 4(C4 H10 O3) FORMUL 11 GOL 6(C3 H8 O3) FORMUL 15 PGE C6 H14 O4 FORMUL 33 HOH *509(H2 O) HELIX 1 1 LYS A 2 THR A 24 1 23 HELIX 2 2 ASP A 26 SER A 48 1 23 HELIX 3 3 ASP A 51 LYS A 60 1 10 HELIX 4 4 SER A 105 GLY A 119 1 15 HELIX 5 5 THR A 133 GLN A 137 1 5 HELIX 6 6 THR A 183 GLN A 195 1 13 HELIX 7 7 LYS B 2 THR B 24 1 23 HELIX 8 8 ASP B 26 GLN B 46 1 21 HELIX 9 9 ASP B 51 LYS B 60 1 10 HELIX 10 10 SER B 105 GLY B 119 1 15 HELIX 11 11 THR B 133 GLN B 137 1 5 HELIX 12 12 ALA B 170 LEU B 174 5 5 HELIX 13 13 THR B 183 GLN B 195 1 13 SHEET 1 A 5 GLY A 97 PHE A 99 0 SHEET 2 A 5 LEU A 69 TRP A 75 -1 N VAL A 72 O GLY A 98 SHEET 3 A 5 TYR A 143 GLY A 155 1 O PHE A 148 N TRP A 75 SHEET 4 A 5 PHE A 120 ASP A 132 -1 N PHE A 131 O LYS A 145 SHEET 5 A 5 TYR A 201 LEU A 202 1 O TYR A 201 N VAL A 130 SHEET 1 B 3 VAL A 77 GLU A 78 0 SHEET 2 B 3 LYS A 81 GLY A 87 -1 O LYS A 81 N GLU A 78 SHEET 3 B 3 TRP A 93 ALA A 94 -1 O ALA A 94 N VAL A 85 SHEET 1 C 3 VAL A 77 GLU A 78 0 SHEET 2 C 3 LYS A 81 GLY A 87 -1 O LYS A 81 N GLU A 78 SHEET 3 C 3 ILE A 163 ALA A 170 -1 O PHE A 169 N ILE A 82 SHEET 1 D 5 GLY B 97 PHE B 99 0 SHEET 2 D 5 LEU B 69 TRP B 75 -1 N VAL B 72 O GLY B 98 SHEET 3 D 5 TYR B 143 GLY B 155 1 O PHE B 148 N TRP B 75 SHEET 4 D 5 PHE B 120 ASP B 132 -1 N LYS B 121 O LEU B 153 SHEET 5 D 5 TYR B 201 LEU B 202 1 O TYR B 201 N VAL B 130 SHEET 1 E 3 VAL B 77 GLU B 78 0 SHEET 2 E 3 LYS B 81 GLY B 87 -1 O LYS B 81 N GLU B 78 SHEET 3 E 3 TRP B 93 ALA B 94 -1 O ALA B 94 N VAL B 85 SHEET 1 F 3 VAL B 77 GLU B 78 0 SHEET 2 F 3 LYS B 81 GLY B 87 -1 O LYS B 81 N GLU B 78 SHEET 3 F 3 ILE B 163 PHE B 169 -1 O GLN B 167 N LEU B 84 CISPEP 1 LYS B 60 PRO B 61 0 -0.16 SITE *** AC1 6 LEU A 177 SER A 178 GLU A 179 LYS A 180 SITE *** AC1 6 PEG A 310 HOH A 464 SITE *** AC2 3 ASP A 5 TYR A 9 HOH A 632 SITE *** AC3 10 ASP A 71 ARG A 73 GLN A 139 TYR A 143 SITE *** AC3 10 LYS A 145 LYS A 180 ARG A 181 HOH A 427 SITE *** AC3 10 HOH A 578 PRO B 61 SITE *** AC4 9 ARG A 73 VAL A 85 GLY A 97 GLU A 117 SITE *** AC4 9 GLU A 162 ARG A 181 HOH A 430 HOH A 442 SITE *** AC4 9 HOH A 593 SITE *** AC5 8 ARG A 86 TRP A 191 GLN A 192 GLN A 195 SITE *** AC5 8 HIS A 197 HOH A 413 HOH A 616 HOH A 617 SITE *** AC6 6 GLU A 101 TYR A 104 LYS A 112 LYS B 8 SITE *** AC6 6 ARG B 12 HOH B 509 SITE *** AC7 8 LEU A 111 LYS A 112 GLU A 115 LYS A 121 SITE *** AC7 8 ALA A 122 HOH A 445 HOH A 446 HOH A 470 SITE *** AC8 4 LYS A 8 ASN A 134 HOH A 420 HOH B 571 SITE *** AC9 7 ARG A 135 ASP A 203 HOH A 438 HOH A 605 SITE *** AC9 7 HOH A 633 SER B 105 GLU B 108 SITE *** BC1 8 ASN A 176 LEU A 177 GLU A 179 LYS A 184 SITE *** BC1 8 EDO A 301 HOH A 414 HOH A 462 HOH A 629 SITE *** BC2 5 LYS A 2 THR A 3 SER A 4 HOH A 498 SITE *** BC2 5 HOH A 508 SITE *** BC3 7 ALA A 66 HOH A 429 HOH A 485 HOH A 511 SITE *** BC3 7 PHE B 99 GLY B 100 GLU B 101 SITE *** BC4 14 THR A 62 SER A 63 TYR A 65 ALA A 66 SITE *** BC4 14 THR A 67 LEU A 69 LYS A 141 GLN A 142 SITE *** BC4 14 HOH A 412 HOH A 416 HOH A 502 HOH A 584 SITE *** BC4 14 LEU B 69 VAL B 102 SITE *** BC5 9 SER A 63 VAL A 102 HOH A 507 ALA B 15 SITE *** BC5 9 LEU B 69 LYS B 141 GLN B 142 HOH B 415 SITE *** BC5 9 HOH B 441 SITE *** BC6 7 GLU A 78 PHE A 120 LEU A 152 PHE A 168 SITE *** BC6 7 HOH A 532 HOH A 534 HOH A 590 SITE *** BC7 6 ASP A 91 TRP A 93 GLN A 167 ASN A 176 SITE *** BC7 6 EDO A 317 HOH A 408 SITE *** BC8 7 ASP A 91 ASN A 176 LEU A 189 GLN A 192 SITE *** BC8 7 ARG A 198 PEG A 316 HOH A 408 SITE *** BC9 6 GLN B 139 SER B 140 LYS B 180 EDO B 302 SITE *** BC9 6 HOH B 432 HOH B 461 SITE *** CC1 5 ASN B 45 LEU B 138 SO4 B 301 HOH B 528 SITE *** CC1 5 HOH B 530 SITE *** CC2 9 ARG B 73 GLN B 139 TYR B 143 LYS B 145 SITE *** CC2 9 LYS B 180 ARG B 181 TRS B 305 HOH B 477 SITE *** CC2 9 HOH B 626 SITE *** CC3 7 GLU B 78 PHE B 120 PHE B 168 HOH B 438 SITE *** CC3 7 HOH B 534 HOH B 543 HOH B 640 SITE *** CC4 11 ARG B 73 GLY B 97 GLU B 117 GLU B 162 SITE *** CC4 11 ILE B 163 ARG B 181 GOL B 303 HOH B 439 SITE *** CC4 11 HOH B 477 HOH B 596 HOH B 633 SITE *** CC5 9 PRO A 68 LEU A 69 MET A 70 THR A 144 SITE *** CC5 9 PRO B 68 MET B 70 THR B 144 PHE B 146 SITE *** CC5 9 HOH B 544 SITE *** CC6 8 LYS A 123 LEU B 177 SER B 178 GLU B 179 SITE *** CC6 8 LYS B 180 HOH B 559 HOH B 604 HOH B 615 SITE *** CC7 8 ARG A 12 GLU B 31 ASP B 35 GLU B 101 SITE *** CC7 8 LYS B 112 GLU B 116 HOH B 417 HOH B 525 SITE *** CC8 5 LEU A 21 THR A 22 HOH B 446 HOH B 618 SITE *** CC8 5 HOH B 620 SITE *** CC9 7 ARG A 30 HOH A 441 THR B 24 LYS B 25 SITE *** CC9 7 PRO B 27 ARG B 30 HOH B 516 SITE *** DC1 4 LEU B 202 PEG B 313 HOH B 542 HOH B 643 SITE *** DC2 6 ARG B 86 TRP B 93 GLY B 196 ARG B 198 SITE *** DC2 6 GLY B 199 HOH B 428 SITE *** DC3 10 LEU B 174 PRO B 175 ARG B 198 GLY B 199 SITE *** DC3 10 GLN B 200 TYR B 201 LEU B 202 EDO B 311 SITE *** DC3 10 HOH B 440 HOH B 567 CRYST1 77.992 77.992 64.704 90.00 90.00 120.00 P 31 6 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 0.012822 0.007403 0.000000 0.00000 SCALE2 0.000000 0.014805 0.000000 0.00000 SCALE3 0.000000 0.000000 0.015455 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 311 EDO O1 : rot -52:sc= 0.801 USER MOD Set 1.2: B 313 PEG O1 : rot 89:sc= 0.0147 USER MOD Set 2.1: B 303 GOL O3 : rot -130:sc= 0.158 USER MOD Set 2.2: B 305 TRS O1 : rot -107:sc= 1.95 USER MOD Set 3.1: B 139 GLN : amide:sc= 1.69 K(o=2.1,f=1.2) USER MOD Set 3.2: B 303 GOL O2 : rot -64:sc= 0.394 USER MOD Set 4.1: B 195 GLN B: amide:sc= 0.647 K(o=-1,f=0.51) USER MOD Set 4.2: B 197 HIS : no HD1:sc= -1.69! K(o=-1!,f=1.3) USER MOD Set 5.1: B 137 GLN : amide:sc= -5.39! K(o=-8.9!,f=1.7) USER MOD Set 5.2: B 186 GLN : amide:sc= -3.54! C(o=-8.9!,f=-5.5!) USER MOD Set 6.1: B 178 SER OG : rot 4:sc= 1.28 USER MOD Set 6.2: B 307 TRS O2 : rot -96:sc= 1.45 USER MOD Set 7.1: B 92 SER OG A: rot -139:sc= -2.35! USER MOD Set 7.2: B 176 ASN : amide:sc= -3.19! K(o=-5.5!,f=1.9) USER MOD Set 8.1: B 145 LYS NZ :NH3+ 169:sc= 2.88 (180deg=1.4) USER MOD Set 8.2: B 303 GOL O1 : rot 59:sc= 2.34 USER MOD Set 9.1: A 70 MET CE A:methyl -178:sc= -5.2! (180deg=-5.21!) USER MOD Set 9.2: B 144 THR OG1 : rot -30:sc= 1.01 USER MOD Set10.1: B 141 LYS NZ A:NH3+ -117:sc= 3.04 (180deg=-0.00283) USER MOD Set10.2: B 143 TYR OH : rot 61:sc= 0.245 USER MOD Set11.1: A 65 TYR OH : rot -172:sc= 1.22 USER MOD Set11.2: B 141 LYS NZ B:NH3+ -160:sc= 0.792 (180deg=0.544) USER MOD Set12.1: B 112 LYS NZ :NH3+ -160:sc= 2.39 (180deg=1.63) USER MOD Set12.2: B 308 GOL O2 : rot -135:sc= 2.46 USER MOD Set12.3: B 308 GOL O3 : rot 14:sc= 0.0612 USER MOD Set13.1: A 309 GOL O3 : rot 153:sc= 1.76 USER MOD Set13.2: B 105 SER OG : rot 92:sc= 0.115 USER MOD Set13.3: B 107 THR OG1 : rot 110:sc= 0.866 USER MOD Set14.1: A 8 LYS NZ :NH3+ -175:sc= 1.05 (180deg=0.818) USER MOD Set14.2: A 308 EDO O2 : rot -119:sc= 1.2 USER MOD Set15.1: A 139 GLN : amide:sc= 0.631 K(o=0.38,f=-12!) USER MOD Set15.2: A 303 TRS O2 : rot 113:sc= -0.249 USER MOD Set16.1: A 200 GLN : amide:sc= -4.7! K(o=-7.5!,f=5.4) USER MOD Set16.2: B 200 GLN : amide:sc= -2.79! K(o=-7.5!,f=1.8) USER MOD Set17.1: A 192 GLN : amide:sc= 0.368 K(o=0.67,f=3.7) USER MOD Set17.2: A 197 HIS : no HD1:sc= 0.297! C(o=0.67!,f=-8!) USER MOD Set18.1: A 178 SER OG : rot 7:sc= 0.897 USER MOD Set18.2: A 301 EDO O2 : rot -124:sc= 1.12 USER MOD Set19.1: A 176 ASN B: amide:sc= -0.274 K(o=1.3,f=-1.7!) USER MOD Set19.2: A 301 EDO O1 : rot 180:sc= 0.362 USER MOD Set19.3: A 310 PEG O1 : rot -55:sc= 1.21 USER MOD Set20.1: A 176 ASN A: amide:sc= -3.09! K(o=-2.2!,f=3.3) USER MOD Set20.2: A 316 PEG O1 : rot -110:sc= 0.927 USER MOD Set21.1: A 167 GLN : amide:sc= 1.84 K(o=1.8,f=-0.95) USER MOD Set21.2: A 316 PEG O4 : rot 180:sc= 0 USER MOD Set22.1: A 145 LYS NZ :NH3+ 168:sc= 3.31 (180deg=1.81) USER MOD Set22.2: A 303 TRS O3 : rot -108:sc= 2.14 USER MOD Set23.1: A 137 GLN : amide:sc= 1.1 K(o=1.9,f=-4.7) USER MOD Set23.2: A 186 GLN : amide:sc= 0.838 K(o=1.9,f=-4.7!) USER MOD Set24.1: A 105 SER OG : rot 180:sc= 0.245 USER MOD Set24.2: A 107 THR OG1 : rot 86:sc= 1.3 USER MOD Set25.1: A 67 THR OG1 : rot 75:sc= 1.35 USER MOD Set25.2: A 313 PGE O4 : rot 82:sc= 1.14 USER MOD Set26.1: A 63 SER OG : rot -150:sc= 1.48 USER MOD Set26.2: A 314 GOL O1 : rot 136:sc= 1.69 USER MOD Set27.1: A 1 MET CE :methyl -170:sc= -0.456 (180deg=-0.541) USER MOD Set27.2: A 13 MET CE :methyl -178:sc= -0.145 (180deg=-0.166) USER MOD Set27.3: B 43 MET CE :methyl 178:sc= -0.0246 (180deg=-0.0288) USER MOD Set28.1: A 11 GLN : amide:sc= 1.72 K(o=4.1,f=2) USER MOD Set28.2: A 134 ASN : amide:sc= 2.41 K(o=4.1,f=2) USER MOD Set29.1: A 9 TYR OH : rot 1:sc= 1.12 USER MOD Set29.2: B 46 GLN : amide:sc= 1.47 K(o=2.6,f=1.5) USER MOD Set30.1: A 1 MET N :NH3+ -177:sc= 2.37 (180deg=1.66) USER MOD Set30.2: B 48 SER OG : rot 80:sc= 1.22 USER MOD Single : A 2 LYS NZ :NH3+ 179:sc= 0.00861 (180deg=0.00845) USER MOD Single : A 3 THR OG1 : rot 150:sc= 2.25 USER MOD Single : A 4 SER OG : rot -119:sc= 2.27 USER MOD Single : A 17 THR OG1A: rot 86:sc= 0.542 USER MOD Single : A 17 THR OG1B: rot -10:sc= 0.332 USER MOD Single : A 19 THR OG1 : rot 77:sc= 1.88 USER MOD Single : A 22 THR OG1 : rot 171:sc= 1.34 USER MOD Single : A 24 THR OG1 : rot 80:sc= 1.23 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 TYR OH : rot 169:sc= 1.51 USER MOD Single : A 38 SER OG : rot 65:sc= 1.07 USER MOD Single : A 41 SER OG A: rot 76:sc= 1.08 USER MOD Single : A 41 SER OG B: rot -101:sc= 1.38 USER MOD Single : A 43 MET CE :methyl 127:sc=-0.00917 (180deg=-0.215) USER MOD Single : A 45 ASN A: amide:sc= 0.594 K(o=0.59,f=-0.49) USER MOD Single : A 45 ASN B: amide:sc= -0.51 X(o=-0.51,f=-0.17) USER MOD Single : A 46 GLN : amide:sc= -0.238 X(o=-0.24,f=-0.5) USER MOD Single : A 48 SER OG : rot -78:sc= 0.625 USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 82:sc= 1.5 USER MOD Single : A 70 MET CE B:methyl -162:sc= -1.7 (180deg=-1.85) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 CYS SG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= -0.4 K(o=-0.4,f=2.3) USER MOD Single : A 92 SER OG : rot -101:sc= 1.5 USER MOD Single : A 104 TYR OH : rot 172:sc= 0.0698 USER MOD Single : A 109 ASN : amide:sc= 1.74 K(o=1.7,f=-3.4!) USER MOD Single : A 112 LYS NZ :NH3+ -137:sc= 0.867 (180deg=-0.02) USER MOD Single : A 118 THR OG1 : rot -66:sc= 1.32 USER MOD Single : A 121 LYS NZ :NH3+ 173:sc= 0.00302 (180deg=0.000777) USER MOD Single : A 123 LYS NZ A:NH3+ -103:sc= 1.24 (180deg=-1.11) USER MOD Single : A 123 LYS NZ B:NH3+ -148:sc= 0.639 (180deg=0.0362) USER MOD Single : A 133 THR OG1 : rot 90:sc= 1.64 USER MOD Single : A 140 SER OG : rot -88:sc= 1.29 USER MOD Single : A 141 LYS NZ :NH3+ 169:sc= 3.02 (180deg=2.86) USER MOD Single : A 142 GLN : amide:sc= 1.12 K(o=1.1,f=-5.6!) USER MOD Single : A 143 TYR OH : rot -32:sc= 2.36 USER MOD Single : A 144 THR OG1 : rot 25:sc= -0.652 USER MOD Single : A 150 CYS SG : rot 59:sc= 0.0257 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 GLN : amide:sc=-0.00358 X(o=-0.0036,f=-0.04) USER MOD Single : A 158 GLN : amide:sc= 0 X(o=0,f=-0.45) USER MOD Single : A 160 ASN : amide:sc= 0.521 K(o=0.52,f=-7.1!) USER MOD Single : A 161 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 173 GLN : amide:sc= 0 X(o=0,f=-0.0031) USER MOD Single : A 180 LYS NZ :NH3+ 160:sc= 1.16 (180deg=0.938) USER MOD Single : A 183 THR OG1 : rot -169:sc= 0.985 USER MOD Single : A 184 LYS NZ :NH3+ -163:sc= 0.884 (180deg=0.674) USER MOD Single : A 194 TYR OH : rot 30:sc= 1.11 USER MOD Single : A 195 GLN A: amide:sc= 1.83 K(o=1.8,f=0.004) USER MOD Single : A 195 GLN B: amide:sc= -1.55 K(o=-1.5,f=-3.4!) USER MOD Single : A 201 TYR OH : rot 31:sc= 2.6 USER MOD Single : A 302 EDO O1 : rot 167:sc= 0.202 USER MOD Single : A 302 EDO O2 : rot 180:sc= 0 USER MOD Single : A 303 TRS N :NH3+ -177:sc= 0.712 (180deg=0.596) USER MOD Single : A 303 TRS O1 : rot -61:sc= 1.85 USER MOD Single : A 307 PEG O1 : rot 21:sc= 0.0741 USER MOD Single : A 307 PEG O4 : rot 160:sc= 2.52 USER MOD Single : A 308 EDO O1 : rot -4:sc= 0.811 USER MOD Single : A 309 GOL O1 : rot -11:sc= 0.155 USER MOD Single : A 309 GOL O2 : rot -82:sc= 1.53 USER MOD Single : A 310 PEG O4 : rot -50:sc= 1.45 USER MOD Single : A 312 EDO O1 : rot -167:sc= 0.868 USER MOD Single : A 312 EDO O2 : rot -26:sc= 1.52 USER MOD Single : A 313 PGE O1 : rot -3:sc= 0.429 USER MOD Single : A 314 GOL O2 : rot 15:sc= 2.04 USER MOD Single : A 314 GOL O3 : rot 68:sc= 1.47 USER MOD Single : A 315 GOL O1 : rot 144:sc= 2.31 USER MOD Single : A 315 GOL O2 : rot 102:sc= 1.28 USER MOD Single : A 315 GOL O3 : rot 110:sc= 2.38 USER MOD Single : A 317 EDO O1 : rot 180:sc= 0 USER MOD Single : A 317 EDO O2 : rot 91:sc= 1.15 USER MOD Single : B 1 MET CE :methyl 172:sc= -3.64! (180deg=-3.75!) USER MOD Single : B 1 MET N :NH3+ 166:sc= 0.119 (180deg=0.0952) USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 3 THR OG1 : rot 156:sc= 0.974 USER MOD Single : B 4 SER OG : rot -125:sc= 0.605 USER MOD Single : B 8 LYS NZ :NH3+ 177:sc= 0.666 (180deg=0.662) USER MOD Single : B 9 TYR OH : rot -140:sc= 1.72 USER MOD Single : B 11 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : B 13 MET CE :methyl -123:sc= 0 (180deg=-0.0167) USER MOD Single : B 17 THR OG1 : rot 78:sc= 0.519 USER MOD Single : B 19 THR OG1A: rot 77:sc= 0.487 USER MOD Single : B 19 THR OG1B: rot 16:sc= 0.122 USER MOD Single : B 22 THR OG1 : rot 38:sc= 0.717 USER MOD Single : B 24 THR OG1 : rot 78:sc= 0.856 USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 2.47 (180deg=2.47) USER MOD Single : B 33 TYR OH : rot -162:sc= 1.12 USER MOD Single : B 38 SER OG A: rot 19:sc= 1.04 USER MOD Single : B 38 SER OG B: rot 63:sc= 0.76 USER MOD Single : B 41 SER OG A: rot 78:sc= 1.14 USER MOD Single : B 41 SER OG B: rot -87:sc= 0.983 USER MOD Single : B 45 ASN : amide:sc= 0.641 X(o=0.64,f=0.15) USER MOD Single : B 52 SER OG : rot 106:sc= 1.51 USER MOD Single : B 60 LYS NZ :NH3+ 172:sc= 0.0816 (180deg=0.0714) USER MOD Single : B 62 THR OG1 : rot 83:sc= 0.784 USER MOD Single : B 63 SER OG A: rot 21:sc= 0.313 USER MOD Single : B 63 SER OG B: rot 180:sc= 0 USER MOD Single : B 63 SER OG C: rot -82:sc= 1.31 USER MOD Single : B 65 TYR OH : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot -110:sc= 0.39 USER MOD Single : B 70 MET CE :methyl 159:sc=-0.000172 (180deg=-0.191) USER MOD Single : B 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 83 CYS SG : rot 180:sc= 0 USER MOD Single : B 88 GLN : amide:sc= -0.344 K(o=-0.34,f=1.4) USER MOD Single : B 92 SER OG B: rot -22:sc= -0.255 USER MOD Single : B 104 TYR OH : rot 180:sc= 0.381 USER MOD Single : B 109 ASN : amide:sc= 1.87 K(o=1.9,f=-3.6!) USER MOD Single : B 118 THR OG1 : rot -60:sc= 0.976 USER MOD Single : B 121 LYS NZ :NH3+ 164:sc= -0.0641 (180deg=-0.344) USER MOD Single : B 123 LYS NZ :NH3+ 145:sc= 0.486 (180deg=0.0987) USER MOD Single : B 133 THR OG1 : rot 91:sc= 1.53 USER MOD Single : B 134 ASN : amide:sc= 1.08 K(o=1.1,f=-0.28) USER MOD Single : B 140 SER OG : rot -76:sc= 1.27 USER MOD Single : B 142 GLN : amide:sc= 1.3 K(o=1.3,f=-6.3!) USER MOD Single : B 150 CYS SG : rot 65:sc= 0.00788 USER MOD Single : B 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 156 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 158 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : B 160 ASN : amide:sc= 0.389 K(o=0.39,f=-6.2!) USER MOD Single : B 161 GLN : amide:sc= 0.424 K(o=0.42,f=-0.99) USER MOD Single : B 167 GLN : amide:sc= 2.4 K(o=2.4,f=-0.058) USER MOD Single : B 173 GLN : amide:sc= 1.04 K(o=1,f=0.53) USER MOD Single : B 180 LYS NZ :NH3+ 173:sc= 1.26 (180deg=1.16) USER MOD Single : B 183 THR OG1 : rot -133:sc= 0.711 USER MOD Single : B 184 LYS NZ :NH3+ -165:sc= 1.31 (180deg=1.12) USER MOD Single : B 192 GLN : amide:sc= 1.57 X(o=1.6,f=1.4) USER MOD Single : B 194 TYR OH : rot 165:sc= 1.34 USER MOD Single : B 195 GLN A: amide:sc= 0.967 K(o=0.97,f=-1.6) USER MOD Single : B 201 TYR OH : rot 22:sc= 1.45 USER MOD Single : B 302 EDO O1 : rot 180:sc= 0 USER MOD Single : B 302 EDO O2 : rot 163:sc= 0.117 USER MOD Single : B 304 GOL O1 : rot 33:sc= 2.3 USER MOD Single : B 304 GOL O2 : rot -86:sc= 2.41 USER MOD Single : B 304 GOL O3 : rot 178:sc= 2.18 USER MOD Single : B 305 TRS N :NH3+ -113:sc= 0.989 (180deg=-0.251) USER MOD Single : B 305 TRS O2 : rot -86:sc= 0.51 USER MOD Single : B 305 TRS O3 : rot -28:sc= -0.705 USER MOD Single : B 306 EDO O1 : rot 48:sc= -2.46! USER MOD Single : B 306 EDO O2 : rot -42:sc= 0.727 USER MOD Single : B 307 TRS N :NH3+ -134:sc= 0.846 (180deg=-1.62!) USER MOD Single : B 307 TRS O1 : rot -37:sc= 0.987 USER MOD Single : B 307 TRS O3 : rot 83:sc= 1.88 USER MOD Single : B 308 GOL O1 : rot -94:sc= 2.1 USER MOD Single : B 309 EDO O1 : rot 180:sc= 0 USER MOD Single : B 309 EDO O2 : rot -33:sc= 0.665 USER MOD Single : B 310 EDO O1 : rot 129:sc= 1.52 USER MOD Single : B 310 EDO O2 : rot 110:sc= 1.34 USER MOD Single : B 311 EDO O2 : rot -98:sc= 1.32 USER MOD Single : B 312 EDO O1 : rot -19:sc= 0.11 USER MOD Single : B 312 EDO O2 : rot 180:sc= 0.139 USER MOD Single : B 313 PEG O4 : rot 154:sc= 1.64 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 23.399 49.004 26.114 1.00 15.57 N ATOM 2 CA MET A 1 22.853 47.714 26.641 1.00 14.52 C ATOM 3 C MET A 1 22.141 47.929 27.968 1.00 14.12 C ATOM 4 O MET A 1 22.667 48.597 28.846 1.00 14.82 O ATOM 5 CB MET A 1 23.978 46.693 26.832 1.00 14.27 C ATOM 6 CG MET A 1 23.438 45.316 27.206 1.00 14.13 C ATOM 7 SD MET A 1 24.713 44.056 27.284 1.00 13.53 S ATOM 8 CE MET A 1 25.229 43.981 25.570 1.00 12.87 C ATOM 0 H1 MET A 1 23.773 48.865 25.318 1.00 15.57 H new ATOM 0 H2 MET A 1 22.738 49.595 26.032 1.00 15.57 H new ATOM 0 H3 MET A 1 24.011 49.320 26.678 1.00 15.57 H new ATOM 0 HA MET A 1 22.217 47.375 25.992 1.00 14.52 H new ATOM 0 HB2 MET A 1 24.496 46.626 26.015 1.00 14.27 H new ATOM 0 HB3 MET A 1 24.581 47.003 27.525 1.00 14.27 H new ATOM 0 HG2 MET A 1 22.993 45.372 28.066 1.00 14.13 H new ATOM 0 HG3 MET A 1 22.768 45.050 26.557 1.00 14.13 H new ATOM 0 HE1 MET A 1 25.814 43.218 25.441 1.00 12.87 H new ATOM 0 HE2 MET A 1 24.449 43.889 25.001 1.00 12.87 H new ATOM 0 HE3 MET A 1 25.703 44.795 25.339 1.00 12.87 H new ATOM 9 N LYS A 2 20.978 47.297 28.112 1.00 14.03 N ATOM 10 CA LYS A 2 20.235 47.277 29.379 1.00 14.71 C ATOM 11 C LYS A 2 20.853 46.301 30.355 1.00 13.30 C ATOM 12 O LYS A 2 21.426 45.281 29.941 1.00 12.57 O ATOM 13 CB LYS A 2 18.783 46.853 29.152 1.00 16.82 C ATOM 14 CG LYS A 2 18.000 47.725 28.186 1.00 19.58 C ATOM 15 CD LYS A 2 16.619 47.121 28.014 1.00 23.22 C ATOM 16 CE LYS A 2 15.741 47.914 27.072 1.00 25.43 C ATOM 17 NZ LYS A 2 14.473 47.161 26.867 1.00 27.85 N ATOM 0 H LYS A 2 20.593 46.865 27.476 1.00 14.03 H new ATOM 0 HA LYS A 2 20.269 48.176 29.741 1.00 14.71 H new ATOM 0 HB2 LYS A 2 18.775 45.941 28.822 1.00 16.82 H new ATOM 0 HB3 LYS A 2 18.324 46.849 30.007 1.00 16.82 H new ATOM 0 HG2 LYS A 2 17.933 48.631 28.526 1.00 19.58 H new ATOM 0 HG3 LYS A 2 18.456 47.776 27.331 1.00 19.58 H new ATOM 0 HD2 LYS A 2 16.707 46.215 27.680 1.00 23.22 H new ATOM 0 HD3 LYS A 2 16.186 47.063 28.880 1.00 23.22 H new ATOM 0 HE2 LYS A 2 15.556 48.792 27.441 1.00 25.43 H new ATOM 0 HE3 LYS A 2 16.193 48.052 26.225 1.00 25.43 H new ATOM 0 HZ1 LYS A 2 13.938 47.622 26.325 1.00 27.85 H new ATOM 0 HZ2 LYS A 2 14.653 46.369 26.502 1.00 27.85 H new ATOM 0 HZ3 LYS A 2 14.069 47.041 27.651 1.00 27.85 H new ATOM 18 N THR A 3 20.737 46.590 31.644 1.00 12.50 N ATOM 19 CA THR A 3 21.200 45.688 32.674 1.00 12.43 C ATOM 20 C THR A 3 20.627 44.285 32.505 1.00 11.98 C ATOM 21 O THR A 3 21.369 43.287 32.554 1.00 12.23 O ATOM 22 CB THR A 3 20.834 46.230 34.070 1.00 13.17 C ATOM 23 OG1 THR A 3 21.471 47.504 34.238 1.00 15.02 O ATOM 24 CG2 THR A 3 21.334 45.315 35.155 1.00 14.04 C ATOM 0 H THR A 3 20.387 47.317 31.942 1.00 12.50 H new ATOM 0 HA THR A 3 22.165 45.631 32.589 1.00 12.43 H new ATOM 0 HB THR A 3 19.869 46.298 34.134 1.00 13.17 H new ATOM 0 HG1 THR A 3 21.007 47.985 34.747 1.00 15.02 H new ATOM 0 HG21 THR A 3 21.092 45.677 36.021 1.00 14.04 H new ATOM 0 HG22 THR A 3 20.934 44.438 35.049 1.00 14.04 H new ATOM 0 HG23 THR A 3 22.299 45.239 35.095 1.00 14.04 H new ATOM 25 N SER A 4 19.324 44.197 32.274 1.00 11.47 N ATOM 26 CA SER A 4 18.679 42.884 32.164 1.00 11.63 C ATOM 27 C SER A 4 19.253 42.083 30.999 1.00 11.45 C ATOM 28 O SER A 4 19.451 40.865 31.107 1.00 10.95 O ATOM 29 CB SER A 4 17.156 43.036 32.020 1.00 11.89 C ATOM 30 OG SER A 4 16.821 43.778 30.881 1.00 13.50 O ATOM 0 H SER A 4 18.798 44.870 32.178 1.00 11.47 H new ATOM 0 HA SER A 4 18.862 42.394 32.981 1.00 11.63 H new ATOM 0 HB2 SER A 4 16.745 42.159 31.969 1.00 11.89 H new ATOM 0 HB3 SER A 4 16.797 43.472 32.809 1.00 11.89 H new ATOM 0 HG SER A 4 16.401 44.469 31.110 1.00 13.50 H new ATOM 31 N ASP A 5 19.523 42.755 29.888 1.00 11.05 N ATOM 32 CA ASP A 5 20.098 42.078 28.737 1.00 11.28 C ATOM 33 C ASP A 5 21.523 41.646 29.025 1.00 10.63 C ATOM 34 O ASP A 5 21.894 40.537 28.675 1.00 10.11 O ATOM 35 CB ASP A 5 20.019 42.942 27.484 1.00 12.58 C ATOM 36 CG ASP A 5 18.612 43.045 26.946 1.00 14.07 C ATOM 37 OD1 ASP A 5 17.859 42.047 26.990 1.00 15.47 O ATOM 38 OD2 ASP A 5 18.248 44.128 26.452 1.00 16.42 O ATOM 0 H ASP A 5 19.382 43.597 29.781 1.00 11.05 H new ATOM 0 HA ASP A 5 19.573 41.280 28.567 1.00 11.28 H new ATOM 0 HB2 ASP A 5 20.352 43.831 27.685 1.00 12.58 H new ATOM 0 HB3 ASP A 5 20.598 42.570 26.800 1.00 12.58 H new ATOM 39 N PHE A 6 22.332 42.481 29.673 1.00 10.20 N ATOM 40 CA PHE A 6 23.669 42.055 30.056 1.00 9.94 C ATOM 41 C PHE A 6 23.612 40.760 30.868 1.00 9.60 C ATOM 42 O PHE A 6 24.348 39.807 30.583 1.00 9.19 O ATOM 43 CB PHE A 6 24.436 43.137 30.850 1.00 10.59 C ATOM 44 CG PHE A 6 25.766 42.648 31.352 1.00 10.76 C ATOM 45 CD1 PHE A 6 26.834 42.521 30.469 1.00 11.26 C ATOM 46 CD2 PHE A 6 25.929 42.244 32.668 1.00 11.20 C ATOM 47 CE1 PHE A 6 28.055 42.058 30.912 1.00 12.18 C ATOM 48 CE2 PHE A 6 27.150 41.751 33.114 1.00 11.81 C ATOM 49 CZ PHE A 6 28.216 41.666 32.227 1.00 12.07 C ATOM 0 H PHE A 6 22.128 43.286 29.896 1.00 10.20 H new ATOM 0 HA PHE A 6 24.155 41.901 29.231 1.00 9.94 H new ATOM 0 HB2 PHE A 6 24.573 43.913 30.284 1.00 10.59 H new ATOM 0 HB3 PHE A 6 23.896 43.426 31.602 1.00 10.59 H new ATOM 0 HD1 PHE A 6 26.724 42.750 29.574 1.00 11.26 H new ATOM 0 HD2 PHE A 6 25.214 42.303 33.259 1.00 11.20 H new ATOM 0 HE1 PHE A 6 28.773 42.009 30.323 1.00 12.18 H new ATOM 0 HE2 PHE A 6 27.252 41.481 33.998 1.00 11.81 H new ATOM 0 HZ PHE A 6 29.039 41.345 32.519 1.00 12.07 H new ATOM 50 N VAL A 7 22.732 40.702 31.864 1.00 9.32 N ATOM 51 CA VAL A 7 22.636 39.505 32.700 1.00 9.62 C ATOM 52 C VAL A 7 22.200 38.289 31.888 1.00 9.51 C ATOM 53 O VAL A 7 22.793 37.217 32.049 1.00 9.27 O ATOM 54 CB VAL A 7 21.729 39.749 33.926 1.00 9.85 C ATOM 55 CG1 VAL A 7 21.416 38.451 34.655 1.00 10.24 C ATOM 56 CG2 VAL A 7 22.406 40.738 34.872 1.00 10.29 C ATOM 0 H VAL A 7 22.188 41.335 32.072 1.00 9.32 H new ATOM 0 HA VAL A 7 23.523 39.308 33.040 1.00 9.62 H new ATOM 0 HB VAL A 7 20.888 40.120 33.615 1.00 9.85 H new ATOM 0 HG11 VAL A 7 20.846 38.637 35.418 1.00 10.24 H new ATOM 0 HG12 VAL A 7 20.960 37.843 34.052 1.00 10.24 H new ATOM 0 HG13 VAL A 7 22.242 38.044 34.961 1.00 10.24 H new ATOM 0 HG21 VAL A 7 21.836 40.891 35.642 1.00 10.29 H new ATOM 0 HG22 VAL A 7 23.256 40.375 35.166 1.00 10.29 H new ATOM 0 HG23 VAL A 7 22.556 41.577 34.410 1.00 10.29 H new ATOM 57 N LYS A 8 21.213 38.439 31.012 1.00 9.36 N ATOM 58 CA LYS A 8 20.797 37.324 30.182 1.00 10.04 C ATOM 59 C LYS A 8 21.920 36.861 29.240 1.00 9.50 C ATOM 60 O LYS A 8 22.105 35.657 29.041 1.00 9.17 O ATOM 61 CB LYS A 8 19.535 37.666 29.412 1.00 10.42 C ATOM 62 CG LYS A 8 18.284 37.759 30.293 1.00 12.06 C ATOM 63 CD LYS A 8 17.137 38.321 29.455 1.00 14.29 C ATOM 64 CE LYS A 8 15.926 38.743 30.264 1.00 15.84 C ATOM 65 NZ LYS A 8 14.909 39.287 29.329 1.00 17.47 N ATOM 0 H LYS A 8 20.778 39.170 30.886 1.00 9.36 H new ATOM 0 HA LYS A 8 20.598 36.580 30.771 1.00 10.04 H new ATOM 0 HB2 LYS A 8 19.663 38.512 28.955 1.00 10.42 H new ATOM 0 HB3 LYS A 8 19.390 36.994 28.728 1.00 10.42 H new ATOM 0 HG2 LYS A 8 18.050 36.883 30.639 1.00 12.06 H new ATOM 0 HG3 LYS A 8 18.453 38.331 31.058 1.00 12.06 H new ATOM 0 HD2 LYS A 8 17.461 39.085 28.953 1.00 14.29 H new ATOM 0 HD3 LYS A 8 16.864 37.652 28.808 1.00 14.29 H new ATOM 0 HE2 LYS A 8 15.566 37.987 30.753 1.00 15.84 H new ATOM 0 HE3 LYS A 8 16.174 39.413 30.920 1.00 15.84 H new ATOM 0 HZ1 LYS A 8 14.220 39.607 29.793 1.00 17.47 H new ATOM 0 HZ2 LYS A 8 15.270 39.941 28.845 1.00 17.47 H new ATOM 0 HZ3 LYS A 8 14.627 38.639 28.788 1.00 17.47 H new ATOM 66 N TYR A 9 22.667 37.798 28.648 1.00 8.93 N ATOM 67 CA TYR A 9 23.806 37.430 27.787 1.00 9.16 C ATOM 68 C TYR A 9 24.850 36.683 28.584 1.00 8.66 C ATOM 69 O TYR A 9 25.330 35.638 28.119 1.00 8.41 O ATOM 70 CB TYR A 9 24.454 38.680 27.174 1.00 9.44 C ATOM 71 CG TYR A 9 23.751 39.256 25.966 1.00 10.36 C ATOM 72 CD1 TYR A 9 23.551 38.490 24.823 1.00 10.73 C ATOM 73 CD2 TYR A 9 23.291 40.574 25.964 1.00 10.74 C ATOM 74 CE1 TYR A 9 22.913 39.002 23.711 1.00 11.43 C ATOM 75 CE2 TYR A 9 22.650 41.103 24.855 1.00 11.08 C ATOM 76 CZ TYR A 9 22.449 40.315 23.741 1.00 11.83 C ATOM 77 OH TYR A 9 21.802 40.791 22.613 1.00 14.42 O ATOM 0 H TYR A 9 22.536 38.644 28.728 1.00 8.93 H new ATOM 0 HA TYR A 9 23.467 36.863 27.077 1.00 9.16 H new ATOM 0 HB2 TYR A 9 24.503 39.367 27.857 1.00 9.44 H new ATOM 0 HB3 TYR A 9 25.366 38.462 26.924 1.00 9.44 H new ATOM 0 HD1 TYR A 9 23.855 37.611 24.807 1.00 10.73 H new ATOM 0 HD2 TYR A 9 23.416 41.105 26.717 1.00 10.74 H new ATOM 0 HE1 TYR A 9 22.795 38.477 22.952 1.00 11.43 H new ATOM 0 HE2 TYR A 9 22.357 41.985 24.862 1.00 11.08 H new ATOM 0 HH TYR A 9 21.769 40.185 22.032 1.00 14.42 H new ATOM 78 N LEU A 10 25.207 37.192 29.765 1.00 9.17 N ATOM 79 CA LEU A 10 26.205 36.517 30.586 1.00 9.56 C ATOM 80 C LEU A 10 25.764 35.098 30.961 1.00 9.29 C ATOM 81 O LEU A 10 26.529 34.127 30.846 1.00 8.88 O ATOM 82 CB LEU A 10 26.518 37.349 31.835 1.00 11.17 C ATOM 83 CG LEU A 10 27.494 36.785 32.868 1.00 12.14 C ATOM 84 CD1 LEU A 10 28.903 36.740 32.319 1.00 13.98 C ATOM 85 CD2 LEU A 10 27.461 37.571 34.177 1.00 13.60 C ATOM 0 H LEU A 10 24.887 37.916 30.102 1.00 9.17 H new ATOM 0 HA LEU A 10 27.017 36.433 30.062 1.00 9.56 H new ATOM 0 HB2 LEU A 10 26.866 38.205 31.539 1.00 11.17 H new ATOM 0 HB3 LEU A 10 25.679 37.525 32.289 1.00 11.17 H new ATOM 0 HG LEU A 10 27.206 35.879 33.060 1.00 12.14 H new ATOM 0 HD11 LEU A 10 29.501 36.379 32.992 1.00 13.98 H new ATOM 0 HD12 LEU A 10 28.925 36.175 31.531 1.00 13.98 H new ATOM 0 HD13 LEU A 10 29.187 37.637 32.082 1.00 13.98 H new ATOM 0 HD21 LEU A 10 28.092 37.183 34.804 1.00 13.60 H new ATOM 0 HD22 LEU A 10 27.702 38.495 34.006 1.00 13.60 H new ATOM 0 HD23 LEU A 10 26.568 37.535 34.554 1.00 13.60 H new ATOM 86 N GLN A 11 24.528 34.998 31.424 1.00 8.77 N ATOM 87 CA GLN A 11 23.968 33.739 31.862 1.00 8.94 C ATOM 88 C GLN A 11 24.034 32.722 30.700 1.00 8.44 C ATOM 89 O GLN A 11 24.455 31.568 30.881 1.00 8.59 O ATOM 90 CB GLN A 11 22.552 34.042 32.322 1.00 9.76 C ATOM 91 CG GLN A 11 21.816 32.908 32.968 1.00 10.25 C ATOM 92 CD GLN A 11 20.335 33.228 32.983 1.00 10.15 C ATOM 93 OE1 GLN A 11 19.651 33.102 31.971 1.00 10.08 O ATOM 94 NE2 GLN A 11 19.837 33.687 34.151 1.00 10.36 N ATOM 0 H GLN A 11 23.989 35.665 31.492 1.00 8.77 H new ATOM 0 HA GLN A 11 24.458 33.337 32.596 1.00 8.94 H new ATOM 0 HB2 GLN A 11 22.586 34.782 32.949 1.00 9.76 H new ATOM 0 HB3 GLN A 11 22.039 34.343 31.556 1.00 9.76 H new ATOM 0 HG2 GLN A 11 21.976 32.084 32.482 1.00 10.25 H new ATOM 0 HG3 GLN A 11 22.139 32.771 33.872 1.00 10.25 H new ATOM 0 HE21 GLN A 11 20.350 33.761 34.838 1.00 10.36 H new ATOM 0 HE22 GLN A 11 19.007 33.906 34.208 1.00 10.36 H new ATOM 95 N ARG A 12 23.676 33.148 29.502 1.00 8.11 N ATOM 96 CA ARG A 12 23.675 32.275 28.341 1.00 8.32 C ATOM 97 C ARG A 12 25.091 31.853 27.926 1.00 8.46 C ATOM 98 O ARG A 12 25.352 30.674 27.627 1.00 8.70 O ATOM 99 CB ARG A 12 22.928 32.943 27.178 1.00 8.52 C ATOM 100 CG ARG A 12 22.869 32.096 25.932 1.00 8.56 C ATOM 101 CD ARG A 12 22.054 30.826 26.121 1.00 8.86 C ATOM 102 NE ARG A 12 22.129 30.008 24.918 1.00 9.31 N ATOM 103 CZ ARG A 12 22.124 28.680 24.902 1.00 9.54 C ATOM 104 NH1 ARG A 12 21.986 27.957 26.028 1.00 10.35 N ATOM 105 NH2 ARG A 12 22.264 28.060 23.737 1.00 10.02 N ATOM 0 H ARG A 12 23.426 33.954 29.337 1.00 8.11 H new ATOM 0 HA ARG A 12 23.208 31.461 28.586 1.00 8.32 H new ATOM 0 HB2 ARG A 12 22.024 33.151 27.461 1.00 8.52 H new ATOM 0 HB3 ARG A 12 23.360 33.785 26.967 1.00 8.52 H new ATOM 0 HG2 ARG A 12 22.485 32.617 25.210 1.00 8.56 H new ATOM 0 HG3 ARG A 12 23.771 31.860 25.663 1.00 8.56 H new ATOM 0 HD2 ARG A 12 22.389 30.327 26.883 1.00 8.86 H new ATOM 0 HD3 ARG A 12 21.130 31.050 26.313 1.00 8.86 H new ATOM 0 HE ARG A 12 22.180 30.415 24.162 1.00 9.31 H new ATOM 0 HH11 ARG A 12 21.898 28.354 26.786 1.00 10.35 H new ATOM 0 HH12 ARG A 12 21.986 27.098 25.990 1.00 10.35 H new ATOM 0 HH21 ARG A 12 22.355 28.518 23.015 1.00 10.02 H new ATOM 0 HH22 ARG A 12 22.264 27.201 23.704 1.00 10.02 H new ATOM 106 N MET A 13 26.021 32.806 27.919 1.00 8.49 N ATOM 107 CA MET A 13 27.394 32.473 27.534 1.00 9.32 C ATOM 108 C MET A 13 28.073 31.544 28.526 1.00 9.13 C ATOM 109 O MET A 13 28.823 30.637 28.114 1.00 9.07 O ATOM 110 CB MET A 13 28.204 33.747 27.352 1.00 10.15 C ATOM 111 CG MET A 13 27.746 34.518 26.136 1.00 10.52 C ATOM 112 SD MET A 13 28.862 35.809 25.575 1.00 13.00 S ATOM 113 CE MET A 13 28.666 36.950 26.926 1.00 12.78 C ATOM 0 H MET A 13 25.886 33.629 28.127 1.00 8.49 H new ATOM 0 HA MET A 13 27.350 31.993 26.692 1.00 9.32 H new ATOM 0 HB2 MET A 13 28.118 34.303 28.142 1.00 10.15 H new ATOM 0 HB3 MET A 13 29.144 33.525 27.262 1.00 10.15 H new ATOM 0 HG2 MET A 13 27.608 33.892 25.408 1.00 10.52 H new ATOM 0 HG3 MET A 13 26.885 34.919 26.332 1.00 10.52 H new ATOM 0 HE1 MET A 13 29.197 37.744 26.758 1.00 12.78 H new ATOM 0 HE2 MET A 13 27.732 37.197 27.008 1.00 12.78 H new ATOM 0 HE3 MET A 13 28.963 36.531 27.749 1.00 12.78 H new ATOM 114 N ILE A 14 27.777 31.690 29.817 1.00 8.90 N ATOM 115 CA ILE A 14 28.267 30.730 30.796 1.00 9.45 C ATOM 116 C ILE A 14 27.737 29.333 30.454 1.00 8.71 C ATOM 117 O ILE A 14 28.491 28.357 30.427 1.00 8.82 O ATOM 118 CB ILE A 14 27.885 31.137 32.241 1.00 10.59 C ATOM 119 CG1 ILE A 14 28.689 32.374 32.675 1.00 11.76 C ATOM 120 CG2 ILE A 14 28.092 29.964 33.203 1.00 11.50 C ATOM 121 CD1 ILE A 14 28.122 33.107 33.875 1.00 13.22 C ATOM 0 H ILE A 14 27.301 32.329 30.140 1.00 8.90 H new ATOM 0 HA ILE A 14 29.236 30.719 30.757 1.00 9.45 H new ATOM 0 HB ILE A 14 26.944 31.371 32.264 1.00 10.59 H new ATOM 0 HG12 ILE A 14 29.597 32.100 32.878 1.00 11.76 H new ATOM 0 HG13 ILE A 14 28.739 32.991 31.928 1.00 11.76 H new ATOM 0 HG21 ILE A 14 27.849 30.236 34.102 1.00 11.50 H new ATOM 0 HG22 ILE A 14 27.535 29.218 32.929 1.00 11.50 H new ATOM 0 HG23 ILE A 14 29.024 29.694 33.189 1.00 11.50 H new ATOM 0 HD11 ILE A 14 28.684 33.870 34.083 1.00 13.22 H new ATOM 0 HD12 ILE A 14 27.224 33.413 33.673 1.00 13.22 H new ATOM 0 HD13 ILE A 14 28.095 32.508 34.637 1.00 13.22 H new ATOM 122 N ALA A 15 26.447 29.233 30.152 1.00 8.29 N ATOM 123 CA ALA A 15 25.859 27.939 29.850 1.00 8.43 C ATOM 124 C ALA A 15 26.460 27.287 28.601 1.00 8.03 C ATOM 125 O ALA A 15 26.756 26.089 28.612 1.00 7.76 O ATOM 126 CB ALA A 15 24.352 28.070 29.731 1.00 8.62 C ATOM 0 H ALA A 15 25.901 29.897 30.117 1.00 8.29 H new ATOM 0 HA ALA A 15 26.070 27.346 30.588 1.00 8.43 H new ATOM 0 HB1 ALA A 15 23.967 27.203 29.529 1.00 8.62 H new ATOM 0 HB2 ALA A 15 23.988 28.398 30.568 1.00 8.62 H new ATOM 0 HB3 ALA A 15 24.136 28.693 29.019 1.00 8.62 H new ATOM 127 N ILE A 16 26.672 28.056 27.532 1.00 7.84 N ATOM 128 CA ILE A 16 27.243 27.510 26.312 1.00 8.18 C ATOM 129 C ILE A 16 28.674 27.032 26.543 1.00 8.24 C ATOM 130 O ILE A 16 29.053 25.926 26.118 1.00 8.24 O ATOM 131 CB ILE A 16 27.204 28.534 25.151 1.00 8.20 C ATOM 132 CG1 ILE A 16 25.760 28.935 24.795 1.00 8.64 C ATOM 133 CG2 ILE A 16 27.917 27.917 23.952 1.00 9.08 C ATOM 134 CD1 ILE A 16 25.652 30.183 23.916 1.00 9.11 C ATOM 0 H ILE A 16 26.490 28.896 27.498 1.00 7.84 H new ATOM 0 HA ILE A 16 26.697 26.749 26.059 1.00 8.18 H new ATOM 0 HB ILE A 16 27.654 29.349 25.422 1.00 8.20 H new ATOM 0 HG12 ILE A 16 25.332 28.193 24.339 1.00 8.64 H new ATOM 0 HG13 ILE A 16 25.266 29.086 25.616 1.00 8.64 H new ATOM 0 HG21 ILE A 16 27.905 28.543 23.211 1.00 9.08 H new ATOM 0 HG22 ILE A 16 28.836 27.716 24.190 1.00 9.08 H new ATOM 0 HG23 ILE A 16 27.465 27.099 23.692 1.00 9.08 H new ATOM 0 HD11 ILE A 16 24.718 30.372 23.735 1.00 9.11 H new ATOM 0 HD12 ILE A 16 26.051 30.938 24.376 1.00 9.11 H new ATOM 0 HD13 ILE A 16 26.119 30.031 23.079 1.00 9.11 H new ATOM 135 N ATHR A 17 29.450 27.863 27.228 0.50 8.30 N ATOM 136 N BTHR A 17 29.476 27.863 27.214 0.50 8.65 N ATOM 137 CA ATHR A 17 30.838 27.560 27.500 0.50 8.72 C ATOM 138 CA BTHR A 17 30.867 27.498 27.477 0.50 9.33 C ATOM 139 C ATHR A 17 30.978 26.300 28.362 0.50 8.91 C ATOM 140 C BTHR A 17 30.957 26.248 28.335 0.50 9.28 C ATOM 141 O ATHR A 17 31.840 25.449 28.103 0.50 9.15 O ATOM 142 O BTHR A 17 31.772 25.360 28.053 0.50 9.37 O ATOM 143 CB ATHR A 17 31.509 28.788 28.138 0.50 8.60 C ATOM 144 CB BTHR A 17 31.682 28.651 28.106 0.50 9.85 C ATOM 145 OG1ATHR A 17 31.430 29.902 27.232 0.50 8.92 O ATOM 146 OG1BTHR A 17 31.081 29.079 29.333 0.50 10.96 O ATOM 147 CG2ATHR A 17 32.955 28.488 28.445 0.50 8.40 C ATOM 148 CG2BTHR A 17 31.789 29.814 27.149 0.50 9.96 C ATOM 0 H ATHR A 17 29.183 28.616 27.546 0.50 8.65 H new ATOM 0 H BTHR A 17 29.238 28.630 27.520 0.50 8.65 H new ATOM 0 HA ATHR A 17 31.294 27.364 26.667 0.50 9.33 H new ATOM 0 HA BTHR A 17 31.265 27.310 26.613 0.50 9.33 H new ATOM 0 HB ATHR A 17 31.050 29.007 28.964 0.50 9.85 H new ATOM 0 HB BTHR A 17 32.575 28.322 28.293 0.50 9.85 H new ATOM 0 HG1ATHR A 17 30.696 30.297 27.337 0.50 10.96 H new ATOM 0 HG1BTHR A 17 30.324 28.723 29.414 0.50 10.96 H new ATOM 0 HG21ATHR A 17 33.369 29.268 28.847 0.50 9.96 H new ATOM 0 HG21BTHR A 17 32.303 30.526 27.561 0.50 9.96 H new ATOM 0 HG22ATHR A 17 33.007 27.741 29.062 0.50 9.96 H new ATOM 0 HG22BTHR A 17 32.232 29.525 26.336 0.50 9.96 H new ATOM 0 HG23ATHR A 17 33.420 28.262 27.624 0.50 9.96 H new ATOM 0 HG23BTHR A 17 30.901 30.139 26.934 0.50 9.96 H new ATOM 149 N ASP A 18 30.107 26.151 29.354 1.00 9.33 N ATOM 150 CA ASP A 18 30.091 24.971 30.202 1.00 9.41 C ATOM 151 C ASP A 18 29.681 23.720 29.431 1.00 8.72 C ATOM 152 O ASP A 18 30.258 22.652 29.619 1.00 8.65 O ATOM 153 CB ASP A 18 29.235 25.256 31.437 1.00 11.31 C ATOM 154 CG ASP A 18 29.914 26.300 32.361 1.00 12.97 C ATOM 155 OD1 ASP A 18 31.047 26.746 32.054 1.00 14.55 O ATOM 156 OD2 ASP A 18 29.340 26.669 33.382 1.00 15.93 O ATOM 0 H AASP A 18 29.508 26.735 29.553 0.50 9.33 H new ATOM 0 H BASP A 18 29.535 26.756 29.568 0.50 9.33 H new ATOM 0 HA ASP A 18 30.989 24.775 30.511 1.00 9.41 H new ATOM 0 HB2 ASP A 18 28.364 25.582 31.162 1.00 11.31 H new ATOM 0 HB3 ASP A 18 29.087 24.433 31.928 1.00 11.31 H new ATOM 157 N THR A 19 28.725 23.877 28.519 1.00 8.29 N ATOM 158 CA THR A 19 28.324 22.774 27.652 1.00 8.31 C ATOM 159 C THR A 19 29.501 22.352 26.764 1.00 8.14 C ATOM 160 O THR A 19 29.755 21.151 26.599 1.00 8.53 O ATOM 161 CB THR A 19 27.103 23.187 26.815 1.00 8.42 C ATOM 162 OG1 THR A 19 26.038 23.553 27.697 1.00 8.96 O ATOM 163 CG2 THR A 19 26.631 22.057 25.916 1.00 8.87 C ATOM 0 H THR A 19 28.298 24.612 28.387 1.00 8.29 H new ATOM 0 HA THR A 19 28.071 22.009 28.192 1.00 8.31 H new ATOM 0 HB THR A 19 27.361 23.934 26.253 1.00 8.42 H new ATOM 0 HG1 THR A 19 26.181 24.321 28.006 1.00 8.96 H new ATOM 0 HG21 THR A 19 25.862 22.351 25.404 1.00 8.87 H new ATOM 0 HG22 THR A 19 27.345 21.805 25.310 1.00 8.87 H new ATOM 0 HG23 THR A 19 26.384 21.292 26.459 1.00 8.87 H new ATOM 164 N GLY A 20 30.246 23.330 26.240 1.00 7.77 N ATOM 165 CA GLY A 20 31.459 23.027 25.467 1.00 8.04 C ATOM 166 C GLY A 20 32.479 22.253 26.299 1.00 8.40 C ATOM 167 O GLY A 20 33.026 21.261 25.825 1.00 8.61 O ATOM 0 H GLY A 20 30.070 24.168 26.319 1.00 7.77 H new ATOM 0 HA2 GLY A 20 31.222 22.509 24.682 1.00 8.04 H new ATOM 0 HA3 GLY A 20 31.858 23.853 25.152 1.00 8.04 H new ATOM 168 N LEU A 21 32.710 22.664 27.540 1.00 8.49 N ATOM 169 CA LEU A 21 33.682 21.947 28.367 1.00 9.01 C ATOM 170 C LEU A 21 33.271 20.512 28.620 1.00 9.24 C ATOM 171 O LEU A 21 34.117 19.611 28.625 1.00 9.76 O ATOM 172 CB LEU A 21 33.928 22.696 29.664 1.00 9.83 C ATOM 173 CG LEU A 21 34.713 23.987 29.468 1.00 10.26 C ATOM 174 CD1 LEU A 21 34.628 24.859 30.717 1.00 11.69 C ATOM 175 CD2 LEU A 21 36.158 23.678 29.077 1.00 10.95 C ATOM 0 H LEU A 21 32.328 23.336 27.917 1.00 8.49 H new ATOM 0 HA LEU A 21 34.517 21.909 27.874 1.00 9.01 H new ATOM 0 HB2 LEU A 21 33.076 22.902 30.079 1.00 9.83 H new ATOM 0 HB3 LEU A 21 34.411 22.120 30.277 1.00 9.83 H new ATOM 0 HG LEU A 21 34.318 24.491 28.739 1.00 10.26 H new ATOM 0 HD11 LEU A 21 35.132 25.676 30.577 1.00 11.69 H new ATOM 0 HD12 LEU A 21 33.700 25.079 30.896 1.00 11.69 H new ATOM 0 HD13 LEU A 21 34.998 24.378 31.474 1.00 11.69 H new ATOM 0 HD21 LEU A 21 36.645 24.508 28.956 1.00 10.95 H new ATOM 0 HD22 LEU A 21 36.579 23.156 29.778 1.00 10.95 H new ATOM 0 HD23 LEU A 21 36.168 23.173 28.249 1.00 10.95 H new ATOM 176 N THR A 22 31.975 20.293 28.847 1.00 8.94 N ATOM 177 CA THR A 22 31.499 18.937 29.102 1.00 9.81 C ATOM 178 C THR A 22 31.545 18.049 27.877 1.00 10.04 C ATOM 179 O THR A 22 31.905 16.875 27.975 1.00 10.69 O ATOM 180 CB THR A 22 30.095 18.995 29.722 1.00 10.09 C ATOM 181 OG1 THR A 22 30.236 19.544 31.031 1.00 10.87 O ATOM 182 CG2 THR A 22 29.452 17.597 29.833 1.00 10.75 C ATOM 0 H THR A 22 31.368 20.902 28.857 1.00 8.94 H new ATOM 0 HA THR A 22 32.107 18.523 29.734 1.00 9.81 H new ATOM 0 HB THR A 22 29.520 19.534 29.157 1.00 10.09 H new ATOM 0 HG1 THR A 22 29.476 19.708 31.350 1.00 10.87 H new ATOM 0 HG21 THR A 22 28.570 17.677 30.228 1.00 10.75 H new ATOM 0 HG22 THR A 22 29.376 17.205 28.949 1.00 10.75 H new ATOM 0 HG23 THR A 22 30.006 17.029 30.392 1.00 10.75 H new ATOM 183 N PHE A 23 31.237 18.602 26.707 1.00 10.43 N ATOM 184 CA PHE A 23 31.012 17.777 25.526 1.00 11.78 C ATOM 185 C PHE A 23 32.118 17.736 24.497 1.00 12.34 C ATOM 186 O PHE A 23 32.148 16.809 23.683 1.00 14.32 O ATOM 187 CB PHE A 23 29.707 18.164 24.836 1.00 12.52 C ATOM 188 CG PHE A 23 28.492 17.705 25.581 1.00 13.02 C ATOM 189 CD1 PHE A 23 28.096 16.380 25.506 1.00 15.00 C ATOM 190 CD2 PHE A 23 27.787 18.574 26.404 1.00 13.13 C ATOM 191 CE1 PHE A 23 26.980 15.940 26.203 1.00 15.21 C ATOM 192 CE2 PHE A 23 26.676 18.139 27.112 1.00 13.64 C ATOM 193 CZ PHE A 23 26.273 16.817 27.008 1.00 14.69 C ATOM 0 H PHE A 23 31.154 19.448 26.577 1.00 10.43 H new ATOM 0 HA PHE A 23 30.977 16.879 25.892 1.00 11.78 H new ATOM 0 HB2 PHE A 23 29.674 19.128 24.736 1.00 12.52 H new ATOM 0 HB3 PHE A 23 29.695 17.786 23.943 1.00 12.52 H new ATOM 0 HD1 PHE A 23 28.581 15.781 24.985 1.00 15.00 H new ATOM 0 HD2 PHE A 23 28.063 19.459 26.481 1.00 13.13 H new ATOM 0 HE1 PHE A 23 26.706 15.054 26.129 1.00 15.21 H new ATOM 0 HE2 PHE A 23 26.205 18.731 27.653 1.00 13.64 H new ATOM 0 HZ PHE A 23 25.528 16.519 27.479 1.00 14.69 H new ATOM 194 N THR A 24 33.022 18.709 24.481 1.00 11.91 N ATOM 195 CA THR A 24 34.062 18.668 23.451 1.00 12.37 C ATOM 196 C THR A 24 35.065 17.541 23.693 1.00 13.69 C ATOM 197 O THR A 24 35.320 17.159 24.834 1.00 14.51 O ATOM 198 CB THR A 24 34.798 20.009 23.287 1.00 11.25 C ATOM 199 OG1 THR A 24 35.564 19.945 22.082 1.00 11.17 O ATOM 200 CG2 THR A 24 35.747 20.291 24.439 1.00 10.84 C ATOM 0 H THR A 24 33.056 19.373 25.027 1.00 11.91 H new ATOM 0 HA THR A 24 33.595 18.490 22.620 1.00 12.37 H new ATOM 0 HB THR A 24 34.136 20.718 23.266 1.00 11.25 H new ATOM 0 HG1 THR A 24 35.063 20.090 21.423 1.00 11.17 H new ATOM 0 HG21 THR A 24 36.188 21.143 24.294 1.00 10.84 H new ATOM 0 HG22 THR A 24 35.247 20.323 25.270 1.00 10.84 H new ATOM 0 HG23 THR A 24 36.413 19.588 24.489 1.00 10.84 H new ATOM 201 N LYS A 25 35.666 17.058 22.605 1.00 15.22 N ATOM 202 CA LYS A 25 36.634 15.975 22.670 1.00 17.27 C ATOM 203 C LYS A 25 38.015 16.408 22.188 1.00 17.83 C ATOM 204 O LYS A 25 38.944 15.597 22.117 1.00 19.74 O ATOM 205 CB LYS A 25 36.127 14.769 21.865 1.00 19.75 C ATOM 206 CG LYS A 25 34.851 14.138 22.416 1.00 22.49 C ATOM 207 CD LYS A 25 35.135 13.311 23.661 1.00 25.97 C ATOM 208 CE LYS A 25 33.962 12.408 24.004 1.00 28.39 C ATOM 209 NZ LYS A 25 34.395 11.247 24.838 1.00 30.32 N ATOM 0 H LYS A 25 35.521 17.352 21.810 1.00 15.22 H new ATOM 0 HA LYS A 25 36.729 15.719 23.601 1.00 17.27 H new ATOM 0 HB2 LYS A 25 35.968 15.048 20.950 1.00 19.75 H new ATOM 0 HB3 LYS A 25 36.824 14.095 21.839 1.00 19.75 H new ATOM 0 HG2 LYS A 25 34.209 14.834 22.627 1.00 22.49 H new ATOM 0 HG3 LYS A 25 34.447 13.575 21.737 1.00 22.49 H new ATOM 0 HD2 LYS A 25 35.930 12.773 23.520 1.00 25.97 H new ATOM 0 HD3 LYS A 25 35.321 13.901 24.408 1.00 25.97 H new ATOM 0 HE2 LYS A 25 33.288 12.917 24.480 1.00 28.39 H new ATOM 0 HE3 LYS A 25 33.550 12.086 23.187 1.00 28.39 H new ATOM 0 HZ1 LYS A 25 33.691 10.736 25.024 1.00 30.32 H new ATOM 0 HZ2 LYS A 25 34.998 10.769 24.391 1.00 30.32 H new ATOM 0 HZ3 LYS A 25 34.754 11.544 25.596 1.00 30.32 H new ATOM 210 N ASP A 26 38.167 17.692 21.888 1.00 15.84 N ATOM 211 CA ASP A 26 39.424 18.206 21.356 1.00 15.29 C ATOM 212 C ASP A 26 40.108 19.125 22.352 1.00 14.35 C ATOM 213 O ASP A 26 39.467 20.036 22.885 1.00 13.18 O ATOM 214 CB ASP A 26 39.186 18.958 20.050 1.00 16.14 C ATOM 215 CG ASP A 26 40.480 19.455 19.438 1.00 18.17 C ATOM 216 OD1 ASP A 26 40.916 20.564 19.787 1.00 18.75 O ATOM 217 OD2 ASP A 26 41.067 18.710 18.626 1.00 21.75 O ATOM 0 H ASP A 26 37.552 18.285 21.985 1.00 15.84 H new ATOM 0 HA ASP A 26 40.002 17.446 21.188 1.00 15.29 H new ATOM 0 HB2 ASP A 26 38.734 18.375 19.420 1.00 16.14 H new ATOM 0 HB3 ASP A 26 38.596 19.711 20.214 1.00 16.14 H new ATOM 218 N PRO A 27 41.414 18.918 22.611 1.00 13.73 N ATOM 219 CA PRO A 27 42.094 19.731 23.619 1.00 14.10 C ATOM 220 C PRO A 27 42.195 21.213 23.278 1.00 12.97 C ATOM 221 O PRO A 27 42.196 22.031 24.188 1.00 12.16 O ATOM 222 CB PRO A 27 43.502 19.112 23.721 1.00 14.69 C ATOM 223 CG PRO A 27 43.670 18.294 22.496 1.00 15.45 C ATOM 224 CD PRO A 27 42.296 17.867 22.047 1.00 14.64 C ATOM 0 HA PRO A 27 41.590 19.716 24.448 1.00 14.10 H new ATOM 0 HB2 PRO A 27 44.182 19.801 23.776 1.00 14.69 H new ATOM 0 HB3 PRO A 27 43.586 18.566 24.519 1.00 14.69 H new ATOM 0 HG2 PRO A 27 44.112 18.806 21.801 1.00 15.45 H new ATOM 0 HG3 PRO A 27 44.226 17.520 22.676 1.00 15.45 H new ATOM 0 HD2 PRO A 27 42.232 17.826 21.080 1.00 14.64 H new ATOM 0 HD3 PRO A 27 42.066 16.987 22.384 1.00 14.64 H new ATOM 225 N PHE A 28 42.242 21.572 21.993 1.00 13.38 N ATOM 226 CA PHE A 28 42.296 22.985 21.644 1.00 13.42 C ATOM 227 C PHE A 28 40.931 23.639 21.799 1.00 11.85 C ATOM 228 O PHE A 28 40.865 24.778 22.230 1.00 11.24 O ATOM 229 CB PHE A 28 42.866 23.214 20.241 1.00 16.60 C ATOM 230 CG PHE A 28 44.293 22.758 20.089 1.00 20.65 C ATOM 231 CD1 PHE A 28 44.571 21.457 19.678 1.00 21.66 C ATOM 232 CD2 PHE A 28 45.351 23.620 20.348 1.00 22.56 C ATOM 233 CE1 PHE A 28 45.882 21.023 19.530 1.00 23.90 C ATOM 234 CE2 PHE A 28 46.674 23.191 20.196 1.00 24.63 C ATOM 235 CZ PHE A 28 46.932 21.892 19.792 1.00 24.85 C ATOM 0 H PHE A 28 42.243 21.027 21.328 1.00 13.38 H new ATOM 0 HA PHE A 28 42.906 23.409 22.268 1.00 13.42 H new ATOM 0 HB2 PHE A 28 42.314 22.746 19.595 1.00 16.60 H new ATOM 0 HB3 PHE A 28 42.812 24.159 20.028 1.00 16.60 H new ATOM 0 HD1 PHE A 28 43.870 20.872 19.500 1.00 21.66 H new ATOM 0 HD2 PHE A 28 45.178 24.491 20.625 1.00 22.56 H new ATOM 0 HE1 PHE A 28 46.056 20.152 19.256 1.00 23.90 H new ATOM 0 HE2 PHE A 28 47.377 23.776 20.366 1.00 24.63 H new ATOM 0 HZ PHE A 28 47.810 21.601 19.696 1.00 24.85 H new ATOM 236 N ASP A 29 39.861 22.907 21.504 1.00 10.67 N ATOM 237 CA ASP A 29 38.510 23.419 21.799 1.00 10.36 C ATOM 238 C ASP A 29 38.311 23.566 23.310 1.00 9.86 C ATOM 239 O ASP A 29 37.801 24.575 23.768 1.00 9.20 O ATOM 240 CB ASP A 29 37.435 22.518 21.200 1.00 11.01 C ATOM 241 CG ASP A 29 37.276 22.720 19.704 1.00 11.90 C ATOM 242 OD1 ASP A 29 37.151 23.889 19.269 1.00 12.16 O ATOM 243 OD2 ASP A 29 37.251 21.712 18.969 1.00 13.62 O ATOM 0 H ASP A 29 39.885 22.128 21.141 1.00 10.67 H new ATOM 0 HA ASP A 29 38.425 24.294 21.389 1.00 10.36 H new ATOM 0 HB2 ASP A 29 37.659 21.591 21.376 1.00 11.01 H new ATOM 0 HB3 ASP A 29 36.588 22.694 21.639 1.00 11.01 H new ATOM 244 N ARG A 30 38.782 22.584 24.086 1.00 9.56 N ATOM 245 CA ARG A 30 38.700 22.695 25.554 1.00 9.33 C ATOM 246 C ARG A 30 39.362 23.999 26.014 1.00 9.61 C ATOM 247 O ARG A 30 38.788 24.745 26.800 1.00 9.18 O ATOM 248 CB ARG A 30 39.359 21.494 26.234 1.00 9.59 C ATOM 249 CG ARG A 30 39.423 21.635 27.743 1.00 10.27 C ATOM 250 CD ARG A 30 39.835 20.321 28.398 1.00 11.06 C ATOM 251 NE ARG A 30 39.919 20.503 29.844 1.00 11.87 N ATOM 252 CZ ARG A 30 38.871 20.456 30.676 1.00 12.27 C ATOM 253 NH1 ARG A 30 37.659 20.174 30.233 1.00 12.66 N ATOM 254 NH2 ARG A 30 39.061 20.662 31.972 1.00 13.41 N ATOM 0 H ARG A 30 39.145 21.861 23.794 1.00 9.56 H new ATOM 0 HA ARG A 30 37.764 22.705 25.810 1.00 9.33 H new ATOM 0 HB2 ARG A 30 38.866 20.690 26.009 1.00 9.59 H new ATOM 0 HB3 ARG A 30 40.257 21.383 25.885 1.00 9.59 H new ATOM 0 HG2 ARG A 30 40.056 22.331 27.980 1.00 10.27 H new ATOM 0 HG3 ARG A 30 38.558 21.912 28.082 1.00 10.27 H new ATOM 0 HD2 ARG A 30 39.191 19.627 28.187 1.00 11.06 H new ATOM 0 HD3 ARG A 30 40.692 20.029 28.049 1.00 11.06 H new ATOM 0 HE ARG A 30 40.695 20.651 30.185 1.00 11.87 H new ATOM 0 HH11 ARG A 30 37.533 20.017 29.397 1.00 12.66 H new ATOM 0 HH12 ARG A 30 36.996 20.148 30.781 1.00 12.66 H new ATOM 0 HH21 ARG A 30 39.851 20.824 32.270 1.00 13.41 H new ATOM 0 HH22 ARG A 30 38.394 20.634 32.514 1.00 13.41 H new ATOM 255 N AGLU A 31 40.565 24.271 25.512 0.50 9.73 N ATOM 256 N BGLU A 31 40.572 24.277 25.525 0.50 9.72 N ATOM 257 CA AGLU A 31 41.285 25.472 25.892 0.50 10.37 C ATOM 258 CA BGLU A 31 41.280 25.486 25.930 0.50 10.35 C ATOM 259 C AGLU A 31 40.525 26.732 25.510 0.50 9.60 C ATOM 260 C BGLU A 31 40.545 26.751 25.502 0.50 9.62 C ATOM 261 O AGLU A 31 40.500 27.684 26.266 0.50 9.39 O ATOM 262 O BGLU A 31 40.541 27.723 26.231 0.50 9.44 O ATOM 263 CB AGLU A 31 42.646 25.492 25.227 0.50 11.67 C ATOM 264 CB BGLU A 31 42.716 25.483 25.409 0.50 11.65 C ATOM 265 CG AGLU A 31 43.494 26.661 25.672 0.50 13.47 C ATOM 266 CG BGLU A 31 43.637 24.575 26.210 0.50 13.27 C ATOM 267 CD AGLU A 31 44.878 26.615 25.065 0.50 14.72 C ATOM 268 CD BGLU A 31 45.106 24.774 25.895 0.50 14.91 C ATOM 269 OE1AGLU A 31 45.007 26.159 23.905 0.50 15.50 O ATOM 270 OE1BGLU A 31 45.429 25.578 24.997 0.50 15.86 O ATOM 271 OE2AGLU A 31 45.835 27.028 25.755 0.50 17.17 O ATOM 272 OE2BGLU A 31 45.937 24.126 26.561 0.50 16.61 O ATOM 0 H AGLU A 31 40.978 23.769 24.949 0.50 9.72 H new ATOM 0 H BGLU A 31 40.995 23.782 24.963 0.50 9.72 H new ATOM 0 HA AGLU A 31 41.384 25.458 26.857 0.50 10.35 H new ATOM 0 HA BGLU A 31 41.310 25.487 26.900 0.50 10.35 H new ATOM 0 HB2AGLU A 31 43.112 24.665 25.426 0.50 11.65 H new ATOM 0 HB2BGLU A 31 42.718 25.200 24.481 0.50 11.65 H new ATOM 0 HB3AGLU A 31 42.531 25.528 24.264 0.50 11.65 H new ATOM 0 HB3BGLU A 31 43.064 26.388 25.430 0.50 11.65 H new ATOM 0 HG2AGLU A 31 43.058 27.491 25.421 0.50 13.27 H new ATOM 0 HG2BGLU A 31 43.492 24.733 27.156 0.50 13.27 H new ATOM 0 HG3AGLU A 31 43.565 26.659 26.639 0.50 13.27 H new ATOM 0 HG3BGLU A 31 43.399 23.651 26.037 0.50 13.27 H new ATOM 273 N ARG A 32 39.903 26.724 24.334 1.00 9.27 N ATOM 274 CA ARG A 32 39.075 27.864 23.898 1.00 9.29 C ATOM 275 C ARG A 32 37.936 28.131 24.883 1.00 8.52 C ATOM 276 O ARG A 32 37.733 29.283 25.288 1.00 8.06 O ATOM 277 CB ARG A 32 38.508 27.654 22.500 1.00 9.97 C ATOM 278 CG ARG A 32 39.530 27.741 21.394 1.00 12.01 C ATOM 279 CD ARG A 32 38.920 27.336 20.046 1.00 13.28 C ATOM 280 NE ARG A 32 40.059 27.205 19.193 1.00 15.08 N ATOM 281 CZ ARG A 32 40.433 26.120 18.541 1.00 13.21 C ATOM 282 NH1 ARG A 32 39.650 25.037 18.443 1.00 12.69 N ATOM 283 NH2 ARG A 32 41.554 26.204 17.870 1.00 14.83 N ATOM 0 H AARG A 32 39.943 26.075 23.771 0.50 9.27 H new ATOM 0 H BARG A 32 39.929 26.066 23.781 0.50 9.27 H new ATOM 0 HA ARG A 32 39.659 28.638 23.875 1.00 9.29 H new ATOM 0 HB2 ARG A 32 38.081 26.784 22.463 1.00 9.97 H new ATOM 0 HB3 ARG A 32 37.817 28.316 22.340 1.00 9.97 H new ATOM 0 HG2 ARG A 32 39.874 28.646 21.338 1.00 12.01 H new ATOM 0 HG3 ARG A 32 40.282 27.164 21.599 1.00 12.01 H new ATOM 0 HD2 ARG A 32 38.426 26.504 20.113 1.00 13.28 H new ATOM 0 HD3 ARG A 32 38.302 28.007 19.717 1.00 13.28 H new ATOM 0 HE ARG A 32 40.551 27.904 19.095 1.00 15.08 H new ATOM 0 HH11 ARG A 32 38.873 25.033 18.812 1.00 12.69 H new ATOM 0 HH12 ARG A 32 39.924 24.346 18.011 1.00 12.69 H new ATOM 0 HH21 ARG A 32 42.002 26.938 17.871 1.00 14.83 H new ATOM 0 HH22 ARG A 32 41.842 25.525 17.428 1.00 14.83 H new ATOM 284 N TYR A 33 37.208 27.081 25.282 1.00 8.01 N ATOM 285 CA TYR A 33 36.140 27.271 26.250 1.00 7.89 C ATOM 286 C TYR A 33 36.684 27.736 27.599 1.00 7.95 C ATOM 287 O TYR A 33 36.067 28.570 28.246 1.00 7.61 O ATOM 288 CB TYR A 33 35.285 26.016 26.406 1.00 8.06 C ATOM 289 CG TYR A 33 34.536 25.586 25.164 1.00 7.74 C ATOM 290 CD1 TYR A 33 33.572 26.423 24.574 1.00 8.07 C ATOM 291 CD2 TYR A 33 34.742 24.330 24.614 1.00 7.98 C ATOM 292 CE1 TYR A 33 32.869 26.019 23.440 1.00 8.10 C ATOM 293 CE2 TYR A 33 34.060 23.925 23.475 1.00 8.19 C ATOM 294 CZ TYR A 33 33.109 24.757 22.914 1.00 7.99 C ATOM 295 OH TYR A 33 32.399 24.335 21.803 1.00 8.42 O ATOM 0 H TYR A 33 37.317 26.273 25.008 1.00 8.01 H new ATOM 0 HA TYR A 33 35.566 27.972 25.904 1.00 7.89 H new ATOM 0 HB2 TYR A 33 35.857 25.286 26.690 1.00 8.06 H new ATOM 0 HB3 TYR A 33 34.643 26.166 27.117 1.00 8.06 H new ATOM 0 HD1 TYR A 33 33.401 27.258 24.946 1.00 8.07 H new ATOM 0 HD2 TYR A 33 35.347 23.749 25.015 1.00 7.98 H new ATOM 0 HE1 TYR A 33 32.249 26.586 23.042 1.00 8.10 H new ATOM 0 HE2 TYR A 33 34.242 23.098 23.091 1.00 8.19 H new ATOM 0 HH TYR A 33 32.742 23.630 21.502 1.00 8.42 H new ATOM 296 N GLU A 34 37.836 27.207 28.012 1.00 8.13 N ATOM 297 CA GLU A 34 38.421 27.631 29.284 1.00 8.65 C ATOM 298 C GLU A 34 38.794 29.114 29.238 1.00 8.58 C ATOM 299 O GLU A 34 38.571 29.855 30.194 1.00 8.57 O ATOM 300 CB GLU A 34 39.642 26.791 29.649 1.00 9.14 C ATOM 301 CG GLU A 34 39.294 25.366 30.024 1.00 10.15 C ATOM 302 CD GLU A 34 40.494 24.503 30.299 1.00 11.68 C ATOM 303 OE1 GLU A 34 41.509 24.642 29.602 1.00 13.88 O ATOM 304 OE2 GLU A 34 40.385 23.643 31.178 1.00 13.01 O ATOM 0 H GLU A 34 38.286 26.614 27.581 1.00 8.13 H new ATOM 0 HA GLU A 34 37.750 27.496 29.972 1.00 8.65 H new ATOM 0 HB2 GLU A 34 40.257 26.781 28.899 1.00 9.14 H new ATOM 0 HB3 GLU A 34 40.106 27.210 30.390 1.00 9.14 H new ATOM 0 HG2 GLU A 34 38.726 25.376 30.810 1.00 10.15 H new ATOM 0 HG3 GLU A 34 38.777 24.968 29.306 1.00 10.15 H new ATOM 305 N ASP A 35 39.370 29.536 28.110 1.00 8.90 N ATOM 306 CA ASP A 35 39.742 30.937 27.932 1.00 9.25 C ATOM 307 C ASP A 35 38.508 31.844 27.892 1.00 8.74 C ATOM 308 O ASP A 35 38.515 32.936 28.446 1.00 8.76 O ATOM 309 CB ASP A 35 40.593 31.095 26.676 1.00 10.66 C ATOM 310 CG ASP A 35 41.969 30.487 26.832 1.00 12.72 C ATOM 311 OD1 ASP A 35 42.375 30.204 27.981 1.00 14.58 O ATOM 312 OD2 ASP A 35 42.624 30.306 25.778 1.00 14.88 O ATOM 0 H ASP A 35 39.552 29.028 27.440 1.00 8.90 H new ATOM 0 HA ASP A 35 40.270 31.214 28.697 1.00 9.25 H new ATOM 0 HB2 ASP A 35 40.140 30.677 25.927 1.00 10.66 H new ATOM 0 HB3 ASP A 35 40.681 32.038 26.464 1.00 10.66 H new ATOM 313 N LEU A 36 37.428 31.369 27.262 1.00 8.10 N ATOM 314 CA LEU A 36 36.176 32.096 27.284 1.00 8.39 C ATOM 315 C LEU A 36 35.643 32.229 28.709 1.00 8.54 C ATOM 316 O LEU A 36 35.208 33.315 29.119 1.00 8.38 O ATOM 317 CB LEU A 36 35.143 31.419 26.367 1.00 8.40 C ATOM 318 CG LEU A 36 35.410 31.644 24.885 1.00 8.74 C ATOM 319 CD1 LEU A 36 34.561 30.670 24.098 1.00 9.68 C ATOM 320 CD2 LEU A 36 35.140 33.081 24.453 1.00 9.92 C ATOM 0 H LEU A 36 37.409 30.631 26.821 1.00 8.10 H new ATOM 0 HA LEU A 36 36.339 32.991 26.947 1.00 8.39 H new ATOM 0 HB2 LEU A 36 35.137 30.466 26.547 1.00 8.40 H new ATOM 0 HB3 LEU A 36 34.259 31.754 26.584 1.00 8.40 H new ATOM 0 HG LEU A 36 36.351 31.488 24.710 1.00 8.74 H new ATOM 0 HD11 LEU A 36 34.717 30.798 23.149 1.00 9.68 H new ATOM 0 HD12 LEU A 36 34.797 29.762 24.345 1.00 9.68 H new ATOM 0 HD13 LEU A 36 33.624 30.825 24.295 1.00 9.68 H new ATOM 0 HD21 LEU A 36 35.324 33.174 23.505 1.00 9.92 H new ATOM 0 HD22 LEU A 36 34.211 33.302 24.625 1.00 9.92 H new ATOM 0 HD23 LEU A 36 35.713 33.683 24.954 1.00 9.92 H new ATOM 321 N AARG A 37 35.708 31.145 29.484 0.50 8.57 N ATOM 322 N BARG A 37 35.693 31.144 29.476 0.50 9.16 N ATOM 323 CA AARG A 37 35.201 31.198 30.858 0.50 8.83 C ATOM 324 CA BARG A 37 35.212 31.204 30.852 0.50 9.83 C ATOM 325 C AARG A 37 36.034 32.139 31.733 0.50 9.14 C ATOM 326 C BARG A 37 36.021 32.200 31.674 0.50 9.68 C ATOM 327 O AARG A 37 35.501 32.799 32.630 0.50 9.25 O ATOM 328 O BARG A 37 35.459 32.966 32.463 0.50 9.58 O ATOM 329 CB AARG A 37 35.091 29.801 31.478 0.50 9.05 C ATOM 330 CB BARG A 37 35.215 29.816 31.479 0.50 11.22 C ATOM 331 CG AARG A 37 33.943 29.722 32.473 0.50 9.46 C ATOM 332 CG BARG A 37 34.108 28.946 30.933 0.50 13.22 C ATOM 333 CD AARG A 37 33.900 28.413 33.233 0.50 9.52 C ATOM 334 CD BARG A 37 33.995 27.674 31.740 0.50 14.63 C ATOM 335 NE AARG A 37 32.545 28.128 33.717 0.50 9.57 N ATOM 336 NE BARG A 37 33.317 27.910 33.004 0.50 16.26 N ATOM 337 CZ AARG A 37 32.033 28.561 34.864 0.50 9.36 C ATOM 338 CZ BARG A 37 33.906 27.882 34.192 0.50 17.15 C ATOM 339 NH1AARG A 37 32.722 29.361 35.669 0.50 9.93 N ATOM 340 NH1BARG A 37 35.196 27.616 34.288 0.50 17.81 N ATOM 341 NH2AARG A 37 30.801 28.205 35.189 0.50 8.99 N ATOM 342 NH2BARG A 37 33.197 28.118 35.287 0.50 17.98 N ATOM 0 H AARG A 37 36.033 30.387 29.242 0.50 9.16 H new ATOM 0 H BARG A 37 35.995 30.379 29.226 0.50 9.16 H new ATOM 0 HA AARG A 37 34.304 31.564 30.816 0.50 9.83 H new ATOM 0 HA BARG A 37 34.295 31.522 30.844 0.50 9.83 H new ATOM 0 HB2AARG A 37 34.959 29.144 30.777 0.50 11.22 H new ATOM 0 HB2BARG A 37 36.071 29.390 31.315 0.50 11.22 H new ATOM 0 HB3AARG A 37 35.923 29.577 31.924 0.50 11.22 H new ATOM 0 HB3BARG A 37 35.118 29.896 32.441 0.50 11.22 H new ATOM 0 HG2AARG A 37 34.020 30.454 33.105 0.50 13.22 H new ATOM 0 HG2BARG A 37 33.267 29.428 30.958 0.50 13.22 H new ATOM 0 HG3AARG A 37 33.104 29.842 32.000 0.50 13.22 H new ATOM 0 HG3BARG A 37 34.285 28.732 30.003 0.50 13.22 H new ATOM 0 HD2AARG A 37 34.200 27.692 32.658 0.50 14.63 H new ATOM 0 HD2BARG A 37 33.510 27.007 31.230 0.50 14.63 H new ATOM 0 HD3AARG A 37 34.513 28.451 33.983 0.50 14.63 H new ATOM 0 HD3BARG A 37 34.880 27.315 31.907 0.50 14.63 H new ATOM 0 HE AARG A 37 32.041 27.641 33.218 0.50 16.26 H new ATOM 0 HE BARG A 37 32.474 28.080 32.980 0.50 16.26 H new ATOM 0 HH11AARG A 37 33.516 29.609 35.452 0.50 17.81 H new ATOM 0 HH11BARG A 37 35.657 27.460 33.579 0.50 17.81 H new ATOM 0 HH12AARG A 37 32.374 29.631 36.408 0.50 17.81 H new ATOM 0 HH12BARG A 37 35.575 27.599 35.060 0.50 17.81 H new ATOM 0 HH21AARG A 37 30.346 27.701 34.661 0.50 17.98 H new ATOM 0 HH21BARG A 37 32.356 28.289 35.226 0.50 17.98 H new ATOM 0 HH22AARG A 37 30.456 28.477 35.928 0.50 17.98 H new ATOM 0 HH22BARG A 37 33.578 28.100 36.058 0.50 17.98 H new ATOM 343 N SER A 38 37.334 32.214 31.459 1.00 9.28 N ATOM 344 CA SER A 38 38.203 33.149 32.179 1.00 9.61 C ATOM 345 C SER A 38 37.825 34.600 31.847 1.00 9.56 C ATOM 346 O SER A 38 37.752 35.446 32.730 1.00 10.15 O ATOM 347 CB SER A 38 39.664 32.886 31.857 1.00 10.75 C ATOM 348 OG SER A 38 40.064 31.605 32.322 1.00 13.51 O ATOM 0 H ASER A 38 37.733 31.737 30.865 0.50 9.28 H new ATOM 0 H BSER A 38 37.741 31.696 30.906 0.50 9.28 H new ATOM 0 HA SER A 38 38.076 33.011 33.131 1.00 9.61 H new ATOM 0 HB2 SER A 38 39.803 32.944 30.899 1.00 10.75 H new ATOM 0 HB3 SER A 38 40.217 33.570 32.266 1.00 10.75 H new ATOM 0 HG SER A 38 39.643 31.011 31.904 1.00 13.51 H new ATOM 349 N LEU A 39 37.527 34.870 30.574 1.00 8.96 N ATOM 350 CA LEU A 39 37.078 36.202 30.185 1.00 9.00 C ATOM 351 C LEU A 39 35.712 36.557 30.754 1.00 9.03 C ATOM 352 O LEU A 39 35.479 37.703 31.145 1.00 9.28 O ATOM 353 CB LEU A 39 37.089 36.363 28.671 1.00 9.09 C ATOM 354 CG LEU A 39 38.493 36.607 28.123 1.00 9.38 C ATOM 355 CD1 LEU A 39 38.552 36.166 26.683 1.00 9.85 C ATOM 356 CD2 LEU A 39 38.872 38.081 28.265 1.00 10.36 C ATOM 0 H LEU A 39 37.578 34.302 29.930 1.00 8.96 H new ATOM 0 HA LEU A 39 37.712 36.827 30.570 1.00 9.00 H new ATOM 0 HB2 LEU A 39 36.718 35.566 28.261 1.00 9.09 H new ATOM 0 HB3 LEU A 39 36.514 37.104 28.423 1.00 9.09 H new ATOM 0 HG LEU A 39 39.134 36.088 28.633 1.00 9.38 H new ATOM 0 HD11 LEU A 39 39.444 36.320 26.333 1.00 9.85 H new ATOM 0 HD12 LEU A 39 38.342 35.221 26.625 1.00 9.85 H new ATOM 0 HD13 LEU A 39 37.909 36.673 26.163 1.00 9.85 H new ATOM 0 HD21 LEU A 39 39.765 38.221 27.913 1.00 10.36 H new ATOM 0 HD22 LEU A 39 38.241 38.627 27.770 1.00 10.36 H new ATOM 0 HD23 LEU A 39 38.851 38.332 29.202 1.00 10.36 H new ATOM 357 N LEU A 40 34.796 35.589 30.790 1.00 9.18 N ATOM 358 CA LEU A 40 33.489 35.850 31.385 1.00 9.98 C ATOM 359 C LEU A 40 33.647 36.238 32.848 1.00 10.82 C ATOM 360 O LEU A 40 32.968 37.134 33.321 1.00 11.16 O ATOM 361 CB LEU A 40 32.557 34.644 31.233 1.00 10.16 C ATOM 362 CG LEU A 40 32.107 34.356 29.801 1.00 10.72 C ATOM 363 CD1 LEU A 40 31.494 32.968 29.650 1.00 11.64 C ATOM 364 CD2 LEU A 40 31.161 35.406 29.233 1.00 11.42 C ATOM 0 H LEU A 40 34.908 34.793 30.483 1.00 9.18 H new ATOM 0 HA LEU A 40 33.081 36.592 30.911 1.00 9.98 H new ATOM 0 HB2 LEU A 40 33.007 33.858 31.581 1.00 10.16 H new ATOM 0 HB3 LEU A 40 31.771 34.788 31.783 1.00 10.16 H new ATOM 0 HG LEU A 40 32.924 34.392 29.280 1.00 10.72 H new ATOM 0 HD11 LEU A 40 31.225 32.832 28.728 1.00 11.64 H new ATOM 0 HD12 LEU A 40 32.148 32.296 29.898 1.00 11.64 H new ATOM 0 HD13 LEU A 40 30.718 32.892 30.228 1.00 11.64 H new ATOM 0 HD21 LEU A 40 30.915 35.164 28.326 1.00 11.42 H new ATOM 0 HD22 LEU A 40 30.363 35.453 29.782 1.00 11.42 H new ATOM 0 HD23 LEU A 40 31.602 36.270 29.228 1.00 11.42 H new ATOM 365 N ASER A 41 34.568 35.561 33.531 0.50 11.11 N ATOM 366 N BSER A 41 34.551 35.557 33.557 0.50 11.13 N ATOM 367 CA ASER A 41 34.860 35.820 34.934 0.50 12.20 C ATOM 368 CA BSER A 41 34.839 35.886 34.956 0.50 12.19 C ATOM 369 C ASER A 41 35.465 37.218 35.151 0.50 12.71 C ATOM 370 C BSER A 41 35.371 37.307 35.080 0.50 12.66 C ATOM 371 O ASER A 41 35.099 37.925 36.093 0.50 12.90 O ATOM 372 O BSER A 41 34.885 38.107 35.888 0.50 12.46 O ATOM 373 CB ASER A 41 35.792 34.728 35.469 0.50 12.40 C ATOM 374 CB BSER A 41 35.869 34.925 35.553 0.50 12.53 C ATOM 375 OG ASER A 41 35.227 33.434 35.278 0.50 13.18 O ATOM 376 OG BSER A 41 36.272 35.369 36.850 0.50 13.52 O ATOM 0 H ASER A 41 35.044 34.933 33.187 0.50 11.13 H new ATOM 0 H BSER A 41 35.009 34.899 33.245 0.50 11.13 H new ATOM 0 HA ASER A 41 34.025 35.801 35.427 0.50 12.19 H new ATOM 0 HA BSER A 41 34.004 35.804 35.444 0.50 12.19 H new ATOM 0 HB2ASER A 41 36.649 34.780 35.018 0.50 12.53 H new ATOM 0 HB2BSER A 41 35.491 34.033 35.613 0.50 12.53 H new ATOM 0 HB3ASER A 41 35.959 34.875 36.413 0.50 12.53 H new ATOM 0 HB3BSER A 41 36.642 34.867 34.970 0.50 12.53 H new ATOM 0 HG ASER A 41 35.297 33.214 34.470 0.50 13.52 H new ATOM 0 HG BSER A 41 37.018 35.752 36.796 0.50 13.52 H new ATOM 377 N GLU A 42 36.372 37.627 34.269 1.00 12.90 N ATOM 378 CA GLU A 42 36.988 38.956 34.328 1.00 14.28 C ATOM 379 C GLU A 42 35.958 40.027 34.039 1.00 14.32 C ATOM 380 O GLU A 42 35.906 41.056 34.712 1.00 15.44 O ATOM 381 CB GLU A 42 38.142 39.063 33.337 1.00 16.12 C ATOM 382 CG GLU A 42 39.354 38.245 33.726 1.00 19.21 C ATOM 383 CD GLU A 42 40.347 38.058 32.597 1.00 22.80 C ATOM 384 OE1 GLU A 42 40.341 38.854 31.629 1.00 25.06 O ATOM 385 OE2 GLU A 42 41.153 37.108 32.690 1.00 26.37 O ATOM 0 H AGLU A 42 36.651 37.142 33.616 0.50 12.90 H new ATOM 0 H BGLU A 42 36.710 37.098 33.681 0.50 12.90 H new ATOM 0 HA GLU A 42 37.337 39.087 35.223 1.00 14.28 H new ATOM 0 HB2 GLU A 42 37.835 38.776 32.463 1.00 16.12 H new ATOM 0 HB3 GLU A 42 38.402 39.994 33.255 1.00 16.12 H new ATOM 0 HG2 GLU A 42 39.800 38.676 34.471 1.00 19.21 H new ATOM 0 HG3 GLU A 42 39.061 37.374 34.037 1.00 19.21 H new ATOM 386 N MET A 43 35.113 39.780 33.050 1.00 13.49 N ATOM 387 CA MET A 43 34.103 40.742 32.665 1.00 13.97 C ATOM 388 C MET A 43 33.064 40.918 33.769 1.00 14.36 C ATOM 389 O MET A 43 32.684 42.047 34.082 1.00 14.33 O ATOM 390 CB MET A 43 33.446 40.329 31.345 1.00 13.90 C ATOM 391 CG MET A 43 32.366 41.306 30.903 1.00 14.82 C ATOM 392 SD MET A 43 31.699 40.871 29.314 1.00 16.70 S ATOM 393 CE MET A 43 30.694 39.511 29.796 1.00 15.14 C ATOM 0 H MET A 43 35.110 39.055 32.588 1.00 13.49 H new ATOM 0 HA MET A 43 34.535 41.600 32.532 1.00 13.97 H new ATOM 0 HB2 MET A 43 34.125 40.267 30.655 1.00 13.90 H new ATOM 0 HB3 MET A 43 33.059 39.445 31.442 1.00 13.90 H new ATOM 0 HG2 MET A 43 31.653 41.321 31.561 1.00 14.82 H new ATOM 0 HG3 MET A 43 32.735 42.202 30.865 1.00 14.82 H new ATOM 0 HE1 MET A 43 29.789 39.647 29.473 1.00 15.14 H new ATOM 0 HE2 MET A 43 31.053 38.693 29.417 1.00 15.14 H new ATOM 0 HE3 MET A 43 30.685 39.442 30.764 1.00 15.14 H new ATOM 394 N LEU A 44 32.628 39.819 34.371 1.00 13.83 N ATOM 395 CA LEU A 44 31.691 39.896 35.482 1.00 15.16 C ATOM 396 C LEU A 44 32.265 40.685 36.658 1.00 15.69 C ATOM 397 O LEU A 44 31.552 41.499 37.268 1.00 15.75 O ATOM 398 CB LEU A 44 31.260 38.498 35.915 1.00 15.54 C ATOM 399 CG LEU A 44 30.458 38.524 37.221 1.00 17.49 C ATOM 400 CD1 LEU A 44 29.174 39.324 37.040 1.00 18.36 C ATOM 401 CD2 LEU A 44 30.186 37.117 37.731 1.00 18.48 C ATOM 0 H LEU A 44 32.862 39.021 34.152 1.00 13.83 H new ATOM 0 HA LEU A 44 30.907 40.378 35.174 1.00 15.16 H new ATOM 0 HB2 LEU A 44 30.724 38.094 35.215 1.00 15.54 H new ATOM 0 HB3 LEU A 44 32.045 37.939 36.029 1.00 15.54 H new ATOM 0 HG LEU A 44 30.990 38.969 37.899 1.00 17.49 H new ATOM 0 HD11 LEU A 44 28.677 39.332 37.873 1.00 18.36 H new ATOM 0 HD12 LEU A 44 29.393 40.234 36.786 1.00 18.36 H new ATOM 0 HD13 LEU A 44 28.633 38.916 36.346 1.00 18.36 H new ATOM 0 HD21 LEU A 44 29.678 37.164 38.556 1.00 18.48 H new ATOM 0 HD22 LEU A 44 29.678 36.625 37.067 1.00 18.48 H new ATOM 0 HD23 LEU A 44 31.028 36.664 37.895 1.00 18.48 H new ATOM 402 N AASN A 45 33.529 40.442 36.980 0.50 16.07 N ATOM 403 N BASN A 45 33.543 40.450 36.965 0.50 15.82 N ATOM 404 CA AASN A 45 34.178 41.186 38.045 0.50 16.44 C ATOM 405 CA BASN A 45 34.254 41.165 38.037 0.50 16.07 C ATOM 406 C AASN A 45 34.078 42.689 37.791 0.50 16.66 C ATOM 407 C BASN A 45 34.331 42.676 37.824 0.50 16.59 C ATOM 408 O AASN A 45 33.705 43.457 38.685 0.50 16.43 O ATOM 409 O BASN A 45 34.363 43.441 38.793 0.50 16.80 O ATOM 410 CB AASN A 45 35.634 40.750 38.181 0.50 17.53 C ATOM 411 CB BASN A 45 35.670 40.601 38.210 0.50 16.42 C ATOM 412 CG AASN A 45 36.250 41.205 39.479 0.50 18.06 C ATOM 413 CG BASN A 45 35.746 39.507 39.253 0.50 16.77 C ATOM 414 OD1AASN A 45 35.620 41.132 40.532 0.50 19.04 O ATOM 415 OD1BASN A 45 35.668 39.772 40.460 0.50 17.06 O ATOM 416 ND2AASN A 45 37.486 41.671 39.415 0.50 19.74 N ATOM 417 ND2BASN A 45 35.924 38.271 38.800 0.50 16.81 N ATOM 0 H AASN A 45 34.025 39.854 36.596 0.50 15.82 H new ATOM 0 H BASN A 45 34.027 39.868 36.556 0.50 15.82 H new ATOM 0 HA AASN A 45 33.723 40.995 38.880 0.50 16.07 H new ATOM 0 HA BASN A 45 33.732 41.021 38.841 0.50 16.07 H new ATOM 0 HB2AASN A 45 35.687 39.783 38.122 0.50 16.42 H new ATOM 0 HB2BASN A 45 35.980 40.253 37.360 0.50 16.42 H new ATOM 0 HB3AASN A 45 36.147 41.108 37.439 0.50 16.42 H new ATOM 0 HB3BASN A 45 36.271 41.320 38.458 0.50 16.42 H new ATOM 0 HD21AASN A 45 37.882 41.939 40.130 0.50 16.81 H new ATOM 0 HD21BASN A 45 35.990 37.616 39.353 0.50 16.81 H new ATOM 0 HD22AASN A 45 37.894 41.706 38.659 0.50 16.81 H new ATOM 0 HD22BASN A 45 35.973 38.126 37.954 0.50 16.81 H new ATOM 418 N GLN A 46 34.377 43.101 36.564 1.00 16.39 N ATOM 419 CA GLN A 46 34.410 44.518 36.211 1.00 18.42 C ATOM 420 C GLN A 46 33.025 45.123 36.046 1.00 19.29 C ATOM 421 O GLN A 46 32.827 46.309 36.289 1.00 19.49 O ATOM 422 CB GLN A 46 35.242 44.748 34.941 1.00 20.50 C ATOM 423 CG GLN A 46 35.821 46.156 34.825 1.00 23.58 C ATOM 424 CD GLN A 46 36.725 46.522 35.994 1.00 25.51 C ATOM 425 OE1 GLN A 46 37.419 45.668 36.548 1.00 29.00 O ATOM 426 NE2 GLN A 46 36.715 47.801 36.376 1.00 29.60 N ATOM 0 H AGLN A 46 34.566 42.570 35.914 0.50 16.39 H new ATOM 0 H BGLN A 46 34.390 42.572 35.886 0.50 16.39 H new ATOM 0 HA GLN A 46 34.831 44.972 36.957 1.00 18.42 H new ATOM 0 HB2 GLN A 46 35.969 44.106 34.921 1.00 20.50 H new ATOM 0 HB3 GLN A 46 34.687 44.572 34.165 1.00 20.50 H new ATOM 0 HG2 GLN A 46 36.324 46.227 33.999 1.00 23.58 H new ATOM 0 HG3 GLN A 46 35.094 46.796 34.771 1.00 23.58 H new ATOM 0 HE21 GLN A 46 36.217 48.369 35.965 1.00 29.60 H new ATOM 0 HE22 GLN A 46 37.207 48.057 37.033 1.00 29.60 H new ATOM 427 N ALA A 47 32.057 44.311 35.644 1.00 19.16 N ATOM 428 CA ALA A 47 30.733 44.832 35.313 1.00 18.84 C ATOM 429 C ALA A 47 29.812 44.946 36.523 1.00 18.80 C ATOM 430 O ALA A 47 28.750 45.555 36.428 1.00 20.05 O ATOM 431 CB ALA A 47 30.076 43.974 34.240 1.00 19.05 C ATOM 0 H ALA A 47 32.142 43.460 35.556 1.00 19.16 H new ATOM 0 HA ALA A 47 30.870 45.732 34.977 1.00 18.84 H new ATOM 0 HB1 ALA A 47 29.199 44.332 34.031 1.00 19.05 H new ATOM 0 HB2 ALA A 47 30.625 43.978 33.441 1.00 19.05 H new ATOM 0 HB3 ALA A 47 29.985 43.064 34.564 1.00 19.05 H new ATOM 432 N SER A 48 30.207 44.358 37.646 1.00 18.61 N ATOM 433 CA SER A 48 29.330 44.262 38.800 1.00 19.24 C ATOM 434 C SER A 48 30.029 44.699 40.079 1.00 20.59 C ATOM 435 O SER A 48 31.262 44.609 40.182 1.00 21.65 O ATOM 436 CB SER A 48 28.817 42.824 38.945 1.00 18.78 C ATOM 437 OG SER A 48 29.810 41.968 39.486 1.00 18.44 O ATOM 0 H SER A 48 30.984 44.007 37.758 1.00 18.61 H new ATOM 0 HA SER A 48 28.582 44.862 38.656 1.00 19.24 H new ATOM 0 HB2 SER A 48 28.034 42.815 39.518 1.00 18.78 H new ATOM 0 HB3 SER A 48 28.538 42.490 38.078 1.00 18.78 H new ATOM 0 HG SER A 48 30.363 41.766 38.887 1.00 18.44 H new ATOM 438 N ASP A 49 29.233 45.156 41.046 1.00 21.03 N ATOM 439 CA ASP A 49 29.729 45.495 42.386 1.00 23.38 C ATOM 440 C ASP A 49 29.786 44.324 43.373 1.00 23.18 C ATOM 441 O ASP A 49 30.020 44.524 44.573 1.00 24.31 O ATOM 442 CB ASP A 49 28.894 46.627 43.001 1.00 23.85 C ATOM 443 CG ASP A 49 29.100 47.946 42.301 1.00 25.18 C ATOM 444 OD1 ASP A 49 30.045 48.043 41.491 1.00 26.40 O ATOM 445 OD2 ASP A 49 28.312 48.881 42.553 1.00 24.66 O ATOM 0 H ASP A 49 28.388 45.279 40.945 1.00 21.03 H new ATOM 0 HA ASP A 49 30.647 45.775 42.242 1.00 23.38 H new ATOM 0 HB2 ASP A 49 27.955 46.388 42.964 1.00 23.85 H new ATOM 0 HB3 ASP A 49 29.125 46.723 43.938 1.00 23.85 H new ATOM 446 N LEU A 50 29.581 43.103 42.882 1.00 23.28 N ATOM 447 CA LEU A 50 29.616 41.926 43.753 1.00 23.72 C ATOM 448 C LEU A 50 30.972 41.819 44.456 1.00 24.58 C ATOM 449 O LEU A 50 32.006 42.103 43.841 1.00 25.94 O ATOM 450 CB LEU A 50 29.344 40.654 42.942 1.00 22.60 C ATOM 451 CG LEU A 50 27.971 40.473 42.290 1.00 21.85 C ATOM 452 CD1 LEU A 50 27.967 39.206 41.438 1.00 22.46 C ATOM 453 CD2 LEU A 50 26.875 40.446 43.349 1.00 21.34 C ATOM 0 H LEU A 50 29.421 42.934 42.054 1.00 23.28 H new ATOM 0 HA LEU A 50 28.924 42.023 44.425 1.00 23.72 H new ATOM 0 HB2 LEU A 50 30.011 40.606 42.239 1.00 22.60 H new ATOM 0 HB3 LEU A 50 29.493 39.895 43.528 1.00 22.60 H new ATOM 0 HG LEU A 50 27.790 41.227 41.708 1.00 21.85 H new ATOM 0 HD11 LEU A 50 27.095 39.095 41.027 1.00 22.46 H new ATOM 0 HD12 LEU A 50 28.643 39.279 40.747 1.00 22.46 H new ATOM 0 HD13 LEU A 50 28.160 38.438 41.999 1.00 22.46 H new ATOM 0 HD21 LEU A 50 26.013 40.331 42.920 1.00 21.34 H new ATOM 0 HD22 LEU A 50 27.033 39.709 43.960 1.00 21.34 H new ATOM 0 HD23 LEU A 50 26.881 41.281 43.843 1.00 21.34 H new ATOM 454 N ASP A 51 30.969 41.430 45.732 1.00 26.41 N ATOM 455 CA ASP A 51 32.234 41.178 46.433 1.00 27.33 C ATOM 456 C ASP A 51 32.836 39.861 45.949 1.00 28.65 C ATOM 457 O ASP A 51 32.176 39.105 45.224 1.00 28.61 O ATOM 458 CB ASP A 51 32.106 41.274 47.973 1.00 28.20 C ATOM 459 CG ASP A 51 31.230 40.182 48.591 1.00 29.39 C ATOM 460 OD1 ASP A 51 31.220 39.033 48.100 1.00 28.33 O ATOM 461 OD2 ASP A 51 30.562 40.481 49.609 1.00 30.29 O ATOM 0 H ASP A 51 30.261 41.308 46.204 1.00 26.41 H new ATOM 0 HA ASP A 51 32.855 41.888 46.207 1.00 27.33 H new ATOM 0 HB2 ASP A 51 32.992 41.227 48.366 1.00 28.20 H new ATOM 0 HB3 ASP A 51 31.738 42.141 48.205 1.00 28.20 H new ATOM 462 N SER A 52 34.084 39.591 46.327 1.00 28.67 N ATOM 463 CA SER A 52 34.789 38.396 45.858 1.00 28.74 C ATOM 464 C SER A 52 34.035 37.089 46.169 1.00 27.06 C ATOM 465 O SER A 52 33.962 36.212 45.321 1.00 24.51 O ATOM 466 CB SER A 52 36.227 38.359 46.397 1.00 30.21 C ATOM 467 OG SER A 52 36.245 38.095 47.789 1.00 33.51 O ATOM 0 H SER A 52 34.543 40.089 46.857 1.00 28.67 H new ATOM 0 HA SER A 52 34.827 38.459 44.891 1.00 28.74 H new ATOM 0 HB2 SER A 52 36.733 37.677 45.929 1.00 30.21 H new ATOM 0 HB3 SER A 52 36.663 39.207 46.220 1.00 30.21 H new ATOM 0 HG SER A 52 37.040 38.078 48.061 1.00 33.51 H new ATOM 468 N GLU A 53 33.461 36.964 47.366 1.00 26.64 N ATOM 469 CA GLU A 53 32.678 35.761 47.700 1.00 26.90 C ATOM 470 C GLU A 53 31.464 35.590 46.772 1.00 25.37 C ATOM 471 O GLU A 53 31.192 34.485 46.294 1.00 23.80 O ATOM 472 CB GLU A 53 32.234 35.765 49.168 1.00 30.41 C ATOM 473 CG GLU A 53 31.588 34.455 49.610 1.00 34.67 C ATOM 474 CD GLU A 53 31.442 34.324 51.118 1.00 37.35 C ATOM 475 OE1 GLU A 53 30.858 35.233 51.751 1.00 39.60 O ATOM 476 OE2 GLU A 53 31.902 33.295 51.669 1.00 39.63 O ATOM 0 H GLU A 53 33.508 37.551 47.993 1.00 26.64 H new ATOM 0 HA GLU A 53 33.266 35.002 47.564 1.00 26.90 H new ATOM 0 HB2 GLU A 53 33.003 35.944 49.731 1.00 30.41 H new ATOM 0 HB3 GLU A 53 31.605 36.491 49.307 1.00 30.41 H new ATOM 0 HG2 GLU A 53 30.712 34.381 49.201 1.00 34.67 H new ATOM 0 HG3 GLU A 53 32.119 33.714 49.279 1.00 34.67 H new ATOM 477 N GLU A 54 30.752 36.685 46.521 1.00 24.31 N ATOM 478 CA GLU A 54 29.570 36.668 45.660 1.00 23.85 C ATOM 479 C GLU A 54 29.917 36.356 44.210 1.00 23.30 C ATOM 480 O GLU A 54 29.201 35.600 43.547 1.00 23.26 O ATOM 481 CB GLU A 54 28.823 37.995 45.750 1.00 23.97 C ATOM 482 CG GLU A 54 28.183 38.243 47.107 1.00 25.37 C ATOM 483 CD GLU A 54 27.708 39.664 47.281 1.00 25.65 C ATOM 484 OE1 GLU A 54 28.419 40.593 46.836 1.00 26.40 O ATOM 485 OE2 GLU A 54 26.630 39.858 47.877 1.00 26.12 O ATOM 0 H GLU A 54 30.940 37.459 46.845 1.00 24.31 H new ATOM 0 HA GLU A 54 28.995 35.956 45.980 1.00 23.85 H new ATOM 0 HB2 GLU A 54 29.439 38.718 45.554 1.00 23.97 H new ATOM 0 HB3 GLU A 54 28.134 38.017 45.067 1.00 23.97 H new ATOM 0 HG2 GLU A 54 27.432 37.640 47.220 1.00 25.37 H new ATOM 0 HG3 GLU A 54 28.823 38.033 47.805 1.00 25.37 H new ATOM 486 N VAL A 55 31.002 36.951 43.710 1.00 23.94 N ATOM 487 CA VAL A 55 31.461 36.670 42.348 1.00 22.32 C ATOM 488 C VAL A 55 31.796 35.187 42.191 1.00 24.40 C ATOM 489 O VAL A 55 31.367 34.557 41.222 1.00 22.24 O ATOM 490 CB VAL A 55 32.672 37.545 41.944 1.00 23.21 C ATOM 491 CG1 VAL A 55 33.233 37.095 40.601 1.00 22.93 C ATOM 492 CG2 VAL A 55 32.258 38.999 41.845 1.00 23.24 C ATOM 0 H VAL A 55 31.484 37.518 44.141 1.00 23.94 H new ATOM 0 HA VAL A 55 30.732 36.896 41.749 1.00 22.32 H new ATOM 0 HB VAL A 55 33.355 37.447 42.626 1.00 23.21 H new ATOM 0 HG11 VAL A 55 33.990 37.653 40.363 1.00 22.93 H new ATOM 0 HG12 VAL A 55 33.520 36.171 40.663 1.00 22.93 H new ATOM 0 HG13 VAL A 55 32.547 37.175 39.920 1.00 22.93 H new ATOM 0 HG21 VAL A 55 33.024 39.537 41.592 1.00 23.24 H new ATOM 0 HG22 VAL A 55 31.562 39.093 41.176 1.00 23.24 H new ATOM 0 HG23 VAL A 55 31.922 39.299 42.704 1.00 23.24 H new ATOM 493 N ALA A 56 32.544 34.635 43.143 1.00 23.82 N ATOM 494 CA ALA A 56 32.857 33.208 43.154 1.00 23.95 C ATOM 495 C ALA A 56 31.586 32.349 43.179 1.00 23.67 C ATOM 496 O ALA A 56 31.555 31.281 42.567 1.00 22.75 O ATOM 497 CB ALA A 56 33.767 32.865 44.333 1.00 24.15 C ATOM 0 H ALA A 56 32.884 35.075 43.799 1.00 23.82 H new ATOM 0 HA ALA A 56 33.329 33.005 42.331 1.00 23.95 H new ATOM 0 HB1 ALA A 56 33.964 31.915 44.324 1.00 24.15 H new ATOM 0 HB2 ALA A 56 34.594 33.367 44.261 1.00 24.15 H new ATOM 0 HB3 ALA A 56 33.322 33.095 45.163 1.00 24.15 H new ATOM 498 N GLU A 57 30.559 32.807 43.901 1.00 23.45 N ATOM 499 CA GLU A 57 29.269 32.095 43.980 1.00 22.95 C ATOM 500 C GLU A 57 28.570 32.039 42.618 1.00 22.16 C ATOM 501 O GLU A 57 27.982 31.010 42.267 1.00 22.86 O ATOM 502 CB GLU A 57 28.358 32.690 45.072 1.00 24.48 C ATOM 503 CG GLU A 57 28.788 32.314 46.488 1.00 25.00 C ATOM 504 CD GLU A 57 27.882 32.853 47.576 1.00 27.31 C ATOM 505 OE1 GLU A 57 27.046 33.746 47.305 1.00 26.53 O ATOM 506 OE2 GLU A 57 28.014 32.375 48.725 1.00 29.30 O ATOM 0 H GLU A 57 30.586 33.535 44.358 1.00 23.45 H new ATOM 0 HA GLU A 57 29.459 31.179 44.238 1.00 22.95 H new ATOM 0 HB2 GLU A 57 28.352 33.656 44.988 1.00 24.48 H new ATOM 0 HB3 GLU A 57 27.448 32.387 44.926 1.00 24.48 H new ATOM 0 HG2 GLU A 57 28.822 31.347 46.559 1.00 25.00 H new ATOM 0 HG3 GLU A 57 29.688 32.641 46.639 1.00 25.00 H new ATOM 507 N VAL A 58 28.640 33.127 41.849 1.00 21.86 N ATOM 508 CA VAL A 58 28.086 33.129 40.486 1.00 21.01 C ATOM 509 C VAL A 58 28.868 32.195 39.567 1.00 22.65 C ATOM 510 O VAL A 58 28.289 31.456 38.773 1.00 23.88 O ATOM 511 CB VAL A 58 28.010 34.559 39.879 1.00 20.57 C ATOM 512 CG1 VAL A 58 27.639 34.518 38.402 1.00 19.72 C ATOM 513 CG2 VAL A 58 26.996 35.405 40.629 1.00 20.79 C ATOM 0 H VAL A 58 29.000 33.869 42.092 1.00 21.86 H new ATOM 0 HA VAL A 58 27.177 32.798 40.558 1.00 21.01 H new ATOM 0 HB VAL A 58 28.891 34.956 39.966 1.00 20.57 H new ATOM 0 HG11 VAL A 58 27.600 35.422 38.053 1.00 19.72 H new ATOM 0 HG12 VAL A 58 28.308 34.012 37.914 1.00 19.72 H new ATOM 0 HG13 VAL A 58 26.773 34.093 38.297 1.00 19.72 H new ATOM 0 HG21 VAL A 58 26.962 36.292 40.238 1.00 20.79 H new ATOM 0 HG22 VAL A 58 26.121 34.991 40.568 1.00 20.79 H new ATOM 0 HG23 VAL A 58 27.257 35.473 41.561 1.00 20.79 H new ATOM 514 N LEU A 59 30.190 32.228 39.679 1.00 22.45 N ATOM 515 CA LEU A 59 31.024 31.485 38.742 1.00 22.78 C ATOM 516 C LEU A 59 31.243 30.017 39.111 1.00 23.05 C ATOM 517 O LEU A 59 31.673 29.228 38.263 1.00 22.95 O ATOM 518 CB LEU A 59 32.368 32.202 38.554 1.00 22.99 C ATOM 519 CG LEU A 59 32.292 33.644 38.049 1.00 22.30 C ATOM 520 CD1 LEU A 59 33.633 34.314 38.292 1.00 21.86 C ATOM 521 CD2 LEU A 59 31.869 33.750 36.581 1.00 21.56 C ATOM 0 H LEU A 59 30.620 32.667 40.281 1.00 22.45 H new ATOM 0 HA LEU A 59 30.533 31.466 37.906 1.00 22.78 H new ATOM 0 HB2 LEU A 59 32.838 32.199 39.403 1.00 22.99 H new ATOM 0 HB3 LEU A 59 32.905 31.687 37.931 1.00 22.99 H new ATOM 0 HG LEU A 59 31.596 34.102 38.546 1.00 22.30 H new ATOM 0 HD11 LEU A 59 33.599 35.230 37.976 1.00 21.86 H new ATOM 0 HD12 LEU A 59 33.831 34.307 39.242 1.00 21.86 H new ATOM 0 HD13 LEU A 59 34.327 33.833 37.814 1.00 21.86 H new ATOM 0 HD21 LEU A 59 31.839 34.684 36.319 1.00 21.56 H new ATOM 0 HD22 LEU A 59 32.509 33.279 36.025 1.00 21.56 H new ATOM 0 HD23 LEU A 59 30.991 33.354 36.468 1.00 21.56 H new ATOM 522 N LYS A 60 30.968 29.652 40.361 1.00 23.12 N ATOM 523 CA LYS A 60 31.119 28.268 40.798 1.00 23.65 C ATOM 524 C LYS A 60 30.274 27.381 39.895 1.00 22.98 C ATOM 525 O LYS A 60 29.067 27.596 39.773 1.00 22.59 O ATOM 526 CB LYS A 60 30.693 28.086 42.253 1.00 24.98 C ATOM 527 CG LYS A 60 30.859 26.655 42.744 1.00 27.35 C ATOM 528 CD LYS A 60 30.031 26.379 43.987 1.00 29.76 C ATOM 529 CE LYS A 60 29.966 24.882 44.263 1.00 32.08 C ATOM 530 NZ LYS A 60 29.444 24.601 45.629 1.00 34.29 N ATOM 0 H LYS A 60 30.693 30.192 40.971 1.00 23.12 H new ATOM 0 HA LYS A 60 32.055 28.022 40.738 1.00 23.65 H new ATOM 0 HB2 LYS A 60 31.216 28.679 42.815 1.00 24.98 H new ATOM 0 HB3 LYS A 60 29.765 28.350 42.349 1.00 24.98 H new ATOM 0 HG2 LYS A 60 30.599 26.040 42.040 1.00 27.35 H new ATOM 0 HG3 LYS A 60 31.795 26.486 42.936 1.00 27.35 H new ATOM 0 HD2 LYS A 60 30.419 26.837 44.749 1.00 29.76 H new ATOM 0 HD3 LYS A 60 29.135 26.731 43.870 1.00 29.76 H new ATOM 0 HE2 LYS A 60 29.397 24.455 43.604 1.00 32.08 H new ATOM 0 HE3 LYS A 60 30.851 24.496 44.168 1.00 32.08 H new ATOM 0 HZ1 LYS A 60 29.417 23.721 45.762 1.00 34.29 H new ATOM 0 HZ2 LYS A 60 29.978 24.976 46.234 1.00 34.29 H new ATOM 0 HZ3 LYS A 60 28.624 24.938 45.709 1.00 34.29 H new ATOM 531 N PRO A 61 30.899 26.380 39.247 1.00 22.20 N ATOM 532 CA PRO A 61 30.103 25.492 38.415 1.00 21.32 C ATOM 533 C PRO A 61 29.184 24.649 39.278 1.00 21.29 C ATOM 534 O PRO A 61 29.617 23.979 40.223 1.00 20.99 O ATOM 535 CB PRO A 61 31.157 24.622 37.715 1.00 21.76 C ATOM 536 CG PRO A 61 32.382 25.457 37.738 1.00 22.81 C ATOM 537 CD PRO A 61 32.340 26.141 39.068 1.00 22.16 C ATOM 0 HA PRO A 61 29.529 25.960 37.788 1.00 21.32 H new ATOM 0 HB2 PRO A 61 31.291 23.782 38.181 1.00 21.76 H new ATOM 0 HB3 PRO A 61 30.892 24.404 36.808 1.00 21.76 H new ATOM 0 HG2 PRO A 61 33.181 24.915 37.644 1.00 22.81 H new ATOM 0 HG3 PRO A 61 32.387 26.098 37.010 1.00 22.81 H new ATOM 0 HD2 PRO A 61 32.706 25.585 39.774 1.00 22.16 H new ATOM 0 HD3 PRO A 61 32.847 26.968 39.067 1.00 22.16 H new ATOM 538 N THR A 62 27.905 24.723 38.964 1.00 21.45 N ATOM 539 CA THR A 62 26.893 24.042 39.734 1.00 21.08 C ATOM 540 C THR A 62 26.771 22.582 39.285 1.00 19.38 C ATOM 541 O THR A 62 26.466 21.703 40.080 1.00 19.71 O ATOM 542 CB THR A 62 25.553 24.789 39.580 1.00 22.00 C ATOM 543 OG1 THR A 62 25.771 26.192 39.801 1.00 23.88 O ATOM 544 CG2 THR A 62 24.539 24.291 40.564 1.00 22.37 C ATOM 0 H THR A 62 27.601 25.171 38.296 1.00 21.45 H new ATOM 0 HA THR A 62 27.143 24.038 40.671 1.00 21.08 H new ATOM 0 HB THR A 62 25.215 24.632 38.685 1.00 22.00 H new ATOM 0 HG1 THR A 62 26.068 26.544 39.098 1.00 23.88 H new ATOM 0 HG21 THR A 62 23.708 24.776 40.446 1.00 22.37 H new ATOM 0 HG22 THR A 62 24.384 23.345 40.418 1.00 22.37 H new ATOM 0 HG23 THR A 62 24.868 24.429 41.466 1.00 22.37 H new ATOM 545 N SER A 63 27.017 22.340 37.998 1.00 18.53 N ATOM 546 CA SER A 63 26.761 21.044 37.359 1.00 17.09 C ATOM 547 C SER A 63 27.617 20.934 36.100 1.00 16.72 C ATOM 548 O SER A 63 27.987 21.945 35.515 1.00 18.84 O ATOM 549 CB SER A 63 25.265 20.936 36.971 1.00 16.77 C ATOM 550 OG SER A 63 24.942 19.782 36.190 1.00 16.65 O ATOM 0 H SER A 63 27.341 22.930 37.463 1.00 18.53 H new ATOM 0 HA SER A 63 26.983 20.329 37.976 1.00 17.09 H new ATOM 0 HB2 SER A 63 24.731 20.925 37.781 1.00 16.77 H new ATOM 0 HB3 SER A 63 25.012 21.730 36.475 1.00 16.77 H new ATOM 0 HG SER A 63 24.293 19.957 35.687 1.00 16.65 H new ATOM 551 N ALA A 64 27.890 19.706 35.675 1.00 15.16 N ATOM 552 CA ALA A 64 28.477 19.462 34.343 1.00 15.33 C ATOM 553 C ALA A 64 27.483 19.733 33.202 1.00 14.96 C ATOM 554 O ALA A 64 27.891 19.923 32.054 1.00 15.82 O ATOM 555 CB ALA A 64 29.015 18.039 34.242 1.00 15.63 C ATOM 0 H ALA A 64 27.746 18.995 36.136 1.00 15.16 H new ATOM 0 HA ALA A 64 29.210 20.089 34.243 1.00 15.33 H new ATOM 0 HB1 ALA A 64 29.396 17.899 33.361 1.00 15.63 H new ATOM 0 HB2 ALA A 64 29.700 17.903 34.915 1.00 15.63 H new ATOM 0 HB3 ALA A 64 28.292 17.409 34.385 1.00 15.63 H new ATOM 556 N TYR A 65 26.187 19.759 33.515 1.00 14.29 N ATOM 557 CA TYR A 65 25.141 19.975 32.505 1.00 14.30 C ATOM 558 C TYR A 65 24.403 21.243 32.839 1.00 13.66 C ATOM 559 O TYR A 65 23.730 21.309 33.878 1.00 16.30 O ATOM 560 CB TYR A 65 24.207 18.760 32.449 1.00 15.61 C ATOM 561 CG TYR A 65 25.011 17.525 32.171 1.00 16.75 C ATOM 562 CD1 TYR A 65 25.326 17.164 30.860 1.00 17.42 C ATOM 563 CD2 TYR A 65 25.546 16.767 33.214 1.00 16.80 C ATOM 564 CE1 TYR A 65 26.122 16.056 30.589 1.00 18.50 C ATOM 565 CE2 TYR A 65 26.351 15.658 32.955 1.00 18.45 C ATOM 566 CZ TYR A 65 26.631 15.305 31.643 1.00 19.00 C ATOM 567 OH TYR A 65 27.425 14.203 31.397 1.00 21.62 O ATOM 0 H TYR A 65 25.888 19.653 34.314 1.00 14.29 H new ATOM 0 HA TYR A 65 25.533 20.073 31.623 1.00 14.30 H new ATOM 0 HB2 TYR A 65 23.732 18.666 33.289 1.00 15.61 H new ATOM 0 HB3 TYR A 65 23.538 18.885 31.757 1.00 15.61 H new ATOM 0 HD1 TYR A 65 24.998 17.674 30.155 1.00 17.42 H new ATOM 0 HD2 TYR A 65 25.363 17.005 34.094 1.00 16.80 H new ATOM 0 HE1 TYR A 65 26.312 15.819 29.710 1.00 18.50 H new ATOM 0 HE2 TYR A 65 26.698 15.158 33.658 1.00 18.45 H new ATOM 0 HH TYR A 65 27.565 13.792 32.116 1.00 21.62 H new ATOM 568 N ALA A 66 24.528 22.231 31.962 1.00 12.14 N ATOM 569 CA ALA A 66 23.935 23.554 32.150 1.00 11.61 C ATOM 570 C ALA A 66 22.478 23.556 31.704 1.00 10.31 C ATOM 571 O ALA A 66 22.183 23.568 30.520 1.00 10.77 O ATOM 572 CB ALA A 66 24.731 24.599 31.373 1.00 11.95 C ATOM 0 H ALA A 66 24.967 22.152 31.227 1.00 12.14 H new ATOM 0 HA ALA A 66 23.964 23.776 33.094 1.00 11.61 H new ATOM 0 HB1 ALA A 66 24.331 25.473 31.503 1.00 11.95 H new ATOM 0 HB2 ALA A 66 25.647 24.612 31.693 1.00 11.95 H new ATOM 0 HB3 ALA A 66 24.722 24.377 30.429 1.00 11.95 H new ATOM 573 N THR A 67 21.570 23.488 32.665 1.00 9.63 N ATOM 574 CA THR A 67 20.134 23.564 32.382 1.00 9.67 C ATOM 575 C THR A 67 19.530 24.563 33.361 1.00 8.97 C ATOM 576 O THR A 67 20.111 24.866 34.393 1.00 9.19 O ATOM 577 CB THR A 67 19.384 22.194 32.518 1.00 9.87 C ATOM 578 OG1 THR A 67 19.135 21.882 33.889 1.00 10.39 O ATOM 579 CG2 THR A 67 20.156 21.036 31.851 1.00 9.94 C ATOM 0 H THR A 67 21.762 23.397 33.498 1.00 9.63 H new ATOM 0 HA THR A 67 20.029 23.835 31.457 1.00 9.67 H new ATOM 0 HB THR A 67 18.538 22.294 32.054 1.00 9.87 H new ATOM 0 HG1 THR A 67 18.502 22.355 34.174 1.00 10.39 H new ATOM 0 HG21 THR A 67 19.658 20.211 31.959 1.00 9.94 H new ATOM 0 HG22 THR A 67 20.269 21.224 30.906 1.00 9.94 H new ATOM 0 HG23 THR A 67 21.027 20.945 32.268 1.00 9.94 H new ATOM 580 N PRO A 68 18.309 25.032 33.083 1.00 8.41 N ATOM 581 CA PRO A 68 17.574 25.741 34.128 1.00 8.59 C ATOM 582 C PRO A 68 17.448 24.866 35.378 1.00 8.84 C ATOM 583 O PRO A 68 17.335 23.632 35.273 1.00 9.45 O ATOM 584 CB PRO A 68 16.218 26.013 33.469 1.00 8.71 C ATOM 585 CG PRO A 68 16.514 26.068 32.007 1.00 8.61 C ATOM 586 CD PRO A 68 17.558 24.994 31.819 1.00 8.46 C ATOM 0 HA PRO A 68 18.004 26.555 34.433 1.00 8.59 H new ATOM 0 HB2 PRO A 68 15.579 25.312 33.673 1.00 8.71 H new ATOM 0 HB3 PRO A 68 15.834 26.847 33.783 1.00 8.71 H new ATOM 0 HG2 PRO A 68 15.722 25.893 31.475 1.00 8.61 H new ATOM 0 HG3 PRO A 68 16.847 26.940 31.742 1.00 8.61 H new ATOM 0 HD2 PRO A 68 17.155 24.125 31.667 1.00 8.46 H new ATOM 0 HD3 PRO A 68 18.129 25.179 31.057 1.00 8.46 H new ATOM 587 N LEU A 69 17.497 25.508 36.536 1.00 8.87 N ATOM 588 CA LEU A 69 17.427 24.806 37.813 1.00 9.15 C ATOM 589 C LEU A 69 16.000 24.700 38.325 1.00 8.97 C ATOM 590 O LEU A 69 15.126 25.481 37.931 1.00 8.92 O ATOM 591 CB LEU A 69 18.287 25.529 38.836 1.00 9.65 C ATOM 592 CG LEU A 69 19.773 25.684 38.499 1.00 10.11 C ATOM 593 CD1 LEU A 69 20.462 26.481 39.607 1.00 10.85 C ATOM 594 CD2 LEU A 69 20.422 24.328 38.345 1.00 11.96 C ATOM 0 H LEU A 69 17.572 26.362 36.606 1.00 8.87 H new ATOM 0 HA LEU A 69 17.757 23.904 37.676 1.00 9.15 H new ATOM 0 HB2 LEU A 69 17.914 26.414 38.974 1.00 9.65 H new ATOM 0 HB3 LEU A 69 18.216 25.056 39.680 1.00 9.65 H new ATOM 0 HG LEU A 69 19.863 26.160 37.659 1.00 10.11 H new ATOM 0 HD11 LEU A 69 21.404 26.581 39.396 1.00 10.85 H new ATOM 0 HD12 LEU A 69 20.052 27.357 39.678 1.00 10.85 H new ATOM 0 HD13 LEU A 69 20.368 26.011 40.450 1.00 10.85 H new ATOM 0 HD21 LEU A 69 21.362 24.441 38.132 1.00 11.96 H new ATOM 0 HD22 LEU A 69 20.336 23.832 39.174 1.00 11.96 H new ATOM 0 HD23 LEU A 69 19.985 23.839 37.630 1.00 11.96 H new ATOM 595 N AMET A 70 15.752 23.708 39.180 0.50 9.02 N ATOM 596 N BMET A 70 15.771 23.767 39.230 0.50 9.09 N ATOM 597 CA AMET A 70 14.441 23.533 39.810 0.50 9.26 C ATOM 598 CA BMET A 70 14.446 23.524 39.754 0.50 9.34 C ATOM 599 C AMET A 70 14.254 24.425 41.029 0.50 8.83 C ATOM 600 C BMET A 70 14.182 24.298 41.047 0.50 8.85 C ATOM 601 O AMET A 70 15.121 24.497 41.908 0.50 8.65 O ATOM 602 O BMET A 70 14.950 24.161 42.010 0.50 8.68 O ATOM 603 CB AMET A 70 14.225 22.068 40.231 0.50 10.21 C ATOM 604 CB BMET A 70 14.360 22.032 40.024 0.50 10.41 C ATOM 605 CG AMET A 70 12.927 21.815 41.006 0.50 11.31 C ATOM 606 CG BMET A 70 12.992 21.493 40.317 0.50 11.51 C ATOM 607 SD AMET A 70 12.661 20.078 41.425 0.50 14.08 S ATOM 608 SD BMET A 70 13.210 19.718 40.436 0.50 13.87 S ATOM 609 CE AMET A 70 13.693 19.386 40.131 0.50 11.68 C ATOM 610 CE BMET A 70 11.589 19.360 41.081 0.50 13.21 C ATOM 0 H AMET A 70 16.335 23.120 39.411 0.50 9.09 H new ATOM 0 H BMET A 70 16.381 23.257 39.557 0.50 9.09 H new ATOM 0 HA AMET A 70 13.786 23.788 39.142 0.50 9.34 H new ATOM 0 HA BMET A 70 13.780 23.823 39.115 0.50 9.34 H new ATOM 0 HB2AMET A 70 14.228 21.511 39.437 0.50 10.41 H new ATOM 0 HB2BMET A 70 14.715 21.561 39.254 0.50 10.41 H new ATOM 0 HB3AMET A 70 14.975 21.786 40.778 0.50 10.41 H new ATOM 0 HB3BMET A 70 14.938 21.824 40.775 0.50 10.41 H new ATOM 0 HG2AMET A 70 12.940 22.338 41.823 0.50 11.51 H new ATOM 0 HG2BMET A 70 12.639 21.860 41.143 0.50 11.51 H new ATOM 0 HG3AMET A 70 12.177 22.131 40.478 0.50 11.51 H new ATOM 0 HG3BMET A 70 12.365 21.724 39.614 0.50 11.51 H new ATOM 0 HE1AMET A 70 13.656 18.418 40.170 0.50 13.21 H new ATOM 0 HE1BMET A 70 11.589 18.478 41.484 0.50 13.21 H new ATOM 0 HE2AMET A 70 13.373 19.687 39.266 0.50 13.21 H new ATOM 0 HE2BMET A 70 11.354 20.021 41.751 0.50 13.21 H new ATOM 0 HE3AMET A 70 14.609 19.679 40.256 0.50 13.21 H new ATOM 0 HE3BMET A 70 10.941 19.386 40.360 0.50 13.21 H new ATOM 611 N ASP A 71 13.120 25.117 41.056 1.00 8.61 N ATOM 612 CA ASP A 71 12.606 25.736 42.284 1.00 8.36 C ATOM 613 C ASP A 71 11.176 25.254 42.438 1.00 8.11 C ATOM 614 O ASP A 71 10.423 25.140 41.453 1.00 7.82 O ATOM 615 CB ASP A 71 12.658 27.269 42.185 1.00 8.55 C ATOM 616 CG ASP A 71 12.144 27.962 43.422 1.00 9.02 C ATOM 617 OD1 ASP A 71 12.918 28.141 44.369 1.00 9.60 O ATOM 618 OD2 ASP A 71 10.955 28.354 43.448 1.00 9.17 O ATOM 0 H AASP A 71 12.624 25.243 40.365 0.50 8.61 H new ATOM 0 H BASP A 71 12.679 25.328 40.349 0.50 8.61 H new ATOM 0 HA ASP A 71 13.143 25.488 43.053 1.00 8.36 H new ATOM 0 HB2 ASP A 71 13.573 27.546 42.023 1.00 8.55 H new ATOM 0 HB3 ASP A 71 12.135 27.556 41.420 1.00 8.55 H new ATOM 619 N VAL A 72 10.817 24.909 43.669 1.00 7.71 N ATOM 620 CA VAL A 72 9.438 24.458 43.975 1.00 7.95 C ATOM 621 C VAL A 72 8.795 25.372 44.996 1.00 7.47 C ATOM 622 O VAL A 72 9.467 25.865 45.906 1.00 7.87 O ATOM 623 CB VAL A 72 9.369 22.971 44.441 1.00 7.99 C ATOM 624 CG1 VAL A 72 9.830 22.048 43.322 1.00 8.44 C ATOM 625 CG2 VAL A 72 10.166 22.722 45.728 1.00 8.55 C ATOM 0 H VAL A 72 11.346 24.925 44.347 1.00 7.71 H new ATOM 0 HA VAL A 72 8.939 24.507 43.145 1.00 7.95 H new ATOM 0 HB VAL A 72 8.442 22.774 44.650 1.00 7.99 H new ATOM 0 HG11 VAL A 72 9.783 21.127 43.622 1.00 8.44 H new ATOM 0 HG12 VAL A 72 9.256 22.165 42.549 1.00 8.44 H new ATOM 0 HG13 VAL A 72 10.745 22.263 43.081 1.00 8.44 H new ATOM 0 HG21 VAL A 72 10.094 21.788 45.978 1.00 8.55 H new ATOM 0 HG22 VAL A 72 11.098 22.946 45.580 1.00 8.55 H new ATOM 0 HG23 VAL A 72 9.811 23.275 46.441 1.00 8.55 H new ATOM 626 N ARG A 73 7.495 25.607 44.828 1.00 7.76 N ATOM 627 CA ARG A 73 6.739 26.482 45.720 1.00 8.13 C ATOM 628 C ARG A 73 5.386 25.865 45.990 1.00 7.95 C ATOM 629 O ARG A 73 4.836 25.143 45.146 1.00 8.33 O ATOM 630 CB ARG A 73 6.525 27.878 45.132 1.00 8.14 C ATOM 631 CG ARG A 73 7.800 28.670 44.876 1.00 8.36 C ATOM 632 CD ARG A 73 8.450 29.092 46.179 1.00 8.78 C ATOM 633 NE ARG A 73 9.900 29.230 46.010 1.00 9.29 N ATOM 634 CZ ARG A 73 10.736 29.605 46.969 1.00 9.77 C ATOM 635 NH1 ARG A 73 10.280 29.957 48.170 1.00 10.22 N ATOM 636 NH2 ARG A 73 12.034 29.661 46.730 1.00 10.86 N ATOM 0 H ARG A 73 7.027 25.263 44.194 1.00 7.76 H new ATOM 0 HA ARG A 73 7.256 26.577 46.535 1.00 8.13 H new ATOM 0 HB2 ARG A 73 6.041 27.791 44.296 1.00 8.14 H new ATOM 0 HB3 ARG A 73 5.961 28.386 45.736 1.00 8.14 H new ATOM 0 HG2 ARG A 73 8.421 28.132 44.361 1.00 8.36 H new ATOM 0 HG3 ARG A 73 7.596 29.455 44.344 1.00 8.36 H new ATOM 0 HD2 ARG A 73 8.072 29.934 46.477 1.00 8.78 H new ATOM 0 HD3 ARG A 73 8.260 28.436 46.868 1.00 8.78 H new ATOM 0 HE ARG A 73 10.231 29.056 45.236 1.00 9.29 H new ATOM 0 HH11 ARG A 73 9.435 29.943 48.330 1.00 10.22 H new ATOM 0 HH12 ARG A 73 10.830 30.199 48.785 1.00 10.22 H new ATOM 0 HH21 ARG A 73 12.337 29.454 45.952 1.00 10.86 H new ATOM 0 HH22 ARG A 73 12.576 29.904 47.352 1.00 10.86 H new ATOM 637 N ALA A 74 4.850 26.171 47.178 1.00 8.28 N ATOM 638 CA ALA A 74 3.542 25.687 47.611 1.00 8.45 C ATOM 639 C ALA A 74 2.536 26.831 47.690 1.00 8.53 C ATOM 640 O ALA A 74 2.799 27.856 48.308 1.00 9.16 O ATOM 641 CB ALA A 74 3.657 25.024 48.975 1.00 9.07 C ATOM 0 H ALA A 74 5.243 26.671 47.757 1.00 8.28 H new ATOM 0 HA ALA A 74 3.230 25.041 46.958 1.00 8.45 H new ATOM 0 HB1 ALA A 74 2.785 24.706 49.255 1.00 9.07 H new ATOM 0 HB2 ALA A 74 4.272 24.276 48.920 1.00 9.07 H new ATOM 0 HB3 ALA A 74 3.988 25.667 49.621 1.00 9.07 H new ATOM 642 N TRP A 75 1.380 26.591 47.085 1.00 8.57 N ATOM 643 CA TRP A 75 0.231 27.487 47.131 1.00 9.14 C ATOM 644 C TRP A 75 -0.821 26.853 48.010 1.00 9.39 C ATOM 645 O TRP A 75 -1.446 25.872 47.635 1.00 9.89 O ATOM 646 CB TRP A 75 -0.274 27.694 45.721 1.00 9.26 C ATOM 647 CG TRP A 75 -1.493 28.554 45.606 1.00 9.70 C ATOM 648 CD1 TRP A 75 -2.828 28.159 45.584 1.00 10.04 C ATOM 649 CD2 TRP A 75 -1.503 30.009 45.457 1.00 9.82 C ATOM 650 NE1 TRP A 75 -3.640 29.258 45.409 1.00 10.48 N ATOM 651 CE2 TRP A 75 -2.907 30.398 45.337 1.00 10.22 C ATOM 652 CE3 TRP A 75 -0.514 30.996 45.407 1.00 10.04 C ATOM 653 CZ2 TRP A 75 -3.286 31.723 45.189 1.00 10.92 C ATOM 654 CZ3 TRP A 75 -0.917 32.323 45.252 1.00 10.16 C ATOM 655 CH2 TRP A 75 -2.275 32.669 45.128 1.00 11.09 C ATOM 0 H TRP A 75 1.237 25.881 46.622 1.00 8.57 H new ATOM 0 HA TRP A 75 0.465 28.353 47.500 1.00 9.14 H new ATOM 0 HB2 TRP A 75 0.436 28.091 45.192 1.00 9.26 H new ATOM 0 HB3 TRP A 75 -0.468 26.827 45.331 1.00 9.26 H new ATOM 0 HD1 TRP A 75 -3.127 27.283 45.674 1.00 10.04 H new ATOM 0 HE1 TRP A 75 -4.498 29.226 45.353 1.00 10.48 H new ATOM 0 HE3 TRP A 75 0.387 30.774 45.475 1.00 10.04 H new ATOM 0 HZ2 TRP A 75 -4.182 31.967 45.133 1.00 10.92 H new ATOM 0 HZ3 TRP A 75 -0.273 32.994 45.230 1.00 10.16 H new ATOM 0 HH2 TRP A 75 -2.502 33.562 45.001 1.00 11.09 H new ATOM 656 N ILE A 76 -0.941 27.400 49.222 1.00 10.14 N ATOM 657 CA ILE A 76 -1.823 26.864 50.271 1.00 11.35 C ATOM 658 C ILE A 76 -2.835 27.949 50.613 1.00 11.96 C ATOM 659 O ILE A 76 -2.464 29.017 51.075 1.00 12.11 O ATOM 660 CB ILE A 76 -0.975 26.521 51.514 1.00 11.53 C ATOM 661 CG1 ILE A 76 0.104 25.473 51.162 1.00 12.07 C ATOM 662 CG2 ILE A 76 -1.865 26.050 52.666 1.00 12.39 C ATOM 663 CD1 ILE A 76 1.331 25.524 52.041 1.00 13.42 C ATOM 0 H ILE A 76 -0.508 28.102 49.464 1.00 10.14 H new ATOM 0 HA ILE A 76 -2.278 26.061 49.973 1.00 11.35 H new ATOM 0 HB ILE A 76 -0.520 27.325 51.809 1.00 11.53 H new ATOM 0 HG12 ILE A 76 -0.288 24.588 51.223 1.00 12.07 H new ATOM 0 HG13 ILE A 76 0.375 25.600 50.239 1.00 12.07 H new ATOM 0 HG21 ILE A 76 -1.314 25.840 53.436 1.00 12.39 H new ATOM 0 HG22 ILE A 76 -2.491 26.753 52.899 1.00 12.39 H new ATOM 0 HG23 ILE A 76 -2.355 25.258 52.394 1.00 12.39 H new ATOM 0 HD11 ILE A 76 1.959 24.840 51.760 1.00 13.42 H new ATOM 0 HD12 ILE A 76 1.748 26.396 51.965 1.00 13.42 H new ATOM 0 HD13 ILE A 76 1.075 25.368 52.964 1.00 13.42 H new ATOM 664 N VAL A 77 -4.105 27.665 50.345 1.00 13.14 N ATOM 665 CA VAL A 77 -5.176 28.644 50.621 1.00 14.02 C ATOM 666 C VAL A 77 -6.088 28.143 51.725 1.00 14.75 C ATOM 667 O VAL A 77 -6.570 27.015 51.657 1.00 15.64 O ATOM 668 CB VAL A 77 -6.014 28.954 49.363 1.00 13.72 C ATOM 669 CG1 VAL A 77 -7.217 29.852 49.685 1.00 14.24 C ATOM 670 CG2 VAL A 77 -5.151 29.596 48.280 1.00 14.03 C ATOM 0 H VAL A 77 -4.375 26.922 50.007 1.00 13.14 H new ATOM 0 HA VAL A 77 -4.742 29.464 50.905 1.00 14.02 H new ATOM 0 HB VAL A 77 -6.355 28.109 49.032 1.00 13.72 H new ATOM 0 HG11 VAL A 77 -7.719 30.025 48.873 1.00 14.24 H new ATOM 0 HG12 VAL A 77 -7.790 29.407 50.330 1.00 14.24 H new ATOM 0 HG13 VAL A 77 -6.904 30.692 50.056 1.00 14.24 H new ATOM 0 HG21 VAL A 77 -5.696 29.782 47.500 1.00 14.03 H new ATOM 0 HG22 VAL A 77 -4.774 30.424 48.615 1.00 14.03 H new ATOM 0 HG23 VAL A 77 -4.434 28.990 48.036 1.00 14.03 H new ATOM 671 N GLU A 78 -6.291 28.984 52.742 1.00 15.04 N ATOM 672 CA GLU A 78 -7.222 28.682 53.833 1.00 16.60 C ATOM 673 C GLU A 78 -8.029 29.939 54.088 1.00 16.91 C ATOM 674 O GLU A 78 -7.470 31.025 54.210 1.00 16.51 O ATOM 675 CB GLU A 78 -6.459 28.279 55.090 1.00 16.99 C ATOM 676 CG GLU A 78 -5.733 26.960 54.943 1.00 18.57 C ATOM 677 CD GLU A 78 -5.034 26.510 56.198 1.00 19.91 C ATOM 678 OE1 GLU A 78 -5.253 27.110 57.276 1.00 21.67 O ATOM 679 OE2 GLU A 78 -4.268 25.532 56.105 1.00 20.29 O ATOM 0 H GLU A 78 -5.894 29.743 52.819 1.00 15.04 H new ATOM 0 HA GLU A 78 -7.801 27.941 53.594 1.00 16.60 H new ATOM 0 HB2 GLU A 78 -5.818 28.973 55.309 1.00 16.99 H new ATOM 0 HB3 GLU A 78 -7.079 28.220 55.834 1.00 16.99 H new ATOM 0 HG2 GLU A 78 -6.369 26.278 54.674 1.00 18.57 H new ATOM 0 HG3 GLU A 78 -5.081 27.037 54.229 1.00 18.57 H new ATOM 680 N ASP A 79 -9.354 29.783 54.135 1.00 18.87 N ATOM 681 CA ASP A 79 -10.259 30.913 54.375 1.00 20.47 C ATOM 682 C ASP A 79 -9.953 32.029 53.366 1.00 19.35 C ATOM 683 O ASP A 79 -9.917 33.211 53.704 1.00 19.41 O ATOM 684 CB ASP A 79 -10.150 31.386 55.842 1.00 22.79 C ATOM 685 CG ASP A 79 -11.230 32.389 56.227 1.00 26.00 C ATOM 686 OD1 ASP A 79 -12.354 32.310 55.687 1.00 28.25 O ATOM 687 OD2 ASP A 79 -10.940 33.262 57.072 1.00 28.84 O ATOM 0 H ASP A 79 -9.751 29.028 54.030 1.00 18.87 H new ATOM 0 HA ASP A 79 -11.180 30.640 54.241 1.00 20.47 H new ATOM 0 HB2 ASP A 79 -10.206 30.616 56.430 1.00 22.79 H new ATOM 0 HB3 ASP A 79 -9.278 31.787 55.983 1.00 22.79 H new ATOM 688 N GLU A 80 -9.692 31.615 52.120 1.00 19.41 N ATOM 689 CA GLU A 80 -9.446 32.521 50.983 1.00 20.04 C ATOM 690 C GLU A 80 -8.183 33.384 51.126 1.00 18.57 C ATOM 691 O GLU A 80 -8.042 34.419 50.471 1.00 19.32 O ATOM 692 CB GLU A 80 -10.685 33.391 50.681 1.00 23.58 C ATOM 693 CG GLU A 80 -11.964 32.590 50.455 1.00 26.99 C ATOM 694 CD GLU A 80 -12.048 31.909 49.098 1.00 29.58 C ATOM 695 OE1 GLU A 80 -11.001 31.596 48.482 1.00 32.71 O ATOM 696 OE2 GLU A 80 -13.188 31.667 48.645 1.00 33.39 O ATOM 0 H GLU A 80 -9.652 30.783 51.906 1.00 19.41 H new ATOM 0 HA GLU A 80 -9.279 31.941 50.224 1.00 20.04 H new ATOM 0 HB2 GLU A 80 -10.825 34.006 51.418 1.00 23.58 H new ATOM 0 HB3 GLU A 80 -10.507 33.929 49.893 1.00 23.58 H new ATOM 0 HG2 GLU A 80 -12.037 31.915 51.148 1.00 26.99 H new ATOM 0 HG3 GLU A 80 -12.725 33.183 50.555 1.00 26.99 H new ATOM 697 N LYS A 81 -7.277 32.955 52.001 1.00 16.40 N ATOM 698 CA LYS A 81 -6.036 33.666 52.258 1.00 15.49 C ATOM 699 C LYS A 81 -4.892 32.727 51.904 1.00 14.12 C ATOM 700 O LYS A 81 -5.042 31.506 51.976 1.00 14.39 O ATOM 701 CB LYS A 81 -5.942 34.093 53.729 1.00 16.49 C ATOM 702 CG LYS A 81 -6.997 35.120 54.132 1.00 18.65 C ATOM 703 CD LYS A 81 -6.776 35.627 55.547 1.00 20.83 C ATOM 704 CE LYS A 81 -7.895 36.600 55.906 1.00 24.19 C ATOM 705 NZ LYS A 81 -7.779 37.135 57.289 1.00 27.48 N ATOM 0 H LYS A 81 -7.369 32.236 52.464 1.00 16.40 H new ATOM 0 HA LYS A 81 -5.996 34.474 51.722 1.00 15.49 H new ATOM 0 HB2 LYS A 81 -6.032 33.309 54.293 1.00 16.49 H new ATOM 0 HB3 LYS A 81 -5.061 34.462 53.896 1.00 16.49 H new ATOM 0 HG2 LYS A 81 -6.975 35.867 53.513 1.00 18.65 H new ATOM 0 HG3 LYS A 81 -7.879 34.722 54.065 1.00 18.65 H new ATOM 0 HD2 LYS A 81 -6.765 34.884 56.171 1.00 20.83 H new ATOM 0 HD3 LYS A 81 -5.914 36.068 55.614 1.00 20.83 H new ATOM 0 HE2 LYS A 81 -7.888 37.339 55.277 1.00 24.19 H new ATOM 0 HE3 LYS A 81 -8.750 36.152 55.809 1.00 24.19 H new ATOM 0 HZ1 LYS A 81 -8.452 37.695 57.448 1.00 27.48 H new ATOM 0 HZ2 LYS A 81 -7.809 36.462 57.871 1.00 27.48 H new ATOM 0 HZ3 LYS A 81 -7.006 37.568 57.376 1.00 27.48 H new ATOM 706 N AILE A 82 -3.741 33.317 51.590 0.34 13.47 N ATOM 707 N BILE A 82 -3.761 33.287 51.488 0.33 13.64 N ATOM 708 N CILE A 82 -3.752 33.319 51.539 0.33 13.51 N ATOM 709 CA AILE A 82 -2.583 32.590 51.076 0.34 13.03 C ATOM 710 CA BILE A 82 -2.640 32.450 51.061 0.33 13.20 C ATOM 711 CA CILE A 82 -2.578 32.581 51.058 0.33 13.02 C ATOM 712 C AILE A 82 -1.496 32.458 52.136 0.34 12.59 C ATOM 713 C BILE A 82 -1.515 32.438 52.087 0.33 12.70 C ATOM 714 C CILE A 82 -1.504 32.454 52.135 0.33 12.59 C ATOM 715 O AILE A 82 -1.153 33.439 52.805 0.34 12.34 O ATOM 716 O BILE A 82 -1.177 33.470 52.681 0.33 12.51 O ATOM 717 O CILE A 82 -1.180 33.433 52.814 0.33 12.37 O ATOM 718 CB AILE A 82 -2.020 33.333 49.854 0.34 12.91 C ATOM 719 CB BILE A 82 -2.111 32.851 49.668 0.33 13.31 C ATOM 720 CB CILE A 82 -1.977 33.265 49.808 0.33 12.91 C ATOM 721 CG1AILE A 82 -3.154 33.648 48.873 0.34 13.16 C ATOM 722 CG1BILE A 82 -1.343 34.171 49.744 0.33 13.13 C ATOM 723 CG1CILE A 82 -0.815 32.442 49.247 0.33 12.52 C ATOM 724 CG2AILE A 82 -0.917 32.519 49.188 0.34 12.64 C ATOM 725 CG2BILE A 82 -3.254 32.932 48.667 0.33 13.41 C ATOM 726 CG2CILE A 82 -1.493 34.670 50.124 0.33 13.43 C ATOM 727 CD1AILE A 82 -2.939 34.919 48.092 0.34 13.50 C ATOM 728 CD1BILE A 82 -0.389 34.390 48.593 0.33 13.32 C ATOM 729 CD1CILE A 82 -1.209 31.048 48.818 0.33 12.47 C ATOM 0 H AILE A 82 -3.609 34.163 51.671 0.34 13.51 H new ATOM 0 H BILE A 82 -3.621 34.134 51.445 0.33 13.51 H new ATOM 0 H CILE A 82 -3.637 34.171 51.564 0.33 13.51 H new ATOM 0 HA AILE A 82 -2.869 31.698 50.824 0.34 13.02 H new ATOM 0 HA BILE A 82 -2.986 31.546 50.992 0.33 13.02 H new ATOM 0 HA CILE A 82 -2.881 31.689 50.825 0.33 13.02 H new ATOM 0 HB AILE A 82 -1.625 34.170 50.145 0.34 12.91 H new ATOM 0 HB BILE A 82 -1.495 32.167 49.361 0.33 12.91 H new ATOM 0 HB CILE A 82 -2.682 33.321 49.144 0.33 12.91 H new ATOM 0 HG12AILE A 82 -3.250 32.908 48.253 0.34 12.52 H new ATOM 0 HG12BILE A 82 -1.978 34.904 49.770 0.33 12.52 H new ATOM 0 HG12CILE A 82 -0.435 32.910 48.487 0.33 12.52 H new ATOM 0 HG13AILE A 82 -3.987 33.716 49.365 0.34 12.52 H new ATOM 0 HG13BILE A 82 -0.844 34.198 50.576 0.33 12.52 H new ATOM 0 HG13CILE A 82 -0.119 32.380 49.920 0.33 12.52 H new ATOM 0 HG21AILE A 82 -0.575 33.004 48.420 0.34 13.43 H new ATOM 0 HG21BILE A 82 -2.906 33.185 47.798 0.33 13.43 H new ATOM 0 HG21CILE A 82 -1.122 35.073 49.323 0.33 13.43 H new ATOM 0 HG22AILE A 82 -0.198 32.369 49.821 0.34 13.43 H new ATOM 0 HG22BILE A 82 -3.689 32.068 48.602 0.33 13.43 H new ATOM 0 HG22CILE A 82 -2.238 35.206 50.440 0.33 13.43 H new ATOM 0 HG23AILE A 82 -1.275 31.665 48.898 0.34 13.43 H new ATOM 0 HG23BILE A 82 -3.897 33.595 48.963 0.33 13.43 H new ATOM 0 HG23CILE A 82 -0.810 34.630 50.811 0.33 13.43 H new ATOM 0 HD11AILE A 82 -3.688 35.061 47.492 0.34 12.47 H new ATOM 0 HD11BILE A 82 0.062 35.241 48.704 0.33 12.47 H new ATOM 0 HD11CILE A 82 -0.430 30.583 48.474 0.33 12.47 H new ATOM 0 HD12AILE A 82 -2.870 35.668 48.705 0.34 12.47 H new ATOM 0 HD12BILE A 82 0.268 33.676 48.576 0.33 12.47 H new ATOM 0 HD12CILE A 82 -1.565 30.563 49.579 0.33 12.47 H new ATOM 0 HD13AILE A 82 -2.121 34.847 47.576 0.34 12.47 H new ATOM 0 HD13BILE A 82 -0.884 34.393 47.759 0.33 12.47 H new ATOM 0 HD13CILE A 82 -1.885 31.102 48.125 0.33 12.47 H new ATOM 730 N CYS A 83 -0.937 31.257 52.280 1.00 12.14 N ATOM 731 CA CYS A 83 0.145 31.040 53.240 1.00 12.28 C ATOM 732 C CYS A 83 1.457 31.632 52.728 1.00 11.93 C ATOM 733 O CYS A 83 1.894 31.304 51.614 1.00 11.58 O ATOM 734 CB CYS A 83 0.333 29.550 53.487 1.00 12.69 C ATOM 735 SG CYS A 83 1.673 29.196 54.641 1.00 13.91 S ATOM 0 H ACYS A 83 -1.168 30.559 51.834 0.34 12.14 H new ATOM 0 H BCYS A 83 -1.165 30.547 51.851 0.33 12.14 H new ATOM 0 H CCYS A 83 -1.164 30.558 51.833 0.33 12.14 H new ATOM 0 HA CYS A 83 -0.097 31.483 54.068 1.00 12.28 H new ATOM 0 HB2 CYS A 83 -0.493 29.177 53.833 1.00 12.69 H new ATOM 0 HB3 CYS A 83 0.513 29.107 52.643 1.00 12.69 H new ATOM 0 HG CYS A 83 1.767 28.009 54.793 1.00 13.91 H new ATOM 736 N LEU A 84 2.074 32.509 53.504 1.00 11.81 N ATOM 737 CA LEU A 84 3.409 33.011 53.204 1.00 11.40 C ATOM 738 C LEU A 84 4.306 32.838 54.410 1.00 11.68 C ATOM 739 O LEU A 84 3.847 32.839 55.568 1.00 12.37 O ATOM 740 CB LEU A 84 3.399 34.487 52.774 1.00 11.34 C ATOM 741 CG LEU A 84 2.618 34.845 51.522 1.00 11.84 C ATOM 742 CD1 LEU A 84 2.514 36.344 51.326 1.00 12.59 C ATOM 743 CD2 LEU A 84 3.202 34.211 50.260 1.00 11.96 C ATOM 0 H LEU A 84 1.731 32.833 54.223 1.00 11.81 H new ATOM 0 HA LEU A 84 3.749 32.494 52.457 1.00 11.40 H new ATOM 0 HB2 LEU A 84 3.044 35.011 53.509 1.00 11.34 H new ATOM 0 HB3 LEU A 84 4.318 34.768 52.644 1.00 11.34 H new ATOM 0 HG LEU A 84 1.730 34.482 51.662 1.00 11.84 H new ATOM 0 HD11 LEU A 84 2.010 36.531 50.519 1.00 12.59 H new ATOM 0 HD12 LEU A 84 2.062 36.740 52.088 1.00 12.59 H new ATOM 0 HD13 LEU A 84 3.403 36.723 51.246 1.00 12.59 H new ATOM 0 HD21 LEU A 84 2.669 34.469 49.492 1.00 11.96 H new ATOM 0 HD22 LEU A 84 4.115 34.515 50.137 1.00 11.96 H new ATOM 0 HD23 LEU A 84 3.193 33.245 50.349 1.00 11.96 H new ATOM 744 N VAL A 85 5.589 32.620 54.148 1.00 11.10 N ATOM 745 CA VAL A 85 6.583 32.496 55.204 1.00 11.19 C ATOM 746 C VAL A 85 7.654 33.552 55.082 1.00 11.42 C ATOM 747 O VAL A 85 7.936 34.053 53.997 1.00 11.24 O ATOM 748 CB VAL A 85 7.217 31.074 55.264 1.00 11.19 C ATOM 749 CG1 VAL A 85 6.177 30.060 55.707 1.00 11.61 C ATOM 750 CG2 VAL A 85 7.843 30.668 53.925 1.00 11.61 C ATOM 0 H VAL A 85 5.907 32.540 53.353 1.00 11.10 H new ATOM 0 HA VAL A 85 6.111 32.635 56.040 1.00 11.19 H new ATOM 0 HB VAL A 85 7.935 31.095 55.916 1.00 11.19 H new ATOM 0 HG11 VAL A 85 6.579 29.178 55.742 1.00 11.61 H new ATOM 0 HG12 VAL A 85 5.846 30.299 56.587 1.00 11.61 H new ATOM 0 HG13 VAL A 85 5.441 30.054 55.076 1.00 11.61 H new ATOM 0 HG21 VAL A 85 8.226 29.780 54.003 1.00 11.61 H new ATOM 0 HG22 VAL A 85 7.160 30.666 53.236 1.00 11.61 H new ATOM 0 HG23 VAL A 85 8.539 31.300 53.688 1.00 11.61 H new ATOM 751 N ARG A 86 8.237 33.912 56.225 1.00 11.56 N ATOM 752 CA ARG A 86 9.335 34.877 56.266 1.00 12.42 C ATOM 753 C ARG A 86 10.561 34.196 56.841 1.00 12.28 C ATOM 754 O ARG A 86 10.510 33.638 57.936 1.00 12.78 O ATOM 755 CB ARG A 86 8.942 36.128 57.084 1.00 12.51 C ATOM 756 CG ARG A 86 10.035 37.188 57.164 1.00 13.17 C ATOM 757 CD ARG A 86 9.561 38.464 57.860 1.00 14.55 C ATOM 758 NE ARG A 86 9.234 38.268 59.276 1.00 15.39 N ATOM 759 CZ ARG A 86 10.123 38.257 60.266 1.00 15.55 C ATOM 760 NH1 ARG A 86 11.427 38.396 60.028 1.00 16.04 N ATOM 761 NH2 ARG A 86 9.715 38.085 61.514 1.00 17.11 N ATOM 0 H ARG A 86 8.008 33.605 56.995 1.00 11.56 H new ATOM 0 HA ARG A 86 9.535 35.183 55.368 1.00 12.42 H new ATOM 0 HB2 ARG A 86 8.149 36.524 56.690 1.00 12.51 H new ATOM 0 HB3 ARG A 86 8.705 35.853 57.984 1.00 12.51 H new ATOM 0 HG2 ARG A 86 10.798 36.827 57.642 1.00 13.17 H new ATOM 0 HG3 ARG A 86 10.338 37.405 56.268 1.00 13.17 H new ATOM 0 HD2 ARG A 86 10.252 39.141 57.785 1.00 14.55 H new ATOM 0 HD3 ARG A 86 8.779 38.805 57.398 1.00 14.55 H new ATOM 0 HE ARG A 86 8.407 38.152 59.482 1.00 15.39 H new ATOM 0 HH11 ARG A 86 11.709 38.495 59.222 1.00 16.04 H new ATOM 0 HH12 ARG A 86 11.987 38.386 60.681 1.00 16.04 H new ATOM 0 HH21 ARG A 86 8.878 37.981 61.682 1.00 17.11 H new ATOM 0 HH22 ARG A 86 10.287 38.077 62.156 1.00 17.11 H new ATOM 762 N GLY A 87 11.654 34.213 56.073 1.00 12.69 N ATOM 763 CA GLY A 87 12.888 33.563 56.517 1.00 13.52 C ATOM 764 C GLY A 87 13.563 34.285 57.669 1.00 14.32 C ATOM 765 O GLY A 87 13.447 35.510 57.799 1.00 14.25 O ATOM 0 H GLY A 87 11.701 34.591 55.302 1.00 12.69 H new ATOM 0 HA2 GLY A 87 12.688 32.653 56.786 1.00 13.52 H new ATOM 0 HA3 GLY A 87 13.505 33.509 55.771 1.00 13.52 H new ATOM 766 N GLN A 88 14.289 33.538 58.489 1.00 15.16 N ATOM 767 CA GLN A 88 15.177 34.165 59.481 1.00 16.11 C ATOM 768 C GLN A 88 16.158 35.109 58.798 1.00 16.38 C ATOM 769 O GLN A 88 16.685 34.808 57.721 1.00 17.05 O ATOM 770 CB GLN A 88 15.940 33.114 60.306 1.00 16.86 C ATOM 771 CG GLN A 88 15.062 32.192 61.148 1.00 17.47 C ATOM 772 CD GLN A 88 14.495 32.812 62.432 1.00 17.82 C ATOM 773 OE1 GLN A 88 13.825 32.125 63.204 1.00 19.48 O ATOM 774 NE2 GLN A 88 14.741 34.101 62.659 1.00 17.84 N ATOM 0 H GLN A 88 14.288 32.678 58.495 1.00 15.16 H new ATOM 0 HA GLN A 88 14.619 34.674 60.090 1.00 16.11 H new ATOM 0 HB2 GLN A 88 16.470 32.571 59.702 1.00 16.86 H new ATOM 0 HB3 GLN A 88 16.561 33.572 60.894 1.00 16.86 H new ATOM 0 HG2 GLN A 88 14.322 31.887 60.600 1.00 17.47 H new ATOM 0 HG3 GLN A 88 15.580 31.408 61.387 1.00 17.47 H new ATOM 0 HE21 GLN A 88 15.213 34.554 62.100 1.00 17.84 H new ATOM 0 HE22 GLN A 88 14.428 34.481 63.364 1.00 17.84 H new ATOM 775 N GLY A 89 16.365 36.275 59.416 1.00 16.33 N ATOM 776 CA GLY A 89 17.255 37.292 58.871 1.00 16.08 C ATOM 777 C GLY A 89 16.714 38.073 57.686 1.00 16.27 C ATOM 778 O GLY A 89 17.447 38.833 57.047 1.00 17.54 O ATOM 0 H GLY A 89 15.993 36.494 60.160 1.00 16.33 H new ATOM 0 HA2 GLY A 89 17.474 37.919 59.578 1.00 16.08 H new ATOM 0 HA3 GLY A 89 18.084 36.864 58.604 1.00 16.08 H new ATOM 779 N AGLU A 90 15.430 37.893 57.393 0.50 15.64 N ATOM 780 N BGLU A 90 15.425 37.897 57.405 0.50 15.65 N ATOM 781 CA AGLU A 90 14.815 38.539 56.240 0.50 15.35 C ATOM 782 CA BGLU A 90 14.794 38.520 56.247 0.50 15.36 C ATOM 783 C AGLU A 90 13.555 39.301 56.626 0.50 14.69 C ATOM 784 C BGLU A 90 13.559 39.314 56.643 0.50 14.69 C ATOM 785 O AGLU A 90 12.896 38.958 57.603 0.50 14.34 O ATOM 786 O BGLU A 90 12.910 38.993 57.633 0.50 14.35 O ATOM 787 CB AGLU A 90 14.548 37.510 55.133 0.50 15.78 C ATOM 788 CB BGLU A 90 14.431 37.454 55.213 0.50 15.79 C ATOM 789 CG AGLU A 90 15.828 37.000 54.481 0.50 15.68 C ATOM 790 CG BGLU A 90 15.583 36.528 54.855 0.50 15.75 C ATOM 791 CD AGLU A 90 15.632 35.780 53.598 0.50 16.04 C ATOM 792 CD BGLU A 90 15.336 35.754 53.576 0.50 16.20 C ATOM 793 OE1AGLU A 90 14.547 35.165 53.641 0.50 15.40 O ATOM 794 OE1BGLU A 90 14.433 36.149 52.808 0.50 16.47 O ATOM 795 OE2AGLU A 90 16.586 35.427 52.874 0.50 16.35 O ATOM 796 OE2BGLU A 90 16.057 34.762 53.343 0.50 16.08 O ATOM 0 H AGLU A 90 14.896 37.399 57.852 0.50 15.65 H new ATOM 0 H BGLU A 90 14.894 37.414 57.879 0.50 15.65 H new ATOM 0 HA AGLU A 90 15.437 39.197 55.893 0.50 15.36 H new ATOM 0 HA BGLU A 90 15.430 39.141 55.857 0.50 15.36 H new ATOM 0 HB2AGLU A 90 14.058 36.760 55.505 0.50 15.79 H new ATOM 0 HB2BGLU A 90 13.694 36.923 55.553 0.50 15.79 H new ATOM 0 HB3AGLU A 90 13.981 37.910 54.455 0.50 15.79 H new ATOM 0 HB3BGLU A 90 14.116 37.892 54.407 0.50 15.79 H new ATOM 0 HG2AGLU A 90 16.215 37.713 53.949 0.50 15.75 H new ATOM 0 HG2BGLU A 90 16.395 37.050 54.761 0.50 15.75 H new ATOM 0 HG3AGLU A 90 16.470 36.784 55.176 0.50 15.75 H new ATOM 0 HG3BGLU A 90 15.730 35.904 55.583 0.50 15.75 H new ATOM 797 N ASP A 91 13.242 40.345 55.863 1.00 14.81 N ATOM 798 CA ASP A 91 12.093 41.191 56.143 1.00 15.63 C ATOM 799 C ASP A 91 10.895 40.915 55.237 1.00 16.25 C ATOM 800 O ASP A 91 9.815 41.466 55.444 1.00 17.53 O ATOM 801 CB ASP A 91 12.494 42.664 56.054 1.00 16.74 C ATOM 802 CG ASP A 91 12.770 43.120 54.630 1.00 17.89 C ATOM 803 OD1 ASP A 91 13.382 42.373 53.838 1.00 19.25 O ATOM 804 OD2 ASP A 91 12.373 44.252 54.287 1.00 19.49 O ATOM 0 H AASP A 91 13.692 40.580 55.169 0.50 14.81 H new ATOM 0 H BASP A 91 13.686 40.570 55.162 0.50 14.81 H new ATOM 0 HA ASP A 91 11.807 40.977 57.045 1.00 15.63 H new ATOM 0 HB2 ASP A 91 11.787 43.210 56.432 1.00 16.74 H new ATOM 0 HB3 ASP A 91 13.286 42.812 56.595 1.00 16.74 H new ATOM 805 N SER A 92 11.082 40.049 54.241 1.00 14.50 N ATOM 806 CA SER A 92 10.062 39.851 53.219 1.00 14.18 C ATOM 807 C SER A 92 9.558 38.407 53.151 1.00 12.41 C ATOM 808 O SER A 92 10.141 37.508 53.756 1.00 12.70 O ATOM 809 CB SER A 92 10.579 40.300 51.857 1.00 15.93 C ATOM 810 OG SER A 92 11.751 39.590 51.556 1.00 17.33 O ATOM 0 H SER A 92 11.789 39.570 54.141 1.00 14.50 H new ATOM 0 HA SER A 92 9.303 40.399 53.472 1.00 14.18 H new ATOM 0 HB2 SER A 92 9.907 40.142 51.175 1.00 15.93 H new ATOM 0 HB3 SER A 92 10.757 41.253 51.864 1.00 15.93 H new ATOM 0 HG SER A 92 12.420 40.076 51.705 1.00 17.33 H new ATOM 811 N TRP A 93 8.488 38.210 52.391 1.00 11.40 N ATOM 812 CA TRP A 93 7.687 37.004 52.475 1.00 11.26 C ATOM 813 C TRP A 93 7.655 36.300 51.154 1.00 10.62 C ATOM 814 O TRP A 93 7.703 36.934 50.103 1.00 11.00 O ATOM 815 CB TRP A 93 6.261 37.390 52.855 1.00 12.01 C ATOM 816 CG TRP A 93 6.156 38.014 54.230 1.00 12.71 C ATOM 817 CD1 TRP A 93 6.423 39.330 54.593 1.00 12.92 C ATOM 818 CD2 TRP A 93 5.725 37.347 55.452 1.00 12.66 C ATOM 819 NE1 TRP A 93 6.212 39.508 55.941 1.00 13.55 N ATOM 820 CE2 TRP A 93 5.774 38.360 56.511 1.00 13.05 C ATOM 821 CE3 TRP A 93 5.306 36.063 55.761 1.00 13.29 C ATOM 822 CZ2 TRP A 93 5.420 38.063 57.816 1.00 13.42 C ATOM 823 CZ3 TRP A 93 4.964 35.771 57.085 1.00 13.48 C ATOM 824 CH2 TRP A 93 5.012 36.758 58.084 1.00 13.59 C ATOM 0 H TRP A 93 8.207 38.778 51.809 1.00 11.40 H new ATOM 0 HA TRP A 93 8.075 36.413 53.139 1.00 11.26 H new ATOM 0 HB2 TRP A 93 5.915 38.013 52.197 1.00 12.01 H new ATOM 0 HB3 TRP A 93 5.699 36.600 52.821 1.00 12.01 H new ATOM 0 HD1 TRP A 93 6.704 39.995 54.007 1.00 12.92 H new ATOM 0 HE1 TRP A 93 6.340 40.246 56.363 1.00 13.55 H new ATOM 0 HE3 TRP A 93 5.253 35.409 55.102 1.00 13.29 H new ATOM 0 HZ2 TRP A 93 5.453 38.707 58.486 1.00 13.42 H new ATOM 0 HZ3 TRP A 93 4.700 34.908 57.309 1.00 13.48 H new ATOM 0 HH2 TRP A 93 4.764 36.533 58.952 1.00 13.59 H new ATOM 825 N ALA A 94 7.508 34.974 51.202 1.00 10.38 N ATOM 826 CA ALA A 94 7.359 34.183 49.961 1.00 10.49 C ATOM 827 C ALA A 94 6.500 32.964 50.211 1.00 10.23 C ATOM 828 O ALA A 94 6.238 32.591 51.354 1.00 10.23 O ATOM 829 CB ALA A 94 8.721 33.753 49.415 1.00 11.34 C ATOM 0 H ALA A 94 7.491 34.513 51.928 1.00 10.38 H new ATOM 0 HA ALA A 94 6.927 34.747 49.301 1.00 10.49 H new ATOM 0 HB1 ALA A 94 8.596 33.237 48.603 1.00 11.34 H new ATOM 0 HB2 ALA A 94 9.254 34.539 49.219 1.00 11.34 H new ATOM 0 HB3 ALA A 94 9.178 33.209 50.076 1.00 11.34 H new ATOM 830 N LEU A 95 6.084 32.304 49.125 1.00 9.48 N ATOM 831 CA LEU A 95 5.417 31.004 49.256 1.00 9.28 C ATOM 832 C LEU A 95 6.439 30.004 49.794 1.00 9.24 C ATOM 833 O LEU A 95 7.633 30.100 49.442 1.00 9.40 O ATOM 834 CB LEU A 95 4.922 30.493 47.895 1.00 9.55 C ATOM 835 CG LEU A 95 3.952 31.368 47.104 1.00 9.61 C ATOM 836 CD1 LEU A 95 3.737 30.797 45.712 1.00 10.34 C ATOM 837 CD2 LEU A 95 2.609 31.445 47.817 1.00 10.28 C ATOM 0 H LEU A 95 6.176 32.585 48.318 1.00 9.48 H new ATOM 0 HA LEU A 95 4.655 31.100 49.849 1.00 9.28 H new ATOM 0 HB2 LEU A 95 5.700 30.334 47.338 1.00 9.55 H new ATOM 0 HB3 LEU A 95 4.496 29.634 48.039 1.00 9.55 H new ATOM 0 HG LEU A 95 4.336 32.256 47.034 1.00 9.61 H new ATOM 0 HD11 LEU A 95 3.120 31.362 45.222 1.00 10.34 H new ATOM 0 HD12 LEU A 95 4.585 30.761 45.242 1.00 10.34 H new ATOM 0 HD13 LEU A 95 3.369 29.902 45.782 1.00 10.34 H new ATOM 0 HD21 LEU A 95 2.002 32.003 47.305 1.00 10.28 H new ATOM 0 HD22 LEU A 95 2.235 30.554 47.901 1.00 10.28 H new ATOM 0 HD23 LEU A 95 2.733 31.828 48.700 1.00 10.28 H new ATOM 838 N PRO A 96 6.014 29.044 50.638 1.00 9.16 N ATOM 839 CA PRO A 96 6.946 28.005 51.084 1.00 9.17 C ATOM 840 C PRO A 96 7.559 27.280 49.884 1.00 9.32 C ATOM 841 O PRO A 96 6.915 27.131 48.853 1.00 9.01 O ATOM 842 CB PRO A 96 6.062 27.048 51.900 1.00 9.25 C ATOM 843 CG PRO A 96 4.923 27.912 52.363 1.00 9.18 C ATOM 844 CD PRO A 96 4.669 28.857 51.215 1.00 9.43 C ATOM 0 HA PRO A 96 7.690 28.360 51.596 1.00 9.17 H new ATOM 0 HB2 PRO A 96 5.748 26.306 51.359 1.00 9.25 H new ATOM 0 HB3 PRO A 96 6.547 26.668 52.649 1.00 9.25 H new ATOM 0 HG2 PRO A 96 4.136 27.381 52.563 1.00 9.18 H new ATOM 0 HG3 PRO A 96 5.153 28.394 53.172 1.00 9.18 H new ATOM 0 HD2 PRO A 96 4.050 28.481 50.570 1.00 9.43 H new ATOM 0 HD3 PRO A 96 4.288 29.696 51.518 1.00 9.43 H new ATOM 845 N GLY A 97 8.806 26.858 50.035 1.00 9.47 N ATOM 846 CA GLY A 97 9.510 26.112 48.981 1.00 9.95 C ATOM 847 C GLY A 97 10.990 26.401 48.994 1.00 10.86 C ATOM 848 O GLY A 97 11.571 26.761 50.031 1.00 12.26 O ATOM 0 H GLY A 97 9.273 26.991 50.745 1.00 9.47 H new ATOM 0 HA2 GLY A 97 9.364 25.161 49.103 1.00 9.95 H new ATOM 0 HA3 GLY A 97 9.141 26.347 48.115 1.00 9.95 H new ATOM 849 N GLY A 98 11.614 26.235 47.836 1.00 10.83 N ATOM 850 CA GLY A 98 13.066 26.354 47.726 1.00 11.01 C ATOM 851 C GLY A 98 13.540 25.551 46.538 1.00 10.79 C ATOM 852 O GLY A 98 12.761 25.082 45.745 1.00 10.44 O ATOM 0 H GLY A 98 11.215 26.052 47.097 1.00 10.83 H new ATOM 0 HA2 GLY A 98 13.318 27.285 47.623 1.00 11.01 H new ATOM 0 HA3 GLY A 98 13.490 26.033 48.537 1.00 11.01 H new ATOM 853 N PHE A 99 14.847 25.405 46.402 1.00 11.47 N ATOM 854 CA PHE A 99 15.359 24.655 45.267 1.00 11.84 C ATOM 855 C PHE A 99 14.977 23.179 45.385 1.00 11.60 C ATOM 856 O PHE A 99 14.782 22.646 46.490 1.00 12.67 O ATOM 857 CB PHE A 99 16.874 24.897 45.060 1.00 14.04 C ATOM 858 CG PHE A 99 17.749 24.224 46.069 1.00 14.63 C ATOM 859 CD1 PHE A 99 18.165 22.911 45.874 1.00 15.35 C ATOM 860 CD2 PHE A 99 18.195 24.907 47.203 1.00 15.91 C ATOM 861 CE1 PHE A 99 18.986 22.280 46.799 1.00 16.13 C ATOM 862 CE2 PHE A 99 19.018 24.273 48.141 1.00 16.44 C ATOM 863 CZ PHE A 99 19.404 22.954 47.938 1.00 16.83 C ATOM 0 H PHE A 99 15.441 25.721 46.938 1.00 11.47 H new ATOM 0 HA PHE A 99 14.938 24.983 44.457 1.00 11.84 H new ATOM 0 HB2 PHE A 99 17.122 24.588 44.175 1.00 14.04 H new ATOM 0 HB3 PHE A 99 17.045 25.852 45.085 1.00 14.04 H new ATOM 0 HD1 PHE A 99 17.890 22.450 45.115 1.00 15.35 H new ATOM 0 HD2 PHE A 99 17.942 25.792 47.336 1.00 15.91 H new ATOM 0 HE1 PHE A 99 19.257 21.402 46.655 1.00 16.13 H new ATOM 0 HE2 PHE A 99 19.305 24.733 48.897 1.00 16.44 H new ATOM 0 HZ PHE A 99 19.941 22.524 48.564 1.00 16.83 H new ATOM 864 N GLY A 100 14.814 22.540 44.231 1.00 10.36 N ATOM 865 CA GLY A 100 14.560 21.095 44.150 1.00 10.68 C ATOM 866 C GLY A 100 15.827 20.327 44.432 1.00 10.68 C ATOM 867 O GLY A 100 16.837 20.547 43.784 1.00 11.69 O ATOM 0 H GLY A 100 14.847 22.931 43.466 1.00 10.36 H new ATOM 0 HA2 GLY A 100 13.873 20.844 44.787 1.00 10.68 H new ATOM 0 HA3 GLY A 100 14.225 20.868 43.268 1.00 10.68 H new ATOM 868 N GLU A 101 15.783 19.431 45.407 1.00 10.49 N ATOM 869 CA GLU A 101 16.942 18.646 45.798 1.00 11.40 C ATOM 870 C GLU A 101 17.019 17.366 45.004 1.00 10.61 C ATOM 871 O GLU A 101 16.010 16.710 44.768 1.00 10.76 O ATOM 872 CB GLU A 101 16.864 18.311 47.283 1.00 13.48 C ATOM 873 CG GLU A 101 16.983 19.562 48.139 1.00 17.80 C ATOM 874 CD GLU A 101 17.055 19.287 49.625 1.00 21.93 C ATOM 875 OE1 GLU A 101 17.387 18.150 50.024 1.00 23.78 O ATOM 876 OE2 GLU A 101 16.782 20.241 50.394 1.00 26.02 O ATOM 0 H GLU A 101 15.074 19.260 45.864 1.00 10.49 H new ATOM 0 HA GLU A 101 17.737 19.173 45.620 1.00 11.40 H new ATOM 0 HB2 GLU A 101 16.023 17.866 47.472 1.00 13.48 H new ATOM 0 HB3 GLU A 101 17.572 17.690 47.514 1.00 13.48 H new ATOM 0 HG2 GLU A 101 17.777 20.051 47.871 1.00 17.80 H new ATOM 0 HG3 GLU A 101 16.222 20.137 47.962 1.00 17.80 H new ATOM 877 N VAL A 102 18.235 16.994 44.626 1.00 10.16 N ATOM 878 CA VAL A 102 18.469 15.720 43.994 1.00 10.42 C ATOM 879 C VAL A 102 18.144 14.584 44.961 1.00 9.96 C ATOM 880 O VAL A 102 18.515 14.622 46.146 1.00 10.12 O ATOM 881 CB VAL A 102 19.950 15.632 43.551 1.00 10.55 C ATOM 882 CG1 VAL A 102 20.319 14.209 43.141 1.00 11.53 C ATOM 883 CG2 VAL A 102 20.215 16.631 42.427 1.00 12.27 C ATOM 0 H VAL A 102 18.940 17.475 44.731 1.00 10.16 H new ATOM 0 HA VAL A 102 17.894 15.638 43.217 1.00 10.42 H new ATOM 0 HB VAL A 102 20.517 15.864 44.303 1.00 10.55 H new ATOM 0 HG11 VAL A 102 21.250 14.182 42.869 1.00 11.53 H new ATOM 0 HG12 VAL A 102 20.185 13.610 43.892 1.00 11.53 H new ATOM 0 HG13 VAL A 102 19.758 13.929 42.401 1.00 11.53 H new ATOM 0 HG21 VAL A 102 21.144 16.572 42.153 1.00 12.27 H new ATOM 0 HG22 VAL A 102 19.642 16.427 41.671 1.00 12.27 H new ATOM 0 HG23 VAL A 102 20.028 17.529 42.741 1.00 12.27 H new ATOM 884 N GLY A 103 17.458 13.559 44.460 1.00 9.99 N ATOM 885 CA GLY A 103 17.081 12.408 45.270 1.00 10.22 C ATOM 886 C GLY A 103 15.621 12.344 45.660 1.00 10.16 C ATOM 887 O GLY A 103 15.164 11.357 46.226 1.00 10.94 O ATOM 0 H GLY A 103 17.199 13.513 43.641 1.00 9.99 H new ATOM 0 HA2 GLY A 103 17.306 11.600 44.783 1.00 10.22 H new ATOM 0 HA3 GLY A 103 17.617 12.410 46.078 1.00 10.22 H new ATOM 888 N TYR A 104 14.897 13.420 45.355 1.00 9.79 N ATOM 889 CA TYR A 104 13.449 13.509 45.585 1.00 9.88 C ATOM 890 C TYR A 104 12.772 13.874 44.289 1.00 9.57 C ATOM 891 O TYR A 104 13.352 14.594 43.482 1.00 9.40 O ATOM 892 CB TYR A 104 13.104 14.583 46.634 1.00 10.84 C ATOM 893 CG TYR A 104 13.679 14.295 48.004 1.00 11.63 C ATOM 894 CD1 TYR A 104 13.014 13.458 48.900 1.00 13.08 C ATOM 895 CD2 TYR A 104 14.908 14.821 48.388 1.00 11.86 C ATOM 896 CE1 TYR A 104 13.562 13.170 50.163 1.00 14.32 C ATOM 897 CE2 TYR A 104 15.445 14.555 49.646 1.00 13.10 C ATOM 898 CZ TYR A 104 14.773 13.733 50.508 1.00 13.96 C ATOM 899 OH TYR A 104 15.327 13.455 51.758 1.00 16.56 O ATOM 0 H TYR A 104 15.234 14.129 45.004 1.00 9.79 H new ATOM 0 HA TYR A 104 13.143 12.649 45.913 1.00 9.88 H new ATOM 0 HB2 TYR A 104 13.433 15.442 46.327 1.00 10.84 H new ATOM 0 HB3 TYR A 104 12.139 14.658 46.705 1.00 10.84 H new ATOM 0 HD1 TYR A 104 12.197 13.085 48.659 1.00 13.08 H new ATOM 0 HD2 TYR A 104 15.380 15.360 47.795 1.00 11.86 H new ATOM 0 HE1 TYR A 104 13.115 12.609 50.756 1.00 14.32 H new ATOM 0 HE2 TYR A 104 16.256 14.934 49.898 1.00 13.10 H new ATOM 0 HH TYR A 104 16.106 13.766 51.795 1.00 16.56 H new ATOM 900 N SER A 105 11.523 13.434 44.129 1.00 9.11 N ATOM 901 CA SER A 105 10.720 13.811 42.948 1.00 9.20 C ATOM 902 C SER A 105 10.227 15.255 43.113 1.00 9.20 C ATOM 903 O SER A 105 10.416 15.862 44.156 1.00 8.96 O ATOM 904 CB SER A 105 9.526 12.872 42.812 1.00 9.79 C ATOM 905 OG SER A 105 8.521 13.250 43.757 1.00 10.05 O ATOM 0 H SER A 105 11.118 12.919 44.686 1.00 9.11 H new ATOM 0 HA SER A 105 11.267 13.743 42.150 1.00 9.20 H new ATOM 0 HB2 SER A 105 9.170 12.913 41.911 1.00 9.79 H new ATOM 0 HB3 SER A 105 9.802 11.955 42.967 1.00 9.79 H new ATOM 0 HG SER A 105 7.861 12.736 43.685 1.00 10.05 H new ATOM 906 N PRO A 106 9.602 15.830 42.076 1.00 9.13 N ATOM 907 CA PRO A 106 9.171 17.211 42.249 1.00 9.48 C ATOM 908 C PRO A 106 8.115 17.360 43.343 1.00 9.18 C ATOM 909 O PRO A 106 8.240 18.270 44.157 1.00 9.38 O ATOM 910 CB PRO A 106 8.631 17.583 40.857 1.00 9.95 C ATOM 911 CG PRO A 106 9.482 16.736 39.929 1.00 10.29 C ATOM 912 CD PRO A 106 9.607 15.424 40.653 1.00 9.85 C ATOM 0 HA PRO A 106 9.887 17.795 42.544 1.00 9.48 H new ATOM 0 HB2 PRO A 106 7.687 17.376 40.770 1.00 9.95 H new ATOM 0 HB3 PRO A 106 8.731 18.530 40.673 1.00 9.95 H new ATOM 0 HG2 PRO A 106 9.061 16.625 39.062 1.00 10.29 H new ATOM 0 HG3 PRO A 106 10.350 17.141 39.773 1.00 10.29 H new ATOM 0 HD2 PRO A 106 8.870 14.828 40.447 1.00 9.85 H new ATOM 0 HD3 PRO A 106 10.424 14.958 40.415 1.00 9.85 H new ATOM 913 N THR A 107 7.148 16.447 43.402 1.00 9.20 N ATOM 914 CA THR A 107 6.163 16.553 44.480 1.00 9.95 C ATOM 915 C THR A 107 6.788 16.222 45.835 1.00 9.62 C ATOM 916 O THR A 107 6.454 16.846 46.840 1.00 9.56 O ATOM 917 CB THR A 107 4.891 15.724 44.233 1.00 10.79 C ATOM 918 OG1 THR A 107 5.207 14.324 44.231 1.00 12.62 O ATOM 919 CG2 THR A 107 4.195 16.137 42.928 1.00 12.10 C ATOM 0 H THR A 107 7.044 15.789 42.858 1.00 9.20 H new ATOM 0 HA THR A 107 5.878 17.480 44.492 1.00 9.95 H new ATOM 0 HB THR A 107 4.269 15.900 44.956 1.00 10.79 H new ATOM 0 HG1 THR A 107 5.192 14.032 45.018 1.00 12.62 H new ATOM 0 HG21 THR A 107 3.399 15.598 42.801 1.00 12.10 H new ATOM 0 HG22 THR A 107 3.946 17.073 42.976 1.00 12.10 H new ATOM 0 HG23 THR A 107 4.799 16.001 42.182 1.00 12.10 H new ATOM 920 N GLU A 108 7.699 15.246 45.876 1.00 9.61 N ATOM 921 CA GLU A 108 8.365 14.923 47.140 1.00 9.65 C ATOM 922 C GLU A 108 9.161 16.122 47.641 1.00 9.39 C ATOM 923 O GLU A 108 9.188 16.408 48.842 1.00 9.37 O ATOM 924 CB GLU A 108 9.273 13.709 46.994 1.00 10.73 C ATOM 925 CG GLU A 108 8.506 12.409 46.872 1.00 12.17 C ATOM 926 CD GLU A 108 9.326 11.273 46.301 1.00 13.98 C ATOM 927 OE1 GLU A 108 10.531 11.442 45.983 1.00 13.56 O ATOM 928 OE2 GLU A 108 8.725 10.171 46.154 1.00 17.21 O ATOM 0 H GLU A 108 7.941 14.770 45.202 1.00 9.61 H new ATOM 0 HA GLU A 108 7.679 14.706 47.791 1.00 9.65 H new ATOM 0 HB2 GLU A 108 9.834 13.823 46.211 1.00 10.73 H new ATOM 0 HB3 GLU A 108 9.864 13.659 47.761 1.00 10.73 H new ATOM 0 HG2 GLU A 108 8.178 12.152 47.748 1.00 12.17 H new ATOM 0 HG3 GLU A 108 7.729 12.552 46.309 1.00 12.17 H new ATOM 929 N ASN A 109 9.793 16.853 46.730 1.00 8.96 N ATOM 930 CA ASN A 109 10.534 18.048 47.108 1.00 9.21 C ATOM 931 C ASN A 109 9.643 19.100 47.751 1.00 8.91 C ATOM 932 O ASN A 109 9.995 19.634 48.802 1.00 9.31 O ATOM 933 CB ASN A 109 11.255 18.626 45.887 1.00 9.33 C ATOM 934 CG ASN A 109 12.697 18.175 45.797 1.00 9.69 C ATOM 935 OD1 ASN A 109 13.458 18.377 46.724 1.00 10.18 O ATOM 936 ND2 ASN A 109 13.084 17.574 44.665 1.00 9.64 N ATOM 0 H ASN A 109 9.805 16.674 45.889 1.00 8.96 H new ATOM 0 HA ASN A 109 11.189 17.787 47.774 1.00 9.21 H new ATOM 0 HB2 ASN A 109 10.785 18.359 45.081 1.00 9.33 H new ATOM 0 HB3 ASN A 109 11.224 19.595 45.926 1.00 9.33 H new ATOM 0 HD21 ASN A 109 13.899 17.314 44.573 1.00 9.64 H new ATOM 0 HD22 ASN A 109 12.518 17.448 44.030 1.00 9.64 H new ATOM 937 N ILE A 110 8.475 19.378 47.171 1.00 8.77 N ATOM 938 CA ILE A 110 7.638 20.418 47.768 1.00 8.85 C ATOM 939 C ILE A 110 7.066 19.958 49.107 1.00 9.02 C ATOM 940 O ILE A 110 6.986 20.756 50.029 1.00 8.83 O ATOM 941 CB ILE A 110 6.560 21.011 46.814 1.00 8.61 C ATOM 942 CG1 ILE A 110 5.984 22.311 47.402 1.00 8.79 C ATOM 943 CG2 ILE A 110 5.428 20.026 46.521 1.00 8.70 C ATOM 944 CD1 ILE A 110 7.020 23.345 47.817 1.00 9.31 C ATOM 0 H ILE A 110 8.161 18.998 46.467 1.00 8.77 H new ATOM 0 HA ILE A 110 8.227 21.170 47.940 1.00 8.85 H new ATOM 0 HB ILE A 110 7.003 21.200 45.972 1.00 8.61 H new ATOM 0 HG12 ILE A 110 5.392 22.712 46.747 1.00 8.79 H new ATOM 0 HG13 ILE A 110 5.442 22.088 48.175 1.00 8.79 H new ATOM 0 HG21 ILE A 110 4.785 20.440 45.925 1.00 8.70 H new ATOM 0 HG22 ILE A 110 5.791 19.231 46.101 1.00 8.70 H new ATOM 0 HG23 ILE A 110 4.989 19.781 47.351 1.00 8.70 H new ATOM 0 HD11 ILE A 110 6.572 24.127 48.174 1.00 9.31 H new ATOM 0 HD12 ILE A 110 7.601 22.967 48.496 1.00 9.31 H new ATOM 0 HD13 ILE A 110 7.549 23.601 47.045 1.00 9.31 H new ATOM 945 N LEU A 111 6.705 18.682 49.227 1.00 9.45 N ATOM 946 CA LEU A 111 6.189 18.196 50.507 1.00 10.44 C ATOM 947 C LEU A 111 7.250 18.262 51.599 1.00 10.84 C ATOM 948 O LEU A 111 6.937 18.622 52.749 1.00 11.52 O ATOM 949 CB LEU A 111 5.642 16.776 50.376 1.00 11.27 C ATOM 950 CG LEU A 111 4.406 16.723 49.477 1.00 12.39 C ATOM 951 CD1 LEU A 111 3.949 15.282 49.279 1.00 13.91 C ATOM 952 CD2 LEU A 111 3.272 17.588 50.028 1.00 13.46 C ATOM 0 H LEU A 111 6.748 18.095 48.600 1.00 9.45 H new ATOM 0 HA LEU A 111 5.460 18.781 50.765 1.00 10.44 H new ATOM 0 HB2 LEU A 111 6.330 16.197 50.014 1.00 11.27 H new ATOM 0 HB3 LEU A 111 5.417 16.434 51.255 1.00 11.27 H new ATOM 0 HG LEU A 111 4.652 17.087 48.612 1.00 12.39 H new ATOM 0 HD11 LEU A 111 3.165 15.266 48.707 1.00 13.91 H new ATOM 0 HD12 LEU A 111 4.661 14.770 48.864 1.00 13.91 H new ATOM 0 HD13 LEU A 111 3.729 14.891 50.139 1.00 13.91 H new ATOM 0 HD21 LEU A 111 2.505 17.532 49.436 1.00 13.46 H new ATOM 0 HD22 LEU A 111 3.022 17.271 50.910 1.00 13.46 H new ATOM 0 HD23 LEU A 111 3.568 18.510 50.088 1.00 13.46 H new ATOM 953 N LYS A 112 8.485 17.913 51.262 1.00 10.94 N ATOM 954 CA LYS A 112 9.594 17.975 52.208 1.00 12.04 C ATOM 955 C LYS A 112 9.789 19.415 52.682 1.00 11.65 C ATOM 956 O LYS A 112 9.878 19.679 53.896 1.00 11.86 O ATOM 957 CB LYS A 112 10.874 17.417 51.566 1.00 13.12 C ATOM 958 CG LYS A 112 12.122 17.518 52.436 1.00 14.73 C ATOM 959 CD LYS A 112 13.303 16.858 51.732 1.00 16.18 C ATOM 960 CE LYS A 112 14.543 16.797 52.609 1.00 17.92 C ATOM 961 NZ LYS A 112 15.193 18.124 52.667 1.00 20.16 N ATOM 0 H LYS A 112 8.705 17.633 50.479 1.00 10.94 H new ATOM 0 HA LYS A 112 9.389 17.426 52.981 1.00 12.04 H new ATOM 0 HB2 LYS A 112 10.727 16.485 51.340 1.00 13.12 H new ATOM 0 HB3 LYS A 112 11.036 17.889 50.734 1.00 13.12 H new ATOM 0 HG2 LYS A 112 12.324 18.449 52.619 1.00 14.73 H new ATOM 0 HG3 LYS A 112 11.965 17.089 53.292 1.00 14.73 H new ATOM 0 HD2 LYS A 112 13.055 15.959 51.464 1.00 16.18 H new ATOM 0 HD3 LYS A 112 13.508 17.349 50.921 1.00 16.18 H new ATOM 0 HE2 LYS A 112 14.301 16.508 53.503 1.00 17.92 H new ATOM 0 HE3 LYS A 112 15.164 16.140 52.257 1.00 17.92 H new ATOM 0 HZ1 LYS A 112 16.074 18.027 52.590 1.00 20.16 H new ATOM 0 HZ2 LYS A 112 14.892 18.632 52.001 1.00 20.16 H new ATOM 0 HZ3 LYS A 112 15.005 18.513 53.445 1.00 20.16 H new ATOM 962 N GLU A 113 9.801 20.359 51.750 1.00 11.53 N ATOM 963 CA GLU A 113 10.024 21.757 52.097 1.00 12.06 C ATOM 964 C GLU A 113 8.857 22.343 52.873 1.00 11.16 C ATOM 965 O GLU A 113 9.078 23.077 53.839 1.00 10.72 O ATOM 966 CB GLU A 113 10.430 22.570 50.872 1.00 13.93 C ATOM 967 CG GLU A 113 11.725 21.970 50.346 1.00 15.89 C ATOM 968 CD GLU A 113 12.247 22.565 49.070 1.00 17.66 C ATOM 969 OE1 GLU A 113 11.712 23.582 48.619 1.00 18.96 O ATOM 970 OE2 GLU A 113 13.216 21.999 48.521 1.00 19.42 O ATOM 0 H GLU A 113 9.682 20.212 50.911 1.00 11.53 H new ATOM 0 HA GLU A 113 10.777 21.803 52.707 1.00 12.06 H new ATOM 0 HB2 GLU A 113 9.737 22.538 50.194 1.00 13.93 H new ATOM 0 HB3 GLU A 113 10.555 23.503 51.106 1.00 13.93 H new ATOM 0 HG2 GLU A 113 12.407 22.063 51.030 1.00 15.89 H new ATOM 0 HG3 GLU A 113 11.589 21.019 50.209 1.00 15.89 H new ATOM 971 N ILE A 114 7.626 21.981 52.524 1.00 10.95 N ATOM 972 CA ILE A 114 6.475 22.398 53.344 1.00 11.31 C ATOM 973 C ILE A 114 6.648 21.916 54.797 1.00 11.98 C ATOM 974 O ILE A 114 6.465 22.690 55.747 1.00 12.10 O ATOM 975 CB ILE A 114 5.157 21.868 52.789 1.00 10.53 C ATOM 976 CG1 ILE A 114 4.799 22.559 51.465 1.00 10.57 C ATOM 977 CG2 ILE A 114 4.025 22.084 53.813 1.00 10.54 C ATOM 978 CD1 ILE A 114 3.720 21.809 50.710 1.00 11.03 C ATOM 0 H ILE A 114 7.431 21.506 51.834 1.00 10.95 H new ATOM 0 HA ILE A 114 6.445 23.367 53.321 1.00 11.31 H new ATOM 0 HB ILE A 114 5.262 20.918 52.621 1.00 10.53 H new ATOM 0 HG12 ILE A 114 4.499 23.464 51.644 1.00 10.57 H new ATOM 0 HG13 ILE A 114 5.593 22.628 50.911 1.00 10.57 H new ATOM 0 HG21 ILE A 114 3.192 21.744 53.451 1.00 10.54 H new ATOM 0 HG22 ILE A 114 4.237 21.613 54.634 1.00 10.54 H new ATOM 0 HG23 ILE A 114 3.933 23.032 53.999 1.00 10.54 H new ATOM 0 HD11 ILE A 114 3.521 22.274 49.882 1.00 11.03 H new ATOM 0 HD12 ILE A 114 4.029 20.911 50.510 1.00 11.03 H new ATOM 0 HD13 ILE A 114 2.918 21.761 51.254 1.00 11.03 H new ATOM 979 N GLU A 115 7.018 20.656 54.990 1.00 12.34 N ATOM 980 CA GLU A 115 7.114 20.144 56.365 1.00 13.59 C ATOM 981 C GLU A 115 8.238 20.841 57.125 1.00 13.73 C ATOM 982 O GLU A 115 8.062 21.236 58.287 1.00 13.70 O ATOM 983 CB GLU A 115 7.305 18.625 56.395 1.00 15.85 C ATOM 984 CG GLU A 115 7.166 18.037 57.804 1.00 18.98 C ATOM 985 CD GLU A 115 7.075 16.521 57.822 1.00 22.06 C ATOM 986 OE1 GLU A 115 7.132 15.897 56.754 1.00 24.55 O ATOM 987 OE2 GLU A 115 6.961 15.938 58.920 1.00 25.93 O ATOM 0 H GLU A 115 7.213 20.094 54.369 1.00 12.34 H new ATOM 0 HA GLU A 115 6.273 20.341 56.806 1.00 13.59 H new ATOM 0 HB2 GLU A 115 6.653 18.209 55.810 1.00 15.85 H new ATOM 0 HB3 GLU A 115 8.182 18.406 56.043 1.00 15.85 H new ATOM 0 HG2 GLU A 115 7.926 18.315 58.339 1.00 18.98 H new ATOM 0 HG3 GLU A 115 6.374 18.406 58.224 1.00 18.98 H new ATOM 988 N GLU A 116 9.389 21.001 56.483 1.00 13.33 N ATOM 989 CA GLU A 116 10.557 21.604 57.118 1.00 14.69 C ATOM 990 C GLU A 116 10.331 23.057 57.488 1.00 14.22 C ATOM 991 O GLU A 116 10.781 23.513 58.543 1.00 15.32 O ATOM 992 CB GLU A 116 11.793 21.471 56.216 1.00 15.72 C ATOM 993 CG GLU A 116 12.293 20.042 56.088 1.00 18.46 C ATOM 994 CD GLU A 116 13.399 19.864 55.059 1.00 20.21 C ATOM 995 OE1 GLU A 116 13.597 20.734 54.188 1.00 23.39 O ATOM 996 OE2 GLU A 116 14.074 18.823 55.132 1.00 22.62 O ATOM 0 H GLU A 116 9.516 20.763 55.666 1.00 13.33 H new ATOM 0 HA GLU A 116 10.710 21.118 57.943 1.00 14.69 H new ATOM 0 HB2 GLU A 116 11.580 21.813 55.334 1.00 15.72 H new ATOM 0 HB3 GLU A 116 12.505 22.026 56.570 1.00 15.72 H new ATOM 0 HG2 GLU A 116 12.617 19.744 56.952 1.00 18.46 H new ATOM 0 HG3 GLU A 116 11.548 19.468 55.851 1.00 18.46 H new ATOM 997 N GLU A 117 9.617 23.785 56.641 1.00 13.61 N ATOM 998 CA GLU A 117 9.417 25.212 56.820 1.00 13.16 C ATOM 999 C GLU A 117 8.174 25.526 57.651 1.00 13.43 C ATOM 1000 O GLU A 117 8.227 26.391 58.534 1.00 14.59 O ATOM 1001 CB GLU A 117 9.305 25.894 55.450 1.00 12.51 C ATOM 1002 CG GLU A 117 10.630 25.917 54.708 1.00 12.89 C ATOM 1003 CD GLU A 117 10.511 26.328 53.264 1.00 13.70 C ATOM 1004 OE1 GLU A 117 9.522 26.980 52.873 1.00 12.47 O ATOM 1005 OE2 GLU A 117 11.460 25.973 52.515 1.00 16.18 O ATOM 0 H GLU A 117 9.233 23.462 55.943 1.00 13.61 H new ATOM 0 HA GLU A 117 10.185 25.553 57.304 1.00 13.16 H new ATOM 0 HB2 GLU A 117 8.644 25.430 54.913 1.00 12.51 H new ATOM 0 HB3 GLU A 117 8.987 26.803 55.568 1.00 12.51 H new ATOM 0 HG2 GLU A 117 11.234 26.527 55.160 1.00 12.89 H new ATOM 0 HG3 GLU A 117 11.031 25.035 54.753 1.00 12.89 H new ATOM 1006 N THR A 118 7.062 24.851 57.370 1.00 13.65 N ATOM 1007 CA THR A 118 5.789 25.220 58.001 1.00 14.16 C ATOM 1008 C THR A 118 5.440 24.376 59.221 1.00 14.57 C ATOM 1009 O THR A 118 4.593 24.796 60.027 1.00 14.90 O ATOM 1010 CB THR A 118 4.597 25.125 57.047 1.00 14.11 C ATOM 1011 OG1 THR A 118 4.289 23.752 56.810 1.00 14.24 O ATOM 1012 CG2 THR A 118 4.867 25.835 55.708 1.00 13.82 C ATOM 0 H THR A 118 7.019 24.186 56.826 1.00 13.65 H new ATOM 0 HA THR A 118 5.939 26.140 58.269 1.00 14.16 H new ATOM 0 HB THR A 118 3.845 25.572 57.467 1.00 14.11 H new ATOM 0 HG1 THR A 118 4.923 23.390 56.395 1.00 14.24 H new ATOM 0 HG21 THR A 118 4.089 25.751 55.135 1.00 13.82 H new ATOM 0 HG22 THR A 118 5.049 26.774 55.870 1.00 13.82 H new ATOM 0 HG23 THR A 118 5.633 25.428 55.274 1.00 13.82 H new ATOM 1013 N GLY A 119 6.039 23.194 59.338 1.00 14.86 N ATOM 1014 CA GLY A 119 5.745 22.267 60.432 1.00 16.29 C ATOM 1015 C GLY A 119 4.583 21.342 60.122 1.00 17.35 C ATOM 1016 O GLY A 119 4.147 20.583 60.997 1.00 19.00 O ATOM 0 H GLY A 119 6.630 22.905 58.784 1.00 14.86 H new ATOM 0 HA2 GLY A 119 6.534 21.736 60.621 1.00 16.29 H new ATOM 0 HA3 GLY A 119 5.545 22.773 61.235 1.00 16.29 H new ATOM 1017 N PHE A 120 4.068 21.402 58.895 1.00 17.29 N ATOM 1018 CA PHE A 120 2.901 20.605 58.516 1.00 18.05 C ATOM 1019 C PHE A 120 3.158 19.542 57.460 1.00 18.14 C ATOM 1020 O PHE A 120 3.913 19.760 56.500 1.00 16.91 O ATOM 1021 CB PHE A 120 1.794 21.510 58.005 1.00 19.08 C ATOM 1022 CG PHE A 120 1.120 22.304 59.085 1.00 20.58 C ATOM 1023 CD1 PHE A 120 1.654 23.509 59.513 1.00 21.39 C ATOM 1024 CD2 PHE A 120 -0.053 21.841 59.670 1.00 21.47 C ATOM 1025 CE1 PHE A 120 1.039 24.242 60.515 1.00 22.75 C ATOM 1026 CE2 PHE A 120 -0.679 22.574 60.676 1.00 22.02 C ATOM 1027 CZ PHE A 120 -0.131 23.775 61.091 1.00 22.77 C ATOM 0 H PHE A 120 4.380 21.899 58.266 1.00 17.29 H new ATOM 0 HA PHE A 120 2.651 20.140 59.330 1.00 18.05 H new ATOM 0 HB2 PHE A 120 2.163 22.121 57.348 1.00 19.08 H new ATOM 0 HB3 PHE A 120 1.130 20.970 57.549 1.00 19.08 H new ATOM 0 HD1 PHE A 120 2.435 23.830 59.123 1.00 21.39 H new ATOM 0 HD2 PHE A 120 -0.423 21.036 59.388 1.00 21.47 H new ATOM 0 HE1 PHE A 120 1.411 25.045 60.800 1.00 22.75 H new ATOM 0 HE2 PHE A 120 -1.461 22.258 61.067 1.00 22.02 H new ATOM 0 HZ PHE A 120 -0.549 24.270 61.758 1.00 22.77 H new ATOM 1028 N LYS A 121 2.522 18.390 57.644 1.00 18.09 N ATOM 1029 CA LYS A 121 2.360 17.418 56.565 1.00 18.05 C ATOM 1030 C LYS A 121 1.408 18.053 55.567 1.00 17.05 C ATOM 1031 O LYS A 121 0.655 18.966 55.918 1.00 16.94 O ATOM 1032 CB LYS A 121 1.749 16.122 57.093 1.00 20.72 C ATOM 1033 CG LYS A 121 2.504 15.486 58.252 1.00 24.03 C ATOM 1034 CD LYS A 121 3.734 14.724 57.801 1.00 26.52 C ATOM 1035 CE LYS A 121 4.024 13.606 58.788 1.00 28.07 C ATOM 1036 NZ LYS A 121 5.400 13.069 58.622 1.00 30.86 N ATOM 0 H LYS A 121 2.174 18.149 58.393 1.00 18.09 H new ATOM 0 HA LYS A 121 3.216 17.199 56.166 1.00 18.05 H new ATOM 0 HB2 LYS A 121 0.838 16.300 57.376 1.00 20.72 H new ATOM 0 HB3 LYS A 121 1.700 15.482 56.365 1.00 20.72 H new ATOM 0 HG2 LYS A 121 2.768 16.177 58.879 1.00 24.03 H new ATOM 0 HG3 LYS A 121 1.911 14.883 58.727 1.00 24.03 H new ATOM 0 HD2 LYS A 121 3.593 14.358 56.914 1.00 26.52 H new ATOM 0 HD3 LYS A 121 4.495 15.323 57.743 1.00 26.52 H new ATOM 0 HE2 LYS A 121 3.912 13.936 59.693 1.00 28.07 H new ATOM 0 HE3 LYS A 121 3.380 12.891 58.665 1.00 28.07 H new ATOM 0 HZ1 LYS A 121 5.574 12.490 59.276 1.00 30.86 H new ATOM 0 HZ2 LYS A 121 5.465 12.657 57.836 1.00 30.86 H new ATOM 0 HZ3 LYS A 121 5.986 13.738 58.655 1.00 30.86 H new ATOM 1037 N ALA A 122 1.449 17.602 54.318 1.00 15.85 N ATOM 1038 CA ALA A 122 0.613 18.201 53.290 1.00 15.05 C ATOM 1039 C ALA A 122 0.296 17.215 52.181 1.00 14.53 C ATOM 1040 O ALA A 122 0.847 16.120 52.142 1.00 14.68 O ATOM 1041 CB ALA A 122 1.306 19.432 52.695 1.00 15.10 C ATOM 0 H ALA A 122 1.949 16.956 54.049 1.00 15.85 H new ATOM 0 HA ALA A 122 -0.221 18.465 53.710 1.00 15.05 H new ATOM 0 HB1 ALA A 122 0.740 19.823 52.011 1.00 15.10 H new ATOM 0 HB2 ALA A 122 1.464 20.084 53.395 1.00 15.10 H new ATOM 0 HB3 ALA A 122 2.153 19.168 52.302 1.00 15.10 H new ATOM 1042 N ALYS A 123 -0.600 17.630 51.290 0.50 14.34 N ATOM 1043 N BLYS A 123 -0.566 17.640 51.264 0.50 14.44 N ATOM 1044 CA ALYS A 123 -0.999 16.894 50.104 0.50 14.55 C ATOM 1045 CA BLYS A 123 -0.937 16.867 50.096 0.50 14.74 C ATOM 1046 C ALYS A 123 -0.761 17.837 48.926 0.50 13.54 C ATOM 1047 C BLYS A 123 -0.905 17.770 48.863 0.50 13.85 C ATOM 1048 O ALYS A 123 -1.050 19.027 49.040 0.50 12.95 O ATOM 1049 O BLYS A 123 -1.493 18.853 48.856 0.50 13.51 O ATOM 1050 CB ALYS A 123 -2.491 16.550 50.199 0.50 15.64 C ATOM 1051 CB BLYS A 123 -2.336 16.292 50.287 0.50 15.98 C ATOM 1052 CG ALYS A 123 -3.142 16.097 48.905 0.50 16.69 C ATOM 1053 CG BLYS A 123 -2.893 15.548 49.095 0.50 16.64 C ATOM 1054 CD ALYS A 123 -4.638 15.882 49.086 0.50 17.42 C ATOM 1055 CD BLYS A 123 -4.344 15.196 49.366 0.50 17.36 C ATOM 1056 CE ALYS A 123 -5.352 15.846 47.743 0.50 18.65 C ATOM 1057 CE BLYS A 123 -5.098 14.923 48.083 0.50 17.46 C ATOM 1058 NZ ALYS A 123 -4.721 14.902 46.781 0.50 19.63 N ATOM 1059 NZ BLYS A 123 -6.564 14.853 48.347 0.50 18.52 N ATOM 0 H ALYS A 123 -1.008 18.383 51.368 0.50 14.44 H new ATOM 0 H BLYS A 123 -0.958 18.404 51.309 0.50 14.44 H new ATOM 0 HA ALYS A 123 -0.501 16.067 50.005 0.50 14.74 H new ATOM 0 HA BLYS A 123 -0.311 16.137 49.974 0.50 14.74 H new ATOM 0 HB2ALYS A 123 -2.604 15.851 50.861 0.50 15.98 H new ATOM 0 HB2BLYS A 123 -2.322 15.691 51.048 0.50 15.98 H new ATOM 0 HB3ALYS A 123 -2.966 17.330 50.526 0.50 15.98 H new ATOM 0 HB3BLYS A 123 -2.941 17.017 50.509 0.50 15.98 H new ATOM 0 HG2ALYS A 123 -2.989 16.760 48.214 0.50 16.64 H new ATOM 0 HG2BLYS A 123 -2.824 16.095 48.297 0.50 16.64 H new ATOM 0 HG3ALYS A 123 -2.729 15.273 48.603 0.50 16.64 H new ATOM 0 HG3BLYS A 123 -2.378 14.743 48.932 0.50 16.64 H new ATOM 0 HD2ALYS A 123 -4.793 15.050 49.561 0.50 17.36 H new ATOM 0 HD2BLYS A 123 -4.387 14.415 49.940 0.50 17.36 H new ATOM 0 HD3ALYS A 123 -5.006 16.594 49.633 0.50 17.36 H new ATOM 0 HD3BLYS A 123 -4.771 15.924 49.845 0.50 17.36 H new ATOM 0 HE2ALYS A 123 -6.278 15.591 47.880 0.50 17.46 H new ATOM 0 HE2BLYS A 123 -4.913 15.622 47.437 0.50 17.46 H new ATOM 0 HE3ALYS A 123 -5.357 16.737 47.360 0.50 17.46 H new ATOM 0 HE3BLYS A 123 -4.793 14.089 47.693 0.50 17.46 H new ATOM 0 HZ1ALYS A 123 -4.242 15.360 46.187 0.50 18.52 H new ATOM 0 HZ1BLYS A 123 -6.940 14.277 47.782 0.50 18.52 H new ATOM 0 HZ2ALYS A 123 -4.189 14.340 47.221 0.50 18.52 H new ATOM 0 HZ2BLYS A 123 -6.703 14.582 49.183 0.50 18.52 H new ATOM 0 HZ3ALYS A 123 -5.354 14.441 46.359 0.50 18.52 H new ATOM 0 HZ3BLYS A 123 -6.925 15.658 48.233 0.50 18.52 H new ATOM 1060 N VAL A 124 -0.218 17.312 47.826 1.00 13.34 N ATOM 1061 CA VAL A 124 -0.182 18.041 46.549 1.00 12.81 C ATOM 1062 C VAL A 124 -1.473 17.756 45.809 1.00 12.90 C ATOM 1063 O VAL A 124 -1.795 16.602 45.522 1.00 13.31 O ATOM 1064 CB VAL A 124 1.022 17.641 45.665 1.00 12.78 C ATOM 1065 CG1 VAL A 124 0.915 18.292 44.284 1.00 13.00 C ATOM 1066 CG2 VAL A 124 2.322 17.998 46.373 1.00 12.69 C ATOM 0 H AVAL A 124 0.138 16.530 47.796 0.50 13.34 H new ATOM 0 H BVAL A 124 0.236 16.582 47.833 0.50 13.34 H new ATOM 0 HA VAL A 124 -0.084 18.987 46.742 1.00 12.81 H new ATOM 0 HB VAL A 124 1.017 16.681 45.525 1.00 12.78 H new ATOM 0 HG11 VAL A 124 1.677 18.031 43.743 1.00 13.00 H new ATOM 0 HG12 VAL A 124 0.097 18.001 43.851 1.00 13.00 H new ATOM 0 HG13 VAL A 124 0.903 19.257 44.381 1.00 13.00 H new ATOM 0 HG21 VAL A 124 3.074 17.745 45.815 1.00 12.69 H new ATOM 0 HG22 VAL A 124 2.349 18.953 46.538 1.00 12.69 H new ATOM 0 HG23 VAL A 124 2.372 17.523 47.217 1.00 12.69 H new ATOM 1067 N GLU A 125 -2.198 18.823 45.488 1.00 12.76 N ATOM 1068 CA GLU A 125 -3.460 18.715 44.768 1.00 13.64 C ATOM 1069 C GLU A 125 -3.318 18.876 43.253 1.00 13.38 C ATOM 1070 O GLU A 125 -3.975 18.167 42.499 1.00 14.50 O ATOM 1071 CB GLU A 125 -4.477 19.718 45.327 1.00 15.17 C ATOM 1072 CG GLU A 125 -4.768 19.496 46.810 1.00 17.25 C ATOM 1073 CD GLU A 125 -5.690 20.546 47.419 1.00 19.89 C ATOM 1074 OE1 GLU A 125 -5.386 21.757 47.326 1.00 21.83 O ATOM 1075 OE2 GLU A 125 -6.712 20.153 48.043 1.00 21.95 O ATOM 0 H GLU A 125 -1.971 19.630 45.682 1.00 12.76 H new ATOM 0 HA GLU A 125 -3.781 17.811 44.911 1.00 13.64 H new ATOM 0 HB2 GLU A 125 -4.142 20.619 45.198 1.00 15.17 H new ATOM 0 HB3 GLU A 125 -5.304 19.649 44.825 1.00 15.17 H new ATOM 0 HG2 GLU A 125 -5.169 18.620 46.925 1.00 17.25 H new ATOM 0 HG3 GLU A 125 -3.930 19.491 47.298 1.00 17.25 H new ATOM 1076 N ARG A 126 -2.480 19.815 42.807 1.00 12.66 N ATOM 1077 CA ARG A 126 -2.278 20.027 41.367 1.00 12.31 C ATOM 1078 C ARG A 126 -1.081 20.932 41.160 1.00 11.17 C ATOM 1079 O ARG A 126 -0.606 21.574 42.094 1.00 11.37 O ATOM 1080 CB ARG A 126 -3.532 20.628 40.703 1.00 13.85 C ATOM 1081 CG ARG A 126 -3.877 22.023 41.203 1.00 15.34 C ATOM 1082 CD ARG A 126 -5.142 22.590 40.559 1.00 17.63 C ATOM 1083 NE ARG A 126 -4.917 22.980 39.167 1.00 19.64 N ATOM 1084 CZ ARG A 126 -5.521 24.005 38.561 1.00 20.16 C ATOM 1085 NH1 ARG A 126 -6.365 24.783 39.229 1.00 20.78 N ATOM 1086 NH2 ARG A 126 -5.253 24.260 37.292 1.00 21.08 N ATOM 0 H ARG A 126 -2.022 20.336 43.315 1.00 12.66 H new ATOM 0 HA ARG A 126 -2.114 19.168 40.947 1.00 12.31 H new ATOM 0 HB2 ARG A 126 -3.396 20.661 39.743 1.00 13.85 H new ATOM 0 HB3 ARG A 126 -4.287 20.040 40.862 1.00 13.85 H new ATOM 0 HG2 ARG A 126 -3.994 21.997 42.166 1.00 15.34 H new ATOM 0 HG3 ARG A 126 -3.133 22.619 41.023 1.00 15.34 H new ATOM 0 HD2 ARG A 126 -5.850 21.928 40.599 1.00 17.63 H new ATOM 0 HD3 ARG A 126 -5.445 23.360 41.065 1.00 17.63 H new ATOM 0 HE ARG A 126 -4.357 22.517 38.707 1.00 19.64 H new ATOM 0 HH11 ARG A 126 -6.527 24.629 40.059 1.00 20.78 H new ATOM 0 HH12 ARG A 126 -6.750 25.441 38.831 1.00 20.78 H new ATOM 0 HH21 ARG A 126 -4.693 23.767 36.863 1.00 21.08 H new ATOM 0 HH22 ARG A 126 -5.638 24.919 36.895 1.00 21.08 H new ATOM 1087 N LEU A 127 -0.598 20.973 39.927 1.00 9.97 N ATOM 1088 CA LEU A 127 0.410 21.946 39.532 1.00 9.62 C ATOM 1089 C LEU A 127 -0.324 23.160 38.965 1.00 9.08 C ATOM 1090 O LEU A 127 -1.115 23.016 38.017 1.00 10.13 O ATOM 1091 CB LEU A 127 1.353 21.339 38.490 1.00 9.61 C ATOM 1092 CG LEU A 127 2.438 22.240 37.888 1.00 9.55 C ATOM 1093 CD1 LEU A 127 3.395 22.717 38.964 1.00 10.12 C ATOM 1094 CD2 LEU A 127 3.179 21.455 36.815 1.00 10.26 C ATOM 0 H LEU A 127 -0.843 20.441 39.298 1.00 9.97 H new ATOM 0 HA LEU A 127 0.952 22.209 40.292 1.00 9.62 H new ATOM 0 HB2 LEU A 127 1.793 20.576 38.896 1.00 9.61 H new ATOM 0 HB3 LEU A 127 0.811 20.999 37.761 1.00 9.61 H new ATOM 0 HG LEU A 127 2.029 23.026 37.493 1.00 9.55 H new ATOM 0 HD11 LEU A 127 4.073 23.285 38.566 1.00 10.12 H new ATOM 0 HD12 LEU A 127 2.905 23.220 39.633 1.00 10.12 H new ATOM 0 HD13 LEU A 127 3.819 21.952 39.382 1.00 10.12 H new ATOM 0 HD21 LEU A 127 3.870 22.013 36.424 1.00 10.26 H new ATOM 0 HD22 LEU A 127 3.585 20.668 37.212 1.00 10.26 H new ATOM 0 HD23 LEU A 127 2.555 21.183 36.124 1.00 10.26 H new ATOM 1095 N LEU A 128 -0.096 24.345 39.540 1.00 8.61 N ATOM 1096 CA LEU A 128 -0.773 25.563 39.078 1.00 8.77 C ATOM 1097 C LEU A 128 0.003 26.290 37.986 1.00 8.45 C ATOM 1098 O LEU A 128 -0.595 26.910 37.101 1.00 8.73 O ATOM 1099 CB LEU A 128 -1.050 26.524 40.234 1.00 9.50 C ATOM 1100 CG LEU A 128 -1.940 25.969 41.351 1.00 10.15 C ATOM 1101 CD1 LEU A 128 -1.847 26.905 42.534 1.00 10.37 C ATOM 1102 CD2 LEU A 128 -3.390 25.827 40.917 1.00 11.17 C ATOM 0 H LEU A 128 0.445 24.465 40.197 1.00 8.61 H new ATOM 0 HA LEU A 128 -1.616 25.268 38.699 1.00 8.77 H new ATOM 0 HB2 LEU A 128 -0.202 26.794 40.621 1.00 9.50 H new ATOM 0 HB3 LEU A 128 -1.466 27.324 39.877 1.00 9.50 H new ATOM 0 HG LEU A 128 -1.628 25.080 41.583 1.00 10.15 H new ATOM 0 HD11 LEU A 128 -2.404 26.572 43.255 1.00 10.37 H new ATOM 0 HD12 LEU A 128 -0.926 26.956 42.835 1.00 10.37 H new ATOM 0 HD13 LEU A 128 -2.151 27.788 42.273 1.00 10.37 H new ATOM 0 HD21 LEU A 128 -3.915 25.474 41.652 1.00 11.17 H new ATOM 0 HD22 LEU A 128 -3.738 26.695 40.660 1.00 11.17 H new ATOM 0 HD23 LEU A 128 -3.444 25.221 40.161 1.00 11.17 H new ATOM 1103 N ALA A 129 1.339 26.269 38.067 1.00 7.97 N ATOM 1104 CA ALA A 129 2.156 27.057 37.151 1.00 7.93 C ATOM 1105 C ALA A 129 3.534 26.495 37.079 1.00 7.48 C ATOM 1106 O ALA A 129 4.050 25.948 38.069 1.00 7.65 O ATOM 1107 CB ALA A 129 2.253 28.505 37.618 1.00 8.39 C ATOM 0 H ALA A 129 1.783 25.808 38.641 1.00 7.97 H new ATOM 0 HA ALA A 129 1.734 27.025 36.278 1.00 7.93 H new ATOM 0 HB1 ALA A 129 2.800 29.010 36.996 1.00 8.39 H new ATOM 0 HB2 ALA A 129 1.365 28.893 37.656 1.00 8.39 H new ATOM 0 HB3 ALA A 129 2.656 28.535 38.500 1.00 8.39 H new ATOM 1108 N VAL A 130 4.164 26.699 35.917 1.00 7.40 N ATOM 1109 CA VAL A 130 5.628 26.591 35.823 1.00 7.89 C ATOM 1110 C VAL A 130 6.117 27.928 35.269 1.00 7.75 C ATOM 1111 O VAL A 130 5.892 28.239 34.097 1.00 8.06 O ATOM 1112 CB VAL A 130 6.106 25.426 34.924 1.00 8.21 C ATOM 1113 CG1 VAL A 130 7.628 25.335 34.967 1.00 9.04 C ATOM 1114 CG2 VAL A 130 5.505 24.106 35.380 1.00 8.74 C ATOM 0 H VAL A 130 3.769 26.898 35.179 1.00 7.40 H new ATOM 0 HA VAL A 130 5.993 26.396 36.700 1.00 7.89 H new ATOM 0 HB VAL A 130 5.813 25.601 34.016 1.00 8.21 H new ATOM 0 HG11 VAL A 130 7.925 24.604 34.403 1.00 9.04 H new ATOM 0 HG12 VAL A 130 8.011 26.166 34.647 1.00 9.04 H new ATOM 0 HG13 VAL A 130 7.917 25.177 35.879 1.00 9.04 H new ATOM 0 HG21 VAL A 130 5.818 23.391 34.803 1.00 8.74 H new ATOM 0 HG22 VAL A 130 5.776 23.925 36.294 1.00 8.74 H new ATOM 0 HG23 VAL A 130 4.537 24.158 35.334 1.00 8.74 H new ATOM 1115 N PHE A 131 6.707 28.743 36.146 1.00 7.58 N ATOM 1116 CA PHE A 131 7.213 30.069 35.774 1.00 7.60 C ATOM 1117 C PHE A 131 8.689 30.036 35.375 1.00 7.56 C ATOM 1118 O PHE A 131 9.496 29.299 35.957 1.00 7.67 O ATOM 1119 CB PHE A 131 7.092 31.053 36.950 1.00 7.90 C ATOM 1120 CG PHE A 131 5.684 31.391 37.360 1.00 8.33 C ATOM 1121 CD1 PHE A 131 4.825 32.047 36.495 1.00 8.62 C ATOM 1122 CD2 PHE A 131 5.245 31.089 38.641 1.00 8.55 C ATOM 1123 CE1 PHE A 131 3.538 32.402 36.905 1.00 9.02 C ATOM 1124 CE2 PHE A 131 3.962 31.437 39.054 1.00 8.85 C ATOM 1125 CZ PHE A 131 3.113 32.091 38.181 1.00 8.95 C ATOM 0 H PHE A 131 6.826 28.543 36.974 1.00 7.58 H new ATOM 0 HA PHE A 131 6.674 30.353 35.020 1.00 7.60 H new ATOM 0 HB2 PHE A 131 7.555 30.679 37.715 1.00 7.90 H new ATOM 0 HB3 PHE A 131 7.551 31.874 36.714 1.00 7.90 H new ATOM 0 HD1 PHE A 131 5.107 32.253 35.633 1.00 8.62 H new ATOM 0 HD2 PHE A 131 5.814 30.649 39.230 1.00 8.55 H new ATOM 0 HE1 PHE A 131 2.969 32.847 36.320 1.00 9.02 H new ATOM 0 HE2 PHE A 131 3.677 31.230 39.915 1.00 8.85 H new ATOM 0 HZ PHE A 131 2.254 32.322 38.454 1.00 8.95 H new ATOM 1126 N ASP A 132 9.032 30.897 34.427 1.00 7.66 N ATOM 1127 CA ASP A 132 10.425 31.155 34.051 1.00 7.90 C ATOM 1128 C ASP A 132 10.915 32.337 34.877 1.00 7.57 C ATOM 1129 O ASP A 132 10.427 33.472 34.689 1.00 7.41 O ATOM 1130 CB ASP A 132 10.487 31.477 32.552 1.00 8.22 C ATOM 1131 CG ASP A 132 11.888 31.775 32.050 1.00 8.61 C ATOM 1132 OD1 ASP A 132 12.881 31.642 32.792 1.00 8.08 O ATOM 1133 OD2 ASP A 132 11.954 32.161 30.872 1.00 10.54 O ATOM 0 H ASP A 132 8.460 31.355 33.976 1.00 7.66 H new ATOM 0 HA ASP A 132 10.986 30.382 34.221 1.00 7.90 H new ATOM 0 HB2 ASP A 132 10.126 30.728 32.053 1.00 8.22 H new ATOM 0 HB3 ASP A 132 9.917 32.241 32.369 1.00 8.22 H new ATOM 1134 N THR A 133 11.899 32.121 35.753 1.00 7.59 N ATOM 1135 CA THR A 133 12.399 33.263 36.547 1.00 7.80 C ATOM 1136 C THR A 133 13.037 34.346 35.703 1.00 8.33 C ATOM 1137 O THR A 133 13.069 35.514 36.107 1.00 8.70 O ATOM 1138 CB THR A 133 13.366 32.857 37.667 1.00 7.70 C ATOM 1139 OG1 THR A 133 14.503 32.187 37.093 1.00 7.78 O ATOM 1140 CG2 THR A 133 12.692 31.966 38.688 1.00 7.86 C ATOM 0 H THR A 133 12.278 31.364 35.903 1.00 7.59 H new ATOM 0 HA THR A 133 11.598 33.625 36.957 1.00 7.80 H new ATOM 0 HB THR A 133 13.656 33.659 38.128 1.00 7.70 H new ATOM 0 HG1 THR A 133 15.096 32.752 36.905 1.00 7.78 H new ATOM 0 HG21 THR A 133 13.328 31.728 39.380 1.00 7.86 H new ATOM 0 HG22 THR A 133 11.944 32.438 39.086 1.00 7.86 H new ATOM 0 HG23 THR A 133 12.371 31.160 38.253 1.00 7.86 H new ATOM 1141 N ASN A 134 13.517 34.000 34.515 1.00 8.24 N ATOM 1142 CA ASN A 134 14.076 35.045 33.646 1.00 8.71 C ATOM 1143 C ASN A 134 13.023 36.048 33.235 1.00 9.42 C ATOM 1144 O ASN A 134 13.356 37.206 32.970 1.00 10.62 O ATOM 1145 CB ASN A 134 14.759 34.455 32.407 1.00 8.61 C ATOM 1146 CG ASN A 134 16.190 34.046 32.661 1.00 8.29 C ATOM 1147 OD1 ASN A 134 16.633 33.865 33.786 1.00 8.56 O ATOM 1148 ND2 ASN A 134 16.936 33.854 31.570 1.00 8.76 N ATOM 0 H ASN A 134 13.532 33.201 34.197 1.00 8.24 H new ATOM 0 HA ASN A 134 14.751 35.507 34.168 1.00 8.71 H new ATOM 0 HB2 ASN A 134 14.256 33.683 32.103 1.00 8.61 H new ATOM 0 HB3 ASN A 134 14.737 35.108 31.690 1.00 8.61 H new ATOM 0 HD21 ASN A 134 17.753 33.596 31.647 1.00 8.76 H new ATOM 0 HD22 ASN A 134 16.600 33.989 30.790 1.00 8.76 H new ATOM 1149 N ARG A 135 11.760 35.622 33.197 1.00 9.50 N ATOM 1150 CA ARG A 135 10.645 36.523 32.882 1.00 10.26 C ATOM 1151 C ARG A 135 10.207 37.362 34.076 1.00 10.79 C ATOM 1152 O ARG A 135 10.027 38.580 33.947 1.00 12.42 O ATOM 1153 CB ARG A 135 9.459 35.720 32.333 1.00 11.03 C ATOM 1154 CG ARG A 135 8.193 36.553 32.101 1.00 12.21 C ATOM 1155 CD ARG A 135 7.132 35.734 31.376 1.00 14.10 C ATOM 1156 NE ARG A 135 7.548 35.370 30.025 1.00 16.41 N ATOM 1157 CZ ARG A 135 7.355 36.128 28.952 1.00 17.95 C ATOM 1158 NH1 ARG A 135 6.739 37.298 29.061 1.00 18.47 N ATOM 1159 NH2 ARG A 135 7.789 35.734 27.766 1.00 19.94 N ATOM 0 H ARG A 135 11.525 34.809 33.352 1.00 9.50 H new ATOM 0 HA ARG A 135 10.963 37.142 32.206 1.00 10.26 H new ATOM 0 HB2 ARG A 135 9.721 35.307 31.495 1.00 11.03 H new ATOM 0 HB3 ARG A 135 9.253 35.002 32.952 1.00 11.03 H new ATOM 0 HG2 ARG A 135 7.844 36.862 32.952 1.00 12.21 H new ATOM 0 HG3 ARG A 135 8.411 37.342 31.580 1.00 12.21 H new ATOM 0 HD2 ARG A 135 6.944 34.929 31.883 1.00 14.10 H new ATOM 0 HD3 ARG A 135 6.306 36.242 31.333 1.00 14.10 H new ATOM 0 HE ARG A 135 7.944 34.615 29.917 1.00 16.41 H new ATOM 0 HH11 ARG A 135 6.463 37.569 29.829 1.00 18.47 H new ATOM 0 HH12 ARG A 135 6.616 37.786 28.364 1.00 18.47 H new ATOM 0 HH21 ARG A 135 8.199 34.982 27.686 1.00 19.94 H new ATOM 0 HH22 ARG A 135 7.661 36.229 27.075 1.00 19.94 H new ATOM 1160 N PHE A 136 10.054 36.731 35.232 1.00 10.07 N ATOM 1161 CA PHE A 136 9.384 37.387 36.367 1.00 10.18 C ATOM 1162 C PHE A 136 10.311 37.946 37.422 1.00 10.28 C ATOM 1163 O PHE A 136 9.919 38.849 38.155 1.00 11.24 O ATOM 1164 CB PHE A 136 8.413 36.419 37.040 1.00 10.20 C ATOM 1165 CG PHE A 136 7.196 36.140 36.224 1.00 9.83 C ATOM 1166 CD1 PHE A 136 6.092 37.000 36.279 1.00 10.20 C ATOM 1167 CD2 PHE A 136 7.144 35.028 35.389 1.00 9.90 C ATOM 1168 CE1 PHE A 136 4.967 36.743 35.514 1.00 10.59 C ATOM 1169 CE2 PHE A 136 6.028 34.782 34.617 1.00 10.58 C ATOM 1170 CZ PHE A 136 4.928 35.630 34.681 1.00 10.60 C ATOM 0 H PHE A 136 10.325 35.930 35.387 1.00 10.07 H new ATOM 0 HA PHE A 136 8.922 38.144 35.975 1.00 10.18 H new ATOM 0 HB2 PHE A 136 8.872 35.584 37.220 1.00 10.20 H new ATOM 0 HB3 PHE A 136 8.143 36.785 37.897 1.00 10.20 H new ATOM 0 HD1 PHE A 136 6.115 37.747 36.832 1.00 10.20 H new ATOM 0 HD2 PHE A 136 7.868 34.446 35.351 1.00 9.90 H new ATOM 0 HE1 PHE A 136 4.236 37.316 35.557 1.00 10.59 H new ATOM 0 HE2 PHE A 136 6.011 34.045 34.050 1.00 10.58 H new ATOM 0 HZ PHE A 136 4.171 35.454 34.170 1.00 10.60 H new ATOM 1171 N GLN A 137 11.498 37.380 37.568 1.00 9.22 N ATOM 1172 CA GLN A 137 12.412 37.783 38.615 1.00 8.95 C ATOM 1173 C GLN A 137 13.831 37.401 38.205 1.00 8.84 C ATOM 1174 O GLN A 137 14.497 36.562 38.831 1.00 8.70 O ATOM 1175 CB GLN A 137 12.017 37.142 39.950 1.00 8.70 C ATOM 1176 CG GLN A 137 11.921 35.599 39.964 1.00 8.61 C ATOM 1177 CD GLN A 137 10.502 35.048 40.095 1.00 8.51 C ATOM 1178 OE1 GLN A 137 10.063 34.231 39.285 1.00 8.83 O ATOM 1179 NE2 GLN A 137 9.788 35.464 41.146 1.00 9.46 N ATOM 0 H GLN A 137 11.795 36.751 37.062 1.00 9.22 H new ATOM 0 HA GLN A 137 12.371 38.744 38.738 1.00 8.95 H new ATOM 0 HB2 GLN A 137 12.662 37.413 40.621 1.00 8.70 H new ATOM 0 HB3 GLN A 137 11.158 37.503 40.220 1.00 8.70 H new ATOM 0 HG2 GLN A 137 12.314 35.255 39.146 1.00 8.61 H new ATOM 0 HG3 GLN A 137 12.455 35.261 40.700 1.00 8.61 H new ATOM 0 HE21 GLN A 137 10.123 36.036 41.694 1.00 9.46 H new ATOM 0 HE22 GLN A 137 8.994 35.160 41.274 1.00 9.46 H new ATOM 1180 N LEU A 138 14.301 38.086 37.167 1.00 9.03 N ATOM 1181 CA LEU A 138 15.589 37.779 36.590 1.00 9.10 C ATOM 1182 C LEU A 138 16.685 37.770 37.648 1.00 9.21 C ATOM 1183 O LEU A 138 16.741 38.639 38.537 1.00 9.75 O ATOM 1184 CB LEU A 138 15.920 38.777 35.489 1.00 9.47 C ATOM 1185 CG LEU A 138 17.265 38.556 34.773 1.00 9.80 C ATOM 1186 CD1 LEU A 138 17.325 37.240 34.008 1.00 10.00 C ATOM 1187 CD2 LEU A 138 17.542 39.727 33.834 1.00 9.82 C ATOM 0 H LEU A 138 13.883 38.733 36.786 1.00 9.03 H new ATOM 0 HA LEU A 138 15.542 36.889 36.207 1.00 9.10 H new ATOM 0 HB2 LEU A 138 15.211 38.751 34.827 1.00 9.47 H new ATOM 0 HB3 LEU A 138 15.918 39.668 35.871 1.00 9.47 H new ATOM 0 HG LEU A 138 17.950 38.507 35.458 1.00 9.80 H new ATOM 0 HD11 LEU A 138 18.191 37.154 33.579 1.00 10.00 H new ATOM 0 HD12 LEU A 138 17.195 36.502 34.623 1.00 10.00 H new ATOM 0 HD13 LEU A 138 16.628 37.225 33.334 1.00 10.00 H new ATOM 0 HD21 LEU A 138 18.389 39.587 33.383 1.00 9.82 H new ATOM 0 HD22 LEU A 138 16.832 39.789 33.176 1.00 9.82 H new ATOM 0 HD23 LEU A 138 17.580 40.550 34.346 1.00 9.82 H new ATOM 1188 N GLN A 139 17.557 36.774 37.567 1.00 8.72 N ATOM 1189 CA GLN A 139 18.637 36.597 38.532 1.00 8.56 C ATOM 1190 C GLN A 139 19.749 35.766 37.880 1.00 8.63 C ATOM 1191 O GLN A 139 19.583 35.272 36.752 1.00 8.58 O ATOM 1192 CB GLN A 139 18.115 35.987 39.838 1.00 8.74 C ATOM 1193 CG GLN A 139 17.293 34.721 39.611 1.00 8.71 C ATOM 1194 CD GLN A 139 16.567 34.288 40.855 1.00 8.54 C ATOM 1195 OE1 GLN A 139 17.132 33.638 41.718 1.00 9.16 O ATOM 1196 NE2 GLN A 139 15.285 34.665 40.949 1.00 8.83 N ATOM 0 H GLN A 139 17.540 36.178 36.948 1.00 8.72 H new ATOM 0 HA GLN A 139 19.011 37.457 38.779 1.00 8.56 H new ATOM 0 HB2 GLN A 139 18.866 35.781 40.417 1.00 8.74 H new ATOM 0 HB3 GLN A 139 17.571 36.642 40.302 1.00 8.74 H new ATOM 0 HG2 GLN A 139 16.651 34.877 38.901 1.00 8.71 H new ATOM 0 HG3 GLN A 139 17.877 34.006 39.314 1.00 8.71 H new ATOM 0 HE21 GLN A 139 14.924 35.123 40.317 1.00 8.83 H new ATOM 0 HE22 GLN A 139 14.823 34.449 41.641 1.00 8.83 H new ATOM 1197 N SER A 140 20.866 35.598 38.584 1.00 8.62 N ATOM 1198 CA SER A 140 22.053 34.998 37.956 1.00 9.19 C ATOM 1199 C SER A 140 21.753 33.614 37.382 1.00 9.41 C ATOM 1200 O SER A 140 22.216 33.295 36.268 1.00 9.84 O ATOM 1201 CB SER A 140 23.226 34.962 38.925 1.00 9.47 C ATOM 1202 OG SER A 140 22.919 34.254 40.095 1.00 9.68 O ATOM 0 H SER A 140 20.962 35.818 39.410 1.00 8.62 H new ATOM 0 HA SER A 140 22.305 35.564 37.210 1.00 9.19 H new ATOM 0 HB2 SER A 140 23.990 34.552 38.491 1.00 9.47 H new ATOM 0 HB3 SER A 140 23.483 35.869 39.155 1.00 9.47 H new ATOM 0 HG SER A 140 22.580 34.777 40.658 1.00 9.68 H new ATOM 1203 N LYS A 141 20.961 32.815 38.102 1.00 9.28 N ATOM 1204 CA LYS A 141 20.550 31.514 37.592 1.00 9.53 C ATOM 1205 C LYS A 141 19.140 31.585 37.069 1.00 9.06 C ATOM 1206 O LYS A 141 18.277 32.242 37.654 1.00 9.11 O ATOM 1207 CB LYS A 141 20.624 30.425 38.667 1.00 10.54 C ATOM 1208 CG LYS A 141 22.030 30.090 39.164 1.00 12.25 C ATOM 1209 CD LYS A 141 22.911 29.519 38.060 1.00 13.67 C ATOM 1210 CE LYS A 141 24.246 28.969 38.567 1.00 14.96 C ATOM 1211 NZ LYS A 141 25.193 30.035 39.029 1.00 17.99 N ATOM 0 H LYS A 141 20.655 33.010 38.882 1.00 9.28 H new ATOM 0 HA LYS A 141 21.164 31.281 36.878 1.00 9.53 H new ATOM 0 HB2 LYS A 141 20.087 30.703 39.425 1.00 10.54 H new ATOM 0 HB3 LYS A 141 20.220 29.616 38.315 1.00 10.54 H new ATOM 0 HG2 LYS A 141 22.443 30.891 39.524 1.00 12.25 H new ATOM 0 HG3 LYS A 141 21.970 29.451 39.891 1.00 12.25 H new ATOM 0 HD2 LYS A 141 22.429 28.810 37.606 1.00 13.67 H new ATOM 0 HD3 LYS A 141 23.083 30.211 37.403 1.00 13.67 H new ATOM 0 HE2 LYS A 141 24.078 28.356 39.299 1.00 14.96 H new ATOM 0 HE3 LYS A 141 24.667 28.457 37.859 1.00 14.96 H new ATOM 0 HZ1 LYS A 141 25.878 29.659 39.456 1.00 17.99 H new ATOM 0 HZ2 LYS A 141 25.495 30.489 38.326 1.00 17.99 H new ATOM 0 HZ3 LYS A 141 24.769 30.590 39.580 1.00 17.99 H new ATOM 1212 N GLN A 142 18.889 30.854 35.982 1.00 9.07 N ATOM 1213 CA GLN A 142 17.527 30.631 35.501 1.00 8.71 C ATOM 1214 C GLN A 142 16.915 29.417 36.182 1.00 8.41 C ATOM 1215 O GLN A 142 17.525 28.349 36.205 1.00 8.64 O ATOM 1216 CB GLN A 142 17.542 30.436 33.992 1.00 8.53 C ATOM 1217 CG GLN A 142 16.150 30.285 33.395 1.00 8.41 C ATOM 1218 CD GLN A 142 16.171 30.132 31.903 1.00 8.92 C ATOM 1219 OE1 GLN A 142 17.127 29.572 31.365 1.00 9.57 O ATOM 1220 NE2 GLN A 142 15.142 30.632 31.215 1.00 8.77 N ATOM 0 H GLN A 142 19.499 30.477 35.507 1.00 9.07 H new ATOM 0 HA GLN A 142 16.986 31.407 35.716 1.00 8.71 H new ATOM 0 HB2 GLN A 142 17.985 31.193 33.578 1.00 8.53 H new ATOM 0 HB3 GLN A 142 18.067 29.649 33.778 1.00 8.53 H new ATOM 0 HG2 GLN A 142 15.716 29.512 33.789 1.00 8.41 H new ATOM 0 HG3 GLN A 142 15.616 31.060 33.629 1.00 8.41 H new ATOM 0 HE21 GLN A 142 14.494 31.016 31.629 1.00 8.77 H new ATOM 0 HE22 GLN A 142 15.128 30.570 30.357 1.00 8.77 H new ATOM 1221 N TYR A 143 15.706 29.583 36.726 1.00 7.86 N ATOM 1222 CA TYR A 143 14.935 28.502 37.320 1.00 8.04 C ATOM 1223 C TYR A 143 13.641 28.260 36.574 1.00 7.86 C ATOM 1224 O TYR A 143 13.020 29.183 36.044 1.00 7.74 O ATOM 1225 CB TYR A 143 14.564 28.815 38.778 1.00 8.19 C ATOM 1226 CG TYR A 143 15.733 28.826 39.729 1.00 8.24 C ATOM 1227 CD1 TYR A 143 16.539 29.951 39.867 1.00 8.29 C ATOM 1228 CD2 TYR A 143 16.020 27.718 40.522 1.00 8.42 C ATOM 1229 CE1 TYR A 143 17.622 29.954 40.744 1.00 8.80 C ATOM 1230 CE2 TYR A 143 17.091 27.715 41.409 1.00 9.27 C ATOM 1231 CZ TYR A 143 17.884 28.841 41.515 1.00 9.01 C ATOM 1232 OH TYR A 143 18.959 28.813 42.394 1.00 10.73 O ATOM 0 H TYR A 143 15.308 30.345 36.758 1.00 7.86 H new ATOM 0 HA TYR A 143 15.501 27.716 37.273 1.00 8.04 H new ATOM 0 HB2 TYR A 143 14.127 29.680 38.810 1.00 8.19 H new ATOM 0 HB3 TYR A 143 13.918 28.159 39.084 1.00 8.19 H new ATOM 0 HD1 TYR A 143 16.352 30.712 39.367 1.00 8.29 H new ATOM 0 HD2 TYR A 143 15.483 26.962 40.457 1.00 8.42 H new ATOM 0 HE1 TYR A 143 18.167 30.705 40.809 1.00 8.80 H new ATOM 0 HE2 TYR A 143 17.271 26.963 41.925 1.00 9.27 H new ATOM 0 HH TYR A 143 19.586 29.278 42.085 1.00 10.73 H new ATOM 1233 N THR A 144 13.246 26.987 36.535 1.00 7.96 N ATOM 1234 CA THR A 144 11.843 26.607 36.309 1.00 7.83 C ATOM 1235 C THR A 144 11.186 26.521 37.684 1.00 7.69 C ATOM 1236 O THR A 144 11.523 25.656 38.499 1.00 8.05 O ATOM 1237 CB THR A 144 11.711 25.247 35.586 1.00 8.16 C ATOM 1238 OG1 THR A 144 12.345 24.232 36.367 1.00 9.27 O ATOM 1239 CG2 THR A 144 12.385 25.297 34.202 1.00 8.79 C ATOM 0 H THR A 144 13.779 26.320 36.638 1.00 7.96 H new ATOM 0 HA THR A 144 11.417 27.266 35.739 1.00 7.83 H new ATOM 0 HB THR A 144 10.768 25.050 35.473 1.00 8.16 H new ATOM 0 HG1 THR A 144 12.364 24.469 37.173 1.00 9.27 H new ATOM 0 HG21 THR A 144 12.292 24.436 33.765 1.00 8.79 H new ATOM 0 HG22 THR A 144 11.962 25.982 33.660 1.00 8.79 H new ATOM 0 HG23 THR A 144 13.327 25.505 34.308 1.00 8.79 H new ATOM 1240 N LYS A 145 10.249 27.434 37.919 1.00 7.69 N ATOM 1241 CA LYS A 145 9.627 27.571 39.224 1.00 7.71 C ATOM 1242 C LYS A 145 8.251 26.902 39.190 1.00 7.81 C ATOM 1243 O LYS A 145 7.298 27.423 38.598 1.00 7.81 O ATOM 1244 CB LYS A 145 9.562 29.059 39.577 1.00 8.01 C ATOM 1245 CG LYS A 145 8.840 29.370 40.899 1.00 7.97 C ATOM 1246 CD LYS A 145 8.850 30.885 41.167 1.00 8.50 C ATOM 1247 CE LYS A 145 10.230 31.443 41.485 1.00 8.47 C ATOM 1248 NZ LYS A 145 10.760 31.020 42.817 1.00 8.18 N ATOM 0 H LYS A 145 9.959 27.987 37.328 1.00 7.69 H new ATOM 0 HA LYS A 145 10.142 27.129 39.917 1.00 7.71 H new ATOM 0 HB2 LYS A 145 10.466 29.408 39.625 1.00 8.01 H new ATOM 0 HB3 LYS A 145 9.114 29.531 38.858 1.00 8.01 H new ATOM 0 HG2 LYS A 145 7.926 29.048 40.859 1.00 7.97 H new ATOM 0 HG3 LYS A 145 9.274 28.903 41.630 1.00 7.97 H new ATOM 0 HD2 LYS A 145 8.496 31.345 40.390 1.00 8.50 H new ATOM 0 HD3 LYS A 145 8.254 31.078 41.907 1.00 8.50 H new ATOM 0 HE2 LYS A 145 10.851 31.161 40.795 1.00 8.47 H new ATOM 0 HE3 LYS A 145 10.193 32.412 41.454 1.00 8.47 H new ATOM 0 HZ1 LYS A 145 11.624 31.227 42.873 1.00 8.18 H new ATOM 0 HZ2 LYS A 145 10.312 31.440 43.462 1.00 8.18 H new ATOM 0 HZ3 LYS A 145 10.660 30.141 42.911 1.00 8.18 H new ATOM 1249 N PHE A 146 8.191 25.708 39.771 1.00 7.84 N ATOM 1250 CA PHE A 146 6.937 24.933 39.865 1.00 8.51 C ATOM 1251 C PHE A 146 6.163 25.476 41.056 1.00 8.63 C ATOM 1252 O PHE A 146 6.714 25.582 42.152 1.00 9.23 O ATOM 1253 CB PHE A 146 7.243 23.468 40.174 1.00 9.55 C ATOM 1254 CG PHE A 146 7.921 22.714 39.070 1.00 10.69 C ATOM 1255 CD1 PHE A 146 9.294 22.768 38.920 1.00 11.69 C ATOM 1256 CD2 PHE A 146 7.182 21.912 38.200 1.00 11.71 C ATOM 1257 CE1 PHE A 146 9.938 22.049 37.921 1.00 13.16 C ATOM 1258 CE2 PHE A 146 7.815 21.195 37.189 1.00 13.10 C ATOM 1259 CZ PHE A 146 9.187 21.285 37.033 1.00 13.36 C ATOM 0 H PHE A 146 8.871 25.317 40.124 1.00 7.84 H new ATOM 0 HA PHE A 146 6.448 25.003 39.030 1.00 8.51 H new ATOM 0 HB2 PHE A 146 7.803 23.429 40.965 1.00 9.55 H new ATOM 0 HB3 PHE A 146 6.412 23.017 40.392 1.00 9.55 H new ATOM 0 HD1 PHE A 146 9.796 23.295 39.499 1.00 11.69 H new ATOM 0 HD2 PHE A 146 6.259 21.856 38.296 1.00 11.71 H new ATOM 0 HE1 PHE A 146 10.865 22.078 37.846 1.00 13.16 H new ATOM 0 HE2 PHE A 146 7.316 20.656 36.619 1.00 13.10 H new ATOM 0 HZ PHE A 146 9.607 20.835 36.335 1.00 13.36 H new ATOM 1260 N VAL A 147 4.893 25.797 40.852 1.00 8.00 N ATOM 1261 CA VAL A 147 4.032 26.183 41.972 1.00 7.92 C ATOM 1262 C VAL A 147 2.897 25.176 42.063 1.00 7.81 C ATOM 1263 O VAL A 147 2.058 25.091 41.155 1.00 7.92 O ATOM 1264 CB VAL A 147 3.470 27.604 41.824 1.00 7.75 C ATOM 1265 CG1 VAL A 147 2.717 27.962 43.093 1.00 8.51 C ATOM 1266 CG2 VAL A 147 4.594 28.605 41.553 1.00 7.97 C ATOM 0 H VAL A 147 4.509 25.799 40.083 1.00 8.00 H new ATOM 0 HA VAL A 147 4.563 26.183 42.783 1.00 7.92 H new ATOM 0 HB VAL A 147 2.864 27.639 41.068 1.00 7.75 H new ATOM 0 HG11 VAL A 147 2.356 28.859 43.013 1.00 8.51 H new ATOM 0 HG12 VAL A 147 1.991 27.333 43.227 1.00 8.51 H new ATOM 0 HG13 VAL A 147 3.322 27.924 43.850 1.00 8.51 H new ATOM 0 HG21 VAL A 147 4.220 29.495 41.463 1.00 7.97 H new ATOM 0 HG22 VAL A 147 5.224 28.593 42.291 1.00 7.97 H new ATOM 0 HG23 VAL A 147 5.053 28.363 40.733 1.00 7.97 H new ATOM 1267 N PHE A 148 2.911 24.398 43.148 1.00 8.08 N ATOM 1268 CA PHE A 148 1.940 23.347 43.387 1.00 8.66 C ATOM 1269 C PHE A 148 0.852 23.831 44.325 1.00 8.80 C ATOM 1270 O PHE A 148 1.140 24.408 45.374 1.00 9.13 O ATOM 1271 CB PHE A 148 2.614 22.143 44.046 1.00 8.97 C ATOM 1272 CG PHE A 148 3.629 21.451 43.171 1.00 8.74 C ATOM 1273 CD1 PHE A 148 3.227 20.497 42.244 1.00 8.81 C ATOM 1274 CD2 PHE A 148 4.983 21.738 43.302 1.00 8.81 C ATOM 1275 CE1 PHE A 148 4.166 19.836 41.449 1.00 9.19 C ATOM 1276 CE2 PHE A 148 5.926 21.073 42.523 1.00 8.83 C ATOM 1277 CZ PHE A 148 5.512 20.132 41.599 1.00 9.51 C ATOM 0 H PHE A 148 3.498 24.473 43.772 1.00 8.08 H new ATOM 0 HA PHE A 148 1.560 23.099 42.530 1.00 8.66 H new ATOM 0 HB2 PHE A 148 3.050 22.435 44.862 1.00 8.97 H new ATOM 0 HB3 PHE A 148 1.932 21.503 44.302 1.00 8.97 H new ATOM 0 HD1 PHE A 148 2.324 20.297 42.152 1.00 8.81 H new ATOM 0 HD2 PHE A 148 5.261 22.380 43.915 1.00 8.81 H new ATOM 0 HE1 PHE A 148 3.891 19.203 40.825 1.00 9.19 H new ATOM 0 HE2 PHE A 148 6.831 21.261 42.624 1.00 8.83 H new ATOM 0 HZ PHE A 148 6.142 19.694 41.073 1.00 9.51 H new ATOM 1278 N GLY A 149 -0.401 23.605 43.949 1.00 9.14 N ATOM 1279 CA GLY A 149 -1.504 23.807 44.903 1.00 9.54 C ATOM 1280 C GLY A 149 -1.502 22.671 45.905 1.00 10.24 C ATOM 1281 O GLY A 149 -1.551 21.499 45.496 1.00 10.81 O ATOM 0 H GLY A 149 -0.638 23.340 43.166 1.00 9.14 H new ATOM 0 HA2 GLY A 149 -1.401 24.657 45.359 1.00 9.54 H new ATOM 0 HA3 GLY A 149 -2.352 23.838 44.433 1.00 9.54 H new ATOM 1282 N CYS A 150 -1.424 23.010 47.195 1.00 10.65 N ATOM 1283 CA CYS A 150 -1.297 22.018 48.272 1.00 11.51 C ATOM 1284 C CYS A 150 -2.272 22.288 49.401 1.00 12.67 C ATOM 1285 O CYS A 150 -2.706 23.413 49.605 1.00 12.74 O ATOM 1286 CB CYS A 150 0.122 21.980 48.858 1.00 11.32 C ATOM 1287 SG CYS A 150 1.445 21.709 47.676 1.00 11.34 S ATOM 0 H CYS A 150 -1.443 23.824 47.472 1.00 10.65 H new ATOM 0 HA CYS A 150 -1.498 21.161 47.865 1.00 11.51 H new ATOM 0 HB2 CYS A 150 0.287 22.818 49.317 1.00 11.32 H new ATOM 0 HB3 CYS A 150 0.159 21.278 49.527 1.00 11.32 H new ATOM 0 HG CYS A 150 1.425 22.576 46.847 1.00 11.34 H new ATOM 1288 N LYS A 151 -2.600 21.223 50.121 1.00 14.04 N ATOM 1289 CA LYS A 151 -3.448 21.314 51.305 1.00 15.43 C ATOM 1290 C LYS A 151 -2.649 20.832 52.509 1.00 15.75 C ATOM 1291 O LYS A 151 -1.978 19.799 52.434 1.00 15.05 O ATOM 1292 CB LYS A 151 -4.696 20.461 51.091 1.00 18.15 C ATOM 1293 CG LYS A 151 -5.586 20.313 52.321 1.00 20.91 C ATOM 1294 CD LYS A 151 -6.782 19.425 52.029 1.00 23.72 C ATOM 1295 CE LYS A 151 -7.576 19.181 53.306 1.00 25.66 C ATOM 1296 NZ LYS A 151 -8.923 18.589 53.064 1.00 28.26 N ATOM 0 H LYS A 151 -2.337 20.425 49.938 1.00 14.04 H new ATOM 0 HA LYS A 151 -3.729 22.229 51.462 1.00 15.43 H new ATOM 0 HB2 LYS A 151 -5.220 20.850 50.373 1.00 18.15 H new ATOM 0 HB3 LYS A 151 -4.423 19.578 50.797 1.00 18.15 H new ATOM 0 HG2 LYS A 151 -5.072 19.937 53.052 1.00 20.91 H new ATOM 0 HG3 LYS A 151 -5.892 21.187 52.609 1.00 20.91 H new ATOM 0 HD2 LYS A 151 -7.349 19.843 51.362 1.00 23.72 H new ATOM 0 HD3 LYS A 151 -6.484 18.580 51.659 1.00 23.72 H new ATOM 0 HE2 LYS A 151 -7.070 18.590 53.885 1.00 25.66 H new ATOM 0 HE3 LYS A 151 -7.680 20.021 53.779 1.00 25.66 H new ATOM 0 HZ1 LYS A 151 -9.339 18.469 53.842 1.00 28.26 H new ATOM 0 HZ2 LYS A 151 -9.402 19.139 52.554 1.00 28.26 H new ATOM 0 HZ3 LYS A 151 -8.833 17.805 52.652 1.00 28.26 H new ATOM 1297 N LEU A 152 -2.695 21.585 53.612 1.00 16.33 N ATOM 1298 CA LEU A 152 -1.998 21.201 54.841 1.00 17.56 C ATOM 1299 C LEU A 152 -2.806 20.154 55.602 1.00 17.99 C ATOM 1300 O LEU A 152 -4.036 20.177 55.566 1.00 19.31 O ATOM 1301 CB LEU A 152 -1.696 22.419 55.727 1.00 17.60 C ATOM 1302 CG LEU A 152 -0.787 23.489 55.106 1.00 17.66 C ATOM 1303 CD1 LEU A 152 -0.502 24.608 56.099 1.00 18.36 C ATOM 1304 CD2 LEU A 152 0.518 22.885 54.614 1.00 18.55 C ATOM 0 H LEU A 152 -3.128 22.326 53.668 1.00 16.33 H new ATOM 0 HA LEU A 152 -1.145 20.812 54.592 1.00 17.56 H new ATOM 0 HB2 LEU A 152 -2.537 22.836 55.972 1.00 17.60 H new ATOM 0 HB3 LEU A 152 -1.285 22.106 56.548 1.00 17.60 H new ATOM 0 HG LEU A 152 -1.258 23.863 54.345 1.00 17.66 H new ATOM 0 HD11 LEU A 152 0.073 25.270 55.684 1.00 18.36 H new ATOM 0 HD12 LEU A 152 -1.336 25.026 56.365 1.00 18.36 H new ATOM 0 HD13 LEU A 152 -0.061 24.242 56.881 1.00 18.36 H new ATOM 0 HD21 LEU A 152 1.072 23.581 54.227 1.00 18.55 H new ATOM 0 HD22 LEU A 152 0.986 22.476 55.358 1.00 18.55 H new ATOM 0 HD23 LEU A 152 0.330 22.212 53.942 1.00 18.55 H new ATOM 1305 N LEU A 153 -2.096 19.213 56.217 1.00 18.81 N ATOM 1306 CA LEU A 153 -2.707 18.141 57.013 1.00 19.99 C ATOM 1307 C LEU A 153 -2.328 18.331 58.494 1.00 21.18 C ATOM 1308 O LEU A 153 -2.500 19.423 59.026 1.00 22.08 O ATOM 1309 CB LEU A 153 -2.326 16.758 56.446 1.00 20.23 C ATOM 1310 CG LEU A 153 -2.533 16.530 54.940 1.00 21.07 C ATOM 1311 CD1 LEU A 153 -1.860 15.253 54.448 1.00 20.65 C ATOM 1312 CD2 LEU A 153 -4.012 16.545 54.560 1.00 22.05 C ATOM 0 H LEU A 153 -1.237 19.175 56.186 1.00 18.81 H new ATOM 0 HA LEU A 153 -3.674 18.187 56.958 1.00 19.99 H new ATOM 0 HB2 LEU A 153 -1.391 16.599 56.648 1.00 20.23 H new ATOM 0 HB3 LEU A 153 -2.838 16.087 56.924 1.00 20.23 H new ATOM 0 HG LEU A 153 -2.102 17.275 54.492 1.00 21.07 H new ATOM 0 HD11 LEU A 153 -2.017 15.151 53.496 1.00 20.65 H new ATOM 0 HD12 LEU A 153 -0.906 15.305 54.615 1.00 20.65 H new ATOM 0 HD13 LEU A 153 -2.229 14.490 54.920 1.00 20.65 H new ATOM 0 HD21 LEU A 153 -4.103 16.398 53.605 1.00 22.05 H new ATOM 0 HD22 LEU A 153 -4.477 15.842 55.040 1.00 22.05 H new ATOM 0 HD23 LEU A 153 -4.397 17.404 54.793 1.00 22.05 H new ATOM 1313 N ASP A 154 -1.797 17.308 59.160 1.00 23.00 N ATOM 1314 CA ASP A 154 -1.414 17.443 60.571 1.00 25.87 C ATOM 1315 C ASP A 154 -0.111 18.207 60.765 1.00 24.75 C ATOM 1316 O ASP A 154 0.787 18.143 59.931 1.00 24.60 O ATOM 1317 CB ASP A 154 -1.275 16.074 61.246 1.00 29.19 C ATOM 1318 CG ASP A 154 -2.588 15.314 61.316 1.00 33.64 C ATOM 1319 OD1 ASP A 154 -3.610 15.897 61.737 1.00 38.12 O ATOM 1320 OD2 ASP A 154 -2.592 14.117 60.959 1.00 37.28 O ATOM 0 H ASP A 154 -1.650 16.532 58.820 1.00 23.00 H new ATOM 0 HA ASP A 154 -2.132 17.949 60.983 1.00 25.87 H new ATOM 0 HB2 ASP A 154 -0.625 15.543 60.760 1.00 29.19 H new ATOM 0 HB3 ASP A 154 -0.928 16.195 62.144 1.00 29.19 H new ATOM 1321 N GLY A 155 -0.014 18.913 61.886 1.00 23.95 N ATOM 1322 CA GLY A 155 1.215 19.571 62.292 1.00 23.44 C ATOM 1323 C GLY A 155 0.974 20.864 63.043 1.00 24.05 C ATOM 1324 O GLY A 155 -0.130 21.122 63.546 1.00 24.79 O ATOM 0 H GLY A 155 -0.667 19.023 62.435 1.00 23.95 H new ATOM 0 HA2 GLY A 155 1.729 18.968 62.852 1.00 23.44 H new ATOM 0 HA3 GLY A 155 1.752 19.755 61.506 1.00 23.44 H new ATOM 1325 N GLN A 156 2.017 21.682 63.108 1.00 24.01 N ATOM 1326 CA GLN A 156 2.005 22.928 63.859 1.00 24.30 C ATOM 1327 C GLN A 156 3.199 23.770 63.435 1.00 22.12 C ATOM 1328 O GLN A 156 4.318 23.250 63.320 1.00 21.98 O ATOM 1329 CB GLN A 156 2.091 22.625 65.359 1.00 26.52 C ATOM 1330 CG GLN A 156 1.962 23.843 66.255 1.00 29.07 C ATOM 1331 CD GLN A 156 2.139 23.499 67.716 1.00 31.25 C ATOM 1332 OE1 GLN A 156 3.197 23.021 68.130 1.00 32.30 O ATOM 1333 NE2 GLN A 156 1.105 23.746 68.509 1.00 33.77 N ATOM 0 H GLN A 156 2.763 21.525 62.710 1.00 24.01 H new ATOM 0 HA GLN A 156 1.184 23.412 63.681 1.00 24.30 H new ATOM 0 HB2 GLN A 156 1.393 21.992 65.590 1.00 26.52 H new ATOM 0 HB3 GLN A 156 2.939 22.191 65.542 1.00 26.52 H new ATOM 0 HG2 GLN A 156 2.624 24.503 65.997 1.00 29.07 H new ATOM 0 HG3 GLN A 156 1.091 24.249 66.123 1.00 29.07 H new ATOM 0 HE21 GLN A 156 0.383 24.080 68.183 1.00 33.77 H new ATOM 0 HE22 GLN A 156 1.157 23.572 69.350 1.00 33.77 H new ATOM 1334 N PHE A 157 2.970 25.061 63.202 1.00 22.00 N ATOM 1335 CA PHE A 157 4.095 25.940 62.909 1.00 20.87 C ATOM 1336 C PHE A 157 4.920 26.214 64.155 1.00 21.87 C ATOM 1337 O PHE A 157 4.377 26.578 65.203 1.00 23.13 O ATOM 1338 CB PHE A 157 3.693 27.267 62.254 1.00 19.61 C ATOM 1339 CG PHE A 157 4.862 28.203 62.066 1.00 18.70 C ATOM 1340 CD1 PHE A 157 5.844 27.922 61.108 1.00 17.76 C ATOM 1341 CD2 PHE A 157 5.031 29.321 62.880 1.00 18.49 C ATOM 1342 CE1 PHE A 157 6.940 28.752 60.941 1.00 17.43 C ATOM 1343 CE2 PHE A 157 6.132 30.149 62.725 1.00 18.56 C ATOM 1344 CZ PHE A 157 7.091 29.866 61.754 1.00 17.60 C ATOM 0 H PHE A 157 2.196 25.437 63.208 1.00 22.00 H new ATOM 0 HA PHE A 157 4.631 25.457 62.261 1.00 20.87 H new ATOM 0 HB2 PHE A 157 3.286 27.087 61.392 1.00 19.61 H new ATOM 0 HB3 PHE A 157 3.020 27.702 62.801 1.00 19.61 H new ATOM 0 HD1 PHE A 157 5.759 27.165 60.575 1.00 17.76 H new ATOM 0 HD2 PHE A 157 4.399 29.514 63.534 1.00 18.49 H new ATOM 0 HE1 PHE A 157 7.573 28.563 60.286 1.00 17.43 H new ATOM 0 HE2 PHE A 157 6.231 30.896 63.271 1.00 18.56 H new ATOM 0 HZ PHE A 157 7.829 30.422 61.651 1.00 17.60 H new ATOM 1345 N GLN A 158 6.227 26.035 64.037 1.00 23.20 N ATOM 1346 CA GLN A 158 7.142 26.478 65.074 1.00 24.69 C ATOM 1347 C GLN A 158 8.276 27.208 64.386 1.00 24.24 C ATOM 1348 O GLN A 158 8.868 26.703 63.426 1.00 23.31 O ATOM 1349 CB GLN A 158 7.683 25.300 65.894 1.00 27.62 C ATOM 1350 CG GLN A 158 6.632 24.566 66.727 1.00 29.92 C ATOM 1351 CD GLN A 158 7.230 23.524 67.657 1.00 32.29 C ATOM 1352 OE1 GLN A 158 8.390 23.120 67.509 1.00 35.54 O ATOM 1353 NE2 GLN A 158 6.438 23.080 68.627 1.00 33.79 N ATOM 0 H GLN A 158 6.605 25.658 63.362 1.00 23.20 H new ATOM 0 HA GLN A 158 6.678 27.059 65.697 1.00 24.69 H new ATOM 0 HB2 GLN A 158 8.100 24.666 65.290 1.00 27.62 H new ATOM 0 HB3 GLN A 158 8.378 25.626 66.487 1.00 27.62 H new ATOM 0 HG2 GLN A 158 6.134 25.212 67.252 1.00 29.92 H new ATOM 0 HG3 GLN A 158 5.999 24.135 66.132 1.00 29.92 H new ATOM 0 HE21 GLN A 158 5.637 23.383 68.700 1.00 33.79 H new ATOM 0 HE22 GLN A 158 6.727 22.490 69.182 1.00 33.79 H new ATOM 1354 N GLU A 159 8.563 28.412 64.865 1.00 23.37 N ATOM 1355 CA GLU A 159 9.735 29.143 64.424 1.00 23.18 C ATOM 1356 C GLU A 159 10.964 28.228 64.492 1.00 22.18 C ATOM 1357 O GLU A 159 11.147 27.497 65.463 1.00 21.75 O ATOM 1358 CB GLU A 159 9.930 30.380 65.300 1.00 25.39 C ATOM 1359 CG GLU A 159 11.135 31.207 64.910 1.00 27.11 C ATOM 1360 CD GLU A 159 11.389 32.382 65.836 1.00 29.21 C ATOM 1361 OE1 GLU A 159 10.631 32.575 66.816 1.00 31.52 O ATOM 1362 OE2 GLU A 159 12.362 33.111 65.579 1.00 30.07 O ATOM 0 H GLU A 159 8.086 28.823 65.450 1.00 23.37 H new ATOM 0 HA GLU A 159 9.615 29.433 63.506 1.00 23.18 H new ATOM 0 HB2 GLU A 159 9.135 30.934 65.248 1.00 25.39 H new ATOM 0 HB3 GLU A 159 10.022 30.102 66.225 1.00 25.39 H new ATOM 0 HG2 GLU A 159 11.920 30.637 64.900 1.00 27.11 H new ATOM 0 HG3 GLU A 159 11.013 31.537 64.006 1.00 27.11 H new ATOM 1363 N ASN A 160 11.794 28.251 63.456 1.00 20.27 N ATOM 1364 CA ASN A 160 12.995 27.423 63.430 1.00 20.45 C ATOM 1365 C ASN A 160 14.177 28.161 62.803 1.00 20.32 C ATOM 1366 O ASN A 160 14.088 29.366 62.540 1.00 19.65 O ATOM 1367 CB ASN A 160 12.727 26.050 62.767 1.00 20.06 C ATOM 1368 CG ASN A 160 12.281 26.156 61.314 1.00 19.93 C ATOM 1369 OD1 ASN A 160 12.757 26.994 60.552 1.00 19.14 O ATOM 1370 ND2 ASN A 160 11.381 25.259 60.918 1.00 20.43 N ATOM 0 H ASN A 160 11.681 28.739 62.757 1.00 20.27 H new ATOM 0 HA ASN A 160 13.244 27.240 64.349 1.00 20.45 H new ATOM 0 HB2 ASN A 160 13.534 25.514 62.812 1.00 20.06 H new ATOM 0 HB3 ASN A 160 12.046 25.581 63.274 1.00 20.06 H new ATOM 0 HD21 ASN A 160 11.112 25.252 60.101 1.00 20.43 H new ATOM 0 HD22 ASN A 160 11.069 24.687 61.479 1.00 20.43 H new ATOM 1371 N GLN A 161 15.278 27.454 62.561 1.00 21.47 N ATOM 1372 CA GLN A 161 16.497 28.105 62.093 1.00 22.41 C ATOM 1373 C GLN A 161 16.332 28.695 60.687 1.00 21.09 C ATOM 1374 O GLN A 161 17.023 29.647 60.309 1.00 21.67 O ATOM 1375 CB GLN A 161 17.699 27.157 62.200 1.00 25.90 C ATOM 1376 CG GLN A 161 18.290 27.124 63.608 1.00 29.17 C ATOM 1377 CD GLN A 161 19.029 25.837 63.950 1.00 32.33 C ATOM 1378 OE1 GLN A 161 19.316 25.006 63.083 1.00 33.79 O ATOM 1379 NE2 GLN A 161 19.344 25.670 65.233 1.00 34.33 N ATOM 0 H GLN A 161 15.340 26.602 62.661 1.00 21.47 H new ATOM 0 HA GLN A 161 16.674 28.859 62.677 1.00 22.41 H new ATOM 0 HB2 GLN A 161 17.425 26.262 61.946 1.00 25.90 H new ATOM 0 HB3 GLN A 161 18.383 27.434 61.571 1.00 25.90 H new ATOM 0 HG2 GLN A 161 18.901 27.871 63.708 1.00 29.17 H new ATOM 0 HG3 GLN A 161 17.575 27.254 64.250 1.00 29.17 H new ATOM 0 HE21 GLN A 161 19.128 26.270 65.810 1.00 34.33 H new ATOM 0 HE22 GLN A 161 19.763 24.962 65.484 1.00 34.33 H new ATOM 1380 N GLU A 162 15.381 28.149 59.935 1.00 20.25 N ATOM 1381 CA GLU A 162 15.104 28.618 58.583 1.00 19.45 C ATOM 1382 C GLU A 162 14.017 29.700 58.513 1.00 17.70 C ATOM 1383 O GLU A 162 14.175 30.679 57.784 1.00 17.52 O ATOM 1384 CB GLU A 162 14.736 27.434 57.683 1.00 21.14 C ATOM 1385 CG GLU A 162 14.495 27.844 56.242 1.00 24.12 C ATOM 1386 CD GLU A 162 14.032 26.722 55.326 1.00 25.92 C ATOM 1387 OE1 GLU A 162 13.845 25.554 55.767 1.00 26.19 O ATOM 1388 OE2 GLU A 162 13.858 27.035 54.131 1.00 27.86 O ATOM 0 H GLU A 162 14.881 27.499 60.193 1.00 20.25 H new ATOM 0 HA GLU A 162 15.919 29.037 58.266 1.00 19.45 H new ATOM 0 HB2 GLU A 162 15.448 26.776 57.713 1.00 21.14 H new ATOM 0 HB3 GLU A 162 13.939 27.004 58.030 1.00 21.14 H new ATOM 0 HG2 GLU A 162 13.831 28.551 56.227 1.00 24.12 H new ATOM 0 HG3 GLU A 162 15.315 28.218 55.884 1.00 24.12 H new ATOM 1389 N ILE A 163 12.928 29.498 59.252 1.00 16.50 N ATOM 1390 CA ILE A 163 11.719 30.313 59.108 1.00 15.96 C ATOM 1391 C ILE A 163 11.373 31.060 60.401 1.00 15.70 C ATOM 1392 O ILE A 163 11.211 30.444 61.464 1.00 16.47 O ATOM 1393 CB ILE A 163 10.506 29.450 58.664 1.00 16.03 C ATOM 1394 CG1 ILE A 163 10.802 28.703 57.349 1.00 15.95 C ATOM 1395 CG2 ILE A 163 9.225 30.279 58.582 1.00 16.09 C ATOM 1396 CD1 ILE A 163 11.004 29.574 56.122 1.00 15.48 C ATOM 0 H ILE A 163 12.868 28.885 59.852 1.00 16.50 H new ATOM 0 HA ILE A 163 11.909 30.969 58.419 1.00 15.96 H new ATOM 0 HB ILE A 163 10.358 28.776 59.346 1.00 16.03 H new ATOM 0 HG12 ILE A 163 11.598 28.164 57.476 1.00 15.95 H new ATOM 0 HG13 ILE A 163 10.070 28.091 57.173 1.00 15.95 H new ATOM 0 HG21 ILE A 163 8.489 29.712 58.303 1.00 16.09 H new ATOM 0 HG22 ILE A 163 9.028 30.658 59.453 1.00 16.09 H new ATOM 0 HG23 ILE A 163 9.343 30.995 57.938 1.00 16.09 H new ATOM 0 HD11 ILE A 163 11.183 29.012 55.352 1.00 15.48 H new ATOM 0 HD12 ILE A 163 10.203 30.097 55.961 1.00 15.48 H new ATOM 0 HD13 ILE A 163 11.755 30.170 56.268 1.00 15.48 H new ATOM 1397 N ALA A 164 11.262 32.385 60.280 1.00 15.16 N ATOM 1398 CA ALA A 164 10.901 33.256 61.413 1.00 15.26 C ATOM 1399 C ALA A 164 9.402 33.312 61.666 1.00 15.57 C ATOM 1400 O ALA A 164 8.969 33.388 62.815 1.00 16.65 O ATOM 1401 CB ALA A 164 11.431 34.662 61.187 1.00 14.73 C ATOM 0 H ALA A 164 11.393 32.807 59.542 1.00 15.16 H new ATOM 0 HA ALA A 164 11.312 32.867 62.201 1.00 15.26 H new ATOM 0 HB1 ALA A 164 11.187 35.225 61.939 1.00 14.73 H new ATOM 0 HB2 ALA A 164 12.397 34.634 61.104 1.00 14.73 H new ATOM 0 HB3 ALA A 164 11.048 35.026 60.374 1.00 14.73 H new ATOM 1402 N ASP A 165 8.597 33.299 60.611 1.00 15.05 N ATOM 1403 CA ASP A 165 7.158 33.491 60.768 1.00 14.41 C ATOM 1404 C ASP A 165 6.393 32.887 59.607 1.00 14.10 C ATOM 1405 O ASP A 165 6.942 32.698 58.513 1.00 13.77 O ATOM 1406 CB ASP A 165 6.831 34.991 60.920 1.00 14.92 C ATOM 1407 CG ASP A 165 5.502 35.254 61.644 1.00 15.44 C ATOM 1408 OD1 ASP A 165 4.873 34.317 62.167 1.00 16.23 O ATOM 1409 OD2 ASP A 165 5.087 36.435 61.666 1.00 16.32 O ATOM 0 H ASP A 165 8.860 33.182 59.801 1.00 15.05 H new ATOM 0 HA ASP A 165 6.878 33.031 61.575 1.00 14.41 H new ATOM 0 HB2 ASP A 165 7.549 35.424 61.408 1.00 14.92 H new ATOM 0 HB3 ASP A 165 6.799 35.399 60.041 1.00 14.92 H new ATOM 1410 N LEU A 166 5.140 32.552 59.882 1.00 14.15 N ATOM 1411 CA LEU A 166 4.204 32.038 58.913 1.00 13.71 C ATOM 1412 C LEU A 166 2.873 32.702 59.182 1.00 14.77 C ATOM 1413 O LEU A 166 2.372 32.680 60.322 1.00 15.58 O ATOM 1414 CB LEU A 166 4.081 30.516 59.047 1.00 13.70 C ATOM 1415 CG LEU A 166 3.094 29.786 58.120 1.00 12.96 C ATOM 1416 CD1 LEU A 166 3.510 28.336 57.951 1.00 13.59 C ATOM 1417 CD2 LEU A 166 1.657 29.867 58.639 1.00 13.61 C ATOM 0 H LEU A 166 4.805 32.623 60.671 1.00 14.15 H new ATOM 0 HA LEU A 166 4.504 32.228 58.010 1.00 13.71 H new ATOM 0 HB2 LEU A 166 4.961 30.133 58.904 1.00 13.70 H new ATOM 0 HB3 LEU A 166 3.830 30.318 59.963 1.00 13.70 H new ATOM 0 HG LEU A 166 3.118 30.230 57.258 1.00 12.96 H new ATOM 0 HD11 LEU A 166 2.882 27.885 57.365 1.00 13.59 H new ATOM 0 HD12 LEU A 166 4.398 28.297 57.563 1.00 13.59 H new ATOM 0 HD13 LEU A 166 3.516 27.898 58.816 1.00 13.59 H new ATOM 0 HD21 LEU A 166 1.066 29.397 58.030 1.00 13.61 H new ATOM 0 HD22 LEU A 166 1.607 29.459 59.518 1.00 13.61 H new ATOM 0 HD23 LEU A 166 1.386 30.797 58.699 1.00 13.61 H new ATOM 1418 N GLN A 167 2.299 33.289 58.147 1.00 14.41 N ATOM 1419 CA GLN A 167 0.969 33.884 58.251 1.00 15.00 C ATOM 1420 C GLN A 167 0.176 33.668 56.978 1.00 14.99 C ATOM 1421 O GLN A 167 0.752 33.364 55.909 1.00 14.95 O ATOM 1422 CB GLN A 167 1.047 35.389 58.543 1.00 16.98 C ATOM 1423 CG GLN A 167 1.672 35.762 59.881 1.00 18.87 C ATOM 1424 CD GLN A 167 1.762 37.261 60.101 1.00 21.32 C ATOM 1425 OE1 GLN A 167 0.956 38.037 59.571 1.00 23.15 O ATOM 1426 NE2 GLN A 167 2.757 37.680 60.879 1.00 23.24 N ATOM 0 H GLN A 167 2.661 33.356 57.370 1.00 14.41 H new ATOM 0 HA GLN A 167 0.520 33.443 58.989 1.00 15.00 H new ATOM 0 HB2 GLN A 167 1.556 35.815 57.835 1.00 16.98 H new ATOM 0 HB3 GLN A 167 0.150 35.757 58.508 1.00 16.98 H new ATOM 0 HG2 GLN A 167 1.150 35.367 60.597 1.00 18.87 H new ATOM 0 HG3 GLN A 167 2.562 35.379 59.934 1.00 18.87 H new ATOM 0 HE21 GLN A 167 3.297 37.111 61.230 1.00 23.24 H new ATOM 0 HE22 GLN A 167 2.860 38.520 61.031 1.00 23.24 H new ATOM 1427 N PHE A 168 -1.138 33.849 57.076 1.00 14.72 N ATOM 1428 CA PHE A 168 -2.033 33.837 55.931 1.00 14.48 C ATOM 1429 C PHE A 168 -2.448 35.260 55.580 1.00 15.60 C ATOM 1430 O PHE A 168 -2.773 36.072 56.471 1.00 15.88 O ATOM 1431 CB PHE A 168 -3.253 32.953 56.201 1.00 14.41 C ATOM 1432 CG PHE A 168 -2.950 31.480 56.131 1.00 14.66 C ATOM 1433 CD1 PHE A 168 -2.335 30.824 57.186 1.00 14.93 C ATOM 1434 CD2 PHE A 168 -3.245 30.760 54.979 1.00 14.33 C ATOM 1435 CE1 PHE A 168 -2.029 29.471 57.095 1.00 15.57 C ATOM 1436 CE2 PHE A 168 -2.958 29.414 54.885 1.00 15.19 C ATOM 1437 CZ PHE A 168 -2.343 28.762 55.941 1.00 15.17 C ATOM 0 H PHE A 168 -1.539 33.984 57.825 1.00 14.72 H new ATOM 0 HA PHE A 168 -1.563 33.459 55.171 1.00 14.48 H new ATOM 0 HB2 PHE A 168 -3.608 33.162 57.079 1.00 14.41 H new ATOM 0 HB3 PHE A 168 -3.947 33.165 55.557 1.00 14.41 H new ATOM 0 HD1 PHE A 168 -2.125 31.293 57.961 1.00 14.93 H new ATOM 0 HD2 PHE A 168 -3.643 31.194 54.259 1.00 14.33 H new ATOM 0 HE1 PHE A 168 -1.614 29.040 57.807 1.00 15.57 H new ATOM 0 HE2 PHE A 168 -3.177 28.944 54.113 1.00 15.19 H new ATOM 0 HZ PHE A 168 -2.141 27.856 55.879 1.00 15.17 H new ATOM 1438 N PHE A 169 -2.448 35.563 54.281 1.00 14.97 N ATOM 1439 CA PHE A 169 -2.723 36.920 53.787 1.00 15.10 C ATOM 1440 C PHE A 169 -3.805 36.930 52.728 1.00 16.23 C ATOM 1441 O PHE A 169 -3.836 36.066 51.844 1.00 16.35 O ATOM 1442 CB PHE A 169 -1.452 37.541 53.197 1.00 15.22 C ATOM 1443 CG PHE A 169 -0.344 37.712 54.183 1.00 14.82 C ATOM 1444 CD1 PHE A 169 0.559 36.682 54.423 1.00 14.57 C ATOM 1445 CD2 PHE A 169 -0.182 38.919 54.865 1.00 14.58 C ATOM 1446 CE1 PHE A 169 1.604 36.851 55.322 1.00 13.86 C ATOM 1447 CE2 PHE A 169 0.854 39.084 55.776 1.00 14.17 C ATOM 1448 CZ PHE A 169 1.756 38.048 56.005 1.00 14.31 C ATOM 0 H PHE A 169 -2.289 34.990 53.660 1.00 14.97 H new ATOM 0 HA PHE A 169 -3.029 37.439 54.547 1.00 15.10 H new ATOM 0 HB2 PHE A 169 -1.140 36.983 52.467 1.00 15.22 H new ATOM 0 HB3 PHE A 169 -1.672 38.407 52.819 1.00 15.22 H new ATOM 0 HD1 PHE A 169 0.462 35.872 53.977 1.00 14.57 H new ATOM 0 HD2 PHE A 169 -0.773 39.620 54.708 1.00 14.58 H new ATOM 0 HE1 PHE A 169 2.206 36.157 55.467 1.00 13.86 H new ATOM 0 HE2 PHE A 169 0.945 39.888 56.234 1.00 14.17 H new ATOM 0 HZ PHE A 169 2.454 38.158 56.610 1.00 14.31 H new ATOM 1449 N ALA A 170 -4.690 37.923 52.791 1.00 17.91 N ATOM 1450 CA ALA A 170 -5.649 38.129 51.719 1.00 18.04 C ATOM 1451 C ALA A 170 -4.938 38.501 50.424 1.00 18.69 C ATOM 1452 O ALA A 170 -3.899 39.151 50.459 1.00 18.23 O ATOM 1453 CB ALA A 170 -6.663 39.205 52.095 1.00 19.10 C ATOM 0 H ALA A 170 -4.749 38.482 53.442 1.00 17.91 H new ATOM 0 HA ALA A 170 -6.126 37.296 51.581 1.00 18.04 H new ATOM 0 HB1 ALA A 170 -7.292 39.326 51.367 1.00 19.10 H new ATOM 0 HB2 ALA A 170 -7.142 38.934 52.894 1.00 19.10 H new ATOM 0 HB3 ALA A 170 -6.201 40.041 52.264 1.00 19.10 H new ATOM 1454 N ILE A 171 -5.532 38.089 49.302 1.00 19.63 N ATOM 1455 CA ILE A 171 -5.017 38.362 47.955 1.00 21.69 C ATOM 1456 C ILE A 171 -4.767 39.852 47.723 1.00 21.84 C ATOM 1457 O ILE A 171 -3.830 40.226 47.023 1.00 22.23 O ATOM 1458 CB ILE A 171 -5.955 37.774 46.858 1.00 22.59 C ATOM 1459 CG1 ILE A 171 -5.293 37.825 45.478 1.00 23.50 C ATOM 1460 CG2 ILE A 171 -7.317 38.470 46.832 1.00 24.20 C ATOM 1461 CD1 ILE A 171 -4.141 36.870 45.316 1.00 24.40 C ATOM 0 H ILE A 171 -6.261 37.633 49.302 1.00 19.63 H new ATOM 0 HA ILE A 171 -4.159 37.915 47.887 1.00 21.69 H new ATOM 0 HB ILE A 171 -6.109 36.844 47.088 1.00 22.59 H new ATOM 0 HG12 ILE A 171 -5.961 37.630 44.802 1.00 23.50 H new ATOM 0 HG13 ILE A 171 -4.978 38.728 45.314 1.00 23.50 H new ATOM 0 HG21 ILE A 171 -7.869 38.076 46.138 1.00 24.20 H new ATOM 0 HG22 ILE A 171 -7.753 38.361 47.692 1.00 24.20 H new ATOM 0 HG23 ILE A 171 -7.194 39.415 46.650 1.00 24.20 H new ATOM 0 HD11 ILE A 171 -3.772 36.956 44.423 1.00 24.40 H new ATOM 0 HD12 ILE A 171 -3.455 37.076 45.970 1.00 24.40 H new ATOM 0 HD13 ILE A 171 -4.452 35.961 45.450 1.00 24.40 H new ATOM 1462 N ASP A 172 -5.609 40.688 48.331 1.00 22.94 N ATOM 1463 CA ASP A 172 -5.518 42.147 48.187 1.00 23.94 C ATOM 1464 C ASP A 172 -4.850 42.849 49.382 1.00 23.82 C ATOM 1465 O ASP A 172 -4.911 44.075 49.508 1.00 24.91 O ATOM 1466 CB ASP A 172 -6.916 42.733 47.928 1.00 25.20 C ATOM 1467 CG ASP A 172 -7.857 42.554 49.105 1.00 26.80 C ATOM 1468 OD1 ASP A 172 -7.675 41.619 49.910 1.00 26.02 O ATOM 1469 OD2 ASP A 172 -8.799 43.364 49.233 1.00 28.72 O ATOM 0 H ASP A 172 -6.251 40.427 48.840 1.00 22.94 H new ATOM 0 HA ASP A 172 -4.940 42.315 47.426 1.00 23.94 H new ATOM 0 HB2 ASP A 172 -6.833 43.678 47.726 1.00 25.20 H new ATOM 0 HB3 ASP A 172 -7.300 42.308 47.145 1.00 25.20 H new ATOM 1470 N GLN A 173 -4.230 42.069 50.264 1.00 23.34 N ATOM 1471 CA GLN A 173 -3.518 42.612 51.422 1.00 22.70 C ATOM 1472 C GLN A 173 -2.171 41.909 51.575 1.00 19.67 C ATOM 1473 O GLN A 173 -1.812 41.435 52.667 1.00 19.61 O ATOM 1474 CB GLN A 173 -4.342 42.426 52.699 1.00 25.84 C ATOM 1475 CG GLN A 173 -5.614 43.258 52.777 1.00 29.41 C ATOM 1476 CD GLN A 173 -6.487 42.856 53.950 1.00 32.87 C ATOM 1477 OE1 GLN A 173 -6.010 42.740 55.083 1.00 36.53 O ATOM 1478 NE2 GLN A 173 -7.775 42.632 53.686 1.00 34.48 N ATOM 0 H GLN A 173 -4.209 41.211 50.209 1.00 23.34 H new ATOM 0 HA GLN A 173 -3.376 43.561 51.279 1.00 22.70 H new ATOM 0 HB2 GLN A 173 -4.580 41.489 52.779 1.00 25.84 H new ATOM 0 HB3 GLN A 173 -3.783 42.643 53.462 1.00 25.84 H new ATOM 0 HG2 GLN A 173 -5.381 44.196 52.855 1.00 29.41 H new ATOM 0 HG3 GLN A 173 -6.116 43.158 51.953 1.00 29.41 H new ATOM 0 HE21 GLN A 173 -8.072 42.723 52.884 1.00 34.48 H new ATOM 0 HE22 GLN A 173 -8.309 42.397 54.318 1.00 34.48 H new ATOM 1479 N LEU A 174 -1.430 41.845 50.472 1.00 18.24 N ATOM 1480 CA LEU A 174 -0.151 41.140 50.479 1.00 17.08 C ATOM 1481 C LEU A 174 0.922 41.962 51.162 1.00 16.26 C ATOM 1482 O LEU A 174 0.927 43.200 51.056 1.00 17.81 O ATOM 1483 CB LEU A 174 0.295 40.786 49.057 1.00 16.73 C ATOM 1484 CG LEU A 174 -0.606 39.820 48.284 1.00 16.57 C ATOM 1485 CD1 LEU A 174 -0.221 39.775 46.806 1.00 17.13 C ATOM 1486 CD2 LEU A 174 -0.605 38.416 48.882 1.00 17.02 C ATOM 0 H LEU A 174 -1.646 42.198 49.718 1.00 18.24 H new ATOM 0 HA LEU A 174 -0.279 40.318 50.978 1.00 17.08 H new ATOM 0 HB2 LEU A 174 0.368 41.608 48.547 1.00 16.73 H new ATOM 0 HB3 LEU A 174 1.184 40.401 49.104 1.00 16.73 H new ATOM 0 HG LEU A 174 -1.510 40.162 48.360 1.00 16.57 H new ATOM 0 HD11 LEU A 174 -0.805 39.158 46.338 1.00 17.13 H new ATOM 0 HD12 LEU A 174 -0.312 40.660 46.421 1.00 17.13 H new ATOM 0 HD13 LEU A 174 0.699 39.478 46.720 1.00 17.13 H new ATOM 0 HD21 LEU A 174 -1.188 37.842 48.361 1.00 17.02 H new ATOM 0 HD22 LEU A 174 0.297 38.059 48.868 1.00 17.02 H new ATOM 0 HD23 LEU A 174 -0.924 38.454 49.797 1.00 17.02 H new ATOM 1487 N PRO A 175 1.845 41.285 51.866 1.00 15.24 N ATOM 1488 CA PRO A 175 2.932 41.962 52.527 1.00 14.33 C ATOM 1489 C PRO A 175 4.076 42.234 51.535 1.00 14.09 C ATOM 1490 O PRO A 175 3.927 42.008 50.330 1.00 14.70 O ATOM 1491 CB PRO A 175 3.371 40.934 53.569 1.00 14.14 C ATOM 1492 CG PRO A 175 3.189 39.625 52.851 1.00 14.16 C ATOM 1493 CD PRO A 175 1.956 39.813 52.014 1.00 14.62 C ATOM 0 HA PRO A 175 2.686 42.822 52.902 1.00 14.33 H new ATOM 0 HB2 PRO A 175 4.292 41.069 53.841 1.00 14.14 H new ATOM 0 HB3 PRO A 175 2.828 40.982 54.372 1.00 14.14 H new ATOM 0 HG2 PRO A 175 3.960 39.416 52.300 1.00 14.16 H new ATOM 0 HG3 PRO A 175 3.081 38.892 53.477 1.00 14.16 H new ATOM 0 HD2 PRO A 175 2.041 39.375 51.153 1.00 14.62 H new ATOM 0 HD3 PRO A 175 1.172 39.439 52.447 1.00 14.62 H new ATOM 1494 N AASN A 176 5.202 42.736 52.033 0.50 14.12 N ATOM 1495 N BASN A 176 5.181 42.738 52.068 0.50 14.47 N ATOM 1496 CA AASN A 176 6.370 42.929 51.179 0.50 13.87 C ATOM 1497 CA BASN A 176 6.431 42.857 51.352 0.50 14.42 C ATOM 1498 C AASN A 176 7.004 41.583 50.844 0.50 13.26 C ATOM 1499 C BASN A 176 6.819 41.463 50.860 0.50 13.52 C ATOM 1500 O AASN A 176 7.444 40.833 51.712 0.50 12.83 O ATOM 1501 O BASN A 176 6.891 40.534 51.663 0.50 13.36 O ATOM 1502 CB AASN A 176 7.386 43.886 51.791 0.50 14.44 C ATOM 1503 CB BASN A 176 7.488 43.369 52.321 0.50 15.61 C ATOM 1504 CG AASN A 176 7.895 43.414 53.128 0.50 15.24 C ATOM 1505 CG BASN A 176 8.775 43.719 51.636 0.50 16.87 C ATOM 1506 OD1AASN A 176 9.102 43.334 53.350 0.50 16.01 O ATOM 1507 OD1BASN A 176 8.765 44.222 50.518 0.50 18.51 O ATOM 1508 ND2AASN A 176 6.978 43.103 54.030 0.50 16.06 N ATOM 1509 ND2BASN A 176 9.891 43.443 52.289 0.50 17.67 N ATOM 0 H AASN A 176 5.310 42.969 52.854 0.50 14.47 H new ATOM 0 H BASN A 176 5.221 43.026 52.877 0.50 14.47 H new ATOM 0 HA AASN A 176 6.067 43.344 50.356 0.50 14.42 H new ATOM 0 HA BASN A 176 6.354 43.467 50.602 0.50 14.42 H new ATOM 0 HB2AASN A 176 8.134 43.990 51.183 0.50 15.61 H new ATOM 0 HB2BASN A 176 7.148 44.151 52.782 0.50 15.61 H new ATOM 0 HB3AASN A 176 6.980 44.761 51.894 0.50 15.61 H new ATOM 0 HB3BASN A 176 7.658 42.693 52.996 0.50 15.61 H new ATOM 0 HD21AASN A 176 7.217 42.832 54.810 0.50 17.67 H new ATOM 0 HD21BASN A 176 10.653 43.617 51.930 0.50 17.67 H new ATOM 0 HD22AASN A 176 6.143 43.172 53.836 0.50 17.67 H new ATOM 0 HD22BASN A 176 9.855 43.090 53.072 0.50 17.67 H new ATOM 1510 N LEU A 177 7.034 41.316 49.553 1.00 13.23 N ATOM 1511 CA LEU A 177 7.413 40.018 49.010 1.00 13.00 C ATOM 1512 C LEU A 177 8.886 39.919 48.709 1.00 12.38 C ATOM 1513 O LEU A 177 9.536 40.901 48.340 1.00 12.96 O ATOM 1514 CB LEU A 177 6.634 39.754 47.735 1.00 12.84 C ATOM 1515 CG LEU A 177 5.113 39.728 47.877 1.00 12.86 C ATOM 1516 CD1 LEU A 177 4.434 39.592 46.536 1.00 13.70 C ATOM 1517 CD2 LEU A 177 4.676 38.619 48.818 1.00 12.57 C ATOM 0 H ALEU A 177 6.831 41.895 48.950 0.50 13.23 H new ATOM 0 H BLEU A 177 6.966 41.947 48.973 0.50 13.23 H new ATOM 0 HA LEU A 177 7.206 39.356 49.688 1.00 13.00 H new ATOM 0 HB2 LEU A 177 6.869 40.435 47.086 1.00 12.84 H new ATOM 0 HB3 LEU A 177 6.922 38.903 47.371 1.00 12.84 H new ATOM 0 HG LEU A 177 4.841 40.577 48.259 1.00 12.86 H new ATOM 0 HD11 LEU A 177 3.472 39.579 46.660 1.00 13.70 H new ATOM 0 HD12 LEU A 177 4.676 40.343 45.973 1.00 13.70 H new ATOM 0 HD13 LEU A 177 4.716 38.766 46.112 1.00 13.70 H new ATOM 0 HD21 LEU A 177 3.709 38.621 48.893 1.00 12.57 H new ATOM 0 HD22 LEU A 177 4.971 37.763 48.469 1.00 12.57 H new ATOM 0 HD23 LEU A 177 5.068 38.764 49.693 1.00 12.57 H new ATOM 1518 N SER A 178 9.414 38.711 48.869 1.00 12.14 N ATOM 1519 CA SER A 178 10.777 38.397 48.459 1.00 12.07 C ATOM 1520 C SER A 178 10.706 38.109 46.962 1.00 11.75 C ATOM 1521 O SER A 178 10.440 36.979 46.541 1.00 11.58 O ATOM 1522 CB SER A 178 11.262 37.174 49.230 1.00 11.98 C ATOM 1523 OG SER A 178 12.574 36.807 48.828 1.00 14.50 O ATOM 0 H SER A 178 8.991 38.049 49.219 1.00 12.14 H new ATOM 0 HA SER A 178 11.397 39.121 48.640 1.00 12.07 H new ATOM 0 HB2 SER A 178 11.252 37.362 50.181 1.00 11.98 H new ATOM 0 HB3 SER A 178 10.655 36.432 49.082 1.00 11.98 H new ATOM 0 HG SER A 178 12.880 37.388 48.304 1.00 14.50 H new ATOM 1524 N GLU A 179 10.918 39.138 46.150 1.00 11.92 N ATOM 1525 CA GLU A 179 10.571 39.094 44.744 1.00 12.10 C ATOM 1526 C GLU A 179 11.379 38.085 43.927 1.00 10.80 C ATOM 1527 O GLU A 179 10.874 37.578 42.928 1.00 10.69 O ATOM 1528 CB GLU A 179 10.650 40.482 44.118 1.00 13.83 C ATOM 1529 CG GLU A 179 9.524 41.389 44.608 1.00 17.20 C ATOM 1530 CD GLU A 179 9.479 42.727 43.913 1.00 20.56 C ATOM 1531 OE1 GLU A 179 10.442 43.496 44.081 1.00 23.89 O ATOM 1532 OE2 GLU A 179 8.473 43.014 43.214 1.00 23.12 O ATOM 0 H GLU A 179 11.268 39.881 46.403 1.00 11.92 H new ATOM 0 HA GLU A 179 9.654 38.780 44.715 1.00 12.10 H new ATOM 0 HB2 GLU A 179 11.506 40.885 44.331 1.00 13.83 H new ATOM 0 HB3 GLU A 179 10.606 40.404 43.152 1.00 13.83 H new ATOM 0 HG2 GLU A 179 8.676 40.937 44.478 1.00 17.20 H new ATOM 0 HG3 GLU A 179 9.626 41.532 45.562 1.00 17.20 H new ATOM 1533 N LYS A 180 12.596 37.766 44.364 1.00 10.61 N ATOM 1534 CA LYS A 180 13.393 36.749 43.667 1.00 10.61 C ATOM 1535 C LYS A 180 12.774 35.372 43.836 1.00 10.17 C ATOM 1536 O LYS A 180 13.085 34.460 43.060 1.00 10.14 O ATOM 1537 CB LYS A 180 14.841 36.753 44.167 1.00 11.41 C ATOM 1538 CG LYS A 180 15.587 38.072 43.958 1.00 12.30 C ATOM 1539 CD LYS A 180 15.978 38.303 42.510 1.00 12.58 C ATOM 1540 CE LYS A 180 16.665 39.658 42.398 1.00 13.37 C ATOM 1541 NZ LYS A 180 17.539 39.764 41.204 1.00 13.19 N ATOM 0 H LYS A 180 12.976 38.118 45.050 1.00 10.61 H new ATOM 0 HA LYS A 180 13.398 36.968 42.722 1.00 10.61 H new ATOM 0 HB2 LYS A 180 14.844 36.541 45.113 1.00 11.41 H new ATOM 0 HB3 LYS A 180 15.328 36.045 43.716 1.00 11.41 H new ATOM 0 HG2 LYS A 180 15.029 38.806 44.259 1.00 12.30 H new ATOM 0 HG3 LYS A 180 16.385 38.078 44.509 1.00 12.30 H new ATOM 0 HD2 LYS A 180 16.572 37.599 42.206 1.00 12.58 H new ATOM 0 HD3 LYS A 180 15.192 38.277 41.942 1.00 12.58 H new ATOM 0 HE2 LYS A 180 15.992 40.355 42.363 1.00 13.37 H new ATOM 0 HE3 LYS A 180 17.194 39.814 43.196 1.00 13.37 H new ATOM 0 HZ1 LYS A 180 17.683 40.622 41.016 1.00 13.19 H new ATOM 0 HZ2 LYS A 180 18.316 39.362 41.368 1.00 13.19 H new ATOM 0 HZ3 LYS A 180 17.143 39.371 40.510 1.00 13.19 H new ATOM 1542 N ARG A 181 11.870 35.234 44.811 1.00 9.63 N ATOM 1543 CA ARG A 181 11.169 33.970 45.088 1.00 9.73 C ATOM 1544 C ARG A 181 9.729 33.939 44.612 1.00 9.11 C ATOM 1545 O ARG A 181 9.255 32.896 44.135 1.00 8.76 O ATOM 1546 CB ARG A 181 11.221 33.640 46.581 1.00 10.30 C ATOM 1547 CG ARG A 181 12.639 33.497 47.086 1.00 11.94 C ATOM 1548 CD ARG A 181 12.713 33.320 48.587 1.00 14.50 C ATOM 1549 NE ARG A 181 14.102 33.477 48.985 1.00 16.68 N ATOM 1550 CZ ARG A 181 14.514 33.790 50.204 1.00 17.23 C ATOM 1551 NH1 ARG A 181 13.636 33.943 51.181 1.00 18.80 N ATOM 1552 NH2 ARG A 181 15.813 33.918 50.456 1.00 19.67 N ATOM 0 H ARG A 181 11.643 35.876 45.336 1.00 9.63 H new ATOM 0 HA ARG A 181 11.644 33.297 44.576 1.00 9.73 H new ATOM 0 HB2 ARG A 181 10.770 34.339 47.081 1.00 10.30 H new ATOM 0 HB3 ARG A 181 10.736 32.816 46.745 1.00 10.30 H new ATOM 0 HG2 ARG A 181 13.056 32.735 46.654 1.00 11.94 H new ATOM 0 HG3 ARG A 181 13.149 34.282 46.832 1.00 11.94 H new ATOM 0 HD2 ARG A 181 12.155 33.975 49.034 1.00 14.50 H new ATOM 0 HD3 ARG A 181 12.383 32.444 48.843 1.00 14.50 H new ATOM 0 HE ARG A 181 14.703 33.357 48.382 1.00 16.68 H new ATOM 0 HH11 ARG A 181 12.797 33.839 51.025 1.00 18.80 H new ATOM 0 HH12 ARG A 181 13.904 34.146 51.972 1.00 18.80 H new ATOM 0 HH21 ARG A 181 16.387 33.798 49.827 1.00 19.67 H new ATOM 0 HH22 ARG A 181 16.079 34.121 51.248 1.00 19.67 H new ATOM 1553 N ILE A 182 9.025 35.068 44.721 1.00 9.24 N ATOM 1554 CA ILE A 182 7.664 35.177 44.226 1.00 9.43 C ATOM 1555 C ILE A 182 7.318 36.648 44.101 1.00 9.67 C ATOM 1556 O ILE A 182 7.742 37.452 44.942 1.00 10.37 O ATOM 1557 CB ILE A 182 6.633 34.430 45.134 1.00 9.26 C ATOM 1558 CG1 ILE A 182 5.387 34.031 44.335 1.00 9.54 C ATOM 1559 CG2 ILE A 182 6.294 35.236 46.401 1.00 9.90 C ATOM 1560 CD1 ILE A 182 5.609 32.949 43.284 1.00 10.43 C ATOM 0 H ILE A 182 9.327 35.787 45.084 1.00 9.24 H new ATOM 0 HA ILE A 182 7.613 34.746 43.359 1.00 9.43 H new ATOM 0 HB ILE A 182 7.047 33.609 45.443 1.00 9.26 H new ATOM 0 HG12 ILE A 182 4.707 33.725 44.955 1.00 9.54 H new ATOM 0 HG13 ILE A 182 5.035 34.821 43.896 1.00 9.54 H new ATOM 0 HG21 ILE A 182 5.654 34.742 46.937 1.00 9.90 H new ATOM 0 HG22 ILE A 182 7.102 35.383 46.917 1.00 9.90 H new ATOM 0 HG23 ILE A 182 5.912 36.091 46.148 1.00 9.90 H new ATOM 0 HD11 ILE A 182 4.772 32.761 42.831 1.00 10.43 H new ATOM 0 HD12 ILE A 182 6.265 33.255 42.638 1.00 10.43 H new ATOM 0 HD13 ILE A 182 5.931 32.141 43.714 1.00 10.43 H new ATOM 1561 N THR A 183 6.580 36.989 43.057 1.00 9.75 N ATOM 1562 CA THR A 183 6.161 38.383 42.864 1.00 10.47 C ATOM 1563 C THR A 183 4.651 38.531 43.026 1.00 10.72 C ATOM 1564 O THR A 183 3.891 37.560 42.929 1.00 10.42 O ATOM 1565 CB THR A 183 6.564 38.947 41.482 1.00 10.83 C ATOM 1566 OG1 THR A 183 5.775 38.325 40.463 1.00 10.86 O ATOM 1567 CG2 THR A 183 8.053 38.734 41.179 1.00 11.44 C ATOM 0 H THR A 183 6.310 36.442 42.451 1.00 9.75 H new ATOM 0 HA THR A 183 6.624 38.891 43.548 1.00 10.47 H new ATOM 0 HB THR A 183 6.403 39.903 41.498 1.00 10.83 H new ATOM 0 HG1 THR A 183 6.087 38.521 39.708 1.00 10.86 H new ATOM 0 HG21 THR A 183 8.262 39.101 40.306 1.00 11.44 H new ATOM 0 HG22 THR A 183 8.588 39.181 41.854 1.00 11.44 H new ATOM 0 HG23 THR A 183 8.252 37.785 41.186 1.00 11.44 H new ATOM 1568 N LYS A 184 4.198 39.775 43.178 1.00 11.51 N ATOM 1569 CA LYS A 184 2.770 40.048 43.272 1.00 12.19 C ATOM 1570 C LYS A 184 2.036 39.613 42.006 1.00 11.83 C ATOM 1571 O LYS A 184 0.936 39.036 42.066 1.00 12.08 O ATOM 1572 CB LYS A 184 2.548 41.538 43.554 1.00 13.29 C ATOM 1573 CG LYS A 184 1.080 41.915 43.678 1.00 14.76 C ATOM 1574 CD LYS A 184 0.931 43.350 44.179 1.00 16.97 C ATOM 1575 CE LYS A 184 -0.523 43.766 44.189 1.00 19.00 C ATOM 1576 NZ LYS A 184 -0.649 45.062 44.917 1.00 21.74 N ATOM 0 H LYS A 184 4.701 40.471 43.228 1.00 11.51 H new ATOM 0 HA LYS A 184 2.403 39.531 44.006 1.00 12.19 H new ATOM 0 HB2 LYS A 184 3.007 41.777 44.374 1.00 13.29 H new ATOM 0 HB3 LYS A 184 2.950 42.059 42.841 1.00 13.29 H new ATOM 0 HG2 LYS A 184 0.644 41.821 42.817 1.00 14.76 H new ATOM 0 HG3 LYS A 184 0.636 41.307 44.289 1.00 14.76 H new ATOM 0 HD2 LYS A 184 1.300 43.425 45.073 1.00 16.97 H new ATOM 0 HD3 LYS A 184 1.440 43.950 43.611 1.00 16.97 H new ATOM 0 HE2 LYS A 184 -0.852 43.858 43.281 1.00 19.00 H new ATOM 0 HE3 LYS A 184 -1.064 43.085 44.619 1.00 19.00 H new ATOM 0 HZ1 LYS A 184 -1.499 45.194 45.144 1.00 21.74 H new ATOM 0 HZ2 LYS A 184 -0.146 45.041 45.651 1.00 21.74 H new ATOM 0 HZ3 LYS A 184 -0.377 45.726 44.391 1.00 21.74 H new ATOM 1577 N GLU A 185 2.651 39.864 40.853 1.00 12.39 N ATOM 1578 CA GLU A 185 2.049 39.454 39.610 1.00 12.25 C ATOM 1579 C GLU A 185 1.861 37.932 39.565 1.00 11.47 C ATOM 1580 O GLU A 185 0.827 37.447 39.122 1.00 12.05 O ATOM 1581 CB GLU A 185 2.895 39.915 38.423 1.00 14.47 C ATOM 1582 CG GLU A 185 2.234 39.605 37.103 1.00 17.34 C ATOM 1583 CD GLU A 185 3.073 39.959 35.896 1.00 19.08 C ATOM 1584 OE1 GLU A 185 4.252 40.344 36.047 1.00 21.85 O ATOM 1585 OE2 GLU A 185 2.537 39.836 34.772 1.00 22.68 O ATOM 0 H GLU A 185 3.408 40.266 40.778 1.00 12.39 H new ATOM 0 HA GLU A 185 1.176 39.872 39.551 1.00 12.25 H new ATOM 0 HB2 GLU A 185 3.050 40.870 38.489 1.00 14.47 H new ATOM 0 HB3 GLU A 185 3.763 39.483 38.458 1.00 14.47 H new ATOM 0 HG2 GLU A 185 2.023 38.659 37.072 1.00 17.34 H new ATOM 0 HG3 GLU A 185 1.393 40.085 37.053 1.00 17.34 H new ATOM 1586 N GLN A 186 2.862 37.186 40.024 1.00 10.59 N ATOM 1587 CA GLN A 186 2.734 35.741 40.036 1.00 9.91 C ATOM 1588 C GLN A 186 1.618 35.309 40.984 1.00 9.80 C ATOM 1589 O GLN A 186 0.838 34.429 40.624 1.00 10.06 O ATOM 1590 CB GLN A 186 4.060 35.097 40.434 1.00 9.39 C ATOM 1591 CG GLN A 186 5.125 35.147 39.338 1.00 9.23 C ATOM 1592 CD GLN A 186 6.499 34.733 39.813 1.00 9.02 C ATOM 1593 OE1 GLN A 186 6.901 34.995 40.945 1.00 8.86 O ATOM 1594 NE2 GLN A 186 7.245 34.026 38.924 1.00 9.34 N ATOM 0 H GLN A 186 3.607 37.492 40.326 1.00 10.59 H new ATOM 0 HA GLN A 186 2.503 35.443 39.142 1.00 9.91 H new ATOM 0 HB2 GLN A 186 4.401 35.542 41.225 1.00 9.39 H new ATOM 0 HB3 GLN A 186 3.900 34.171 40.676 1.00 9.39 H new ATOM 0 HG2 GLN A 186 4.855 34.568 38.608 1.00 9.23 H new ATOM 0 HG3 GLN A 186 5.171 36.048 38.983 1.00 9.23 H new ATOM 0 HE21 GLN A 186 6.935 33.859 38.139 1.00 9.34 H new ATOM 0 HE22 GLN A 186 8.027 33.745 39.146 1.00 9.34 H new ATOM 1595 N ILE A 187 1.560 35.921 42.179 1.00 10.06 N ATOM 1596 CA ILE A 187 0.512 35.584 43.145 1.00 10.63 C ATOM 1597 C ILE A 187 -0.871 35.845 42.546 1.00 10.65 C ATOM 1598 O ILE A 187 -1.790 35.042 42.703 1.00 10.58 O ATOM 1599 CB ILE A 187 0.726 36.312 44.483 1.00 10.57 C ATOM 1600 CG1 ILE A 187 1.944 35.684 45.181 1.00 11.50 C ATOM 1601 CG2 ILE A 187 -0.526 36.210 45.363 1.00 11.15 C ATOM 1602 CD1 ILE A 187 2.424 36.404 46.416 1.00 12.46 C ATOM 0 H ILE A 187 2.112 36.525 42.442 1.00 10.06 H new ATOM 0 HA ILE A 187 0.566 34.636 43.342 1.00 10.63 H new ATOM 0 HB ILE A 187 0.889 37.255 44.326 1.00 10.57 H new ATOM 0 HG12 ILE A 187 1.724 34.771 45.423 1.00 11.50 H new ATOM 0 HG13 ILE A 187 2.675 35.641 44.545 1.00 11.50 H new ATOM 0 HG21 ILE A 187 -0.372 36.674 46.201 1.00 11.15 H new ATOM 0 HG22 ILE A 187 -1.279 36.614 44.904 1.00 11.15 H new ATOM 0 HG23 ILE A 187 -0.721 35.277 45.542 1.00 11.15 H new ATOM 0 HD11 ILE A 187 3.191 35.938 46.785 1.00 12.46 H new ATOM 0 HD12 ILE A 187 2.678 37.311 46.184 1.00 12.46 H new ATOM 0 HD13 ILE A 187 1.712 36.427 47.075 1.00 12.46 H new ATOM 1603 N GLU A 188 -1.008 36.955 41.825 1.00 11.44 N ATOM 1604 CA GLU A 188 -2.289 37.270 41.202 1.00 12.77 C ATOM 1605 C GLU A 188 -2.673 36.272 40.108 1.00 11.95 C ATOM 1606 O GLU A 188 -3.837 35.858 40.025 1.00 12.27 O ATOM 1607 CB GLU A 188 -2.304 38.722 40.716 1.00 14.72 C ATOM 1608 CG GLU A 188 -2.349 39.698 41.897 1.00 16.09 C ATOM 1609 CD GLU A 188 -2.228 41.168 41.524 1.00 19.15 C ATOM 1610 OE1 GLU A 188 -1.836 41.481 40.389 1.00 21.41 O ATOM 1611 OE2 GLU A 188 -2.526 42.018 42.400 1.00 21.00 O ATOM 0 H GLU A 188 -0.383 37.529 41.686 1.00 11.44 H new ATOM 0 HA GLU A 188 -2.979 37.181 41.878 1.00 12.77 H new ATOM 0 HB2 GLU A 188 -1.515 38.895 40.179 1.00 14.72 H new ATOM 0 HB3 GLU A 188 -3.073 38.867 40.143 1.00 14.72 H new ATOM 0 HG2 GLU A 188 -3.183 39.567 42.375 1.00 16.09 H new ATOM 0 HG3 GLU A 188 -1.632 39.474 42.511 1.00 16.09 H new ATOM 1612 N ALEU A 189 -1.703 35.890 39.282 0.50 12.19 N ATOM 1613 N BLEU A 189 -1.708 35.867 39.284 0.50 11.46 N ATOM 1614 CA ALEU A 189 -1.893 34.848 38.270 0.50 12.25 C ATOM 1615 CA BLEU A 189 -1.957 34.845 38.261 0.50 11.07 C ATOM 1616 C ALEU A 189 -2.316 33.531 38.908 0.50 11.40 C ATOM 1617 C BLEU A 189 -2.324 33.510 38.903 0.50 10.72 C ATOM 1618 O ALEU A 189 -3.260 32.876 38.462 0.50 10.82 O ATOM 1619 O BLEU A 189 -3.245 32.822 38.454 0.50 10.20 O ATOM 1620 CB ALEU A 189 -0.579 34.622 37.516 0.50 13.72 C ATOM 1621 CB BLEU A 189 -0.724 34.653 37.368 0.50 11.27 C ATOM 1622 CG ALEU A 189 -0.436 34.826 36.007 0.50 15.06 C ATOM 1623 CG BLEU A 189 -0.365 35.707 36.323 0.50 11.03 C ATOM 1624 CD1ALEU A 189 -1.125 36.070 35.480 0.50 15.75 C ATOM 1625 CD1BLEU A 189 1.128 35.677 36.017 0.50 11.26 C ATOM 1626 CD2ALEU A 189 1.038 34.858 35.662 0.50 14.79 C ATOM 1627 CD2BLEU A 189 -1.185 35.419 35.070 0.50 11.22 C ATOM 0 H ALEU A 189 -0.912 36.228 39.291 0.50 11.46 H new ATOM 0 H BLEU A 189 -0.903 36.169 39.299 0.50 11.46 H new ATOM 0 HA ALEU A 189 -2.590 35.143 37.664 0.50 11.07 H new ATOM 0 HA BLEU A 189 -2.700 35.152 37.718 0.50 11.07 H new ATOM 0 HB2ALEU A 189 0.081 35.197 37.935 0.50 11.27 H new ATOM 0 HB2BLEU A 189 0.043 34.554 37.953 0.50 11.27 H new ATOM 0 HB3ALEU A 189 -0.313 33.707 37.696 0.50 11.27 H new ATOM 0 HB3BLEU A 189 -0.835 33.810 36.901 0.50 11.27 H new ATOM 0 HG ALEU A 189 -0.883 34.082 35.575 0.50 11.03 H new ATOM 0 HG BLEU A 189 -0.569 36.595 36.657 0.50 11.03 H new ATOM 0 HD11ALEU A 189 -0.992 36.132 34.521 0.50 11.26 H new ATOM 0 HD11BLEU A 189 1.336 36.352 35.352 0.50 11.26 H new ATOM 0 HD12ALEU A 189 -2.075 36.020 35.671 0.50 11.26 H new ATOM 0 HD12BLEU A 189 1.628 35.857 36.828 0.50 11.26 H new ATOM 0 HD13ALEU A 189 -0.750 36.855 35.910 0.50 11.26 H new ATOM 0 HD13BLEU A 189 1.371 34.802 35.675 0.50 11.26 H new ATOM 0 HD21ALEU A 189 1.144 34.987 34.706 0.50 11.22 H new ATOM 0 HD21BLEU A 189 -0.976 36.076 34.388 0.50 11.22 H new ATOM 0 HD22ALEU A 189 1.466 35.588 36.136 0.50 11.22 H new ATOM 0 HD22BLEU A 189 -0.972 34.532 34.740 0.50 11.22 H new ATOM 0 HD23ALEU A 189 1.450 34.019 35.922 0.50 11.22 H new ATOM 0 HD23BLEU A 189 -2.130 35.465 35.284 0.50 11.22 H new ATOM 1628 N LEU A 190 -1.589 33.141 39.951 1.00 10.54 N ATOM 1629 CA LEU A 190 -1.866 31.902 40.673 1.00 10.36 C ATOM 1630 C LEU A 190 -3.270 31.856 41.255 1.00 10.20 C ATOM 1631 O LEU A 190 -3.918 30.828 41.198 1.00 9.71 O ATOM 1632 CB LEU A 190 -0.833 31.680 41.773 1.00 9.53 C ATOM 1633 CG LEU A 190 0.556 31.319 41.242 1.00 9.13 C ATOM 1634 CD1 LEU A 190 1.552 31.539 42.359 1.00 9.72 C ATOM 1635 CD2 LEU A 190 0.545 29.873 40.756 1.00 9.63 C ATOM 0 H ALEU A 190 -0.922 33.587 40.260 0.50 10.54 H new ATOM 0 H BLEU A 190 -0.926 33.594 40.259 0.50 10.54 H new ATOM 0 HA LEU A 190 -1.806 31.185 40.023 1.00 10.36 H new ATOM 0 HB2 LEU A 190 -0.767 32.484 42.312 1.00 9.53 H new ATOM 0 HB3 LEU A 190 -1.142 30.971 42.359 1.00 9.53 H new ATOM 0 HG LEU A 190 0.808 31.876 40.489 1.00 9.13 H new ATOM 0 HD11 LEU A 190 2.443 31.316 42.047 1.00 9.72 H new ATOM 0 HD12 LEU A 190 1.529 32.469 42.635 1.00 9.72 H new ATOM 0 HD13 LEU A 190 1.323 30.973 43.113 1.00 9.72 H new ATOM 0 HD21 LEU A 190 1.423 29.638 40.418 1.00 9.63 H new ATOM 0 HD22 LEU A 190 0.315 29.286 41.493 1.00 9.63 H new ATOM 0 HD23 LEU A 190 -0.110 29.774 40.048 1.00 9.63 H new ATOM 1636 N TRP A 191 -3.735 32.995 41.774 1.00 10.69 N ATOM 1637 CA TRP A 191 -5.085 33.071 42.294 1.00 11.19 C ATOM 1638 C TRP A 191 -6.114 32.803 41.224 1.00 11.13 C ATOM 1639 O TRP A 191 -7.077 32.062 41.449 1.00 11.33 O ATOM 1640 CB TRP A 191 -5.284 34.438 42.939 1.00 12.77 C ATOM 1641 CG TRP A 191 -6.652 34.676 43.516 1.00 14.42 C ATOM 1642 CD1 TRP A 191 -7.706 35.352 42.922 1.00 15.86 C ATOM 1643 CD2 TRP A 191 -7.132 34.277 44.829 1.00 16.64 C ATOM 1644 NE1 TRP A 191 -8.798 35.374 43.757 1.00 16.30 N ATOM 1645 CE2 TRP A 191 -8.512 34.757 44.925 1.00 17.48 C ATOM 1646 CE3 TRP A 191 -6.576 33.597 45.907 1.00 18.62 C ATOM 1647 CZ2 TRP A 191 -9.283 34.549 46.057 1.00 18.64 C ATOM 1648 CZ3 TRP A 191 -7.362 33.394 47.043 1.00 19.77 C ATOM 1649 CH2 TRP A 191 -8.688 33.858 47.113 1.00 20.65 C ATOM 0 H TRP A 191 -3.283 33.725 41.831 1.00 10.69 H new ATOM 0 HA TRP A 191 -5.209 32.380 42.963 1.00 11.19 H new ATOM 0 HB2 TRP A 191 -4.627 34.546 43.644 1.00 12.77 H new ATOM 0 HB3 TRP A 191 -5.104 35.123 42.276 1.00 12.77 H new ATOM 0 HD1 TRP A 191 -7.678 35.737 42.076 1.00 15.86 H new ATOM 0 HE1 TRP A 191 -9.556 35.730 43.563 1.00 16.30 H new ATOM 0 HE3 TRP A 191 -5.701 33.285 45.872 1.00 18.62 H new ATOM 0 HZ2 TRP A 191 -10.159 34.857 46.111 1.00 18.64 H new ATOM 0 HZ3 TRP A 191 -7.000 32.941 47.770 1.00 19.77 H new ATOM 0 HH2 TRP A 191 -9.182 33.700 47.885 1.00 20.65 H new ATOM 1650 N GLN A 192 -5.897 33.362 40.032 1.00 10.88 N ATOM 1651 CA GLN A 192 -6.802 33.121 38.918 1.00 11.49 C ATOM 1652 C GLN A 192 -6.810 31.652 38.477 1.00 11.35 C ATOM 1653 O GLN A 192 -7.868 31.089 38.182 1.00 11.13 O ATOM 1654 CB GLN A 192 -6.482 34.058 37.745 1.00 11.97 C ATOM 1655 CG GLN A 192 -6.688 35.544 38.062 1.00 12.54 C ATOM 1656 CD GLN A 192 -8.098 35.869 38.530 1.00 13.03 C ATOM 1657 OE1 GLN A 192 -8.289 36.618 39.509 1.00 14.39 O ATOM 1658 NE2 GLN A 192 -9.079 35.291 37.874 1.00 12.66 N ATOM 0 H GLN A 192 -5.235 33.880 39.853 1.00 10.88 H new ATOM 0 HA GLN A 192 -7.699 33.319 39.229 1.00 11.49 H new ATOM 0 HB2 GLN A 192 -5.561 33.919 37.474 1.00 11.97 H new ATOM 0 HB3 GLN A 192 -7.040 33.817 36.989 1.00 11.97 H new ATOM 0 HG2 GLN A 192 -6.056 35.813 38.747 1.00 12.54 H new ATOM 0 HG3 GLN A 192 -6.488 36.068 37.271 1.00 12.54 H new ATOM 0 HE21 GLN A 192 -8.906 34.781 37.204 1.00 12.66 H new ATOM 0 HE22 GLN A 192 -9.894 35.423 38.115 1.00 12.66 H new ATOM 1659 N VAL A 193 -5.634 31.012 38.433 1.00 11.08 N ATOM 1660 CA VAL A 193 -5.575 29.577 38.101 1.00 11.38 C ATOM 1661 C VAL A 193 -6.268 28.743 39.194 1.00 11.38 C ATOM 1662 O VAL A 193 -7.084 27.865 38.915 1.00 11.48 O ATOM 1663 CB VAL A 193 -4.117 29.079 37.943 1.00 11.19 C ATOM 1664 CG1 VAL A 193 -4.100 27.591 37.605 1.00 11.68 C ATOM 1665 CG2 VAL A 193 -3.376 29.850 36.865 1.00 11.81 C ATOM 0 H VAL A 193 -4.872 31.380 38.588 1.00 11.08 H new ATOM 0 HA VAL A 193 -6.034 29.465 37.254 1.00 11.38 H new ATOM 0 HB VAL A 193 -3.666 29.228 38.789 1.00 11.19 H new ATOM 0 HG11 VAL A 193 -3.183 27.291 37.509 1.00 11.68 H new ATOM 0 HG12 VAL A 193 -4.530 27.092 38.317 1.00 11.68 H new ATOM 0 HG13 VAL A 193 -4.577 27.442 36.774 1.00 11.68 H new ATOM 0 HG21 VAL A 193 -2.469 29.514 36.792 1.00 11.81 H new ATOM 0 HG22 VAL A 193 -3.831 29.738 36.016 1.00 11.81 H new ATOM 0 HG23 VAL A 193 -3.354 30.791 37.097 1.00 11.81 H new ATOM 1666 N TYR A 194 -5.945 29.067 40.441 1.00 11.75 N ATOM 1667 CA TYR A 194 -6.491 28.352 41.594 1.00 12.47 C ATOM 1668 C TYR A 194 -8.028 28.380 41.606 1.00 13.10 C ATOM 1669 O TYR A 194 -8.663 27.373 41.910 1.00 13.07 O ATOM 1670 CB TYR A 194 -5.923 28.947 42.886 1.00 13.11 C ATOM 1671 CG TYR A 194 -6.625 28.462 44.131 1.00 14.14 C ATOM 1672 CD1 TYR A 194 -6.390 27.183 44.621 1.00 14.63 C ATOM 1673 CD2 TYR A 194 -7.538 29.272 44.802 1.00 15.30 C ATOM 1674 CE1 TYR A 194 -7.051 26.716 45.748 1.00 15.95 C ATOM 1675 CE2 TYR A 194 -8.187 28.821 45.945 1.00 16.08 C ATOM 1676 CZ TYR A 194 -7.941 27.545 46.397 1.00 16.39 C ATOM 1677 OH TYR A 194 -8.585 27.069 47.530 1.00 18.41 O ATOM 0 H TYR A 194 -5.405 29.705 40.644 1.00 11.75 H new ATOM 0 HA TYR A 194 -6.225 27.421 41.529 1.00 12.47 H new ATOM 0 HB2 TYR A 194 -4.980 28.727 42.948 1.00 13.11 H new ATOM 0 HB3 TYR A 194 -5.986 29.914 42.844 1.00 13.11 H new ATOM 0 HD1 TYR A 194 -5.780 26.631 44.187 1.00 14.63 H new ATOM 0 HD2 TYR A 194 -7.716 30.126 44.481 1.00 15.30 H new ATOM 0 HE1 TYR A 194 -6.896 25.854 46.062 1.00 15.95 H new ATOM 0 HE2 TYR A 194 -8.780 29.375 46.399 1.00 16.08 H new ATOM 0 HH TYR A 194 -8.091 26.514 47.921 1.00 18.41 H new ATOM 1678 N AGLN A 195 -8.595 29.545 41.277 0.50 13.20 N ATOM 1679 N BGLN A 195 -8.615 29.521 41.268 0.50 13.46 N ATOM 1680 CA AGLN A 195 -10.047 29.735 41.265 0.50 14.23 C ATOM 1681 CA BGLN A 195 -10.069 29.630 41.274 0.50 14.65 C ATOM 1682 C AGLN A 195 -10.699 29.220 39.974 0.50 14.49 C ATOM 1683 C BGLN A 195 -10.720 28.988 40.065 0.50 14.87 C ATOM 1684 O AGLN A 195 -11.910 29.386 39.792 0.50 14.86 O ATOM 1685 O BGLN A 195 -11.947 28.855 40.016 0.50 15.60 O ATOM 1686 CB AGLN A 195 -10.398 31.217 41.461 0.50 14.88 C ATOM 1687 CB BGLN A 195 -10.470 31.083 41.313 0.50 15.65 C ATOM 1688 CG AGLN A 195 -9.876 31.856 42.746 0.50 15.61 C ATOM 1689 CG BGLN A 195 -10.252 31.725 42.658 0.50 16.79 C ATOM 1690 CD AGLN A 195 -10.556 31.322 43.992 0.50 16.06 C ATOM 1691 CD BGLN A 195 -10.779 33.123 42.650 0.50 17.93 C ATOM 1692 OE1AGLN A 195 -11.503 30.557 43.906 0.50 17.04 O ATOM 1693 OE1BGLN A 195 -10.186 34.010 42.033 0.50 18.67 O ATOM 1694 NE2AGLN A 195 -10.065 31.721 45.159 0.50 16.62 N ATOM 1695 NE2BGLN A 195 -11.926 33.326 43.287 0.50 18.13 N ATOM 0 H AGLN A 195 -8.148 30.245 41.055 0.50 13.46 H new ATOM 0 H BGLN A 195 -8.197 30.236 41.035 0.50 13.46 H new ATOM 0 HA AGLN A 195 -10.400 29.213 42.002 0.50 14.65 H new ATOM 0 HA BGLN A 195 -10.376 29.157 42.063 0.50 14.65 H new ATOM 0 HB2AGLN A 195 -10.051 31.717 40.706 0.50 15.65 H new ATOM 0 HB2BGLN A 195 -9.964 31.570 40.643 0.50 15.65 H new ATOM 0 HB3AGLN A 195 -11.363 31.309 41.442 0.50 15.65 H new ATOM 0 HB3BGLN A 195 -11.407 31.160 41.073 0.50 15.65 H new ATOM 0 HG2AGLN A 195 -8.921 31.701 42.813 0.50 16.79 H new ATOM 0 HG2BGLN A 195 -10.697 31.208 43.347 0.50 16.79 H new ATOM 0 HG3AGLN A 195 -10.005 32.816 42.699 0.50 16.79 H new ATOM 0 HG3BGLN A 195 -9.306 31.729 42.873 0.50 16.79 H new ATOM 0 HE21AGLN A 195 -9.396 32.261 45.182 0.50 18.13 H new ATOM 0 HE21BGLN A 195 -12.306 32.678 43.705 0.50 18.13 H new ATOM 0 HE22AGLN A 195 -10.416 31.439 45.892 0.50 18.13 H new ATOM 0 HE22BGLN A 195 -12.289 34.106 43.281 0.50 18.13 H new ATOM 1696 N GLY A 196 -9.911 28.615 39.083 1.00 14.46 N ATOM 1697 CA GLY A 196 -10.430 28.010 37.853 1.00 14.55 C ATOM 1698 C GLY A 196 -10.866 29.018 36.804 1.00 15.01 C ATOM 1699 O GLY A 196 -11.621 28.670 35.890 1.00 17.01 O ATOM 0 H AGLY A 196 -9.059 28.544 39.175 0.50 14.46 H new ATOM 0 H BGLY A 196 -9.056 28.702 39.105 0.50 14.46 H new ATOM 0 HA2 GLY A 196 -9.747 27.436 37.472 1.00 14.55 H new ATOM 0 HA3 GLY A 196 -11.184 27.443 38.076 1.00 14.55 H new ATOM 1700 N HIS A 197 -10.379 30.251 36.914 1.00 13.96 N ATOM 1701 CA HIS A 197 -10.706 31.292 35.941 1.00 14.70 C ATOM 1702 C HIS A 197 -9.850 31.202 34.713 1.00 15.20 C ATOM 1703 O HIS A 197 -10.133 31.826 33.692 1.00 16.75 O ATOM 1704 CB HIS A 197 -10.558 32.667 36.573 1.00 14.79 C ATOM 1705 CG HIS A 197 -11.437 32.891 37.788 1.00 15.63 C ATOM 1706 ND1 HIS A 197 -11.302 33.967 38.577 1.00 15.39 N ATOM 1707 CD2 HIS A 197 -12.480 32.135 38.332 1.00 16.32 C ATOM 1708 CE1 HIS A 197 -12.201 33.906 39.581 1.00 15.91 C ATOM 1709 NE2 HIS A 197 -12.927 32.794 39.421 1.00 17.03 N ATOM 0 H HIS A 197 -9.856 30.507 37.547 1.00 13.96 H new ATOM 0 HA HIS A 197 -11.627 31.155 35.670 1.00 14.70 H new ATOM 0 HB2 HIS A 197 -9.631 32.796 36.829 1.00 14.79 H new ATOM 0 HB3 HIS A 197 -10.765 33.342 35.908 1.00 14.79 H new ATOM 0 HD2 HIS A 197 -12.805 31.328 38.004 1.00 16.32 H new ATOM 0 HE1 HIS A 197 -12.299 34.528 40.265 1.00 15.91 H new ATOM 0 HE2 HIS A 197 -13.573 32.541 39.929 1.00 17.03 H new ATOM 1710 N ARG A 198 -8.781 30.415 34.790 1.00 14.40 N ATOM 1711 CA ARG A 198 -7.937 30.136 33.628 1.00 14.46 C ATOM 1712 C ARG A 198 -7.225 28.837 33.912 1.00 13.90 C ATOM 1713 O ARG A 198 -7.243 28.373 35.046 1.00 14.05 O ATOM 1714 CB ARG A 198 -6.928 31.247 33.391 1.00 15.05 C ATOM 1715 CG ARG A 198 -6.050 31.532 34.598 1.00 15.71 C ATOM 1716 CD ARG A 198 -4.724 32.111 34.161 1.00 16.97 C ATOM 1717 NE ARG A 198 -3.981 31.119 33.390 1.00 16.51 N ATOM 1718 CZ ARG A 198 -3.048 31.400 32.492 1.00 17.59 C ATOM 1719 NH1 ARG A 198 -2.721 32.666 32.242 1.00 19.29 N ATOM 1720 NH2 ARG A 198 -2.438 30.417 31.855 1.00 16.84 N ATOM 0 H ARG A 198 -8.524 30.028 35.514 1.00 14.40 H new ATOM 0 HA ARG A 198 -8.480 30.077 32.826 1.00 14.46 H new ATOM 0 HB2 ARG A 198 -6.364 31.008 32.639 1.00 15.05 H new ATOM 0 HB3 ARG A 198 -7.401 32.057 33.145 1.00 15.05 H new ATOM 0 HG2 ARG A 198 -6.500 32.152 35.193 1.00 15.71 H new ATOM 0 HG3 ARG A 198 -5.903 30.714 35.099 1.00 15.71 H new ATOM 0 HD2 ARG A 198 -4.870 32.906 33.625 1.00 16.97 H new ATOM 0 HD3 ARG A 198 -4.209 32.382 34.937 1.00 16.97 H new ATOM 0 HE ARG A 198 -4.162 30.290 33.529 1.00 16.51 H new ATOM 0 HH11 ARG A 198 -3.116 33.303 32.664 1.00 19.29 H new ATOM 0 HH12 ARG A 198 -2.115 32.847 31.659 1.00 19.29 H new ATOM 0 HH21 ARG A 198 -2.647 29.600 32.024 1.00 16.84 H new ATOM 0 HH22 ARG A 198 -1.832 30.594 31.271 1.00 16.84 H new ATOM 1721 N GLY A 199 -6.616 28.255 32.887 1.00 13.24 N ATOM 1722 CA GLY A 199 -5.886 27.006 33.032 1.00 12.67 C ATOM 1723 C GLY A 199 -4.481 27.223 33.566 1.00 11.63 C ATOM 1724 O GLY A 199 -4.023 28.353 33.794 1.00 11.64 O ATOM 0 H GLY A 199 -6.615 28.574 32.088 1.00 13.24 H new ATOM 0 HA2 GLY A 199 -6.371 26.417 33.631 1.00 12.67 H new ATOM 0 HA3 GLY A 199 -5.838 26.559 32.172 1.00 12.67 H new ATOM 1725 N GLN A 200 -3.809 26.103 33.765 1.00 11.12 N ATOM 1726 CA GLN A 200 -2.419 26.067 34.187 1.00 10.93 C ATOM 1727 C GLN A 200 -1.544 27.077 33.435 1.00 10.80 C ATOM 1728 O GLN A 200 -1.606 27.167 32.205 1.00 11.35 O ATOM 1729 CB GLN A 200 -1.902 24.660 33.922 1.00 11.09 C ATOM 1730 CG GLN A 200 -0.477 24.466 34.408 1.00 11.16 C ATOM 1731 CD GLN A 200 -0.115 23.010 34.385 1.00 11.94 C ATOM 1732 OE1 GLN A 200 -0.220 22.313 35.405 1.00 13.97 O ATOM 1733 NE2 GLN A 200 0.273 22.524 33.215 1.00 10.94 N ATOM 0 H GLN A 200 -4.155 25.323 33.656 1.00 11.12 H new ATOM 0 HA GLN A 200 -2.373 26.304 35.127 1.00 10.93 H new ATOM 0 HB2 GLN A 200 -2.481 24.017 34.361 1.00 11.09 H new ATOM 0 HB3 GLN A 200 -1.944 24.476 32.970 1.00 11.09 H new ATOM 0 HG2 GLN A 200 0.134 24.967 33.846 1.00 11.16 H new ATOM 0 HG3 GLN A 200 -0.385 24.815 35.308 1.00 11.16 H new ATOM 0 HE21 GLN A 200 0.332 23.043 32.532 1.00 10.94 H new ATOM 0 HE22 GLN A 200 0.465 21.689 33.139 1.00 10.94 H new ATOM 1734 N TYR A 201 -0.716 27.813 34.178 1.00 9.97 N ATOM 1735 CA TYR A 201 0.197 28.783 33.577 1.00 10.09 C ATOM 1736 C TYR A 201 1.528 28.122 33.210 1.00 9.84 C ATOM 1737 O TYR A 201 2.137 27.497 34.056 1.00 9.91 O ATOM 1738 CB TYR A 201 0.450 29.958 34.537 1.00 10.72 C ATOM 1739 CG TYR A 201 1.315 31.018 33.904 1.00 11.18 C ATOM 1740 CD1 TYR A 201 2.705 30.864 33.860 1.00 10.82 C ATOM 1741 CD2 TYR A 201 0.752 32.152 33.303 1.00 11.76 C ATOM 1742 CE1 TYR A 201 3.508 31.806 33.237 1.00 11.37 C ATOM 1743 CE2 TYR A 201 1.555 33.106 32.688 1.00 12.16 C ATOM 1744 CZ TYR A 201 2.921 32.923 32.657 1.00 11.44 C ATOM 1745 OH TYR A 201 3.706 33.863 32.024 1.00 12.16 O ATOM 0 H TYR A 201 -0.669 27.764 35.035 1.00 9.97 H new ATOM 0 HA TYR A 201 -0.219 29.120 32.768 1.00 10.09 H new ATOM 0 HB2 TYR A 201 -0.398 30.348 34.803 1.00 10.72 H new ATOM 0 HB3 TYR A 201 0.877 29.631 35.344 1.00 10.72 H new ATOM 0 HD1 TYR A 201 3.096 30.118 34.255 1.00 10.82 H new ATOM 0 HD2 TYR A 201 -0.171 32.268 33.316 1.00 11.76 H new ATOM 0 HE1 TYR A 201 4.430 31.691 33.208 1.00 11.37 H new ATOM 0 HE2 TYR A 201 1.174 33.861 32.301 1.00 12.16 H new ATOM 0 HH TYR A 201 4.380 33.488 31.692 1.00 12.16 H new ATOM 1746 N LEU A 202 1.960 28.273 31.966 1.00 9.93 N ATOM 1747 CA LEU A 202 3.248 27.759 31.521 1.00 10.54 C ATOM 1748 C LEU A 202 4.010 28.806 30.733 1.00 10.64 C ATOM 1749 O LEU A 202 3.516 29.313 29.726 1.00 12.18 O ATOM 1750 CB LEU A 202 3.077 26.562 30.588 1.00 11.79 C ATOM 1751 CG LEU A 202 2.331 25.335 31.094 1.00 12.60 C ATOM 1752 CD1 LEU A 202 2.167 24.414 29.896 1.00 13.99 C ATOM 1753 CD2 LEU A 202 3.086 24.651 32.226 1.00 12.67 C ATOM 0 H LEU A 202 1.513 28.678 31.353 1.00 9.93 H new ATOM 0 HA LEU A 202 3.729 27.506 32.325 1.00 10.54 H new ATOM 0 HB2 LEU A 202 2.621 26.874 29.791 1.00 11.79 H new ATOM 0 HB3 LEU A 202 3.962 26.275 30.314 1.00 11.79 H new ATOM 0 HG LEU A 202 1.469 25.580 31.465 1.00 12.60 H new ATOM 0 HD11 LEU A 202 1.694 23.612 30.167 1.00 13.99 H new ATOM 0 HD12 LEU A 202 1.661 24.869 29.205 1.00 13.99 H new ATOM 0 HD13 LEU A 202 3.041 24.173 29.551 1.00 13.99 H new ATOM 0 HD21 LEU A 202 2.587 23.875 32.526 1.00 12.67 H new ATOM 0 HD22 LEU A 202 3.959 24.371 31.910 1.00 12.67 H new ATOM 0 HD23 LEU A 202 3.194 25.271 32.964 1.00 12.67 H new ATOM 1754 N ASP A 203 5.224 29.121 31.161 1.00 9.64 N ATOM 1755 CA ASP A 203 6.100 29.936 30.316 1.00 10.27 C ATOM 1756 C ASP A 203 6.760 29.111 29.217 1.00 11.23 C ATOM 1757 O ASP A 203 7.045 27.940 29.409 1.00 10.37 O ATOM 1758 CB ASP A 203 7.153 30.648 31.161 1.00 10.01 C ATOM 1759 CG ASP A 203 6.613 31.886 31.850 1.00 9.84 C ATOM 1760 OD1 ASP A 203 5.862 32.664 31.204 1.00 10.91 O ATOM 1761 OD2 ASP A 203 6.967 32.102 33.023 1.00 9.56 O ATOM 0 H ASP A 203 5.558 28.883 31.917 1.00 9.64 H new ATOM 0 HA ASP A 203 5.545 30.603 29.883 1.00 10.27 H new ATOM 0 HB2 ASP A 203 7.495 30.034 31.829 1.00 10.01 H new ATOM 0 HB3 ASP A 203 7.901 30.897 30.596 1.00 10.01 H new TER 1762 ASP A 203 ATOM 1763 N MET B 1 31.037 49.902 34.686 1.00 24.98 N ATOM 1764 CA MET B 1 32.062 49.547 33.659 1.00 23.55 C ATOM 1765 C MET B 1 31.860 50.481 32.501 1.00 21.10 C ATOM 1766 O MET B 1 30.735 50.740 32.106 1.00 21.09 O ATOM 1767 CB MET B 1 31.920 48.090 33.179 1.00 24.25 C ATOM 1768 CG MET B 1 32.956 47.682 32.120 1.00 24.65 C ATOM 1769 SD MET B 1 33.004 45.948 31.570 1.00 26.64 S ATOM 1770 CE MET B 1 31.295 45.657 31.149 1.00 26.71 C ATOM 0 H1 MET B 1 30.987 49.253 35.293 1.00 24.98 H new ATOM 0 H2 MET B 1 31.267 50.664 35.085 1.00 24.98 H new ATOM 0 H3 MET B 1 30.245 50.001 34.293 1.00 24.98 H new ATOM 0 HA MET B 1 32.949 49.631 34.043 1.00 23.55 H new ATOM 0 HB2 MET B 1 32.000 47.497 33.943 1.00 24.25 H new ATOM 0 HB3 MET B 1 31.030 47.964 32.814 1.00 24.25 H new ATOM 0 HG2 MET B 1 32.810 48.235 31.337 1.00 24.65 H new ATOM 0 HG3 MET B 1 33.834 47.906 32.466 1.00 24.65 H new ATOM 0 HE1 MET B 1 31.210 44.792 30.718 1.00 26.71 H new ATOM 0 HE2 MET B 1 30.756 45.670 31.955 1.00 26.71 H new ATOM 0 HE3 MET B 1 30.988 46.350 30.544 1.00 26.71 H new ATOM 1771 N LYS B 2 32.962 50.986 31.957 1.00 19.74 N ATOM 1772 CA LYS B 2 32.910 51.853 30.796 1.00 17.86 C ATOM 1773 C LYS B 2 32.813 51.070 29.494 1.00 15.16 C ATOM 1774 O LYS B 2 33.312 49.934 29.398 1.00 14.68 O ATOM 1775 CB LYS B 2 34.164 52.715 30.728 1.00 20.57 C ATOM 1776 CG LYS B 2 34.293 53.717 31.859 1.00 24.14 C ATOM 1777 CD LYS B 2 35.703 54.282 31.900 1.00 27.97 C ATOM 1778 CE LYS B 2 35.896 55.163 33.126 1.00 30.81 C ATOM 1779 NZ LYS B 2 37.271 55.737 33.169 1.00 33.29 N ATOM 0 H LYS B 2 33.756 50.834 32.252 1.00 19.74 H new ATOM 0 HA LYS B 2 32.115 52.399 30.895 1.00 17.86 H new ATOM 0 HB2 LYS B 2 34.942 52.136 30.732 1.00 20.57 H new ATOM 0 HB3 LYS B 2 34.170 53.193 29.884 1.00 20.57 H new ATOM 0 HG2 LYS B 2 33.653 54.436 31.738 1.00 24.14 H new ATOM 0 HG3 LYS B 2 34.084 53.290 32.704 1.00 24.14 H new ATOM 0 HD2 LYS B 2 36.347 53.556 31.913 1.00 27.97 H new ATOM 0 HD3 LYS B 2 35.873 54.797 31.096 1.00 27.97 H new ATOM 0 HE2 LYS B 2 35.244 55.881 33.117 1.00 30.81 H new ATOM 0 HE3 LYS B 2 35.735 54.643 33.929 1.00 30.81 H new ATOM 0 HZ1 LYS B 2 37.358 56.247 33.893 1.00 33.29 H new ATOM 0 HZ2 LYS B 2 37.868 55.077 33.198 1.00 33.29 H new ATOM 0 HZ3 LYS B 2 37.410 56.230 32.441 1.00 33.29 H new ATOM 1780 N THR B 3 32.216 51.709 28.494 1.00 13.90 N ATOM 1781 CA THR B 3 32.094 51.137 27.158 1.00 13.65 C ATOM 1782 C THR B 3 33.406 50.568 26.643 1.00 13.41 C ATOM 1783 O THR B 3 33.437 49.463 26.106 1.00 12.52 O ATOM 1784 CB THR B 3 31.569 52.186 26.160 1.00 14.11 C ATOM 1785 OG1 THR B 3 30.376 52.772 26.691 1.00 14.98 O ATOM 1786 CG2 THR B 3 31.287 51.562 24.796 1.00 14.04 C ATOM 0 H THR B 3 31.868 52.492 28.572 1.00 13.90 H new ATOM 0 HA THR B 3 31.460 50.406 27.232 1.00 13.65 H new ATOM 0 HB THR B 3 32.248 52.868 26.035 1.00 14.11 H new ATOM 0 HG1 THR B 3 30.266 53.535 26.358 1.00 14.98 H new ATOM 0 HG21 THR B 3 30.959 52.244 24.190 1.00 14.04 H new ATOM 0 HG22 THR B 3 32.104 51.180 24.440 1.00 14.04 H new ATOM 0 HG23 THR B 3 30.619 50.865 24.891 1.00 14.04 H new ATOM 1787 N SER B 4 34.501 51.301 26.793 1.00 13.18 N ATOM 1788 CA SER B 4 35.765 50.833 26.251 1.00 12.99 C ATOM 1789 C SER B 4 36.241 49.530 26.901 1.00 12.48 C ATOM 1790 O SER B 4 36.841 48.683 26.226 1.00 11.98 O ATOM 1791 CB SER B 4 36.838 51.929 26.356 1.00 14.34 C ATOM 1792 OG SER B 4 37.142 52.206 27.705 1.00 16.52 O ATOM 0 H SER B 4 34.534 52.059 27.198 1.00 13.18 H new ATOM 0 HA SER B 4 35.615 50.633 25.314 1.00 12.99 H new ATOM 0 HB2 SER B 4 37.641 51.647 25.891 1.00 14.34 H new ATOM 0 HB3 SER B 4 36.525 52.736 25.918 1.00 14.34 H new ATOM 0 HG SER B 4 37.045 53.027 27.851 1.00 16.52 H new ATOM 1793 N ASP B 5 35.977 49.357 28.195 1.00 12.77 N ATOM 1794 CA ASP B 5 36.345 48.107 28.863 1.00 12.94 C ATOM 1795 C ASP B 5 35.445 46.948 28.416 1.00 11.90 C ATOM 1796 O ASP B 5 35.920 45.822 28.265 1.00 11.42 O ATOM 1797 CB ASP B 5 36.358 48.285 30.379 1.00 15.48 C ATOM 1798 CG ASP B 5 37.535 49.141 30.837 1.00 18.80 C ATOM 1799 OD1 ASP B 5 38.672 48.845 30.417 1.00 23.28 O ATOM 1800 OD2 ASP B 5 37.324 50.104 31.590 1.00 22.76 O ATOM 0 H ASP B 5 35.592 49.939 28.698 1.00 12.77 H new ATOM 0 HA ASP B 5 37.248 47.873 28.596 1.00 12.94 H new ATOM 0 HB2 ASP B 5 35.528 48.697 30.664 1.00 15.48 H new ATOM 0 HB3 ASP B 5 36.404 47.416 30.807 1.00 15.48 H new ATOM 1801 N PHE B 6 34.168 47.251 28.184 1.00 11.27 N ATOM 1802 CA PHE B 6 33.227 46.259 27.690 1.00 10.62 C ATOM 1803 C PHE B 6 33.670 45.791 26.310 1.00 9.91 C ATOM 1804 O PHE B 6 33.741 44.580 26.062 1.00 9.87 O ATOM 1805 CB PHE B 6 31.832 46.887 27.667 1.00 11.26 C ATOM 1806 CG PHE B 6 30.675 45.909 27.562 1.00 12.10 C ATOM 1807 CD1 PHE B 6 30.841 44.530 27.675 1.00 12.01 C ATOM 1808 CD2 PHE B 6 29.389 46.410 27.393 1.00 12.93 C ATOM 1809 CE1 PHE B 6 29.745 43.669 27.576 1.00 11.95 C ATOM 1810 CE2 PHE B 6 28.297 45.560 27.308 1.00 13.69 C ATOM 1811 CZ PHE B 6 28.481 44.189 27.399 1.00 13.14 C ATOM 0 H PHE B 6 33.829 48.032 28.309 1.00 11.27 H new ATOM 0 HA PHE B 6 33.201 45.480 28.267 1.00 10.62 H new ATOM 0 HB2 PHE B 6 31.718 47.413 28.474 1.00 11.26 H new ATOM 0 HB3 PHE B 6 31.784 47.502 26.918 1.00 11.26 H new ATOM 0 HD1 PHE B 6 31.690 44.179 27.818 1.00 12.01 H new ATOM 0 HD2 PHE B 6 29.259 47.329 27.336 1.00 12.93 H new ATOM 0 HE1 PHE B 6 29.868 42.749 27.629 1.00 11.95 H new ATOM 0 HE2 PHE B 6 27.443 45.909 27.190 1.00 13.69 H new ATOM 0 HZ PHE B 6 27.749 43.618 27.340 1.00 13.14 H new ATOM 1812 N VAL B 7 34.004 46.741 25.435 1.00 9.75 N ATOM 1813 CA VAL B 7 34.492 46.437 24.093 1.00 9.86 C ATOM 1814 C VAL B 7 35.739 45.537 24.161 1.00 9.95 C ATOM 1815 O VAL B 7 35.841 44.558 23.412 1.00 9.75 O ATOM 1816 CB VAL B 7 34.784 47.744 23.298 1.00 10.30 C ATOM 1817 CG1 VAL B 7 35.577 47.462 22.027 1.00 11.01 C ATOM 1818 CG2 VAL B 7 33.489 48.476 22.976 1.00 10.66 C ATOM 0 H VAL B 7 33.953 47.582 25.606 1.00 9.75 H new ATOM 0 HA VAL B 7 33.798 45.953 23.619 1.00 9.86 H new ATOM 0 HB VAL B 7 35.329 48.316 23.861 1.00 10.30 H new ATOM 0 HG11 VAL B 7 35.742 48.294 21.557 1.00 11.01 H new ATOM 0 HG12 VAL B 7 36.424 47.049 22.259 1.00 11.01 H new ATOM 0 HG13 VAL B 7 35.071 46.863 21.456 1.00 11.01 H new ATOM 0 HG21 VAL B 7 33.689 49.286 22.482 1.00 10.66 H new ATOM 0 HG22 VAL B 7 32.918 47.903 22.440 1.00 10.66 H new ATOM 0 HG23 VAL B 7 33.033 48.706 23.801 1.00 10.66 H new ATOM 1819 N LYS B 8 36.654 45.826 25.080 1.00 9.53 N ATOM 1820 CA LYS B 8 37.847 45.031 25.257 1.00 9.81 C ATOM 1821 C LYS B 8 37.495 43.551 25.514 1.00 9.36 C ATOM 1822 O LYS B 8 38.074 42.662 24.904 1.00 8.84 O ATOM 1823 CB LYS B 8 38.666 45.628 26.413 1.00 10.80 C ATOM 1824 CG LYS B 8 39.779 44.745 26.932 1.00 11.50 C ATOM 1825 CD LYS B 8 40.502 45.355 28.112 1.00 13.55 C ATOM 1826 CE LYS B 8 39.633 45.341 29.353 1.00 15.16 C ATOM 1827 NZ LYS B 8 40.228 46.220 30.411 1.00 17.41 N ATOM 0 H LYS B 8 36.594 46.494 25.618 1.00 9.53 H new ATOM 0 HA LYS B 8 38.378 45.052 24.446 1.00 9.81 H new ATOM 0 HB2 LYS B 8 39.049 46.469 26.119 1.00 10.80 H new ATOM 0 HB3 LYS B 8 38.064 45.831 27.146 1.00 10.80 H new ATOM 0 HG2 LYS B 8 39.411 43.886 27.191 1.00 11.50 H new ATOM 0 HG3 LYS B 8 40.415 44.578 26.218 1.00 11.50 H new ATOM 0 HD2 LYS B 8 41.321 44.864 28.282 1.00 13.55 H new ATOM 0 HD3 LYS B 8 40.757 46.267 27.902 1.00 13.55 H new ATOM 0 HE2 LYS B 8 38.739 45.647 29.134 1.00 15.16 H new ATOM 0 HE3 LYS B 8 39.548 44.434 29.686 1.00 15.16 H new ATOM 0 HZ1 LYS B 8 39.689 46.239 31.119 1.00 17.41 H new ATOM 0 HZ2 LYS B 8 41.022 45.899 30.652 1.00 17.41 H new ATOM 0 HZ3 LYS B 8 40.327 47.045 30.091 1.00 17.41 H new ATOM 1828 N TYR B 9 36.580 43.308 26.453 1.00 9.17 N ATOM 1829 CA TYR B 9 36.228 41.930 26.795 1.00 9.45 C ATOM 1830 C TYR B 9 35.534 41.261 25.632 1.00 9.21 C ATOM 1831 O TYR B 9 35.824 40.101 25.323 1.00 9.21 O ATOM 1832 CB TYR B 9 35.372 41.876 28.065 1.00 10.41 C ATOM 1833 CG TYR B 9 36.154 42.226 29.311 1.00 11.74 C ATOM 1834 CD1 TYR B 9 37.281 41.497 29.686 1.00 13.10 C ATOM 1835 CD2 TYR B 9 35.786 43.325 30.099 1.00 11.98 C ATOM 1836 CE1 TYR B 9 38.013 41.833 30.822 1.00 14.24 C ATOM 1837 CE2 TYR B 9 36.516 43.665 31.229 1.00 13.28 C ATOM 1838 CZ TYR B 9 37.616 42.911 31.583 1.00 14.26 C ATOM 1839 OH TYR B 9 38.354 43.240 32.707 1.00 16.93 O ATOM 0 H TYR B 9 36.159 43.913 26.896 1.00 9.17 H new ATOM 0 HA TYR B 9 37.046 41.442 26.979 1.00 9.45 H new ATOM 0 HB2 TYR B 9 34.625 42.488 27.974 1.00 10.41 H new ATOM 0 HB3 TYR B 9 34.999 40.986 28.161 1.00 10.41 H new ATOM 0 HD1 TYR B 9 37.549 40.773 29.168 1.00 13.10 H new ATOM 0 HD2 TYR B 9 35.044 43.832 29.862 1.00 11.98 H new ATOM 0 HE1 TYR B 9 38.761 41.336 31.064 1.00 14.24 H new ATOM 0 HE2 TYR B 9 36.265 44.397 31.745 1.00 13.28 H new ATOM 0 HH TYR B 9 37.834 43.463 33.328 1.00 16.93 H new ATOM 1840 N LEU B 10 34.626 41.978 24.983 1.00 8.72 N ATOM 1841 CA LEU B 10 33.908 41.416 23.858 1.00 8.70 C ATOM 1842 C LEU B 10 34.849 41.037 22.710 1.00 8.39 C ATOM 1843 O LEU B 10 34.737 39.940 22.147 1.00 8.30 O ATOM 1844 CB LEU B 10 32.820 42.361 23.356 1.00 9.05 C ATOM 1845 CG LEU B 10 31.693 42.622 24.360 1.00 9.40 C ATOM 1846 CD1 LEU B 10 30.805 43.753 23.860 1.00 10.20 C ATOM 1847 CD2 LEU B 10 30.891 41.360 24.658 1.00 9.46 C ATOM 0 H LEU B 10 34.414 42.788 25.180 1.00 8.72 H new ATOM 0 HA LEU B 10 33.484 40.605 24.180 1.00 8.70 H new ATOM 0 HB2 LEU B 10 33.228 43.208 23.117 1.00 9.05 H new ATOM 0 HB3 LEU B 10 32.436 41.993 22.545 1.00 9.05 H new ATOM 0 HG LEU B 10 32.092 42.894 25.201 1.00 9.40 H new ATOM 0 HD11 LEU B 10 30.094 43.913 24.500 1.00 10.20 H new ATOM 0 HD12 LEU B 10 31.335 44.559 23.757 1.00 10.20 H new ATOM 0 HD13 LEU B 10 30.420 43.508 23.004 1.00 10.20 H new ATOM 0 HD21 LEU B 10 30.189 41.565 25.295 1.00 9.46 H new ATOM 0 HD22 LEU B 10 30.495 41.027 23.838 1.00 9.46 H new ATOM 0 HD23 LEU B 10 31.478 40.684 25.031 1.00 9.46 H new ATOM 1848 N GLN B 11 35.794 41.920 22.377 1.00 7.82 N ATOM 1849 CA GLN B 11 36.714 41.634 21.291 1.00 7.91 C ATOM 1850 C GLN B 11 37.622 40.458 21.623 1.00 7.40 C ATOM 1851 O GLN B 11 37.917 39.664 20.746 1.00 7.45 O ATOM 1852 CB GLN B 11 37.532 42.875 20.939 1.00 7.75 C ATOM 1853 CG GLN B 11 36.724 43.930 20.188 1.00 8.06 C ATOM 1854 CD GLN B 11 37.552 45.154 19.851 1.00 8.00 C ATOM 1855 OE1 GLN B 11 38.470 45.530 20.589 1.00 8.42 O ATOM 1856 NE2 GLN B 11 37.269 45.749 18.700 1.00 8.15 N ATOM 0 H GLN B 11 35.913 42.678 22.765 1.00 7.82 H new ATOM 0 HA GLN B 11 36.188 41.384 20.515 1.00 7.91 H new ATOM 0 HB2 GLN B 11 37.885 43.265 21.754 1.00 7.75 H new ATOM 0 HB3 GLN B 11 38.293 42.612 20.398 1.00 7.75 H new ATOM 0 HG2 GLN B 11 36.373 43.544 19.370 1.00 8.06 H new ATOM 0 HG3 GLN B 11 35.962 44.195 20.727 1.00 8.06 H new ATOM 0 HE21 GLN B 11 36.622 45.458 18.213 1.00 8.15 H new ATOM 0 HE22 GLN B 11 37.732 46.425 18.440 1.00 8.15 H new ATOM 1857 N ARG B 12 38.039 40.321 22.885 1.00 7.64 N ATOM 1858 CA ARG B 12 38.863 39.185 23.280 1.00 7.78 C ATOM 1859 C ARG B 12 38.084 37.874 23.150 1.00 7.67 C ATOM 1860 O ARG B 12 38.621 36.864 22.694 1.00 7.67 O ATOM 1861 CB ARG B 12 39.399 39.374 24.695 1.00 8.26 C ATOM 1862 CG ARG B 12 40.479 40.458 24.762 1.00 9.03 C ATOM 1863 CD ARG B 12 40.951 40.693 26.182 1.00 10.05 C ATOM 1864 NE ARG B 12 41.824 41.873 26.234 1.00 10.90 N ATOM 1865 CZ ARG B 12 42.449 42.292 27.329 1.00 11.68 C ATOM 1866 NH1 ARG B 12 42.321 41.635 28.471 1.00 13.64 N ATOM 1867 NH2 ARG B 12 43.198 43.380 27.271 1.00 12.49 N ATOM 0 H ARG B 12 37.856 40.872 23.520 1.00 7.64 H new ATOM 0 HA ARG B 12 39.623 39.136 22.679 1.00 7.78 H new ATOM 0 HB2 ARG B 12 38.668 39.610 25.288 1.00 8.26 H new ATOM 0 HB3 ARG B 12 39.764 38.535 25.016 1.00 8.26 H new ATOM 0 HG2 ARG B 12 41.233 40.199 24.209 1.00 9.03 H new ATOM 0 HG3 ARG B 12 40.130 41.286 24.396 1.00 9.03 H new ATOM 0 HD2 ARG B 12 40.188 40.820 26.767 1.00 10.05 H new ATOM 0 HD3 ARG B 12 41.429 39.913 26.505 1.00 10.05 H new ATOM 0 HE ARG B 12 41.938 42.322 25.509 1.00 10.90 H new ATOM 0 HH11 ARG B 12 41.830 40.930 28.509 1.00 13.64 H new ATOM 0 HH12 ARG B 12 42.729 41.913 29.175 1.00 13.64 H new ATOM 0 HH21 ARG B 12 43.277 43.809 26.530 1.00 12.49 H new ATOM 0 HH22 ARG B 12 43.606 43.659 27.975 1.00 12.49 H new ATOM 1868 N MET B 13 36.805 37.906 23.518 1.00 7.50 N ATOM 1869 CA MET B 13 35.972 36.719 23.383 1.00 8.21 C ATOM 1870 C MET B 13 35.657 36.397 21.930 1.00 7.73 C ATOM 1871 O MET B 13 35.631 35.221 21.544 1.00 7.70 O ATOM 1872 CB MET B 13 34.688 36.873 24.182 1.00 8.60 C ATOM 1873 CG MET B 13 34.943 36.863 25.695 1.00 9.00 C ATOM 1874 SD MET B 13 33.446 36.789 26.696 1.00 11.59 S ATOM 1875 CE MET B 13 32.883 38.429 26.482 1.00 12.77 C ATOM 0 H MET B 13 36.407 38.595 23.843 1.00 7.50 H new ATOM 0 HA MET B 13 36.480 35.973 23.739 1.00 8.21 H new ATOM 0 HB2 MET B 13 34.252 37.704 23.934 1.00 8.60 H new ATOM 0 HB3 MET B 13 34.078 36.154 23.953 1.00 8.60 H new ATOM 0 HG2 MET B 13 35.504 36.102 25.913 1.00 9.00 H new ATOM 0 HG3 MET B 13 35.441 37.660 25.934 1.00 9.00 H new ATOM 0 HE1 MET B 13 32.787 38.854 27.349 1.00 12.77 H new ATOM 0 HE2 MET B 13 33.524 38.924 25.949 1.00 12.77 H new ATOM 0 HE3 MET B 13 32.025 38.420 26.030 1.00 12.77 H new ATOM 1876 N ILE B 14 35.434 37.428 21.109 1.00 7.98 N ATOM 1877 CA ILE B 14 35.235 37.229 19.688 1.00 8.25 C ATOM 1878 C ILE B 14 36.464 36.588 19.053 1.00 8.30 C ATOM 1879 O ILE B 14 36.329 35.696 18.208 1.00 8.02 O ATOM 1880 CB ILE B 14 34.848 38.559 19.005 1.00 8.43 C ATOM 1881 CG1 ILE B 14 33.404 38.930 19.398 1.00 8.84 C ATOM 1882 CG2 ILE B 14 34.989 38.447 17.488 1.00 9.17 C ATOM 1883 CD1 ILE B 14 33.022 40.381 19.112 1.00 9.60 C ATOM 0 H ILE B 14 35.396 38.248 21.364 1.00 7.98 H new ATOM 0 HA ILE B 14 34.497 36.613 19.558 1.00 8.25 H new ATOM 0 HB ILE B 14 35.448 39.260 19.304 1.00 8.43 H new ATOM 0 HG12 ILE B 14 32.792 38.347 18.923 1.00 8.84 H new ATOM 0 HG13 ILE B 14 33.284 38.757 20.345 1.00 8.84 H new ATOM 0 HG21 ILE B 14 34.742 39.290 17.077 1.00 9.17 H new ATOM 0 HG22 ILE B 14 35.908 38.235 17.263 1.00 9.17 H new ATOM 0 HG23 ILE B 14 34.406 37.745 17.160 1.00 9.17 H new ATOM 0 HD11 ILE B 14 32.104 40.534 19.386 1.00 9.60 H new ATOM 0 HD12 ILE B 14 33.609 40.974 19.606 1.00 9.60 H new ATOM 0 HD13 ILE B 14 33.110 40.558 18.162 1.00 9.60 H new ATOM 1884 N ALA B 15 37.664 37.030 19.430 1.00 8.19 N ATOM 1885 CA ALA B 15 38.892 36.411 18.893 1.00 8.63 C ATOM 1886 C ALA B 15 38.917 34.907 19.111 1.00 8.31 C ATOM 1887 O ALA B 15 39.210 34.135 18.198 1.00 8.78 O ATOM 1888 CB ALA B 15 40.139 37.052 19.491 1.00 9.15 C ATOM 0 H ALA B 15 37.795 37.674 19.985 1.00 8.19 H new ATOM 0 HA ALA B 15 38.889 36.570 17.936 1.00 8.63 H new ATOM 0 HB1 ALA B 15 40.930 36.628 19.122 1.00 9.15 H new ATOM 0 HB2 ALA B 15 40.151 37.998 19.278 1.00 9.15 H new ATOM 0 HB3 ALA B 15 40.131 36.938 20.454 1.00 9.15 H new ATOM 1889 N ILE B 16 38.612 34.481 20.332 1.00 8.55 N ATOM 1890 CA ILE B 16 38.635 33.065 20.642 1.00 8.28 C ATOM 1891 C ILE B 16 37.540 32.327 19.870 1.00 8.39 C ATOM 1892 O ILE B 16 37.766 31.244 19.318 1.00 8.53 O ATOM 1893 CB ILE B 16 38.446 32.829 22.153 1.00 8.61 C ATOM 1894 CG1 ILE B 16 39.643 33.350 22.950 1.00 9.17 C ATOM 1895 CG2 ILE B 16 38.232 31.336 22.419 1.00 9.00 C ATOM 1896 CD1 ILE B 16 39.294 33.703 24.376 1.00 9.73 C ATOM 0 H ILE B 16 38.392 34.993 20.987 1.00 8.55 H new ATOM 0 HA ILE B 16 39.501 32.719 20.376 1.00 8.28 H new ATOM 0 HB ILE B 16 37.663 33.321 22.445 1.00 8.61 H new ATOM 0 HG12 ILE B 16 40.342 32.678 22.950 1.00 9.17 H new ATOM 0 HG13 ILE B 16 40.004 34.134 22.507 1.00 9.17 H new ATOM 0 HG21 ILE B 16 38.113 31.190 23.371 1.00 9.00 H new ATOM 0 HG22 ILE B 16 37.442 31.033 21.945 1.00 9.00 H new ATOM 0 HG23 ILE B 16 39.005 30.838 22.110 1.00 9.00 H new ATOM 0 HD11 ILE B 16 40.086 34.026 24.833 1.00 9.73 H new ATOM 0 HD12 ILE B 16 38.614 34.394 24.381 1.00 9.73 H new ATOM 0 HD13 ILE B 16 38.958 32.915 24.831 1.00 9.73 H new ATOM 1897 N THR B 17 36.350 32.912 19.819 1.00 8.38 N ATOM 1898 CA THR B 17 35.234 32.305 19.123 1.00 8.77 C ATOM 1899 C THR B 17 35.536 32.139 17.636 1.00 8.92 C ATOM 1900 O THR B 17 35.247 31.073 17.050 1.00 8.97 O ATOM 1901 CB THR B 17 33.944 33.107 19.373 1.00 9.05 C ATOM 1902 OG1 THR B 17 33.708 33.194 20.798 1.00 9.57 O ATOM 1903 CG2 THR B 17 32.781 32.458 18.723 1.00 9.39 C ATOM 0 H THR B 17 36.171 33.669 20.186 1.00 8.38 H new ATOM 0 HA THR B 17 35.094 31.413 19.478 1.00 8.77 H new ATOM 0 HB THR B 17 34.052 33.993 18.994 1.00 9.05 H new ATOM 0 HG1 THR B 17 34.214 33.775 21.131 1.00 9.57 H new ATOM 0 HG21 THR B 17 31.982 32.980 18.894 1.00 9.39 H new ATOM 0 HG22 THR B 17 32.933 32.404 17.767 1.00 9.39 H new ATOM 0 HG23 THR B 17 32.666 31.564 19.083 1.00 9.39 H new ATOM 1904 N ASP B 18 36.143 33.167 17.035 1.00 9.24 N ATOM 1905 CA ASP B 18 36.530 33.094 15.631 1.00 9.70 C ATOM 1906 C ASP B 18 37.556 31.994 15.379 1.00 9.72 C ATOM 1907 O ASP B 18 37.489 31.314 14.352 1.00 9.49 O ATOM 1908 CB ASP B 18 37.079 34.441 15.169 1.00 10.34 C ATOM 1909 CG ASP B 18 36.002 35.462 14.924 1.00 11.14 C ATOM 1910 OD1 ASP B 18 34.810 35.124 14.892 1.00 12.19 O ATOM 1911 OD2 ASP B 18 36.360 36.650 14.736 1.00 12.27 O ATOM 0 H ASP B 18 36.337 33.909 17.423 1.00 9.24 H new ATOM 0 HA ASP B 18 35.736 32.875 15.119 1.00 9.70 H new ATOM 0 HB2 ASP B 18 37.694 34.781 15.838 1.00 10.34 H new ATOM 0 HB3 ASP B 18 37.589 34.314 14.354 1.00 10.34 H new ATOM 1912 N ATHR B 19 38.482 31.830 16.302 0.60 9.65 N ATOM 1913 N BTHR B 19 38.492 31.772 16.303 0.40 9.64 N ATOM 1914 CA ATHR B 19 39.438 30.757 16.222 0.60 10.15 C ATOM 1915 CA BTHR B 19 39.450 30.656 16.153 0.40 10.03 C ATOM 1916 C ATHR B 19 38.681 29.421 16.186 0.60 9.96 C ATOM 1917 C BTHR B 19 38.759 29.301 16.280 0.40 9.97 C ATOM 1918 O ATHR B 19 38.951 28.579 15.319 0.60 9.66 O ATOM 1919 O BTHR B 19 39.166 28.311 15.656 0.40 9.69 O ATOM 1920 CB ATHR B 19 40.460 30.894 17.365 0.60 10.68 C ATOM 1921 CB BTHR B 19 40.643 30.737 17.134 0.40 10.36 C ATOM 1922 OG1ATHR B 19 41.131 32.166 17.229 0.60 10.76 O ATOM 1923 OG1BTHR B 19 41.728 29.946 16.642 0.40 11.81 O ATOM 1924 CG2ATHR B 19 41.475 29.798 17.328 0.60 11.02 C ATOM 1925 CG2BTHR B 19 40.259 30.246 18.515 0.40 9.68 C ATOM 0 H ATHR B 19 38.572 32.338 16.990 0.60 9.64 H new ATOM 0 H BTHR B 19 38.594 32.243 17.015 0.40 9.64 H new ATOM 0 HA ATHR B 19 39.959 30.794 15.404 0.60 10.03 H new ATOM 0 HA BTHR B 19 39.810 30.744 15.257 0.40 10.03 H new ATOM 0 HB ATHR B 19 39.989 30.837 18.211 0.60 10.36 H new ATOM 0 HB BTHR B 19 40.909 31.667 17.201 0.40 10.36 H new ATOM 0 HG1ATHR B 19 40.623 32.781 17.493 0.60 11.81 H new ATOM 0 HG1BTHR B 19 41.601 29.770 15.830 0.40 11.81 H new ATOM 0 HG21ATHR B 19 42.102 29.913 18.059 0.60 9.68 H new ATOM 0 HG21BTHR B 19 41.026 30.309 19.106 0.40 9.68 H new ATOM 0 HG22ATHR B 19 41.029 28.941 17.417 0.60 9.68 H new ATOM 0 HG22BTHR B 19 39.537 30.792 18.864 0.40 9.68 H new ATOM 0 HG23ATHR B 19 41.953 29.828 16.484 0.60 9.68 H new ATOM 0 HG23BTHR B 19 39.968 29.322 18.461 0.40 9.68 H new ATOM 1926 N GLY B 20 37.704 29.241 17.084 1.00 9.66 N ATOM 1927 CA GLY B 20 36.892 28.030 17.125 1.00 9.71 C ATOM 1928 C GLY B 20 36.194 27.797 15.799 1.00 9.64 C ATOM 1929 O GLY B 20 36.206 26.679 15.272 1.00 9.86 O ATOM 0 H AGLY B 20 37.498 29.821 17.684 0.60 9.66 H new ATOM 0 H BGLY B 20 37.445 29.875 17.604 0.40 9.66 H new ATOM 0 HA2 GLY B 20 37.453 27.268 17.337 1.00 9.71 H new ATOM 0 HA3 GLY B 20 36.233 28.103 17.833 1.00 9.71 H new ATOM 1930 N LEU B 21 35.589 28.849 15.238 1.00 9.75 N ATOM 1931 CA LEU B 21 34.896 28.729 13.965 1.00 10.44 C ATOM 1932 C LEU B 21 35.834 28.303 12.831 1.00 10.68 C ATOM 1933 O LEU B 21 35.401 27.591 11.919 1.00 12.33 O ATOM 1934 CB LEU B 21 34.209 30.055 13.598 1.00 10.40 C ATOM 1935 CG LEU B 21 32.983 30.367 14.461 1.00 10.12 C ATOM 1936 CD1 LEU B 21 32.544 31.807 14.236 1.00 11.08 C ATOM 1937 CD2 LEU B 21 31.816 29.407 14.209 1.00 11.28 C ATOM 0 H LEU B 21 35.572 29.637 15.583 1.00 9.75 H new ATOM 0 HA LEU B 21 34.227 28.035 14.073 1.00 10.44 H new ATOM 0 HB2 LEU B 21 34.850 30.778 13.686 1.00 10.40 H new ATOM 0 HB3 LEU B 21 33.941 30.025 12.666 1.00 10.40 H new ATOM 0 HG LEU B 21 33.247 30.245 15.386 1.00 10.12 H new ATOM 0 HD11 LEU B 21 31.768 31.998 14.785 1.00 11.08 H new ATOM 0 HD12 LEU B 21 33.266 32.407 14.478 1.00 11.08 H new ATOM 0 HD13 LEU B 21 32.318 31.934 13.301 1.00 11.08 H new ATOM 0 HD21 LEU B 21 31.069 29.649 14.779 1.00 11.28 H new ATOM 0 HD22 LEU B 21 31.545 29.464 13.279 1.00 11.28 H new ATOM 0 HD23 LEU B 21 32.094 28.500 14.409 1.00 11.28 H new ATOM 1938 N THR B 22 37.084 28.747 12.850 1.00 10.56 N ATOM 1939 CA THR B 22 38.032 28.323 11.805 1.00 11.08 C ATOM 1940 C THR B 22 38.475 26.880 12.044 1.00 10.93 C ATOM 1941 O THR B 22 38.461 26.064 11.109 1.00 11.58 O ATOM 1942 CB THR B 22 39.262 29.248 11.726 1.00 11.33 C ATOM 1943 OG1 THR B 22 38.859 30.524 11.210 1.00 12.19 O ATOM 1944 CG2 THR B 22 40.329 28.676 10.785 1.00 11.99 C ATOM 0 H THR B 22 37.406 29.282 13.441 1.00 10.56 H new ATOM 0 HA THR B 22 37.568 28.382 10.955 1.00 11.08 H new ATOM 0 HB THR B 22 39.633 29.329 12.619 1.00 11.33 H new ATOM 0 HG1 THR B 22 38.102 30.723 11.514 1.00 12.19 H new ATOM 0 HG21 THR B 22 41.090 29.277 10.755 1.00 11.99 H new ATOM 0 HG22 THR B 22 40.616 27.808 11.110 1.00 11.99 H new ATOM 0 HG23 THR B 22 39.957 28.580 9.894 1.00 11.99 H new ATOM 1945 N PHE B 23 38.863 26.559 13.274 1.00 9.94 N ATOM 1946 CA PHE B 23 39.657 25.347 13.506 1.00 9.77 C ATOM 1947 C PHE B 23 38.918 24.125 14.004 1.00 9.89 C ATOM 1948 O PHE B 23 39.429 23.030 13.848 1.00 10.42 O ATOM 1949 CB PHE B 23 40.848 25.664 14.405 1.00 10.25 C ATOM 1950 CG PHE B 23 41.863 26.589 13.764 1.00 11.24 C ATOM 1951 CD1 PHE B 23 42.869 26.080 12.931 1.00 11.94 C ATOM 1952 CD2 PHE B 23 41.834 27.954 14.009 1.00 11.63 C ATOM 1953 CE1 PHE B 23 43.804 26.931 12.344 1.00 12.52 C ATOM 1954 CE2 PHE B 23 42.775 28.812 13.419 1.00 12.33 C ATOM 1955 CZ PHE B 23 43.753 28.295 12.574 1.00 12.96 C ATOM 0 H PHE B 23 38.683 27.017 13.979 1.00 9.94 H new ATOM 0 HA PHE B 23 39.947 25.084 12.619 1.00 9.77 H new ATOM 0 HB2 PHE B 23 40.526 26.069 15.225 1.00 10.25 H new ATOM 0 HB3 PHE B 23 41.287 24.835 14.651 1.00 10.25 H new ATOM 0 HD1 PHE B 23 42.913 25.165 12.768 1.00 11.94 H new ATOM 0 HD2 PHE B 23 41.182 28.305 14.572 1.00 11.63 H new ATOM 0 HE1 PHE B 23 44.467 26.580 11.794 1.00 12.52 H new ATOM 0 HE2 PHE B 23 42.745 29.725 13.592 1.00 12.33 H new ATOM 0 HZ PHE B 23 44.368 28.862 12.167 1.00 12.96 H new ATOM 1956 N THR B 24 37.754 24.281 14.625 1.00 9.49 N ATOM 1957 CA THR B 24 37.110 23.085 15.161 1.00 9.80 C ATOM 1958 C THR B 24 36.720 22.090 14.057 1.00 9.85 C ATOM 1959 O THR B 24 36.330 22.492 12.958 1.00 10.48 O ATOM 1960 CB THR B 24 35.887 23.392 16.055 1.00 9.94 C ATOM 1961 OG1 THR B 24 35.570 22.201 16.783 1.00 10.43 O ATOM 1962 CG2 THR B 24 34.654 23.830 15.257 1.00 9.79 C ATOM 0 H THR B 24 37.339 25.025 14.743 1.00 9.49 H new ATOM 0 HA THR B 24 37.783 22.673 15.726 1.00 9.80 H new ATOM 0 HB THR B 24 36.120 24.130 16.640 1.00 9.94 H new ATOM 0 HG1 THR B 24 36.108 22.111 17.421 1.00 10.43 H new ATOM 0 HG21 THR B 24 33.921 24.009 15.866 1.00 9.79 H new ATOM 0 HG22 THR B 24 34.861 24.635 14.757 1.00 9.79 H new ATOM 0 HG23 THR B 24 34.399 23.124 14.642 1.00 9.79 H new ATOM 1963 N LYS B 25 36.775 20.810 14.408 1.00 10.65 N ATOM 1964 CA LYS B 25 36.424 19.729 13.483 1.00 11.65 C ATOM 1965 C LYS B 25 35.119 19.058 13.881 1.00 12.28 C ATOM 1966 O LYS B 25 34.663 18.149 13.199 1.00 13.99 O ATOM 1967 CB LYS B 25 37.561 18.696 13.394 1.00 12.05 C ATOM 1968 CG LYS B 25 38.856 19.322 12.874 1.00 12.88 C ATOM 1969 CD LYS B 25 40.015 18.325 12.870 1.00 14.23 C ATOM 1970 CE LYS B 25 41.241 18.965 12.238 1.00 15.67 C ATOM 1971 NZ LYS B 25 42.352 17.976 12.201 1.00 17.76 N ATOM 0 H LYS B 25 37.016 20.540 15.188 1.00 10.65 H new ATOM 0 HA LYS B 25 36.298 20.123 12.606 1.00 11.65 H new ATOM 0 HB2 LYS B 25 37.717 18.310 14.270 1.00 12.05 H new ATOM 0 HB3 LYS B 25 37.294 17.971 12.808 1.00 12.05 H new ATOM 0 HG2 LYS B 25 38.714 19.655 11.974 1.00 12.88 H new ATOM 0 HG3 LYS B 25 39.089 20.085 13.425 1.00 12.88 H new ATOM 0 HD2 LYS B 25 40.216 18.046 13.777 1.00 14.23 H new ATOM 0 HD3 LYS B 25 39.765 17.528 12.377 1.00 14.23 H new ATOM 0 HE2 LYS B 25 41.034 19.267 11.340 1.00 15.67 H new ATOM 0 HE3 LYS B 25 41.508 19.747 12.746 1.00 15.67 H new ATOM 0 HZ1 LYS B 25 43.070 18.350 11.831 1.00 17.76 H new ATOM 0 HZ2 LYS B 25 42.547 17.717 13.030 1.00 17.76 H new ATOM 0 HZ3 LYS B 25 42.105 17.269 11.720 1.00 17.76 H new ATOM 1972 N ASP B 26 34.502 19.535 14.961 1.00 12.15 N ATOM 1973 CA ASP B 26 33.317 18.894 15.544 1.00 12.63 C ATOM 1974 C ASP B 26 32.109 19.780 15.252 1.00 12.17 C ATOM 1975 O ASP B 26 32.121 20.960 15.587 1.00 11.45 O ATOM 1976 CB ASP B 26 33.585 18.725 17.061 1.00 13.54 C ATOM 1977 CG ASP B 26 32.410 18.149 17.861 1.00 15.64 C ATOM 1978 OD1 ASP B 26 31.252 18.417 17.554 1.00 17.01 O ATOM 1979 OD2 ASP B 26 32.682 17.489 18.895 1.00 19.15 O ATOM 0 H ASP B 26 34.758 20.242 15.379 1.00 12.15 H new ATOM 0 HA ASP B 26 33.135 18.019 15.168 1.00 12.63 H new ATOM 0 HB2 ASP B 26 34.354 18.146 17.178 1.00 13.54 H new ATOM 0 HB3 ASP B 26 33.821 19.589 17.433 1.00 13.54 H new ATOM 1980 N PRO B 27 31.059 19.242 14.613 1.00 12.29 N ATOM 1981 CA PRO B 27 29.899 20.072 14.278 1.00 12.43 C ATOM 1982 C PRO B 27 29.149 20.665 15.490 1.00 11.73 C ATOM 1983 O PRO B 27 28.510 21.706 15.376 1.00 11.33 O ATOM 1984 CB PRO B 27 28.966 19.095 13.518 1.00 13.34 C ATOM 1985 CG PRO B 27 29.379 17.749 13.985 1.00 14.39 C ATOM 1986 CD PRO B 27 30.866 17.840 14.175 1.00 13.87 C ATOM 0 HA PRO B 27 30.183 20.852 13.776 1.00 12.43 H new ATOM 0 HB2 PRO B 27 28.033 19.268 13.720 1.00 13.34 H new ATOM 0 HB3 PRO B 27 29.069 19.183 12.558 1.00 13.34 H new ATOM 0 HG2 PRO B 27 28.933 17.513 14.814 1.00 14.39 H new ATOM 0 HG3 PRO B 27 29.149 17.066 13.335 1.00 14.39 H new ATOM 0 HD2 PRO B 27 31.183 17.209 14.840 1.00 13.87 H new ATOM 0 HD3 PRO B 27 31.346 17.651 13.353 1.00 13.87 H new ATOM 1987 N PHE B 28 29.221 19.986 16.632 1.00 11.24 N ATOM 1988 CA PHE B 28 28.531 20.479 17.813 1.00 11.25 C ATOM 1989 C PHE B 28 29.318 21.605 18.480 1.00 10.30 C ATOM 1990 O PHE B 28 28.724 22.549 18.993 1.00 9.82 O ATOM 1991 CB PHE B 28 28.226 19.337 18.780 1.00 12.86 C ATOM 1992 CG PHE B 28 27.267 18.325 18.208 1.00 14.48 C ATOM 1993 CD1 PHE B 28 25.941 18.680 17.975 1.00 15.94 C ATOM 1994 CD2 PHE B 28 27.697 17.061 17.853 1.00 16.69 C ATOM 1995 CE1 PHE B 28 25.043 17.771 17.427 1.00 17.48 C ATOM 1996 CE2 PHE B 28 26.806 16.140 17.305 1.00 17.25 C ATOM 1997 CZ PHE B 28 25.488 16.501 17.091 1.00 17.82 C ATOM 0 H PHE B 28 29.656 19.252 16.741 1.00 11.24 H new ATOM 0 HA PHE B 28 27.681 20.855 17.536 1.00 11.25 H new ATOM 0 HB2 PHE B 28 29.054 18.892 19.019 1.00 12.86 H new ATOM 0 HB3 PHE B 28 27.854 19.702 19.598 1.00 12.86 H new ATOM 0 HD1 PHE B 28 25.652 19.538 18.189 1.00 15.94 H new ATOM 0 HD2 PHE B 28 28.587 16.823 17.981 1.00 16.69 H new ATOM 0 HE1 PHE B 28 24.155 18.011 17.288 1.00 17.48 H new ATOM 0 HE2 PHE B 28 27.097 15.285 17.084 1.00 17.25 H new ATOM 0 HZ PHE B 28 24.896 15.888 16.719 1.00 17.82 H new ATOM 1998 N ASP B 29 30.643 21.524 18.431 1.00 10.01 N ATOM 1999 CA ASP B 29 31.479 22.677 18.809 1.00 9.46 C ATOM 2000 C ASP B 29 31.215 23.839 17.849 1.00 9.36 C ATOM 2001 O ASP B 29 31.038 24.979 18.293 1.00 8.60 O ATOM 2002 CB ASP B 29 32.962 22.305 18.829 1.00 9.93 C ATOM 2003 CG ASP B 29 33.345 21.511 20.032 1.00 10.86 C ATOM 2004 OD1 ASP B 29 33.005 21.898 21.171 1.00 10.88 O ATOM 2005 OD2 ASP B 29 34.041 20.499 19.834 1.00 12.56 O ATOM 0 H ASP B 29 31.080 20.825 18.186 1.00 10.01 H new ATOM 0 HA ASP B 29 31.241 22.952 19.708 1.00 9.46 H new ATOM 0 HB2 ASP B 29 33.174 21.797 18.031 1.00 9.93 H new ATOM 0 HB3 ASP B 29 33.494 23.115 18.799 1.00 9.93 H new ATOM 2006 N ARG B 30 31.114 23.565 16.541 1.00 9.20 N ATOM 2007 CA ARG B 30 30.874 24.637 15.586 1.00 10.18 C ATOM 2008 C ARG B 30 29.567 25.353 15.917 1.00 9.83 C ATOM 2009 O ARG B 30 29.517 26.585 15.896 1.00 9.91 O ATOM 2010 CB ARG B 30 30.878 24.092 14.151 1.00 10.57 C ATOM 2011 CG ARG B 30 30.510 25.140 13.102 1.00 12.17 C ATOM 2012 CD ARG B 30 30.884 24.714 11.677 1.00 13.19 C ATOM 2013 NE ARG B 30 32.309 24.375 11.632 1.00 15.05 N ATOM 2014 CZ ARG B 30 33.295 25.275 11.596 1.00 14.77 C ATOM 2015 NH1 ARG B 30 33.000 26.576 11.522 1.00 15.47 N ATOM 2016 NH2 ARG B 30 34.576 24.861 11.616 1.00 14.75 N ATOM 0 H ARG B 30 31.181 22.779 16.199 1.00 9.20 H new ATOM 0 HA ARG B 30 31.592 25.286 15.651 1.00 10.18 H new ATOM 0 HB2 ARG B 30 31.758 23.738 13.949 1.00 10.57 H new ATOM 0 HB3 ARG B 30 30.254 23.352 14.092 1.00 10.57 H new ATOM 0 HG2 ARG B 30 29.556 25.312 13.144 1.00 12.17 H new ATOM 0 HG3 ARG B 30 30.958 25.974 13.314 1.00 12.17 H new ATOM 0 HD2 ARG B 30 30.350 23.951 11.406 1.00 13.19 H new ATOM 0 HD3 ARG B 30 30.691 25.431 11.053 1.00 13.19 H new ATOM 0 HE ARG B 30 32.524 23.542 11.629 1.00 15.05 H new ATOM 0 HH11 ARG B 30 32.179 26.830 11.498 1.00 15.47 H new ATOM 0 HH12 ARG B 30 33.631 27.159 11.499 1.00 15.47 H new ATOM 0 HH21 ARG B 30 34.756 24.021 11.652 1.00 14.75 H new ATOM 0 HH22 ARG B 30 35.214 25.437 11.593 1.00 14.75 H new ATOM 2017 N GLU B 31 28.515 24.588 16.213 1.00 10.34 N ATOM 2018 CA GLU B 31 27.227 25.192 16.578 1.00 11.26 C ATOM 2019 C GLU B 31 27.347 26.101 17.808 1.00 9.92 C ATOM 2020 O GLU B 31 26.779 27.184 17.856 1.00 9.99 O ATOM 2021 CB GLU B 31 26.181 24.121 16.903 1.00 14.14 C ATOM 2022 CG GLU B 31 25.591 23.311 15.778 1.00 18.30 C ATOM 2023 CD GLU B 31 24.569 22.291 16.286 1.00 20.14 C ATOM 2024 OE1 GLU B 31 24.366 22.135 17.528 1.00 21.19 O ATOM 2025 OE2 GLU B 31 23.954 21.633 15.421 1.00 24.24 O ATOM 0 H GLU B 31 28.523 23.728 16.209 1.00 10.34 H new ATOM 0 HA GLU B 31 26.953 25.713 15.807 1.00 11.26 H new ATOM 0 HB2 GLU B 31 26.583 23.501 17.531 1.00 14.14 H new ATOM 0 HB3 GLU B 31 25.448 24.558 17.365 1.00 14.14 H new ATOM 0 HG2 GLU B 31 25.165 23.905 15.140 1.00 18.30 H new ATOM 0 HG3 GLU B 31 26.301 22.849 15.305 1.00 18.30 H new ATOM 2026 N ARG B 32 28.071 25.646 18.822 1.00 8.80 N ATOM 2027 CA ARG B 32 28.305 26.476 20.012 1.00 8.78 C ATOM 2028 C ARG B 32 29.054 27.762 19.672 1.00 8.44 C ATOM 2029 O ARG B 32 28.684 28.817 20.151 1.00 8.45 O ATOM 2030 CB ARG B 32 29.069 25.685 21.074 1.00 8.52 C ATOM 2031 CG ARG B 32 28.152 24.711 21.782 1.00 8.73 C ATOM 2032 CD ARG B 32 28.803 23.973 22.943 1.00 9.10 C ATOM 2033 NE ARG B 32 29.783 22.965 22.518 1.00 9.06 N ATOM 2034 CZ ARG B 32 29.523 21.673 22.312 1.00 9.57 C ATOM 2035 NH1 ARG B 32 28.301 21.181 22.511 1.00 9.79 N ATOM 2036 NH2 ARG B 32 30.508 20.858 21.973 1.00 10.14 N ATOM 0 H ARG B 32 28.436 24.867 18.848 1.00 8.80 H new ATOM 0 HA ARG B 32 27.437 26.726 20.365 1.00 8.78 H new ATOM 0 HB2 ARG B 32 29.802 25.203 20.660 1.00 8.52 H new ATOM 0 HB3 ARG B 32 29.460 26.295 21.719 1.00 8.52 H new ATOM 0 HG2 ARG B 32 27.377 25.193 22.112 1.00 8.73 H new ATOM 0 HG3 ARG B 32 27.829 24.061 21.139 1.00 8.73 H new ATOM 0 HD2 ARG B 32 29.241 24.617 23.521 1.00 9.10 H new ATOM 0 HD3 ARG B 32 28.113 23.541 23.471 1.00 9.10 H new ATOM 0 HE ARG B 32 30.591 23.230 22.391 1.00 9.06 H new ATOM 0 HH11 ARG B 32 27.667 21.698 22.776 1.00 9.79 H new ATOM 0 HH12 ARG B 32 28.146 20.346 22.375 1.00 9.79 H new ATOM 0 HH21 ARG B 32 31.308 21.162 21.887 1.00 10.14 H new ATOM 0 HH22 ARG B 32 30.349 20.024 21.838 1.00 10.14 H new ATOM 2037 N TYR B 33 30.106 27.677 18.848 1.00 8.29 N ATOM 2038 CA TYR B 33 30.836 28.882 18.472 1.00 8.61 C ATOM 2039 C TYR B 33 29.979 29.808 17.625 1.00 8.77 C ATOM 2040 O TYR B 33 30.100 31.025 17.761 1.00 8.94 O ATOM 2041 CB TYR B 33 32.151 28.554 17.743 1.00 8.73 C ATOM 2042 CG TYR B 33 33.200 27.816 18.565 1.00 8.78 C ATOM 2043 CD1 TYR B 33 33.646 28.322 19.779 1.00 9.85 C ATOM 2044 CD2 TYR B 33 33.741 26.641 18.089 1.00 9.52 C ATOM 2045 CE1 TYR B 33 34.624 27.671 20.504 1.00 10.14 C ATOM 2046 CE2 TYR B 33 34.703 25.957 18.810 1.00 9.83 C ATOM 2047 CZ TYR B 33 35.145 26.478 20.016 1.00 10.01 C ATOM 2048 OH TYR B 33 36.123 25.828 20.731 1.00 11.34 O ATOM 0 H TYR B 33 30.404 26.946 18.505 1.00 8.29 H new ATOM 0 HA TYR B 33 31.060 29.341 19.297 1.00 8.61 H new ATOM 0 HB2 TYR B 33 31.943 28.019 16.961 1.00 8.73 H new ATOM 0 HB3 TYR B 33 32.540 29.384 17.424 1.00 8.73 H new ATOM 0 HD1 TYR B 33 33.280 29.111 20.108 1.00 9.85 H new ATOM 0 HD2 TYR B 33 33.455 26.303 17.271 1.00 9.52 H new ATOM 0 HE1 TYR B 33 34.930 28.025 21.307 1.00 10.14 H new ATOM 0 HE2 TYR B 33 35.050 25.156 18.489 1.00 9.83 H new ATOM 0 HH TYR B 33 36.518 25.280 20.232 1.00 11.34 H new ATOM 2049 N GLU B 34 29.131 29.260 16.756 1.00 9.23 N ATOM 2050 CA GLU B 34 28.206 30.106 16.000 1.00 9.95 C ATOM 2051 C GLU B 34 27.243 30.861 16.923 1.00 9.96 C ATOM 2052 O GLU B 34 26.983 32.057 16.739 1.00 10.16 O ATOM 2053 CB GLU B 34 27.413 29.274 14.987 1.00 11.30 C ATOM 2054 CG GLU B 34 28.226 28.859 13.767 1.00 13.28 C ATOM 2055 CD GLU B 34 27.574 27.751 12.970 1.00 15.84 C ATOM 2056 OE1 GLU B 34 26.542 27.197 13.424 1.00 18.58 O ATOM 2057 OE2 GLU B 34 28.103 27.413 11.890 1.00 18.51 O ATOM 0 H GLU B 34 29.074 28.418 16.591 1.00 9.23 H new ATOM 0 HA GLU B 34 28.741 30.760 15.524 1.00 9.95 H new ATOM 0 HB2 GLU B 34 27.076 28.478 15.427 1.00 11.30 H new ATOM 0 HB3 GLU B 34 26.642 29.784 14.694 1.00 11.30 H new ATOM 0 HG2 GLU B 34 28.355 29.630 13.193 1.00 13.28 H new ATOM 0 HG3 GLU B 34 29.106 28.569 14.054 1.00 13.28 H new ATOM 2058 N ASP B 35 26.737 30.162 17.937 1.00 9.41 N ATOM 2059 CA ASP B 35 25.825 30.740 18.912 1.00 9.51 C ATOM 2060 C ASP B 35 26.543 31.850 19.673 1.00 9.14 C ATOM 2061 O ASP B 35 26.072 32.992 19.730 1.00 9.56 O ATOM 2062 CB ASP B 35 25.341 29.604 19.827 1.00 9.49 C ATOM 2063 CG ASP B 35 24.137 29.967 20.729 1.00 9.89 C ATOM 2064 OD1 ASP B 35 23.655 31.118 20.749 1.00 10.89 O ATOM 2065 OD2 ASP B 35 23.701 29.031 21.435 1.00 10.28 O ATOM 0 H ASP B 35 26.917 29.333 18.077 1.00 9.41 H new ATOM 0 HA ASP B 35 25.050 31.145 18.492 1.00 9.51 H new ATOM 0 HB2 ASP B 35 25.099 28.843 19.276 1.00 9.49 H new ATOM 0 HB3 ASP B 35 26.079 29.323 20.391 1.00 9.49 H new ATOM 2066 N LEU B 36 27.723 31.526 20.210 1.00 8.79 N ATOM 2067 CA LEU B 36 28.545 32.525 20.907 1.00 9.23 C ATOM 2068 C LEU B 36 28.862 33.723 20.028 1.00 9.08 C ATOM 2069 O LEU B 36 28.753 34.861 20.482 1.00 9.56 O ATOM 2070 CB LEU B 36 29.844 31.907 21.408 1.00 9.37 C ATOM 2071 CG LEU B 36 29.711 30.969 22.611 1.00 9.50 C ATOM 2072 CD1 LEU B 36 30.958 30.099 22.718 1.00 10.29 C ATOM 2073 CD2 LEU B 36 29.469 31.732 23.903 1.00 10.75 C ATOM 0 H LEU B 36 28.065 30.738 20.183 1.00 8.79 H new ATOM 0 HA LEU B 36 28.021 32.835 21.662 1.00 9.23 H new ATOM 0 HB2 LEU B 36 30.252 31.415 20.678 1.00 9.37 H new ATOM 0 HB3 LEU B 36 30.454 32.623 21.643 1.00 9.37 H new ATOM 0 HG LEU B 36 28.935 30.403 22.471 1.00 9.50 H new ATOM 0 HD11 LEU B 36 30.874 29.505 23.480 1.00 10.29 H new ATOM 0 HD12 LEU B 36 31.057 29.574 21.908 1.00 10.29 H new ATOM 0 HD13 LEU B 36 31.738 30.664 22.834 1.00 10.29 H new ATOM 0 HD21 LEU B 36 29.391 31.105 24.639 1.00 10.75 H new ATOM 0 HD22 LEU B 36 30.212 32.333 24.068 1.00 10.75 H new ATOM 0 HD23 LEU B 36 28.649 32.245 23.827 1.00 10.75 H new ATOM 2074 N ARG B 37 29.226 33.484 18.766 1.00 9.32 N ATOM 2075 CA ARG B 37 29.609 34.603 17.885 1.00 10.49 C ATOM 2076 C ARG B 37 28.416 35.514 17.616 1.00 10.26 C ATOM 2077 O ARG B 37 28.570 36.728 17.576 1.00 10.70 O ATOM 2078 CB ARG B 37 30.182 34.093 16.552 1.00 11.59 C ATOM 2079 CG ARG B 37 31.381 34.854 15.966 1.00 14.00 C ATOM 2080 CD ARG B 37 31.256 36.357 15.862 1.00 15.05 C ATOM 2081 NE ARG B 37 32.486 36.921 15.291 1.00 13.79 N ATOM 2082 CZ ARG B 37 32.645 38.176 14.832 1.00 14.38 C ATOM 2083 NH1 ARG B 37 31.676 39.069 14.890 1.00 16.06 N ATOM 2084 NH2 ARG B 37 33.818 38.528 14.327 1.00 16.21 N ATOM 0 H ARG B 37 29.259 32.705 18.404 1.00 9.32 H new ATOM 0 HA ARG B 37 30.297 35.110 18.343 1.00 10.49 H new ATOM 0 HB2 ARG B 37 30.443 33.167 16.672 1.00 11.59 H new ATOM 0 HB3 ARG B 37 29.469 34.104 15.895 1.00 11.59 H new ATOM 0 HG2 ARG B 37 32.160 34.653 16.508 1.00 14.00 H new ATOM 0 HG3 ARG B 37 31.556 34.504 15.078 1.00 14.00 H new ATOM 0 HD2 ARG B 37 30.496 36.589 15.306 1.00 15.05 H new ATOM 0 HD3 ARG B 37 31.093 36.738 16.739 1.00 15.05 H new ATOM 0 HE ARG B 37 33.169 36.400 15.246 1.00 13.79 H new ATOM 0 HH11 ARG B 37 30.915 38.856 15.229 1.00 16.06 H new ATOM 0 HH12 ARG B 37 31.805 39.864 14.589 1.00 16.06 H new ATOM 0 HH21 ARG B 37 34.462 37.958 14.297 1.00 16.21 H new ATOM 0 HH22 ARG B 37 33.936 39.326 14.029 1.00 16.21 H new ATOM 2085 N ASER B 38 27.233 34.927 17.451 0.70 10.22 N ATOM 2086 N BSER B 38 27.232 34.927 17.458 0.30 10.21 N ATOM 2087 CA ASER B 38 26.018 35.718 17.233 0.70 10.52 C ATOM 2088 CA BSER B 38 26.014 35.710 17.231 0.30 10.25 C ATOM 2089 C ASER B 38 25.721 36.590 18.459 0.70 10.38 C ATOM 2090 C BSER B 38 25.636 36.554 18.446 0.30 10.18 C ATOM 2091 O ASER B 38 25.469 37.802 18.355 0.70 10.10 O ATOM 2092 O BSER B 38 25.224 37.708 18.304 0.30 10.29 O ATOM 2093 CB ASER B 38 24.838 34.790 16.904 0.70 11.34 C ATOM 2094 CB BSER B 38 24.860 34.797 16.821 0.30 10.48 C ATOM 2095 OG ASER B 38 23.673 35.538 16.606 0.70 12.81 O ATOM 2096 OG BSER B 38 25.073 34.304 15.516 0.30 10.84 O ATOM 0 H ASER B 38 27.110 34.076 17.461 0.70 10.21 H new ATOM 0 H BSER B 38 27.110 34.076 17.478 0.30 10.21 H new ATOM 0 HA ASER B 38 26.155 36.310 16.477 0.70 10.25 H new ATOM 0 HA BSER B 38 26.197 36.326 16.505 0.30 10.25 H new ATOM 0 HB2ASER B 38 25.066 34.226 16.149 0.70 10.48 H new ATOM 0 HB2BSER B 38 24.785 34.058 17.445 0.30 10.48 H new ATOM 0 HB3ASER B 38 24.665 34.202 17.656 0.70 10.48 H new ATOM 0 HB3BSER B 38 24.023 35.286 16.857 0.30 10.48 H new ATOM 0 HG ASER B 38 23.888 36.327 16.415 0.70 10.84 H new ATOM 0 HG BSER B 38 25.766 33.830 15.505 0.30 10.84 H new ATOM 2097 N LEU B 39 25.793 35.989 19.641 1.00 9.78 N ATOM 2098 CA LEU B 39 25.543 36.732 20.886 1.00 9.81 C ATOM 2099 C LEU B 39 26.553 37.872 21.055 1.00 9.68 C ATOM 2100 O LEU B 39 26.181 39.012 21.362 1.00 9.37 O ATOM 2101 CB LEU B 39 25.588 35.802 22.109 1.00 10.51 C ATOM 2102 CG LEU B 39 24.517 34.698 22.148 1.00 10.69 C ATOM 2103 CD1 LEU B 39 24.886 33.659 23.197 1.00 11.45 C ATOM 2104 CD2 LEU B 39 23.136 35.284 22.427 1.00 11.71 C ATOM 0 H ALEU B 39 25.983 35.158 19.751 0.70 9.78 H new ATOM 0 H BLEU B 39 26.044 35.175 19.758 0.30 9.78 H new ATOM 0 HA LEU B 39 24.653 37.112 20.824 1.00 9.81 H new ATOM 0 HB2 LEU B 39 26.462 35.383 22.144 1.00 10.51 H new ATOM 0 HB3 LEU B 39 25.500 36.343 22.909 1.00 10.51 H new ATOM 0 HG LEU B 39 24.483 34.268 21.279 1.00 10.69 H new ATOM 0 HD11 LEU B 39 24.208 32.965 23.218 1.00 11.45 H new ATOM 0 HD12 LEU B 39 25.744 33.265 22.975 1.00 11.45 H new ATOM 0 HD13 LEU B 39 24.941 34.083 24.068 1.00 11.45 H new ATOM 0 HD21 LEU B 39 22.479 34.570 22.447 1.00 11.71 H new ATOM 0 HD22 LEU B 39 23.144 35.739 23.284 1.00 11.71 H new ATOM 0 HD23 LEU B 39 22.905 35.916 21.728 1.00 11.71 H new ATOM 2105 N LEU B 40 27.829 37.553 20.858 1.00 9.50 N ATOM 2106 CA LEU B 40 28.898 38.535 21.047 1.00 9.79 C ATOM 2107 C LEU B 40 28.761 39.691 20.058 1.00 10.16 C ATOM 2108 O LEU B 40 29.014 40.835 20.425 1.00 9.97 O ATOM 2109 CB LEU B 40 30.279 37.872 20.932 1.00 9.25 C ATOM 2110 CG LEU B 40 30.636 36.962 22.106 1.00 9.07 C ATOM 2111 CD1 LEU B 40 31.785 36.047 21.687 1.00 8.89 C ATOM 2112 CD2 LEU B 40 30.987 37.770 23.342 1.00 9.26 C ATOM 0 H LEU B 40 28.099 36.774 20.615 1.00 9.50 H new ATOM 0 HA LEU B 40 28.815 38.898 21.942 1.00 9.79 H new ATOM 0 HB2 LEU B 40 30.311 37.354 20.113 1.00 9.25 H new ATOM 0 HB3 LEU B 40 30.954 38.565 20.856 1.00 9.25 H new ATOM 0 HG LEU B 40 29.867 36.419 22.340 1.00 9.07 H new ATOM 0 HD11 LEU B 40 32.020 35.464 22.426 1.00 8.89 H new ATOM 0 HD12 LEU B 40 31.511 35.510 20.927 1.00 8.89 H new ATOM 0 HD13 LEU B 40 32.554 36.585 21.442 1.00 8.89 H new ATOM 0 HD21 LEU B 40 31.209 37.168 24.070 1.00 9.26 H new ATOM 0 HD22 LEU B 40 31.748 38.340 23.151 1.00 9.26 H new ATOM 0 HD23 LEU B 40 30.229 38.319 23.596 1.00 9.26 H new ATOM 2113 N ASER B 41 28.364 39.398 18.832 0.70 10.55 N ATOM 2114 N BSER B 41 28.353 39.374 18.828 0.30 10.68 N ATOM 2115 CA ASER B 41 28.167 40.447 17.830 0.70 11.33 C ATOM 2116 CA BSER B 41 28.096 40.361 17.765 0.30 11.37 C ATOM 2117 C ASER B 41 27.041 41.384 18.265 0.70 11.73 C ATOM 2118 C BSER B 41 27.002 41.346 18.157 0.30 11.74 C ATOM 2119 O ASER B 41 27.176 42.606 18.162 0.70 11.92 O ATOM 2120 O BSER B 41 27.117 42.546 17.901 0.30 12.06 O ATOM 2121 CB ASER B 41 27.876 39.835 16.464 0.70 11.94 C ATOM 2122 CB BSER B 41 27.697 39.654 16.464 0.30 11.71 C ATOM 2123 OG ASER B 41 28.964 39.035 16.033 0.70 13.45 O ATOM 2124 OG BSER B 41 27.162 40.565 15.516 0.30 12.62 O ATOM 0 H ASER B 41 28.202 38.601 18.554 0.70 10.68 H new ATOM 0 H BSER B 41 28.214 38.563 18.579 0.30 10.68 H new ATOM 0 HA ASER B 41 28.983 40.966 17.755 0.70 11.37 H new ATOM 0 HA BSER B 41 28.919 40.857 17.631 0.30 11.37 H new ATOM 0 HB2ASER B 41 27.071 39.296 16.510 0.70 11.71 H new ATOM 0 HB2BSER B 41 28.472 39.210 16.085 0.30 11.71 H new ATOM 0 HB3ASER B 41 27.710 40.539 15.818 0.70 11.71 H new ATOM 0 HB3BSER B 41 27.042 38.965 16.657 0.30 11.71 H new ATOM 0 HG ASER B 41 28.942 38.294 16.429 0.70 12.62 H new ATOM 0 HG BSER B 41 26.337 40.652 15.646 0.30 12.62 H new ATOM 2125 N GLU B 42 25.933 40.830 18.757 1.00 11.78 N ATOM 2126 CA GLU B 42 24.822 41.656 19.243 1.00 12.54 C ATOM 2127 C GLU B 42 25.290 42.498 20.415 1.00 11.60 C ATOM 2128 O GLU B 42 24.965 43.685 20.525 1.00 11.89 O ATOM 2129 CB GLU B 42 23.633 40.789 19.711 1.00 13.88 C ATOM 2130 CG GLU B 42 22.875 39.959 18.677 1.00 17.31 C ATOM 2131 CD GLU B 42 21.761 39.081 19.280 1.00 18.85 C ATOM 2132 OE1 GLU B 42 21.543 39.057 20.522 1.00 20.26 O ATOM 2133 OE2 GLU B 42 21.075 38.389 18.486 1.00 21.60 O ATOM 0 H AGLU B 42 25.803 39.982 18.819 0.70 11.78 H new ATOM 0 H BGLU B 42 25.828 39.988 18.896 0.30 11.78 H new ATOM 0 HA GLU B 42 24.530 42.218 18.508 1.00 12.54 H new ATOM 0 HB2 GLU B 42 23.963 40.181 20.391 1.00 13.88 H new ATOM 0 HB3 GLU B 42 22.993 41.377 20.142 1.00 13.88 H new ATOM 0 HG2 GLU B 42 22.485 40.555 18.019 1.00 17.31 H new ATOM 0 HG3 GLU B 42 23.504 39.390 18.207 1.00 17.31 H new ATOM 2134 N MET B 43 26.038 41.884 21.329 1.00 10.73 N ATOM 2135 CA MET B 43 26.551 42.613 22.478 1.00 10.36 C ATOM 2136 C MET B 43 27.436 43.778 22.066 1.00 10.88 C ATOM 2137 O MET B 43 27.328 44.869 22.627 1.00 11.08 O ATOM 2138 CB MET B 43 27.318 41.686 23.414 1.00 10.35 C ATOM 2139 CG MET B 43 26.415 40.640 24.084 1.00 10.24 C ATOM 2140 SD MET B 43 27.363 39.529 25.136 1.00 10.42 S ATOM 2141 CE MET B 43 27.535 40.583 26.577 1.00 11.82 C ATOM 0 H MET B 43 26.257 41.053 21.300 1.00 10.73 H new ATOM 0 HA MET B 43 25.782 42.973 22.947 1.00 10.36 H new ATOM 0 HB2 MET B 43 28.015 41.233 22.915 1.00 10.35 H new ATOM 0 HB3 MET B 43 27.757 42.215 24.099 1.00 10.35 H new ATOM 0 HG2 MET B 43 25.736 41.088 24.613 1.00 10.24 H new ATOM 0 HG3 MET B 43 25.952 40.127 23.403 1.00 10.24 H new ATOM 0 HE1 MET B 43 28.012 40.105 27.273 1.00 11.82 H new ATOM 0 HE2 MET B 43 28.030 41.382 26.337 1.00 11.82 H new ATOM 0 HE3 MET B 43 26.656 40.833 26.902 1.00 11.82 H new ATOM 2142 N LEU B 44 28.314 43.557 21.090 1.00 11.06 N ATOM 2143 CA LEU B 44 29.200 44.625 20.621 1.00 11.76 C ATOM 2144 C LEU B 44 28.390 45.772 20.021 1.00 12.73 C ATOM 2145 O LEU B 44 28.697 46.938 20.277 1.00 13.99 O ATOM 2146 CB LEU B 44 30.242 44.086 19.648 1.00 11.62 C ATOM 2147 CG LEU B 44 31.289 45.118 19.209 1.00 11.64 C ATOM 2148 CD1 LEU B 44 32.057 45.745 20.349 1.00 12.31 C ATOM 2149 CD2 LEU B 44 32.249 44.451 18.241 1.00 12.07 C ATOM 0 H LEU B 44 28.414 42.803 20.688 1.00 11.06 H new ATOM 0 HA LEU B 44 29.684 44.980 21.383 1.00 11.76 H new ATOM 0 HB2 LEU B 44 30.697 43.335 20.061 1.00 11.62 H new ATOM 0 HB3 LEU B 44 29.789 43.746 18.861 1.00 11.62 H new ATOM 0 HG LEU B 44 30.809 45.848 18.787 1.00 11.64 H new ATOM 0 HD11 LEU B 44 32.697 46.383 19.996 1.00 12.31 H new ATOM 0 HD12 LEU B 44 31.440 46.201 20.943 1.00 12.31 H new ATOM 0 HD13 LEU B 44 32.528 45.054 20.841 1.00 12.31 H new ATOM 0 HD21 LEU B 44 32.918 45.093 17.954 1.00 12.07 H new ATOM 0 HD22 LEU B 44 32.685 43.704 18.680 1.00 12.07 H new ATOM 0 HD23 LEU B 44 31.758 44.129 17.469 1.00 12.07 H new ATOM 2150 N ASN B 45 27.344 45.446 19.262 1.00 13.30 N ATOM 2151 CA ASN B 45 26.462 46.477 18.690 1.00 15.40 C ATOM 2152 C ASN B 45 25.792 47.312 19.779 1.00 15.92 C ATOM 2153 O ASN B 45 25.516 48.502 19.581 1.00 18.46 O ATOM 2154 CB ASN B 45 25.408 45.833 17.786 1.00 17.11 C ATOM 2155 CG ASN B 45 25.979 45.311 16.480 1.00 19.86 C ATOM 2156 OD1 ASN B 45 27.067 45.703 16.052 1.00 22.24 O ATOM 2157 ND2 ASN B 45 25.243 44.413 15.838 1.00 22.03 N ATOM 0 H ASN B 45 27.125 44.638 19.064 1.00 13.30 H new ATOM 0 HA ASN B 45 27.011 47.074 18.159 1.00 15.40 H new ATOM 0 HB2 ASN B 45 24.985 45.102 18.262 1.00 17.11 H new ATOM 0 HB3 ASN B 45 24.715 46.484 17.592 1.00 17.11 H new ATOM 0 HD21 ASN B 45 25.520 44.082 15.094 1.00 22.03 H new ATOM 0 HD22 ASN B 45 24.488 44.162 16.166 1.00 22.03 H new ATOM 2158 N GLN B 46 25.550 46.689 20.927 1.00 15.34 N ATOM 2159 CA GLN B 46 24.860 47.321 22.054 1.00 16.09 C ATOM 2160 C GLN B 46 25.822 47.868 23.109 1.00 15.64 C ATOM 2161 O GLN B 46 25.399 48.302 24.181 1.00 15.62 O ATOM 2162 CB GLN B 46 23.943 46.298 22.741 1.00 16.79 C ATOM 2163 CG GLN B 46 22.769 45.783 21.935 1.00 19.53 C ATOM 2164 CD GLN B 46 22.052 44.644 22.651 1.00 21.35 C ATOM 2165 OE1 GLN B 46 21.935 44.624 23.884 1.00 22.80 O ATOM 2166 NE2 GLN B 46 21.597 43.673 21.881 1.00 22.95 N ATOM 0 H GLN B 46 25.784 45.875 21.078 1.00 15.34 H new ATOM 0 HA GLN B 46 24.355 48.063 21.685 1.00 16.09 H new ATOM 0 HB2 GLN B 46 24.484 45.538 23.007 1.00 16.79 H new ATOM 0 HB3 GLN B 46 23.599 46.699 23.554 1.00 16.79 H new ATOM 0 HG2 GLN B 46 22.145 46.507 21.772 1.00 19.53 H new ATOM 0 HG3 GLN B 46 23.080 45.477 21.069 1.00 19.53 H new ATOM 0 HE21 GLN B 46 21.695 43.719 21.028 1.00 22.95 H new ATOM 0 HE22 GLN B 46 21.202 42.995 22.233 1.00 22.95 H new ATOM 2167 N ALA B 47 27.129 47.826 22.839 1.00 15.36 N ATOM 2168 CA ALA B 47 28.099 48.148 23.880 1.00 15.39 C ATOM 2169 C ALA B 47 27.872 49.544 24.447 1.00 15.98 C ATOM 2170 O ALA B 47 27.618 50.483 23.703 1.00 18.00 O ATOM 2171 CB ALA B 47 29.521 47.992 23.364 1.00 16.29 C ATOM 0 H ALA B 47 27.466 47.618 22.076 1.00 15.36 H new ATOM 0 HA ALA B 47 27.970 47.517 24.605 1.00 15.39 H new ATOM 0 HB1 ALA B 47 30.148 48.211 24.071 1.00 16.29 H new ATOM 0 HB2 ALA B 47 29.663 47.076 23.078 1.00 16.29 H new ATOM 0 HB3 ALA B 47 29.660 48.590 22.613 1.00 16.29 H new ATOM 2172 N SER B 48 27.934 49.634 25.767 1.00 15.88 N ATOM 2173 CA SER B 48 27.695 50.887 26.475 1.00 15.52 C ATOM 2174 C SER B 48 28.289 50.772 27.860 1.00 16.13 C ATOM 2175 O SER B 48 28.830 49.729 28.241 1.00 16.77 O ATOM 2176 CB SER B 48 26.192 51.154 26.581 1.00 15.84 C ATOM 2177 OG SER B 48 25.578 50.235 27.481 1.00 16.23 O ATOM 0 H SER B 48 28.116 48.969 26.281 1.00 15.88 H new ATOM 0 HA SER B 48 28.106 51.621 25.992 1.00 15.52 H new ATOM 0 HB2 SER B 48 26.041 52.062 26.886 1.00 15.84 H new ATOM 0 HB3 SER B 48 25.783 51.078 25.705 1.00 15.84 H new ATOM 0 HG SER B 48 25.711 50.486 28.272 1.00 16.23 H new ATOM 2178 N ASP B 49 28.173 51.843 28.638 1.00 16.38 N ATOM 2179 CA ASP B 49 28.471 51.767 30.043 1.00 16.32 C ATOM 2180 C ASP B 49 27.457 50.824 30.681 1.00 16.35 C ATOM 2181 O ASP B 49 26.327 50.708 30.200 1.00 16.20 O ATOM 2182 CB ASP B 49 28.335 53.151 30.700 1.00 17.50 C ATOM 2183 CG ASP B 49 29.399 54.145 30.265 1.00 19.31 C ATOM 2184 OD1 ASP B 49 30.415 53.792 29.622 1.00 19.04 O ATOM 2185 OD2 ASP B 49 29.193 55.325 30.600 1.00 21.36 O ATOM 0 H ASP B 49 27.923 52.619 28.363 1.00 16.38 H new ATOM 0 HA ASP B 49 29.380 51.451 30.167 1.00 16.32 H new ATOM 0 HB2 ASP B 49 27.460 53.514 30.491 1.00 17.50 H new ATOM 0 HB3 ASP B 49 28.376 53.048 31.664 1.00 17.50 H new ATOM 2186 N LEU B 50 27.874 50.172 31.753 1.00 16.19 N ATOM 2187 CA LEU B 50 26.977 49.350 32.547 1.00 16.85 C ATOM 2188 C LEU B 50 26.960 49.883 33.961 1.00 17.22 C ATOM 2189 O LEU B 50 27.995 50.280 34.492 1.00 18.09 O ATOM 2190 CB LEU B 50 27.427 47.880 32.520 1.00 18.29 C ATOM 2191 CG LEU B 50 27.370 47.154 31.173 1.00 19.33 C ATOM 2192 CD1 LEU B 50 28.032 45.795 31.328 1.00 19.97 C ATOM 2193 CD2 LEU B 50 25.950 47.018 30.672 1.00 19.88 C ATOM 0 H LEU B 50 28.684 50.193 32.041 1.00 16.19 H new ATOM 0 HA LEU B 50 26.081 49.387 32.177 1.00 16.85 H new ATOM 0 HB2 LEU B 50 28.340 47.839 32.845 1.00 18.29 H new ATOM 0 HB3 LEU B 50 26.879 47.387 33.151 1.00 18.29 H new ATOM 0 HG LEU B 50 27.847 47.675 30.508 1.00 19.33 H new ATOM 0 HD11 LEU B 50 28.003 45.323 30.481 1.00 19.97 H new ATOM 0 HD12 LEU B 50 28.955 45.914 31.601 1.00 19.97 H new ATOM 0 HD13 LEU B 50 27.560 45.280 32.001 1.00 19.97 H new ATOM 0 HD21 LEU B 50 25.950 46.555 29.820 1.00 19.88 H new ATOM 0 HD22 LEU B 50 25.427 46.512 31.314 1.00 19.88 H new ATOM 0 HD23 LEU B 50 25.560 47.899 30.561 1.00 19.88 H new ATOM 2194 N ASP B 51 25.775 49.890 34.556 1.00 17.18 N ATOM 2195 CA ASP B 51 25.596 50.302 35.945 1.00 17.66 C ATOM 2196 C ASP B 51 25.926 49.099 36.822 1.00 18.39 C ATOM 2197 O ASP B 51 25.113 48.173 36.945 1.00 16.78 O ATOM 2198 CB ASP B 51 24.145 50.746 36.134 1.00 19.19 C ATOM 2199 CG ASP B 51 23.832 51.214 37.553 1.00 20.66 C ATOM 2200 OD1 ASP B 51 24.491 50.796 38.531 1.00 20.93 O ATOM 2201 OD2 ASP B 51 22.862 51.994 37.683 1.00 23.72 O ATOM 0 H ASP B 51 25.046 49.655 34.165 1.00 17.18 H new ATOM 0 HA ASP B 51 26.175 51.043 36.185 1.00 17.66 H new ATOM 0 HB2 ASP B 51 23.951 51.466 35.513 1.00 19.19 H new ATOM 0 HB3 ASP B 51 23.556 50.009 35.907 1.00 19.19 H new ATOM 2202 N SER B 52 27.112 49.103 37.419 1.00 18.87 N ATOM 2203 CA SER B 52 27.616 47.926 38.131 1.00 19.96 C ATOM 2204 C SER B 52 26.867 47.615 39.437 1.00 19.82 C ATOM 2205 O SER B 52 26.838 46.461 39.883 1.00 18.63 O ATOM 2206 CB SER B 52 29.129 48.030 38.348 1.00 21.67 C ATOM 2207 OG SER B 52 29.429 49.160 39.134 1.00 24.22 O ATOM 0 H SER B 52 27.645 49.778 37.425 1.00 18.87 H new ATOM 0 HA SER B 52 27.438 47.165 37.556 1.00 19.96 H new ATOM 0 HB2 SER B 52 29.456 47.228 38.784 1.00 21.67 H new ATOM 0 HB3 SER B 52 29.582 48.093 37.493 1.00 21.67 H new ATOM 0 HG SER B 52 29.638 48.915 39.910 1.00 24.22 H new ATOM 2208 N GLU B 53 26.258 48.632 40.042 1.00 19.63 N ATOM 2209 CA GLU B 53 25.371 48.413 41.185 1.00 20.07 C ATOM 2210 C GLU B 53 24.092 47.681 40.751 1.00 17.92 C ATOM 2211 O GLU B 53 23.680 46.719 41.406 1.00 17.72 O ATOM 2212 CB GLU B 53 25.031 49.724 41.920 1.00 22.79 C ATOM 2213 CG GLU B 53 24.096 49.507 43.107 1.00 26.94 C ATOM 2214 CD GLU B 53 23.779 50.756 43.918 1.00 30.25 C ATOM 2215 OE1 GLU B 53 24.479 51.779 43.777 1.00 32.64 O ATOM 2216 OE2 GLU B 53 22.820 50.698 44.720 1.00 32.77 O ATOM 0 H GLU B 53 26.344 49.455 39.808 1.00 19.63 H new ATOM 0 HA GLU B 53 25.850 47.851 41.814 1.00 20.07 H new ATOM 0 HB2 GLU B 53 25.851 50.139 42.230 1.00 22.79 H new ATOM 0 HB3 GLU B 53 24.619 50.342 41.297 1.00 22.79 H new ATOM 0 HG2 GLU B 53 23.264 49.131 42.780 1.00 26.94 H new ATOM 0 HG3 GLU B 53 24.493 48.848 43.697 1.00 26.94 H new ATOM 2217 N GLU B 54 23.472 48.144 39.666 1.00 16.41 N ATOM 2218 CA GLU B 54 22.287 47.488 39.096 1.00 16.48 C ATOM 2219 C GLU B 54 22.583 46.059 38.652 1.00 15.24 C ATOM 2220 O GLU B 54 21.780 45.144 38.888 1.00 13.93 O ATOM 2221 CB GLU B 54 21.782 48.242 37.882 1.00 18.56 C ATOM 2222 CG GLU B 54 20.933 49.464 38.123 1.00 23.01 C ATOM 2223 CD GLU B 54 20.409 50.034 36.810 1.00 24.70 C ATOM 2224 OE1 GLU B 54 20.193 49.255 35.835 1.00 26.27 O ATOM 2225 OE2 GLU B 54 20.196 51.266 36.752 1.00 29.74 O ATOM 0 H GLU B 54 23.724 48.846 39.238 1.00 16.41 H new ATOM 0 HA GLU B 54 21.620 47.481 39.800 1.00 16.48 H new ATOM 0 HB2 GLU B 54 22.551 48.511 37.356 1.00 18.56 H new ATOM 0 HB3 GLU B 54 21.269 47.624 37.338 1.00 18.56 H new ATOM 0 HG2 GLU B 54 20.188 49.235 38.700 1.00 23.01 H new ATOM 0 HG3 GLU B 54 21.455 50.138 38.587 1.00 23.01 H new ATOM 2226 N VAL B 55 23.709 45.869 37.983 1.00 14.17 N ATOM 2227 CA VAL B 55 24.106 44.521 37.569 1.00 14.26 C ATOM 2228 C VAL B 55 24.165 43.582 38.780 1.00 13.60 C ATOM 2229 O VAL B 55 23.607 42.484 38.746 1.00 12.95 O ATOM 2230 CB VAL B 55 25.438 44.533 36.786 1.00 14.20 C ATOM 2231 CG1 VAL B 55 25.930 43.110 36.535 1.00 14.70 C ATOM 2232 CG2 VAL B 55 25.271 45.248 35.459 1.00 14.99 C ATOM 0 H VAL B 55 24.255 46.494 37.758 1.00 14.17 H new ATOM 0 HA VAL B 55 23.430 44.182 36.962 1.00 14.26 H new ATOM 0 HB VAL B 55 26.093 45.005 37.323 1.00 14.20 H new ATOM 0 HG11 VAL B 55 26.766 43.138 36.043 1.00 14.70 H new ATOM 0 HG12 VAL B 55 26.070 42.661 37.384 1.00 14.70 H new ATOM 0 HG13 VAL B 55 25.268 42.625 36.018 1.00 14.70 H new ATOM 0 HG21 VAL B 55 26.115 45.246 34.982 1.00 14.99 H new ATOM 0 HG22 VAL B 55 24.599 44.793 34.928 1.00 14.99 H new ATOM 0 HG23 VAL B 55 24.992 46.163 35.617 1.00 14.99 H new ATOM 2233 N ALA B 56 24.826 44.001 39.852 1.00 14.02 N ATOM 2234 CA ALA B 56 24.926 43.186 41.058 1.00 14.01 C ATOM 2235 C ALA B 56 23.540 42.858 41.628 1.00 14.30 C ATOM 2236 O ALA B 56 23.278 41.709 41.973 1.00 14.13 O ATOM 2237 CB ALA B 56 25.800 43.887 42.097 1.00 14.50 C ATOM 0 H ALA B 56 25.227 44.760 39.902 1.00 14.02 H new ATOM 0 HA ALA B 56 25.345 42.344 40.822 1.00 14.01 H new ATOM 0 HB1 ALA B 56 25.860 43.337 42.894 1.00 14.50 H new ATOM 0 HB2 ALA B 56 26.688 44.025 41.733 1.00 14.50 H new ATOM 0 HB3 ALA B 56 25.408 44.744 42.325 1.00 14.50 H new ATOM 2238 N AGLU B 57 22.643 43.838 41.696 0.50 14.04 N ATOM 2239 N BGLU B 57 22.687 43.883 41.719 0.50 14.18 N ATOM 2240 CA AGLU B 57 21.303 43.602 42.252 0.50 14.33 C ATOM 2241 CA BGLU B 57 21.298 43.751 42.166 0.50 14.58 C ATOM 2242 C AGLU B 57 20.425 42.683 41.374 0.50 13.49 C ATOM 2243 C BGLU B 57 20.591 42.635 41.389 0.50 13.54 C ATOM 2244 O AGLU B 57 19.605 41.919 41.884 0.50 12.82 O ATOM 2245 O BGLU B 57 20.074 41.692 41.990 0.50 13.04 O ATOM 2246 CB AGLU B 57 20.612 44.936 42.550 0.50 15.78 C ATOM 2247 CB BGLU B 57 20.535 45.084 41.999 0.50 16.11 C ATOM 2248 CG AGLU B 57 21.297 45.708 43.669 0.50 17.56 C ATOM 2249 CG BGLU B 57 20.778 46.111 43.096 0.50 18.34 C ATOM 2250 CD AGLU B 57 21.480 44.856 44.911 0.50 18.46 C ATOM 2251 CD BGLU B 57 20.095 47.443 42.827 0.50 20.01 C ATOM 2252 OE1AGLU B 57 20.461 44.355 45.437 0.50 19.82 O ATOM 2253 OE1BGLU B 57 19.389 47.576 41.801 0.50 22.03 O ATOM 2254 OE2AGLU B 57 22.637 44.662 45.352 0.50 19.44 O ATOM 2255 OE2BGLU B 57 20.270 48.365 43.654 0.50 21.77 O ATOM 0 H AGLU B 57 22.784 44.643 41.429 0.50 14.18 H new ATOM 0 H BGLU B 57 22.905 44.690 41.518 0.50 14.18 H new ATOM 0 HA AGLU B 57 21.422 43.119 43.084 0.50 14.58 H new ATOM 0 HA BGLU B 57 21.305 43.521 43.108 0.50 14.58 H new ATOM 0 HB2AGLU B 57 20.601 45.478 41.746 0.50 16.11 H new ATOM 0 HB2BGLU B 57 20.782 45.477 41.147 0.50 16.11 H new ATOM 0 HB3AGLU B 57 19.688 44.771 42.793 0.50 16.11 H new ATOM 0 HB3BGLU B 57 19.585 44.893 41.959 0.50 16.11 H new ATOM 0 HG2AGLU B 57 22.162 46.023 43.362 0.50 18.34 H new ATOM 0 HG2BGLU B 57 20.460 45.755 43.941 0.50 18.34 H new ATOM 0 HG3AGLU B 57 20.771 46.493 43.890 0.50 18.34 H new ATOM 0 HG3BGLU B 57 21.732 46.256 43.190 0.50 18.34 H new ATOM 2256 N VAL B 58 20.593 42.746 40.060 1.00 12.93 N ATOM 2257 CA VAL B 58 19.908 41.789 39.187 1.00 12.33 C ATOM 2258 C VAL B 58 20.486 40.379 39.340 1.00 11.76 C ATOM 2259 O VAL B 58 19.742 39.396 39.400 1.00 11.52 O ATOM 2260 CB VAL B 58 19.882 42.267 37.726 1.00 12.00 C ATOM 2261 CG1 VAL B 58 19.225 41.216 36.834 1.00 11.89 C ATOM 2262 CG2 VAL B 58 19.104 43.563 37.653 1.00 12.94 C ATOM 0 H AVAL B 58 21.088 43.321 39.656 0.50 12.93 H new ATOM 0 H BVAL B 58 20.993 43.380 39.638 0.50 12.93 H new ATOM 0 HA VAL B 58 18.982 41.741 39.472 1.00 12.33 H new ATOM 0 HB VAL B 58 20.790 42.407 37.415 1.00 12.00 H new ATOM 0 HG11 VAL B 58 19.215 41.530 35.916 1.00 11.89 H new ATOM 0 HG12 VAL B 58 19.727 40.388 36.886 1.00 11.89 H new ATOM 0 HG13 VAL B 58 18.315 41.062 37.132 1.00 11.89 H new ATOM 0 HG21 VAL B 58 19.080 43.875 36.735 1.00 12.94 H new ATOM 0 HG22 VAL B 58 18.198 43.415 37.967 1.00 12.94 H new ATOM 0 HG23 VAL B 58 19.534 44.231 38.210 1.00 12.94 H new ATOM 2263 N LEU B 59 21.795 40.272 39.494 1.00 11.48 N ATOM 2264 CA LEU B 59 22.427 38.956 39.595 1.00 11.26 C ATOM 2265 C LEU B 59 22.043 38.206 40.858 1.00 11.55 C ATOM 2266 O LEU B 59 21.951 36.982 40.863 1.00 11.64 O ATOM 2267 CB LEU B 59 23.950 39.090 39.513 1.00 11.52 C ATOM 2268 CG LEU B 59 24.488 39.347 38.110 1.00 12.13 C ATOM 2269 CD1 LEU B 59 25.937 39.755 38.209 1.00 13.32 C ATOM 2270 CD2 LEU B 59 24.352 38.151 37.179 1.00 12.46 C ATOM 0 H LEU B 59 22.336 40.939 39.543 1.00 11.48 H new ATOM 0 HA LEU B 59 22.099 38.435 38.845 1.00 11.26 H new ATOM 0 HB2 LEU B 59 24.231 39.815 40.093 1.00 11.52 H new ATOM 0 HB3 LEU B 59 24.354 38.278 39.858 1.00 11.52 H new ATOM 0 HG LEU B 59 23.951 40.056 37.722 1.00 12.13 H new ATOM 0 HD11 LEU B 59 26.288 39.921 37.320 1.00 13.32 H new ATOM 0 HD12 LEU B 59 26.010 40.563 38.741 1.00 13.32 H new ATOM 0 HD13 LEU B 59 26.446 39.044 38.630 1.00 13.32 H new ATOM 0 HD21 LEU B 59 24.711 38.377 36.307 1.00 12.46 H new ATOM 0 HD22 LEU B 59 24.843 37.399 37.545 1.00 12.46 H new ATOM 0 HD23 LEU B 59 23.416 37.914 37.092 1.00 12.46 H new ATOM 2271 N LYS B 60 21.831 38.928 41.951 1.00 11.49 N ATOM 2272 CA LYS B 60 21.508 38.256 43.211 1.00 12.06 C ATOM 2273 C LYS B 60 20.159 37.515 43.164 1.00 11.27 C ATOM 2274 O LYS B 60 19.241 37.974 42.498 1.00 11.86 O ATOM 2275 CB LYS B 60 21.518 39.255 44.378 1.00 13.24 C ATOM 2276 CG LYS B 60 22.908 39.769 44.721 1.00 15.13 C ATOM 2277 CD LYS B 60 22.878 40.857 45.787 1.00 17.46 C ATOM 2278 CE LYS B 60 24.282 41.409 45.932 1.00 18.89 C ATOM 2279 NZ LYS B 60 24.337 42.507 46.932 1.00 22.02 N ATOM 0 H LYS B 60 21.867 39.786 41.990 1.00 11.49 H new ATOM 0 HA LYS B 60 22.198 37.588 43.351 1.00 12.06 H new ATOM 0 HB2 LYS B 60 20.948 40.008 44.156 1.00 13.24 H new ATOM 0 HB3 LYS B 60 21.135 38.831 45.162 1.00 13.24 H new ATOM 0 HG2 LYS B 60 23.456 39.031 45.031 1.00 15.13 H new ATOM 0 HG3 LYS B 60 23.328 40.117 43.919 1.00 15.13 H new ATOM 0 HD2 LYS B 60 22.261 41.562 45.535 1.00 17.46 H new ATOM 0 HD3 LYS B 60 22.567 40.496 46.632 1.00 17.46 H new ATOM 0 HE2 LYS B 60 24.885 40.697 46.198 1.00 18.89 H new ATOM 0 HE3 LYS B 60 24.592 41.737 45.073 1.00 18.89 H new ATOM 0 HZ1 LYS B 60 25.185 42.731 47.081 1.00 22.02 H new ATOM 0 HZ2 LYS B 60 23.894 43.214 46.622 1.00 22.02 H new ATOM 0 HZ3 LYS B 60 23.965 42.234 47.693 1.00 22.02 H new ATOM 2280 N PRO B 61 20.040 36.371 43.875 1.00 11.63 N ATOM 2281 CA PRO B 61 21.065 35.742 44.697 1.00 12.24 C ATOM 2282 C PRO B 61 22.135 35.056 43.856 1.00 12.39 C ATOM 2283 O PRO B 61 21.855 34.505 42.766 1.00 12.57 O ATOM 2284 CB PRO B 61 20.273 34.722 45.524 1.00 12.36 C ATOM 2285 CG PRO B 61 19.171 34.316 44.599 1.00 11.82 C ATOM 2286 CD PRO B 61 18.773 35.601 43.927 1.00 11.74 C ATOM 0 HA PRO B 61 21.551 36.383 45.238 1.00 12.24 H new ATOM 0 HB2 PRO B 61 20.822 33.965 45.781 1.00 12.36 H new ATOM 0 HB3 PRO B 61 19.929 35.114 46.342 1.00 12.36 H new ATOM 0 HG2 PRO B 61 19.472 33.656 43.955 1.00 11.82 H new ATOM 0 HG3 PRO B 61 18.428 33.922 45.082 1.00 11.82 H new ATOM 0 HD2 PRO B 61 18.414 35.444 43.040 1.00 11.74 H new ATOM 0 HD3 PRO B 61 18.090 36.071 44.430 1.00 11.74 H new ATOM 2287 N THR B 62 23.351 35.085 44.379 1.00 13.82 N ATOM 2288 CA THR B 62 24.509 34.505 43.729 1.00 14.90 C ATOM 2289 C THR B 62 24.716 33.024 44.066 1.00 14.88 C ATOM 2290 O THR B 62 25.245 32.272 43.246 1.00 14.59 O ATOM 2291 CB THR B 62 25.772 35.325 44.057 1.00 15.78 C ATOM 2292 OG1 THR B 62 25.919 35.436 45.476 1.00 17.89 O ATOM 2293 CG2 THR B 62 25.619 36.730 43.444 1.00 16.86 C ATOM 0 H THR B 62 23.528 35.450 45.137 1.00 13.82 H new ATOM 0 HA THR B 62 24.341 34.542 42.774 1.00 14.90 H new ATOM 0 HB THR B 62 26.556 34.886 43.691 1.00 15.78 H new ATOM 0 HG1 THR B 62 26.297 34.747 45.774 1.00 17.89 H new ATOM 0 HG21 THR B 62 26.408 37.258 43.643 1.00 16.86 H new ATOM 0 HG22 THR B 62 25.515 36.654 42.483 1.00 16.86 H new ATOM 0 HG23 THR B 62 24.837 37.164 43.820 1.00 16.86 H new ATOM 2294 N ASER B 63 24.301 32.626 45.266 0.34 15.08 N ATOM 2295 N BSER B 63 24.294 32.622 45.262 0.33 15.11 N ATOM 2296 N CSER B 63 24.305 32.621 45.264 0.33 15.12 N ATOM 2297 CA ASER B 63 24.412 31.233 45.703 0.34 15.46 C ATOM 2298 CA BSER B 63 24.422 31.233 45.703 0.33 15.51 C ATOM 2299 CA CSER B 63 24.441 31.229 45.689 0.33 15.51 C ATOM 2300 C ASER B 63 23.480 30.360 44.874 0.34 15.34 C ATOM 2301 C BSER B 63 23.473 30.344 44.907 0.33 15.39 C ATOM 2302 C CSER B 63 23.484 30.354 44.890 0.33 15.38 C ATOM 2303 O ASER B 63 22.329 30.729 44.633 0.34 15.48 O ATOM 2304 O BSER B 63 22.304 30.687 44.724 0.33 15.53 O ATOM 2305 O CSER B 63 22.323 30.716 44.689 0.33 15.52 O ATOM 2306 CB ASER B 63 24.078 31.098 47.193 0.34 15.95 C ATOM 2307 CB BSER B 63 24.132 31.113 47.202 0.33 16.04 C ATOM 2308 CB CSER B 63 24.165 31.084 47.186 0.33 16.06 C ATOM 2309 OG ASER B 63 24.999 31.817 47.998 0.34 16.35 O ATOM 2310 OG BSER B 63 24.451 29.820 47.685 0.33 16.54 O ATOM 2311 OG CSER B 63 22.823 31.418 47.484 0.33 16.56 O ATOM 0 H ASER B 63 23.949 33.152 45.848 0.34 15.12 H new ATOM 0 H BSER B 63 23.927 33.143 45.839 0.33 15.12 H new ATOM 0 H CSER B 63 23.944 33.138 45.848 0.33 15.12 H new ATOM 0 HA ASER B 63 25.327 30.940 45.573 0.34 15.51 H new ATOM 0 HA BSER B 63 25.334 30.941 45.546 0.33 15.51 H new ATOM 0 HA CSER B 63 25.353 30.943 45.524 0.33 15.51 H new ATOM 0 HB2ASER B 63 23.180 31.425 47.356 0.34 16.06 H new ATOM 0 HB2BSER B 63 24.645 31.778 47.687 0.33 16.06 H new ATOM 0 HB2CSER B 63 24.346 30.173 47.466 0.33 16.06 H new ATOM 0 HB3ASER B 63 24.088 30.161 47.445 0.34 16.06 H new ATOM 0 HB3BSER B 63 23.195 31.301 47.369 0.33 16.06 H new ATOM 0 HB3CSER B 63 24.765 31.659 47.687 0.33 16.06 H new ATOM 0 HG ASER B 63 25.379 32.404 47.533 0.34 16.56 H new ATOM 0 HG BSER B 63 24.285 29.779 48.507 0.33 16.56 H new ATOM 0 HG CSER B 63 22.750 32.252 47.554 0.33 16.56 H new ATOM 2312 N ALA B 64 23.988 29.216 44.428 1.00 15.07 N ATOM 2313 CA ALA B 64 23.194 28.267 43.662 1.00 15.19 C ATOM 2314 C ALA B 64 23.588 26.852 44.060 1.00 15.41 C ATOM 2315 O ALA B 64 24.769 26.562 44.320 1.00 16.09 O ATOM 2316 CB ALA B 64 23.421 28.479 42.173 1.00 15.42 C ATOM 0 H AALA B 64 24.801 28.970 44.561 0.34 15.07 H new ATOM 0 H BALA B 64 24.808 28.981 44.539 0.33 15.07 H new ATOM 0 H CALA B 64 24.804 28.972 44.551 0.33 15.07 H new ATOM 0 HA ALA B 64 22.252 28.404 43.851 1.00 15.19 H new ATOM 0 HB1 ALA B 64 22.888 27.843 41.670 1.00 15.42 H new ATOM 0 HB2 ALA B 64 23.160 29.381 41.931 1.00 15.42 H new ATOM 0 HB3 ALA B 64 24.360 28.348 41.967 1.00 15.42 H new ATOM 2317 N TYR B 65 22.603 25.967 44.084 1.00 15.96 N ATOM 2318 CA TYR B 65 22.834 24.572 44.419 1.00 16.03 C ATOM 2319 C TYR B 65 22.370 23.695 43.281 1.00 14.96 C ATOM 2320 O TYR B 65 21.464 24.065 42.545 1.00 15.04 O ATOM 2321 CB TYR B 65 22.098 24.201 45.700 1.00 18.61 C ATOM 2322 CG TYR B 65 22.575 25.001 46.877 1.00 22.20 C ATOM 2323 CD1 TYR B 65 23.708 24.605 47.589 1.00 23.97 C ATOM 2324 CD2 TYR B 65 21.915 26.169 47.266 1.00 23.01 C ATOM 2325 CE1 TYR B 65 24.168 25.347 48.670 1.00 26.21 C ATOM 2326 CE2 TYR B 65 22.365 26.917 48.347 1.00 25.99 C ATOM 2327 CZ TYR B 65 23.489 26.498 49.043 1.00 26.39 C ATOM 2328 OH TYR B 65 23.946 27.233 50.121 1.00 30.79 O ATOM 0 H TYR B 65 21.783 26.158 43.907 1.00 15.96 H new ATOM 0 HA TYR B 65 23.784 24.436 44.562 1.00 16.03 H new ATOM 0 HB2 TYR B 65 21.146 24.344 45.578 1.00 18.61 H new ATOM 0 HB3 TYR B 65 22.222 23.256 45.881 1.00 18.61 H new ATOM 0 HD1 TYR B 65 24.162 23.833 47.336 1.00 23.97 H new ATOM 0 HD2 TYR B 65 21.164 26.450 46.795 1.00 23.01 H new ATOM 0 HE1 TYR B 65 24.924 25.075 49.139 1.00 26.21 H new ATOM 0 HE2 TYR B 65 21.917 27.691 48.601 1.00 25.99 H new ATOM 0 HH TYR B 65 23.448 27.900 50.237 1.00 30.79 H new ATOM 2329 N ALA B 66 23.021 22.547 43.113 1.00 14.84 N ATOM 2330 CA ALA B 66 22.601 21.577 42.120 1.00 13.75 C ATOM 2331 C ALA B 66 21.171 21.074 42.380 1.00 12.17 C ATOM 2332 O ALA B 66 20.728 20.878 43.514 1.00 13.11 O ATOM 2333 CB ALA B 66 23.583 20.416 42.043 1.00 15.83 C ATOM 0 H ALA B 66 23.712 22.314 43.569 1.00 14.84 H new ATOM 0 HA ALA B 66 22.596 22.027 41.261 1.00 13.75 H new ATOM 0 HB1 ALA B 66 23.282 19.781 41.374 1.00 15.83 H new ATOM 0 HB2 ALA B 66 24.461 20.750 41.800 1.00 15.83 H new ATOM 0 HB3 ALA B 66 23.633 19.976 42.906 1.00 15.83 H new ATOM 2334 N THR B 67 20.445 20.936 41.282 1.00 10.66 N ATOM 2335 CA THR B 67 19.091 20.388 41.305 1.00 9.83 C ATOM 2336 C THR B 67 19.014 19.284 40.264 1.00 9.17 C ATOM 2337 O THR B 67 19.932 19.096 39.467 1.00 9.05 O ATOM 2338 CB THR B 67 18.028 21.496 40.992 1.00 9.26 C ATOM 2339 OG1 THR B 67 17.981 21.803 39.584 1.00 8.62 O ATOM 2340 CG2 THR B 67 18.304 22.783 41.787 1.00 9.53 C ATOM 0 H THR B 67 20.721 21.157 40.498 1.00 10.66 H new ATOM 0 HA THR B 67 18.897 20.039 42.189 1.00 9.83 H new ATOM 0 HB THR B 67 17.168 21.139 41.263 1.00 9.26 H new ATOM 0 HG1 THR B 67 18.295 22.571 39.454 1.00 8.62 H new ATOM 0 HG21 THR B 67 17.631 23.447 41.572 1.00 9.53 H new ATOM 0 HG22 THR B 67 18.274 22.589 42.737 1.00 9.53 H new ATOM 0 HG23 THR B 67 19.181 23.125 41.554 1.00 9.53 H new ATOM 2341 N PRO B 68 17.904 18.528 40.237 1.00 9.18 N ATOM 2342 CA PRO B 68 17.719 17.651 39.088 1.00 9.27 C ATOM 2343 C PRO B 68 17.816 18.443 37.775 1.00 9.32 C ATOM 2344 O PRO B 68 17.519 19.651 37.749 1.00 9.48 O ATOM 2345 CB PRO B 68 16.317 17.061 39.316 1.00 9.47 C ATOM 2346 CG PRO B 68 16.166 17.108 40.807 1.00 9.92 C ATOM 2347 CD PRO B 68 16.809 18.397 41.216 1.00 9.51 C ATOM 0 HA PRO B 68 18.397 16.962 39.011 1.00 9.27 H new ATOM 0 HB2 PRO B 68 15.632 17.582 38.870 1.00 9.47 H new ATOM 0 HB3 PRO B 68 16.250 16.155 38.977 1.00 9.47 H new ATOM 0 HG2 PRO B 68 15.232 17.082 41.067 1.00 9.92 H new ATOM 0 HG3 PRO B 68 16.599 16.349 41.229 1.00 9.92 H new ATOM 0 HD2 PRO B 68 16.189 19.142 41.167 1.00 9.51 H new ATOM 0 HD3 PRO B 68 17.140 18.363 42.127 1.00 9.51 H new ATOM 2348 N LEU B 69 18.234 17.766 36.719 1.00 9.58 N ATOM 2349 CA LEU B 69 18.448 18.381 35.421 1.00 9.41 C ATOM 2350 C LEU B 69 17.159 18.461 34.599 1.00 9.34 C ATOM 2351 O LEU B 69 16.327 17.562 34.631 1.00 10.64 O ATOM 2352 CB LEU B 69 19.474 17.556 34.658 1.00 10.11 C ATOM 2353 CG LEU B 69 20.844 17.322 35.300 1.00 10.97 C ATOM 2354 CD1 LEU B 69 21.668 16.423 34.407 1.00 11.57 C ATOM 2355 CD2 LEU B 69 21.529 18.656 35.531 1.00 12.04 C ATOM 0 H LEU B 69 18.404 16.923 36.736 1.00 9.58 H new ATOM 0 HA LEU B 69 18.761 19.288 35.565 1.00 9.41 H new ATOM 0 HB2 LEU B 69 19.080 16.688 34.478 1.00 10.11 H new ATOM 0 HB3 LEU B 69 19.619 17.985 33.800 1.00 10.11 H new ATOM 0 HG LEU B 69 20.742 16.884 36.159 1.00 10.97 H new ATOM 0 HD11 LEU B 69 22.537 16.273 34.812 1.00 11.57 H new ATOM 0 HD12 LEU B 69 21.213 15.574 34.294 1.00 11.57 H new ATOM 0 HD13 LEU B 69 21.783 16.845 33.541 1.00 11.57 H new ATOM 0 HD21 LEU B 69 22.397 18.508 35.938 1.00 12.04 H new ATOM 0 HD22 LEU B 69 21.643 19.112 34.683 1.00 12.04 H new ATOM 0 HD23 LEU B 69 20.985 19.202 36.120 1.00 12.04 H new ATOM 2356 N MET B 70 17.019 19.495 33.806 1.00 8.20 N ATOM 2357 CA MET B 70 15.808 19.641 32.993 1.00 7.86 C ATOM 2358 C MET B 70 15.924 18.848 31.699 1.00 7.48 C ATOM 2359 O MET B 70 16.876 19.018 30.938 1.00 8.12 O ATOM 2360 CB MET B 70 15.616 21.116 32.672 1.00 8.15 C ATOM 2361 CG MET B 70 14.361 21.407 31.864 1.00 8.16 C ATOM 2362 SD MET B 70 14.261 23.189 31.621 1.00 8.89 S ATOM 2363 CE MET B 70 12.673 23.407 30.824 1.00 9.42 C ATOM 0 H MET B 70 17.598 20.124 33.715 1.00 8.20 H new ATOM 0 HA MET B 70 15.048 19.299 33.489 1.00 7.86 H new ATOM 0 HB2 MET B 70 15.581 21.617 33.502 1.00 8.15 H new ATOM 0 HB3 MET B 70 16.389 21.435 32.180 1.00 8.15 H new ATOM 0 HG2 MET B 70 14.393 20.949 31.010 1.00 8.16 H new ATOM 0 HG3 MET B 70 13.574 21.083 32.330 1.00 8.16 H new ATOM 0 HE1 MET B 70 12.373 24.322 30.944 1.00 9.42 H new ATOM 0 HE2 MET B 70 12.757 23.217 29.877 1.00 9.42 H new ATOM 0 HE3 MET B 70 12.027 22.801 31.219 1.00 9.42 H new ATOM 2364 N ASP B 71 14.919 18.016 31.422 1.00 7.07 N ATOM 2365 CA ASP B 71 14.751 17.343 30.137 1.00 7.33 C ATOM 2366 C ASP B 71 13.368 17.676 29.613 1.00 7.05 C ATOM 2367 O ASP B 71 12.406 17.736 30.386 1.00 7.42 O ATOM 2368 CB ASP B 71 14.916 15.825 30.327 1.00 7.69 C ATOM 2369 CG ASP B 71 14.815 15.039 29.030 1.00 8.21 C ATOM 2370 OD1 ASP B 71 15.788 15.046 28.257 1.00 9.56 O ATOM 2371 OD2 ASP B 71 13.749 14.446 28.738 1.00 8.13 O ATOM 0 H ASP B 71 14.303 17.824 31.990 1.00 7.07 H new ATOM 0 HA ASP B 71 15.419 17.639 29.500 1.00 7.33 H new ATOM 0 HB2 ASP B 71 15.777 15.649 30.738 1.00 7.69 H new ATOM 0 HB3 ASP B 71 14.238 15.507 30.943 1.00 7.69 H new ATOM 2372 N VAL B 72 13.269 17.955 28.314 1.00 7.03 N ATOM 2373 CA VAL B 72 11.978 18.248 27.681 1.00 6.97 C ATOM 2374 C VAL B 72 11.711 17.243 26.588 1.00 7.05 C ATOM 2375 O VAL B 72 12.634 16.820 25.888 1.00 7.18 O ATOM 2376 CB VAL B 72 11.873 19.706 27.129 1.00 7.06 C ATOM 2377 CG1 VAL B 72 11.999 20.741 28.252 1.00 7.04 C ATOM 2378 CG2 VAL B 72 12.924 19.971 26.061 1.00 7.49 C ATOM 0 H VAL B 72 13.940 17.980 27.777 1.00 7.03 H new ATOM 0 HA VAL B 72 11.300 18.176 28.371 1.00 6.97 H new ATOM 0 HB VAL B 72 10.994 19.793 26.727 1.00 7.06 H new ATOM 0 HG11 VAL B 72 11.930 21.634 27.879 1.00 7.04 H new ATOM 0 HG12 VAL B 72 11.289 20.605 28.898 1.00 7.04 H new ATOM 0 HG13 VAL B 72 12.858 20.640 28.691 1.00 7.04 H new ATOM 0 HG21 VAL B 72 12.835 20.881 25.738 1.00 7.49 H new ATOM 0 HG22 VAL B 72 13.809 19.848 26.440 1.00 7.49 H new ATOM 0 HG23 VAL B 72 12.800 19.353 25.324 1.00 7.49 H new ATOM 2379 N ARG B 73 10.445 16.863 26.461 1.00 7.16 N ATOM 2380 CA ARG B 73 10.020 15.900 25.442 1.00 7.08 C ATOM 2381 C ARG B 73 8.727 16.370 24.807 1.00 7.26 C ATOM 2382 O ARG B 73 7.928 17.070 25.441 1.00 7.03 O ATOM 2383 CB ARG B 73 9.815 14.501 26.037 1.00 7.28 C ATOM 2384 CG ARG B 73 11.068 13.863 26.608 1.00 7.36 C ATOM 2385 CD ARG B 73 12.066 13.506 25.515 1.00 7.88 C ATOM 2386 NE ARG B 73 13.416 13.488 26.060 1.00 8.20 N ATOM 2387 CZ ARG B 73 14.488 13.144 25.357 1.00 8.70 C ATOM 2388 NH1 ARG B 73 14.349 12.742 24.102 1.00 9.30 N ATOM 2389 NH2 ARG B 73 15.678 13.205 25.918 1.00 9.94 N ATOM 0 H ARG B 73 9.807 17.153 26.960 1.00 7.16 H new ATOM 0 HA ARG B 73 10.721 15.844 24.774 1.00 7.08 H new ATOM 0 HB2 ARG B 73 9.147 14.556 26.738 1.00 7.28 H new ATOM 0 HB3 ARG B 73 9.456 13.920 25.348 1.00 7.28 H new ATOM 0 HG2 ARG B 73 11.483 14.472 27.239 1.00 7.36 H new ATOM 0 HG3 ARG B 73 10.828 13.063 27.101 1.00 7.36 H new ATOM 0 HD2 ARG B 73 11.849 12.638 25.139 1.00 7.88 H new ATOM 0 HD3 ARG B 73 12.010 14.150 24.792 1.00 7.88 H new ATOM 0 HE ARG B 73 13.525 13.713 26.883 1.00 8.20 H new ATOM 0 HH11 ARG B 73 13.567 12.705 23.746 1.00 9.30 H new ATOM 0 HH12 ARG B 73 15.041 12.518 23.643 1.00 9.30 H new ATOM 0 HH21 ARG B 73 15.756 13.466 26.734 1.00 9.94 H new ATOM 0 HH22 ARG B 73 16.377 12.984 25.469 1.00 9.94 H new ATOM 2390 N ALA B 74 8.537 15.995 23.546 1.00 7.45 N ATOM 2391 CA ALA B 74 7.326 16.331 22.772 1.00 7.55 C ATOM 2392 C ALA B 74 6.505 15.083 22.494 1.00 7.61 C ATOM 2393 O ALA B 74 7.036 14.073 22.038 1.00 8.23 O ATOM 2394 CB ALA B 74 7.689 16.992 21.451 1.00 7.90 C ATOM 0 H ALA B 74 9.111 15.532 23.103 1.00 7.45 H new ATOM 0 HA ALA B 74 6.803 16.951 23.304 1.00 7.55 H new ATOM 0 HB1 ALA B 74 6.879 17.203 20.961 1.00 7.90 H new ATOM 0 HB2 ALA B 74 8.184 17.808 21.623 1.00 7.90 H new ATOM 0 HB3 ALA B 74 8.236 16.387 20.926 1.00 7.90 H new ATOM 2395 N TRP B 75 5.207 15.185 22.778 1.00 7.44 N ATOM 2396 CA TRP B 75 4.221 14.146 22.506 1.00 7.76 C ATOM 2397 C TRP B 75 3.395 14.631 21.354 1.00 8.01 C ATOM 2398 O TRP B 75 2.581 15.554 21.485 1.00 8.53 O ATOM 2399 CB TRP B 75 3.353 13.974 23.723 1.00 7.79 C ATOM 2400 CG TRP B 75 2.263 12.967 23.570 1.00 7.82 C ATOM 2401 CD1 TRP B 75 0.928 13.203 23.256 1.00 8.17 C ATOM 2402 CD2 TRP B 75 2.378 11.525 23.763 1.00 7.97 C ATOM 2403 NE1 TRP B 75 0.232 12.029 23.257 1.00 8.37 N ATOM 2404 CE2 TRP B 75 1.038 10.981 23.549 1.00 8.39 C ATOM 2405 CE3 TRP B 75 3.416 10.653 24.092 1.00 8.14 C ATOM 2406 CZ2 TRP B 75 0.774 9.623 23.670 1.00 8.55 C ATOM 2407 CZ3 TRP B 75 3.135 9.289 24.191 1.00 8.36 C ATOM 2408 CH2 TRP B 75 1.837 8.796 23.990 1.00 8.68 C ATOM 0 H TRP B 75 4.868 15.884 23.146 1.00 7.44 H new ATOM 0 HA TRP B 75 4.638 13.295 22.297 1.00 7.76 H new ATOM 0 HB2 TRP B 75 3.913 13.716 24.472 1.00 7.79 H new ATOM 0 HB3 TRP B 75 2.957 14.831 23.947 1.00 7.79 H new ATOM 0 HD1 TRP B 75 0.563 14.039 23.072 1.00 8.17 H new ATOM 0 HE1 TRP B 75 -0.610 11.963 23.093 1.00 8.37 H new ATOM 0 HE3 TRP B 75 4.276 10.973 24.242 1.00 8.14 H new ATOM 0 HZ2 TRP B 75 -0.082 9.283 23.541 1.00 8.55 H new ATOM 0 HZ3 TRP B 75 3.822 8.696 24.394 1.00 8.36 H new ATOM 0 HH2 TRP B 75 1.686 7.882 24.075 1.00 8.68 H new ATOM 2409 N ILE B 76 3.621 14.012 20.195 1.00 8.47 N ATOM 2410 CA ILE B 76 2.981 14.432 18.931 1.00 9.16 C ATOM 2411 C ILE B 76 2.252 13.219 18.367 1.00 9.40 C ATOM 2412 O ILE B 76 2.872 12.203 18.077 1.00 9.63 O ATOM 2413 CB ILE B 76 4.059 14.904 17.929 1.00 9.47 C ATOM 2414 CG1 ILE B 76 4.888 16.078 18.498 1.00 10.09 C ATOM 2415 CG2 ILE B 76 3.452 15.201 16.551 1.00 10.32 C ATOM 2416 CD1 ILE B 76 6.275 16.167 17.891 1.00 11.22 C ATOM 0 H ILE B 76 4.148 13.337 20.113 1.00 8.47 H new ATOM 0 HA ILE B 76 2.364 15.165 19.085 1.00 9.16 H new ATOM 0 HB ILE B 76 4.685 14.175 17.796 1.00 9.47 H new ATOM 0 HG12 ILE B 76 4.415 16.910 18.338 1.00 10.09 H new ATOM 0 HG13 ILE B 76 4.966 15.977 19.460 1.00 10.09 H new ATOM 0 HG21 ILE B 76 4.151 15.494 15.946 1.00 10.32 H new ATOM 0 HG22 ILE B 76 3.037 14.398 16.200 1.00 10.32 H new ATOM 0 HG23 ILE B 76 2.784 15.899 16.635 1.00 10.32 H new ATOM 0 HD11 ILE B 76 6.751 16.917 18.280 1.00 11.22 H new ATOM 0 HD12 ILE B 76 6.761 15.347 18.072 1.00 11.22 H new ATOM 0 HD13 ILE B 76 6.201 16.294 16.932 1.00 11.22 H new ATOM 2417 N VAL B 77 0.925 13.323 18.262 1.00 9.87 N ATOM 2418 CA VAL B 77 0.085 12.212 17.794 1.00 10.90 C ATOM 2419 C VAL B 77 -0.513 12.602 16.441 1.00 11.20 C ATOM 2420 O VAL B 77 -1.111 13.674 16.301 1.00 11.85 O ATOM 2421 CB VAL B 77 -1.045 11.881 18.789 1.00 11.38 C ATOM 2422 CG1 VAL B 77 -1.985 10.841 18.183 1.00 12.06 C ATOM 2423 CG2 VAL B 77 -0.469 11.346 20.082 1.00 13.30 C ATOM 0 H VAL B 77 0.486 14.036 18.459 1.00 9.87 H new ATOM 0 HA VAL B 77 0.636 11.418 17.715 1.00 10.90 H new ATOM 0 HB VAL B 77 -1.539 12.695 18.975 1.00 11.38 H new ATOM 0 HG11 VAL B 77 -2.693 10.638 18.814 1.00 12.06 H new ATOM 0 HG12 VAL B 77 -2.372 11.192 17.366 1.00 12.06 H new ATOM 0 HG13 VAL B 77 -1.488 10.032 17.984 1.00 12.06 H new ATOM 0 HG21 VAL B 77 -1.190 11.142 20.698 1.00 13.30 H new ATOM 0 HG22 VAL B 77 0.039 10.540 19.901 1.00 13.30 H new ATOM 0 HG23 VAL B 77 0.114 12.013 20.477 1.00 13.30 H new ATOM 2424 N GLU B 78 -0.318 11.748 15.443 1.00 11.79 N ATOM 2425 CA GLU B 78 -0.943 11.952 14.123 1.00 13.10 C ATOM 2426 C GLU B 78 -1.471 10.597 13.708 1.00 13.90 C ATOM 2427 O GLU B 78 -0.741 9.601 13.784 1.00 13.67 O ATOM 2428 CB GLU B 78 0.061 12.483 13.089 1.00 13.07 C ATOM 2429 CG GLU B 78 0.589 13.875 13.423 1.00 13.72 C ATOM 2430 CD GLU B 78 1.537 14.421 12.390 1.00 14.63 C ATOM 2431 OE1 GLU B 78 1.676 13.781 11.322 1.00 16.09 O ATOM 2432 OE2 GLU B 78 2.158 15.476 12.651 1.00 15.16 O ATOM 0 H GLU B 78 0.171 11.043 15.501 1.00 11.79 H new ATOM 0 HA GLU B 78 -1.647 12.617 14.174 1.00 13.10 H new ATOM 0 HB2 GLU B 78 0.808 11.867 13.026 1.00 13.07 H new ATOM 0 HB3 GLU B 78 -0.363 12.505 12.217 1.00 13.07 H new ATOM 0 HG2 GLU B 78 -0.161 14.483 13.517 1.00 13.72 H new ATOM 0 HG3 GLU B 78 1.040 13.845 14.281 1.00 13.72 H new ATOM 2433 N AASP B 79 -2.737 10.568 13.281 0.50 14.46 N ATOM 2434 N BASP B 79 -2.743 10.555 13.307 0.50 14.55 N ATOM 2435 CA AASP B 79 -3.437 9.337 12.880 0.50 15.37 C ATOM 2436 CA BASP B 79 -3.395 9.316 12.863 0.50 15.54 C ATOM 2437 C AASP B 79 -3.284 8.237 13.933 0.50 15.17 C ATOM 2438 C BASP B 79 -3.280 8.227 13.934 0.50 15.26 C ATOM 2439 O AASP B 79 -3.006 7.083 13.609 0.50 16.04 O ATOM 2440 O BASP B 79 -3.022 7.063 13.624 0.50 16.12 O ATOM 2441 CB AASP B 79 -2.961 8.852 11.501 0.50 16.59 C ATOM 2442 CB BASP B 79 -2.782 8.846 11.535 0.50 16.92 C ATOM 2443 CG AASP B 79 -3.191 9.882 10.407 0.50 17.75 C ATOM 2444 CG BASP B 79 -3.592 7.760 10.865 0.50 18.32 C ATOM 2445 OD1AASP B 79 -4.221 10.583 10.454 0.50 19.07 O ATOM 2446 OD1BASP B 79 -4.830 7.760 11.019 0.50 19.72 O ATOM 2447 OD2AASP B 79 -2.336 10.004 9.503 0.50 19.22 O ATOM 2448 OD2BASP B 79 -2.981 6.916 10.172 0.50 19.78 O ATOM 0 H AASP B 79 -3.223 11.274 13.214 0.50 14.55 H new ATOM 0 H BASP B 79 -3.255 11.246 13.284 0.50 14.55 H new ATOM 0 HA AASP B 79 -4.381 9.548 12.812 0.50 15.54 H new ATOM 0 HA BASP B 79 -4.338 9.494 12.722 0.50 15.54 H new ATOM 0 HB2AASP B 79 -2.016 8.638 11.546 0.50 16.92 H new ATOM 0 HB2BASP B 79 -2.705 9.603 10.934 0.50 16.92 H new ATOM 0 HB3AASP B 79 -3.427 8.032 11.272 0.50 16.92 H new ATOM 0 HB3BASP B 79 -1.883 8.520 11.697 0.50 16.92 H new ATOM 2449 N GLU B 80 -3.444 8.630 15.199 1.00 15.46 N ATOM 2450 CA GLU B 80 -3.362 7.718 16.354 1.00 16.59 C ATOM 2451 C GLU B 80 -2.017 7.008 16.515 1.00 14.94 C ATOM 2452 O GLU B 80 -1.939 5.912 17.061 1.00 16.28 O ATOM 2453 CB GLU B 80 -4.510 6.690 16.361 1.00 19.74 C ATOM 2454 CG GLU B 80 -5.915 7.294 16.402 1.00 24.11 C ATOM 2455 CD GLU B 80 -6.252 7.937 17.742 1.00 27.49 C ATOM 2456 OE1 GLU B 80 -5.831 9.087 17.992 1.00 31.05 O ATOM 2457 OE2 GLU B 80 -6.954 7.295 18.555 1.00 32.26 O ATOM 0 H AGLU B 80 -3.606 9.446 15.418 0.50 15.46 H new ATOM 0 H BGLU B 80 -3.607 9.446 15.415 0.50 15.46 H new ATOM 0 HA GLU B 80 -3.452 8.303 17.123 1.00 16.59 H new ATOM 0 HB2 GLU B 80 -4.434 6.134 15.570 1.00 19.74 H new ATOM 0 HB3 GLU B 80 -4.400 6.107 17.129 1.00 19.74 H new ATOM 0 HG2 GLU B 80 -5.995 7.960 15.701 1.00 24.11 H new ATOM 0 HG3 GLU B 80 -6.565 6.600 16.210 1.00 24.11 H new ATOM 2458 N LYS B 81 -0.959 7.638 16.009 1.00 13.23 N ATOM 2459 CA LYS B 81 0.396 7.129 16.145 1.00 12.46 C ATOM 2460 C LYS B 81 1.258 8.235 16.729 1.00 11.13 C ATOM 2461 O LYS B 81 0.983 9.419 16.540 1.00 11.08 O ATOM 2462 CB LYS B 81 0.943 6.689 14.785 1.00 13.78 C ATOM 2463 CG LYS B 81 0.151 5.549 14.152 1.00 15.37 C ATOM 2464 CD LYS B 81 0.673 5.311 12.750 1.00 19.03 C ATOM 2465 CE LYS B 81 0.105 4.058 12.117 1.00 21.86 C ATOM 2466 NZ LYS B 81 0.946 3.730 10.924 1.00 25.16 N ATOM 0 H LYS B 81 -1.012 8.378 15.574 1.00 13.23 H new ATOM 0 HA LYS B 81 0.403 6.355 16.730 1.00 12.46 H new ATOM 0 HB2 LYS B 81 0.941 7.449 14.182 1.00 13.78 H new ATOM 0 HB3 LYS B 81 1.867 6.413 14.890 1.00 13.78 H new ATOM 0 HG2 LYS B 81 0.239 4.743 14.684 1.00 15.37 H new ATOM 0 HG3 LYS B 81 -0.793 5.770 14.126 1.00 15.37 H new ATOM 0 HD2 LYS B 81 0.456 6.076 12.194 1.00 19.03 H new ATOM 0 HD3 LYS B 81 1.640 5.245 12.776 1.00 19.03 H new ATOM 0 HE2 LYS B 81 0.112 3.324 12.751 1.00 21.86 H new ATOM 0 HE3 LYS B 81 -0.818 4.198 11.855 1.00 21.86 H new ATOM 0 HZ1 LYS B 81 0.632 2.995 10.532 1.00 25.16 H new ATOM 0 HZ2 LYS B 81 0.920 4.407 10.347 1.00 25.16 H new ATOM 0 HZ3 LYS B 81 1.787 3.593 11.182 1.00 25.16 H new ATOM 2467 N AILE B 82 2.279 7.839 17.485 0.50 10.25 N ATOM 2468 N BILE B 82 2.324 7.823 17.405 0.50 10.57 N ATOM 2469 CA AILE B 82 3.159 8.805 18.147 0.50 10.02 C ATOM 2470 CA BILE B 82 3.198 8.710 18.165 0.50 10.60 C ATOM 2471 C AILE B 82 4.463 9.017 17.387 0.50 9.60 C ATOM 2472 C BILE B 82 4.501 8.995 17.414 0.50 9.92 C ATOM 2473 O AILE B 82 5.037 8.079 16.837 0.50 9.33 O ATOM 2474 O BILE B 82 5.122 8.067 16.889 0.50 9.57 O ATOM 2475 CB AILE B 82 3.466 8.406 19.610 0.50 9.88 C ATOM 2476 CB BILE B 82 3.533 8.026 19.499 0.50 10.85 C ATOM 2477 CG1AILE B 82 4.207 7.066 19.705 0.50 10.01 C ATOM 2478 CG1BILE B 82 2.261 7.444 20.138 0.50 12.29 C ATOM 2479 CG2AILE B 82 2.197 8.404 20.456 0.50 9.98 C ATOM 2480 CG2BILE B 82 4.300 8.961 20.417 0.50 10.25 C ATOM 2481 CD1AILE B 82 4.888 6.899 21.052 0.50 10.73 C ATOM 2482 CD1BILE B 82 1.137 8.429 20.292 0.50 13.88 C ATOM 0 H AILE B 82 2.481 7.015 17.629 0.50 10.57 H new ATOM 0 H BILE B 82 2.566 6.998 17.436 0.50 10.57 H new ATOM 0 HA AILE B 82 2.671 9.643 18.152 0.50 10.60 H new ATOM 0 HA BILE B 82 2.740 9.554 18.304 0.50 10.60 H new ATOM 0 HB AILE B 82 4.064 9.080 19.969 0.50 10.85 H new ATOM 0 HB BILE B 82 4.126 7.277 19.332 0.50 10.85 H new ATOM 0 HG12AILE B 82 3.581 6.338 19.566 0.50 12.29 H new ATOM 0 HG12BILE B 82 1.952 6.700 19.598 0.50 12.29 H new ATOM 0 HG13AILE B 82 4.869 7.010 18.998 0.50 12.29 H new ATOM 0 HG13BILE B 82 2.485 7.087 21.011 0.50 12.29 H new ATOM 0 HG21AILE B 82 2.415 8.151 21.367 0.50 10.25 H new ATOM 0 HG21BILE B 82 4.499 8.506 21.250 0.50 10.25 H new ATOM 0 HG22AILE B 82 1.804 9.291 20.452 0.50 10.25 H new ATOM 0 HG22BILE B 82 5.129 9.227 19.989 0.50 10.25 H new ATOM 0 HG23AILE B 82 1.563 7.769 20.088 0.50 10.25 H new ATOM 0 HG23BILE B 82 3.763 9.748 20.599 0.50 10.25 H new ATOM 0 HD11AILE B 82 5.346 6.044 21.080 0.50 13.88 H new ATOM 0 HD11BILE B 82 0.375 7.989 20.700 0.50 13.88 H new ATOM 0 HD12AILE B 82 5.531 7.614 21.181 0.50 13.88 H new ATOM 0 HD12BILE B 82 1.425 9.164 20.856 0.50 13.88 H new ATOM 0 HD13AILE B 82 4.223 6.932 21.757 0.50 13.88 H new ATOM 0 HD13BILE B 82 0.884 8.771 19.420 0.50 13.88 H new ATOM 2483 N CYS B 83 4.928 10.260 17.369 1.00 9.48 N ATOM 2484 CA CYS B 83 6.181 10.592 16.720 1.00 9.40 C ATOM 2485 C CYS B 83 7.377 10.163 17.571 1.00 8.82 C ATOM 2486 O CYS B 83 7.479 10.548 18.753 1.00 9.04 O ATOM 2487 CB CYS B 83 6.244 12.097 16.479 1.00 9.49 C ATOM 2488 SG CYS B 83 7.779 12.651 15.691 1.00 11.39 S ATOM 0 H ACYS B 83 4.527 10.929 17.731 0.50 9.48 H new ATOM 0 H BCYS B 83 4.506 10.929 17.707 0.50 9.48 H new ATOM 0 HA CYS B 83 6.222 10.116 15.876 1.00 9.40 H new ATOM 0 HB2 CYS B 83 5.493 12.358 15.923 1.00 9.49 H new ATOM 0 HB3 CYS B 83 6.142 12.556 17.327 1.00 9.49 H new ATOM 0 HG CYS B 83 7.744 13.841 15.538 1.00 11.39 H new ATOM 2489 N LEU B 84 8.271 9.358 16.999 1.00 8.86 N ATOM 2490 CA LEU B 84 9.536 9.008 17.639 1.00 8.87 C ATOM 2491 C LEU B 84 10.678 9.347 16.694 1.00 8.61 C ATOM 2492 O LEU B 84 10.529 9.297 15.473 1.00 8.71 O ATOM 2493 CB LEU B 84 9.598 7.520 18.033 1.00 8.80 C ATOM 2494 CG LEU B 84 8.512 7.046 19.016 1.00 8.99 C ATOM 2495 CD1 LEU B 84 8.543 5.536 19.162 1.00 9.60 C ATOM 2496 CD2 LEU B 84 8.636 7.708 20.387 1.00 9.35 C ATOM 0 H LEU B 84 8.159 8.999 16.226 1.00 8.86 H new ATOM 0 HA LEU B 84 9.612 9.521 18.459 1.00 8.87 H new ATOM 0 HB2 LEU B 84 9.536 6.985 17.226 1.00 8.80 H new ATOM 0 HB3 LEU B 84 10.467 7.342 18.426 1.00 8.80 H new ATOM 0 HG LEU B 84 7.659 7.314 18.640 1.00 8.99 H new ATOM 0 HD11 LEU B 84 7.853 5.257 19.784 1.00 9.60 H new ATOM 0 HD12 LEU B 84 8.385 5.124 18.298 1.00 9.60 H new ATOM 0 HD13 LEU B 84 9.411 5.261 19.497 1.00 9.60 H new ATOM 0 HD21 LEU B 84 7.934 7.380 20.970 1.00 9.35 H new ATOM 0 HD22 LEU B 84 9.501 7.496 20.772 1.00 9.35 H new ATOM 0 HD23 LEU B 84 8.553 8.670 20.291 1.00 9.35 H new ATOM 2497 N VAL B 85 11.822 9.688 17.286 1.00 8.74 N ATOM 2498 CA VAL B 85 13.054 9.944 16.539 1.00 9.20 C ATOM 2499 C VAL B 85 14.156 9.010 16.999 1.00 9.42 C ATOM 2500 O VAL B 85 14.179 8.544 18.146 1.00 9.60 O ATOM 2501 CB VAL B 85 13.523 11.415 16.663 1.00 9.02 C ATOM 2502 CG1 VAL B 85 12.569 12.334 15.943 1.00 9.20 C ATOM 2503 CG2 VAL B 85 13.717 11.830 18.125 1.00 9.50 C ATOM 0 H VAL B 85 11.906 9.778 18.137 1.00 8.74 H new ATOM 0 HA VAL B 85 12.858 9.778 15.604 1.00 9.20 H new ATOM 0 HB VAL B 85 14.391 11.489 16.237 1.00 9.02 H new ATOM 0 HG11 VAL B 85 12.875 13.250 16.029 1.00 9.20 H new ATOM 0 HG12 VAL B 85 12.533 12.092 15.004 1.00 9.20 H new ATOM 0 HG13 VAL B 85 11.684 12.251 16.332 1.00 9.20 H new ATOM 0 HG21 VAL B 85 14.010 12.754 18.163 1.00 9.50 H new ATOM 0 HG22 VAL B 85 12.877 11.737 18.602 1.00 9.50 H new ATOM 0 HG23 VAL B 85 14.387 11.262 18.537 1.00 9.50 H new ATOM 2504 N ARG B 86 15.074 8.723 16.068 1.00 9.90 N ATOM 2505 CA ARG B 86 16.211 7.866 16.316 1.00 10.39 C ATOM 2506 C ARG B 86 17.460 8.681 16.100 1.00 10.55 C ATOM 2507 O ARG B 86 17.651 9.271 15.029 1.00 10.49 O ATOM 2508 CB ARG B 86 16.182 6.642 15.376 1.00 10.42 C ATOM 2509 CG ARG B 86 17.351 5.687 15.610 1.00 11.44 C ATOM 2510 CD ARG B 86 17.251 4.432 14.734 1.00 11.94 C ATOM 2511 NE ARG B 86 17.362 4.712 13.301 1.00 11.89 N ATOM 2512 CZ ARG B 86 18.496 4.983 12.642 1.00 11.95 C ATOM 2513 NH1 ARG B 86 19.646 5.035 13.293 1.00 12.68 N ATOM 2514 NH2 ARG B 86 18.470 5.211 11.327 1.00 13.07 N ATOM 0 H ARG B 86 15.043 9.031 15.266 1.00 9.90 H new ATOM 0 HA ARG B 86 16.188 7.530 17.226 1.00 10.39 H new ATOM 0 HB2 ARG B 86 15.348 6.163 15.502 1.00 10.42 H new ATOM 0 HB3 ARG B 86 16.198 6.946 14.455 1.00 10.42 H new ATOM 0 HG2 ARG B 86 18.185 6.146 15.423 1.00 11.44 H new ATOM 0 HG3 ARG B 86 17.374 5.427 16.544 1.00 11.44 H new ATOM 0 HD2 ARG B 86 17.950 3.810 14.990 1.00 11.94 H new ATOM 0 HD3 ARG B 86 16.404 3.992 14.906 1.00 11.94 H new ATOM 0 HE ARG B 86 16.635 4.702 12.842 1.00 11.89 H new ATOM 0 HH11 ARG B 86 19.667 4.895 14.141 1.00 12.68 H new ATOM 0 HH12 ARG B 86 20.373 5.209 12.868 1.00 12.68 H new ATOM 0 HH21 ARG B 86 17.724 5.184 10.901 1.00 13.07 H new ATOM 0 HH22 ARG B 86 19.200 5.385 10.906 1.00 13.07 H new ATOM 2515 N GLY B 87 18.292 8.729 17.139 1.00 11.24 N ATOM 2516 CA GLY B 87 19.543 9.498 17.063 1.00 12.21 C ATOM 2517 C GLY B 87 20.562 8.888 16.116 1.00 13.00 C ATOM 2518 O GLY B 87 20.587 7.671 15.908 1.00 13.70 O ATOM 0 H GLY B 87 18.157 8.331 17.889 1.00 11.24 H new ATOM 0 HA2 GLY B 87 19.343 10.402 16.775 1.00 12.21 H new ATOM 0 HA3 GLY B 87 19.931 9.562 17.950 1.00 12.21 H new ATOM 2519 N GLN B 88 21.386 9.743 15.512 1.00 14.37 N ATOM 2520 CA GLN B 88 22.515 9.259 14.699 1.00 15.76 C ATOM 2521 C GLN B 88 23.369 8.255 15.472 1.00 16.96 C ATOM 2522 O GLN B 88 23.755 8.499 16.621 1.00 18.29 O ATOM 2523 CB GLN B 88 23.395 10.430 14.239 1.00 15.91 C ATOM 2524 CG GLN B 88 22.804 11.313 13.159 1.00 15.91 C ATOM 2525 CD GLN B 88 22.650 10.644 11.792 1.00 15.32 C ATOM 2526 OE1 GLN B 88 22.035 11.207 10.893 1.00 17.28 O ATOM 2527 NE2 GLN B 88 23.170 9.440 11.651 1.00 16.66 N ATOM 0 H GLN B 88 21.315 10.599 15.556 1.00 14.37 H new ATOM 0 HA GLN B 88 22.141 8.814 13.923 1.00 15.76 H new ATOM 0 HB2 GLN B 88 23.598 10.983 15.010 1.00 15.91 H new ATOM 0 HB3 GLN B 88 24.237 10.073 13.916 1.00 15.91 H new ATOM 0 HG2 GLN B 88 21.933 11.622 13.453 1.00 15.91 H new ATOM 0 HG3 GLN B 88 23.365 12.098 13.059 1.00 15.91 H new ATOM 0 HE21 GLN B 88 23.595 9.076 12.304 1.00 16.66 H new ATOM 0 HE22 GLN B 88 23.084 9.019 10.906 1.00 16.66 H new ATOM 2528 N GLY B 89 23.633 7.111 14.848 1.00 17.62 N ATOM 2529 CA GLY B 89 24.467 6.072 15.468 1.00 18.51 C ATOM 2530 C GLY B 89 23.771 5.222 16.521 1.00 18.63 C ATOM 2531 O GLY B 89 24.395 4.367 17.147 1.00 21.54 O ATOM 0 H GLY B 89 23.341 6.912 14.064 1.00 17.62 H new ATOM 0 HA2 GLY B 89 24.801 5.487 14.770 1.00 18.51 H new ATOM 0 HA3 GLY B 89 25.238 6.497 15.875 1.00 18.51 H new ATOM 2532 N GLU B 90 22.469 5.453 16.716 1.00 17.64 N ATOM 2533 CA GLU B 90 21.692 4.730 17.727 1.00 17.28 C ATOM 2534 C GLU B 90 20.690 3.785 17.080 1.00 15.89 C ATOM 2535 O GLU B 90 20.267 4.008 15.944 1.00 17.18 O ATOM 2536 CB GLU B 90 20.959 5.726 18.645 1.00 17.75 C ATOM 2537 CG GLU B 90 21.919 6.628 19.419 1.00 19.94 C ATOM 2538 CD GLU B 90 21.307 7.334 20.620 1.00 22.14 C ATOM 2539 OE1 GLU B 90 20.202 6.971 21.068 1.00 22.20 O ATOM 2540 OE2 GLU B 90 21.968 8.250 21.155 1.00 25.15 O ATOM 0 H GLU B 90 22.014 6.030 16.268 1.00 17.64 H new ATOM 0 HA GLU B 90 22.309 4.200 18.256 1.00 17.28 H new ATOM 0 HB2 GLU B 90 20.364 6.275 18.111 1.00 17.75 H new ATOM 0 HB3 GLU B 90 20.405 5.235 19.272 1.00 17.75 H new ATOM 0 HG2 GLU B 90 22.670 6.094 19.722 1.00 19.94 H new ATOM 0 HG3 GLU B 90 22.273 7.297 18.813 1.00 19.94 H new ATOM 2541 N ASP B 91 20.308 2.742 17.808 1.00 16.20 N ATOM 2542 CA ASP B 91 19.348 1.767 17.286 1.00 16.21 C ATOM 2543 C ASP B 91 18.048 1.797 18.075 1.00 15.37 C ATOM 2544 O ASP B 91 17.264 0.860 18.012 1.00 16.88 O ATOM 2545 CB ASP B 91 19.947 0.356 17.332 1.00 19.32 C ATOM 2546 CG ASP B 91 20.294 -0.100 18.745 1.00 21.70 C ATOM 2547 OD1 ASP B 91 19.807 0.483 19.735 1.00 23.63 O ATOM 2548 OD2 ASP B 91 21.076 -1.070 18.867 1.00 26.34 O ATOM 0 H ASP B 91 20.590 2.578 18.604 1.00 16.20 H new ATOM 0 HA ASP B 91 19.153 2.005 16.366 1.00 16.21 H new ATOM 0 HB2 ASP B 91 19.317 -0.270 16.941 1.00 19.32 H new ATOM 0 HB3 ASP B 91 20.747 0.332 16.784 1.00 19.32 H new ATOM 2549 N ASER B 92 17.842 2.851 18.857 0.50 14.44 N ATOM 2550 N BSER B 92 17.846 2.890 18.810 0.50 13.77 N ATOM 2551 CA ASER B 92 16.640 2.974 19.678 0.50 13.66 C ATOM 2552 CA BSER B 92 16.743 3.059 19.753 0.50 12.75 C ATOM 2553 C ASER B 92 15.981 4.318 19.453 0.50 12.20 C ATOM 2554 C BSER B 92 15.982 4.341 19.436 0.50 11.67 C ATOM 2555 O ASER B 92 16.599 5.242 18.943 0.50 12.03 O ATOM 2556 O BSER B 92 16.531 5.256 18.830 0.50 11.76 O ATOM 2557 CB ASER B 92 16.968 2.782 21.161 0.50 14.73 C ATOM 2558 CB BSER B 92 17.304 3.142 21.177 0.50 12.54 C ATOM 2559 OG ASER B 92 17.280 1.431 21.419 0.50 17.20 O ATOM 2560 OG BSER B 92 18.143 4.270 21.306 0.50 13.19 O ATOM 0 H ASER B 92 18.389 3.511 18.928 0.50 13.77 H new ATOM 0 H BSER B 92 18.364 3.575 18.772 0.50 13.77 H new ATOM 0 HA ASER B 92 16.021 2.276 19.412 0.50 12.75 H new ATOM 0 HA BSER B 92 16.140 2.303 19.680 0.50 12.75 H new ATOM 0 HB2ASER B 92 17.716 3.347 21.410 0.50 12.54 H new ATOM 0 HB2BSER B 92 16.576 3.197 21.816 0.50 12.54 H new ATOM 0 HB3ASER B 92 16.213 3.056 21.704 0.50 12.54 H new ATOM 0 HB3BSER B 92 17.802 2.335 21.383 0.50 12.54 H new ATOM 0 HG ASER B 92 16.933 1.197 22.148 0.50 13.19 H new ATOM 0 HG BSER B 92 18.422 4.500 20.548 0.50 13.19 H new ATOM 2561 N TRP B 93 14.722 4.406 19.879 1.00 10.82 N ATOM 2562 CA TRP B 93 13.842 5.533 19.571 1.00 9.97 C ATOM 2563 C TRP B 93 13.330 6.219 20.823 1.00 9.19 C ATOM 2564 O TRP B 93 13.180 5.599 21.868 1.00 9.44 O ATOM 2565 CB TRP B 93 12.645 5.015 18.775 1.00 9.62 C ATOM 2566 CG TRP B 93 13.008 4.380 17.460 1.00 9.81 C ATOM 2567 CD1 TRP B 93 13.538 3.111 17.231 1.00 9.96 C ATOM 2568 CD2 TRP B 93 12.866 4.990 16.157 1.00 9.76 C ATOM 2569 NE1 TRP B 93 13.727 2.924 15.876 1.00 10.40 N ATOM 2570 CE2 TRP B 93 13.330 3.999 15.182 1.00 9.81 C ATOM 2571 CE3 TRP B 93 12.409 6.218 15.703 1.00 9.56 C ATOM 2572 CZ2 TRP B 93 13.342 4.268 13.817 1.00 9.92 C ATOM 2573 CZ3 TRP B 93 12.406 6.472 14.329 1.00 9.74 C ATOM 2574 CH2 TRP B 93 12.862 5.504 13.408 1.00 9.93 C ATOM 0 H ATRP B 93 14.349 3.802 20.364 0.50 10.82 H new ATOM 0 H BTRP B 93 14.357 3.798 20.365 0.50 10.82 H new ATOM 0 HA TRP B 93 14.354 6.181 19.063 1.00 9.97 H new ATOM 0 HB2 TRP B 93 12.166 4.367 19.315 1.00 9.62 H new ATOM 0 HB3 TRP B 93 12.036 5.752 18.610 1.00 9.62 H new ATOM 0 HD1 TRP B 93 13.734 2.485 17.891 1.00 9.96 H new ATOM 0 HE1 TRP B 93 14.056 2.212 15.524 1.00 10.40 H new ATOM 0 HE3 TRP B 93 12.109 6.862 16.303 1.00 9.56 H new ATOM 0 HZ2 TRP B 93 13.659 3.645 13.204 1.00 9.92 H new ATOM 0 HZ3 TRP B 93 12.099 7.292 14.016 1.00 9.74 H new ATOM 0 HH2 TRP B 93 12.840 5.701 12.499 1.00 9.93 H new ATOM 2575 N ALA B 94 13.021 7.509 20.707 1.00 9.00 N ATOM 2576 CA ALA B 94 12.445 8.247 21.822 1.00 8.95 C ATOM 2577 C ALA B 94 11.587 9.383 21.315 1.00 8.39 C ATOM 2578 O ALA B 94 11.631 9.750 20.144 1.00 8.71 O ATOM 2579 CB ALA B 94 13.549 8.795 22.719 1.00 9.97 C ATOM 0 H ALA B 94 13.138 7.972 19.992 1.00 9.00 H new ATOM 0 HA ALA B 94 11.891 7.640 22.337 1.00 8.95 H new ATOM 0 HB1 ALA B 94 13.153 9.284 23.457 1.00 9.97 H new ATOM 0 HB2 ALA B 94 14.079 8.060 23.066 1.00 9.97 H new ATOM 0 HB3 ALA B 94 14.118 9.390 22.206 1.00 9.97 H new ATOM 2580 N LEU B 95 10.799 9.972 22.222 1.00 8.26 N ATOM 2581 CA LEU B 95 10.101 11.198 21.891 1.00 7.99 C ATOM 2582 C LEU B 95 11.144 12.281 21.569 1.00 7.91 C ATOM 2583 O LEU B 95 12.206 12.330 22.219 1.00 7.49 O ATOM 2584 CB LEU B 95 9.265 11.690 23.088 1.00 8.31 C ATOM 2585 CG LEU B 95 8.185 10.735 23.627 1.00 7.93 C ATOM 2586 CD1 LEU B 95 7.519 11.329 24.860 1.00 8.37 C ATOM 2587 CD2 LEU B 95 7.121 10.433 22.570 1.00 8.50 C ATOM 0 H LEU B 95 10.663 9.677 23.018 1.00 8.26 H new ATOM 0 HA LEU B 95 9.516 11.030 21.136 1.00 7.99 H new ATOM 0 HB2 LEU B 95 9.873 11.898 23.815 1.00 8.31 H new ATOM 0 HB3 LEU B 95 8.833 12.520 22.833 1.00 8.31 H new ATOM 0 HG LEU B 95 8.626 9.904 23.863 1.00 7.93 H new ATOM 0 HD11 LEU B 95 6.842 10.717 25.188 1.00 8.37 H new ATOM 0 HD12 LEU B 95 8.185 11.474 25.550 1.00 8.37 H new ATOM 0 HD13 LEU B 95 7.105 12.175 24.628 1.00 8.37 H new ATOM 0 HD21 LEU B 95 6.458 9.830 22.941 1.00 8.50 H new ATOM 0 HD22 LEU B 95 6.691 11.259 22.298 1.00 8.50 H new ATOM 0 HD23 LEU B 95 7.539 10.018 21.799 1.00 8.50 H new ATOM 2588 N PRO B 96 10.826 13.172 20.615 1.00 7.94 N ATOM 2589 CA PRO B 96 11.760 14.291 20.383 1.00 8.35 C ATOM 2590 C PRO B 96 11.977 15.096 21.660 1.00 8.46 C ATOM 2591 O PRO B 96 11.060 15.238 22.487 1.00 8.32 O ATOM 2592 CB PRO B 96 11.020 15.137 19.339 1.00 8.63 C ATOM 2593 CG PRO B 96 10.070 14.198 18.660 1.00 8.89 C ATOM 2594 CD PRO B 96 9.629 13.257 19.751 1.00 8.13 C ATOM 0 HA PRO B 96 12.641 14.000 20.099 1.00 8.35 H new ATOM 0 HB2 PRO B 96 10.545 15.871 19.758 1.00 8.63 H new ATOM 0 HB3 PRO B 96 11.640 15.527 18.703 1.00 8.63 H new ATOM 0 HG2 PRO B 96 9.316 14.673 18.277 1.00 8.89 H new ATOM 0 HG3 PRO B 96 10.502 13.721 17.935 1.00 8.89 H new ATOM 0 HD2 PRO B 96 8.861 13.600 20.233 1.00 8.13 H new ATOM 0 HD3 PRO B 96 9.378 12.389 19.398 1.00 8.13 H new ATOM 2595 N GLY B 97 13.185 15.625 21.808 1.00 8.86 N ATOM 2596 CA GLY B 97 13.523 16.492 22.931 1.00 9.11 C ATOM 2597 C GLY B 97 14.957 16.318 23.354 1.00 9.17 C ATOM 2598 O GLY B 97 15.820 15.873 22.579 1.00 10.16 O ATOM 0 H GLY B 97 13.834 15.492 21.259 1.00 8.86 H new ATOM 0 HA2 GLY B 97 13.368 17.417 22.684 1.00 9.11 H new ATOM 0 HA3 GLY B 97 12.938 16.296 23.680 1.00 9.11 H new ATOM 2599 N GLY B 98 15.238 16.657 24.596 1.00 9.21 N ATOM 2600 CA GLY B 98 16.605 16.660 25.090 1.00 8.95 C ATOM 2601 C GLY B 98 16.719 17.608 26.255 1.00 8.88 C ATOM 2602 O GLY B 98 15.718 18.003 26.839 1.00 8.67 O ATOM 0 H GLY B 98 14.648 16.891 25.177 1.00 9.21 H new ATOM 0 HA2 GLY B 98 16.862 15.765 25.363 1.00 8.95 H new ATOM 0 HA3 GLY B 98 17.213 16.927 24.383 1.00 8.95 H new ATOM 2603 N PHE B 99 17.944 17.960 26.625 1.00 9.60 N ATOM 2604 CA PHE B 99 18.154 18.885 27.736 1.00 10.24 C ATOM 2605 C PHE B 99 17.469 20.202 27.534 1.00 9.90 C ATOM 2606 O PHE B 99 17.500 20.767 26.443 1.00 10.67 O ATOM 2607 CB PHE B 99 19.638 19.239 27.848 1.00 12.07 C ATOM 2608 CG PHE B 99 20.460 18.194 28.493 1.00 13.89 C ATOM 2609 CD1 PHE B 99 20.360 17.961 29.865 1.00 15.05 C ATOM 2610 CD2 PHE B 99 21.367 17.443 27.745 1.00 15.41 C ATOM 2611 CE1 PHE B 99 21.135 16.985 30.471 1.00 16.47 C ATOM 2612 CE2 PHE B 99 22.149 16.462 28.356 1.00 16.05 C ATOM 2613 CZ PHE B 99 22.028 16.242 29.717 1.00 15.97 C ATOM 0 H PHE B 99 18.664 17.678 26.250 1.00 9.60 H new ATOM 0 HA PHE B 99 17.803 18.431 28.518 1.00 10.24 H new ATOM 0 HB2 PHE B 99 19.988 19.410 26.960 1.00 12.07 H new ATOM 0 HB3 PHE B 99 19.727 20.063 28.351 1.00 12.07 H new ATOM 0 HD1 PHE B 99 19.769 18.464 30.377 1.00 15.05 H new ATOM 0 HD2 PHE B 99 21.451 17.597 26.832 1.00 15.41 H new ATOM 0 HE1 PHE B 99 21.055 16.829 31.384 1.00 16.47 H new ATOM 0 HE2 PHE B 99 22.748 15.959 27.852 1.00 16.05 H new ATOM 0 HZ PHE B 99 22.550 15.591 30.128 1.00 15.97 H new ATOM 2614 N GLY B 100 16.882 20.719 28.608 1.00 9.38 N ATOM 2615 CA GLY B 100 16.473 22.118 28.611 1.00 9.38 C ATOM 2616 C GLY B 100 17.716 23.001 28.640 1.00 9.22 C ATOM 2617 O GLY B 100 18.645 22.736 29.416 1.00 10.60 O ATOM 0 H GLY B 100 16.714 20.286 29.332 1.00 9.38 H new ATOM 0 HA2 GLY B 100 15.942 22.313 27.823 1.00 9.38 H new ATOM 0 HA3 GLY B 100 15.914 22.302 29.382 1.00 9.38 H new ATOM 2618 N GLU B 101 17.719 24.032 27.804 1.00 9.18 N ATOM 2619 CA GLU B 101 18.859 24.957 27.734 1.00 9.41 C ATOM 2620 C GLU B 101 18.573 26.228 28.492 1.00 9.29 C ATOM 2621 O GLU B 101 17.444 26.736 28.507 1.00 8.78 O ATOM 2622 CB GLU B 101 19.170 25.300 26.293 1.00 11.11 C ATOM 2623 CG GLU B 101 19.686 24.121 25.486 1.00 13.48 C ATOM 2624 CD GLU B 101 20.018 24.557 24.100 1.00 15.20 C ATOM 2625 OE1 GLU B 101 21.151 25.041 23.896 1.00 16.48 O ATOM 2626 OE2 GLU B 101 19.140 24.434 23.218 1.00 17.01 O ATOM 0 H GLU B 101 17.074 24.219 27.267 1.00 9.18 H new ATOM 0 HA GLU B 101 19.622 24.515 28.137 1.00 9.41 H new ATOM 0 HB2 GLU B 101 18.368 25.646 25.870 1.00 11.11 H new ATOM 0 HB3 GLU B 101 19.830 26.010 26.273 1.00 11.11 H new ATOM 0 HG2 GLU B 101 20.473 23.747 25.913 1.00 13.48 H new ATOM 0 HG3 GLU B 101 19.017 23.419 25.461 1.00 13.48 H new ATOM 2627 N VAL B 102 19.633 26.768 29.079 1.00 8.61 N ATOM 2628 CA VAL B 102 19.559 28.067 29.733 1.00 9.07 C ATOM 2629 C VAL B 102 19.317 29.130 28.684 1.00 9.10 C ATOM 2630 O VAL B 102 19.919 29.098 27.612 1.00 9.75 O ATOM 2631 CB VAL B 102 20.877 28.350 30.473 1.00 9.06 C ATOM 2632 CG1 VAL B 102 20.964 29.815 30.927 1.00 9.33 C ATOM 2633 CG2 VAL B 102 21.049 27.393 31.640 1.00 9.73 C ATOM 0 H VAL B 102 20.408 26.397 29.110 1.00 8.61 H new ATOM 0 HA VAL B 102 18.832 28.072 30.375 1.00 9.07 H new ATOM 0 HB VAL B 102 21.608 28.201 29.853 1.00 9.06 H new ATOM 0 HG11 VAL B 102 21.804 29.961 31.389 1.00 9.33 H new ATOM 0 HG12 VAL B 102 20.916 30.397 30.153 1.00 9.33 H new ATOM 0 HG13 VAL B 102 20.227 30.013 31.526 1.00 9.33 H new ATOM 0 HG21 VAL B 102 21.884 27.584 32.095 1.00 9.73 H new ATOM 0 HG22 VAL B 102 20.311 27.502 32.260 1.00 9.73 H new ATOM 0 HG23 VAL B 102 21.063 26.481 31.311 1.00 9.73 H new ATOM 2634 N GLY B 103 18.419 30.065 28.982 1.00 9.14 N ATOM 2635 CA GLY B 103 18.095 31.152 28.079 1.00 9.36 C ATOM 2636 C GLY B 103 16.786 31.003 27.335 1.00 9.27 C ATOM 2637 O GLY B 103 16.398 31.864 26.557 1.00 10.56 O ATOM 0 H GLY B 103 17.980 30.082 29.721 1.00 9.14 H new ATOM 0 HA2 GLY B 103 18.070 31.978 28.586 1.00 9.36 H new ATOM 0 HA3 GLY B 103 18.811 31.239 27.430 1.00 9.36 H new ATOM 2638 N TYR B 104 16.084 29.897 27.597 1.00 9.30 N ATOM 2639 CA TYR B 104 14.815 29.586 26.940 1.00 9.58 C ATOM 2640 C TYR B 104 13.870 29.125 28.039 1.00 9.16 C ATOM 2641 O TYR B 104 14.292 28.458 28.981 1.00 9.34 O ATOM 2642 CB TYR B 104 15.007 28.472 25.884 1.00 11.14 C ATOM 2643 CG TYR B 104 16.016 28.854 24.830 1.00 11.98 C ATOM 2644 CD1 TYR B 104 17.372 28.603 25.014 1.00 12.46 C ATOM 2645 CD2 TYR B 104 15.619 29.521 23.676 1.00 12.91 C ATOM 2646 CE1 TYR B 104 18.310 29.001 24.071 1.00 14.26 C ATOM 2647 CE2 TYR B 104 16.557 29.910 22.721 1.00 14.04 C ATOM 2648 CZ TYR B 104 17.892 29.643 22.941 1.00 14.75 C ATOM 2649 OH TYR B 104 18.846 30.036 22.015 1.00 16.80 O ATOM 0 H TYR B 104 16.335 29.303 28.166 1.00 9.30 H new ATOM 0 HA TYR B 104 14.461 30.359 26.473 1.00 9.58 H new ATOM 0 HB2 TYR B 104 15.295 27.657 26.325 1.00 11.14 H new ATOM 0 HB3 TYR B 104 14.156 28.280 25.460 1.00 11.14 H new ATOM 0 HD1 TYR B 104 17.655 28.161 25.782 1.00 12.46 H new ATOM 0 HD2 TYR B 104 14.718 29.709 23.540 1.00 12.91 H new ATOM 0 HE1 TYR B 104 19.214 28.832 24.208 1.00 14.26 H new ATOM 0 HE2 TYR B 104 16.286 30.344 21.945 1.00 14.04 H new ATOM 0 HH TYR B 104 18.469 30.417 21.368 1.00 16.80 H new ATOM 2650 N SER B 105 12.586 29.459 27.882 1.00 8.71 N ATOM 2651 CA SER B 105 11.570 29.013 28.816 1.00 9.24 C ATOM 2652 C SER B 105 11.250 27.536 28.597 1.00 9.13 C ATOM 2653 O SER B 105 11.730 26.926 27.648 1.00 8.83 O ATOM 2654 CB SER B 105 10.306 29.836 28.619 1.00 9.06 C ATOM 2655 OG SER B 105 9.658 29.441 27.420 1.00 9.44 O ATOM 0 H SER B 105 12.290 29.945 27.237 1.00 8.71 H new ATOM 0 HA SER B 105 11.905 29.130 29.719 1.00 9.24 H new ATOM 0 HB2 SER B 105 9.710 29.714 29.374 1.00 9.06 H new ATOM 0 HB3 SER B 105 10.527 30.780 28.581 1.00 9.06 H new ATOM 0 HG SER B 105 9.096 28.840 27.590 1.00 9.44 H new ATOM 2656 N PRO B 106 10.412 26.934 29.455 1.00 8.82 N ATOM 2657 CA PRO B 106 10.065 25.518 29.207 1.00 8.81 C ATOM 2658 C PRO B 106 9.426 25.267 27.842 1.00 8.75 C ATOM 2659 O PRO B 106 9.871 24.383 27.096 1.00 8.63 O ATOM 2660 CB PRO B 106 9.142 25.187 30.377 1.00 9.47 C ATOM 2661 CG PRO B 106 9.670 26.063 31.484 1.00 9.74 C ATOM 2662 CD PRO B 106 9.962 27.372 30.798 1.00 9.21 C ATOM 0 HA PRO B 106 10.847 24.946 29.167 1.00 8.81 H new ATOM 0 HB2 PRO B 106 8.215 25.387 30.171 1.00 9.47 H new ATOM 0 HB3 PRO B 106 9.183 24.247 30.612 1.00 9.47 H new ATOM 0 HG2 PRO B 106 9.018 26.171 32.194 1.00 9.74 H new ATOM 0 HG3 PRO B 106 10.468 25.686 31.886 1.00 9.74 H new ATOM 0 HD2 PRO B 106 9.176 27.938 30.749 1.00 9.21 H new ATOM 0 HD3 PRO B 106 10.647 27.878 31.262 1.00 9.21 H new ATOM 2663 N THR B 107 8.461 26.093 27.467 1.00 8.89 N ATOM 2664 CA THR B 107 7.836 25.883 26.166 1.00 9.76 C ATOM 2665 C THR B 107 8.794 26.235 25.023 1.00 9.84 C ATOM 2666 O THR B 107 8.805 25.562 23.993 1.00 9.51 O ATOM 2667 CB THR B 107 6.505 26.651 26.004 1.00 10.60 C ATOM 2668 OG1 THR B 107 6.760 28.053 26.017 1.00 11.60 O ATOM 2669 CG2 THR B 107 5.494 26.272 27.083 1.00 11.01 C ATOM 0 H THR B 107 8.161 26.755 27.927 1.00 8.89 H new ATOM 0 HA THR B 107 7.627 24.937 26.121 1.00 9.76 H new ATOM 0 HB THR B 107 6.113 26.403 25.152 1.00 10.60 H new ATOM 0 HG1 THR B 107 6.636 28.368 25.248 1.00 11.60 H new ATOM 0 HG21 THR B 107 4.674 26.773 26.949 1.00 11.01 H new ATOM 0 HG22 THR B 107 5.305 25.322 27.030 1.00 11.01 H new ATOM 0 HG23 THR B 107 5.860 26.480 27.957 1.00 11.01 H new ATOM 2670 N GLU B 108 9.599 27.279 25.180 1.00 9.68 N ATOM 2671 CA GLU B 108 10.544 27.643 24.127 1.00 9.87 C ATOM 2672 C GLU B 108 11.578 26.540 23.949 1.00 9.53 C ATOM 2673 O GLU B 108 12.023 26.248 22.835 1.00 9.51 O ATOM 2674 CB GLU B 108 11.236 28.957 24.452 1.00 11.47 C ATOM 2675 CG GLU B 108 10.320 30.160 24.365 1.00 12.95 C ATOM 2676 CD GLU B 108 10.938 31.395 24.996 1.00 14.28 C ATOM 2677 OE1 GLU B 108 11.954 31.310 25.729 1.00 15.62 O ATOM 2678 OE2 GLU B 108 10.362 32.489 24.767 1.00 18.60 O ATOM 0 H GLU B 108 9.616 27.784 25.876 1.00 9.68 H new ATOM 0 HA GLU B 108 10.050 27.754 23.299 1.00 9.87 H new ATOM 0 HB2 GLU B 108 11.607 28.906 25.347 1.00 11.47 H new ATOM 0 HB3 GLU B 108 11.980 29.082 23.843 1.00 11.47 H new ATOM 0 HG2 GLU B 108 10.115 30.342 23.435 1.00 12.95 H new ATOM 0 HG3 GLU B 108 9.480 29.958 24.807 1.00 12.95 H new ATOM 2679 N ASN B 109 11.950 25.889 25.039 1.00 8.97 N ATOM 2680 CA ASN B 109 12.883 24.763 24.972 1.00 8.81 C ATOM 2681 C ASN B 109 12.349 23.612 24.132 1.00 8.77 C ATOM 2682 O ASN B 109 13.070 23.104 23.256 1.00 9.11 O ATOM 2683 CB ASN B 109 13.291 24.279 26.353 1.00 8.90 C ATOM 2684 CG ASN B 109 14.597 24.878 26.802 1.00 9.28 C ATOM 2685 OD1 ASN B 109 15.606 24.737 26.118 1.00 9.43 O ATOM 2686 ND2 ASN B 109 14.601 25.529 27.956 1.00 8.98 N ATOM 0 H ASN B 109 11.676 26.080 25.832 1.00 8.97 H new ATOM 0 HA ASN B 109 13.677 25.100 24.528 1.00 8.81 H new ATOM 0 HB2 ASN B 109 12.597 24.505 26.992 1.00 8.90 H new ATOM 0 HB3 ASN B 109 13.366 23.312 26.346 1.00 8.90 H new ATOM 0 HD21 ASN B 109 15.331 25.873 28.253 1.00 8.98 H new ATOM 0 HD22 ASN B 109 13.874 25.607 28.408 1.00 8.98 H new ATOM 2687 N ILE B 110 11.097 23.207 24.350 1.00 8.54 N ATOM 2688 CA ILE B 110 10.614 22.099 23.552 1.00 8.77 C ATOM 2689 C ILE B 110 10.454 22.510 22.094 1.00 8.87 C ATOM 2690 O ILE B 110 10.702 21.701 21.193 1.00 9.27 O ATOM 2691 CB ILE B 110 9.377 21.380 24.162 1.00 8.43 C ATOM 2692 CG1 ILE B 110 9.105 20.059 23.422 1.00 8.75 C ATOM 2693 CG2 ILE B 110 8.128 22.248 24.107 1.00 8.78 C ATOM 2694 CD1 ILE B 110 10.261 19.086 23.433 1.00 8.65 C ATOM 0 H ILE B 110 10.546 23.540 24.920 1.00 8.54 H new ATOM 0 HA ILE B 110 11.296 21.410 23.569 1.00 8.77 H new ATOM 0 HB ILE B 110 9.584 21.202 25.093 1.00 8.43 H new ATOM 0 HG12 ILE B 110 8.332 19.630 23.822 1.00 8.75 H new ATOM 0 HG13 ILE B 110 8.874 20.259 22.501 1.00 8.75 H new ATOM 0 HG21 ILE B 110 7.381 21.766 24.495 1.00 8.78 H new ATOM 0 HG22 ILE B 110 8.280 23.066 24.607 1.00 8.78 H new ATOM 0 HG23 ILE B 110 7.926 22.467 23.184 1.00 8.78 H new ATOM 0 HD11 ILE B 110 10.013 18.283 22.949 1.00 8.65 H new ATOM 0 HD12 ILE B 110 11.032 19.494 23.008 1.00 8.65 H new ATOM 0 HD13 ILE B 110 10.482 18.856 24.349 1.00 8.65 H new ATOM 2695 N LEU B 111 10.058 23.749 21.843 1.00 9.33 N ATOM 2696 CA LEU B 111 9.907 24.169 20.449 1.00 10.16 C ATOM 2697 C LEU B 111 11.270 24.207 19.745 1.00 10.42 C ATOM 2698 O LEU B 111 11.385 23.790 18.584 1.00 10.55 O ATOM 2699 CB LEU B 111 9.219 25.532 20.385 1.00 10.95 C ATOM 2700 CG LEU B 111 7.760 25.536 20.849 1.00 11.73 C ATOM 2701 CD1 LEU B 111 7.211 26.955 20.860 1.00 12.89 C ATOM 2702 CD2 LEU B 111 6.919 24.622 19.966 1.00 12.44 C ATOM 0 H LEU B 111 9.877 24.345 22.436 1.00 9.33 H new ATOM 0 HA LEU B 111 9.352 23.523 19.985 1.00 10.16 H new ATOM 0 HB2 LEU B 111 9.720 26.159 20.929 1.00 10.95 H new ATOM 0 HB3 LEU B 111 9.256 25.856 19.472 1.00 10.95 H new ATOM 0 HG LEU B 111 7.718 25.194 21.756 1.00 11.73 H new ATOM 0 HD11 LEU B 111 6.287 26.942 21.156 1.00 12.89 H new ATOM 0 HD12 LEU B 111 7.736 27.501 21.466 1.00 12.89 H new ATOM 0 HD13 LEU B 111 7.259 27.328 19.966 1.00 12.89 H new ATOM 0 HD21 LEU B 111 5.998 24.634 20.271 1.00 12.44 H new ATOM 0 HD22 LEU B 111 6.959 24.932 19.048 1.00 12.44 H new ATOM 0 HD23 LEU B 111 7.264 23.717 20.016 1.00 12.44 H new ATOM 2703 N LYS B 112 12.303 24.667 20.451 1.00 10.19 N ATOM 2704 CA LYS B 112 13.669 24.694 19.909 1.00 10.79 C ATOM 2705 C LYS B 112 14.116 23.268 19.576 1.00 11.48 C ATOM 2706 O LYS B 112 14.638 23.005 18.484 1.00 11.46 O ATOM 2707 CB LYS B 112 14.624 25.347 20.910 1.00 11.52 C ATOM 2708 CG LYS B 112 16.041 25.519 20.389 1.00 12.69 C ATOM 2709 CD LYS B 112 16.896 26.286 21.378 1.00 13.65 C ATOM 2710 CE LYS B 112 18.223 26.692 20.746 1.00 15.47 C ATOM 2711 NZ LYS B 112 19.150 25.532 20.667 1.00 16.93 N ATOM 0 H LYS B 112 12.236 24.971 21.253 1.00 10.19 H new ATOM 0 HA LYS B 112 13.682 25.222 19.095 1.00 10.79 H new ATOM 0 HB2 LYS B 112 14.273 26.216 21.159 1.00 11.52 H new ATOM 0 HB3 LYS B 112 14.649 24.810 21.717 1.00 11.52 H new ATOM 0 HG2 LYS B 112 16.436 24.649 20.223 1.00 12.69 H new ATOM 0 HG3 LYS B 112 16.022 25.989 19.541 1.00 12.69 H new ATOM 0 HD2 LYS B 112 16.421 27.077 21.678 1.00 13.65 H new ATOM 0 HD3 LYS B 112 17.060 25.739 22.162 1.00 13.65 H new ATOM 0 HE2 LYS B 112 18.067 27.047 19.857 1.00 15.47 H new ATOM 0 HE3 LYS B 112 18.630 27.401 21.267 1.00 15.47 H new ATOM 0 HZ1 LYS B 112 19.986 25.825 20.577 1.00 16.93 H new ATOM 0 HZ2 LYS B 112 19.084 25.048 21.411 1.00 16.93 H new ATOM 0 HZ3 LYS B 112 18.936 25.028 19.966 1.00 16.93 H new ATOM 2712 N GLU B 113 13.913 22.342 20.508 1.00 10.85 N ATOM 2713 CA GLU B 113 14.268 20.935 20.279 1.00 11.93 C ATOM 2714 C GLU B 113 13.491 20.327 19.103 1.00 11.20 C ATOM 2715 O GLU B 113 14.089 19.635 18.254 1.00 10.90 O ATOM 2716 CB GLU B 113 14.050 20.108 21.556 1.00 13.50 C ATOM 2717 CG GLU B 113 15.024 20.396 22.707 1.00 16.13 C ATOM 2718 CD GLU B 113 16.363 19.705 22.549 1.00 18.76 C ATOM 2719 OE1 GLU B 113 16.512 18.869 21.643 1.00 22.56 O ATOM 2720 OE2 GLU B 113 17.277 20.002 23.337 1.00 22.98 O ATOM 0 H GLU B 113 13.571 22.503 21.281 1.00 10.85 H new ATOM 0 HA GLU B 113 15.209 20.910 20.046 1.00 11.93 H new ATOM 0 HB2 GLU B 113 13.146 20.263 21.872 1.00 13.50 H new ATOM 0 HB3 GLU B 113 14.113 19.167 21.328 1.00 13.50 H new ATOM 0 HG2 GLU B 113 15.167 21.353 22.769 1.00 16.13 H new ATOM 0 HG3 GLU B 113 14.619 20.115 23.542 1.00 16.13 H new ATOM 2721 N ILE B 114 12.187 20.589 19.025 1.00 10.82 N ATOM 2722 CA ILE B 114 11.391 20.078 17.917 1.00 11.34 C ATOM 2723 C ILE B 114 11.948 20.592 16.592 1.00 11.77 C ATOM 2724 O ILE B 114 12.129 19.807 15.656 1.00 12.11 O ATOM 2725 CB ILE B 114 9.893 20.418 18.046 1.00 10.41 C ATOM 2726 CG1 ILE B 114 9.246 19.620 19.201 1.00 10.10 C ATOM 2727 CG2 ILE B 114 9.137 20.102 16.758 1.00 10.81 C ATOM 2728 CD1 ILE B 114 7.901 20.178 19.614 1.00 10.26 C ATOM 0 H ILE B 114 11.750 21.057 19.599 1.00 10.82 H new ATOM 0 HA ILE B 114 11.455 19.110 17.942 1.00 11.34 H new ATOM 0 HB ILE B 114 9.835 21.369 18.228 1.00 10.41 H new ATOM 0 HG12 ILE B 114 9.139 18.695 18.930 1.00 10.10 H new ATOM 0 HG13 ILE B 114 9.842 19.624 19.966 1.00 10.10 H new ATOM 0 HG21 ILE B 114 8.200 20.326 16.869 1.00 10.81 H new ATOM 0 HG22 ILE B 114 9.509 20.622 16.028 1.00 10.81 H new ATOM 0 HG23 ILE B 114 9.222 19.157 16.556 1.00 10.81 H new ATOM 0 HD11 ILE B 114 7.538 19.645 20.339 1.00 10.26 H new ATOM 0 HD12 ILE B 114 8.008 21.095 19.910 1.00 10.26 H new ATOM 0 HD13 ILE B 114 7.294 20.152 18.858 1.00 10.26 H new ATOM 2729 N GLU B 115 12.226 21.893 16.506 1.00 12.61 N ATOM 2730 CA GLU B 115 12.677 22.444 15.222 1.00 14.17 C ATOM 2731 C GLU B 115 14.027 21.860 14.835 1.00 14.35 C ATOM 2732 O GLU B 115 14.215 21.441 13.686 1.00 14.72 O ATOM 2733 CB GLU B 115 12.730 23.970 15.247 1.00 15.76 C ATOM 2734 CG GLU B 115 12.995 24.537 13.853 1.00 18.71 C ATOM 2735 CD GLU B 115 12.727 26.024 13.726 1.00 21.90 C ATOM 2736 OE1 GLU B 115 12.240 26.655 14.682 1.00 24.00 O ATOM 2737 OE2 GLU B 115 13.002 26.567 12.635 1.00 25.36 O ATOM 0 H GLU B 115 12.164 22.458 17.152 1.00 12.61 H new ATOM 0 HA GLU B 115 12.026 22.190 14.549 1.00 14.17 H new ATOM 0 HB2 GLU B 115 11.892 24.320 15.587 1.00 15.76 H new ATOM 0 HB3 GLU B 115 13.427 24.262 15.855 1.00 15.76 H new ATOM 0 HG2 GLU B 115 13.919 24.364 13.615 1.00 18.71 H new ATOM 0 HG3 GLU B 115 12.443 24.063 13.212 1.00 18.71 H new ATOM 2738 N GLU B 116 14.961 21.801 15.777 1.00 14.19 N ATOM 2739 CA GLU B 116 16.311 21.327 15.477 1.00 15.13 C ATOM 2740 C GLU B 116 16.334 19.855 15.116 1.00 14.75 C ATOM 2741 O GLU B 116 17.071 19.453 14.223 1.00 15.42 O ATOM 2742 CB GLU B 116 17.261 21.597 16.638 1.00 16.75 C ATOM 2743 CG GLU B 116 17.558 23.075 16.823 1.00 18.47 C ATOM 2744 CD GLU B 116 18.272 23.387 18.117 1.00 20.62 C ATOM 2745 OE1 GLU B 116 18.428 22.488 18.966 1.00 23.35 O ATOM 2746 OE2 GLU B 116 18.670 24.557 18.288 1.00 22.06 O ATOM 0 H GLU B 116 14.836 22.030 16.596 1.00 14.19 H new ATOM 0 HA GLU B 116 16.614 21.826 14.702 1.00 15.13 H new ATOM 0 HB2 GLU B 116 16.875 21.244 17.455 1.00 16.75 H new ATOM 0 HB3 GLU B 116 18.092 21.120 16.488 1.00 16.75 H new ATOM 0 HG2 GLU B 116 18.099 23.385 16.080 1.00 18.47 H new ATOM 0 HG3 GLU B 116 16.725 23.571 16.793 1.00 18.47 H new ATOM 2747 N GLU B 117 15.515 19.052 15.785 1.00 13.75 N ATOM 2748 CA GLU B 117 15.500 17.609 15.560 1.00 13.55 C ATOM 2749 C GLU B 117 14.615 17.176 14.404 1.00 13.49 C ATOM 2750 O GLU B 117 15.032 16.325 13.601 1.00 14.29 O ATOM 2751 CB GLU B 117 15.065 16.882 16.832 1.00 12.91 C ATOM 2752 CG GLU B 117 16.104 17.030 17.923 1.00 12.93 C ATOM 2753 CD GLU B 117 15.709 16.421 19.244 1.00 14.40 C ATOM 2754 OE1 GLU B 117 14.698 15.704 19.342 1.00 12.91 O ATOM 2755 OE2 GLU B 117 16.453 16.669 20.212 1.00 16.17 O ATOM 0 H GLU B 117 14.955 19.324 16.379 1.00 13.75 H new ATOM 0 HA GLU B 117 16.409 17.368 15.321 1.00 13.55 H new ATOM 0 HB2 GLU B 117 14.216 17.238 17.138 1.00 12.91 H new ATOM 0 HB3 GLU B 117 14.925 15.942 16.639 1.00 12.91 H new ATOM 0 HG2 GLU B 117 16.931 16.621 17.625 1.00 12.93 H new ATOM 0 HG3 GLU B 117 16.286 17.973 18.056 1.00 12.93 H new ATOM 2756 N THR B 118 13.407 17.727 14.311 1.00 13.65 N ATOM 2757 CA THR B 118 12.403 17.261 13.346 1.00 13.91 C ATOM 2758 C THR B 118 12.313 18.079 12.074 1.00 14.48 C ATOM 2759 O THR B 118 11.764 17.580 11.082 1.00 14.73 O ATOM 2760 CB THR B 118 10.987 17.190 13.937 1.00 13.83 C ATOM 2761 OG1 THR B 118 10.402 18.495 13.998 1.00 13.02 O ATOM 2762 CG2 THR B 118 10.981 16.523 15.317 1.00 13.79 C ATOM 0 H THR B 118 13.143 18.381 14.803 1.00 13.65 H new ATOM 0 HA THR B 118 12.728 16.374 13.125 1.00 13.91 H new ATOM 0 HB THR B 118 10.449 16.638 13.348 1.00 13.83 H new ATOM 0 HG1 THR B 118 10.874 18.991 14.484 1.00 13.02 H new ATOM 0 HG21 THR B 118 10.074 16.495 15.659 1.00 13.79 H new ATOM 0 HG22 THR B 118 11.325 15.619 15.241 1.00 13.79 H new ATOM 0 HG23 THR B 118 11.540 17.032 15.925 1.00 13.79 H new ATOM 2763 N GLY B 119 12.787 19.327 12.106 1.00 14.42 N ATOM 2764 CA GLY B 119 12.698 20.234 10.952 1.00 15.63 C ATOM 2765 C GLY B 119 11.343 20.909 10.838 1.00 16.24 C ATOM 2766 O GLY B 119 11.003 21.514 9.808 1.00 17.30 O ATOM 0 H GLY B 119 13.169 19.673 12.795 1.00 14.42 H new ATOM 0 HA2 GLY B 119 13.388 20.912 11.025 1.00 15.63 H new ATOM 0 HA3 GLY B 119 12.876 19.735 10.139 1.00 15.63 H new ATOM 2767 N PHE B 120 10.549 20.813 11.902 1.00 15.78 N ATOM 2768 CA PHE B 120 9.220 21.397 11.922 1.00 16.23 C ATOM 2769 C PHE B 120 9.065 22.496 12.949 1.00 16.25 C ATOM 2770 O PHE B 120 9.602 22.399 14.048 1.00 15.60 O ATOM 2771 CB PHE B 120 8.174 20.320 12.213 1.00 17.14 C ATOM 2772 CG PHE B 120 7.882 19.434 11.039 1.00 17.52 C ATOM 2773 CD1 PHE B 120 6.889 19.779 10.109 1.00 17.71 C ATOM 2774 CD2 PHE B 120 8.609 18.260 10.849 1.00 17.94 C ATOM 2775 CE1 PHE B 120 6.636 18.961 9.017 1.00 18.66 C ATOM 2776 CE2 PHE B 120 8.350 17.436 9.764 1.00 19.10 C ATOM 2777 CZ PHE B 120 7.372 17.789 8.845 1.00 18.40 C ATOM 0 H PHE B 120 10.769 20.408 12.628 1.00 15.78 H new ATOM 0 HA PHE B 120 9.088 21.787 11.044 1.00 16.23 H new ATOM 0 HB2 PHE B 120 8.481 19.773 12.953 1.00 17.14 H new ATOM 0 HB3 PHE B 120 7.351 20.747 12.499 1.00 17.14 H new ATOM 0 HD1 PHE B 120 6.398 20.560 10.225 1.00 17.71 H new ATOM 0 HD2 PHE B 120 9.274 18.027 11.456 1.00 17.94 H new ATOM 0 HE1 PHE B 120 5.978 19.193 8.402 1.00 18.66 H new ATOM 0 HE2 PHE B 120 8.831 16.648 9.652 1.00 19.10 H new ATOM 0 HZ PHE B 120 7.207 17.242 8.111 1.00 18.40 H new ATOM 2778 N LYS B 121 8.353 23.550 12.559 1.00 16.28 N ATOM 2779 CA LYS B 121 7.767 24.485 13.521 1.00 16.14 C ATOM 2780 C LYS B 121 6.639 23.746 14.260 1.00 14.98 C ATOM 2781 O LYS B 121 6.145 22.730 13.793 1.00 14.48 O ATOM 2782 CB LYS B 121 7.228 25.749 12.819 1.00 18.03 C ATOM 2783 CG LYS B 121 8.268 26.569 12.065 1.00 21.80 C ATOM 2784 CD LYS B 121 9.173 27.347 13.006 1.00 24.47 C ATOM 2785 CE LYS B 121 10.122 28.292 12.271 1.00 26.62 C ATOM 2786 NZ LYS B 121 9.385 29.195 11.344 1.00 29.50 N ATOM 0 H LYS B 121 8.196 23.744 11.736 1.00 16.28 H new ATOM 0 HA LYS B 121 8.445 24.783 14.148 1.00 16.14 H new ATOM 0 HB2 LYS B 121 6.533 25.484 12.196 1.00 18.03 H new ATOM 0 HB3 LYS B 121 6.810 26.317 13.485 1.00 18.03 H new ATOM 0 HG2 LYS B 121 8.806 25.979 11.514 1.00 21.80 H new ATOM 0 HG3 LYS B 121 7.820 27.186 11.466 1.00 21.80 H new ATOM 0 HD2 LYS B 121 8.627 27.859 13.623 1.00 24.47 H new ATOM 0 HD3 LYS B 121 9.692 26.723 13.538 1.00 24.47 H new ATOM 0 HE2 LYS B 121 10.616 28.822 12.916 1.00 26.62 H new ATOM 0 HE3 LYS B 121 10.773 27.775 11.771 1.00 26.62 H new ATOM 0 HZ1 LYS B 121 9.911 29.874 11.110 1.00 29.50 H new ATOM 0 HZ2 LYS B 121 9.144 28.742 10.617 1.00 29.50 H new ATOM 0 HZ3 LYS B 121 8.659 29.510 11.751 1.00 29.50 H new ATOM 2787 N ALA B 122 6.254 24.232 15.433 1.00 13.74 N ATOM 2788 CA ALA B 122 5.266 23.520 16.235 1.00 13.29 C ATOM 2789 C ALA B 122 4.535 24.444 17.168 1.00 13.39 C ATOM 2790 O ALA B 122 4.946 25.580 17.366 1.00 13.59 O ATOM 2791 CB ALA B 122 5.931 22.382 17.026 1.00 13.28 C ATOM 0 H ALA B 122 6.547 24.962 15.780 1.00 13.74 H new ATOM 0 HA ALA B 122 4.615 23.141 15.624 1.00 13.29 H new ATOM 0 HB1 ALA B 122 5.261 21.919 17.553 1.00 13.28 H new ATOM 0 HB2 ALA B 122 6.344 21.758 16.409 1.00 13.28 H new ATOM 0 HB3 ALA B 122 6.608 22.750 17.615 1.00 13.28 H new ATOM 2792 N LYS B 123 3.468 23.932 17.763 1.00 13.86 N ATOM 2793 CA LYS B 123 2.825 24.644 18.855 1.00 14.70 C ATOM 2794 C LYS B 123 2.652 23.730 20.055 1.00 13.79 C ATOM 2795 O LYS B 123 2.399 22.528 19.908 1.00 13.15 O ATOM 2796 CB LYS B 123 1.502 25.291 18.443 1.00 18.20 C ATOM 2797 CG LYS B 123 0.440 24.347 17.958 1.00 20.51 C ATOM 2798 CD LYS B 123 -0.926 25.009 18.115 1.00 24.03 C ATOM 2799 CE LYS B 123 -1.842 24.686 16.950 1.00 26.93 C ATOM 2800 NZ LYS B 123 -3.153 25.362 17.152 1.00 28.33 N ATOM 0 H LYS B 123 3.104 23.182 17.553 1.00 13.86 H new ATOM 0 HA LYS B 123 3.411 25.375 19.107 1.00 14.70 H new ATOM 0 HB2 LYS B 123 1.152 25.784 19.201 1.00 18.20 H new ATOM 0 HB3 LYS B 123 1.681 25.938 17.743 1.00 18.20 H new ATOM 0 HG2 LYS B 123 0.596 24.117 17.029 1.00 20.51 H new ATOM 0 HG3 LYS B 123 0.471 23.520 18.464 1.00 20.51 H new ATOM 0 HD2 LYS B 123 -1.337 24.712 18.942 1.00 24.03 H new ATOM 0 HD3 LYS B 123 -0.814 25.970 18.183 1.00 24.03 H new ATOM 0 HE2 LYS B 123 -1.440 24.980 16.118 1.00 26.93 H new ATOM 0 HE3 LYS B 123 -1.968 23.727 16.881 1.00 26.93 H new ATOM 0 HZ1 LYS B 123 -3.479 25.619 16.365 1.00 28.33 H new ATOM 0 HZ2 LYS B 123 -3.722 24.797 17.538 1.00 28.33 H new ATOM 0 HZ3 LYS B 123 -3.043 26.074 17.674 1.00 28.33 H new ATOM 2801 N VAL B 124 2.812 24.315 21.235 1.00 13.11 N ATOM 2802 CA VAL B 124 2.625 23.591 22.481 1.00 12.99 C ATOM 2803 C VAL B 124 1.149 23.680 22.860 1.00 13.18 C ATOM 2804 O VAL B 124 0.579 24.786 22.968 1.00 14.24 O ATOM 2805 CB VAL B 124 3.515 24.150 23.612 1.00 12.57 C ATOM 2806 CG1 VAL B 124 3.201 23.464 24.936 1.00 13.24 C ATOM 2807 CG2 VAL B 124 4.986 23.987 23.260 1.00 13.23 C ATOM 0 H VAL B 124 3.031 25.141 21.335 1.00 13.11 H new ATOM 0 HA VAL B 124 2.889 22.666 22.357 1.00 12.99 H new ATOM 0 HB VAL B 124 3.325 25.096 23.710 1.00 12.57 H new ATOM 0 HG11 VAL B 124 3.770 23.828 25.632 1.00 13.24 H new ATOM 0 HG12 VAL B 124 2.271 23.615 25.166 1.00 13.24 H new ATOM 0 HG13 VAL B 124 3.362 22.511 24.853 1.00 13.24 H new ATOM 0 HG21 VAL B 124 5.532 24.342 23.979 1.00 13.23 H new ATOM 0 HG22 VAL B 124 5.187 23.046 23.136 1.00 13.23 H new ATOM 0 HG23 VAL B 124 5.178 24.469 22.440 1.00 13.23 H new ATOM 2808 N AGLU B 125 0.524 22.522 23.025 0.50 13.41 N ATOM 2809 N BGLU B 125 0.541 22.521 23.077 0.50 13.40 N ATOM 2810 CA AGLU B 125 -0.876 22.450 23.440 0.50 13.96 C ATOM 2811 CA BGLU B 125 -0.881 22.429 23.420 0.50 13.88 C ATOM 2812 C AGLU B 125 -0.998 22.506 24.964 0.50 13.76 C ATOM 2813 C BGLU B 125 -1.165 22.308 24.917 0.50 13.63 C ATOM 2814 O AGLU B 125 -1.715 23.351 25.517 0.50 13.82 O ATOM 2815 O BGLU B 125 -2.168 22.838 25.401 0.50 12.99 O ATOM 2816 CB AGLU B 125 -1.524 21.169 22.904 0.50 14.89 C ATOM 2817 CB BGLU B 125 -1.521 21.268 22.668 0.50 14.97 C ATOM 2818 CG AGLU B 125 -1.416 20.976 21.397 0.50 16.54 C ATOM 2819 CG BGLU B 125 -1.594 21.505 21.168 0.50 16.62 C ATOM 2820 CD AGLU B 125 -2.254 21.965 20.614 0.50 17.90 C ATOM 2821 CD BGLU B 125 -2.097 20.302 20.404 0.50 17.97 C ATOM 2822 OE1AGLU B 125 -2.760 22.938 21.209 0.50 18.69 O ATOM 2823 OE1BGLU B 125 -1.873 19.167 20.861 0.50 19.38 O ATOM 2824 OE2AGLU B 125 -2.404 21.767 19.389 0.50 18.66 O ATOM 2825 OE2BGLU B 125 -2.707 20.494 19.330 0.50 18.72 O ATOM 0 H AGLU B 125 0.895 21.756 22.901 0.50 13.40 H new ATOM 0 H BGLU B 125 0.939 21.760 23.030 0.50 13.40 H new ATOM 0 HA AGLU B 125 -1.341 23.217 23.070 0.50 13.88 H new ATOM 0 HA BGLU B 125 -1.276 23.272 23.147 0.50 13.88 H new ATOM 0 HB2AGLU B 125 -1.116 20.407 23.344 0.50 14.97 H new ATOM 0 HB2BGLU B 125 -1.014 20.459 22.839 0.50 14.97 H new ATOM 0 HB3AGLU B 125 -2.462 21.170 23.150 0.50 14.97 H new ATOM 0 HB3BGLU B 125 -2.416 21.120 23.012 0.50 14.97 H new ATOM 0 HG2AGLU B 125 -0.488 21.063 21.130 0.50 16.62 H new ATOM 0 HG2BGLU B 125 -2.177 22.260 20.993 0.50 16.62 H new ATOM 0 HG3AGLU B 125 -1.693 20.074 21.170 0.50 16.62 H new ATOM 0 HG3BGLU B 125 -0.713 21.745 20.840 0.50 16.62 H new ATOM 2826 N ARG B 126 -0.301 21.597 25.642 1.00 13.21 N ATOM 2827 CA ARG B 126 -0.427 21.450 27.111 1.00 12.41 C ATOM 2828 C ARG B 126 0.783 20.713 27.626 1.00 11.32 C ATOM 2829 O ARG B 126 1.529 20.111 26.853 1.00 10.96 O ATOM 2830 CB ARG B 126 -1.717 20.692 27.499 1.00 14.06 C ATOM 2831 CG ARG B 126 -1.767 19.288 26.925 1.00 15.28 C ATOM 2832 CD ARG B 126 -3.080 18.544 27.225 1.00 17.40 C ATOM 2833 NE ARG B 126 -3.295 18.250 28.648 1.00 19.86 N ATOM 2834 CZ ARG B 126 -3.950 17.184 29.127 1.00 19.82 C ATOM 2835 NH1 ARG B 126 -4.444 16.253 28.305 1.00 19.92 N ATOM 2836 NH2 ARG B 126 -4.092 17.044 30.439 1.00 21.06 N ATOM 0 H AARG B 126 0.254 21.050 25.278 0.50 13.21 H new ATOM 0 H BARG B 126 0.375 21.185 25.306 0.50 13.21 H new ATOM 0 HA ARG B 126 -0.480 22.332 27.511 1.00 12.41 H new ATOM 0 HB2 ARG B 126 -1.781 20.645 28.466 1.00 14.06 H new ATOM 0 HB3 ARG B 126 -2.488 21.192 27.188 1.00 14.06 H new ATOM 0 HG2 ARG B 126 -1.644 19.335 25.964 1.00 15.28 H new ATOM 0 HG3 ARG B 126 -1.025 18.775 27.281 1.00 15.28 H new ATOM 0 HD2 ARG B 126 -3.823 19.076 26.899 1.00 17.40 H new ATOM 0 HD3 ARG B 126 -3.088 17.711 26.728 1.00 17.40 H new ATOM 0 HE ARG B 126 -2.975 18.807 29.220 1.00 19.86 H new ATOM 0 HH11 ARG B 126 -4.343 16.333 27.455 1.00 19.92 H new ATOM 0 HH12 ARG B 126 -4.862 15.574 28.626 1.00 19.92 H new ATOM 0 HH21 ARG B 126 -3.765 17.634 30.972 1.00 21.06 H new ATOM 0 HH22 ARG B 126 -4.511 16.363 30.756 1.00 21.06 H new ATOM 2837 N LEU B 127 1.002 20.780 28.929 1.00 10.16 N ATOM 2838 CA LEU B 127 1.945 19.902 29.601 1.00 9.39 C ATOM 2839 C LEU B 127 1.201 18.629 30.022 1.00 9.06 C ATOM 2840 O LEU B 127 0.200 18.690 30.760 1.00 10.50 O ATOM 2841 CB LEU B 127 2.523 20.635 30.815 1.00 9.03 C ATOM 2842 CG LEU B 127 3.539 19.899 31.703 1.00 8.96 C ATOM 2843 CD1 LEU B 127 4.784 19.516 30.930 1.00 9.25 C ATOM 2844 CD2 LEU B 127 3.894 20.823 32.867 1.00 9.71 C ATOM 0 H LEU B 127 0.607 21.338 29.451 1.00 10.16 H new ATOM 0 HA LEU B 127 2.678 19.657 29.015 1.00 9.39 H new ATOM 0 HB2 LEU B 127 2.945 21.447 30.495 1.00 9.03 H new ATOM 0 HB3 LEU B 127 1.780 20.904 31.378 1.00 9.03 H new ATOM 0 HG LEU B 127 3.148 19.073 32.028 1.00 8.96 H new ATOM 0 HD11 LEU B 127 5.402 19.055 31.519 1.00 9.25 H new ATOM 0 HD12 LEU B 127 4.542 18.932 30.195 1.00 9.25 H new ATOM 0 HD13 LEU B 127 5.207 20.316 30.581 1.00 9.25 H new ATOM 0 HD21 LEU B 127 4.536 20.383 33.446 1.00 9.71 H new ATOM 0 HD22 LEU B 127 4.279 21.644 32.523 1.00 9.71 H new ATOM 0 HD23 LEU B 127 3.092 21.030 33.372 1.00 9.71 H new ATOM 2845 N LEU B 128 1.660 17.474 29.554 1.00 8.19 N ATOM 2846 CA LEU B 128 0.999 16.210 29.880 1.00 8.07 C ATOM 2847 C LEU B 128 1.540 15.547 31.144 1.00 7.78 C ATOM 2848 O LEU B 128 0.785 14.909 31.872 1.00 7.74 O ATOM 2849 CB LEU B 128 1.146 15.220 28.723 1.00 8.42 C ATOM 2850 CG LEU B 128 0.447 15.623 27.415 1.00 8.91 C ATOM 2851 CD1 LEU B 128 0.890 14.711 26.283 1.00 9.72 C ATOM 2852 CD2 LEU B 128 -1.077 15.571 27.551 1.00 10.13 C ATOM 0 H LEU B 128 2.351 17.398 29.047 1.00 8.19 H new ATOM 0 HA LEU B 128 0.068 16.434 30.036 1.00 8.07 H new ATOM 0 HB2 LEU B 128 2.091 15.096 28.542 1.00 8.42 H new ATOM 0 HB3 LEU B 128 0.797 14.361 29.007 1.00 8.42 H new ATOM 0 HG LEU B 128 0.701 16.538 27.216 1.00 8.91 H new ATOM 0 HD11 LEU B 128 0.444 14.973 25.463 1.00 9.72 H new ATOM 0 HD12 LEU B 128 1.850 14.783 26.166 1.00 9.72 H new ATOM 0 HD13 LEU B 128 0.659 13.794 26.497 1.00 9.72 H new ATOM 0 HD21 LEU B 128 -1.486 15.830 26.711 1.00 10.13 H new ATOM 0 HD22 LEU B 128 -1.351 14.669 27.779 1.00 10.13 H new ATOM 0 HD23 LEU B 128 -1.361 16.181 28.250 1.00 10.13 H new ATOM 2853 N ALA B 129 2.833 15.700 31.416 1.00 7.46 N ATOM 2854 CA ALA B 129 3.461 14.986 32.523 1.00 7.35 C ATOM 2855 C ALA B 129 4.726 15.697 32.927 1.00 7.36 C ATOM 2856 O ALA B 129 5.416 16.296 32.094 1.00 7.77 O ATOM 2857 CB ALA B 129 3.797 13.544 32.137 1.00 7.66 C ATOM 0 H ALA B 129 3.363 16.212 30.972 1.00 7.46 H new ATOM 0 HA ALA B 129 2.834 14.967 33.263 1.00 7.35 H new ATOM 0 HB1 ALA B 129 4.212 13.096 32.890 1.00 7.66 H new ATOM 0 HB2 ALA B 129 2.983 13.077 31.891 1.00 7.66 H new ATOM 0 HB3 ALA B 129 4.409 13.544 31.384 1.00 7.66 H new ATOM 2858 N VAL B 130 5.049 15.572 34.208 1.00 6.99 N ATOM 2859 CA VAL B 130 6.389 15.880 34.725 1.00 7.66 C ATOM 2860 C VAL B 130 6.875 14.603 35.399 1.00 7.53 C ATOM 2861 O VAL B 130 6.420 14.254 36.498 1.00 8.46 O ATOM 2862 CB VAL B 130 6.405 17.080 35.699 1.00 8.22 C ATOM 2863 CG1 VAL B 130 7.840 17.393 36.118 1.00 9.16 C ATOM 2864 CG2 VAL B 130 5.775 18.309 35.061 1.00 8.77 C ATOM 0 H VAL B 130 4.497 15.305 34.811 1.00 6.99 H new ATOM 0 HA VAL B 130 6.974 16.153 34.001 1.00 7.66 H new ATOM 0 HB VAL B 130 5.885 16.841 36.482 1.00 8.22 H new ATOM 0 HG11 VAL B 130 7.842 18.147 36.729 1.00 9.16 H new ATOM 0 HG12 VAL B 130 8.225 16.619 36.559 1.00 9.16 H new ATOM 0 HG13 VAL B 130 8.366 17.612 35.333 1.00 9.16 H new ATOM 0 HG21 VAL B 130 5.797 19.047 35.690 1.00 8.77 H new ATOM 0 HG22 VAL B 130 6.271 18.550 34.263 1.00 8.77 H new ATOM 0 HG23 VAL B 130 4.855 18.115 34.823 1.00 8.77 H new ATOM 2865 N PHE B 131 7.760 13.883 34.714 1.00 7.45 N ATOM 2866 CA PHE B 131 8.286 12.628 35.226 1.00 7.55 C ATOM 2867 C PHE B 131 9.603 12.807 35.986 1.00 7.63 C ATOM 2868 O PHE B 131 10.413 13.691 35.671 1.00 8.36 O ATOM 2869 CB PHE B 131 8.559 11.653 34.070 1.00 7.67 C ATOM 2870 CG PHE B 131 7.331 11.087 33.391 1.00 7.64 C ATOM 2871 CD1 PHE B 131 6.433 10.280 34.082 1.00 7.75 C ATOM 2872 CD2 PHE B 131 7.117 11.323 32.051 1.00 7.58 C ATOM 2873 CE1 PHE B 131 5.326 9.734 33.427 1.00 7.97 C ATOM 2874 CE2 PHE B 131 6.016 10.784 31.390 1.00 7.80 C ATOM 2875 CZ PHE B 131 5.117 9.986 32.088 1.00 7.76 C ATOM 0 H PHE B 131 8.069 14.109 33.944 1.00 7.45 H new ATOM 0 HA PHE B 131 7.612 12.283 35.832 1.00 7.55 H new ATOM 0 HB2 PHE B 131 9.097 12.109 33.404 1.00 7.67 H new ATOM 0 HB3 PHE B 131 9.091 10.916 34.408 1.00 7.67 H new ATOM 0 HD1 PHE B 131 6.570 10.103 34.985 1.00 7.75 H new ATOM 0 HD2 PHE B 131 7.719 11.852 31.579 1.00 7.58 H new ATOM 0 HE1 PHE B 131 4.728 9.198 33.896 1.00 7.97 H new ATOM 0 HE2 PHE B 131 5.883 10.957 30.486 1.00 7.80 H new ATOM 0 HZ PHE B 131 4.378 9.624 31.654 1.00 7.76 H new ATOM 2876 N ASP B 132 9.792 11.968 36.991 1.00 7.57 N ATOM 2877 CA ASP B 132 11.091 11.840 37.649 1.00 7.82 C ATOM 2878 C ASP B 132 11.801 10.633 37.056 1.00 7.40 C ATOM 2879 O ASP B 132 11.298 9.505 37.127 1.00 7.54 O ATOM 2880 CB ASP B 132 10.879 11.671 39.154 1.00 8.24 C ATOM 2881 CG ASP B 132 12.186 11.568 39.946 1.00 8.52 C ATOM 2882 OD1 ASP B 132 13.286 11.697 39.361 1.00 8.73 O ATOM 2883 OD2 ASP B 132 12.065 11.344 41.173 1.00 9.82 O ATOM 0 H ASP B 132 9.179 11.458 37.313 1.00 7.57 H new ATOM 0 HA ASP B 132 11.634 12.631 37.509 1.00 7.82 H new ATOM 0 HB2 ASP B 132 10.365 12.423 39.488 1.00 8.24 H new ATOM 0 HB3 ASP B 132 10.350 10.874 39.312 1.00 8.24 H new ATOM 2884 N THR B 133 12.964 10.831 36.440 1.00 7.07 N ATOM 2885 CA THR B 133 13.693 9.679 35.905 1.00 7.24 C ATOM 2886 C THR B 133 14.089 8.683 36.988 1.00 7.28 C ATOM 2887 O THR B 133 14.235 7.498 36.685 1.00 7.30 O ATOM 2888 CB THR B 133 14.942 10.069 35.096 1.00 7.50 C ATOM 2889 OG1 THR B 133 15.833 10.827 35.930 1.00 7.13 O ATOM 2890 CG2 THR B 133 14.584 10.870 33.881 1.00 7.67 C ATOM 0 H THR B 133 13.340 11.596 36.323 1.00 7.07 H new ATOM 0 HA THR B 133 13.063 9.255 35.301 1.00 7.24 H new ATOM 0 HB THR B 133 15.376 9.254 34.798 1.00 7.50 H new ATOM 0 HG1 THR B 133 16.375 10.307 36.307 1.00 7.13 H new ATOM 0 HG21 THR B 133 15.391 11.099 33.395 1.00 7.67 H new ATOM 0 HG22 THR B 133 14.000 10.348 33.309 1.00 7.67 H new ATOM 0 HG23 THR B 133 14.129 11.683 34.152 1.00 7.67 H new ATOM 2891 N ASN B 134 14.203 9.123 38.244 1.00 7.48 N ATOM 2892 CA ASN B 134 14.507 8.163 39.310 1.00 8.39 C ATOM 2893 C ASN B 134 13.418 7.102 39.460 1.00 8.92 C ATOM 2894 O ASN B 134 13.710 5.995 39.913 1.00 10.51 O ATOM 2895 CB ASN B 134 14.758 8.858 40.643 1.00 8.16 C ATOM 2896 CG ASN B 134 16.150 9.457 40.726 1.00 8.14 C ATOM 2897 OD1 ASN B 134 16.902 9.465 39.766 1.00 8.53 O ATOM 2898 ND2 ASN B 134 16.495 9.967 41.891 1.00 9.20 N ATOM 0 H ASN B 134 14.112 9.941 38.494 1.00 7.48 H new ATOM 0 HA ASN B 134 15.324 7.713 39.044 1.00 8.39 H new ATOM 0 HB2 ASN B 134 14.099 9.558 40.770 1.00 8.16 H new ATOM 0 HB3 ASN B 134 14.638 8.221 41.365 1.00 8.16 H new ATOM 0 HD21 ASN B 134 17.272 10.320 41.992 1.00 9.20 H new ATOM 0 HD22 ASN B 134 15.943 9.947 42.550 1.00 9.20 H new ATOM 2899 N ARG B 135 12.181 7.431 39.078 1.00 9.13 N ATOM 2900 CA ARG B 135 11.091 6.446 39.169 1.00 10.43 C ATOM 2901 C ARG B 135 11.050 5.509 37.963 1.00 10.54 C ATOM 2902 O ARG B 135 10.822 4.312 38.118 1.00 12.41 O ATOM 2903 CB ARG B 135 9.746 7.139 39.346 1.00 11.79 C ATOM 2904 CG ARG B 135 8.608 6.152 39.166 1.00 14.64 C ATOM 2905 CD ARG B 135 7.299 6.599 39.752 1.00 18.21 C ATOM 2906 NE ARG B 135 6.350 5.509 39.540 1.00 20.68 N ATOM 2907 CZ ARG B 135 5.163 5.384 40.128 1.00 22.49 C ATOM 2908 NH1 ARG B 135 4.732 6.297 40.985 1.00 22.88 N ATOM 2909 NH2 ARG B 135 4.402 4.331 39.835 1.00 24.61 N ATOM 0 H ARG B 135 11.952 8.201 38.770 1.00 9.13 H new ATOM 0 HA ARG B 135 11.271 5.902 39.952 1.00 10.43 H new ATOM 0 HB2 ARG B 135 9.697 7.540 40.228 1.00 11.79 H new ATOM 0 HB3 ARG B 135 9.661 7.859 38.702 1.00 11.79 H new ATOM 0 HG2 ARG B 135 8.485 5.986 38.218 1.00 14.64 H new ATOM 0 HG3 ARG B 135 8.860 5.308 39.572 1.00 14.64 H new ATOM 0 HD2 ARG B 135 7.394 6.794 40.697 1.00 18.21 H new ATOM 0 HD3 ARG B 135 6.990 7.413 39.324 1.00 18.21 H new ATOM 0 HE ARG B 135 6.579 4.893 38.985 1.00 20.68 H new ATOM 0 HH11 ARG B 135 5.221 6.981 41.167 1.00 22.88 H new ATOM 0 HH12 ARG B 135 3.963 6.206 41.359 1.00 22.88 H new ATOM 0 HH21 ARG B 135 4.680 3.743 39.272 1.00 24.61 H new ATOM 0 HH22 ARG B 135 3.633 4.239 40.209 1.00 24.61 H new ATOM 2910 N PHE B 136 11.256 6.047 36.764 1.00 9.45 N ATOM 2911 CA PHE B 136 10.979 5.299 35.547 1.00 9.33 C ATOM 2912 C PHE B 136 12.191 4.757 34.819 1.00 9.26 C ATOM 2913 O PHE B 136 12.088 3.789 34.056 1.00 10.08 O ATOM 2914 CB PHE B 136 10.137 6.147 34.586 1.00 9.43 C ATOM 2915 CG PHE B 136 8.714 6.332 35.030 1.00 9.32 C ATOM 2916 CD1 PHE B 136 7.758 5.356 34.738 1.00 10.02 C ATOM 2917 CD2 PHE B 136 8.331 7.438 35.773 1.00 9.77 C ATOM 2918 CE1 PHE B 136 6.448 5.502 35.162 1.00 10.05 C ATOM 2919 CE2 PHE B 136 7.024 7.564 36.211 1.00 9.45 C ATOM 2920 CZ PHE B 136 6.076 6.612 35.891 1.00 10.10 C ATOM 0 H PHE B 136 11.555 6.843 36.636 1.00 9.45 H new ATOM 0 HA PHE B 136 10.491 4.516 35.846 1.00 9.33 H new ATOM 0 HB2 PHE B 136 10.552 7.018 34.488 1.00 9.43 H new ATOM 0 HB3 PHE B 136 10.142 5.730 33.710 1.00 9.43 H new ATOM 0 HD1 PHE B 136 8.004 4.601 34.254 1.00 10.02 H new ATOM 0 HD2 PHE B 136 8.954 8.097 35.978 1.00 9.77 H new ATOM 0 HE1 PHE B 136 5.818 4.850 34.955 1.00 10.05 H new ATOM 0 HE2 PHE B 136 6.781 8.299 36.727 1.00 9.45 H new ATOM 0 HZ PHE B 136 5.194 6.719 36.165 1.00 10.10 H new ATOM 2921 N GLN B 137 13.337 5.405 35.001 1.00 8.75 N ATOM 2922 CA GLN B 137 14.556 5.045 34.263 1.00 8.35 C ATOM 2923 C GLN B 137 15.776 5.496 35.054 1.00 8.56 C ATOM 2924 O GLN B 137 16.545 6.364 34.601 1.00 8.29 O ATOM 2925 CB GLN B 137 14.557 5.620 32.833 1.00 8.39 C ATOM 2926 CG GLN B 137 14.356 7.126 32.723 1.00 8.23 C ATOM 2927 CD GLN B 137 13.000 7.523 32.162 1.00 7.87 C ATOM 2928 OE1 GLN B 137 12.615 7.110 31.044 1.00 9.30 O ATOM 2929 NE2 GLN B 137 12.290 8.345 32.883 1.00 7.08 N ATOM 0 H GLN B 137 13.435 6.060 35.549 1.00 8.75 H new ATOM 0 HA GLN B 137 14.585 4.081 34.164 1.00 8.35 H new ATOM 0 HB2 GLN B 137 15.400 5.392 32.412 1.00 8.39 H new ATOM 0 HB3 GLN B 137 13.858 5.180 32.325 1.00 8.39 H new ATOM 0 HG2 GLN B 137 14.462 7.523 33.601 1.00 8.23 H new ATOM 0 HG3 GLN B 137 15.052 7.497 32.158 1.00 8.23 H new ATOM 0 HE21 GLN B 137 12.583 8.610 33.647 1.00 7.08 H new ATOM 0 HE22 GLN B 137 11.529 8.622 32.595 1.00 7.08 H new ATOM 2930 N LEU B 138 15.935 4.898 36.229 1.00 9.17 N ATOM 2931 CA LEU B 138 16.980 5.321 37.167 1.00 9.48 C ATOM 2932 C LEU B 138 18.336 5.339 36.484 1.00 9.83 C ATOM 2933 O LEU B 138 18.735 4.365 35.846 1.00 10.58 O ATOM 2934 CB LEU B 138 17.007 4.422 38.403 1.00 10.30 C ATOM 2935 CG LEU B 138 18.092 4.743 39.433 1.00 11.04 C ATOM 2936 CD1 LEU B 138 17.920 6.136 40.017 1.00 11.66 C ATOM 2937 CD2 LEU B 138 18.113 3.704 40.532 1.00 12.56 C ATOM 0 H LEU B 138 15.450 4.244 36.506 1.00 9.17 H new ATOM 0 HA LEU B 138 16.773 6.222 37.460 1.00 9.48 H new ATOM 0 HB2 LEU B 138 16.143 4.475 38.840 1.00 10.30 H new ATOM 0 HB3 LEU B 138 17.122 3.504 38.112 1.00 10.30 H new ATOM 0 HG LEU B 138 18.945 4.722 38.971 1.00 11.04 H new ATOM 0 HD11 LEU B 138 18.623 6.305 40.664 1.00 11.66 H new ATOM 0 HD12 LEU B 138 17.971 6.794 39.306 1.00 11.66 H new ATOM 0 HD13 LEU B 138 17.057 6.199 40.454 1.00 11.66 H new ATOM 0 HD21 LEU B 138 18.806 3.925 41.173 1.00 12.56 H new ATOM 0 HD22 LEU B 138 17.252 3.688 40.979 1.00 12.56 H new ATOM 0 HD23 LEU B 138 18.294 2.831 40.149 1.00 12.56 H new ATOM 2938 N GLN B 139 19.032 6.460 36.616 1.00 9.68 N ATOM 2939 CA GLN B 139 20.346 6.611 36.004 1.00 10.17 C ATOM 2940 C GLN B 139 21.229 7.444 36.927 1.00 9.65 C ATOM 2941 O GLN B 139 20.785 7.902 37.979 1.00 9.25 O ATOM 2942 CB GLN B 139 20.246 7.191 34.586 1.00 11.68 C ATOM 2943 CG GLN B 139 19.281 8.332 34.399 1.00 11.92 C ATOM 2944 CD GLN B 139 18.929 8.529 32.925 1.00 12.47 C ATOM 2945 OE1 GLN B 139 19.745 9.012 32.124 1.00 13.47 O ATOM 2946 NE2 GLN B 139 17.711 8.122 32.539 1.00 10.43 N ATOM 0 H GLN B 139 18.761 7.147 37.057 1.00 9.68 H new ATOM 0 HA GLN B 139 20.758 5.739 35.896 1.00 10.17 H new ATOM 0 HB2 GLN B 139 21.128 7.491 34.317 1.00 11.68 H new ATOM 0 HB3 GLN B 139 19.993 6.476 33.982 1.00 11.68 H new ATOM 0 HG2 GLN B 139 18.472 8.160 34.906 1.00 11.92 H new ATOM 0 HG3 GLN B 139 19.669 9.148 34.752 1.00 11.92 H new ATOM 0 HE21 GLN B 139 17.166 7.791 33.116 1.00 10.43 H new ATOM 0 HE22 GLN B 139 17.475 8.192 31.715 1.00 10.43 H new ATOM 2947 N SER B 140 22.485 7.641 36.532 1.00 9.77 N ATOM 2948 CA SER B 140 23.441 8.299 37.418 1.00 9.97 C ATOM 2949 C SER B 140 23.124 9.764 37.670 1.00 9.65 C ATOM 2950 O SER B 140 23.518 10.308 38.709 1.00 9.99 O ATOM 2951 CB SER B 140 24.865 8.106 36.897 1.00 10.87 C ATOM 2952 OG SER B 140 25.085 8.817 35.719 1.00 11.42 O ATOM 0 H SER B 140 22.800 7.405 35.767 1.00 9.77 H new ATOM 0 HA SER B 140 23.365 7.870 38.285 1.00 9.97 H new ATOM 0 HB2 SER B 140 25.499 8.395 37.572 1.00 10.87 H new ATOM 0 HB3 SER B 140 25.027 7.163 36.741 1.00 10.87 H new ATOM 0 HG SER B 140 24.718 8.417 35.078 1.00 11.42 H new ATOM 2953 N ALYS B 141 22.389 10.368 36.745 0.50 9.45 N ATOM 2954 N BLYS B 141 22.436 10.395 36.723 0.50 9.57 N ATOM 2955 CA ALYS B 141 21.899 11.730 36.874 0.50 9.35 C ATOM 2956 CA BLYS B 141 21.899 11.739 36.904 0.50 9.56 C ATOM 2957 C ALYS B 141 20.384 11.702 36.979 0.50 8.73 C ATOM 2958 C BLYS B 141 20.400 11.639 37.071 0.50 8.81 C ATOM 2959 O ALYS B 141 19.735 10.851 36.364 0.50 8.45 O ATOM 2960 O BLYS B 141 19.784 10.688 36.579 0.50 8.41 O ATOM 2961 CB ALYS B 141 22.362 12.528 35.657 0.50 10.36 C ATOM 2962 CB BLYS B 141 22.227 12.615 35.695 0.50 10.77 C ATOM 2963 CG ALYS B 141 23.886 12.453 35.527 0.50 11.43 C ATOM 2964 CG BLYS B 141 23.713 12.929 35.579 0.50 12.58 C ATOM 2965 CD ALYS B 141 24.450 12.990 34.231 0.50 12.96 C ATOM 2966 CD BLYS B 141 24.016 13.709 34.324 0.50 14.28 C ATOM 2967 CE ALYS B 141 24.630 11.882 33.209 0.50 14.28 C ATOM 2968 CE BLYS B 141 24.150 12.777 33.131 0.50 15.79 C ATOM 2969 NZ ALYS B 141 23.496 11.760 32.256 0.50 14.50 N ATOM 2970 NZ BLYS B 141 25.468 12.070 33.143 0.50 18.13 N ATOM 0 H ALYS B 141 22.157 9.988 36.009 0.50 9.57 H new ATOM 0 H BLYS B 141 22.267 10.053 35.952 0.50 9.57 H new ATOM 0 HA ALYS B 141 22.249 12.154 37.673 0.50 9.56 H new ATOM 0 HA BLYS B 141 22.298 12.144 37.690 0.50 9.56 H new ATOM 0 HB2ALYS B 141 21.944 12.179 34.854 0.50 10.77 H new ATOM 0 HB2BLYS B 141 21.931 12.167 34.887 0.50 10.77 H new ATOM 0 HB3ALYS B 141 22.083 13.453 35.743 0.50 10.77 H new ATOM 0 HB3BLYS B 141 21.729 13.445 35.758 0.50 10.77 H new ATOM 0 HG2ALYS B 141 24.283 12.943 36.264 0.50 12.58 H new ATOM 0 HG2BLYS B 141 23.999 13.437 36.354 0.50 12.58 H new ATOM 0 HG3ALYS B 141 24.159 11.527 35.623 0.50 12.58 H new ATOM 0 HG3BLYS B 141 24.221 12.102 35.578 0.50 12.58 H new ATOM 0 HD2ALYS B 141 23.857 13.669 33.874 0.50 14.28 H new ATOM 0 HD2BLYS B 141 23.309 14.353 34.159 0.50 14.28 H new ATOM 0 HD3ALYS B 141 25.303 13.419 34.400 0.50 14.28 H new ATOM 0 HD3BLYS B 141 24.837 14.212 34.441 0.50 14.28 H new ATOM 0 HE2ALYS B 141 25.446 12.042 32.710 0.50 15.79 H new ATOM 0 HE2BLYS B 141 23.431 12.126 33.143 0.50 15.79 H new ATOM 0 HE3ALYS B 141 24.743 11.039 33.674 0.50 15.79 H new ATOM 0 HE3BLYS B 141 24.060 13.284 32.309 0.50 15.79 H new ATOM 0 HZ1ALYS B 141 23.109 10.965 32.355 0.50 18.13 H new ATOM 0 HZ1BLYS B 141 25.651 11.769 32.326 0.50 18.13 H new ATOM 0 HZ2ALYS B 141 22.901 12.401 32.419 0.50 18.13 H new ATOM 0 HZ2BLYS B 141 26.106 12.635 33.400 0.50 18.13 H new ATOM 0 HZ3ALYS B 141 23.798 11.841 31.423 0.50 18.13 H new ATOM 0 HZ3BLYS B 141 25.433 11.385 33.710 0.50 18.13 H new ATOM 2971 N GLN B 142 19.828 12.605 37.782 1.00 8.58 N ATOM 2972 CA GLN B 142 18.379 12.710 37.933 1.00 8.45 C ATOM 2973 C GLN B 142 17.870 13.845 37.066 1.00 8.53 C ATOM 2974 O GLN B 142 18.438 14.956 37.087 1.00 8.93 O ATOM 2975 CB GLN B 142 18.004 12.989 39.381 1.00 8.58 C ATOM 2976 CG GLN B 142 16.497 13.020 39.580 1.00 9.08 C ATOM 2977 CD GLN B 142 16.121 13.380 40.979 1.00 9.38 C ATOM 2978 OE1 GLN B 142 16.956 13.839 41.763 1.00 9.96 O ATOM 2979 NE2 GLN B 142 14.857 13.214 41.305 1.00 9.70 N ATOM 0 H AGLN B 142 20.276 13.170 38.251 0.50 8.58 H new ATOM 0 H BGLN B 142 20.269 13.219 38.191 0.50 8.58 H new ATOM 0 HA GLN B 142 17.978 11.869 37.663 1.00 8.45 H new ATOM 0 HB2 GLN B 142 18.391 12.307 39.952 1.00 8.58 H new ATOM 0 HB3 GLN B 142 18.384 13.838 39.655 1.00 8.58 H new ATOM 0 HG2 GLN B 142 16.104 13.660 38.966 1.00 9.08 H new ATOM 0 HG3 GLN B 142 16.125 12.151 39.360 1.00 9.08 H new ATOM 0 HE21 GLN B 142 14.304 12.891 40.731 1.00 9.70 H new ATOM 0 HE22 GLN B 142 14.584 13.429 42.092 1.00 9.70 H new ATOM 2980 N TYR B 143 16.800 13.565 36.319 1.00 8.34 N ATOM 2981 CA TYR B 143 16.144 14.575 35.487 1.00 8.67 C ATOM 2982 C TYR B 143 14.703 14.771 35.892 1.00 8.54 C ATOM 2983 O TYR B 143 14.014 13.828 36.318 1.00 8.40 O ATOM 2984 CB TYR B 143 16.165 14.199 33.997 1.00 9.79 C ATOM 2985 CG TYR B 143 17.533 13.868 33.413 1.00 10.95 C ATOM 2986 CD1 TYR B 143 18.156 12.648 33.706 1.00 12.04 C ATOM 2987 CD2 TYR B 143 18.195 14.755 32.550 1.00 12.66 C ATOM 2988 CE1 TYR B 143 19.393 12.309 33.174 1.00 14.20 C ATOM 2989 CE2 TYR B 143 19.437 14.416 32.017 1.00 14.27 C ATOM 2990 CZ TYR B 143 20.009 13.198 32.326 1.00 14.47 C ATOM 2991 OH TYR B 143 21.246 12.836 31.815 1.00 19.02 O ATOM 0 H TYR B 143 16.436 12.787 36.281 1.00 8.34 H new ATOM 0 HA TYR B 143 16.646 15.394 35.622 1.00 8.67 H new ATOM 0 HB2 TYR B 143 15.583 13.434 33.866 1.00 9.79 H new ATOM 0 HB3 TYR B 143 15.786 14.934 33.490 1.00 9.79 H new ATOM 0 HD1 TYR B 143 17.729 12.048 34.273 1.00 12.04 H new ATOM 0 HD2 TYR B 143 17.804 15.571 32.333 1.00 12.66 H new ATOM 0 HE1 TYR B 143 19.796 11.498 33.387 1.00 14.20 H new ATOM 0 HE2 TYR B 143 19.880 15.009 31.454 1.00 14.27 H new ATOM 0 HH TYR B 143 21.168 12.131 31.365 1.00 19.02 H new ATOM 2992 N THR B 144 14.252 16.001 35.707 1.00 8.61 N ATOM 2993 CA THR B 144 12.846 16.363 35.685 1.00 8.69 C ATOM 2994 C THR B 144 12.458 16.431 34.232 1.00 8.31 C ATOM 2995 O THR B 144 12.957 17.283 33.491 1.00 7.87 O ATOM 2996 CB THR B 144 12.658 17.724 36.344 1.00 9.62 C ATOM 2997 OG1 THR B 144 13.093 17.615 37.701 1.00 11.71 O ATOM 2998 CG2 THR B 144 11.226 18.180 36.289 1.00 10.56 C ATOM 0 H THR B 144 14.776 16.673 35.586 1.00 8.61 H new ATOM 0 HA THR B 144 12.300 15.722 36.166 1.00 8.69 H new ATOM 0 HB THR B 144 13.180 18.387 35.866 1.00 9.62 H new ATOM 0 HG1 THR B 144 12.967 16.831 37.974 1.00 11.71 H new ATOM 0 HG21 THR B 144 11.146 19.047 36.717 1.00 10.56 H new ATOM 0 HG22 THR B 144 10.943 18.249 35.364 1.00 10.56 H new ATOM 0 HG23 THR B 144 10.664 17.539 36.751 1.00 10.56 H new ATOM 2999 N LYS B 145 11.604 15.498 33.831 1.00 7.87 N ATOM 3000 CA LYS B 145 11.288 15.275 32.418 1.00 7.70 C ATOM 3001 C LYS B 145 9.891 15.849 32.124 1.00 7.49 C ATOM 3002 O LYS B 145 8.855 15.237 32.472 1.00 7.50 O ATOM 3003 CB LYS B 145 11.376 13.770 32.116 1.00 7.78 C ATOM 3004 CG LYS B 145 11.025 13.381 30.674 1.00 7.85 C ATOM 3005 CD LYS B 145 11.138 11.862 30.445 1.00 8.45 C ATOM 3006 CE LYS B 145 12.563 11.333 30.634 1.00 8.69 C ATOM 3007 NZ LYS B 145 13.462 11.757 29.513 1.00 8.28 N ATOM 0 H LYS B 145 11.188 14.972 34.370 1.00 7.87 H new ATOM 0 HA LYS B 145 11.923 15.728 31.841 1.00 7.70 H new ATOM 0 HB2 LYS B 145 12.277 13.466 32.309 1.00 7.78 H new ATOM 0 HB3 LYS B 145 10.782 13.297 32.719 1.00 7.78 H new ATOM 0 HG2 LYS B 145 10.122 13.672 30.472 1.00 7.85 H new ATOM 0 HG3 LYS B 145 11.617 13.845 30.061 1.00 7.85 H new ATOM 0 HD2 LYS B 145 10.544 11.402 31.058 1.00 8.45 H new ATOM 0 HD3 LYS B 145 10.837 11.652 29.547 1.00 8.45 H new ATOM 0 HE2 LYS B 145 12.920 11.656 31.476 1.00 8.69 H new ATOM 0 HE3 LYS B 145 12.545 10.365 30.687 1.00 8.69 H new ATOM 0 HZ1 LYS B 145 14.307 11.575 29.725 1.00 8.28 H new ATOM 0 HZ2 LYS B 145 13.241 11.316 28.772 1.00 8.28 H new ATOM 0 HZ3 LYS B 145 13.373 12.632 29.375 1.00 8.28 H new ATOM 3008 N PHE B 146 9.863 17.014 31.486 1.00 7.27 N ATOM 3009 CA PHE B 146 8.618 17.647 31.065 1.00 7.57 C ATOM 3010 C PHE B 146 8.177 16.998 29.764 1.00 7.65 C ATOM 3011 O PHE B 146 8.982 16.913 28.829 1.00 8.38 O ATOM 3012 CB PHE B 146 8.875 19.117 30.713 1.00 8.54 C ATOM 3013 CG PHE B 146 9.228 20.031 31.854 1.00 9.52 C ATOM 3014 CD1 PHE B 146 10.497 20.035 32.449 1.00 9.78 C ATOM 3015 CD2 PHE B 146 8.304 21.001 32.248 1.00 10.83 C ATOM 3016 CE1 PHE B 146 10.803 20.980 33.455 1.00 10.71 C ATOM 3017 CE2 PHE B 146 8.606 21.927 33.236 1.00 12.07 C ATOM 3018 CZ PHE B 146 9.842 21.911 33.843 1.00 11.92 C ATOM 0 H PHE B 146 10.569 17.462 31.284 1.00 7.27 H new ATOM 0 HA PHE B 146 7.965 17.560 31.777 1.00 7.57 H new ATOM 0 HB2 PHE B 146 9.594 19.152 30.063 1.00 8.54 H new ATOM 0 HB3 PHE B 146 8.082 19.468 30.278 1.00 8.54 H new ATOM 0 HD1 PHE B 146 11.138 19.416 32.182 1.00 9.78 H new ATOM 0 HD2 PHE B 146 7.469 21.027 31.840 1.00 10.83 H new ATOM 0 HE1 PHE B 146 11.642 20.980 33.856 1.00 10.71 H new ATOM 0 HE2 PHE B 146 7.973 22.559 33.489 1.00 12.07 H new ATOM 0 HZ PHE B 146 10.036 22.524 34.515 1.00 11.92 H new ATOM 3019 N VAL B 147 6.930 16.558 29.666 1.00 7.15 N ATOM 3020 CA VAL B 147 6.443 16.041 28.392 1.00 7.34 C ATOM 3021 C VAL B 147 5.275 16.907 27.962 1.00 7.21 C ATOM 3022 O VAL B 147 4.216 16.915 28.609 1.00 7.60 O ATOM 3023 CB VAL B 147 6.037 14.555 28.453 1.00 6.97 C ATOM 3024 CG1 VAL B 147 5.611 14.111 27.056 1.00 7.28 C ATOM 3025 CG2 VAL B 147 7.159 13.691 29.046 1.00 7.41 C ATOM 0 H VAL B 147 6.359 16.549 30.309 1.00 7.15 H new ATOM 0 HA VAL B 147 7.164 16.080 27.744 1.00 7.34 H new ATOM 0 HB VAL B 147 5.283 14.439 29.052 1.00 6.97 H new ATOM 0 HG11 VAL B 147 5.352 13.176 27.078 1.00 7.28 H new ATOM 0 HG12 VAL B 147 4.859 14.648 26.761 1.00 7.28 H new ATOM 0 HG13 VAL B 147 6.351 14.227 26.440 1.00 7.28 H new ATOM 0 HG21 VAL B 147 6.875 12.764 29.071 1.00 7.41 H new ATOM 0 HG22 VAL B 147 7.954 13.770 28.496 1.00 7.41 H new ATOM 0 HG23 VAL B 147 7.358 13.992 29.946 1.00 7.41 H new ATOM 3026 N PHE B 148 5.465 17.637 26.863 1.00 7.42 N ATOM 3027 CA PHE B 148 4.465 18.565 26.323 1.00 7.88 C ATOM 3028 C PHE B 148 3.741 17.910 25.162 1.00 8.06 C ATOM 3029 O PHE B 148 4.372 17.364 24.266 1.00 8.40 O ATOM 3030 CB PHE B 148 5.160 19.826 25.802 1.00 8.38 C ATOM 3031 CG PHE B 148 5.814 20.669 26.865 1.00 8.81 C ATOM 3032 CD1 PHE B 148 5.076 21.633 27.566 1.00 9.57 C ATOM 3033 CD2 PHE B 148 7.178 20.521 27.125 1.00 9.20 C ATOM 3034 CE1 PHE B 148 5.701 22.425 28.520 1.00 10.32 C ATOM 3035 CE2 PHE B 148 7.797 21.318 28.080 1.00 9.84 C ATOM 3036 CZ PHE B 148 7.050 22.268 28.762 1.00 10.25 C ATOM 0 H PHE B 148 6.190 17.608 26.401 1.00 7.42 H new ATOM 0 HA PHE B 148 3.838 18.795 27.026 1.00 7.88 H new ATOM 0 HB2 PHE B 148 5.833 19.565 25.154 1.00 8.38 H new ATOM 0 HB3 PHE B 148 4.508 20.369 25.332 1.00 8.38 H new ATOM 0 HD1 PHE B 148 4.169 21.742 27.392 1.00 9.57 H new ATOM 0 HD2 PHE B 148 7.673 19.887 26.658 1.00 9.20 H new ATOM 0 HE1 PHE B 148 5.212 23.059 28.994 1.00 10.32 H new ATOM 0 HE2 PHE B 148 8.704 21.216 28.260 1.00 9.84 H new ATOM 0 HZ PHE B 148 7.466 22.809 29.394 1.00 10.25 H new ATOM 3037 N GLY B 149 2.411 17.998 25.172 1.00 8.15 N ATOM 3038 CA GLY B 149 1.628 17.690 23.967 1.00 9.03 C ATOM 3039 C GLY B 149 1.814 18.804 22.960 1.00 9.31 C ATOM 3040 O GLY B 149 1.572 19.962 23.284 1.00 9.41 O ATOM 0 H GLY B 149 1.945 18.231 25.856 1.00 8.15 H new ATOM 0 HA2 GLY B 149 1.915 16.845 23.588 1.00 9.03 H new ATOM 0 HA3 GLY B 149 0.689 17.596 24.193 1.00 9.03 H new ATOM 3041 N CYS B 150 2.243 18.447 21.750 1.00 9.84 N ATOM 3042 CA CYS B 150 2.568 19.437 20.717 1.00 10.43 C ATOM 3043 C CYS B 150 1.944 19.037 19.391 1.00 10.92 C ATOM 3044 O CYS B 150 1.709 17.858 19.126 1.00 11.18 O ATOM 3045 CB CYS B 150 4.090 19.572 20.519 1.00 9.80 C ATOM 3046 SG CYS B 150 4.985 20.086 22.005 1.00 10.51 S ATOM 0 H CYS B 150 2.354 17.630 21.504 1.00 9.84 H new ATOM 0 HA CYS B 150 2.212 20.289 21.015 1.00 10.43 H new ATOM 0 HB2 CYS B 150 4.444 18.721 20.218 1.00 9.80 H new ATOM 0 HB3 CYS B 150 4.259 20.215 19.813 1.00 9.80 H new ATOM 0 HG CYS B 150 4.892 19.233 22.844 1.00 10.51 H new ATOM 3047 N LYS B 151 1.693 20.047 18.560 1.00 12.31 N ATOM 3048 CA LYS B 151 1.250 19.854 17.172 1.00 13.13 C ATOM 3049 C LYS B 151 2.310 20.416 16.238 1.00 12.59 C ATOM 3050 O LYS B 151 2.795 21.531 16.444 1.00 13.06 O ATOM 3051 CB LYS B 151 -0.076 20.589 16.951 1.00 15.33 C ATOM 3052 CG LYS B 151 -0.620 20.565 15.533 1.00 18.30 C ATOM 3053 CD LYS B 151 -1.924 21.337 15.472 1.00 20.68 C ATOM 3054 CE LYS B 151 -2.490 21.292 14.063 1.00 23.26 C ATOM 3055 NZ LYS B 151 -3.674 22.183 13.943 1.00 26.58 N ATOM 0 H LYS B 151 1.775 20.873 18.785 1.00 12.31 H new ATOM 0 HA LYS B 151 1.122 18.909 16.993 1.00 13.13 H new ATOM 0 HB2 LYS B 151 -0.742 20.203 17.541 1.00 15.33 H new ATOM 0 HB3 LYS B 151 0.038 21.514 17.219 1.00 15.33 H new ATOM 0 HG2 LYS B 151 0.026 20.955 14.923 1.00 18.30 H new ATOM 0 HG3 LYS B 151 -0.763 19.649 15.248 1.00 18.30 H new ATOM 0 HD2 LYS B 151 -2.562 20.959 16.097 1.00 20.68 H new ATOM 0 HD3 LYS B 151 -1.776 22.257 15.740 1.00 20.68 H new ATOM 0 HE2 LYS B 151 -1.809 21.564 13.427 1.00 23.26 H new ATOM 0 HE3 LYS B 151 -2.740 20.382 13.839 1.00 23.26 H new ATOM 0 HZ1 LYS B 151 -3.992 22.144 13.113 1.00 26.58 H new ATOM 0 HZ2 LYS B 151 -4.304 21.919 14.514 1.00 26.58 H new ATOM 0 HZ3 LYS B 151 -3.436 23.020 14.130 1.00 26.58 H new ATOM 3056 N LEU B 152 2.650 19.649 15.202 1.00 12.95 N ATOM 3057 CA LEU B 152 3.587 20.121 14.192 1.00 13.78 C ATOM 3058 C LEU B 152 2.893 21.048 13.204 1.00 15.01 C ATOM 3059 O LEU B 152 1.735 20.841 12.846 1.00 15.78 O ATOM 3060 CB LEU B 152 4.220 18.948 13.441 1.00 14.12 C ATOM 3061 CG LEU B 152 5.032 18.006 14.332 1.00 13.66 C ATOM 3062 CD1 LEU B 152 5.595 16.854 13.525 1.00 14.53 C ATOM 3063 CD2 LEU B 152 6.147 18.729 15.089 1.00 13.64 C ATOM 0 H LEU B 152 2.348 18.855 15.069 1.00 12.95 H new ATOM 0 HA LEU B 152 4.287 20.613 14.648 1.00 13.78 H new ATOM 0 HB2 LEU B 152 3.519 18.440 13.003 1.00 14.12 H new ATOM 0 HB3 LEU B 152 4.797 19.296 12.743 1.00 14.12 H new ATOM 0 HG LEU B 152 4.420 17.654 14.997 1.00 13.66 H new ATOM 0 HD11 LEU B 152 6.105 16.270 14.107 1.00 14.53 H new ATOM 0 HD12 LEU B 152 4.867 16.354 13.123 1.00 14.53 H new ATOM 0 HD13 LEU B 152 6.173 17.200 12.827 1.00 14.53 H new ATOM 0 HD21 LEU B 152 6.631 18.092 15.638 1.00 13.64 H new ATOM 0 HD22 LEU B 152 6.756 19.138 14.455 1.00 13.64 H new ATOM 0 HD23 LEU B 152 5.761 19.416 15.655 1.00 13.64 H new ATOM 3064 N LEU B 153 3.631 22.062 12.770 1.00 15.30 N ATOM 3065 CA LEU B 153 3.138 23.032 11.803 1.00 16.98 C ATOM 3066 C LEU B 153 3.926 22.836 10.502 1.00 17.51 C ATOM 3067 O LEU B 153 4.051 21.709 10.044 1.00 18.19 O ATOM 3068 CB LEU B 153 3.246 24.445 12.375 1.00 17.25 C ATOM 3069 CG LEU B 153 2.481 24.658 13.695 1.00 17.98 C ATOM 3070 CD1 LEU B 153 2.790 26.015 14.303 1.00 18.10 C ATOM 3071 CD2 LEU B 153 0.973 24.465 13.564 1.00 18.39 C ATOM 0 H LEU B 153 4.438 22.207 13.030 1.00 15.30 H new ATOM 0 HA LEU B 153 2.197 22.899 11.609 1.00 16.98 H new ATOM 0 HB2 LEU B 153 4.182 24.653 12.520 1.00 17.25 H new ATOM 0 HB3 LEU B 153 2.914 25.075 11.716 1.00 17.25 H new ATOM 0 HG LEU B 153 2.799 23.964 14.294 1.00 17.98 H new ATOM 0 HD11 LEU B 153 2.295 26.119 15.131 1.00 18.10 H new ATOM 0 HD12 LEU B 153 3.741 26.079 14.485 1.00 18.10 H new ATOM 0 HD13 LEU B 153 2.532 26.714 13.682 1.00 18.10 H new ATOM 0 HD21 LEU B 153 0.552 24.612 14.425 1.00 18.39 H new ATOM 0 HD22 LEU B 153 0.620 25.098 12.919 1.00 18.39 H new ATOM 0 HD23 LEU B 153 0.787 23.561 13.264 1.00 18.39 H new ATOM 3072 N ASP B 154 4.465 23.904 9.917 1.00 19.16 N ATOM 3073 CA ASP B 154 5.177 23.762 8.657 1.00 21.00 C ATOM 3074 C ASP B 154 6.616 23.285 8.838 1.00 19.38 C ATOM 3075 O ASP B 154 7.275 23.567 9.845 1.00 20.03 O ATOM 3076 CB ASP B 154 5.142 25.069 7.844 1.00 24.32 C ATOM 3077 CG ASP B 154 3.786 25.321 7.192 1.00 27.35 C ATOM 3078 OD1 ASP B 154 3.004 24.361 6.988 1.00 29.83 O ATOM 3079 OD2 ASP B 154 3.498 26.494 6.871 1.00 31.66 O ATOM 0 H ASP B 154 4.429 24.705 10.229 1.00 19.16 H new ATOM 0 HA ASP B 154 4.709 23.073 8.160 1.00 21.00 H new ATOM 0 HB2 ASP B 154 5.360 25.814 8.426 1.00 24.32 H new ATOM 0 HB3 ASP B 154 5.826 25.036 7.157 1.00 24.32 H new ATOM 3080 N GLY B 155 7.100 22.568 7.837 1.00 19.76 N ATOM 3081 CA GLY B 155 8.498 22.178 7.787 1.00 19.59 C ATOM 3082 C GLY B 155 8.665 20.877 7.044 1.00 19.99 C ATOM 3083 O GLY B 155 7.786 20.463 6.292 1.00 20.77 O ATOM 0 H GLY B 155 6.630 22.295 7.170 1.00 19.76 H new ATOM 0 HA2 GLY B 155 9.016 22.873 7.352 1.00 19.59 H new ATOM 0 HA3 GLY B 155 8.845 22.087 8.688 1.00 19.59 H new ATOM 3084 N GLN B 156 9.808 20.235 7.253 1.00 19.50 N ATOM 3085 CA GLN B 156 10.101 18.953 6.624 1.00 20.92 C ATOM 3086 C GLN B 156 11.244 18.288 7.355 1.00 18.95 C ATOM 3087 O GLN B 156 12.212 18.956 7.733 1.00 19.33 O ATOM 3088 CB GLN B 156 10.416 19.110 5.122 1.00 23.83 C ATOM 3089 CG GLN B 156 11.221 20.349 4.755 1.00 27.62 C ATOM 3090 CD GLN B 156 11.690 20.340 3.308 1.00 30.43 C ATOM 3091 OE1 GLN B 156 12.713 19.733 2.978 1.00 33.33 O ATOM 3092 NE2 GLN B 156 10.951 21.022 2.439 1.00 32.51 N ATOM 0 H GLN B 156 10.435 20.529 7.763 1.00 19.50 H new ATOM 0 HA GLN B 156 9.312 18.391 6.685 1.00 20.92 H new ATOM 0 HB2 GLN B 156 10.903 18.326 4.825 1.00 23.83 H new ATOM 0 HB3 GLN B 156 9.580 19.128 4.631 1.00 23.83 H new ATOM 0 HG2 GLN B 156 10.680 21.139 4.910 1.00 27.62 H new ATOM 0 HG3 GLN B 156 11.992 20.414 5.340 1.00 27.62 H new ATOM 0 HE21 GLN B 156 10.244 21.433 2.705 1.00 32.51 H new ATOM 0 HE22 GLN B 156 11.180 21.052 1.611 1.00 32.51 H new ATOM 3093 N PHE B 157 11.123 16.981 7.582 1.00 17.57 N ATOM 3094 CA PHE B 157 12.197 16.244 8.222 1.00 17.12 C ATOM 3095 C PHE B 157 13.394 16.104 7.297 1.00 18.22 C ATOM 3096 O PHE B 157 13.252 15.753 6.114 1.00 19.79 O ATOM 3097 CB PHE B 157 11.779 14.862 8.731 1.00 15.69 C ATOM 3098 CG PHE B 157 12.927 14.090 9.300 1.00 14.61 C ATOM 3099 CD1 PHE B 157 13.517 14.497 10.496 1.00 14.06 C ATOM 3100 CD2 PHE B 157 13.476 12.991 8.625 1.00 14.47 C ATOM 3101 CE1 PHE B 157 14.604 13.835 11.010 1.00 14.31 C ATOM 3102 CE2 PHE B 157 14.574 12.322 9.149 1.00 14.70 C ATOM 3103 CZ PHE B 157 15.141 12.737 10.344 1.00 14.45 C ATOM 0 H PHE B 157 10.433 16.511 7.374 1.00 17.57 H new ATOM 0 HA PHE B 157 12.441 16.771 8.999 1.00 17.12 H new ATOM 0 HB2 PHE B 157 11.094 14.964 9.410 1.00 15.69 H new ATOM 0 HB3 PHE B 157 11.384 14.358 8.002 1.00 15.69 H new ATOM 0 HD1 PHE B 157 13.169 15.228 10.953 1.00 14.06 H new ATOM 0 HD2 PHE B 157 13.103 12.708 7.822 1.00 14.47 H new ATOM 0 HE1 PHE B 157 14.984 14.122 11.809 1.00 14.31 H new ATOM 0 HE2 PHE B 157 14.931 11.592 8.696 1.00 14.70 H new ATOM 0 HZ PHE B 157 15.873 12.286 10.697 1.00 14.45 H new ATOM 3104 N GLN B 158 14.556 16.390 7.859 1.00 19.65 N ATOM 3105 CA GLN B 158 15.818 16.190 7.184 1.00 20.96 C ATOM 3106 C GLN B 158 16.776 15.509 8.151 1.00 19.85 C ATOM 3107 O GLN B 158 17.011 15.992 9.266 1.00 18.85 O ATOM 3108 CB GLN B 158 16.369 17.546 6.729 1.00 25.46 C ATOM 3109 CG GLN B 158 17.502 17.465 5.719 1.00 29.78 C ATOM 3110 CD GLN B 158 18.101 18.824 5.389 1.00 32.79 C ATOM 3111 OE1 GLN B 158 17.428 19.858 5.481 1.00 36.47 O ATOM 3112 NE2 GLN B 158 19.379 18.829 5.000 1.00 33.41 N ATOM 0 H GLN B 158 14.632 16.710 8.654 1.00 19.65 H new ATOM 0 HA GLN B 158 15.706 15.630 6.400 1.00 20.96 H new ATOM 0 HB2 GLN B 158 15.644 18.063 6.343 1.00 25.46 H new ATOM 0 HB3 GLN B 158 16.681 18.033 7.508 1.00 25.46 H new ATOM 0 HG2 GLN B 158 18.198 16.886 6.067 1.00 29.78 H new ATOM 0 HG3 GLN B 158 17.173 17.055 4.904 1.00 29.78 H new ATOM 0 HE21 GLN B 158 19.815 18.090 4.948 1.00 33.41 H new ATOM 0 HE22 GLN B 158 19.765 19.571 4.802 1.00 33.41 H new ATOM 3113 N GLU B 159 17.330 14.373 7.740 1.00 19.01 N ATOM 3114 CA GLU B 159 18.382 13.747 8.520 1.00 19.37 C ATOM 3115 C GLU B 159 19.469 14.794 8.824 1.00 19.15 C ATOM 3116 O GLU B 159 19.865 15.563 7.941 1.00 19.42 O ATOM 3117 CB GLU B 159 18.960 12.538 7.767 1.00 21.20 C ATOM 3118 CG GLU B 159 20.153 11.894 8.444 1.00 22.96 C ATOM 3119 CD GLU B 159 20.630 10.609 7.782 1.00 24.03 C ATOM 3120 OE1 GLU B 159 20.070 10.191 6.735 1.00 26.47 O ATOM 3121 OE2 GLU B 159 21.583 10.018 8.329 1.00 24.61 O ATOM 0 H GLU B 159 17.112 13.955 7.021 1.00 19.01 H new ATOM 0 HA GLU B 159 18.021 13.419 9.358 1.00 19.37 H new ATOM 0 HB2 GLU B 159 18.263 11.872 7.662 1.00 21.20 H new ATOM 0 HB3 GLU B 159 19.220 12.819 6.876 1.00 21.20 H new ATOM 0 HG2 GLU B 159 20.886 12.530 8.458 1.00 22.96 H new ATOM 0 HG3 GLU B 159 19.924 11.704 9.367 1.00 22.96 H new ATOM 3122 N ASN B 160 19.923 14.845 10.068 1.00 17.96 N ATOM 3123 CA ASN B 160 20.985 15.787 10.451 1.00 18.02 C ATOM 3124 C ASN B 160 21.985 15.181 11.436 1.00 18.27 C ATOM 3125 O ASN B 160 21.964 13.979 11.691 1.00 18.00 O ATOM 3126 CB ASN B 160 20.400 17.122 10.942 1.00 18.56 C ATOM 3127 CG ASN B 160 19.505 16.970 12.156 1.00 18.23 C ATOM 3128 OD1 ASN B 160 19.777 16.190 13.060 1.00 17.72 O ATOM 3129 ND2 ASN B 160 18.453 17.769 12.197 1.00 20.10 N ATOM 0 H ASN B 160 19.636 14.348 10.708 1.00 17.96 H new ATOM 0 HA ASN B 160 21.496 15.980 9.650 1.00 18.02 H new ATOM 0 HB2 ASN B 160 21.127 17.728 11.157 1.00 18.56 H new ATOM 0 HB3 ASN B 160 19.893 17.531 10.223 1.00 18.56 H new ATOM 0 HD21 ASN B 160 17.928 17.754 12.878 1.00 20.10 H new ATOM 0 HD22 ASN B 160 18.294 18.304 11.543 1.00 20.10 H new ATOM 3130 N GLN B 161 22.889 15.997 11.969 1.00 19.94 N ATOM 3131 CA GLN B 161 23.953 15.480 12.828 1.00 21.37 C ATOM 3132 C GLN B 161 23.438 14.869 14.134 1.00 19.65 C ATOM 3133 O GLN B 161 24.127 14.080 14.777 1.00 19.46 O ATOM 3134 CB GLN B 161 24.977 16.576 13.139 1.00 24.62 C ATOM 3135 CG GLN B 161 25.680 17.148 11.912 1.00 29.27 C ATOM 3136 CD GLN B 161 26.922 16.377 11.497 1.00 31.53 C ATOM 3137 OE1 GLN B 161 27.279 15.355 12.093 1.00 33.96 O ATOM 3138 NE2 GLN B 161 27.592 16.871 10.459 1.00 33.57 N ATOM 0 H GLN B 161 22.906 16.848 11.848 1.00 19.94 H new ATOM 0 HA GLN B 161 24.376 14.764 12.328 1.00 21.37 H new ATOM 0 HB2 GLN B 161 24.530 17.298 13.608 1.00 24.62 H new ATOM 0 HB3 GLN B 161 25.646 16.217 13.743 1.00 24.62 H new ATOM 0 HG2 GLN B 161 25.056 17.161 11.170 1.00 29.27 H new ATOM 0 HG3 GLN B 161 25.927 18.069 12.092 1.00 29.27 H new ATOM 0 HE21 GLN B 161 27.314 17.585 10.068 1.00 33.57 H new ATOM 0 HE22 GLN B 161 28.303 16.476 10.179 1.00 33.57 H new ATOM 3139 N GLU B 162 22.224 15.245 14.514 1.00 18.86 N ATOM 3140 CA GLU B 162 21.607 14.689 15.706 1.00 18.14 C ATOM 3141 C GLU B 162 20.678 13.497 15.431 1.00 15.62 C ATOM 3142 O GLU B 162 20.748 12.494 16.131 1.00 15.01 O ATOM 3143 CB GLU B 162 20.835 15.760 16.449 1.00 21.32 C ATOM 3144 CG GLU B 162 20.456 15.313 17.841 1.00 24.01 C ATOM 3145 CD GLU B 162 19.919 16.439 18.689 1.00 26.51 C ATOM 3146 OE1 GLU B 162 19.565 17.510 18.128 1.00 28.19 O ATOM 3147 OE2 GLU B 162 19.838 16.226 19.920 1.00 28.61 O ATOM 0 H GLU B 162 21.742 15.821 14.095 1.00 18.86 H new ATOM 0 HA GLU B 162 22.340 14.356 16.247 1.00 18.14 H new ATOM 0 HB2 GLU B 162 21.371 16.567 16.503 1.00 21.32 H new ATOM 0 HB3 GLU B 162 20.033 15.985 15.952 1.00 21.32 H new ATOM 0 HG2 GLU B 162 19.788 14.612 17.781 1.00 24.01 H new ATOM 0 HG3 GLU B 162 21.233 14.928 18.276 1.00 24.01 H new ATOM 3148 N ILE B 163 19.825 13.641 14.423 1.00 14.52 N ATOM 3149 CA ILE B 163 18.715 12.697 14.198 1.00 13.42 C ATOM 3150 C ILE B 163 18.857 11.990 12.857 1.00 12.76 C ATOM 3151 O ILE B 163 18.916 12.638 11.816 1.00 12.98 O ATOM 3152 CB ILE B 163 17.355 13.427 14.228 1.00 13.09 C ATOM 3153 CG1 ILE B 163 17.154 14.186 15.559 1.00 13.67 C ATOM 3154 CG2 ILE B 163 16.212 12.446 13.972 1.00 12.60 C ATOM 3155 CD1 ILE B 163 17.263 13.325 16.803 1.00 13.81 C ATOM 0 H ILE B 163 19.866 14.281 13.850 1.00 14.52 H new ATOM 0 HA ILE B 163 18.750 12.042 14.913 1.00 13.42 H new ATOM 0 HB ILE B 163 17.352 14.086 13.516 1.00 13.09 H new ATOM 0 HG12 ILE B 163 17.812 14.897 15.614 1.00 13.67 H new ATOM 0 HG13 ILE B 163 16.281 14.608 15.548 1.00 13.67 H new ATOM 0 HG21 ILE B 163 15.367 12.921 13.994 1.00 12.60 H new ATOM 0 HG22 ILE B 163 16.328 12.034 13.102 1.00 12.60 H new ATOM 0 HG23 ILE B 163 16.215 11.759 14.657 1.00 12.60 H new ATOM 0 HD11 ILE B 163 17.125 13.875 17.590 1.00 13.81 H new ATOM 0 HD12 ILE B 163 16.590 12.628 16.774 1.00 13.81 H new ATOM 0 HD13 ILE B 163 18.144 12.921 16.841 1.00 13.81 H new ATOM 3156 N ALA B 164 18.856 10.661 12.922 1.00 12.39 N ATOM 3157 CA ALA B 164 18.910 9.807 11.738 1.00 12.74 C ATOM 3158 C ALA B 164 17.559 9.565 11.094 1.00 12.56 C ATOM 3159 O ALA B 164 17.484 9.403 9.888 1.00 13.41 O ATOM 3160 CB ALA B 164 19.555 8.489 12.078 1.00 13.04 C ATOM 0 H ALA B 164 18.824 10.225 13.663 1.00 12.39 H new ATOM 0 HA ALA B 164 19.443 10.287 11.086 1.00 12.74 H new ATOM 0 HB1 ALA B 164 19.586 7.930 11.286 1.00 13.04 H new ATOM 0 HB2 ALA B 164 20.457 8.643 12.400 1.00 13.04 H new ATOM 0 HB3 ALA B 164 19.038 8.044 12.767 1.00 13.04 H new ATOM 3161 N ASP B 165 16.485 9.515 11.892 1.00 11.94 N ATOM 3162 CA ASP B 165 15.172 9.175 11.344 1.00 11.43 C ATOM 3163 C ASP B 165 14.060 9.676 12.271 1.00 10.73 C ATOM 3164 O ASP B 165 14.279 9.891 13.476 1.00 10.82 O ATOM 3165 CB ASP B 165 15.057 7.645 11.112 1.00 11.14 C ATOM 3166 CG ASP B 165 14.001 7.266 10.074 1.00 10.84 C ATOM 3167 OD1 ASP B 165 13.320 8.113 9.480 1.00 11.19 O ATOM 3168 OD2 ASP B 165 13.855 6.047 9.873 1.00 11.97 O ATOM 0 H ASP B 165 16.497 9.672 12.737 1.00 11.94 H new ATOM 0 HA ASP B 165 15.071 9.616 10.486 1.00 11.43 H new ATOM 0 HB2 ASP B 165 15.919 7.302 10.827 1.00 11.14 H new ATOM 0 HB3 ASP B 165 14.844 7.212 11.953 1.00 11.14 H new ATOM 3169 N LEU B 166 12.889 9.871 11.675 1.00 10.19 N ATOM 3170 CA LEU B 166 11.683 10.301 12.389 1.00 10.07 C ATOM 3171 C LEU B 166 10.541 9.503 11.788 1.00 9.96 C ATOM 3172 O LEU B 166 10.341 9.538 10.581 1.00 10.00 O ATOM 3173 CB LEU B 166 11.436 11.802 12.160 1.00 10.77 C ATOM 3174 CG LEU B 166 10.169 12.416 12.772 1.00 11.03 C ATOM 3175 CD1 LEU B 166 10.392 13.904 12.968 1.00 11.95 C ATOM 3176 CD2 LEU B 166 8.922 12.189 11.923 1.00 11.85 C ATOM 0 H LEU B 166 12.767 9.756 10.831 1.00 10.19 H new ATOM 0 HA LEU B 166 11.767 10.156 13.344 1.00 10.07 H new ATOM 0 HB2 LEU B 166 12.201 12.287 12.507 1.00 10.77 H new ATOM 0 HB3 LEU B 166 11.412 11.958 11.203 1.00 10.77 H new ATOM 0 HG LEU B 166 10.010 11.973 13.620 1.00 11.03 H new ATOM 0 HD11 LEU B 166 9.597 14.302 13.355 1.00 11.95 H new ATOM 0 HD12 LEU B 166 11.145 14.043 13.564 1.00 11.95 H new ATOM 0 HD13 LEU B 166 10.577 14.319 12.111 1.00 11.95 H new ATOM 0 HD21 LEU B 166 8.156 12.597 12.357 1.00 11.85 H new ATOM 0 HD22 LEU B 166 9.049 12.589 11.048 1.00 11.85 H new ATOM 0 HD23 LEU B 166 8.767 11.237 11.823 1.00 11.85 H new ATOM 3177 N GLN B 167 9.762 8.838 12.629 1.00 10.03 N ATOM 3178 CA GLN B 167 8.648 8.008 12.145 1.00 10.54 C ATOM 3179 C GLN B 167 7.534 8.034 13.172 1.00 10.41 C ATOM 3180 O GLN B 167 7.746 8.396 14.338 1.00 10.40 O ATOM 3181 CB GLN B 167 9.096 6.553 11.902 1.00 11.08 C ATOM 3182 CG GLN B 167 10.162 6.355 10.820 1.00 11.83 C ATOM 3183 CD GLN B 167 9.697 6.686 9.402 1.00 12.08 C ATOM 3184 OE1 GLN B 167 8.548 6.447 9.028 1.00 14.17 O ATOM 3185 NE2 GLN B 167 10.614 7.187 8.591 1.00 12.69 N ATOM 0 H GLN B 167 9.855 8.849 13.484 1.00 10.03 H new ATOM 0 HA GLN B 167 8.337 8.369 11.300 1.00 10.54 H new ATOM 0 HB2 GLN B 167 9.436 6.194 12.736 1.00 11.08 H new ATOM 0 HB3 GLN B 167 8.316 6.028 11.664 1.00 11.08 H new ATOM 0 HG2 GLN B 167 10.930 6.908 11.034 1.00 11.83 H new ATOM 0 HG3 GLN B 167 10.462 5.433 10.843 1.00 11.83 H new ATOM 0 HE21 GLN B 167 11.408 7.343 8.883 1.00 12.69 H new ATOM 0 HE22 GLN B 167 10.416 7.357 7.771 1.00 12.69 H new ATOM 3186 N PHE B 168 6.341 7.638 12.747 1.00 10.17 N ATOM 3187 CA PHE B 168 5.185 7.535 13.635 1.00 10.45 C ATOM 3188 C PHE B 168 4.864 6.079 13.899 1.00 10.84 C ATOM 3189 O PHE B 168 4.842 5.272 12.963 1.00 10.74 O ATOM 3190 CB PHE B 168 4.002 8.267 13.020 1.00 10.96 C ATOM 3191 CG PHE B 168 4.089 9.756 13.152 1.00 10.98 C ATOM 3192 CD1 PHE B 168 4.860 10.516 12.272 1.00 11.42 C ATOM 3193 CD2 PHE B 168 3.388 10.412 14.159 1.00 11.25 C ATOM 3194 CE1 PHE B 168 4.937 11.896 12.419 1.00 11.77 C ATOM 3195 CE2 PHE B 168 3.459 11.783 14.296 1.00 11.72 C ATOM 3196 CZ PHE B 168 4.229 12.529 13.431 1.00 11.57 C ATOM 0 H PHE B 168 6.176 7.420 11.932 1.00 10.17 H new ATOM 0 HA PHE B 168 5.387 7.952 14.487 1.00 10.45 H new ATOM 0 HB2 PHE B 168 3.940 8.036 12.080 1.00 10.96 H new ATOM 0 HB3 PHE B 168 3.185 7.959 13.442 1.00 10.96 H new ATOM 0 HD1 PHE B 168 5.325 10.097 11.584 1.00 11.42 H new ATOM 0 HD2 PHE B 168 2.864 9.919 14.748 1.00 11.25 H new ATOM 0 HE1 PHE B 168 5.464 12.396 11.838 1.00 11.77 H new ATOM 0 HE2 PHE B 168 2.985 12.205 14.975 1.00 11.72 H new ATOM 0 HZ PHE B 168 4.274 13.453 13.525 1.00 11.57 H new ATOM 3197 N PHE B 169 4.563 5.755 15.154 1.00 10.53 N ATOM 3198 CA PHE B 169 4.359 4.367 15.580 1.00 10.50 C ATOM 3199 C PHE B 169 3.071 4.200 16.362 1.00 11.55 C ATOM 3200 O PHE B 169 2.748 5.015 17.238 1.00 11.12 O ATOM 3201 CB PHE B 169 5.526 3.899 16.443 1.00 10.44 C ATOM 3202 CG PHE B 169 6.836 3.855 15.711 1.00 10.63 C ATOM 3203 CD1 PHE B 169 7.207 2.712 15.011 1.00 10.61 C ATOM 3204 CD2 PHE B 169 7.699 4.939 15.725 1.00 10.88 C ATOM 3205 CE1 PHE B 169 8.413 2.662 14.336 1.00 11.11 C ATOM 3206 CE2 PHE B 169 8.902 4.900 15.039 1.00 11.17 C ATOM 3207 CZ PHE B 169 9.265 3.753 14.343 1.00 10.75 C ATOM 0 H PHE B 169 4.471 6.332 15.785 1.00 10.53 H new ATOM 0 HA PHE B 169 4.303 3.828 14.775 1.00 10.50 H new ATOM 0 HB2 PHE B 169 5.611 4.491 17.207 1.00 10.44 H new ATOM 0 HB3 PHE B 169 5.328 3.015 16.789 1.00 10.44 H new ATOM 0 HD1 PHE B 169 6.640 1.975 14.997 1.00 10.61 H new ATOM 0 HD2 PHE B 169 7.467 5.703 16.202 1.00 10.88 H new ATOM 0 HE1 PHE B 169 8.653 1.891 13.875 1.00 11.11 H new ATOM 0 HE2 PHE B 169 9.466 5.640 15.044 1.00 11.17 H new ATOM 0 HZ PHE B 169 10.074 3.719 13.886 1.00 10.75 H new ATOM 3208 N ALA B 170 2.356 3.117 16.086 1.00 12.21 N ATOM 3209 CA ALA B 170 1.197 2.788 16.898 1.00 13.28 C ATOM 3210 C ALA B 170 1.688 2.347 18.273 1.00 13.95 C ATOM 3211 O ALA B 170 2.762 1.766 18.403 1.00 13.27 O ATOM 3212 CB ALA B 170 0.394 1.677 16.237 1.00 13.83 C ATOM 0 H ALA B 170 2.522 2.569 15.444 1.00 12.21 H new ATOM 0 HA ALA B 170 0.619 3.562 16.988 1.00 13.28 H new ATOM 0 HB1 ALA B 170 -0.377 1.464 16.786 1.00 13.83 H new ATOM 0 HB2 ALA B 170 0.096 1.970 15.361 1.00 13.83 H new ATOM 0 HB3 ALA B 170 0.950 0.888 16.142 1.00 13.83 H new ATOM 3213 N AILE B 171 0.921 2.611 19.323 0.50 15.02 N ATOM 3214 N BILE B 171 0.849 2.607 19.280 0.50 15.84 N ATOM 3215 CA AILE B 171 1.414 2.220 20.644 0.50 15.96 C ATOM 3216 CA BILE B 171 1.132 2.255 20.675 0.50 17.59 C ATOM 3217 C AILE B 171 1.473 0.702 20.839 0.50 16.55 C ATOM 3218 C BILE B 171 1.335 0.755 20.896 0.50 17.60 C ATOM 3219 O AILE B 171 2.257 0.217 21.658 0.50 16.49 O ATOM 3220 O BILE B 171 2.058 0.344 21.805 0.50 18.31 O ATOM 3221 CB AILE B 171 0.709 2.965 21.795 0.50 15.75 C ATOM 3222 CB BILE B 171 0.034 2.785 21.629 0.50 18.56 C ATOM 3223 CG1AILE B 171 1.126 4.437 21.772 0.50 15.90 C ATOM 3224 CG1BILE B 171 -1.299 2.069 21.401 0.50 19.75 C ATOM 3225 CG2AILE B 171 1.078 2.366 23.146 0.50 15.64 C ATOM 3226 CG2BILE B 171 -0.132 4.291 21.471 0.50 18.83 C ATOM 3227 CD1AILE B 171 0.351 5.307 22.730 0.50 16.15 C ATOM 3228 CD1BILE B 171 -2.450 2.629 22.217 0.50 21.11 C ATOM 0 H AILE B 171 0.152 2.995 19.302 0.50 15.84 H new ATOM 0 H BILE B 171 0.091 2.997 19.170 0.50 15.84 H new ATOM 0 HA AILE B 171 2.338 2.514 20.679 0.50 17.59 H new ATOM 0 HA BILE B 171 1.973 2.690 20.883 0.50 17.59 H new ATOM 0 HB AILE B 171 -0.249 2.881 21.671 0.50 18.56 H new ATOM 0 HB BILE B 171 0.317 2.598 22.538 0.50 18.56 H new ATOM 0 HG12AILE B 171 2.071 4.500 21.984 0.50 19.75 H new ATOM 0 HG12BILE B 171 -1.527 2.122 20.460 0.50 19.75 H new ATOM 0 HG13AILE B 171 1.013 4.782 20.872 0.50 19.75 H new ATOM 0 HG13BILE B 171 -1.191 1.129 21.614 0.50 19.75 H new ATOM 0 HG21AILE B 171 0.622 2.852 23.851 0.50 18.83 H new ATOM 0 HG21BILE B 171 -0.823 4.606 22.075 0.50 18.83 H new ATOM 0 HG22AILE B 171 0.810 1.434 23.171 0.50 18.83 H new ATOM 0 HG22BILE B 171 0.706 4.733 21.680 0.50 18.83 H new ATOM 0 HG23AILE B 171 2.037 2.430 23.278 0.50 18.83 H new ATOM 0 HG23BILE B 171 -0.385 4.495 20.557 0.50 18.83 H new ATOM 0 HD11AILE B 171 0.666 6.222 22.663 0.50 21.11 H new ATOM 0 HD11BILE B 171 -3.258 2.129 22.022 0.50 21.11 H new ATOM 0 HD12AILE B 171 -0.593 5.273 22.508 0.50 21.11 H new ATOM 0 HD12BILE B 171 -2.244 2.554 23.162 0.50 21.11 H new ATOM 0 HD13AILE B 171 0.481 4.986 23.636 0.50 21.11 H new ATOM 0 HD13BILE B 171 -2.585 3.562 21.989 0.50 21.11 H new ATOM 3229 N ASP B 172 0.710 -0.053 20.043 1.00 17.56 N ATOM 3230 CA ASP B 172 0.833 -1.514 20.073 1.00 18.63 C ATOM 3231 C ASP B 172 1.901 -2.064 19.107 1.00 18.32 C ATOM 3232 O ASP B 172 2.069 -3.276 18.970 1.00 19.52 O ATOM 3233 CB ASP B 172 -0.534 -2.186 19.854 1.00 19.75 C ATOM 3234 CG ASP B 172 -1.103 -1.955 18.461 1.00 22.59 C ATOM 3235 OD1 ASP B 172 -0.533 -1.181 17.677 1.00 22.02 O ATOM 3236 OD2 ASP B 172 -2.157 -2.562 18.138 1.00 24.77 O ATOM 0 H AASP B 172 0.127 0.253 19.490 0.50 17.56 H new ATOM 0 H BASP B 172 0.193 0.235 19.419 0.50 17.56 H new ATOM 0 HA ASP B 172 1.147 -1.742 20.962 1.00 18.63 H new ATOM 0 HB2 ASP B 172 -0.446 -3.140 20.007 1.00 19.75 H new ATOM 0 HB3 ASP B 172 -1.162 -1.850 20.513 1.00 19.75 H new ATOM 3237 N GLN B 173 2.636 -1.167 18.446 1.00 16.81 N ATOM 3238 CA GLN B 173 3.720 -1.552 17.546 1.00 16.85 C ATOM 3239 C GLN B 173 4.949 -0.687 17.788 1.00 14.98 C ATOM 3240 O GLN B 173 5.635 -0.288 16.850 1.00 15.56 O ATOM 3241 CB GLN B 173 3.320 -1.375 16.076 1.00 18.10 C ATOM 3242 CG GLN B 173 2.166 -2.226 15.569 1.00 20.13 C ATOM 3243 CD GLN B 173 1.839 -1.981 14.096 1.00 20.69 C ATOM 3244 OE1 GLN B 173 2.020 -0.878 13.561 1.00 21.79 O ATOM 3245 NE2 GLN B 173 1.330 -3.018 13.432 1.00 20.72 N ATOM 0 H GLN B 173 2.518 -0.317 18.509 1.00 16.81 H new ATOM 0 HA GLN B 173 3.913 -2.485 17.727 1.00 16.85 H new ATOM 0 HB2 GLN B 173 3.092 -0.443 15.935 1.00 18.10 H new ATOM 0 HB3 GLN B 173 4.097 -1.563 15.527 1.00 18.10 H new ATOM 0 HG2 GLN B 173 2.383 -3.163 15.695 1.00 20.13 H new ATOM 0 HG3 GLN B 173 1.378 -2.043 16.104 1.00 20.13 H new ATOM 0 HE21 GLN B 173 1.217 -3.771 13.832 1.00 20.72 H new ATOM 0 HE22 GLN B 173 1.115 -2.934 12.604 1.00 20.72 H new ATOM 3246 N LEU B 174 5.249 -0.399 19.047 1.00 14.13 N ATOM 3247 CA LEU B 174 6.416 0.442 19.332 1.00 13.28 C ATOM 3248 C LEU B 174 7.721 -0.232 18.920 1.00 13.13 C ATOM 3249 O LEU B 174 7.852 -1.467 19.008 1.00 13.45 O ATOM 3250 CB LEU B 174 6.465 0.832 20.806 1.00 13.44 C ATOM 3251 CG LEU B 174 5.307 1.676 21.323 1.00 13.17 C ATOM 3252 CD1 LEU B 174 5.368 1.738 22.838 1.00 14.24 C ATOM 3253 CD2 LEU B 174 5.300 3.081 20.737 1.00 13.30 C ATOM 0 H LEU B 174 4.809 -0.668 19.735 1.00 14.13 H new ATOM 0 HA LEU B 174 6.319 1.247 18.800 1.00 13.28 H new ATOM 0 HB2 LEU B 174 6.508 0.019 21.334 1.00 13.44 H new ATOM 0 HB3 LEU B 174 7.290 1.318 20.965 1.00 13.44 H new ATOM 0 HG LEU B 174 4.482 1.251 21.039 1.00 13.17 H new ATOM 0 HD11 LEU B 174 4.632 2.275 23.170 1.00 14.24 H new ATOM 0 HD12 LEU B 174 5.303 0.841 23.202 1.00 14.24 H new ATOM 0 HD13 LEU B 174 6.208 2.138 23.112 1.00 14.24 H new ATOM 0 HD21 LEU B 174 4.547 3.577 21.095 1.00 13.30 H new ATOM 0 HD22 LEU B 174 6.126 3.533 20.971 1.00 13.30 H new ATOM 0 HD23 LEU B 174 5.222 3.029 19.772 1.00 13.30 H new ATOM 3254 N PRO B 175 8.694 0.567 18.452 1.00 12.20 N ATOM 3255 CA PRO B 175 10.001 0.037 18.134 1.00 12.28 C ATOM 3256 C PRO B 175 10.832 -0.095 19.419 1.00 12.11 C ATOM 3257 O PRO B 175 10.331 0.140 20.526 1.00 12.33 O ATOM 3258 CB PRO B 175 10.583 1.124 17.235 1.00 12.03 C ATOM 3259 CG PRO B 175 10.046 2.382 17.838 1.00 12.04 C ATOM 3260 CD PRO B 175 8.645 2.032 18.252 1.00 12.16 C ATOM 0 HA PRO B 175 9.985 -0.841 17.721 1.00 12.28 H new ATOM 0 HB2 PRO B 175 11.553 1.110 17.237 1.00 12.03 H new ATOM 0 HB3 PRO B 175 10.299 1.018 16.313 1.00 12.03 H new ATOM 0 HG2 PRO B 175 10.579 2.665 18.598 1.00 12.04 H new ATOM 0 HG3 PRO B 175 10.054 3.112 17.199 1.00 12.04 H new ATOM 0 HD2 PRO B 175 8.388 2.494 19.065 1.00 12.16 H new ATOM 0 HD3 PRO B 175 8.000 2.277 17.570 1.00 12.16 H new ATOM 3261 N ASN B 176 12.101 -0.442 19.265 1.00 12.78 N ATOM 3262 CA ASN B 176 13.034 -0.503 20.380 1.00 13.67 C ATOM 3263 C ASN B 176 13.177 0.907 20.971 1.00 12.17 C ATOM 3264 O ASN B 176 13.616 1.823 20.295 1.00 12.99 O ATOM 3265 CB ASN B 176 14.383 -1.001 19.841 1.00 15.96 C ATOM 3266 CG ASN B 176 15.466 -1.075 20.893 1.00 17.80 C ATOM 3267 OD1 ASN B 176 15.248 -1.555 22.005 1.00 21.56 O ATOM 3268 ND2 ASN B 176 16.662 -0.626 20.527 1.00 20.77 N ATOM 0 H ASN B 176 12.448 -0.650 18.506 1.00 12.78 H new ATOM 0 HA ASN B 176 12.721 -1.105 21.073 1.00 13.67 H new ATOM 0 HB2 ASN B 176 14.262 -1.881 19.450 1.00 15.96 H new ATOM 0 HB3 ASN B 176 14.675 -0.412 19.128 1.00 15.96 H new ATOM 0 HD21 ASN B 176 17.322 -0.664 21.077 1.00 20.77 H new ATOM 0 HD22 ASN B 176 16.776 -0.297 19.741 1.00 20.77 H new ATOM 3269 N LEU B 177 12.816 1.056 22.238 1.00 11.49 N ATOM 3270 CA LEU B 177 12.874 2.373 22.886 1.00 11.28 C ATOM 3271 C LEU B 177 14.218 2.627 23.566 1.00 10.80 C ATOM 3272 O LEU B 177 14.834 1.722 24.100 1.00 10.78 O ATOM 3273 CB LEU B 177 11.752 2.467 23.926 1.00 11.59 C ATOM 3274 CG LEU B 177 10.310 2.429 23.413 1.00 12.02 C ATOM 3275 CD1 LEU B 177 9.337 2.541 24.580 1.00 12.58 C ATOM 3276 CD2 LEU B 177 10.042 3.521 22.397 1.00 13.32 C ATOM 0 H LEU B 177 12.536 0.418 22.742 1.00 11.49 H new ATOM 0 HA LEU B 177 12.765 3.048 22.198 1.00 11.28 H new ATOM 0 HB2 LEU B 177 11.865 1.738 24.556 1.00 11.59 H new ATOM 0 HB3 LEU B 177 11.872 3.292 24.422 1.00 11.59 H new ATOM 0 HG LEU B 177 10.179 1.578 22.966 1.00 12.02 H new ATOM 0 HD11 LEU B 177 8.427 2.516 24.246 1.00 12.58 H new ATOM 0 HD12 LEU B 177 9.477 1.801 25.191 1.00 12.58 H new ATOM 0 HD13 LEU B 177 9.487 3.378 25.047 1.00 12.58 H new ATOM 0 HD21 LEU B 177 9.121 3.465 22.096 1.00 13.32 H new ATOM 0 HD22 LEU B 177 10.196 4.388 22.805 1.00 13.32 H new ATOM 0 HD23 LEU B 177 10.637 3.411 21.639 1.00 13.32 H new ATOM 3277 N SER B 178 14.661 3.882 23.541 1.00 10.52 N ATOM 3278 CA SER B 178 15.792 4.323 24.353 1.00 10.40 C ATOM 3279 C SER B 178 15.217 4.585 25.743 1.00 10.22 C ATOM 3280 O SER B 178 14.685 5.687 26.019 1.00 9.38 O ATOM 3281 CB SER B 178 16.357 5.587 23.737 1.00 11.42 C ATOM 3282 OG SER B 178 17.402 6.105 24.545 1.00 12.76 O ATOM 0 H SER B 178 14.315 4.500 23.054 1.00 10.52 H new ATOM 0 HA SER B 178 16.511 3.673 24.401 1.00 10.40 H new ATOM 0 HB2 SER B 178 16.692 5.398 22.846 1.00 11.42 H new ATOM 0 HB3 SER B 178 15.655 6.249 23.642 1.00 11.42 H new ATOM 0 HG SER B 178 17.544 5.583 25.188 1.00 12.76 H new ATOM 3283 N AGLU B 179 15.307 3.572 26.601 0.50 10.56 N ATOM 3284 N BGLU B 179 15.314 3.601 26.622 0.50 10.43 N ATOM 3285 CA AGLU B 179 14.659 3.564 27.918 0.50 11.00 C ATOM 3286 CA BGLU B 179 14.594 3.657 27.893 0.50 10.81 C ATOM 3287 C AGLU B 179 15.072 4.751 28.786 0.50 10.57 C ATOM 3288 C BGLU B 179 15.096 4.701 28.871 0.50 10.54 C ATOM 3289 O AGLU B 179 14.251 5.305 29.524 0.50 10.02 O ATOM 3290 O BGLU B 179 14.345 5.118 29.762 0.50 10.09 O ATOM 3291 CB AGLU B 179 14.938 2.242 28.653 0.50 12.11 C ATOM 3292 CB BGLU B 179 14.508 2.272 28.522 0.50 11.65 C ATOM 3293 CG AGLU B 179 14.454 0.992 27.928 0.50 13.96 C ATOM 3294 CG BGLU B 179 13.634 1.381 27.660 0.50 12.87 C ATOM 3295 CD AGLU B 179 13.005 0.679 28.207 0.50 15.19 C ATOM 3296 CD BGLU B 179 13.708 -0.083 28.005 0.50 14.78 C ATOM 3297 OE1AGLU B 179 12.148 1.498 27.828 0.50 17.43 O ATOM 3298 OE1BGLU B 179 14.293 -0.445 29.041 0.50 16.65 O ATOM 3299 OE2AGLU B 179 12.714 -0.391 28.791 0.50 16.10 O ATOM 3300 OE2BGLU B 179 13.166 -0.869 27.205 0.50 17.01 O ATOM 0 H AGLU B 179 15.753 2.856 26.434 0.50 10.43 H new ATOM 0 H BGLU B 179 15.788 2.893 26.507 0.50 10.43 H new ATOM 0 HA AGLU B 179 13.706 3.646 27.759 0.50 10.81 H new ATOM 0 HA BGLU B 179 13.699 3.959 27.673 0.50 10.81 H new ATOM 0 HB2AGLU B 179 15.893 2.165 28.801 0.50 11.65 H new ATOM 0 HB2BGLU B 179 15.395 1.888 28.606 0.50 11.65 H new ATOM 0 HB3AGLU B 179 14.517 2.277 29.526 0.50 11.65 H new ATOM 0 HB3BGLU B 179 14.140 2.335 29.417 0.50 11.65 H new ATOM 0 HG2AGLU B 179 14.577 1.109 26.973 0.50 12.87 H new ATOM 0 HG2BGLU B 179 12.713 1.675 27.740 0.50 12.87 H new ATOM 0 HG3AGLU B 179 15.001 0.236 28.194 0.50 12.87 H new ATOM 0 HG3BGLU B 179 13.889 1.497 26.731 0.50 12.87 H new ATOM 3301 N LYS B 180 16.334 5.151 28.692 1.00 10.77 N ATOM 3302 CA LYS B 180 16.835 6.253 29.497 1.00 10.83 C ATOM 3303 C LYS B 180 16.146 7.550 29.144 1.00 10.30 C ATOM 3304 O LYS B 180 16.123 8.480 29.957 1.00 10.07 O ATOM 3305 CB LYS B 180 18.347 6.374 29.356 1.00 13.08 C ATOM 3306 CG LYS B 180 19.056 5.286 30.128 1.00 16.21 C ATOM 3307 CD LYS B 180 20.553 5.369 29.953 1.00 18.69 C ATOM 3308 CE LYS B 180 21.201 4.188 30.656 1.00 21.32 C ATOM 3309 NZ LYS B 180 22.678 4.310 30.530 1.00 24.10 N ATOM 0 H ALYS B 180 16.916 4.796 28.167 0.50 10.77 H new ATOM 0 H BLYS B 180 16.891 4.836 28.118 0.50 10.77 H new ATOM 0 HA LYS B 180 16.632 6.063 30.426 1.00 10.83 H new ATOM 0 HB2 LYS B 180 18.592 6.322 28.419 1.00 13.08 H new ATOM 0 HB3 LYS B 180 18.636 7.243 29.677 1.00 13.08 H new ATOM 0 HG2 LYS B 180 18.835 5.359 31.070 1.00 16.21 H new ATOM 0 HG3 LYS B 180 18.742 4.418 29.829 1.00 16.21 H new ATOM 0 HD2 LYS B 180 20.781 5.363 29.010 1.00 18.69 H new ATOM 0 HD3 LYS B 180 20.887 6.202 30.321 1.00 18.69 H new ATOM 0 HE2 LYS B 180 20.944 4.171 31.591 1.00 21.32 H new ATOM 0 HE3 LYS B 180 20.898 3.355 30.263 1.00 21.32 H new ATOM 0 HZ1 LYS B 180 23.071 3.681 31.022 1.00 24.10 H new ATOM 0 HZ2 LYS B 180 22.913 4.208 29.678 1.00 24.10 H new ATOM 0 HZ3 LYS B 180 22.935 5.113 30.814 1.00 24.10 H new ATOM 3310 N ARG B 181 15.555 7.598 27.943 1.00 9.08 N ATOM 3311 CA ARG B 181 14.843 8.784 27.463 1.00 9.15 C ATOM 3312 C ARG B 181 13.325 8.673 27.593 1.00 8.55 C ATOM 3313 O ARG B 181 12.657 9.659 27.912 1.00 8.64 O ATOM 3314 CB ARG B 181 15.191 9.058 26.006 1.00 9.49 C ATOM 3315 CG ARG B 181 16.649 9.466 25.803 1.00 10.88 C ATOM 3316 CD ARG B 181 16.956 9.676 24.339 1.00 13.25 C ATOM 3317 NE ARG B 181 18.339 10.105 24.079 1.00 15.19 N ATOM 3318 CZ ARG B 181 19.258 9.346 23.492 1.00 16.16 C ATOM 3319 NH1 ARG B 181 18.965 8.107 23.118 1.00 17.09 N ATOM 3320 NH2 ARG B 181 20.474 9.830 23.278 1.00 18.30 N ATOM 0 H ARG B 181 15.557 6.942 27.386 1.00 9.08 H new ATOM 0 HA ARG B 181 15.134 9.516 28.029 1.00 9.15 H new ATOM 0 HB2 ARG B 181 15.007 8.264 25.481 1.00 9.49 H new ATOM 0 HB3 ARG B 181 14.614 9.761 25.668 1.00 9.49 H new ATOM 0 HG2 ARG B 181 16.831 10.282 26.295 1.00 10.88 H new ATOM 0 HG3 ARG B 181 17.233 8.781 26.164 1.00 10.88 H new ATOM 0 HD2 ARG B 181 16.787 8.850 23.860 1.00 13.25 H new ATOM 0 HD3 ARG B 181 16.347 10.341 23.981 1.00 13.25 H new ATOM 0 HE ARG B 181 18.567 10.898 24.323 1.00 15.19 H new ATOM 0 HH11 ARG B 181 18.177 7.791 23.255 1.00 17.09 H new ATOM 0 HH12 ARG B 181 19.563 7.620 22.738 1.00 17.09 H new ATOM 0 HH21 ARG B 181 20.666 10.633 23.519 1.00 18.30 H new ATOM 0 HH22 ARG B 181 21.071 9.341 22.898 1.00 18.30 H new ATOM 3321 N ILE B 182 12.760 7.509 27.313 1.00 8.29 N ATOM 3322 CA ILE B 182 11.321 7.272 27.463 1.00 8.56 C ATOM 3323 C ILE B 182 11.092 5.775 27.533 1.00 8.70 C ATOM 3324 O ILE B 182 11.776 4.999 26.835 1.00 9.18 O ATOM 3325 CB ILE B 182 10.509 7.913 26.308 1.00 8.76 C ATOM 3326 CG1 ILE B 182 9.049 8.155 26.727 1.00 9.51 C ATOM 3327 CG2 ILE B 182 10.626 7.116 25.012 1.00 9.14 C ATOM 3328 CD1 ILE B 182 8.890 9.255 27.756 1.00 9.48 C ATOM 0 H ILE B 182 13.198 6.826 27.028 1.00 8.29 H new ATOM 0 HA ILE B 182 11.008 7.692 28.279 1.00 8.56 H new ATOM 0 HB ILE B 182 10.898 8.781 26.121 1.00 8.76 H new ATOM 0 HG12 ILE B 182 8.527 8.380 25.941 1.00 9.51 H new ATOM 0 HG13 ILE B 182 8.682 7.332 27.085 1.00 9.51 H new ATOM 0 HG21 ILE B 182 10.105 7.549 24.317 1.00 9.14 H new ATOM 0 HG22 ILE B 182 11.556 7.075 24.740 1.00 9.14 H new ATOM 0 HG23 ILE B 182 10.291 6.217 25.153 1.00 9.14 H new ATOM 0 HD11 ILE B 182 7.951 9.358 27.977 1.00 9.48 H new ATOM 0 HD12 ILE B 182 9.387 9.024 28.556 1.00 9.48 H new ATOM 0 HD13 ILE B 182 9.230 10.088 27.394 1.00 9.48 H new ATOM 3329 N THR B 183 10.155 5.372 28.391 1.00 8.86 N ATOM 3330 CA THR B 183 9.795 3.957 28.492 1.00 9.26 C ATOM 3331 C THR B 183 8.389 3.692 27.999 1.00 9.42 C ATOM 3332 O THR B 183 7.575 4.589 27.855 1.00 9.05 O ATOM 3333 CB THR B 183 9.901 3.414 29.927 1.00 9.49 C ATOM 3334 OG1 THR B 183 8.820 3.948 30.702 1.00 9.77 O ATOM 3335 CG2 THR B 183 11.244 3.796 30.566 1.00 10.22 C ATOM 0 H THR B 183 9.720 5.895 28.918 1.00 8.86 H new ATOM 0 HA THR B 183 10.438 3.498 27.929 1.00 9.26 H new ATOM 0 HB THR B 183 9.850 2.446 29.903 1.00 9.49 H new ATOM 0 HG1 THR B 183 9.115 4.235 31.434 1.00 9.77 H new ATOM 0 HG21 THR B 183 11.285 3.442 31.468 1.00 10.22 H new ATOM 0 HG22 THR B 183 11.970 3.425 30.040 1.00 10.22 H new ATOM 0 HG23 THR B 183 11.326 4.762 30.594 1.00 10.22 H new ATOM 3336 N LYS B 184 8.105 2.418 27.749 1.00 10.20 N ATOM 3337 CA LYS B 184 6.766 2.021 27.315 1.00 11.00 C ATOM 3338 C LYS B 184 5.738 2.398 28.379 1.00 10.56 C ATOM 3339 O LYS B 184 4.650 2.888 28.052 1.00 10.28 O ATOM 3340 CB LYS B 184 6.719 0.522 27.003 1.00 12.92 C ATOM 3341 CG LYS B 184 5.340 0.050 26.549 1.00 15.87 C ATOM 3342 CD LYS B 184 5.404 -1.370 26.017 1.00 19.34 C ATOM 3343 CE LYS B 184 4.061 -1.798 25.455 1.00 22.59 C ATOM 3344 NZ LYS B 184 4.198 -3.076 24.701 1.00 25.52 N ATOM 0 H LYS B 184 8.667 1.771 27.823 1.00 10.20 H new ATOM 0 HA LYS B 184 6.547 2.497 26.498 1.00 11.00 H new ATOM 0 HB2 LYS B 184 7.368 0.320 26.311 1.00 12.92 H new ATOM 0 HB3 LYS B 184 6.982 0.024 27.793 1.00 12.92 H new ATOM 0 HG2 LYS B 184 4.718 0.094 27.292 1.00 15.87 H new ATOM 0 HG3 LYS B 184 5.001 0.643 25.860 1.00 15.87 H new ATOM 0 HD2 LYS B 184 6.082 -1.430 25.326 1.00 19.34 H new ATOM 0 HD3 LYS B 184 5.669 -1.974 26.728 1.00 19.34 H new ATOM 0 HE2 LYS B 184 3.422 -1.908 26.176 1.00 22.59 H new ATOM 0 HE3 LYS B 184 3.713 -1.106 24.871 1.00 22.59 H new ATOM 0 HZ1 LYS B 184 3.473 -3.205 24.201 1.00 25.52 H new ATOM 0 HZ2 LYS B 184 4.916 -3.036 24.177 1.00 25.52 H new ATOM 0 HZ3 LYS B 184 4.286 -3.751 25.274 1.00 25.52 H new ATOM 3345 N AGLU B 185 6.076 2.184 29.646 0.50 10.22 N ATOM 3346 N BGLU B 185 6.087 2.187 29.642 0.50 10.38 N ATOM 3347 CA AGLU B 185 5.175 2.576 30.723 0.50 10.51 C ATOM 3348 CA BGLU B 185 5.205 2.558 30.740 0.50 10.78 C ATOM 3349 C AGLU B 185 4.820 4.068 30.653 0.50 9.71 C ATOM 3350 C BGLU B 185 4.846 4.060 30.741 0.50 9.93 C ATOM 3351 O AGLU B 185 3.651 4.445 30.745 0.50 9.78 O ATOM 3352 O BGLU B 185 3.699 4.435 30.975 0.50 10.03 O ATOM 3353 CB AGLU B 185 5.750 2.196 32.092 0.50 11.70 C ATOM 3354 CB BGLU B 185 5.810 2.101 32.072 0.50 12.22 C ATOM 3355 CG AGLU B 185 4.805 2.487 33.235 0.50 13.09 C ATOM 3356 CG BGLU B 185 5.900 0.583 32.241 0.50 14.08 C ATOM 3357 CD AGLU B 185 5.365 2.135 34.600 0.50 14.12 C ATOM 3358 CD BGLU B 185 6.688 -0.139 31.144 0.50 15.11 C ATOM 3359 OE1AGLU B 185 6.580 1.895 34.719 0.50 15.71 O ATOM 3360 OE1BGLU B 185 7.796 0.328 30.742 0.50 15.03 O ATOM 3361 OE2AGLU B 185 4.573 2.127 35.565 0.50 15.42 O ATOM 3362 OE2BGLU B 185 6.212 -1.220 30.688 0.50 16.69 O ATOM 0 H AGLU B 185 6.812 1.819 29.901 0.50 10.38 H new ATOM 0 H BGLU B 185 6.831 1.830 29.885 0.50 10.38 H new ATOM 0 HA AGLU B 185 4.348 2.082 30.605 0.50 10.78 H new ATOM 0 HA BGLU B 185 4.361 2.097 30.613 0.50 10.78 H new ATOM 0 HB2AGLU B 185 5.969 1.251 32.093 0.50 12.22 H new ATOM 0 HB2BGLU B 185 6.700 2.478 32.156 0.50 12.22 H new ATOM 0 HB3AGLU B 185 6.579 2.680 32.234 0.50 12.22 H new ATOM 0 HB3BGLU B 185 5.278 2.465 32.797 0.50 12.22 H new ATOM 0 HG2AGLU B 185 4.576 3.430 33.222 0.50 14.08 H new ATOM 0 HG2BGLU B 185 6.311 0.389 33.098 0.50 14.08 H new ATOM 0 HG3AGLU B 185 3.982 1.994 33.096 0.50 14.08 H new ATOM 0 HG3BGLU B 185 5.001 0.219 32.269 0.50 14.08 H new ATOM 3363 N GLN B 186 5.832 4.915 30.469 1.00 9.12 N ATOM 3364 CA GLN B 186 5.585 6.349 30.309 1.00 8.46 C ATOM 3365 C GLN B 186 4.713 6.648 29.091 1.00 8.33 C ATOM 3366 O GLN B 186 3.792 7.443 29.192 1.00 8.13 O ATOM 3367 CB GLN B 186 6.897 7.125 30.216 1.00 8.26 C ATOM 3368 CG GLN B 186 7.628 7.160 31.555 1.00 8.40 C ATOM 3369 CD GLN B 186 9.030 7.713 31.435 1.00 8.16 C ATOM 3370 OE1 GLN B 186 9.747 7.458 30.459 1.00 7.60 O ATOM 3371 NE2 GLN B 186 9.424 8.501 32.416 1.00 8.50 N ATOM 0 H AGLN B 186 6.660 4.684 30.434 0.50 9.12 H new ATOM 0 H BGLN B 186 6.655 4.684 30.373 0.50 9.12 H new ATOM 0 HA GLN B 186 5.103 6.640 31.099 1.00 8.46 H new ATOM 0 HB2 GLN B 186 7.468 6.717 29.546 1.00 8.26 H new ATOM 0 HB3 GLN B 186 6.717 8.032 29.921 1.00 8.26 H new ATOM 0 HG2 GLN B 186 7.123 7.701 32.182 1.00 8.40 H new ATOM 0 HG3 GLN B 186 7.668 6.263 31.922 1.00 8.40 H new ATOM 0 HE21 GLN B 186 8.900 8.657 33.080 1.00 8.50 H new ATOM 0 HE22 GLN B 186 10.205 8.859 32.392 1.00 8.50 H new ATOM 3372 N ILE B 187 4.977 5.993 27.956 1.00 8.17 N ATOM 3373 CA ILE B 187 4.140 6.192 26.762 1.00 8.61 C ATOM 3374 C ILE B 187 2.676 5.800 27.027 1.00 8.88 C ATOM 3375 O ILE B 187 1.770 6.493 26.604 1.00 8.81 O ATOM 3376 CB ILE B 187 4.747 5.429 25.558 1.00 8.66 C ATOM 3377 CG1 ILE B 187 6.032 6.139 25.112 1.00 9.55 C ATOM 3378 CG2 ILE B 187 3.765 5.290 24.392 1.00 9.38 C ATOM 3379 CD1 ILE B 187 6.908 5.357 24.175 1.00 10.56 C ATOM 0 H ILE B 187 5.625 5.437 27.855 1.00 8.17 H new ATOM 0 HA ILE B 187 4.130 7.136 26.541 1.00 8.61 H new ATOM 0 HB ILE B 187 4.952 4.526 25.846 1.00 8.66 H new ATOM 0 HG12 ILE B 187 5.790 6.974 24.683 1.00 9.55 H new ATOM 0 HG13 ILE B 187 6.549 6.365 25.901 1.00 9.55 H new ATOM 0 HG21 ILE B 187 4.190 4.807 23.666 1.00 9.38 H new ATOM 0 HG22 ILE B 187 2.979 4.803 24.687 1.00 9.38 H new ATOM 0 HG23 ILE B 187 3.502 6.171 24.083 1.00 9.38 H new ATOM 0 HD11 ILE B 187 7.691 5.883 23.950 1.00 10.56 H new ATOM 0 HD12 ILE B 187 7.185 4.532 24.603 1.00 10.56 H new ATOM 0 HD13 ILE B 187 6.414 5.151 23.366 1.00 10.56 H new ATOM 3380 N GLU B 188 2.466 4.718 27.771 1.00 9.38 N ATOM 3381 CA GLU B 188 1.095 4.286 28.081 1.00 10.18 C ATOM 3382 C GLU B 188 0.393 5.279 28.994 1.00 9.76 C ATOM 3383 O GLU B 188 -0.782 5.628 28.774 1.00 9.79 O ATOM 3384 CB GLU B 188 1.123 2.881 28.672 1.00 12.60 C ATOM 3385 CG GLU B 188 1.433 1.861 27.591 1.00 16.16 C ATOM 3386 CD GLU B 188 1.722 0.478 28.103 1.00 19.86 C ATOM 3387 OE1 GLU B 188 1.966 0.322 29.315 1.00 24.53 O ATOM 3388 OE2 GLU B 188 1.718 -0.444 27.265 1.00 23.83 O ATOM 0 H GLU B 188 3.087 4.225 28.103 1.00 9.38 H new ATOM 0 HA GLU B 188 0.579 4.259 27.260 1.00 10.18 H new ATOM 0 HB2 GLU B 188 1.791 2.832 29.373 1.00 12.60 H new ATOM 0 HB3 GLU B 188 0.267 2.678 29.081 1.00 12.60 H new ATOM 0 HG2 GLU B 188 0.682 1.817 26.979 1.00 16.16 H new ATOM 0 HG3 GLU B 188 2.197 2.170 27.080 1.00 16.16 H new ATOM 3389 N LEU B 189 1.099 5.786 30.000 1.00 9.29 N ATOM 3390 CA LEU B 189 0.540 6.822 30.858 1.00 9.03 C ATOM 3391 C LEU B 189 0.221 8.076 30.062 1.00 9.04 C ATOM 3392 O LEU B 189 -0.865 8.651 30.203 1.00 8.99 O ATOM 3393 CB LEU B 189 1.493 7.163 32.018 1.00 9.28 C ATOM 3394 CG LEU B 189 1.566 6.149 33.168 1.00 9.47 C ATOM 3395 CD1 LEU B 189 2.806 6.356 34.041 1.00 10.02 C ATOM 3396 CD2 LEU B 189 0.326 6.248 34.045 1.00 10.27 C ATOM 0 H LEU B 189 1.900 5.545 30.201 1.00 9.29 H new ATOM 0 HA LEU B 189 -0.284 6.473 31.232 1.00 9.03 H new ATOM 0 HB2 LEU B 189 2.385 7.274 31.655 1.00 9.28 H new ATOM 0 HB3 LEU B 189 1.228 8.020 32.386 1.00 9.28 H new ATOM 0 HG LEU B 189 1.619 5.270 32.762 1.00 9.47 H new ATOM 0 HD11 LEU B 189 2.814 5.698 34.753 1.00 10.02 H new ATOM 0 HD12 LEU B 189 3.604 6.255 33.499 1.00 10.02 H new ATOM 0 HD13 LEU B 189 2.787 7.247 34.425 1.00 10.02 H new ATOM 0 HD21 LEU B 189 0.387 5.602 34.766 1.00 10.27 H new ATOM 0 HD22 LEU B 189 0.263 7.142 34.417 1.00 10.27 H new ATOM 0 HD23 LEU B 189 -0.463 6.063 33.512 1.00 10.27 H new ATOM 3397 N LEU B 190 1.154 8.499 29.204 1.00 8.65 N ATOM 3398 CA LEU B 190 0.947 9.683 28.373 1.00 8.53 C ATOM 3399 C LEU B 190 -0.260 9.552 27.474 1.00 8.74 C ATOM 3400 O LEU B 190 -1.004 10.498 27.304 1.00 8.30 O ATOM 3401 CB LEU B 190 2.197 9.969 27.530 1.00 7.80 C ATOM 3402 CG LEU B 190 3.383 10.510 28.359 1.00 7.60 C ATOM 3403 CD1 LEU B 190 4.695 10.360 27.599 1.00 7.67 C ATOM 3404 CD2 LEU B 190 3.138 11.959 28.746 1.00 7.75 C ATOM 0 H LEU B 190 1.914 8.112 29.090 1.00 8.65 H new ATOM 0 HA LEU B 190 0.783 10.426 28.975 1.00 8.53 H new ATOM 0 HB2 LEU B 190 2.470 9.154 27.081 1.00 7.80 H new ATOM 0 HB3 LEU B 190 1.973 10.612 26.839 1.00 7.80 H new ATOM 0 HG LEU B 190 3.454 9.985 29.171 1.00 7.60 H new ATOM 0 HD11 LEU B 190 5.423 10.706 28.139 1.00 7.67 H new ATOM 0 HD12 LEU B 190 4.853 9.422 27.407 1.00 7.67 H new ATOM 0 HD13 LEU B 190 4.646 10.856 26.767 1.00 7.67 H new ATOM 0 HD21 LEU B 190 3.889 12.287 29.266 1.00 7.75 H new ATOM 0 HD22 LEU B 190 3.041 12.496 27.944 1.00 7.75 H new ATOM 0 HD23 LEU B 190 2.328 12.020 29.276 1.00 7.75 H new ATOM 3405 N TRP B 191 -0.459 8.356 26.912 1.00 9.19 N ATOM 3406 CA TRP B 191 -1.623 8.142 26.056 1.00 10.10 C ATOM 3407 C TRP B 191 -2.895 8.359 26.844 1.00 9.72 C ATOM 3408 O TRP B 191 -3.836 9.012 26.360 1.00 9.97 O ATOM 3409 CB TRP B 191 -1.568 6.752 25.434 1.00 12.25 C ATOM 3410 CG TRP B 191 -2.729 6.468 24.502 1.00 15.37 C ATOM 3411 CD1 TRP B 191 -3.897 5.765 24.798 1.00 16.79 C ATOM 3412 CD2 TRP B 191 -2.897 6.909 23.101 1.00 17.97 C ATOM 3413 NE1 TRP B 191 -4.736 5.738 23.708 1.00 18.46 N ATOM 3414 CE2 TRP B 191 -4.199 6.398 22.664 1.00 19.12 C ATOM 3415 CE3 TRP B 191 -2.127 7.639 22.201 1.00 19.76 C ATOM 3416 CZ2 TRP B 191 -4.680 6.612 21.376 1.00 20.35 C ATOM 3417 CZ3 TRP B 191 -2.629 7.859 20.912 1.00 21.31 C ATOM 3418 CH2 TRP B 191 -3.878 7.359 20.513 1.00 21.20 C ATOM 0 H TRP B 191 0.055 7.674 27.011 1.00 9.19 H new ATOM 0 HA TRP B 191 -1.614 8.787 25.331 1.00 10.10 H new ATOM 0 HB2 TRP B 191 -0.737 6.656 24.944 1.00 12.25 H new ATOM 0 HB3 TRP B 191 -1.559 6.088 26.141 1.00 12.25 H new ATOM 0 HD1 TRP B 191 -4.083 5.369 25.619 1.00 16.79 H new ATOM 0 HE1 TRP B 191 -5.503 5.350 23.695 1.00 18.46 H new ATOM 0 HE3 TRP B 191 -1.296 7.974 22.450 1.00 19.76 H new ATOM 0 HZ2 TRP B 191 -5.501 6.272 21.102 1.00 20.35 H new ATOM 0 HZ3 TRP B 191 -2.122 8.349 20.305 1.00 21.31 H new ATOM 0 HH2 TRP B 191 -4.179 7.530 19.650 1.00 21.20 H new ATOM 3419 N GLN B 192 -2.922 7.832 28.077 1.00 9.49 N ATOM 3420 CA GLN B 192 -4.091 8.045 28.952 1.00 9.45 C ATOM 3421 C GLN B 192 -4.352 9.512 29.254 1.00 9.31 C ATOM 3422 O GLN B 192 -5.501 9.974 29.201 1.00 9.25 O ATOM 3423 CB GLN B 192 -3.990 7.237 30.253 1.00 10.49 C ATOM 3424 CG GLN B 192 -4.088 5.735 30.032 1.00 11.31 C ATOM 3425 CD GLN B 192 -5.305 5.337 29.202 1.00 12.74 C ATOM 3426 OE1 GLN B 192 -6.445 5.601 29.589 1.00 14.51 O ATOM 3427 NE2 GLN B 192 -5.067 4.707 28.053 1.00 13.32 N ATOM 0 H GLN B 192 -2.291 7.359 28.421 1.00 9.49 H new ATOM 0 HA GLN B 192 -4.853 7.718 28.449 1.00 9.45 H new ATOM 0 HB2 GLN B 192 -3.148 7.440 30.689 1.00 10.49 H new ATOM 0 HB3 GLN B 192 -4.696 7.516 30.857 1.00 10.49 H new ATOM 0 HG2 GLN B 192 -3.283 5.425 29.588 1.00 11.31 H new ATOM 0 HG3 GLN B 192 -4.128 5.288 30.892 1.00 11.31 H new ATOM 0 HE21 GLN B 192 -4.258 4.539 27.814 1.00 13.32 H new ATOM 0 HE22 GLN B 192 -5.722 4.468 27.550 1.00 13.32 H new ATOM 3428 N VAL B 193 -3.297 10.265 29.581 1.00 8.74 N ATOM 3429 CA VAL B 193 -3.454 11.689 29.839 1.00 9.05 C ATOM 3430 C VAL B 193 -3.936 12.413 28.583 1.00 9.33 C ATOM 3431 O VAL B 193 -4.865 13.239 28.637 1.00 9.70 O ATOM 3432 CB VAL B 193 -2.127 12.339 30.341 1.00 8.54 C ATOM 3433 CG1 VAL B 193 -2.320 13.819 30.645 1.00 8.76 C ATOM 3434 CG2 VAL B 193 -1.592 11.639 31.585 1.00 8.97 C ATOM 0 H VAL B 193 -2.493 9.970 29.657 1.00 8.74 H new ATOM 0 HA VAL B 193 -4.119 11.780 30.540 1.00 9.05 H new ATOM 0 HB VAL B 193 -1.481 12.240 29.625 1.00 8.54 H new ATOM 0 HG11 VAL B 193 -1.482 14.198 30.954 1.00 8.76 H new ATOM 0 HG12 VAL B 193 -2.606 14.280 29.841 1.00 8.76 H new ATOM 0 HG13 VAL B 193 -2.995 13.923 31.334 1.00 8.76 H new ATOM 0 HG21 VAL B 193 -0.769 12.067 31.869 1.00 8.97 H new ATOM 0 HG22 VAL B 193 -2.248 11.697 32.297 1.00 8.97 H new ATOM 0 HG23 VAL B 193 -1.417 10.707 31.382 1.00 8.97 H new ATOM 3435 N TYR B 194 -3.290 12.116 27.457 1.00 9.82 N ATOM 3436 CA TYR B 194 -3.608 12.728 26.185 1.00 10.55 C ATOM 3437 C TYR B 194 -5.089 12.539 25.814 1.00 11.07 C ATOM 3438 O TYR B 194 -5.718 13.477 25.308 1.00 11.34 O ATOM 3439 CB TYR B 194 -2.666 12.150 25.108 1.00 11.24 C ATOM 3440 CG TYR B 194 -3.080 12.459 23.687 1.00 12.40 C ATOM 3441 CD1 TYR B 194 -2.896 13.722 23.154 1.00 13.72 C ATOM 3442 CD2 TYR B 194 -3.656 11.465 22.888 1.00 13.40 C ATOM 3443 CE1 TYR B 194 -3.280 14.008 21.849 1.00 14.91 C ATOM 3444 CE2 TYR B 194 -4.049 11.749 21.578 1.00 14.52 C ATOM 3445 CZ TYR B 194 -3.842 13.020 21.085 1.00 15.21 C ATOM 3446 OH TYR B 194 -4.211 13.340 19.786 1.00 19.04 O ATOM 0 H TYR B 194 -2.648 11.545 27.417 1.00 9.82 H new ATOM 0 HA TYR B 194 -3.470 13.686 26.247 1.00 10.55 H new ATOM 0 HB2 TYR B 194 -1.772 12.497 25.256 1.00 11.24 H new ATOM 0 HB3 TYR B 194 -2.619 11.187 25.218 1.00 11.24 H new ATOM 0 HD1 TYR B 194 -2.510 14.389 23.675 1.00 13.72 H new ATOM 0 HD2 TYR B 194 -3.778 10.609 23.232 1.00 13.40 H new ATOM 0 HE1 TYR B 194 -3.157 14.861 21.499 1.00 14.91 H new ATOM 0 HE2 TYR B 194 -4.443 11.094 21.049 1.00 14.52 H new ATOM 0 HH TYR B 194 -4.352 12.634 19.353 1.00 19.04 H new ATOM 3447 N AGLN B 195 -5.609 11.335 26.071 0.50 11.17 N ATOM 3448 N BGLN B 195 -5.639 11.350 26.066 0.50 11.19 N ATOM 3449 CA AGLN B 195 -7.006 10.997 25.780 0.50 11.85 C ATOM 3450 CA BGLN B 195 -7.055 11.075 25.761 0.50 11.82 C ATOM 3451 C AGLN B 195 -7.980 11.453 26.873 0.50 11.96 C ATOM 3452 C BGLN B 195 -8.024 11.697 26.777 0.50 11.95 C ATOM 3453 O AGLN B 195 -9.169 11.124 26.777 0.50 12.05 O ATOM 3454 O BGLN B 195 -9.246 11.722 26.563 0.50 12.00 O ATOM 3455 CB AGLN B 195 -7.161 9.490 25.539 0.50 12.72 C ATOM 3456 CB BGLN B 195 -7.290 9.572 25.680 0.50 12.73 C ATOM 3457 CG AGLN B 195 -6.399 8.952 24.333 0.50 14.34 C ATOM 3458 CG BGLN B 195 -6.641 8.888 24.490 0.50 14.28 C ATOM 3459 CD AGLN B 195 -6.947 9.457 23.011 0.50 15.57 C ATOM 3460 CD BGLN B 195 -7.176 7.491 24.313 0.50 15.53 C ATOM 3461 OE1AGLN B 195 -7.976 10.130 22.965 0.50 18.38 O ATOM 3462 OE1BGLN B 195 -7.297 6.744 25.279 0.50 17.32 O ATOM 3463 NE2AGLN B 195 -6.255 9.132 21.926 0.50 16.84 N ATOM 3464 NE2BGLN B 195 -7.525 7.135 23.084 0.50 16.64 N ATOM 0 H AGLN B 195 -5.160 10.690 26.420 0.50 11.19 H new ATOM 0 H BGLN B 195 -5.214 10.687 26.413 0.50 11.19 H new ATOM 0 HA AGLN B 195 -7.237 11.483 24.973 0.50 11.82 H new ATOM 0 HA BGLN B 195 -7.239 11.490 24.904 0.50 11.82 H new ATOM 0 HB2AGLN B 195 -6.863 9.016 26.331 0.50 12.73 H new ATOM 0 HB2BGLN B 195 -6.958 9.161 26.494 0.50 12.73 H new ATOM 0 HB3AGLN B 195 -8.103 9.289 25.426 0.50 12.73 H new ATOM 0 HB3BGLN B 195 -8.246 9.408 25.649 0.50 12.73 H new ATOM 0 HG2AGLN B 195 -5.465 9.204 24.408 0.50 14.28 H new ATOM 0 HG2BGLN B 195 -6.805 9.405 23.686 0.50 14.28 H new ATOM 0 HG3AGLN B 195 -6.432 7.983 24.342 0.50 14.28 H new ATOM 0 HG3BGLN B 195 -5.680 8.856 24.615 0.50 14.28 H new ATOM 0 HE21AGLN B 195 -5.540 8.660 21.998 0.50 16.64 H new ATOM 0 HE21BGLN B 195 -7.425 7.687 22.432 0.50 16.64 H new ATOM 0 HE22AGLN B 195 -6.522 9.394 21.151 0.50 16.64 H new ATOM 0 HE22BGLN B 195 -7.851 6.353 22.939 0.50 16.64 H new ATOM 3465 N GLY B 196 -7.490 12.182 27.887 1.00 11.48 N ATOM 3466 CA GLY B 196 -8.329 12.760 28.942 1.00 11.91 C ATOM 3467 C GLY B 196 -8.868 11.717 29.888 1.00 12.01 C ATOM 3468 O GLY B 196 -9.880 11.970 30.545 1.00 13.59 O ATOM 0 H AGLY B 196 -6.653 12.355 27.979 0.50 11.48 H new ATOM 0 H BGLY B 196 -6.647 12.189 28.055 0.50 11.48 H new ATOM 0 HA2 GLY B 196 -7.812 13.410 29.443 1.00 11.91 H new ATOM 0 HA3 GLY B 196 -9.069 13.238 28.537 1.00 11.91 H new ATOM 3469 N HIS B 197 -8.193 10.572 29.993 1.00 10.95 N ATOM 3470 CA HIS B 197 -8.633 9.488 30.870 1.00 10.95 C ATOM 3471 C HIS B 197 -7.914 9.439 32.183 1.00 10.40 C ATOM 3472 O HIS B 197 -8.109 8.522 32.976 1.00 10.56 O ATOM 3473 CB HIS B 197 -8.569 8.165 30.131 1.00 11.73 C ATOM 3474 CG HIS B 197 -9.586 8.084 29.039 1.00 12.87 C ATOM 3475 ND1 HIS B 197 -9.309 7.701 27.778 1.00 14.66 N ATOM 3476 CD2 HIS B 197 -10.929 8.417 29.068 1.00 12.60 C ATOM 3477 CE1 HIS B 197 -10.443 7.767 27.044 1.00 13.92 C ATOM 3478 NE2 HIS B 197 -11.426 8.211 27.836 1.00 15.28 N ATOM 0 H HIS B 197 -7.470 10.403 29.559 1.00 10.95 H new ATOM 0 HA HIS B 197 -9.556 9.671 31.106 1.00 10.95 H new ATOM 0 HB2 HIS B 197 -7.682 8.048 29.755 1.00 11.73 H new ATOM 0 HB3 HIS B 197 -8.710 7.438 30.758 1.00 11.73 H new ATOM 0 HD2 HIS B 197 -11.402 8.727 29.806 1.00 12.60 H new ATOM 0 HE1 HIS B 197 -10.525 7.543 26.145 1.00 13.92 H new ATOM 0 HE2 HIS B 197 -12.241 8.343 27.596 1.00 15.28 H new ATOM 3479 N ARG B 198 -7.038 10.415 32.401 1.00 10.59 N ATOM 3480 CA ARG B 198 -6.498 10.736 33.733 1.00 11.28 C ATOM 3481 C ARG B 198 -5.908 12.127 33.624 1.00 10.63 C ATOM 3482 O ARG B 198 -5.732 12.646 32.518 1.00 11.46 O ATOM 3483 CB ARG B 198 -5.461 9.737 34.250 1.00 12.47 C ATOM 3484 CG ARG B 198 -4.269 9.570 33.334 1.00 12.70 C ATOM 3485 CD ARG B 198 -3.316 8.445 33.814 1.00 14.36 C ATOM 3486 NE ARG B 198 -2.808 8.678 35.169 1.00 15.33 N ATOM 3487 CZ ARG B 198 -2.556 7.738 36.092 1.00 14.43 C ATOM 3488 NH1 ARG B 198 -2.740 6.439 35.864 1.00 13.71 N ATOM 3489 NH2 ARG B 198 -2.119 8.113 37.274 1.00 15.37 N ATOM 0 H ARG B 198 -6.733 10.920 31.775 1.00 10.59 H new ATOM 0 HA ARG B 198 -7.214 10.688 34.386 1.00 11.28 H new ATOM 0 HB2 ARG B 198 -5.151 10.027 35.122 1.00 12.47 H new ATOM 0 HB3 ARG B 198 -5.888 8.875 34.373 1.00 12.47 H new ATOM 0 HG2 ARG B 198 -4.578 9.369 32.437 1.00 12.70 H new ATOM 0 HG3 ARG B 198 -3.781 10.407 33.285 1.00 12.70 H new ATOM 0 HD2 ARG B 198 -3.785 7.596 33.789 1.00 14.36 H new ATOM 0 HD3 ARG B 198 -2.569 8.374 33.200 1.00 14.36 H new ATOM 0 HE ARG B 198 -2.657 9.494 35.393 1.00 15.33 H new ATOM 0 HH11 ARG B 198 -3.032 6.174 35.100 1.00 13.71 H new ATOM 0 HH12 ARG B 198 -2.567 5.865 36.481 1.00 13.71 H new ATOM 0 HH21 ARG B 198 -2.000 8.948 37.443 1.00 15.37 H new ATOM 0 HH22 ARG B 198 -1.952 7.524 37.878 1.00 15.37 H new ATOM 3490 N GLY B 199 -5.656 12.743 34.763 1.00 9.73 N ATOM 3491 CA GLY B 199 -5.164 14.110 34.795 1.00 9.65 C ATOM 3492 C GLY B 199 -3.679 14.188 34.508 1.00 8.90 C ATOM 3493 O GLY B 199 -2.990 13.162 34.398 1.00 10.10 O ATOM 0 H GLY B 199 -5.764 12.385 35.538 1.00 9.73 H new ATOM 0 HA2 GLY B 199 -5.647 14.641 34.143 1.00 9.65 H new ATOM 0 HA3 GLY B 199 -5.345 14.497 35.666 1.00 9.65 H new ATOM 3494 N GLN B 200 -3.187 15.418 34.431 1.00 8.94 N ATOM 3495 CA GLN B 200 -1.757 15.639 34.252 1.00 8.93 C ATOM 3496 C GLN B 200 -0.982 14.766 35.226 1.00 8.95 C ATOM 3497 O GLN B 200 -1.278 14.741 36.413 1.00 9.65 O ATOM 3498 CB GLN B 200 -1.465 17.091 34.540 1.00 8.89 C ATOM 3499 CG GLN B 200 -0.005 17.462 34.364 1.00 9.46 C ATOM 3500 CD GLN B 200 0.179 18.946 34.526 1.00 9.80 C ATOM 3501 OE1 GLN B 200 0.111 19.475 35.629 1.00 10.28 O ATOM 3502 NE2 GLN B 200 0.343 19.637 33.415 1.00 10.83 N ATOM 0 H GLN B 200 -3.660 16.135 34.480 1.00 8.94 H new ATOM 0 HA GLN B 200 -1.494 15.414 33.346 1.00 8.93 H new ATOM 0 HB2 GLN B 200 -2.005 17.644 33.954 1.00 8.89 H new ATOM 0 HB3 GLN B 200 -1.735 17.293 35.449 1.00 8.89 H new ATOM 0 HG2 GLN B 200 0.536 16.990 35.016 1.00 9.46 H new ATOM 0 HG3 GLN B 200 0.302 17.185 33.486 1.00 9.46 H new ATOM 0 HE21 GLN B 200 0.386 19.231 32.658 1.00 10.83 H new ATOM 0 HE22 GLN B 200 0.407 20.494 33.447 1.00 10.83 H new ATOM 3503 N TYR B 201 0.036 14.078 34.728 1.00 8.43 N ATOM 3504 CA TYR B 201 0.808 13.161 35.560 1.00 8.54 C ATOM 3505 C TYR B 201 1.986 13.875 36.227 1.00 8.80 C ATOM 3506 O TYR B 201 2.799 14.492 35.532 1.00 8.88 O ATOM 3507 CB TYR B 201 1.323 12.000 34.702 1.00 8.94 C ATOM 3508 CG TYR B 201 2.054 10.995 35.552 1.00 9.35 C ATOM 3509 CD1 TYR B 201 3.389 11.199 35.884 1.00 9.67 C ATOM 3510 CD2 TYR B 201 1.403 9.882 36.083 1.00 10.10 C ATOM 3511 CE1 TYR B 201 4.066 10.333 36.718 1.00 10.21 C ATOM 3512 CE2 TYR B 201 2.072 8.998 36.919 1.00 10.55 C ATOM 3513 CZ TYR B 201 3.405 9.235 37.225 1.00 10.39 C ATOM 3514 OH TYR B 201 4.064 8.366 38.056 1.00 12.39 O ATOM 0 H TYR B 201 0.298 14.126 33.910 1.00 8.43 H new ATOM 0 HA TYR B 201 0.227 12.821 36.259 1.00 8.54 H new ATOM 0 HB2 TYR B 201 0.579 11.570 34.251 1.00 8.94 H new ATOM 0 HB3 TYR B 201 1.915 12.339 34.012 1.00 8.94 H new ATOM 0 HD1 TYR B 201 3.836 11.936 35.536 1.00 9.67 H new ATOM 0 HD2 TYR B 201 0.510 9.730 35.875 1.00 10.10 H new ATOM 0 HE1 TYR B 201 4.957 10.488 36.935 1.00 10.21 H new ATOM 0 HE2 TYR B 201 1.633 8.257 37.269 1.00 10.55 H new ATOM 0 HH TYR B 201 4.719 8.757 38.408 1.00 12.39 H new ATOM 3515 N LEU B 202 2.093 13.774 37.544 1.00 8.85 N ATOM 3516 CA LEU B 202 3.205 14.376 38.284 1.00 9.61 C ATOM 3517 C LEU B 202 3.846 13.357 39.197 1.00 9.97 C ATOM 3518 O LEU B 202 3.163 12.781 40.039 1.00 11.28 O ATOM 3519 CB LEU B 202 2.694 15.507 39.170 1.00 9.82 C ATOM 3520 CG LEU B 202 1.906 16.638 38.501 1.00 10.64 C ATOM 3521 CD1 LEU B 202 1.254 17.563 39.526 1.00 12.12 C ATOM 3522 CD2 LEU B 202 2.778 17.432 37.539 1.00 11.10 C ATOM 0 H LEU B 202 1.526 13.356 38.038 1.00 8.85 H new ATOM 0 HA LEU B 202 3.845 14.705 37.634 1.00 9.61 H new ATOM 0 HB2 LEU B 202 2.131 15.117 39.856 1.00 9.82 H new ATOM 0 HB3 LEU B 202 3.457 15.901 39.620 1.00 9.82 H new ATOM 0 HG LEU B 202 1.196 16.219 37.989 1.00 10.64 H new ATOM 0 HD11 LEU B 202 0.766 18.264 39.066 1.00 12.12 H new ATOM 0 HD12 LEU B 202 0.642 17.053 40.079 1.00 12.12 H new ATOM 0 HD13 LEU B 202 1.939 17.961 40.085 1.00 12.12 H new ATOM 0 HD21 LEU B 202 2.252 18.138 37.133 1.00 11.10 H new ATOM 0 HD22 LEU B 202 3.523 17.822 38.023 1.00 11.10 H new ATOM 0 HD23 LEU B 202 3.116 16.843 36.847 1.00 11.10 H new ATOM 3523 N ASP B 203 5.146 13.126 39.063 1.00 9.81 N ATOM 3524 CA ASP B 203 5.877 12.360 40.097 1.00 9.89 C ATOM 3525 C ASP B 203 6.168 13.225 41.320 1.00 10.77 C ATOM 3526 O ASP B 203 6.379 14.424 41.213 1.00 10.07 O ATOM 3527 CB ASP B 203 7.184 11.783 39.532 1.00 10.30 C ATOM 3528 CG ASP B 203 6.963 10.542 38.703 1.00 10.10 C ATOM 3529 OD1 ASP B 203 6.180 9.650 39.129 1.00 11.30 O ATOM 3530 OD2 ASP B 203 7.570 10.422 37.628 1.00 10.09 O ATOM 0 H ASP B 203 5.625 13.393 38.400 1.00 9.81 H new ATOM 0 HA ASP B 203 5.308 11.624 40.372 1.00 9.89 H new ATOM 0 HB2 ASP B 203 7.622 12.457 38.989 1.00 10.30 H new ATOM 0 HB3 ASP B 203 7.785 11.575 40.265 1.00 10.30 H new TER 3531 ASP B 203 HETATM 3532 C1 EDO A 301 13.602 40.635 47.773 1.00 24.90 C HETATM 3533 O1 EDO A 301 12.530 41.391 47.183 1.00 24.30 O HETATM 3534 C2 EDO A 301 14.251 39.704 46.751 1.00 23.71 C HETATM 3535 O2 EDO A 301 14.033 38.313 47.046 1.00 19.59 O HETATM 0 HO2 EDO A 301 14.773 37.920 47.107 1.00 19.59 H new HETATM 0 HO1 EDO A 301 12.189 41.893 47.763 1.00 24.30 H new HETATM 0 H22 EDO A 301 13.898 39.902 45.869 1.00 23.71 H new HETATM 0 H21 EDO A 301 15.205 39.878 46.721 1.00 23.71 H new HETATM 0 H12 EDO A 301 14.269 41.241 48.131 1.00 24.90 H new HETATM 0 H11 EDO A 301 13.262 40.115 48.518 1.00 24.90 H new HETATM 3536 C1 EDO A 302 19.807 38.717 25.620 1.00 32.42 C HETATM 3537 O1 EDO A 302 18.723 39.508 26.116 1.00 34.77 O HETATM 3538 C2 EDO A 302 19.429 37.239 25.683 1.00 32.13 C HETATM 3539 O2 EDO A 302 20.426 36.446 25.025 1.00 33.59 O HETATM 0 HO2 EDO A 302 20.211 35.635 25.066 1.00 33.59 H new HETATM 0 HO1 EDO A 302 18.989 40.292 26.256 1.00 34.77 H new HETATM 0 H22 EDO A 302 19.342 36.959 26.608 1.00 32.13 H new HETATM 0 H21 EDO A 302 18.566 37.100 25.262 1.00 32.13 H new HETATM 0 H12 EDO A 302 20.013 38.970 24.706 1.00 32.42 H new HETATM 0 H11 EDO A 302 20.606 38.879 26.146 1.00 32.42 H new HETATM 3540 C TRS A 303 15.174 31.403 44.062 0.50 10.88 C HETATM 3541 C1 TRS A 303 15.607 30.425 45.140 0.50 11.04 C HETATM 3542 C2 TRS A 303 15.966 32.692 44.024 0.50 10.32 C HETATM 3543 C3 TRS A 303 13.762 31.752 44.367 0.50 10.61 C HETATM 3544 N TRS A 303 14.898 30.911 42.695 0.50 10.67 N HETATM 3545 O1 TRS A 303 15.389 29.061 44.810 0.50 10.87 O HETATM 3546 O2 TRS A 303 17.341 32.343 43.755 0.50 14.95 O HETATM 3547 O3 TRS A 303 13.346 31.762 43.014 0.50 7.87 O HETATM 0 HO3 TRS A 303 13.204 32.553 42.770 0.50 7.87 H new HETATM 0 HO2 TRS A 303 17.560 32.629 42.996 0.50 14.95 H new HETATM 0 HO1 TRS A 303 14.568 28.929 44.690 0.50 10.87 H new HETATM 0 HN3 TRS A 303 14.705 31.576 42.184 0.50 10.67 H new HETATM 0 HN2 TRS A 303 15.593 30.507 42.389 0.50 10.67 H new HETATM 0 HN1 TRS A 303 14.235 30.364 42.715 0.50 10.67 H new HETATM 0 H32 TRS A 303 13.305 31.091 44.911 0.50 10.61 H new HETATM 0 H31 TRS A 303 13.659 32.607 44.813 0.50 10.61 H new HETATM 0 H22 TRS A 303 15.623 33.284 43.337 0.50 10.32 H new HETATM 0 H21 TRS A 303 15.892 33.164 44.868 0.50 10.32 H new HETATM 0 H12 TRS A 303 16.551 30.557 45.322 0.50 11.04 H new HETATM 0 H11 TRS A 303 15.129 30.630 45.959 0.50 11.04 H new HETATM 3548 S SO4 A 304 11.742 30.149 51.754 1.00 53.25 S HETATM 3549 O1 SO4 A 304 12.382 30.971 52.813 1.00 50.41 O HETATM 3550 O2 SO4 A 304 12.551 28.923 51.559 1.00 51.07 O HETATM 3551 O3 SO4 A 304 10.367 29.786 52.151 1.00 49.28 O HETATM 3552 O4 SO4 A 304 11.674 30.907 50.485 1.00 45.75 O HETATM 3553 S SO4 A 305 12.747 38.963 63.461 0.70 16.36 S HETATM 3554 O1 SO4 A 305 14.127 38.581 63.772 0.70 20.05 O HETATM 3555 O2 SO4 A 305 12.788 39.732 62.194 0.70 19.90 O HETATM 3556 O3 SO4 A 305 11.855 37.777 63.364 0.70 20.78 O HETATM 3557 O4 SO4 A 305 12.331 39.775 64.618 0.70 20.22 O HETATM 3558 S SO4 A 306 18.269 15.477 52.795 1.00 34.86 S HETATM 3559 O1 SO4 A 306 19.735 15.660 52.731 1.00 35.81 O HETATM 3560 O2 SO4 A 306 17.709 16.370 53.845 1.00 33.97 O HETATM 3561 O3 SO4 A 306 17.700 15.836 51.480 1.00 33.61 O HETATM 3562 O4 SO4 A 306 17.957 14.080 53.144 1.00 35.89 O HETATM 3563 C1 PEG A 307 9.774 14.644 53.944 1.00 34.08 C HETATM 3564 O1 PEG A 307 10.011 15.631 54.960 1.00 35.60 O HETATM 3565 C2 PEG A 307 8.376 14.815 53.353 1.00 32.84 C HETATM 3566 O2 PEG A 307 7.411 15.059 54.375 1.00 35.80 O HETATM 3567 C3 PEG A 307 6.257 15.761 53.909 1.00 31.28 C HETATM 3568 C4 PEG A 307 4.985 15.003 54.271 1.00 32.26 C HETATM 3569 O4 PEG A 307 3.841 15.739 53.816 1.00 28.67 O HETATM 0 HO4 PEG A 307 3.180 15.223 53.759 1.00 28.67 H new HETATM 0 HO1 PEG A 307 9.276 15.925 55.242 1.00 35.60 H new HETATM 0 H42 PEG A 307 4.996 14.122 53.866 1.00 32.26 H new HETATM 0 H41 PEG A 307 4.937 14.873 55.231 1.00 32.26 H new HETATM 0 H32 PEG A 307 6.233 16.649 54.300 1.00 31.28 H new HETATM 0 H31 PEG A 307 6.309 15.876 52.947 1.00 31.28 H new HETATM 0 H22 PEG A 307 8.376 15.552 52.722 1.00 32.84 H new HETATM 0 H21 PEG A 307 8.132 14.018 52.857 1.00 32.84 H new HETATM 0 H12 PEG A 307 10.440 14.726 53.244 1.00 34.08 H new HETATM 0 H11 PEG A 307 9.866 13.755 54.321 1.00 34.08 H new HETATM 3570 C1 EDO A 308 11.554 35.979 28.918 1.00 32.56 C HETATM 3571 O1 EDO A 308 11.642 36.215 27.506 1.00 37.04 O HETATM 3572 C2 EDO A 308 12.900 36.233 29.591 1.00 30.33 C HETATM 3573 O2 EDO A 308 13.911 36.632 28.656 1.00 28.16 O HETATM 0 HO2 EDO A 308 14.536 36.071 28.662 1.00 28.16 H new HETATM 0 HO1 EDO A 308 12.408 36.502 27.317 1.00 37.04 H new HETATM 0 H22 EDO A 308 12.797 36.922 30.266 1.00 30.33 H new HETATM 0 H21 EDO A 308 13.187 35.428 30.050 1.00 30.33 H new HETATM 0 H12 EDO A 308 10.879 36.557 29.306 1.00 32.56 H new HETATM 0 H11 EDO A 308 11.273 35.065 29.081 1.00 32.56 H new HETATM 3574 C1 GOL A 309 6.194 32.986 28.207 1.00 32.12 C HETATM 3575 O1 GOL A 309 4.786 32.971 28.465 1.00 34.46 O HETATM 3576 C2 GOL A 309 6.633 32.005 27.116 1.00 31.38 C HETATM 3577 O2 GOL A 309 5.553 31.615 26.260 1.00 36.15 O HETATM 3578 C3 GOL A 309 7.699 32.687 26.267 1.00 32.73 C HETATM 3579 O3 GOL A 309 8.867 32.932 27.062 1.00 29.90 O HETATM 0 HO3 GOL A 309 9.544 32.953 26.566 1.00 29.90 H new HETATM 0 HO2 GOL A 309 5.110 31.004 26.628 1.00 36.15 H new HETATM 0 HO1 GOL A 309 4.396 32.527 27.868 1.00 34.46 H new HETATM 0 H32 GOL A 309 7.926 32.129 25.507 1.00 32.73 H new HETATM 0 H31 GOL A 309 7.357 33.523 25.913 1.00 32.73 H new HETATM 0 H2 GOL A 309 6.968 31.205 27.550 1.00 31.38 H new HETATM 0 H12 GOL A 309 6.457 33.883 27.949 1.00 32.12 H new HETATM 0 H11 GOL A 309 6.667 32.777 29.028 1.00 32.12 H new HETATM 3580 C1 PEG A 310 9.860 44.330 47.340 1.00 34.26 C HETATM 3581 O1 PEG A 310 10.082 43.643 48.580 1.00 35.10 O HETATM 3582 C2 PEG A 310 8.370 44.599 47.157 1.00 32.20 C HETATM 3583 O2 PEG A 310 7.610 43.534 47.740 1.00 31.84 O HETATM 3584 C3 PEG A 310 6.212 43.677 47.552 1.00 27.71 C HETATM 3585 C4 PEG A 310 5.866 43.010 46.232 1.00 27.98 C HETATM 3586 O4 PEG A 310 4.594 43.460 45.785 1.00 25.96 O HETATM 0 HO4 PEG A 310 4.036 43.389 46.409 1.00 25.96 H new HETATM 0 HO1 PEG A 310 9.742 44.083 49.209 1.00 35.10 H new HETATM 0 H42 PEG A 310 6.543 43.216 45.569 1.00 27.98 H new HETATM 0 H41 PEG A 310 5.858 42.046 46.339 1.00 27.98 H new HETATM 0 H32 PEG A 310 5.724 43.265 48.282 1.00 27.71 H new HETATM 0 H31 PEG A 310 5.963 44.614 47.538 1.00 27.71 H new HETATM 0 H22 PEG A 310 8.132 45.443 47.572 1.00 32.20 H new HETATM 0 H21 PEG A 310 8.161 44.678 46.213 1.00 32.20 H new HETATM 0 H12 PEG A 310 10.351 45.166 47.332 1.00 34.26 H new HETATM 0 H11 PEG A 310 10.194 43.797 46.601 1.00 34.26 H new HETATM 3587 S SO4 A 311 16.200 46.952 32.295 1.00 32.99 S HETATM 3588 O1 SO4 A 311 17.496 46.384 32.713 1.00 24.14 O HETATM 3589 O2 SO4 A 311 15.468 46.046 31.368 1.00 29.71 O HETATM 3590 O3 SO4 A 311 15.374 47.193 33.506 1.00 30.76 O HETATM 3591 O4 SO4 A 311 16.466 48.250 31.619 1.00 31.72 O HETATM 3592 C1 EDO A 312 22.766 21.493 28.155 1.00 27.83 C HETATM 3593 O1 EDO A 312 21.462 22.066 28.334 1.00 25.74 O HETATM 3594 C2 EDO A 312 22.899 20.787 26.808 1.00 27.42 C HETATM 3595 O2 EDO A 312 22.375 21.613 25.758 1.00 29.11 O HETATM 0 HO2 EDO A 312 21.795 22.132 26.073 1.00 29.11 H new HETATM 0 HO1 EDO A 312 21.472 22.586 28.994 1.00 25.74 H new HETATM 0 H22 EDO A 312 23.831 20.584 26.633 1.00 27.42 H new HETATM 0 H21 EDO A 312 22.424 19.942 26.831 1.00 27.42 H new HETATM 0 H12 EDO A 312 23.437 22.190 28.222 1.00 27.83 H new HETATM 0 H11 EDO A 312 22.942 20.861 28.870 1.00 27.83 H new HETATM 3596 C1 PGE A 313 20.836 28.302 35.223 1.00 21.93 C HETATM 3597 O1 PGE A 313 21.256 29.604 34.710 1.00 15.46 O HETATM 3598 C2 PGE A 313 21.827 27.132 34.995 1.00 22.85 C HETATM 3599 O2 PGE A 313 22.869 27.173 35.971 1.00 27.63 O HETATM 3600 C3 PGE A 313 23.881 26.203 35.775 1.00 29.80 C HETATM 3601 C4 PGE A 313 23.634 25.065 36.748 1.00 28.60 C HETATM 3602 O4 PGE A 313 20.653 22.079 36.168 1.00 30.03 O HETATM 3603 C6 PGE A 313 22.031 22.116 35.807 1.00 20.31 C HETATM 3604 C5 PGE A 313 22.500 23.496 35.378 1.00 24.13 C HETATM 3605 O3 PGE A 313 23.721 23.848 36.024 1.00 28.90 O HETATM 0 HO4 PGE A 313 20.183 22.020 35.474 1.00 30.03 H new HETATM 0 HO1 PGE A 313 22.027 29.541 34.383 1.00 15.46 H new HETATM 0 H62 PGE A 313 22.565 21.819 36.560 1.00 20.31 H new HETATM 0 H6 PGE A 313 22.187 21.488 35.084 1.00 20.31 H new HETATM 0 H52 PGE A 313 22.623 23.514 34.416 1.00 24.13 H new HETATM 0 H5 PGE A 313 21.818 24.153 35.589 1.00 24.13 H new HETATM 0 H42 PGE A 313 24.288 25.082 37.464 1.00 28.60 H new HETATM 0 H4 PGE A 313 22.760 25.154 37.160 1.00 28.60 H new HETATM 0 H32 PGE A 313 23.866 25.877 34.861 1.00 29.80 H new HETATM 0 H3 PGE A 313 24.757 26.592 35.923 1.00 29.80 H new HETATM 0 H22 PGE A 313 21.357 26.285 35.049 1.00 22.85 H new HETATM 0 H2 PGE A 313 22.206 27.189 34.104 1.00 22.85 H new HETATM 0 H12 PGE A 313 20.675 28.386 36.176 1.00 21.93 H new HETATM 0 H1 PGE A 313 19.989 28.070 34.812 1.00 21.93 H new HETATM 3606 C1 GOL A 314 23.276 17.496 38.450 1.00 23.20 C HETATM 3607 O1 GOL A 314 24.512 17.699 37.778 1.00 24.70 O HETATM 3608 C2 GOL A 314 22.938 16.026 38.254 1.00 21.10 C HETATM 3609 O2 GOL A 314 24.138 15.227 38.277 1.00 22.25 O HETATM 3610 C3 GOL A 314 22.031 15.642 39.404 1.00 19.38 C HETATM 3611 O3 GOL A 314 21.593 14.304 39.240 1.00 14.72 O HETATM 0 HO3 GOL A 314 22.243 13.782 39.340 1.00 14.72 H new HETATM 0 HO2 GOL A 314 24.771 15.681 38.590 1.00 22.25 H new HETATM 0 HO1 GOL A 314 24.475 18.410 37.332 1.00 24.70 H new HETATM 0 H32 GOL A 314 22.504 15.736 40.246 1.00 19.38 H new HETATM 0 H31 GOL A 314 21.268 16.240 39.439 1.00 19.38 H new HETATM 0 H2 GOL A 314 22.507 15.876 37.398 1.00 21.10 H new HETATM 0 H12 GOL A 314 23.352 17.714 39.392 1.00 23.20 H new HETATM 0 H11 GOL A 314 22.582 18.065 38.082 1.00 23.20 H new HETATM 3612 C1 GOL A 315 -1.574 26.711 59.573 1.00 32.17 C HETATM 3613 O1 GOL A 315 -1.714 27.984 60.213 1.00 32.13 O HETATM 3614 C2 GOL A 315 -2.839 25.875 59.753 1.00 31.56 C HETATM 3615 O2 GOL A 315 -4.009 26.676 59.505 1.00 31.41 O HETATM 3616 C3 GOL A 315 -2.742 24.668 58.818 1.00 29.65 C HETATM 3617 O3 GOL A 315 -4.015 24.220 58.351 1.00 29.24 O HETATM 0 HO3 GOL A 315 -4.093 24.399 57.534 1.00 29.24 H new HETATM 0 HO2 GOL A 315 -4.307 26.508 58.738 1.00 31.41 H new HETATM 0 HO1 GOL A 315 -0.976 28.215 60.542 1.00 32.13 H new HETATM 0 H32 GOL A 315 -2.187 24.899 58.057 1.00 29.65 H new HETATM 0 H31 GOL A 315 -2.299 23.940 59.282 1.00 29.65 H new HETATM 0 H2 GOL A 315 -2.919 25.556 60.666 1.00 31.56 H new HETATM 0 H12 GOL A 315 -1.396 26.837 58.628 1.00 32.17 H new HETATM 0 H11 GOL A 315 -0.813 26.239 59.945 1.00 32.17 H new HETATM 3618 C1 PEG A 316 5.246 42.672 56.962 1.00 41.07 C HETATM 3619 O1 PEG A 316 6.594 42.383 56.571 1.00 39.88 O HETATM 3620 C2 PEG A 316 4.828 41.756 58.107 1.00 41.94 C HETATM 3621 O2 PEG A 316 3.406 41.614 58.085 1.00 44.41 O HETATM 3622 C3 PEG A 316 2.952 40.606 58.988 1.00 43.79 C HETATM 3623 C4 PEG A 316 2.159 41.236 60.127 1.00 46.38 C HETATM 3624 O4 PEG A 316 2.896 41.084 61.347 1.00 48.53 O HETATM 0 HO4 PEG A 316 2.465 41.430 61.980 1.00 48.53 H new HETATM 0 HO1 PEG A 316 7.094 43.020 56.795 1.00 39.88 H new HETATM 0 H42 PEG A 316 2.001 42.176 59.946 1.00 46.38 H new HETATM 0 H41 PEG A 316 1.290 40.812 60.205 1.00 46.38 H new HETATM 0 H32 PEG A 316 2.398 39.965 58.515 1.00 43.79 H new HETATM 0 H31 PEG A 316 3.710 40.117 59.345 1.00 43.79 H new HETATM 0 H22 PEG A 316 5.254 40.889 58.017 1.00 41.94 H new HETATM 0 H21 PEG A 316 5.116 42.126 58.956 1.00 41.94 H new HETATM 0 H12 PEG A 316 5.173 43.599 57.236 1.00 41.07 H new HETATM 0 H11 PEG A 316 4.649 42.551 56.207 1.00 41.07 H new HETATM 3625 C1 EDO A 317 -4.967 35.632 34.748 1.00 25.64 C HETATM 3626 O1 EDO A 317 -4.269 35.603 33.495 1.00 26.19 O HETATM 3627 C2 EDO A 317 -4.325 36.537 35.793 1.00 25.65 C HETATM 3628 O2 EDO A 317 -4.504 37.918 35.481 1.00 28.07 O HETATM 0 HO2 EDO A 317 -5.207 38.199 35.845 1.00 28.07 H new HETATM 0 HO1 EDO A 317 -4.668 35.089 32.964 1.00 26.19 H new HETATM 0 H22 EDO A 317 -4.710 36.350 36.663 1.00 25.65 H new HETATM 0 H21 EDO A 317 -3.377 36.339 35.854 1.00 25.65 H new HETATM 0 H12 EDO A 317 -5.878 35.927 34.594 1.00 25.64 H new HETATM 0 H11 EDO A 317 -5.017 34.730 35.101 1.00 25.64 H new HETATM 3629 S SO4 B 301 23.954 6.505 33.309 1.00 22.36 S HETATM 3630 O1 SO4 B 301 25.283 5.872 33.080 1.00 24.19 O HETATM 3631 O2 SO4 B 301 23.063 6.283 32.133 1.00 23.31 O HETATM 3632 O3 SO4 B 301 23.364 5.853 34.478 1.00 21.05 O HETATM 3633 O4 SO4 B 301 24.075 7.963 33.408 1.00 21.95 O HETATM 3634 C1 EDO B 302 21.839 1.938 37.711 1.00 38.52 C HETATM 3635 O1 EDO B 302 20.468 1.593 37.946 1.00 39.59 O HETATM 3636 C2 EDO B 302 21.917 3.316 37.065 1.00 36.72 C HETATM 3637 O2 EDO B 302 23.225 3.509 36.511 1.00 36.93 O HETATM 0 HO2 EDO B 302 23.205 4.142 35.959 1.00 36.93 H new HETATM 0 HO1 EDO B 302 20.427 0.833 38.301 1.00 39.59 H new HETATM 0 H22 EDO B 302 21.245 3.397 36.370 1.00 36.72 H new HETATM 0 H21 EDO B 302 21.729 4.004 37.723 1.00 36.72 H new HETATM 0 H12 EDO B 302 22.331 1.935 38.547 1.00 38.52 H new HETATM 0 H11 EDO B 302 22.254 1.277 37.135 1.00 38.52 H new HETATM 3638 C1 GOL B 303 17.243 11.857 30.431 1.00 18.24 C HETATM 3639 O1 GOL B 303 16.065 11.145 30.007 1.00 15.33 O HETATM 3640 C2 GOL B 303 18.475 11.573 29.563 1.00 19.80 C HETATM 3641 O2 GOL B 303 18.863 10.189 29.571 1.00 20.27 O HETATM 3642 C3 GOL B 303 18.203 12.005 28.131 1.00 20.81 C HETATM 3643 O3 GOL B 303 19.359 11.702 27.324 1.00 25.96 O HETATM 0 HO3 GOL B 303 19.576 12.380 26.878 1.00 25.96 H new HETATM 0 HO2 GOL B 303 19.095 9.967 30.347 1.00 20.27 H new HETATM 0 HO1 GOL B 303 16.216 10.319 30.021 1.00 15.33 H new HETATM 0 H32 GOL B 303 17.422 11.545 27.785 1.00 20.81 H new HETATM 0 H31 GOL B 303 18.011 12.955 28.098 1.00 20.81 H new HETATM 0 H2 GOL B 303 19.208 12.081 29.944 1.00 19.80 H new HETATM 0 H12 GOL B 303 17.059 12.809 30.417 1.00 18.24 H new HETATM 0 H11 GOL B 303 17.442 11.620 31.350 1.00 18.24 H new HETATM 3644 C1 GOL B 304 4.197 16.595 9.965 1.00 22.86 C HETATM 3645 O1 GOL B 304 2.929 16.920 10.536 1.00 23.55 O HETATM 3646 C2 GOL B 304 4.471 15.108 10.111 1.00 22.62 C HETATM 3647 O2 GOL B 304 3.447 14.378 9.432 1.00 22.58 O HETATM 3648 C3 GOL B 304 5.805 14.782 9.462 1.00 23.22 C HETATM 3649 O3 GOL B 304 5.950 13.365 9.427 1.00 24.23 O HETATM 0 HO3 GOL B 304 6.674 13.166 9.050 1.00 24.23 H new HETATM 0 HO2 GOL B 304 2.795 14.263 9.949 1.00 22.58 H new HETATM 0 HO1 GOL B 304 2.778 16.414 11.189 1.00 23.55 H new HETATM 0 H32 GOL B 304 5.843 15.148 8.564 1.00 23.22 H new HETATM 0 H31 GOL B 304 6.532 15.184 9.963 1.00 23.22 H new HETATM 0 H2 GOL B 304 4.489 14.869 11.051 1.00 22.62 H new HETATM 0 H12 GOL B 304 4.210 16.843 9.027 1.00 22.86 H new HETATM 0 H11 GOL B 304 4.897 17.104 10.403 1.00 22.86 H new HETATM 3650 C TRS B 305 18.032 13.233 21.896 1.00 29.63 C HETATM 3651 C1 TRS B 305 18.682 12.627 23.137 1.00 28.34 C HETATM 3652 C2 TRS B 305 16.519 13.065 21.800 1.00 28.29 C HETATM 3653 C3 TRS B 305 18.646 12.576 20.665 1.00 31.09 C HETATM 3654 N TRS B 305 18.359 14.681 21.918 1.00 31.77 N HETATM 3655 O1 TRS B 305 18.103 13.005 24.397 1.00 21.14 O HETATM 3656 O2 TRS B 305 16.125 11.713 22.025 1.00 24.24 O HETATM 3657 O3 TRS B 305 18.530 13.463 19.557 1.00 34.21 O HETATM 0 HO3 TRS B 305 17.859 13.957 19.662 1.00 34.21 H new HETATM 0 HO2 TRS B 305 16.166 11.285 21.303 1.00 24.24 H new HETATM 0 HO1 TRS B 305 18.620 13.534 24.796 1.00 21.14 H new HETATM 0 HN3 TRS B 305 17.640 15.136 22.044 1.00 31.77 H new HETATM 0 HN2 TRS B 305 18.914 14.840 22.556 1.00 31.77 H new HETATM 0 HN1 TRS B 305 18.713 14.907 21.168 1.00 31.77 H new HETATM 0 H32 TRS B 305 19.579 12.365 20.828 1.00 31.09 H new HETATM 0 H31 TRS B 305 18.195 11.739 20.472 1.00 31.09 H new HETATM 0 H22 TRS B 305 16.087 13.641 22.450 1.00 28.29 H new HETATM 0 H21 TRS B 305 16.216 13.349 20.923 1.00 28.29 H new HETATM 0 H12 TRS B 305 18.645 11.661 23.061 1.00 28.34 H new HETATM 0 H11 TRS B 305 19.620 12.876 23.144 1.00 28.34 H new HETATM 3658 C1 EDO B 306 13.367 21.533 35.895 1.00 17.21 C HETATM 3659 O1 EDO B 306 13.444 20.389 35.034 1.00 24.76 O HETATM 3660 C2 EDO B 306 14.678 22.344 35.804 1.00 15.86 C HETATM 3661 O2 EDO B 306 15.878 21.612 36.262 1.00 16.33 O HETATM 0 HO2 EDO B 306 15.697 21.189 36.965 1.00 16.33 H new HETATM 0 HO1 EDO B 306 14.174 19.993 35.158 1.00 24.76 H new HETATM 0 H22 EDO B 306 14.812 22.620 34.884 1.00 15.86 H new HETATM 0 H21 EDO B 306 14.584 23.152 36.332 1.00 15.86 H new HETATM 0 H12 EDO B 306 12.614 22.089 35.641 1.00 17.21 H new HETATM 0 H11 EDO B 306 13.215 21.250 36.810 1.00 17.21 H new HETATM 3662 C TRS B 307 19.232 2.030 26.977 1.00 30.47 C HETATM 3663 C1 TRS B 307 20.468 1.633 27.775 1.00 33.24 C HETATM 3664 C2 TRS B 307 18.569 3.234 27.606 1.00 27.97 C HETATM 3665 C3 TRS B 307 18.249 0.869 26.915 1.00 30.76 C HETATM 3666 N TRS B 307 19.676 2.365 25.596 1.00 31.95 N HETATM 3667 O1 TRS B 307 20.133 1.242 29.115 1.00 38.23 O HETATM 3668 O2 TRS B 307 18.446 4.294 26.677 1.00 25.64 O HETATM 3669 O3 TRS B 307 17.070 1.308 26.234 1.00 23.81 O HETATM 0 HO3 TRS B 307 17.188 1.251 25.404 1.00 23.81 H new HETATM 0 HO2 TRS B 307 19.088 4.827 26.773 1.00 25.64 H new HETATM 0 HO1 TRS B 307 19.512 1.730 29.403 1.00 38.23 H new HETATM 0 HN3 TRS B 307 19.305 3.099 25.345 1.00 31.95 H new HETATM 0 HN2 TRS B 307 20.531 2.458 25.584 1.00 31.95 H new HETATM 0 HN1 TRS B 307 19.449 1.732 25.060 1.00 31.95 H new HETATM 0 H32 TRS B 307 18.646 0.116 26.450 1.00 30.76 H new HETATM 0 H31 TRS B 307 18.028 0.566 27.810 1.00 30.76 H new HETATM 0 H22 TRS B 307 17.691 2.987 27.937 1.00 27.97 H new HETATM 0 H21 TRS B 307 19.088 3.529 28.371 1.00 27.97 H new HETATM 0 H12 TRS B 307 20.921 0.901 27.328 1.00 33.24 H new HETATM 0 H11 TRS B 307 21.089 2.377 27.801 1.00 33.24 H new HETATM 3670 C1 GOL B 308 24.358 25.821 20.595 1.00 17.58 C HETATM 3671 O1 GOL B 308 24.921 26.606 21.667 1.00 13.81 O HETATM 3672 C2 GOL B 308 23.166 25.003 21.101 1.00 19.84 C HETATM 3673 O2 GOL B 308 22.118 25.872 21.564 1.00 20.92 O HETATM 3674 C3 GOL B 308 22.642 24.135 19.961 1.00 22.63 C HETATM 3675 O3 GOL B 308 21.406 23.529 20.386 1.00 25.54 O HETATM 0 HO3 GOL B 308 21.132 23.910 21.083 1.00 25.54 H new HETATM 0 HO2 GOL B 308 21.826 25.592 22.300 1.00 20.92 H new HETATM 0 HO1 GOL B 308 24.587 27.377 21.656 1.00 13.81 H new HETATM 0 H32 GOL B 308 22.499 24.672 19.166 1.00 22.63 H new HETATM 0 H31 GOL B 308 23.291 23.452 19.730 1.00 22.63 H new HETATM 0 H2 GOL B 308 23.454 24.446 21.841 1.00 19.84 H new HETATM 0 H12 GOL B 308 24.075 26.404 19.874 1.00 17.58 H new HETATM 0 H11 GOL B 308 25.034 25.228 20.231 1.00 17.58 H new HETATM 3676 C1 EDO B 309 36.341 29.294 8.635 1.00 34.33 C HETATM 3677 O1 EDO B 309 35.393 28.394 8.052 1.00 35.96 O HETATM 3678 C2 EDO B 309 35.777 30.709 8.680 1.00 33.83 C HETATM 3679 O2 EDO B 309 34.820 30.821 9.743 1.00 37.27 O HETATM 0 HO2 EDO B 309 34.419 30.089 9.838 1.00 37.27 H new HETATM 0 HO1 EDO B 309 35.717 27.619 8.032 1.00 35.96 H new HETATM 0 H22 EDO B 309 36.495 31.348 8.812 1.00 33.83 H new HETATM 0 H21 EDO B 309 35.357 30.925 7.833 1.00 33.83 H new HETATM 0 H12 EDO B 309 36.564 29.000 9.532 1.00 34.33 H new HETATM 0 H11 EDO B 309 37.163 29.284 8.120 1.00 34.33 H new HETATM 3680 C1 EDO B 310 32.427 20.359 11.469 1.00 31.19 C HETATM 3681 O1 EDO B 310 31.575 21.502 11.627 1.00 29.31 O HETATM 3682 C2 EDO B 310 33.705 20.799 10.767 1.00 31.53 C HETATM 3683 O2 EDO B 310 34.146 22.049 11.311 1.00 31.63 O HETATM 0 HO2 EDO B 310 34.847 21.929 11.758 1.00 31.63 H new HETATM 0 HO1 EDO B 310 30.807 21.321 11.339 1.00 29.31 H new HETATM 0 H22 EDO B 310 34.394 20.126 10.879 1.00 31.53 H new HETATM 0 H21 EDO B 310 33.547 20.888 9.814 1.00 31.53 H new HETATM 0 H12 EDO B 310 32.634 19.971 12.334 1.00 31.19 H new HETATM 0 H11 EDO B 310 31.977 19.673 10.951 1.00 31.19 H new HETATM 3684 C1 EDO B 311 1.055 12.735 43.498 1.00 46.62 C HETATM 3685 O1 EDO B 311 2.282 12.204 42.981 1.00 47.00 O HETATM 3686 C2 EDO B 311 1.016 14.243 43.278 1.00 45.77 C HETATM 3687 O2 EDO B 311 -0.243 14.609 42.687 1.00 48.65 O HETATM 0 HO2 EDO B 311 -0.150 14.689 41.856 1.00 48.65 H new HETATM 0 HO1 EDO B 311 2.384 12.456 42.186 1.00 47.00 H new HETATM 0 H22 EDO B 311 1.135 14.706 44.122 1.00 45.77 H new HETATM 0 H21 EDO B 311 1.747 14.514 42.700 1.00 45.77 H new HETATM 0 H12 EDO B 311 0.300 12.315 43.058 1.00 46.62 H new HETATM 0 H11 EDO B 311 0.979 12.535 44.444 1.00 46.62 H new HETATM 3688 C1 EDO B 312 -9.143 13.404 33.846 1.00 31.84 C HETATM 3689 O1 EDO B 312 -9.043 12.867 35.173 1.00 32.09 O HETATM 3690 C2 EDO B 312 -9.932 14.709 33.878 1.00 33.62 C HETATM 3691 O2 EDO B 312 -9.464 15.506 34.970 1.00 34.61 O HETATM 0 HO2 EDO B 312 -9.893 16.228 34.994 1.00 34.61 H new HETATM 0 HO1 EDO B 312 -9.202 13.472 35.733 1.00 32.09 H new HETATM 0 H22 EDO B 312 -9.822 15.188 33.042 1.00 33.62 H new HETATM 0 H21 EDO B 312 -10.879 14.526 33.978 1.00 33.62 H new HETATM 0 H12 EDO B 312 -8.257 13.560 33.483 1.00 31.84 H new HETATM 0 H11 EDO B 312 -9.580 12.766 33.261 1.00 31.84 H new HETATM 3692 C1 PEG B 313 -0.028 10.294 40.794 1.00 35.12 C HETATM 3693 O1 PEG B 313 1.380 10.119 40.576 1.00 37.78 O HETATM 3694 C2 PEG B 313 -0.771 10.192 39.464 1.00 32.91 C HETATM 3695 O2 PEG B 313 -1.906 11.070 39.442 1.00 31.61 O HETATM 3696 C3 PEG B 313 -2.756 10.849 38.315 1.00 27.98 C HETATM 3697 C4 PEG B 313 -2.523 11.863 37.203 1.00 25.83 C HETATM 3698 O4 PEG B 313 -1.991 11.235 36.031 1.00 21.98 O HETATM 0 HO4 PEG B 313 -2.192 11.689 35.354 1.00 21.98 H new HETATM 0 HO1 PEG B 313 1.734 10.864 40.420 1.00 37.78 H new HETATM 0 H42 PEG B 313 -3.358 12.305 36.985 1.00 25.83 H new HETATM 0 H41 PEG B 313 -1.911 12.549 37.511 1.00 25.83 H new HETATM 0 H32 PEG B 313 -2.606 9.955 37.970 1.00 27.98 H new HETATM 0 H31 PEG B 313 -3.683 10.892 38.599 1.00 27.98 H new HETATM 0 H22 PEG B 313 -0.170 10.416 38.736 1.00 32.91 H new HETATM 0 H21 PEG B 313 -1.062 9.278 39.321 1.00 32.91 H new HETATM 0 H12 PEG B 313 -0.355 9.620 41.410 1.00 35.12 H new HETATM 0 H11 PEG B 313 -0.196 11.157 41.203 1.00 35.12 H new HETATM 3699 O HOH A 401 21.171 50.624 26.163 1.00 26.51 O HETATM 3700 O HOH A 402 16.444 33.989 36.475 1.00 8.60 O HETATM 3701 O HOH A 403 19.986 33.793 29.282 1.00 10.27 O HETATM 3702 O HOH A 404 24.609 32.106 40.617 1.00 16.88 O HETATM 3703 O HOH A 405 22.164 25.511 28.522 1.00 10.07 O HETATM 3704 O HOH A 406 1.121 29.112 50.170 1.00 10.37 O HETATM 3705 O HOH A 407 13.916 32.355 28.973 1.00 12.93 O HETATM 3706 O HOH A 408 -6.740 38.957 36.601 1.00 28.37 O HETATM 3707 O HOH A 409 -0.756 22.324 30.657 1.00 14.37 O HETATM 3708 O HOH A 410 20.604 30.799 42.455 1.00 15.09 O HETATM 3709 O HOH A 411 12.840 28.720 33.218 1.00 10.70 O HETATM 3710 O HOH A 412 21.941 21.005 38.445 1.00 15.77 O HETATM 3711 O HOH A 413 15.246 36.665 61.976 1.00 22.64 O HETATM 3712 O HOH A 414 5.961 41.918 43.505 1.00 18.59 O HETATM 3713 O HOH A 415 12.667 40.131 35.830 1.00 19.33 O HETATM 3714 O HOH A 416 23.952 30.271 33.388 1.00 13.43 O HETATM 3715 O HOH A 417 26.108 19.313 39.953 1.00 32.27 O HETATM 3716 O HOH A 418 -5.873 37.676 40.795 1.00 16.57 O HETATM 3717 O HOH A 419 6.993 39.471 38.293 1.00 19.91 O HETATM 3718 O HOH A 420 15.644 34.433 29.063 1.00 13.08 O HETATM 3719 O HOH A 421 13.940 42.046 43.302 1.00 27.21 O HETATM 3720 O HOH A 422 12.715 16.419 41.491 1.00 12.56 O HETATM 3721 O HOH A 423 36.573 19.861 27.647 1.00 13.85 O HETATM 3722 O HOH A 424 20.047 46.030 25.653 1.00 17.24 O HETATM 3723 O HOH A 425 4.797 41.930 40.661 1.00 19.14 O HETATM 3724 O HOH A 426 32.049 23.083 41.180 1.00 18.53 O HETATM 3725 O HOH A 427 16.095 33.846 46.639 1.00 17.63 O HETATM 3726 O HOH A 428 7.943 25.295 61.257 1.00 19.33 O HETATM 3727 O HOH A 429 24.019 20.616 23.586 1.00 28.01 O HETATM 3728 O HOH A 430 13.974 29.981 48.816 1.00 19.67 O HETATM 3729 O HOH A 431 43.098 21.169 26.668 1.00 18.61 O HETATM 3730 O HOH A 432 0.492 14.480 47.834 1.00 18.75 O HETATM 3731 O HOH A 433 43.132 26.593 21.894 1.00 21.20 O HETATM 3732 O HOH A 434 44.082 19.147 28.016 1.00 36.55 O HETATM 3733 O HOH A 435 37.961 19.852 16.874 1.00 19.50 O HETATM 3734 O HOH A 436 42.784 24.104 16.814 1.00 16.73 O HETATM 3735 O HOH A 437 10.029 11.743 50.472 1.00 30.30 O HETATM 3736 O HOH A 438 9.746 33.259 29.605 1.00 17.38 O HETATM 3737 O HOH A 439 -6.564 23.365 43.724 1.00 27.66 O HETATM 3738 O HOH A 440 24.638 32.161 35.347 1.00 16.70 O HETATM 3739 O HOH A 441 42.046 21.576 31.671 1.00 20.02 O HETATM 3740 O HOH A 442 10.857 33.250 52.047 1.00 20.20 O HETATM 3741 O HOH A 443 12.152 9.587 44.879 1.00 18.41 O HETATM 3742 O HOH A 444 0.171 29.769 30.127 1.00 20.84 O HETATM 3743 O HOH A 445 8.657 14.198 50.657 1.00 19.29 O HETATM 3744 O HOH A 446 1.761 14.174 53.946 1.00 35.03 O HETATM 3745 O HOH A 447 15.855 42.053 28.891 1.00 18.13 O HETATM 3746 O HOH A 448 6.896 38.425 61.060 1.00 18.79 O HETATM 3747 O HOH A 449 41.057 34.095 28.717 1.00 18.88 O HETATM 3748 O HOH A 450 -1.979 41.143 37.832 1.00 37.05 O HETATM 3749 O HOH A 451 0.488 26.292 63.610 1.00 26.74 O HETATM 3750 O HOH A 452 2.864 36.395 31.482 1.00 29.88 O HETATM 3751 O HOH A 453 -7.264 26.003 36.391 1.00 18.72 O HETATM 3752 O HOH A 454 15.101 40.651 39.381 1.00 19.41 O HETATM 3753 O HOH A 455 16.022 25.732 49.313 1.00 28.62 O HETATM 3754 O HOH A 456 25.998 31.568 37.493 1.00 34.58 O HETATM 3755 O HOH A 457 37.643 17.653 26.296 1.00 24.23 O HETATM 3756 O HOH A 458 11.770 35.365 53.484 1.00 15.82 O HETATM 3757 O HOH A 459 13.332 40.087 41.365 1.00 17.68 O HETATM 3758 O HOH A 460 -1.543 38.120 58.179 1.00 29.79 O HETATM 3759 O HOH A 461 -6.093 24.260 51.936 1.00 25.87 O HETATM 3760 O HOH A 462 3.030 42.874 47.839 1.00 20.72 O HETATM 3761 O HOH A 463 38.219 41.890 36.083 1.00 26.61 O HETATM 3762 O HOH A 464 16.483 36.567 47.343 1.00 22.01 O HETATM 3763 O HOH A 465 40.818 22.503 17.634 1.00 22.13 O HETATM 3764 O HOH A 466 10.891 40.702 40.013 1.00 18.84 O HETATM 3765 O HOH A 467 0.715 44.631 47.510 1.00 31.27 O HETATM 3766 O HOH A 468 -4.620 23.668 45.539 1.00 25.75 O HETATM 3767 O HOH A 469 27.034 26.579 42.359 1.00 31.63 O HETATM 3768 O HOH A 470 4.375 18.414 53.952 1.00 19.85 O HETATM 3769 O HOH A 471 12.704 16.542 56.325 1.00 42.97 O HETATM 3770 O HOH A 472 -4.393 23.808 54.070 1.00 20.50 O HETATM 3771 O HOH A 473 0.531 13.711 50.776 1.00 27.10 O HETATM 3772 O HOH A 474 -10.642 29.093 51.109 1.00 24.00 O HETATM 3773 O HOH A 475 16.843 42.582 40.509 1.00 20.14 O HETATM 3774 O HOH A 476 -1.768 13.036 46.990 1.00 29.68 O HETATM 3775 O HOH A 477 41.936 31.045 20.888 1.00 23.92 O HETATM 3776 O HOH A 478 26.998 28.908 40.635 1.00 19.78 O HETATM 3777 O HOH A 479 -8.132 36.859 49.688 1.00 31.38 O HETATM 3778 O HOH A 480 -0.910 36.017 61.817 1.00 47.43 O HETATM 3779 O HOH A 481 29.519 13.839 28.724 1.00 41.11 O HETATM 3780 O HOH A 482 41.765 29.983 30.740 1.00 25.32 O HETATM 3781 O HOH A 483 18.231 39.949 54.626 1.00 30.78 O HETATM 3782 O HOH A 484 30.472 14.646 23.548 1.00 32.09 O HETATM 3783 O HOH A 485 19.863 20.837 24.491 1.00 20.31 O HETATM 3784 O HOH A 486 -2.123 34.251 59.774 1.00 21.60 O HETATM 3785 O HOH A 487 -1.126 38.857 37.231 1.00 29.03 O HETATM 3786 O HOH A 488 -7.506 24.831 41.768 1.00 22.23 O HETATM 3787 O HOH A 489 41.987 29.554 23.272 1.00 23.89 O HETATM 3788 O HOH A 490 20.089 39.247 57.831 1.00 38.57 O HETATM 3789 O HOH A 491 -6.465 31.803 56.891 1.00 25.12 O HETATM 3790 O HOH A 492 15.810 40.605 53.833 1.00 26.89 O HETATM 3791 O HOH A 493 23.762 48.540 33.218 1.00 22.33 O HETATM 3792 O HOH A 494 33.368 45.137 44.119 1.00 44.74 O HETATM 3793 O HOH A 495 42.197 37.445 25.674 1.00 31.70 O HETATM 3794 O HOH A 496 43.314 32.902 24.896 1.00 29.76 O HETATM 3795 O HOH A 497 36.855 17.463 17.665 1.00 28.52 O HETATM 3796 O HOH A 498 17.152 45.229 35.302 1.00 28.54 O HETATM 3797 O HOH A 499 15.924 42.735 35.520 1.00 24.96 O HETATM 3798 O HOH A 500 13.976 41.521 33.749 1.00 26.47 O HETATM 3799 O HOH A 501 13.097 39.516 31.545 1.00 26.70 O HETATM 3800 O HOH A 502 24.382 27.657 33.425 1.00 19.52 O HETATM 3801 O HOH A 503 8.220 9.264 43.322 1.00 26.40 O HETATM 3802 O HOH A 504 2.485 13.904 46.079 1.00 33.72 O HETATM 3803 O HOH A 505 4.886 12.729 46.292 1.00 35.56 O HETATM 3804 O HOH A 506 5.078 11.599 48.624 1.00 33.23 O HETATM 3805 O HOH A 507 26.383 15.334 36.461 1.00 18.27 O HETATM 3806 O HOH A 508 19.277 49.068 32.171 1.00 24.75 O HETATM 3807 O HOH A 509 23.224 50.170 30.807 1.00 30.59 O HETATM 3808 O HOH A 510 26.848 26.309 33.673 1.00 24.58 O HETATM 3809 O HOH A 511 25.334 21.358 29.300 1.00 22.74 O HETATM 3810 O HOH A 512 33.775 15.415 26.588 1.00 24.32 O HETATM 3811 O HOH A 513 42.180 18.010 27.055 1.00 30.93 O HETATM 3812 O HOH A 514 40.210 17.359 25.363 1.00 30.44 O HETATM 3813 O HOH A 515 37.037 26.570 33.187 1.00 15.01 O HETATM 3814 O HOH A 516 38.557 36.617 37.078 1.00 30.36 O HETATM 3815 O HOH A 517 37.579 30.511 34.648 1.00 25.09 O HETATM 3816 O HOH A 518 42.985 22.298 29.063 1.00 24.53 O HETATM 3817 O HOH A 519 39.161 32.345 35.695 1.00 35.52 O HETATM 3818 O HOH A 520 39.563 35.078 35.045 1.00 25.56 O HETATM 3819 O HOH A 521 39.340 39.509 37.203 1.00 37.77 O HETATM 3820 O HOH A 522 32.716 47.709 40.640 1.00 37.59 O HETATM 3821 O HOH A 523 33.002 42.396 41.304 1.00 23.59 O HETATM 3822 O HOH A 524 33.954 45.124 41.209 1.00 35.03 O HETATM 3823 O HOH A 525 35.775 36.148 43.429 1.00 35.69 O HETATM 3824 O HOH A 526 -10.360 27.078 54.177 1.00 30.17 O HETATM 3825 O HOH A 527 -6.214 22.223 55.482 1.00 27.74 O HETATM 3826 O HOH A 528 5.308 17.349 60.886 1.00 39.34 O HETATM 3827 O HOH A 529 2.459 31.056 64.981 1.00 37.92 O HETATM 3828 O HOH A 530 -5.686 29.676 58.430 1.00 32.75 O HETATM 3829 O HOH A 531 -9.731 37.068 52.460 1.00 35.30 O HETATM 3830 O HOH A 532 0.178 28.433 61.878 1.00 37.83 O HETATM 3831 O HOH A 533 1.417 30.942 62.340 1.00 31.67 O HETATM 3832 O HOH A 534 -3.601 30.142 60.457 1.00 33.91 O HETATM 3833 O HOH A 535 15.419 30.893 55.067 1.00 35.83 O HETATM 3834 O HOH A 536 6.953 29.507 67.133 1.00 33.72 O HETATM 3835 O HOH A 537 2.040 43.330 55.774 1.00 52.22 O HETATM 3836 O HOH A 538 13.822 19.338 49.346 1.00 23.25 O HETATM 3837 O HOH A 539 13.298 23.526 53.703 1.00 26.69 O HETATM 3838 O HOH A 540 13.793 24.015 58.023 1.00 39.75 O HETATM 3839 O HOH A 541 15.919 23.041 49.177 1.00 31.32 O HETATM 3840 O HOH A 542 11.988 19.319 59.881 1.00 41.56 O HETATM 3841 O HOH A 543 9.361 20.774 60.718 1.00 28.36 O HETATM 3842 O HOH A 544 9.594 23.166 62.171 1.00 40.26 O HETATM 3843 O HOH A 545 11.165 23.211 64.642 1.00 54.59 O HETATM 3844 O HOH A 546 6.022 21.143 64.028 1.00 36.21 O HETATM 3845 O HOH A 547 -2.255 12.410 51.885 1.00 49.58 O HETATM 3846 O HOH A 548 -6.460 13.077 46.231 1.00 28.72 O HETATM 3847 O HOH A 549 -3.581 21.044 33.915 1.00 31.35 O HETATM 3848 O HOH A 550 -5.214 23.644 33.173 1.00 23.14 O HETATM 3849 O HOH A 551 -4.204 19.777 36.465 1.00 39.94 O HETATM 3850 O HOH A 552 6.059 39.357 31.140 1.00 34.66 O HETATM 3851 O HOH A 553 6.494 40.056 33.932 1.00 37.72 O HETATM 3852 O HOH A 554 -0.146 39.018 34.580 1.00 32.00 O HETATM 3853 O HOH A 555 -0.837 32.666 29.947 1.00 37.40 O HETATM 3854 O HOH A 556 8.402 41.071 36.744 1.00 33.33 O HETATM 3855 O HOH A 557 -0.745 14.568 58.696 1.00 36.16 O HETATM 3856 O HOH A 558 0.535 12.369 55.914 1.00 47.97 O HETATM 3857 O HOH A 559 -2.513 19.017 63.541 1.00 40.80 O HETATM 3858 O HOH A 560 -6.487 19.358 56.743 1.00 41.65 O HETATM 3859 O HOH A 561 -4.787 39.516 55.027 1.00 25.61 O HETATM 3860 O HOH A 562 -3.439 44.739 45.820 1.00 36.19 O HETATM 3861 O HOH A 563 -1.894 43.291 47.838 1.00 27.93 O HETATM 3862 O HOH A 564 -3.601 41.979 44.781 1.00 30.14 O HETATM 3863 O HOH A 565 6.675 46.220 42.267 1.00 47.63 O HETATM 3864 O HOH A 566 9.227 42.379 40.764 1.00 29.90 O HETATM 3865 O HOH A 567 -11.099 26.642 44.136 1.00 43.51 O HETATM 3866 O HOH A 568 -12.312 30.171 46.485 1.00 36.71 O HETATM 3867 O HOH A 569 -10.729 28.587 48.281 1.00 27.85 O HETATM 3868 O HOH A 570 -14.781 32.858 41.568 1.00 39.95 O HETATM 3869 O HOH A 571 -10.329 27.673 32.943 1.00 39.46 O HETATM 3870 O HOH A 572 -6.793 29.532 30.364 1.00 30.80 O HETATM 3871 O HOH A 573 1.346 32.869 28.114 1.00 49.84 O HETATM 3872 O HOH A 574 -1.276 24.750 29.400 1.00 31.74 O HETATM 3873 O HOH A 575 -3.400 26.247 30.350 1.00 27.93 O HETATM 3874 O HOH A 576 25.029 37.739 48.844 1.00 33.41 O HETATM 3875 O HOH A 577 26.979 29.162 44.125 1.00 23.27 O HETATM 3876 O HOH A 578 15.940 28.152 47.628 1.00 29.74 O HETATM 3877 O HOH A 579 32.319 31.832 47.683 1.00 38.34 O HETATM 3878 O HOH A 580 19.252 48.255 24.199 1.00 37.03 O HETATM 3879 O HOH A 581 15.794 44.465 25.608 1.00 31.36 O HETATM 3880 O HOH A 582 28.503 29.148 37.166 1.00 25.14 O HETATM 3881 O HOH A 583 26.907 26.883 37.029 1.00 30.64 O HETATM 3882 O HOH A 584 26.468 24.093 35.521 1.00 35.35 O HETATM 3883 O HOH A 585 41.623 35.533 30.726 1.00 33.65 O HETATM 3884 O HOH A 586 -4.304 25.569 47.400 1.00 26.61 O HETATM 3885 O HOH A 587 12.898 22.060 60.096 1.00 33.27 O HETATM 3886 O HOH A 588 17.761 25.474 58.848 1.00 39.23 O HETATM 3887 O HOH A 589 15.268 24.943 60.189 1.00 42.42 O HETATM 3888 O HOH A 590 -4.222 21.565 58.895 1.00 32.25 O HETATM 3889 O HOH A 591 15.784 24.483 63.568 1.00 41.25 O HETATM 3890 O HOH A 592 18.418 28.224 45.830 1.00 36.69 O HETATM 3891 O HOH A 593 14.342 26.804 51.036 1.00 33.60 O HETATM 3892 O HOH A 594 -4.753 35.821 58.650 1.00 35.47 O HETATM 3893 O HOH A 595 -2.797 40.399 56.966 1.00 43.24 O HETATM 3894 O HOH A 596 -0.713 42.583 54.997 1.00 42.77 O HETATM 3895 O HOH A 597 -1.047 45.182 51.634 1.00 32.08 O HETATM 3896 O HOH A 598 2.737 43.542 39.995 1.00 29.46 O HETATM 3897 O HOH A 599 0.123 43.747 40.653 1.00 39.88 O HETATM 3898 O HOH A 600 10.262 40.105 31.500 1.00 30.61 O HETATM 3899 O HOH A 601 24.523 18.133 22.264 1.00 38.46 O HETATM 3900 O HOH A 602 28.956 51.528 41.899 1.00 44.29 O HETATM 3901 O HOH A 603 17.362 47.104 37.481 1.00 56.65 O HETATM 3902 O HOH A 604 10.145 38.832 28.956 1.00 45.53 O HETATM 3903 O HOH A 605 3.168 31.319 24.975 1.00 47.09 O HETATM 3904 O HOH A 606 -3.693 22.083 36.845 1.00 31.86 O HETATM 3905 O HOH A 607 48.293 26.286 24.610 1.00 36.37 O HETATM 3906 O HOH A 608 35.561 41.469 47.941 1.00 39.72 O HETATM 3907 O HOH A 609 36.075 35.652 40.810 1.00 34.69 O HETATM 3908 O HOH A 610 -6.881 23.758 48.717 1.00 42.96 O HETATM 3909 O HOH A 611 -4.835 25.071 49.673 1.00 29.29 O HETATM 3910 O HOH A 612 -7.096 18.991 42.124 1.00 43.47 O HETATM 3911 O HOH A 613 -13.728 29.651 42.109 1.00 34.11 O HETATM 3912 O HOH A 614 -8.735 21.504 49.259 1.00 34.21 O HETATM 3913 O HOH A 615 -9.311 26.570 51.294 1.00 31.64 O HETATM 3914 O HOH A 616 9.577 40.355 65.197 1.00 43.57 O HETATM 3915 O HOH A 617 13.229 35.565 64.563 1.00 32.58 O HETATM 3916 O HOH A 618 13.830 39.577 52.651 1.00 30.50 O HETATM 3917 O HOH A 619 2.727 16.229 61.790 1.00 45.08 O HETATM 3918 O HOH A 620 7.218 19.430 61.970 1.00 43.03 O HETATM 3919 O HOH A 621 -9.595 24.670 37.996 1.00 39.86 O HETATM 3920 O HOH A 622 -9.337 24.944 34.628 1.00 36.14 O HETATM 3921 O HOH A 623 6.206 38.650 26.171 1.00 46.94 O HETATM 3922 O HOH A 624 3.274 40.538 30.123 1.00 43.28 O HETATM 3923 O HOH A 625 15.307 26.964 66.018 1.00 44.32 O HETATM 3924 O HOH A 626 10.616 27.345 68.305 1.00 35.23 O HETATM 3925 O HOH A 627 2.737 44.359 36.837 1.00 41.22 O HETATM 3926 O HOH A 628 3.231 45.848 41.586 1.00 45.38 O HETATM 3927 O HOH A 629 4.532 45.512 44.230 1.00 44.54 O HETATM 3928 O HOH A 630 42.391 34.769 26.550 1.00 31.78 O HETATM 3929 O HOH A 631 27.565 43.204 46.906 1.00 42.68 O HETATM 3930 O HOH A 632 17.494 38.220 23.539 1.00 48.22 O HETATM 3931 O HOH A 633 3.721 29.893 27.048 1.00 34.82 O HETATM 3932 O HOH A 634 21.960 49.394 23.492 1.00 37.79 O HETATM 3933 O HOH A 635 44.439 28.238 28.360 1.00 33.20 O HETATM 3934 O HOH A 636 45.440 29.789 26.719 1.00 34.05 O HETATM 3935 O HOH A 637 38.463 43.852 38.168 1.00 46.86 O HETATM 3936 O HOH A 638 19.104 35.858 53.596 1.00 42.18 O HETATM 3937 O HOH A 639 16.273 43.584 52.384 1.00 39.19 O HETATM 3938 O HOH B 401 17.605 9.160 37.160 1.00 7.52 O HETATM 3939 O HOH B 402 17.755 40.577 46.226 1.00 26.53 O HETATM 3940 O HOH B 403 15.259 5.676 42.362 1.00 37.38 O HETATM 3941 O HOH B 404 13.234 26.820 31.033 1.00 9.48 O HETATM 3942 O HOH B 405 5.986 12.563 19.912 1.00 9.21 O HETATM 3943 O HOH B 406 25.958 22.270 19.862 1.00 14.42 O HETATM 3944 O HOH B 407 -1.604 19.274 37.790 1.00 12.96 O HETATM 3945 O HOH B 408 19.903 33.185 41.167 1.00 10.72 O HETATM 3946 O HOH B 409 -3.937 14.843 37.811 1.00 29.48 O HETATM 3947 O HOH B 410 25.716 22.539 22.560 1.00 10.97 O HETATM 3948 O HOH B 411 44.479 19.625 11.183 1.00 12.14 O HETATM 3949 O HOH B 412 40.717 22.473 11.396 1.00 12.62 O HETATM 3950 O HOH B 413 8.032 26.428 16.375 1.00 28.68 O HETATM 3951 O HOH B 414 12.854 14.970 39.002 1.00 13.34 O HETATM 3952 O HOH B 415 23.937 12.842 39.630 1.00 9.90 O HETATM 3953 O HOH B 416 38.533 49.102 24.049 1.00 15.28 O HETATM 3954 O HOH B 417 25.300 25.041 23.966 1.00 12.64 O HETATM 3955 O HOH B 418 10.663 9.358 42.207 1.00 16.59 O HETATM 3956 O HOH B 419 21.619 31.352 22.490 1.00 13.70 O HETATM 3957 O HOH B 420 -2.275 16.668 38.340 1.00 25.40 O HETATM 3958 O HOH B 421 19.936 16.875 24.677 1.00 22.41 O HETATM 3959 O HOH B 422 8.918 35.144 21.236 1.00 46.91 O HETATM 3960 O HOH B 423 14.268 2.641 37.022 1.00 18.50 O HETATM 3961 O HOH B 424 11.811 -1.186 23.825 1.00 21.63 O HETATM 3962 O HOH B 425 -2.444 3.737 27.597 1.00 16.48 O HETATM 3963 O HOH B 426 44.656 39.432 30.179 1.00 39.56 O HETATM 3964 O HOH B 427 13.988 10.983 43.224 1.00 12.82 O HETATM 3965 O HOH B 428 16.269 -0.515 15.848 1.00 28.46 O HETATM 3966 O HOH B 429 30.865 18.054 20.991 1.00 16.07 O HETATM 3967 O HOH B 430 34.442 54.183 27.413 1.00 18.65 O HETATM 3968 O HOH B 431 18.462 15.182 28.728 1.00 20.98 O HETATM 3969 O HOH B 432 22.182 9.794 33.511 1.00 17.41 O HETATM 3970 O HOH B 433 17.900 7.455 19.711 1.00 15.11 O HETATM 3971 O HOH B 434 9.498 2.856 33.147 1.00 15.72 O HETATM 3972 O HOH B 435 -0.225 18.723 12.469 1.00 23.45 O HETATM 3973 O HOH B 436 -6.663 6.150 32.396 1.00 15.69 O HETATM 3974 O HOH B 437 1.195 17.255 14.444 1.00 16.56 O HETATM 3975 O HOH B 438 2.447 19.434 9.802 1.00 23.22 O HETATM 3976 O HOH B 439 15.981 9.479 20.352 1.00 18.82 O HETATM 3977 O HOH B 440 -0.266 12.884 38.927 1.00 21.10 O HETATM 3978 O HOH B 441 40.614 35.257 15.927 1.00 14.37 O HETATM 3979 O HOH B 442 6.046 7.220 9.935 1.00 17.87 O HETATM 3980 O HOH B 443 23.158 34.254 47.596 1.00 23.53 O HETATM 3981 O HOH B 444 28.767 51.604 37.237 1.00 25.84 O HETATM 3982 O HOH B 445 -11.525 11.313 32.709 1.00 14.30 O HETATM 3983 O HOH B 446 36.670 32.132 11.677 1.00 21.17 O HETATM 3984 O HOH B 447 -0.881 16.403 16.085 1.00 19.87 O HETATM 3985 O HOH B 448 3.162 27.169 21.220 1.00 19.29 O HETATM 3986 O HOH B 449 10.074 0.362 27.828 1.00 16.54 O HETATM 3987 O HOH B 450 -6.747 4.082 25.638 1.00 36.40 O HETATM 3988 O HOH B 451 22.349 5.825 12.510 1.00 23.02 O HETATM 3989 O HOH B 452 -4.039 13.131 12.848 1.00 26.25 O HETATM 3990 O HOH B 453 1.058 8.998 11.571 1.00 21.58 O HETATM 3991 O HOH B 454 4.215 -1.875 21.380 1.00 18.94 O HETATM 3992 O HOH B 455 24.365 38.671 15.830 1.00 20.25 O HETATM 3993 O HOH B 456 41.440 36.734 22.896 1.00 16.63 O HETATM 3994 O HOH B 457 1.899 11.182 10.213 1.00 21.57 O HETATM 3995 O HOH B 458 21.822 44.004 19.019 1.00 24.70 O HETATM 3996 O HOH B 459 -4.766 11.088 15.887 1.00 19.86 O HETATM 3997 O HOH B 460 27.172 33.143 14.209 1.00 18.07 O HETATM 3998 O HOH B 461 30.405 41.414 14.083 1.00 19.59 O HETATM 3999 O HOH B 462 19.889 26.343 43.529 1.00 18.52 O HETATM 4000 O HOH B 463 11.937 28.280 20.840 1.00 19.93 O HETATM 4001 O HOH B 464 16.719 23.066 24.119 1.00 21.20 O HETATM 4002 O HOH B 465 -5.946 15.030 31.110 1.00 18.73 O HETATM 4003 O HOH B 466 -5.046 17.592 34.743 1.00 19.81 O HETATM 4004 O HOH B 467 4.338 27.999 18.661 1.00 27.12 O HETATM 4005 O HOH B 468 21.673 2.784 20.486 1.00 31.56 O HETATM 4006 O HOH B 469 17.457 26.663 16.848 1.00 26.83 O HETATM 4007 O HOH B 470 34.493 52.190 22.785 1.00 32.79 O HETATM 4008 O HOH B 471 6.145 3.086 11.609 1.00 17.49 O HETATM 4009 O HOH B 472 38.440 46.222 32.702 1.00 29.89 O HETATM 4010 O HOH B 473 23.094 25.164 25.768 1.00 18.06 O HETATM 4011 O HOH B 474 30.561 27.999 10.904 1.00 20.55 O HETATM 4012 O HOH B 475 20.515 18.774 45.316 1.00 20.48 O HETATM 4013 O HOH B 476 18.027 34.699 27.609 1.00 17.70 O HETATM 4014 O HOH B 477 19.622 14.447 26.020 1.00 25.34 O HETATM 4015 O HOH B 478 31.594 53.021 34.893 1.00 42.27 O HETATM 4016 O HOH B 479 -4.667 20.280 24.538 1.00 32.35 O HETATM 4017 O HOH B 480 18.599 37.942 46.467 1.00 22.69 O HETATM 4018 O HOH B 481 -1.675 3.818 18.680 1.00 24.68 O HETATM 4019 O HOH B 482 41.944 38.946 29.275 1.00 20.37 O HETATM 4020 O HOH B 483 8.993 15.317 6.607 1.00 21.39 O HETATM 4021 O HOH B 484 13.752 1.974 32.677 1.00 18.83 O HETATM 4022 O HOH B 485 -2.810 20.261 31.188 1.00 25.75 O HETATM 4023 O HOH B 486 13.743 9.216 6.991 1.00 23.57 O HETATM 4024 O HOH B 487 20.097 31.157 46.372 1.00 24.41 O HETATM 4025 O HOH B 488 8.778 -0.885 22.711 1.00 28.02 O HETATM 4026 O HOH B 489 -0.138 15.991 18.859 1.00 20.82 O HETATM 4027 O HOH B 490 28.708 53.217 34.462 1.00 37.48 O HETATM 4028 O HOH B 491 27.465 18.520 22.175 1.00 18.45 O HETATM 4029 O HOH B 492 -1.849 -0.932 15.243 1.00 38.90 O HETATM 4030 O HOH B 493 32.220 55.468 28.552 1.00 25.64 O HETATM 4031 O HOH B 494 18.338 32.522 47.832 1.00 35.86 O HETATM 4032 O HOH B 495 41.738 16.083 10.549 1.00 37.29 O HETATM 4033 O HOH B 496 18.886 42.181 44.480 1.00 22.61 O HETATM 4034 O HOH B 497 10.144 11.050 8.301 1.00 27.92 O HETATM 4035 O HOH B 498 3.160 1.496 13.838 1.00 20.53 O HETATM 4036 O HOH B 499 27.274 10.142 32.490 1.00 44.31 O HETATM 4037 O HOH B 500 23.364 8.412 29.724 1.00 36.78 O HETATM 4038 O HOH B 501 16.501 2.674 32.039 1.00 27.39 O HETATM 4039 O HOH B 502 -7.274 13.188 22.585 1.00 37.54 O HETATM 4040 O HOH B 503 27.994 36.034 14.131 1.00 28.52 O HETATM 4041 O HOH B 504 12.426 0.172 31.323 1.00 25.77 O HETATM 4042 O HOH B 505 38.314 51.356 22.463 1.00 27.89 O HETATM 4043 O HOH B 506 34.299 54.539 24.551 1.00 29.53 O HETATM 4044 O HOH B 507 31.571 52.442 21.286 1.00 35.73 O HETATM 4045 O HOH B 508 36.932 54.908 28.620 1.00 33.12 O HETATM 4046 O HOH B 509 40.720 41.676 32.853 1.00 32.77 O HETATM 4047 O HOH B 510 42.852 34.583 22.778 1.00 26.06 O HETATM 4048 O HOH B 511 43.939 22.575 14.501 1.00 32.93 O HETATM 4049 O HOH B 512 42.890 19.930 14.949 1.00 32.56 O HETATM 4050 O HOH B 513 29.365 32.393 12.838 1.00 32.88 O HETATM 4051 O HOH B 514 30.812 34.800 11.939 1.00 43.87 O HETATM 4052 O HOH B 515 33.568 35.114 12.368 1.00 29.11 O HETATM 4053 O HOH B 516 29.118 21.323 10.763 1.00 34.97 O HETATM 4054 O HOH B 517 40.361 20.990 15.435 1.00 23.13 O HETATM 4055 O HOH B 518 43.070 16.866 14.813 1.00 39.94 O HETATM 4056 O HOH B 519 28.661 16.288 21.464 1.00 25.45 O HETATM 4057 O HOH B 520 33.204 22.751 8.174 1.00 34.09 O HETATM 4058 O HOH B 521 27.546 22.383 12.827 1.00 24.69 O HETATM 4059 O HOH B 522 35.051 17.713 19.956 1.00 22.13 O HETATM 4060 O HOH B 523 22.616 32.904 18.928 1.00 21.64 O HETATM 4061 O HOH B 524 23.227 31.457 16.207 1.00 37.37 O HETATM 4062 O HOH B 525 21.307 28.003 19.899 1.00 22.94 O HETATM 4063 O HOH B 526 24.325 27.889 16.543 1.00 20.92 O HETATM 4064 O HOH B 527 25.723 37.530 13.681 1.00 37.40 O HETATM 4065 O HOH B 528 29.291 43.388 15.991 1.00 25.53 O HETATM 4066 O HOH B 529 24.614 41.481 15.509 1.00 29.42 O HETATM 4067 O HOH B 530 29.106 49.545 19.204 1.00 28.61 O HETATM 4068 O HOH B 531 23.131 36.893 47.033 1.00 22.57 O HETATM 4069 O HOH B 532 -5.647 11.564 18.595 1.00 35.41 O HETATM 4070 O HOH B 533 6.809 9.838 8.685 1.00 35.48 O HETATM 4071 O HOH B 534 4.353 11.279 8.726 1.00 25.87 O HETATM 4072 O HOH B 535 0.172 6.879 9.786 1.00 37.65 O HETATM 4073 O HOH B 536 18.986 32.955 25.218 1.00 36.21 O HETATM 4074 O HOH B 537 20.007 33.629 22.855 1.00 25.67 O HETATM 4075 O HOH B 538 6.516 29.646 23.782 1.00 27.96 O HETATM 4076 O HOH B 539 11.970 7.050 42.575 1.00 38.55 O HETATM 4077 O HOH B 540 5.913 8.867 41.634 1.00 21.11 O HETATM 4078 O HOH B 541 1.920 6.176 41.728 1.00 32.30 O HETATM 4079 O HOH B 542 4.732 10.660 43.596 1.00 32.50 O HETATM 4080 O HOH B 543 3.239 14.814 6.891 1.00 36.68 O HETATM 4081 O HOH B 544 14.771 20.044 37.422 1.00 19.71 O HETATM 4082 O HOH B 545 -0.273 16.099 21.680 1.00 24.16 O HETATM 4083 O HOH B 546 4.808 26.763 10.419 1.00 32.41 O HETATM 4084 O HOH B 547 4.829 21.697 5.622 1.00 32.35 O HETATM 4085 O HOH B 548 16.589 12.842 5.313 1.00 29.41 O HETATM 4086 O HOH B 549 24.555 12.790 17.340 1.00 32.19 O HETATM 4087 O HOH B 550 23.399 18.169 9.587 1.00 40.17 O HETATM 4088 O HOH B 551 0.907 7.645 6.846 1.00 46.66 O HETATM 4089 O HOH B 552 7.786 5.322 6.655 1.00 24.43 O HETATM 4090 O HOH B 553 4.576 3.495 9.318 1.00 28.75 O HETATM 4091 O HOH B 554 3.596 5.707 10.293 1.00 32.73 O HETATM 4092 O HOH B 555 1.823 -3.070 23.206 1.00 34.70 O HETATM 4093 O HOH B 556 9.690 -1.160 25.434 1.00 24.46 O HETATM 4094 O HOH B 557 11.804 -3.147 27.752 1.00 32.73 O HETATM 4095 O HOH B 558 20.718 6.607 26.459 1.00 38.45 O HETATM 4096 O HOH B 559 19.478 4.321 24.163 1.00 29.34 O HETATM 4097 O HOH B 560 9.889 0.176 32.441 1.00 31.33 O HETATM 4098 O HOH B 561 -1.259 3.777 32.046 1.00 22.53 O HETATM 4099 O HOH B 562 -3.278 4.868 33.740 1.00 24.05 O HETATM 4100 O HOH B 563 -2.510 2.278 30.017 1.00 22.10 O HETATM 4101 O HOH B 564 1.837 2.755 32.210 1.00 19.94 O HETATM 4102 O HOH B 565 -12.027 11.503 27.215 1.00 36.44 O HETATM 4103 O HOH B 566 -10.535 7.048 24.202 1.00 39.13 O HETATM 4104 O HOH B 567 -0.025 7.220 39.640 1.00 36.23 O HETATM 4105 O HOH B 568 13.961 33.008 22.285 1.00 42.75 O HETATM 4106 O HOH B 569 28.034 12.694 33.535 1.00 34.62 O HETATM 4107 O HOH B 570 16.549 29.081 18.885 1.00 42.11 O HETATM 4108 O HOH B 571 12.851 33.485 26.755 1.00 25.82 O HETATM 4109 O HOH B 572 19.674 37.177 21.871 1.00 41.89 O HETATM 4110 O HOH B 573 0.325 26.093 26.576 1.00 44.91 O HETATM 4111 O HOH B 574 27.288 54.430 27.560 1.00 24.66 O HETATM 4112 O HOH B 575 30.106 55.261 25.537 1.00 38.78 O HETATM 4113 O HOH B 576 26.975 53.309 23.342 1.00 35.96 O HETATM 4114 O HOH B 577 41.237 41.847 35.535 1.00 38.41 O HETATM 4115 O HOH B 578 42.336 38.934 21.447 1.00 30.50 O HETATM 4116 O HOH B 579 42.079 33.660 20.299 1.00 35.80 O HETATM 4117 O HOH B 580 21.936 35.637 18.789 1.00 35.62 O HETATM 4118 O HOH B 581 22.762 43.192 16.826 1.00 32.95 O HETATM 4119 O HOH B 582 33.440 57.889 29.316 1.00 41.70 O HETATM 4120 O HOH B 583 30.566 57.723 29.732 1.00 45.14 O HETATM 4121 O HOH B 584 25.627 53.290 33.603 1.00 45.27 O HETATM 4122 O HOH B 585 20.812 37.772 48.052 1.00 27.19 O HETATM 4123 O HOH B 586 16.623 30.738 49.020 1.00 39.93 O HETATM 4124 O HOH B 587 25.084 21.942 45.108 1.00 26.73 O HETATM 4125 O HOH B 588 13.883 28.554 18.935 1.00 31.05 O HETATM 4126 O HOH B 589 14.607 26.900 17.089 1.00 33.54 O HETATM 4127 O HOH B 590 13.081 30.675 21.403 1.00 35.19 O HETATM 4128 O HOH B 591 8.228 32.743 22.924 1.00 36.40 O HETATM 4129 O HOH B 592 7.698 30.299 21.485 1.00 29.53 O HETATM 4130 O HOH B 593 14.784 33.042 24.693 1.00 34.10 O HETATM 4131 O HOH B 594 10.627 26.653 16.707 1.00 31.36 O HETATM 4132 O HOH B 595 9.332 23.778 16.668 1.00 17.42 O HETATM 4133 O HOH B 596 18.852 17.533 22.016 1.00 29.23 O HETATM 4134 O HOH B 597 17.958 19.625 19.249 1.00 27.13 O HETATM 4135 O HOH B 598 15.241 17.388 10.801 1.00 19.96 O HETATM 4136 O HOH B 599 15.900 22.138 11.717 1.00 27.78 O HETATM 4137 O HOH B 600 16.115 19.905 10.040 1.00 33.07 O HETATM 4138 O HOH B 601 14.147 20.846 7.282 1.00 36.06 O HETATM 4139 O HOH B 602 12.771 25.033 10.191 1.00 42.40 O HETATM 4140 O HOH B 603 24.602 13.682 27.854 1.00 38.52 O HETATM 4141 O HOH B 604 18.092 1.271 30.298 1.00 33.79 O HETATM 4142 O HOH B 605 17.496 1.925 35.221 1.00 26.84 O HETATM 4143 O HOH B 606 19.866 0.461 34.109 1.00 37.61 O HETATM 4144 O HOH B 607 14.273 -2.499 30.886 1.00 34.90 O HETATM 4145 O HOH B 608 -4.872 16.077 25.520 1.00 21.17 O HETATM 4146 O HOH B 609 -1.702 16.891 24.147 1.00 27.83 O HETATM 4147 O HOH B 610 -3.898 17.820 23.672 1.00 34.67 O HETATM 4148 O HOH B 611 -2.722 16.744 19.150 1.00 35.17 O HETATM 4149 O HOH B 612 -7.918 16.105 23.010 1.00 39.25 O HETATM 4150 O HOH B 613 20.130 15.271 5.313 1.00 33.84 O HETATM 4151 O HOH B 614 22.567 13.452 5.637 1.00 42.46 O HETATM 4152 O HOH B 615 17.670 0.656 23.769 1.00 27.23 O HETATM 4153 O HOH B 616 6.489 -2.810 22.780 1.00 33.65 O HETATM 4154 O HOH B 617 6.336 16.169 39.037 1.00 19.94 O HETATM 4155 O HOH B 618 32.068 30.579 10.371 1.00 40.82 O HETATM 4156 O HOH B 619 21.756 18.924 47.819 1.00 41.41 O HETATM 4157 O HOH B 620 34.400 26.117 7.558 1.00 43.96 O HETATM 4158 O HOH B 621 35.242 50.396 33.271 1.00 33.99 O HETATM 4159 O HOH B 622 40.217 16.670 8.450 1.00 35.30 O HETATM 4160 O HOH B 623 19.259 21.146 13.629 1.00 37.87 O HETATM 4161 O HOH B 624 29.073 14.410 14.400 1.00 37.31 O HETATM 4162 O HOH B 625 22.994 10.715 18.505 1.00 34.02 O HETATM 4163 O HOH B 626 21.260 12.296 25.477 1.00 42.07 O HETATM 4164 O HOH B 627 24.432 11.434 29.812 1.00 39.60 O HETATM 4165 O HOH B 628 25.628 50.806 21.612 1.00 32.86 O HETATM 4166 O HOH B 629 26.970 51.968 39.668 1.00 34.87 O HETATM 4167 O HOH B 630 20.621 5.736 9.475 1.00 36.22 O HETATM 4168 O HOH B 631 22.618 7.411 9.975 1.00 32.50 O HETATM 4169 O HOH B 632 22.120 3.320 9.433 1.00 47.17 O HETATM 4170 O HOH B 633 21.691 13.117 22.683 1.00 44.74 O HETATM 4171 O HOH B 634 8.582 -4.956 23.283 1.00 60.82 O HETATM 4172 O HOH B 635 13.316 -0.961 16.243 1.00 13.84 O HETATM 4173 O HOH B 636 16.800 -2.270 17.881 1.00 41.33 O HETATM 4174 O HOH B 637 5.835 30.222 19.419 1.00 36.68 O HETATM 4175 O HOH B 638 2.352 27.890 25.461 1.00 37.37 O HETATM 4176 O HOH B 639 6.775 16.190 5.352 1.00 37.26 O HETATM 4177 O HOH B 640 8.334 13.262 8.174 1.00 29.55 O HETATM 4178 O HOH B 641 5.905 27.885 15.611 1.00 48.11 O HETATM 4179 O HOH B 642 -4.380 23.021 18.382 1.00 33.65 O HETATM 4180 O HOH B 643 -1.385 14.980 40.467 1.00 33.88 O HETATM 4181 O HOH B 644 3.844 3.915 36.926 1.00 29.99 O HETATM 4182 O HOH B 645 12.644 -3.710 20.190 1.00 42.42 O HETATM 4183 O HOH B 646 -3.022 -4.777 19.821 1.00 37.70 O HETATM 4184 O HOH B 647 -1.556 2.282 25.460 1.00 42.59 O HETATM 4185 O HOH B 648 -12.978 12.152 29.860 1.00 40.46 O HETATM 4186 O HOH B 649 24.515 46.404 44.204 1.00 33.89 O HETATM 4187 O HOH B 650 10.877 2.684 40.393 1.00 33.67 O HETATM 4188 O HOH B 651 10.754 4.520 42.670 1.00 37.85 O HETATM 4189 O HOH B 652 8.044 5.459 42.894 1.00 42.24 O HETATM 4190 O HOH B 653 2.170 5.827 38.062 1.00 37.07 O HETATM 4191 O HOH B 654 25.108 19.833 13.680 1.00 39.28 O HETATM 4192 O HOH B 655 26.026 24.563 12.699 1.00 32.91 O HETATM 4193 O HOH B 656 18.066 23.730 12.717 1.00 44.82 O HETATM 4194 O HOH B 657 21.073 50.325 41.956 1.00 40.07 O HETATM 4195 O HOH B 658 25.565 7.485 18.690 1.00 38.90 O HETATM 4196 O HOH B 659 4.248 27.789 23.635 1.00 32.48 O HETATM 4197 O HOH B 660 10.039 24.674 9.353 1.00 36.40 O HETATM 4198 O HOH B 661 13.658 3.181 39.753 1.00 32.88 O HETATM 4199 O HOH B 662 -4.670 17.692 21.084 1.00 40.12 O HETATM 4200 O HOH B 663 20.806 19.089 15.968 1.00 50.90 O HETATM 4201 O HOH B 664 16.943 -1.483 30.069 1.00 40.18 O HETATM 4202 O HOH B 665 18.254 -2.001 34.060 1.00 41.49 O HETATM 4203 O HOH B 666 10.966 14.243 4.825 1.00 36.05 O HETATM 4204 O HOH B 667 3.640 -1.952 29.490 1.00 35.23 O HETATM 4205 O HOH B 668 -8.129 16.348 29.592 1.00 43.02 O HETATM 4206 O HOH B 669 -9.490 15.839 27.049 1.00 57.16 O HETATM 4207 O HOH B 670 7.578 2.716 37.674 1.00 52.77 O CONECT 3532 3533 3534 CONECT 3533 3532 CONECT 3534 3532 3535 CONECT 3535 3534 CONECT 3536 3537 3538 CONECT 3537 3536 CONECT 3538 3536 3539 CONECT 3539 3538 CONECT 3540 3541 3542 3543 3544 CONECT 3541 3540 3545 CONECT 3542 3540 3546 CONECT 3543 3540 3547 CONECT 3544 3540 CONECT 3545 3541 CONECT 3546 3542 CONECT 3547 3543 CONECT 3548 3549 3550 3551 3552 CONECT 3549 3548 CONECT 3550 3548 CONECT 3551 3548 CONECT 3552 3548 CONECT 3553 3554 3555 3556 3557 CONECT 3554 3553 CONECT 3555 3553 CONECT 3556 3553 CONECT 3557 3553 CONECT 3558 3559 3560 3561 3562 CONECT 3559 3558 CONECT 3560 3558 CONECT 3561 3558 CONECT 3562 3558 CONECT 3563 3564 3565 CONECT 3564 3563 CONECT 3565 3563 3566 CONECT 3566 3565 3567 CONECT 3567 3566 3568 CONECT 3568 3567 3569 CONECT 3569 3568 CONECT 3570 3571 3572 CONECT 3571 3570 CONECT 3572 3570 3573 CONECT 3573 3572 CONECT 3574 3575 3576 CONECT 3575 3574 CONECT 3576 3574 3577 3578 CONECT 3577 3576 CONECT 3578 3576 3579 CONECT 3579 3578 CONECT 3580 3581 3582 CONECT 3581 3580 CONECT 3582 3580 3583 CONECT 3583 3582 3584 CONECT 3584 3583 3585 CONECT 3585 3584 3586 CONECT 3586 3585 CONECT 3587 3588 3589 3590 3591 CONECT 3588 3587 CONECT 3589 3587 CONECT 3590 3587 CONECT 3591 3587 CONECT 3592 3593 3594 CONECT 3593 3592 CONECT 3594 3592 3595 CONECT 3595 3594 CONECT 3596 3597 3598 CONECT 3597 3596 CONECT 3598 3596 3599 CONECT 3599 3598 3600 CONECT 3600 3599 3601 CONECT 3601 3600 3605 CONECT 3602 3603 CONECT 3603 3602 3604 CONECT 3604 3603 3605 CONECT 3605 3601 3604 CONECT 3606 3607 3608 CONECT 3607 3606 CONECT 3608 3606 3609 3610 CONECT 3609 3608 CONECT 3610 3608 3611 CONECT 3611 3610 CONECT 3612 3613 3614 CONECT 3613 3612 CONECT 3614 3612 3615 3616 CONECT 3615 3614 CONECT 3616 3614 3617 CONECT 3617 3616 CONECT 3618 3619 3620 CONECT 3619 3618 CONECT 3620 3618 3621 CONECT 3621 3620 3622 CONECT 3622 3621 3623 CONECT 3623 3622 3624 CONECT 3624 3623 CONECT 3625 3626 3627 CONECT 3626 3625 CONECT 3627 3625 3628 CONECT 3628 3627 CONECT 3629 3630 3631 3632 3633 CONECT 3630 3629 CONECT 3631 3629 CONECT 3632 3629 CONECT 3633 3629 CONECT 3634 3635 3636 CONECT 3635 3634 CONECT 3636 3634 3637 CONECT 3637 3636 CONECT 3638 3639 3640 CONECT 3639 3638 CONECT 3640 3638 3641 3642 CONECT 3641 3640 CONECT 3642 3640 3643 CONECT 3643 3642 CONECT 3644 3645 3646 CONECT 3645 3644 CONECT 3646 3644 3647 3648 CONECT 3647 3646 CONECT 3648 3646 3649 CONECT 3649 3648 CONECT 3650 3651 3652 3653 3654 CONECT 3651 3650 3655 CONECT 3652 3650 3656 CONECT 3653 3650 3657 CONECT 3654 3650 CONECT 3655 3651 CONECT 3656 3652 CONECT 3657 3653 CONECT 3658 3659 3660 CONECT 3659 3658 CONECT 3660 3658 3661 CONECT 3661 3660 CONECT 3662 3663 3664 3665 3666 CONECT 3663 3662 3667 CONECT 3664 3662 3668 CONECT 3665 3662 3669 CONECT 3666 3662 CONECT 3667 3663 CONECT 3668 3664 CONECT 3669 3665 CONECT 3670 3671 3672 CONECT 3671 3670 CONECT 3672 3670 3673 3674 CONECT 3673 3672 CONECT 3674 3672 3675 CONECT 3675 3674 CONECT 3676 3677 3678 CONECT 3677 3676 CONECT 3678 3676 3679 CONECT 3679 3678 CONECT 3680 3681 3682 CONECT 3681 3680 CONECT 3682 3680 3683 CONECT 3683 3682 CONECT 3684 3685 3686 CONECT 3685 3684 CONECT 3686 3684 3687 CONECT 3687 3686 CONECT 3688 3689 3690 CONECT 3689 3688 CONECT 3690 3688 3691 CONECT 3691 3690 CONECT 3692 3693 3694 CONECT 3693 3692 CONECT 3694 3692 3695 CONECT 3695 3694 3696 CONECT 3696 3695 3697 CONECT 3697 3696 3698 CONECT 3698 3697 END