USER MOD reduce.3.24.130724 H: found=0, std=0, add=2647, rem=0, adj=72 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER LIGASE/LIGASE INHIBITOR 30-JUN-13 4LH6 TITLE CRYSTAL STRUCTURE OF A LIGA INHIBITOR COMPND MOL_ID: 1; COMPND 2 MOLECULE: DNA LIGASE; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: ADENYLATION DOMAIN, UNP RESIDUES 1-323; COMPND 5 SYNONYM: POLYDEOXYRIBONUCLEOTIDE SYNTHASE [NAD(+)]; COMPND 6 EC: 6.5.1.2; COMPND 7 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ENTEROCOCCUS FAECALIS; SOURCE 3 ORGANISM_TAXID: 226185; SOURCE 4 STRAIN: ATCC 700802 / V583; SOURCE 5 GENE: LIGA, EF_0722; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3) KEYWDS PROTEIN-INHIBITOR COMPLEX, LIGASE-LIGASE INHIBITOR COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR K.BENENATO,H.WANG,H.M.MCGUIRE,H.DAVIS,N.GAO,D.B.PRINCE,H.JAHIC, AUTHOR 2 S.S.STOKES,P.A.BORIACK-SJODIN REVDAT 2 08-JAN-14 4LH6 1 JRNL REVDAT 1 25-DEC-13 4LH6 0 JRNL AUTH K.MURPHY-BENENATO,H.WANG,H.M.MCGUIRE,H.E.DAVIS,N.GAO, JRNL AUTH 2 D.B.PRINCE,H.JAHIC,S.S.STOKES,P.A.BORIACK-SJODIN JRNL TITL IDENTIFICATION THROUGH STRUCTURE-BASED METHODS OF A JRNL TITL 2 BACTERIAL NAD(+)-DEPENDENT DNA LIGASE INHIBITOR THAT AVOIDS JRNL TITL 3 KNOWN RESISTANCE MUTATIONS. JRNL REF BIOORG.MED.CHEM.LETT. V. 24 360 2014 JRNL REFN ISSN 0960-894X JRNL PMID 24287382 JRNL DOI 10.1016/J.BMCL.2013.11.007 REMARK 2 REMARK 2 RESOLUTION. 1.65 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) : 1.65 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 52.19 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : 98.8 REMARK 3 NUMBER OF REFLECTIONS : 39958 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) : 0.221 REMARK 3 R VALUE (WORKING SET) : 0.219 REMARK 3 FREE R VALUE : 0.248 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 2119 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) : 1.65 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.69 REMARK 3 REFLECTION IN BIN (WORKING SET) : 2605 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 92.46 REMARK 3 BIN R VALUE (WORKING SET) : 0.3070 REMARK 3 BIN FREE R VALUE SET COUNT : 143 REMARK 3 BIN FREE R VALUE : 0.3280 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2586 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 42 REMARK 3 SOLVENT ATOMS : 260 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 30.52 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.07000 REMARK 3 B22 (A**2) : -0.78000 REMARK 3 B33 (A**2) : 0.86000 REMARK 3 B12 (A**2) : 0.00000 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): 0.121 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.114 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.082 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 2.403 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.948 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.936 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2792 ; 0.005 ; 0.020 REMARK 3 BOND LENGTHS OTHERS (A): 1903 ; 0.001 ; 0.020 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3802 ; 0.958 ; 1.982 REMARK 3 BOND ANGLES OTHERS (DEGREES): 4634 ; 0.748 ; 3.000 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 343 ; 4.969 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 145 ;32.885 ;24.483 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 478 ;12.677 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 22 ;14.379 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 404 ; 0.057 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 3186 ; 0.004 ; 0.021 REMARK 3 GENERAL PLANES OTHERS (A): 570 ; 0.001 ; 0.020 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 : 1 REMARK 3 REMARK 3 TLS GROUP : 1 REMARK 3 NUMBER OF COMPONENTS GROUP : 3 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 501 A 760 REMARK 3 RESIDUE RANGE : A 401 A 405 REMARK 3 RESIDUE RANGE : A 2 A 323 REMARK 3 ORIGIN FOR THE GROUP (A): 11.5660 38.6870 17.3500 REMARK 3 T TENSOR REMARK 3 T11: 0.0153 T22: 0.0130 REMARK 3 T33: 0.0097 T12: 0.0024 REMARK 3 T13: 0.0109 T23: 0.0034 REMARK 3 L TENSOR REMARK 3 L11: 0.2113 L22: 0.1517 REMARK 3 L33: 0.1444 L12: -0.1269 REMARK 3 L13: 0.0778 L23: 0.0240 REMARK 3 S TENSOR REMARK 3 S11: -0.0238 S12: -0.0156 S13: -0.0333 REMARK 3 S21: 0.0116 S22: 0.0198 S23: 0.0237 REMARK 3 S31: 0.0101 S32: -0.0057 S33: 0.0041 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : BABINET MODEL WITH 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 ADDED IN THE RIDING REMARK 3 POSITIONS REMARK 4 REMARK 4 4LH6 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 22-JUL-13. REMARK 100 THE RCSB ID CODE IS RCSB080624. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 21-AUG-08 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 5.0 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : ROTATING ANODE REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : RIGAKU FR-E+ SUPERBRIGHT REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : NI FILTER REMARK 200 OPTICS : MIRRORS REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : RIGAKU SATURN 944+ REMARK 200 INTENSITY-INTEGRATION SOFTWARE : D*TREK REMARK 200 DATA SCALING SOFTWARE : D*TREK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 42107 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.650 REMARK 200 RESOLUTION RANGE LOW (A) : 52.190 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 2.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 98.9 REMARK 200 DATA REDUNDANCY : 4.620 REMARK 200 R MERGE (I) : 0.05800 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 11.9000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.65 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.71 REMARK 200 COMPLETENESS FOR SHELL (%) : 94.0 REMARK 200 DATA REDUNDANCY IN SHELL : 3.31 REMARK 200 R MERGE FOR SHELL (I) : 0.43600 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 2.200 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: AMORE REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 48.07 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.37 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 26-32% PEG4000, 0.2M AMMONIUM ACETATE, REMARK 280 0.1M SODIUM ACETATE PH 5, VAPOR DIFFUSION, HANGING DROP, REMARK 280 TEMPERATURE 293K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 2 2 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -X,Y,-Z+1/2 REMARK 290 4555 X,-Y,-Z REMARK 290 5555 X+1/2,Y+1/2,Z REMARK 290 6555 -X+1/2,-Y+1/2,Z+1/2 REMARK 290 7555 -X+1/2,Y+1/2,-Z+1/2 REMARK 290 8555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 68.35450 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 68.35450 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 24.47750 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 52.18850 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 6 -1.000000 0.000000 0.000000 24.47750 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 52.18850 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 68.35450 REMARK 290 SMTRY1 7 -1.000000 0.000000 0.000000 24.47750 REMARK 290 SMTRY2 7 0.000000 1.000000 0.000000 52.18850 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 68.35450 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 24.47750 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 52.18850 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 1 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 GLU A 322 56.73 -118.94 REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 NA A 404 NA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HOH A 583 O REMARK 620 2 ARG A 220 O 175.3 REMARK 620 3 HOH A 755 O 95.1 89.6 REMARK 620 4 HOH A 519 O 100.6 79.2 89.2 REMARK 620 5 ALA A 218 O 85.1 93.8 108.1 161.4 REMARK 620 6 HOH A 556 O 89.8 86.0 152.3 63.0 99.5 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 NA A 405 NA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HOH A 593 O REMARK 620 2 HOH A 590 O 103.1 REMARK 620 3 SER A 279 OG 90.8 152.7 REMARK 620 4 GLU A 276 O 84.0 97.6 107.3 REMARK 620 5 HOH A 515 O 111.8 73.7 79.3 163.1 REMARK 620 6 HOH A 503 O 153.7 93.9 82.6 73.8 92.0 REMARK 620 N 1 2 3 4 5 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 1X7 A 401 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NMN A 402 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ACT A 403 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NA A 404 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NA A 405 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 4LH7 RELATED DB: PDB DBREF 4LH6 A 1 323 UNP Q837V6 DNLJ_ENTFA 1 323 SEQRES 1 A 323 MET GLU GLN GLN PRO LEU THR LEU THR ALA ALA THR THR SEQRES 2 A 323 ARG ALA GLN GLU LEU ARG LYS GLN LEU ASN GLN TYR SER SEQRES 3 A 323 HIS GLU TYR TYR VAL LYS ASP GLN PRO SER VAL GLU ASP SEQRES 4 A 323 TYR VAL TYR ASP ARG LEU TYR LYS GLU LEU VAL ASP ILE SEQRES 5 A 323 GLU THR GLU PHE PRO ASP LEU ILE THR PRO ASP SER PRO SEQRES 6 A 323 THR GLN ARG VAL GLY GLY LYS VAL LEU SER GLY PHE GLU SEQRES 7 A 323 LYS ALA PRO HIS ASP ILE PRO MET TYR SER LEU ASN ASP SEQRES 8 A 323 GLY PHE SER LYS GLU ASP ILE PHE ALA PHE ASP GLU ARG SEQRES 9 A 323 VAL ARG LYS ALA ILE GLY LYS PRO VAL ALA TYR CYS CYS SEQRES 10 A 323 GLU LEU LYS ILE ASP GLY LEU ALA ILE SER LEU ARG TYR SEQRES 11 A 323 GLU ASN GLY VAL PHE VAL ARG GLY ALA THR ARG GLY ASP SEQRES 12 A 323 GLY THR VAL GLY GLU ASN ILE THR GLU ASN LEU ARG THR SEQRES 13 A 323 VAL ARG SER VAL PRO MET ARG LEU THR GLU PRO ILE SER SEQRES 14 A 323 VAL GLU VAL ARG GLY GLU CYS TYR MET PRO LYS GLN SER SEQRES 15 A 323 PHE VAL ALA LEU ASN GLU GLU ARG GLU GLU ASN GLY GLN SEQRES 16 A 323 ASP ILE PHE ALA ASN PRO ARG ASN ALA ALA ALA GLY SER SEQRES 17 A 323 LEU ARG GLN LEU ASP THR LYS ILE VAL ALA LYS ARG ASN SEQRES 18 A 323 LEU ASN THR PHE LEU TYR THR VAL ALA ASP PHE GLY PRO SEQRES 19 A 323 MET LYS ALA LYS THR GLN PHE GLU ALA LEU GLU GLU LEU SEQRES 20 A 323 SER ALA ILE GLY PHE ARG THR ASN PRO GLU ARG GLN LEU SEQRES 21 A 323 CYS GLN SER ILE ASP GLU VAL TRP ALA TYR ILE GLU GLU SEQRES 22 A 323 TYR HIS GLU LYS ARG SER THR LEU PRO TYR GLU ILE ASP SEQRES 23 A 323 GLY ILE VAL ILE LYS VAL ASN GLU PHE ALA LEU GLN ASP SEQRES 24 A 323 GLU LEU GLY PHE THR VAL LYS ALA PRO ARG TRP ALA ILE SEQRES 25 A 323 ALA TYR LYS PHE PRO PRO GLU GLU ALA GLU THR HET 1X7 A 401 14 HET NMN A 402 22 HET ACT A 403 4 HET NA A 404 1 HET NA A 405 1 HETNAM 1X7 4-AMINO-2-BROMOTHIENO[3,2-C]PYRIDINE-7-CARBOXAMIDE HETNAM NMN BETA-NICOTINAMIDE RIBOSE MONOPHOSPHATE HETNAM ACT ACETATE ION HETNAM NA SODIUM ION HETSYN NMN NICOTINAMIDE MONONUCLEOTIDE FORMUL 2 1X7 C8 H6 BR N3 O S FORMUL 3 NMN C11 H16 N2 O8 P 1+ FORMUL 4 ACT C2 H3 O2 1- FORMUL 5 NA 2(NA 1+) FORMUL 7 HOH *260(H2 O) HELIX 1 1 THR A 7 VAL A 31 1 25 HELIX 2 2 GLU A 38 PHE A 56 1 19 HELIX 3 3 PRO A 57 ILE A 60 5 4 HELIX 4 4 SER A 64 ARG A 68 5 5 HELIX 5 5 SER A 94 GLY A 110 1 17 HELIX 6 6 ILE A 150 THR A 156 1 7 HELIX 7 7 PRO A 179 ASN A 193 1 15 HELIX 8 8 ASN A 200 ARG A 210 1 11 HELIX 9 9 ASP A 213 ARG A 220 1 8 HELIX 10 10 THR A 239 GLY A 251 1 13 HELIX 11 11 SER A 263 ARG A 278 1 16 HELIX 12 12 SER A 279 LEU A 281 5 3 HELIX 13 13 GLU A 294 GLY A 302 1 9 HELIX 14 14 PRO A 318 GLU A 322 5 5 SHEET 1 A 2 LYS A 79 PRO A 81 0 SHEET 2 A 2 VAL A 146 GLU A 148 -1 O GLY A 147 N ALA A 80 SHEET 1 B 5 ASP A 91 GLY A 92 0 SHEET 2 B 5 ALA A 311 LYS A 315 1 O ALA A 313 N GLY A 92 SHEET 3 B 5 ILE A 285 VAL A 292 -1 N ILE A 288 O TYR A 314 SHEET 4 B 5 TYR A 115 ILE A 121 -1 N GLU A 118 O VAL A 289 SHEET 5 B 5 GLN A 259 CYS A 261 -1 O CYS A 261 N TYR A 115 SHEET 1 C 4 VAL A 134 THR A 140 0 SHEET 2 C 4 LEU A 124 GLU A 131 -1 N ARG A 129 O ARG A 137 SHEET 3 C 4 VAL A 170 TYR A 177 -1 O VAL A 172 N LEU A 128 SHEET 4 C 4 ASN A 223 VAL A 229 -1 O THR A 228 N ARG A 173 LINK NA NA A 404 O HOH A 583 1555 1555 2.15 LINK O ARG A 220 NA NA A 404 1555 1555 2.25 LINK NA NA A 405 O HOH A 593 1555 1555 2.27 LINK NA NA A 405 O HOH A 590 1555 1555 2.32 LINK NA NA A 404 O HOH A 755 1555 1555 2.40 LINK NA NA A 404 O HOH A 519 1555 1555 2.40 LINK OG SER A 279 NA NA A 405 1555 1555 2.41 LINK O GLU A 276 NA NA A 405 1555 1555 2.46 LINK NA NA A 405 O HOH A 515 1555 1555 2.51 LINK O ALA A 218 NA NA A 404 1555 1555 2.52 LINK NA NA A 405 O HOH A 503 1555 1555 2.52 LINK NA NA A 404 O HOH A 556 1555 1555 2.83 SITE *** AC1 10 TYR A 87 GLU A 118 LEU A 119 LYS A 120 SITE *** AC1 10 ILE A 121 GLU A 175 TYR A 227 VAL A 289 SITE *** AC1 10 LYS A 291 HOH A 570 SITE *** AC2 14 TYR A 25 SER A 26 TYR A 29 TYR A 30 SITE *** AC2 14 VAL A 37 ASP A 39 TYR A 42 ASP A 43 SITE *** AC2 14 ARG A 158 HOH A 520 HOH A 528 HOH A 571 SITE *** AC2 14 HOH A 645 HOH A 694 SITE *** AC3 5 TRP A 268 HIS A 275 TYR A 314 HOH A 716 SITE *** AC3 5 HOH A 739 SITE *** AC4 6 ALA A 218 ARG A 220 HOH A 519 HOH A 556 SITE *** AC4 6 HOH A 583 HOH A 755 SITE *** AC5 6 GLU A 276 SER A 279 HOH A 503 HOH A 515 SITE *** AC5 6 HOH A 590 HOH A 593 CRYST1 48.955 104.377 136.709 90.00 90.00 90.00 C 2 2 21 8 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 0.020427 0.000000 0.000000 0.00000 SCALE2 0.000000 0.009581 0.000000 0.00000 SCALE3 0.000000 0.000000 0.007315 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 117 CYS SG : rot -179:sc= -0.535 USER MOD Set 1.2: A 259 GLN A: amide:sc= -0.124 K(o=-0.64,f=0.44) USER MOD Set 1.3: A 261 CYS SG : rot 121:sc= 0.0179 USER MOD Set 2.1: A 255 ASN : amide:sc= 2.18 K(o=3.8,f=-1.5!) USER MOD Set 2.2: A 283 TYR OH : rot 8:sc= 1.6 USER MOD Set 3.1: A 240 GLN B: amide:sc= 0.266 K(o=2.7,f=-0.67!) USER MOD Set 3.2: A 291 LYS NZ :NH3+ -172:sc= 2.43 (180deg=2.19) USER MOD Set 4.1: A 240 GLN A: amide:sc= 0.0999 K(o=2.1,f=-0.8) USER MOD Set 4.2: A 298 GLN : amide:sc= 1.97 K(o=2.1,f=-0.2) USER MOD Set 5.1: A 159 SER OG : rot -159:sc= 1.89 USER MOD Set 5.2: A 223 ASN : amide:sc= 0.543 K(o=3.9,f=-1.7!) USER MOD Set 5.3: A 224 THR OG1 : rot -75:sc= 1.48 USER MOD Set 6.1: A 182 SER OG : rot 70:sc= 0.98 USER MOD Set 6.2: A 221 ASN A: amide:sc= 0.756 X(o=2.7,f=2.2) USER MOD Set 6.3: A 221 ASN B: amide:sc= 0.974 K(o=2.7,f=1.1) USER MOD Set 7.1: A 178 MET CE :methyl -138:sc= -0.195 (180deg=-0.585) USER MOD Set 7.2: A 208 SER OG : rot 79:sc= 1.74 USER MOD Set 8.1: A 193 ASN : amide:sc= 0.043 K(o=0.083,f=-0.69) USER MOD Set 8.2: A 195 GLN : amide:sc= 0.04 K(o=0.083,f=-1.4) USER MOD Set 9.1: A 149 ASN : amide:sc= -2.44! K(o=-2!,f=2.9) USER MOD Set 9.2: A 151 THR OG1 : rot 176:sc= 0.471 USER MOD Set10.1: A 64 SER OG : rot 171:sc= 1.26 USER MOD Set10.2: A 66 THR OG1 : rot -168:sc= 1.28 USER MOD Set10.3: A 67 GLN : amide:sc= -0.0239 X(o=2.5,f=2.5) USER MOD Single : A 3 GLN : amide:sc= -0.282 X(o=-0.28,f=-0.053) USER MOD Single : A 4 GLN : amide:sc= -0.0603 K(o=-0.06,f=-4.7!) USER MOD Single : A 7 THR OG1 : rot -170:sc= 0.0256 USER MOD Single : A 9 THR OG1 : rot -70:sc= 0.518 USER MOD Single : A 12 THR OG1 : rot 69:sc= 1.06 USER MOD Single : A 13 THR OG1 : rot 137:sc= 0.914 USER MOD Single : A 16 GLN : amide:sc= -0.975 K(o=-0.97,f=0) USER MOD Single : A 20 LYS NZ :NH3+ -166:sc= -0.0261 (180deg=-0.106) USER MOD Single : A 21 GLN : amide:sc= -0.329 X(o=-0.33,f=-0.17) USER MOD Single : A 23 ASN : amide:sc= 1.89 K(o=1.9,f=0.023) USER MOD Single : A 24 GLN : amide:sc= 0.526 K(o=0.53,f=-0.038) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 SER OG A: rot 127:sc= 2.39 USER MOD Single : A 26 SER OG B: rot 45:sc= 1.12 USER MOD Single : A 27 HIS : no HE2:sc= 2.71 K(o=2.7,f=-7.1!) USER MOD Single : A 29 TYR OH : rot 173:sc= 1.3 USER MOD Single : A 30 TYR OH : rot 173:sc= 1.3 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 36 SER OG : rot -90:sc= 1.31 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot 166:sc= 2.34 USER MOD Single : A 46 TYR OH : rot 180:sc= -0.199 USER MOD Single : A 47 LYS NZ :NH3+ -172:sc= 0.389 (180deg=0.277) USER MOD Single : A 54 THR OG1 : rot 71:sc= 0.91 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 168:sc= -0.0116 (180deg=-0.106) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ -123:sc= 0.286 (180deg=0) USER MOD Single : A 82 HIS : no HD1:sc= 1.44 K(o=1.4,f=-4.4!) USER MOD Single : A 86 MET CE :methyl -113:sc= -0.0167 (180deg=-1.84!) USER MOD Single : A 87 TYR OH : rot 68:sc= 0.0405 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 ASN : amide:sc= -0.858 K(o=-0.86,f=-0.024) USER MOD Single : A 94 SER OG : rot 180:sc= 0.175 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 TYR OH : rot -174:sc= 1.2 USER MOD Single : A 116 CYS SG : rot -106:sc= -0.0879 USER MOD Single : A 120 LYS NZ :NH3+ -126:sc= -0.0799 (180deg=-0.409) USER MOD Single : A 127 SER OG : rot -96:sc= 1.58 USER MOD Single : A 130 TYR OH : rot 2:sc= 1.18 USER MOD Single : A 132 ASN : amide:sc= -0.532 K(o=-0.53,f=0) USER MOD Single : A 140 THR OG1 : rot 166:sc= 1.74 USER MOD Single : A 145 THR OG1 : rot 180:sc= 0 USER MOD Single : A 153 ASN : amide:sc= -0.198 K(o=-0.2,f=-6!) USER MOD Single : A 156 THR OG1 : rot -63:sc= 2.4 USER MOD Single : A 162 MET CE :methyl -123:sc= -11.6! (180deg=-13.1!) USER MOD Single : A 165 THR OG1 : rot -179:sc= -0.53 USER MOD Single : A 169 SER OG : rot 180:sc= 0.24 USER MOD Single : A 176 CYS SG : rot 26:sc= -1.39 USER MOD Single : A 177 TYR OH : rot -173:sc= 1.92 USER MOD Single : A 180 LYS NZ :NH3+ 158:sc= 1.68 (180deg=1.18) USER MOD Single : A 181 GLN : amide:sc= 0 X(o=0,f=0.034) USER MOD Single : A 187 ASN : amide:sc= 1.33 K(o=1.3,f=-5.5!) USER MOD Single : A 200 ASN : amide:sc= 0.415 K(o=0.41,f=-6.1!) USER MOD Single : A 203 ASN : amide:sc= 2.09 K(o=2.1,f=0.015) USER MOD Single : A 211 GLN A: amide:sc= 0.491 X(o=0.49,f=0.3) USER MOD Single : A 211 GLN B: amide:sc= -0.16 K(o=-0.16,f=0.51) USER MOD Single : A 214 THR OG1 : rot -81:sc= 2.02 USER MOD Single : A 215 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 219 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 227 TYR OH A: rot 180:sc= 0 USER MOD Single : A 227 TYR OH B: rot 180:sc= 0 USER MOD Single : A 228 THR OG1 : rot 180:sc= -0.0513 USER MOD Single : A 235 MET CE :methyl -176:sc= -0.298 (180deg=-0.324) USER MOD Single : A 236 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 238 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 239 THR OG1 : rot 176:sc= 1.39 USER MOD Single : A 248 SER OG : rot -12:sc= 0.413 USER MOD Single : A 254 THR OG1 : rot -51:sc= 0.619 USER MOD Single : A 259 GLN B: amide:sc= 1.24 K(o=1.2,f=-0.38) USER MOD Single : A 262 GLN : amide:sc= -0.102 X(o=-0.1,f=-0.4) USER MOD Single : A 263 SER OG : rot 180:sc= 0.0238 USER MOD Single : A 270 TYR OH : rot -5:sc= 1.13 USER MOD Single : A 274 TYR OH : rot -15:sc= 2.48 USER MOD Single : A 275 HIS : no HE2:sc= 0.498 K(o=2.3,f=-8!) USER MOD Single : A 277 LYS NZ :NH3+ 146:sc= 1.3 (180deg=0.241) USER MOD Single : A 280 THR OG1 : rot -63:sc= 1.32 USER MOD Single : A 293 ASN : amide:sc= 1.04 K(o=1,f=-2.9!) USER MOD Single : A 304 THR OG1 : rot 180:sc= 0.107 USER MOD Single : A 306 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 314 TYR OH : rot -14:sc= 1.4 USER MOD Single : A 315 LYS NZ A:NH3+ 169:sc= -1.03 (180deg=-1.46) USER MOD Single : A 315 LYS NZ B:NH3+ 144:sc= 0.0459 (180deg=-0.0143) USER MOD Single : A 323 THR OG1 : rot 180:sc= 0 USER MOD Single : A 402 NMN O2R : rot -87:sc= 1.09 USER MOD Single : A 402 NMN O3R : rot -170:sc= 1.24 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 2 -31.305 61.853 18.726 1.00 58.86 N ANISOU 1 N GLU A 2 7104 7855 7404 423 -96 -271 N ATOM 2 CA GLU A 2 -29.894 62.326 18.818 1.00 58.44 C ANISOU 2 CA GLU A 2 7091 7780 7335 421 -105 -265 C ATOM 3 C GLU A 2 -29.067 61.520 19.830 1.00 56.42 C ANISOU 3 C GLU A 2 6833 7529 7075 410 -76 -240 C ATOM 4 O GLU A 2 -27.947 61.906 20.167 1.00 56.91 O ANISOU 4 O GLU A 2 6922 7577 7122 413 -81 -235 O ATOM 5 CB GLU A 2 -29.865 63.815 19.180 1.00 60.73 C ANISOU 5 CB GLU A 2 7401 8073 7599 454 -130 -283 C ATOM 6 CG GLU A 2 -30.557 64.155 20.495 1.00 62.70 C ANISOU 6 CG GLU A 2 7632 8358 7835 484 -119 -286 C ATOM 7 CD GLU A 2 -30.669 65.650 20.734 1.00 64.38 C ANISOU 7 CD GLU A 2 7863 8572 8025 519 -148 -308 C ATOM 8 OE1 GLU A 2 -29.810 66.407 20.232 1.00 65.67 O ANISOU 8 OE1 GLU A 2 8062 8708 8181 518 -172 -314 O ATOM 9 OE2 GLU A 2 -31.619 66.069 21.431 1.00 66.49 O ANISOU 9 OE2 GLU A 2 8111 8870 8283 546 -146 -319 O ATOM 0 HA GLU A 2 -29.488 62.191 17.948 1.00 58.44 H new ATOM 0 HB2 GLU A 2 -28.941 64.107 19.228 1.00 60.73 H new ATOM 0 HB3 GLU A 2 -30.286 64.319 18.466 1.00 60.73 H new ATOM 0 HG2 GLU A 2 -31.445 63.764 20.499 1.00 62.70 H new ATOM 0 HG3 GLU A 2 -30.066 63.751 21.228 1.00 62.70 H new ATOM 10 N GLN A 3 -29.613 60.399 20.300 1.00 54.18 N ANISOU 10 N GLN A 3 6517 7263 6807 398 -47 -225 N ATOM 11 CA GLN A 3 -28.916 59.545 21.268 1.00 52.00 C ANISOU 11 CA GLN A 3 6237 6993 6529 388 -18 -200 C ATOM 12 C GLN A 3 -27.863 58.666 20.574 1.00 50.42 C ANISOU 12 C GLN A 3 6052 6762 6343 355 -13 -186 C ATOM 13 O GLN A 3 -28.111 58.143 19.487 1.00 50.69 O ANISOU 13 O GLN A 3 6080 6781 6398 335 -20 -190 O ATOM 14 CB GLN A 3 -29.918 58.673 22.042 1.00 51.80 C ANISOU 14 CB GLN A 3 6169 6997 6515 388 13 -187 C ATOM 15 CG GLN A 3 -30.622 59.380 23.198 1.00 51.66 C ANISOU 15 CG GLN A 3 6138 7015 6476 423 20 -192 C ATOM 16 CD GLN A 3 -31.637 60.426 22.757 1.00 52.01 C ANISOU 16 CD GLN A 3 6177 7070 6516 446 -5 -220 C ATOM 17 OE1 GLN A 3 -31.649 61.546 23.270 1.00 51.19 O ANISOU 17 OE1 GLN A 3 6085 6976 6387 477 -20 -234 O ATOM 18 NE2 GLN A 3 -32.501 60.063 21.811 1.00 50.53 N ANISOU 18 NE2 GLN A 3 5968 6879 6353 432 -11 -228 N ATOM 0 H GLN A 3 -30.391 60.112 20.071 1.00 54.18 H new ATOM 0 HA GLN A 3 -28.458 60.123 21.898 1.00 52.00 H new ATOM 0 HB2 GLN A 3 -30.589 58.346 21.423 1.00 51.80 H new ATOM 0 HB3 GLN A 3 -29.451 57.897 22.390 1.00 51.80 H new ATOM 0 HG2 GLN A 3 -31.071 58.717 23.745 1.00 51.66 H new ATOM 0 HG3 GLN A 3 -29.955 59.806 23.759 1.00 51.66 H new ATOM 0 HE21 GLN A 3 -32.463 59.272 21.475 1.00 50.53 H new ATOM 0 HE22 GLN A 3 -33.096 60.619 21.536 1.00 50.53 H new ATOM 19 N GLN A 4 -26.697 58.521 21.210 1.00 47.57 N ANISOU 19 N GLN A 4 5711 6394 5970 353 -4 -172 N ATOM 20 CA GLN A 4 -25.586 57.689 20.703 1.00 45.13 C ANISOU 20 CA GLN A 4 5418 6059 5672 324 1 -158 C ATOM 21 C GLN A 4 -26.008 56.215 20.615 1.00 43.37 C ANISOU 21 C GLN A 4 5165 5838 5474 298 27 -140 C ATOM 22 O GLN A 4 -26.698 55.719 21.509 1.00 44.90 O ANISOU 22 O GLN A 4 5331 6056 5671 304 50 -129 O ATOM 23 CB GLN A 4 -24.335 57.876 21.598 1.00 45.41 C ANISOU 23 CB GLN A 4 5476 6091 5686 330 7 -146 C ATOM 24 CG GLN A 4 -23.415 56.665 21.811 1.00 45.05 C ANISOU 24 CG GLN A 4 5432 6034 5650 306 29 -123 C ATOM 25 CD GLN A 4 -22.386 56.447 20.709 1.00 43.85 C ANISOU 25 CD GLN A 4 5305 5850 5507 283 16 -123 C ATOM 26 OE1 GLN A 4 -22.216 55.329 20.216 1.00 41.40 O ANISOU 26 OE1 GLN A 4 4987 5528 5216 258 28 -112 O ATOM 27 NE2 GLN A 4 -21.683 57.510 20.330 1.00 43.48 N ANISOU 27 NE2 GLN A 4 5287 5788 5445 292 -9 -136 N ATOM 0 H GLN A 4 -26.522 58.906 21.959 1.00 47.57 H new ATOM 0 HA GLN A 4 -25.358 57.976 19.805 1.00 45.13 H new ATOM 0 HB2 GLN A 4 -23.802 58.591 21.218 1.00 45.41 H new ATOM 0 HB3 GLN A 4 -24.635 58.178 22.469 1.00 45.41 H new ATOM 0 HG2 GLN A 4 -22.949 56.772 22.655 1.00 45.05 H new ATOM 0 HG3 GLN A 4 -23.962 55.868 21.888 1.00 45.05 H new ATOM 0 HE21 GLN A 4 -21.829 58.275 20.696 1.00 43.48 H new ATOM 0 HE22 GLN A 4 -21.083 57.433 19.719 1.00 43.48 H new ATOM 28 N PRO A 5 -25.614 55.515 19.531 1.00 39.44 N ANISOU 28 N PRO A 5 4674 5316 4997 272 22 -139 N ATOM 29 CA PRO A 5 -26.055 54.125 19.365 1.00 37.53 C ANISOU 29 CA PRO A 5 4405 5073 4783 247 42 -125 C ATOM 30 C PRO A 5 -25.496 53.133 20.384 1.00 35.06 C ANISOU 30 C PRO A 5 4085 4764 4471 237 73 -98 C ATOM 31 O PRO A 5 -26.204 52.209 20.776 1.00 34.53 O ANISOU 31 O PRO A 5 3988 4710 4424 228 95 -85 O ATOM 32 CB PRO A 5 -25.581 53.758 17.948 1.00 37.65 C ANISOU 32 CB PRO A 5 4434 5058 4813 225 25 -133 C ATOM 33 CG PRO A 5 -24.552 54.771 17.594 1.00 38.39 C ANISOU 33 CG PRO A 5 4566 5137 4885 234 4 -142 C ATOM 34 CD PRO A 5 -24.920 56.019 18.331 1.00 38.78 C ANISOU 34 CD PRO A 5 4620 5205 4911 264 -5 -152 C ATOM 0 HA PRO A 5 -27.013 54.067 19.504 1.00 37.53 H new ATOM 0 HB2 PRO A 5 -25.210 52.862 17.926 1.00 37.65 H new ATOM 0 HB3 PRO A 5 -26.319 53.776 17.318 1.00 37.65 H new ATOM 0 HG2 PRO A 5 -23.666 54.468 17.848 1.00 38.39 H new ATOM 0 HG3 PRO A 5 -24.535 54.927 16.637 1.00 38.39 H new ATOM 0 HD2 PRO A 5 -24.136 56.541 18.564 1.00 38.78 H new ATOM 0 HD3 PRO A 5 -25.495 56.592 17.800 1.00 38.78 H new ATOM 35 N LEU A 6 -24.242 53.309 20.797 1.00 33.51 N ANISOU 35 N LEU A 6 3916 4559 4257 239 73 -90 N ATOM 36 CA LEU A 6 -23.592 52.346 21.683 1.00 32.56 C ANISOU 36 CA LEU A 6 3794 4441 4138 230 100 -65 C ATOM 37 C LEU A 6 -23.696 52.735 23.154 1.00 31.72 C ANISOU 37 C LEU A 6 3681 4361 4008 255 116 -56 C ATOM 38 O LEU A 6 -23.446 53.880 23.522 1.00 32.37 O ANISOU 38 O LEU A 6 3782 4452 4066 279 101 -68 O ATOM 39 CB LEU A 6 -22.113 52.174 21.309 1.00 32.21 C ANISOU 39 CB LEU A 6 3780 4370 4088 217 93 -61 C ATOM 40 CG LEU A 6 -21.837 51.715 19.875 1.00 32.98 C ANISOU 40 CG LEU A 6 3886 4441 4206 193 78 -69 C ATOM 41 CD1 LEU A 6 -20.336 51.616 19.624 1.00 33.53 C ANISOU 41 CD1 LEU A 6 3985 4488 4267 183 72 -64 C ATOM 42 CD2 LEU A 6 -22.520 50.388 19.580 1.00 33.14 C ANISOU 42 CD2 LEU A 6 3876 4457 4257 171 94 -58 C ATOM 0 H LEU A 6 -23.751 53.979 20.576 1.00 33.51 H new ATOM 0 HA LEU A 6 -24.063 51.507 21.563 1.00 32.56 H new ATOM 0 HB2 LEU A 6 -21.660 53.020 21.453 1.00 32.21 H new ATOM 0 HB3 LEU A 6 -21.715 51.532 21.918 1.00 32.21 H new ATOM 0 HG LEU A 6 -22.207 52.379 19.272 1.00 32.98 H new ATOM 0 HD11 LEU A 6 -20.179 51.324 18.712 1.00 33.53 H new ATOM 0 HD12 LEU A 6 -19.927 52.485 19.760 1.00 33.53 H new ATOM 0 HD13 LEU A 6 -19.946 50.976 20.240 1.00 33.53 H new ATOM 0 HD21 LEU A 6 -22.329 50.121 18.667 1.00 33.14 H new ATOM 0 HD22 LEU A 6 -22.189 49.711 20.190 1.00 33.14 H new ATOM 0 HD23 LEU A 6 -23.478 50.485 19.694 1.00 33.14 H new ATOM 43 N THR A 7 -24.079 51.770 23.983 1.00 31.54 N ANISOU 43 N THR A 7 3635 4355 3995 250 146 -33 N ATOM 44 CA THR A 7 -23.888 51.879 25.424 1.00 31.04 C ANISOU 44 CA THR A 7 3570 4315 3908 271 166 -18 C ATOM 45 C THR A 7 -22.433 51.526 25.718 1.00 31.27 C ANISOU 45 C THR A 7 3626 4327 3927 264 169 -6 C ATOM 46 O THR A 7 -21.723 51.018 24.845 1.00 30.96 O ANISOU 46 O THR A 7 3601 4261 3903 241 161 -6 O ATOM 47 CB THR A 7 -24.790 50.906 26.192 1.00 31.38 C ANISOU 47 CB THR A 7 3578 4381 3965 267 199 5 C ATOM 48 OG1 THR A 7 -24.508 49.565 25.773 1.00 30.39 O ANISOU 48 OG1 THR A 7 3445 4234 3868 235 212 23 O ATOM 49 CG2 THR A 7 -26.264 51.230 25.946 1.00 32.06 C ANISOU 49 CG2 THR A 7 3633 4485 4062 274 197 -7 C ATOM 0 H THR A 7 -24.454 51.039 23.729 1.00 31.54 H new ATOM 0 HA THR A 7 -24.112 52.780 25.706 1.00 31.04 H new ATOM 0 HB THR A 7 -24.612 50.995 27.141 1.00 31.38 H new ATOM 0 HG1 THR A 7 -25.088 49.045 26.088 1.00 30.39 H new ATOM 0 HG21 THR A 7 -26.819 50.606 26.439 1.00 32.06 H new ATOM 0 HG22 THR A 7 -26.451 52.134 26.245 1.00 32.06 H new ATOM 0 HG23 THR A 7 -26.458 51.156 24.998 1.00 32.06 H new ATOM 50 N LEU A 8 -21.991 51.774 26.946 1.00 31.24 N ANISOU 50 N LEU A 8 3631 4342 3899 286 180 3 N ATOM 51 CA LEU A 8 -20.623 51.429 27.335 1.00 31.61 C ANISOU 51 CA LEU A 8 3701 4374 3935 282 184 15 C ATOM 52 C LEU A 8 -20.369 49.927 27.191 1.00 30.80 C ANISOU 52 C LEU A 8 3589 4258 3857 252 206 39 C ATOM 53 O LEU A 8 -19.337 49.518 26.661 1.00 31.15 O ANISOU 53 O LEU A 8 3652 4277 3907 235 199 40 O ATOM 54 CB LEU A 8 -20.342 51.888 28.772 1.00 32.41 C ANISOU 54 CB LEU A 8 3809 4501 4006 313 195 21 C ATOM 55 CG LEU A 8 -18.926 51.651 29.315 1.00 33.04 C ANISOU 55 CG LEU A 8 3913 4570 4071 314 197 31 C ATOM 56 CD1 LEU A 8 -17.862 52.235 28.398 1.00 32.67 C ANISOU 56 CD1 LEU A 8 3896 4493 4024 304 168 13 C ATOM 57 CD2 LEU A 8 -18.794 52.229 30.717 1.00 34.56 C ANISOU 57 CD2 LEU A 8 4110 4789 4230 349 204 34 C ATOM 0 H LEU A 8 -22.461 52.139 27.567 1.00 31.24 H new ATOM 0 HA LEU A 8 -20.016 51.892 26.737 1.00 31.61 H new ATOM 0 HB2 LEU A 8 -20.531 52.838 28.827 1.00 32.41 H new ATOM 0 HB3 LEU A 8 -20.969 51.439 29.360 1.00 32.41 H new ATOM 0 HG LEU A 8 -18.784 50.692 29.352 1.00 33.04 H new ATOM 0 HD11 LEU A 8 -16.983 52.066 28.773 1.00 32.67 H new ATOM 0 HD12 LEU A 8 -17.925 51.820 27.523 1.00 32.67 H new ATOM 0 HD13 LEU A 8 -17.998 53.192 28.312 1.00 32.67 H new ATOM 0 HD21 LEU A 8 -17.896 52.073 31.048 1.00 34.56 H new ATOM 0 HD22 LEU A 8 -18.968 53.183 30.692 1.00 34.56 H new ATOM 0 HD23 LEU A 8 -19.434 51.800 31.306 1.00 34.56 H new ATOM 58 N THR A 9 -21.311 49.106 27.649 1.00 30.63 N ANISOU 58 N THR A 9 3536 4252 3849 247 232 57 N ATOM 59 CA THR A 9 -21.147 47.657 27.588 1.00 31.10 C ANISOU 59 CA THR A 9 3584 4299 3934 220 253 81 C ATOM 60 C THR A 9 -21.100 47.163 26.131 1.00 30.79 C ANISOU 60 C THR A 9 3546 4229 3925 190 237 71 C ATOM 61 O THR A 9 -20.282 46.305 25.790 1.00 30.81 O ANISOU 61 O THR A 9 3558 4207 3939 170 239 80 O ATOM 62 CB THR A 9 -22.236 46.916 28.403 1.00 32.00 C ANISOU 62 CB THR A 9 3663 4437 4058 221 284 105 C ATOM 63 OG1 THR A 9 -21.911 45.523 28.488 1.00 31.96 O ANISOU 63 OG1 THR A 9 3650 4416 4075 196 305 131 O ATOM 64 CG2 THR A 9 -23.622 47.090 27.781 1.00 33.10 C ANISOU 64 CG2 THR A 9 3773 4584 4218 216 280 93 C ATOM 0 H THR A 9 -22.052 49.368 27.998 1.00 30.63 H new ATOM 0 HA THR A 9 -20.294 47.447 27.999 1.00 31.10 H new ATOM 0 HB THR A 9 -22.260 47.303 29.292 1.00 32.00 H new ATOM 0 HG1 THR A 9 -22.012 45.165 27.735 1.00 31.96 H new ATOM 0 HG21 THR A 9 -24.278 46.615 28.314 1.00 33.10 H new ATOM 0 HG22 THR A 9 -23.849 48.033 27.754 1.00 33.10 H new ATOM 0 HG23 THR A 9 -23.619 46.733 26.879 1.00 33.10 H new ATOM 65 N ALA A 10 -21.949 47.728 25.273 1.00 30.14 N ANISOU 65 N ALA A 10 3454 4146 3853 189 219 50 N ATOM 66 CA ALA A 10 -21.935 47.382 23.850 1.00 29.57 C ANISOU 66 CA ALA A 10 3384 4046 3806 165 201 37 C ATOM 67 C ALA A 10 -20.620 47.824 23.204 1.00 29.21 C ANISOU 67 C ALA A 10 3375 3978 3747 162 179 24 C ATOM 68 O ALA A 10 -20.041 47.090 22.399 1.00 28.83 O ANISOU 68 O ALA A 10 3334 3905 3716 140 174 25 O ATOM 69 CB ALA A 10 -23.119 48.012 23.130 1.00 30.05 C ANISOU 69 CB ALA A 10 3428 4115 3876 169 185 15 C ATOM 0 H ALA A 10 -22.540 48.313 25.493 1.00 30.14 H new ATOM 0 HA ALA A 10 -22.009 46.418 23.771 1.00 29.57 H new ATOM 0 HB1 ALA A 10 -23.092 47.772 22.191 1.00 30.05 H new ATOM 0 HB2 ALA A 10 -23.945 47.689 23.522 1.00 30.05 H new ATOM 0 HB3 ALA A 10 -23.075 48.977 23.218 1.00 30.05 H new ATOM 70 N ALA A 11 -20.154 49.016 23.567 1.00 29.01 N ANISOU 70 N ALA A 11 3370 3961 3692 186 166 13 N ATOM 71 CA ALA A 11 -18.895 49.544 23.045 1.00 28.88 C ANISOU 71 CA ALA A 11 3386 3923 3662 184 146 2 C ATOM 72 C ALA A 11 -17.709 48.705 23.503 1.00 29.47 C ANISOU 72 C ALA A 11 3474 3987 3736 174 159 20 C ATOM 73 O ALA A 11 -16.770 48.476 22.735 1.00 29.02 O ANISOU 73 O ALA A 11 3435 3907 3683 159 148 17 O ATOM 74 CB ALA A 11 -18.709 50.995 23.469 1.00 28.77 C ANISOU 74 CB ALA A 11 3390 3921 3620 212 129 -13 C ATOM 0 H ALA A 11 -20.555 49.539 24.119 1.00 29.01 H new ATOM 0 HA ALA A 11 -18.936 49.502 22.077 1.00 28.88 H new ATOM 0 HB1 ALA A 11 -17.870 51.331 23.115 1.00 28.77 H new ATOM 0 HB2 ALA A 11 -19.442 51.529 23.125 1.00 28.77 H new ATOM 0 HB3 ALA A 11 -18.696 51.050 24.437 1.00 28.77 H new ATOM 75 N THR A 12 -17.754 48.255 24.755 1.00 29.78 N ANISOU 75 N THR A 12 3504 4044 3767 184 183 40 N ATOM 76 CA THR A 12 -16.685 47.436 25.324 1.00 30.27 C ANISOU 76 CA THR A 12 3577 4099 3826 177 197 59 C ATOM 77 C THR A 12 -16.559 46.106 24.588 1.00 30.34 C ANISOU 77 C THR A 12 3578 4085 3865 147 205 70 C ATOM 78 O THR A 12 -15.461 45.688 24.225 1.00 31.04 O ANISOU 78 O THR A 12 3686 4154 3955 135 200 72 O ATOM 79 CB THR A 12 -16.924 47.183 26.825 1.00 31.32 C ANISOU 79 CB THR A 12 3699 4258 3945 195 223 80 C ATOM 80 OG1 THR A 12 -17.017 48.439 27.502 1.00 31.48 O ANISOU 80 OG1 THR A 12 3728 4298 3936 225 214 67 O ATOM 81 CG2 THR A 12 -15.791 46.356 27.437 1.00 31.50 C ANISOU 81 CG2 THR A 12 3735 4272 3963 190 237 99 C ATOM 0 H THR A 12 -18.402 48.415 25.297 1.00 29.78 H new ATOM 0 HA THR A 12 -15.855 47.927 25.218 1.00 30.27 H new ATOM 0 HB THR A 12 -17.750 46.684 26.925 1.00 31.32 H new ATOM 0 HG1 THR A 12 -17.727 48.827 27.277 1.00 31.48 H new ATOM 0 HG21 THR A 12 -15.968 46.213 28.380 1.00 31.50 H new ATOM 0 HG22 THR A 12 -15.735 45.500 26.985 1.00 31.50 H new ATOM 0 HG23 THR A 12 -14.951 46.831 27.334 1.00 31.50 H new ATOM 82 N THR A 13 -17.690 45.447 24.361 1.00 30.16 N ANISOU 82 N THR A 13 3527 4065 3866 135 215 76 N ATOM 83 CA THR A 13 -17.704 44.168 23.658 1.00 29.80 C ANISOU 83 CA THR A 13 3471 3998 3852 107 221 84 C ATOM 84 C THR A 13 -17.288 44.339 22.193 1.00 29.92 C ANISOU 84 C THR A 13 3502 3990 3878 93 194 63 C ATOM 85 O THR A 13 -16.488 43.549 21.680 1.00 29.22 O ANISOU 85 O THR A 13 3423 3879 3800 76 192 66 O ATOM 86 CB THR A 13 -19.089 43.498 23.767 1.00 30.43 C ANISOU 86 CB THR A 13 3515 4087 3958 97 237 95 C ATOM 87 OG1 THR A 13 -19.369 43.248 25.150 1.00 30.25 O ANISOU 87 OG1 THR A 13 3480 4088 3925 110 264 119 O ATOM 88 CG2 THR A 13 -19.124 42.185 23.008 1.00 30.62 C ANISOU 88 CG2 THR A 13 3528 4086 4018 68 239 102 C ATOM 0 H THR A 13 -18.465 45.725 24.608 1.00 30.16 H new ATOM 0 HA THR A 13 -17.055 43.586 24.083 1.00 29.80 H new ATOM 0 HB THR A 13 -19.754 44.090 23.382 1.00 30.43 H new ATOM 0 HG1 THR A 13 -20.167 43.452 25.316 1.00 30.25 H new ATOM 0 HG21 THR A 13 -20.004 41.785 23.093 1.00 30.62 H new ATOM 0 HG22 THR A 13 -18.932 42.347 22.071 1.00 30.62 H new ATOM 0 HG23 THR A 13 -18.459 41.581 23.374 1.00 30.62 H new ATOM 89 N ARG A 14 -17.799 45.381 21.539 1.00 28.75 N ANISOU 89 N ARG A 14 3355 3845 3723 102 174 40 N ATOM 90 CA ARG A 14 -17.454 45.639 20.139 1.00 28.73 C ANISOU 90 CA ARG A 14 3367 3822 3726 91 149 20 C ATOM 91 C ARG A 14 -15.968 45.959 19.972 1.00 28.46 C ANISOU 91 C ARG A 14 3365 3774 3673 93 139 18 C ATOM 92 O ARG A 14 -15.335 45.497 19.019 1.00 28.13 O ANISOU 92 O ARG A 14 3335 3713 3642 77 129 13 O ATOM 93 CB ARG A 14 -18.309 46.773 19.553 1.00 27.97 C ANISOU 93 CB ARG A 14 3269 3735 3625 104 130 -2 C ATOM 94 CG ARG A 14 -18.073 47.048 18.070 1.00 27.00 C ANISOU 94 CG ARG A 14 3159 3593 3507 95 104 -22 C ATOM 95 CD ARG A 14 -18.153 45.778 17.235 1.00 26.70 C ANISOU 95 CD ARG A 14 3111 3537 3499 71 106 -20 C ATOM 96 NE ARG A 14 -17.983 46.057 15.813 1.00 26.38 N ANISOU 96 NE ARG A 14 3082 3479 3460 65 81 -40 N ATOM 97 CZ ARG A 14 -17.899 45.125 14.868 1.00 26.78 C ANISOU 97 CZ ARG A 14 3130 3513 3534 47 76 -44 C ATOM 98 NH1 ARG A 14 -17.969 43.836 15.181 1.00 27.24 N ANISOU 98 NH1 ARG A 14 3172 3564 3615 31 92 -29 N ATOM 99 NH2 ARG A 14 -17.746 45.484 13.598 1.00 26.31 N ANISOU 99 NH2 ARG A 14 3083 3441 3472 46 53 -62 N ATOM 0 H ARG A 14 -18.345 45.949 21.885 1.00 28.75 H new ATOM 0 HA ARG A 14 -17.644 44.824 19.648 1.00 28.73 H new ATOM 0 HB2 ARG A 14 -19.245 46.557 19.684 1.00 27.97 H new ATOM 0 HB3 ARG A 14 -18.133 47.586 20.052 1.00 27.97 H new ATOM 0 HG2 ARG A 14 -18.731 47.686 17.751 1.00 27.00 H new ATOM 0 HG3 ARG A 14 -17.201 47.457 17.952 1.00 27.00 H new ATOM 0 HD2 ARG A 14 -17.470 45.155 17.527 1.00 26.70 H new ATOM 0 HD3 ARG A 14 -19.010 45.348 17.381 1.00 26.70 H new ATOM 0 HE ARG A 14 -17.934 46.880 15.569 1.00 26.38 H new ATOM 0 HH11 ARG A 14 -18.070 43.598 16.001 1.00 27.24 H new ATOM 0 HH12 ARG A 14 -17.914 43.240 14.564 1.00 27.24 H new ATOM 0 HH21 ARG A 14 -17.702 46.317 13.389 1.00 26.31 H new ATOM 0 HH22 ARG A 14 -17.691 44.883 12.985 1.00 26.31 H new ATOM 100 N ALA A 15 -15.418 46.758 20.886 1.00 28.74 N ANISOU 100 N ALA A 15 3415 3823 3683 112 141 20 N ATOM 101 CA ALA A 15 -13.985 47.079 20.871 1.00 28.34 C ANISOU 101 CA ALA A 15 3393 3761 3615 114 132 19 C ATOM 102 C ALA A 15 -13.139 45.815 20.982 1.00 28.77 C ANISOU 102 C ALA A 15 3450 3801 3680 97 146 35 C ATOM 103 O ALA A 15 -12.162 45.646 20.250 1.00 28.27 O ANISOU 103 O ALA A 15 3403 3720 3617 87 136 30 O ATOM 104 CB ALA A 15 -13.641 48.043 21.999 1.00 27.92 C ANISOU 104 CB ALA A 15 3351 3725 3534 138 133 20 C ATOM 0 H ALA A 15 -15.857 47.127 21.527 1.00 28.74 H new ATOM 0 HA ALA A 15 -13.784 47.506 20.023 1.00 28.34 H new ATOM 0 HB1 ALA A 15 -12.692 48.244 21.975 1.00 27.92 H new ATOM 0 HB2 ALA A 15 -14.148 48.863 21.890 1.00 27.92 H new ATOM 0 HB3 ALA A 15 -13.863 47.637 22.851 1.00 27.92 H new ATOM 105 N GLN A 16 -13.518 44.928 21.899 1.00 29.34 N ANISOU 105 N GLN A 16 3505 3882 3760 96 169 55 N ATOM 106 CA GLN A 16 -12.847 43.640 22.043 1.00 30.97 C ANISOU 106 CA GLN A 16 3712 4075 3979 80 183 72 C ATOM 107 C GLN A 16 -12.884 42.850 20.733 1.00 30.48 C ANISOU 107 C GLN A 16 3647 3991 3944 57 173 64 C ATOM 108 O GLN A 16 -11.857 42.348 20.290 1.00 30.08 O ANISOU 108 O GLN A 16 3612 3923 3895 47 169 65 O ATOM 109 CB GLN A 16 -13.473 42.826 23.177 1.00 32.81 C ANISOU 109 CB GLN A 16 3926 4322 4220 82 210 96 C ATOM 110 CG GLN A 16 -13.132 43.354 24.562 1.00 35.34 C ANISOU 110 CG GLN A 16 4252 4663 4512 106 222 106 C ATOM 111 CD GLN A 16 -14.006 42.778 25.666 1.00 37.10 C ANISOU 111 CD GLN A 16 4452 4904 4738 112 249 129 C ATOM 112 OE1 GLN A 16 -13.942 43.230 26.809 1.00 40.83 O ANISOU 112 OE1 GLN A 16 4927 5398 5187 134 259 137 O ATOM 113 NE2 GLN A 16 -14.820 41.779 25.336 1.00 38.56 N ANISOU 113 NE2 GLN A 16 4615 5083 4954 92 260 140 N ATOM 0 H GLN A 16 -14.166 45.055 22.450 1.00 29.34 H new ATOM 0 HA GLN A 16 -11.919 43.812 22.265 1.00 30.97 H new ATOM 0 HB2 GLN A 16 -14.437 42.822 23.069 1.00 32.81 H new ATOM 0 HB3 GLN A 16 -13.175 41.905 23.107 1.00 32.81 H new ATOM 0 HG2 GLN A 16 -12.203 43.153 24.757 1.00 35.34 H new ATOM 0 HG3 GLN A 16 -13.219 44.320 24.562 1.00 35.34 H new ATOM 0 HE21 GLN A 16 -14.838 41.489 24.527 1.00 38.56 H new ATOM 0 HE22 GLN A 16 -15.328 41.424 25.932 1.00 38.56 H new ATOM 114 N GLU A 17 -14.061 42.758 20.114 1.00 30.07 N ANISOU 114 N GLU A 17 3575 3939 3911 50 169 57 N ATOM 115 CA GLU A 17 -14.210 42.069 18.827 1.00 30.02 C ANISOU 115 CA GLU A 17 3564 3913 3930 31 157 46 C ATOM 116 C GLU A 17 -13.292 42.670 17.760 1.00 28.41 C ANISOU 116 C GLU A 17 3385 3696 3713 31 135 28 C ATOM 117 O GLU A 17 -12.573 41.952 17.067 1.00 27.59 O ANISOU 117 O GLU A 17 3290 3574 3619 18 130 26 O ATOM 118 CB GLU A 17 -15.652 42.158 18.325 1.00 31.52 C ANISOU 118 CB GLU A 17 3729 4108 4138 28 152 36 C ATOM 119 CG GLU A 17 -16.643 41.284 19.068 1.00 32.95 C ANISOU 119 CG GLU A 17 3881 4296 4342 21 174 55 C ATOM 120 CD GLU A 17 -18.054 41.396 18.510 1.00 35.65 C ANISOU 120 CD GLU A 17 4197 4644 4704 17 168 43 C ATOM 121 OE1 GLU A 17 -18.386 42.434 17.888 1.00 35.31 O ANISOU 121 OE1 GLU A 17 4160 4607 4650 28 149 22 O ATOM 122 OE2 GLU A 17 -18.839 40.440 18.702 1.00 39.15 O ANISOU 122 OE2 GLU A 17 4614 5085 5176 4 181 55 O ATOM 0 H GLU A 17 -14.791 43.090 20.424 1.00 30.07 H new ATOM 0 HA GLU A 17 -13.967 41.142 18.976 1.00 30.02 H new ATOM 0 HB2 GLU A 17 -15.945 43.081 18.386 1.00 31.52 H new ATOM 0 HB3 GLU A 17 -15.669 41.917 17.386 1.00 31.52 H new ATOM 0 HG2 GLU A 17 -16.353 40.360 19.021 1.00 32.95 H new ATOM 0 HG3 GLU A 17 -16.649 41.532 20.006 1.00 32.95 H new ATOM 123 N LEU A 18 -13.340 43.989 17.629 1.00 27.75 N ANISOU 123 N LEU A 18 3313 3622 3609 45 121 15 N ATOM 124 CA LEU A 18 -12.545 44.695 16.623 1.00 26.95 C ANISOU 124 CA LEU A 18 3235 3511 3496 46 100 -1 C ATOM 125 C LEU A 18 -11.047 44.478 16.836 1.00 26.97 C ANISOU 125 C LEU A 18 3258 3504 3485 44 103 6 C ATOM 126 O LEU A 18 -10.314 44.229 15.880 1.00 27.30 O ANISOU 126 O LEU A 18 3312 3531 3530 34 92 -1 O ATOM 127 CB LEU A 18 -12.872 46.191 16.626 1.00 25.71 C ANISOU 127 CB LEU A 18 3085 3365 3318 64 86 -14 C ATOM 128 CG LEU A 18 -14.242 46.583 16.061 1.00 25.51 C ANISOU 128 CG LEU A 18 3044 3347 3303 67 76 -28 C ATOM 129 CD1 LEU A 18 -14.545 48.044 16.364 1.00 25.11 C ANISOU 129 CD1 LEU A 18 3001 3309 3231 87 65 -37 C ATOM 130 CD2 LEU A 18 -14.293 46.330 14.560 1.00 25.33 C ANISOU 130 CD2 LEU A 18 3023 3307 3292 55 59 -42 C ATOM 0 H LEU A 18 -13.830 44.501 18.116 1.00 27.75 H new ATOM 0 HA LEU A 18 -12.778 44.326 15.757 1.00 26.95 H new ATOM 0 HB2 LEU A 18 -12.814 46.514 17.539 1.00 25.71 H new ATOM 0 HB3 LEU A 18 -12.188 46.654 16.117 1.00 25.71 H new ATOM 0 HG LEU A 18 -14.918 46.034 16.488 1.00 25.51 H new ATOM 0 HD11 LEU A 18 -15.414 48.277 16.001 1.00 25.11 H new ATOM 0 HD12 LEU A 18 -14.549 48.181 17.324 1.00 25.11 H new ATOM 0 HD13 LEU A 18 -13.865 48.606 15.960 1.00 25.11 H new ATOM 0 HD21 LEU A 18 -15.165 46.583 14.218 1.00 25.33 H new ATOM 0 HD22 LEU A 18 -13.608 46.857 14.119 1.00 25.33 H new ATOM 0 HD23 LEU A 18 -14.138 45.389 14.385 1.00 25.33 H new ATOM 131 N ARG A 19 -10.595 44.560 18.084 1.00 27.93 N ANISOU 131 N ARG A 19 3383 3636 3594 54 116 20 N ATOM 132 CA ARG A 19 -9.172 44.358 18.383 1.00 28.38 C ANISOU 132 CA ARG A 19 3459 3685 3639 53 119 27 C ATOM 133 C ARG A 19 -8.697 42.964 18.001 1.00 28.77 C ANISOU 133 C ARG A 19 3506 3719 3707 35 126 34 C ATOM 134 O ARG A 19 -7.612 42.807 17.439 1.00 28.18 O ANISOU 134 O ARG A 19 3447 3632 3628 30 119 31 O ATOM 135 CB ARG A 19 -8.874 44.615 19.861 1.00 29.02 C ANISOU 135 CB ARG A 19 3543 3781 3703 68 133 39 C ATOM 136 CG ARG A 19 -8.956 46.076 20.225 1.00 30.19 C ANISOU 136 CG ARG A 19 3699 3941 3830 88 121 29 C ATOM 137 CD ARG A 19 -8.422 46.362 21.611 1.00 31.23 C ANISOU 137 CD ARG A 19 3838 4086 3942 105 131 39 C ATOM 138 NE ARG A 19 -8.706 47.753 21.946 1.00 32.51 N ANISOU 138 NE ARG A 19 4006 4260 4086 124 119 27 N ATOM 139 CZ ARG A 19 -9.654 48.165 22.787 1.00 32.50 C ANISOU 139 CZ ARG A 19 3992 4278 4077 141 126 29 C ATOM 140 NH1 ARG A 19 -10.435 47.299 23.442 1.00 32.16 N ANISOU 140 NH1 ARG A 19 3929 4247 4044 140 147 44 N ATOM 141 NH2 ARG A 19 -9.809 49.470 22.977 1.00 32.28 N ANISOU 141 NH2 ARG A 19 3973 4260 4034 159 111 15 N ATOM 0 H ARG A 19 -11.087 44.730 18.769 1.00 27.93 H new ATOM 0 HA ARG A 19 -8.685 45.001 17.844 1.00 28.38 H new ATOM 0 HB2 ARG A 19 -9.501 44.114 20.406 1.00 29.02 H new ATOM 0 HB3 ARG A 19 -7.987 44.282 20.071 1.00 29.02 H new ATOM 0 HG2 ARG A 19 -8.456 46.596 19.576 1.00 30.19 H new ATOM 0 HG3 ARG A 19 -9.880 46.368 20.172 1.00 30.19 H new ATOM 0 HD2 ARG A 19 -8.835 45.770 22.259 1.00 31.23 H new ATOM 0 HD3 ARG A 19 -7.467 46.197 21.644 1.00 31.23 H new ATOM 0 HE ARG A 19 -8.222 48.356 21.570 1.00 32.51 H new ATOM 0 HH11 ARG A 19 -10.332 46.453 23.325 1.00 32.16 H new ATOM 0 HH12 ARG A 19 -11.041 47.588 23.980 1.00 32.16 H new ATOM 0 HH21 ARG A 19 -9.303 50.028 22.562 1.00 32.28 H new ATOM 0 HH22 ARG A 19 -10.415 49.757 23.516 1.00 32.28 H new ATOM 142 N LYS A 20 -9.503 41.956 18.313 1.00 29.62 N ANISOU 142 N LYS A 20 3594 3826 3836 27 140 45 N ATOM 143 CA LYS A 20 -9.176 40.583 17.950 1.00 30.50 C ANISOU 143 CA LYS A 20 3700 3920 3967 11 146 52 C ATOM 144 C LYS A 20 -9.043 40.445 16.434 1.00 29.33 C ANISOU 144 C LYS A 20 3557 3756 3829 0 127 34 C ATOM 145 O LYS A 20 -8.057 39.897 15.940 1.00 28.60 O ANISOU 145 O LYS A 20 3477 3651 3738 -7 123 33 O ATOM 146 CB LYS A 20 -10.219 39.606 18.501 1.00 32.65 C ANISOU 146 CB LYS A 20 3948 4194 4264 3 163 67 C ATOM 147 CG LYS A 20 -9.964 38.153 18.130 1.00 34.76 C ANISOU 147 CG LYS A 20 4210 4441 4556 -15 167 75 C ATOM 148 CD LYS A 20 -10.977 37.225 18.781 1.00 37.24 C ANISOU 148 CD LYS A 20 4499 4756 4895 -23 185 93 C ATOM 149 CE LYS A 20 -10.975 35.849 18.129 1.00 38.87 C ANISOU 149 CE LYS A 20 4697 4938 5132 -42 183 94 C ATOM 150 NZ LYS A 20 -11.567 35.872 16.761 1.00 40.23 N ANISOU 150 NZ LYS A 20 4863 5101 5323 -51 163 72 N ATOM 0 H LYS A 20 -10.246 42.046 18.736 1.00 29.62 H new ATOM 0 HA LYS A 20 -8.321 40.360 18.350 1.00 30.50 H new ATOM 0 HB2 LYS A 20 -10.242 39.684 19.468 1.00 32.65 H new ATOM 0 HB3 LYS A 20 -11.095 39.864 18.174 1.00 32.65 H new ATOM 0 HG2 LYS A 20 -10.004 38.052 17.166 1.00 34.76 H new ATOM 0 HG3 LYS A 20 -9.069 37.900 18.405 1.00 34.76 H new ATOM 0 HD2 LYS A 20 -10.776 37.137 19.726 1.00 37.24 H new ATOM 0 HD3 LYS A 20 -11.863 37.614 18.715 1.00 37.24 H new ATOM 0 HE2 LYS A 20 -10.065 35.518 18.080 1.00 38.87 H new ATOM 0 HE3 LYS A 20 -11.473 35.229 18.685 1.00 38.87 H new ATOM 0 HZ1 LYS A 20 -11.735 35.039 16.496 1.00 40.23 H new ATOM 0 HZ2 LYS A 20 -12.325 36.338 16.773 1.00 40.23 H new ATOM 0 HZ3 LYS A 20 -10.995 36.253 16.196 1.00 40.23 H new ATOM 151 N GLN A 21 -10.012 40.981 15.701 1.00 28.09 N ANISOU 151 N GLN A 21 3392 3604 3679 0 115 20 N ATOM 152 CA GLN A 21 -10.014 40.889 14.243 1.00 28.14 C ANISOU 152 CA GLN A 21 3402 3597 3693 -8 96 2 C ATOM 153 C GLN A 21 -8.866 41.671 13.596 1.00 26.58 C ANISOU 153 C GLN A 21 3230 3397 3473 -2 83 -7 C ATOM 154 O GLN A 21 -8.240 41.192 12.649 1.00 25.93 O ANISOU 154 O GLN A 21 3155 3302 3394 -10 74 -15 O ATOM 155 CB GLN A 21 -11.351 41.382 13.684 1.00 29.74 C ANISOU 155 CB GLN A 21 3589 3805 3905 -5 86 -11 C ATOM 156 CG GLN A 21 -11.585 40.967 12.246 1.00 31.13 C ANISOU 156 CG GLN A 21 3764 3968 4096 -14 68 -28 C ATOM 157 CD GLN A 21 -11.604 39.459 12.087 1.00 32.23 C ANISOU 157 CD GLN A 21 3892 4092 4263 -30 74 -23 C ATOM 158 OE1 GLN A 21 -12.547 38.797 12.505 1.00 34.37 O ANISOU 158 OE1 GLN A 21 4140 4363 4558 -37 83 -16 O ATOM 159 NE2 GLN A 21 -10.550 38.911 11.497 1.00 34.27 N ANISOU 159 NE2 GLN A 21 4164 4338 4520 -35 69 -26 N ATOM 0 H GLN A 21 -10.683 41.406 16.030 1.00 28.09 H new ATOM 0 HA GLN A 21 -9.886 39.953 14.023 1.00 28.14 H new ATOM 0 HB2 GLN A 21 -12.072 41.039 14.235 1.00 29.74 H new ATOM 0 HB3 GLN A 21 -11.383 42.350 13.745 1.00 29.74 H new ATOM 0 HG2 GLN A 21 -12.428 41.335 11.937 1.00 31.13 H new ATOM 0 HG3 GLN A 21 -10.889 41.342 11.684 1.00 31.13 H new ATOM 0 HE21 GLN A 21 -9.907 39.409 11.216 1.00 34.27 H new ATOM 0 HE22 GLN A 21 -10.509 38.058 11.395 1.00 34.27 H new ATOM 160 N LEU A 22 -8.600 42.870 14.107 1.00 24.85 N ANISOU 160 N LEU A 22 3022 3190 3232 11 81 -7 N ATOM 161 CA LEU A 22 -7.523 43.716 13.577 1.00 25.17 C ANISOU 161 CA LEU A 22 3085 3227 3252 15 69 -14 C ATOM 162 C LEU A 22 -6.141 43.130 13.889 1.00 24.89 C ANISOU 162 C LEU A 22 3062 3185 3210 11 76 -5 C ATOM 163 O LEU A 22 -5.226 43.209 13.060 1.00 24.57 O ANISOU 163 O LEU A 22 3035 3137 3163 7 67 -11 O ATOM 164 CB LEU A 22 -7.647 45.150 14.109 1.00 24.67 C ANISOU 164 CB LEU A 22 3030 3177 3169 30 63 -17 C ATOM 165 CG LEU A 22 -8.867 45.927 13.592 1.00 24.43 C ANISOU 165 CG LEU A 22 2992 3152 3140 36 51 -29 C ATOM 166 CD1 LEU A 22 -9.143 47.163 14.440 1.00 24.17 C ANISOU 166 CD1 LEU A 22 2962 3133 3090 53 49 -30 C ATOM 167 CD2 LEU A 22 -8.719 46.286 12.118 1.00 24.96 C ANISOU 167 CD2 LEU A 22 3069 3211 3205 33 33 -44 C ATOM 0 H LEU A 22 -9.032 43.217 14.765 1.00 24.85 H new ATOM 0 HA LEU A 22 -7.615 43.741 12.612 1.00 25.17 H new ATOM 0 HB2 LEU A 22 -7.686 45.120 15.078 1.00 24.67 H new ATOM 0 HB3 LEU A 22 -6.844 45.640 13.872 1.00 24.67 H new ATOM 0 HG LEU A 22 -9.636 45.342 13.672 1.00 24.43 H new ATOM 0 HD11 LEU A 22 -9.917 47.630 14.089 1.00 24.17 H new ATOM 0 HD12 LEU A 22 -9.316 46.895 15.356 1.00 24.17 H new ATOM 0 HD13 LEU A 22 -8.372 47.751 14.416 1.00 24.17 H new ATOM 0 HD21 LEU A 22 -9.504 46.774 11.823 1.00 24.96 H new ATOM 0 HD22 LEU A 22 -7.931 46.838 11.997 1.00 24.96 H new ATOM 0 HD23 LEU A 22 -8.629 45.474 11.595 1.00 24.96 H new ATOM 168 N ASN A 23 -5.993 42.535 15.071 1.00 25.99 N ANISOU 168 N ASN A 23 3195 3327 3352 12 93 10 N ATOM 169 CA ASN A 23 -4.743 41.859 15.426 1.00 26.78 C ANISOU 169 CA ASN A 23 3306 3422 3449 9 100 19 C ATOM 170 C ASN A 23 -4.480 40.655 14.518 1.00 27.07 C ANISOU 170 C ASN A 23 3340 3443 3503 -5 98 16 C ATOM 171 O ASN A 23 -3.339 40.419 14.102 1.00 27.25 O ANISOU 171 O ASN A 23 3375 3458 3519 -8 95 14 O ATOM 172 CB ASN A 23 -4.734 41.440 16.905 1.00 27.53 C ANISOU 172 CB ASN A 23 3395 3523 3543 15 119 37 C ATOM 173 CG ASN A 23 -4.414 42.595 17.837 1.00 28.32 C ANISOU 173 CG ASN A 23 3504 3637 3620 31 119 38 C ATOM 174 OD1 ASN A 23 -3.551 43.422 17.547 1.00 30.40 O ANISOU 174 OD1 ASN A 23 3783 3899 3868 35 108 31 O ATOM 175 ND2 ASN A 23 -5.106 42.653 18.967 1.00 29.80 N ANISOU 175 ND2 ASN A 23 3681 3837 3805 41 132 49 N ATOM 0 H ASN A 23 -6.600 42.510 15.680 1.00 25.99 H new ATOM 0 HA ASN A 23 -4.023 42.495 15.291 1.00 26.78 H new ATOM 0 HB2 ASN A 23 -5.600 41.071 17.138 1.00 27.53 H new ATOM 0 HB3 ASN A 23 -4.081 40.734 17.034 1.00 27.53 H new ATOM 0 HD21 ASN A 23 -4.958 43.286 19.530 1.00 29.80 H new ATOM 0 HD22 ASN A 23 -5.702 42.057 19.137 1.00 29.80 H new ATOM 176 N GLN A 24 -5.540 39.917 14.189 1.00 26.87 N ANISOU 176 N GLN A 24 3298 3412 3500 -13 99 14 N ATOM 177 CA GLN A 24 -5.442 38.790 13.266 1.00 27.53 C ANISOU 177 CA GLN A 24 3377 3480 3602 -25 94 8 C ATOM 178 C GLN A 24 -5.007 39.274 11.883 1.00 26.51 C ANISOU 178 C GLN A 24 3260 3347 3464 -25 76 -9 C ATOM 179 O GLN A 24 -4.066 38.738 11.300 1.00 25.74 O ANISOU 179 O GLN A 24 3172 3241 3365 -28 72 -13 O ATOM 180 CB GLN A 24 -6.783 38.050 13.176 1.00 29.20 C ANISOU 180 CB GLN A 24 3566 3686 3841 -33 96 9 C ATOM 181 CG GLN A 24 -6.787 36.836 12.250 1.00 30.95 C ANISOU 181 CG GLN A 24 3782 3890 4086 -45 89 1 C ATOM 182 CD GLN A 24 -8.191 36.450 11.809 1.00 33.37 C ANISOU 182 CD GLN A 24 4068 4194 4419 -52 84 -6 C ATOM 183 OE1 GLN A 24 -9.101 36.348 12.628 1.00 37.16 O ANISOU 183 OE1 GLN A 24 4530 4678 4911 -54 96 5 O ATOM 184 NE2 GLN A 24 -8.374 36.251 10.508 1.00 34.48 N ANISOU 184 NE2 GLN A 24 4209 4326 4568 -55 66 -26 N ATOM 0 H GLN A 24 -6.332 40.056 14.494 1.00 26.87 H new ATOM 0 HA GLN A 24 -4.774 38.173 13.603 1.00 27.53 H new ATOM 0 HB2 GLN A 24 -7.039 37.762 14.066 1.00 29.20 H new ATOM 0 HB3 GLN A 24 -7.462 38.673 12.873 1.00 29.20 H new ATOM 0 HG2 GLN A 24 -6.246 37.027 11.468 1.00 30.95 H new ATOM 0 HG3 GLN A 24 -6.375 36.084 12.704 1.00 30.95 H new ATOM 0 HE21 GLN A 24 -7.713 36.331 9.964 1.00 34.48 H new ATOM 0 HE22 GLN A 24 -9.153 36.042 10.210 1.00 34.48 H new ATOM 185 N TYR A 25 -5.688 40.294 11.368 1.00 25.36 N ANISOU 185 N TYR A 25 3115 3209 3311 -19 65 -20 N ATOM 186 CA TYR A 25 -5.393 40.806 10.034 1.00 25.88 C ANISOU 186 CA TYR A 25 3192 3273 3368 -18 48 -35 C ATOM 187 C TYR A 25 -3.965 41.340 9.939 1.00 26.05 C ANISOU 187 C TYR A 25 3234 3296 3368 -14 47 -33 C ATOM 188 O TYR A 25 -3.281 41.116 8.939 1.00 26.10 O ANISOU 188 O TYR A 25 3249 3297 3370 -16 39 -41 O ATOM 189 CB TYR A 25 -6.381 41.907 9.637 1.00 26.35 C ANISOU 189 CB TYR A 25 3249 3341 3422 -10 37 -45 C ATOM 190 CG TYR A 25 -7.796 41.436 9.355 1.00 26.93 C ANISOU 190 CG TYR A 25 3302 3413 3517 -14 33 -53 C ATOM 191 CD1 TYR A 25 -8.068 40.126 8.956 1.00 27.15 C ANISOU 191 CD1 TYR A 25 3318 3429 3569 -24 33 -56 C ATOM 192 CD2 TYR A 25 -8.862 42.324 9.445 1.00 27.50 C ANISOU 192 CD2 TYR A 25 3367 3494 3587 -7 28 -58 C ATOM 193 CE1 TYR A 25 -9.361 39.712 8.686 1.00 28.04 C ANISOU 193 CE1 TYR A 25 3411 3539 3705 -28 28 -63 C ATOM 194 CE2 TYR A 25 -10.156 41.920 9.174 1.00 27.94 C ANISOU 194 CE2 TYR A 25 3403 3550 3665 -10 24 -66 C ATOM 195 CZ TYR A 25 -10.403 40.616 8.798 1.00 28.35 C ANISOU 195 CZ TYR A 25 3441 3589 3741 -21 24 -68 C ATOM 196 OH TYR A 25 -11.694 40.214 8.523 1.00 30.06 O ANISOU 196 OH TYR A 25 3636 3804 3981 -25 19 -76 O ATOM 0 H TYR A 25 -6.325 40.704 11.775 1.00 25.36 H new ATOM 0 HA TYR A 25 -5.484 40.062 9.419 1.00 25.88 H new ATOM 0 HB2 TYR A 25 -6.411 42.566 10.348 1.00 26.35 H new ATOM 0 HB3 TYR A 25 -6.042 42.356 8.847 1.00 26.35 H new ATOM 0 HD1 TYR A 25 -7.368 39.520 8.870 1.00 27.15 H new ATOM 0 HD2 TYR A 25 -8.702 43.206 9.692 1.00 27.50 H new ATOM 0 HE1 TYR A 25 -9.528 38.833 8.431 1.00 28.04 H new ATOM 0 HE2 TYR A 25 -10.858 42.526 9.245 1.00 27.94 H new ATOM 0 HH TYR A 25 -12.218 40.861 8.633 1.00 30.06 H new ATOM 197 N ASER A 26 -3.521 42.047 10.975 0.50 26.18 N ANISOU 197 N ASER A 26 3257 3320 3370 -8 54 -23 N ATOM 198 N BSER A 26 -3.537 42.044 10.984 0.50 25.95 N ANISOU 198 N BSER A 26 3227 3291 3342 -8 54 -23 N ATOM 199 CA ASER A 26 -2.160 42.577 11.007 0.50 26.22 C ANISOU 199 CA ASER A 26 3278 3326 3357 -5 53 -20 C ATOM 200 CA BSER A 26 -2.187 42.591 11.062 0.50 25.89 C ANISOU 200 CA BSER A 26 3236 3285 3315 -5 54 -20 C ATOM 201 C ASER A 26 -1.137 41.448 11.008 0.50 25.94 C ANISOU 201 C ASER A 26 3246 3284 3327 -11 60 -16 C ATOM 202 C BSER A 26 -1.147 41.467 11.030 0.50 25.75 C ANISOU 202 C BSER A 26 3222 3260 3302 -11 60 -15 C ATOM 203 O ASER A 26 -0.130 41.516 10.296 0.50 25.67 O ANISOU 203 O ASER A 26 3223 3247 3283 -12 55 -20 O ATOM 204 O BSER A 26 -0.145 41.558 10.315 0.50 25.63 O ANISOU 204 O BSER A 26 3218 3242 3277 -12 55 -19 O ATOM 205 CB ASER A 26 -1.961 43.478 12.224 0.50 26.54 C ANISOU 205 CB ASER A 26 3324 3376 3385 4 59 -12 C ATOM 206 CB BSER A 26 -2.050 43.430 12.335 0.50 25.92 C ANISOU 206 CB BSER A 26 3244 3298 3308 4 60 -11 C ATOM 207 OG ASER A 26 -2.566 44.738 12.010 0.50 26.74 O ANISOU 207 OG ASER A 26 3352 3408 3401 11 49 -18 O ATOM 208 OG BSER A 26 -0.760 43.998 12.459 0.50 25.24 O ANISOU 208 OG BSER A 26 3173 3212 3206 7 59 -8 O ATOM 0 H ASER A 26 -3.992 42.231 11.670 0.50 25.95 H new ATOM 0 H BSER A 26 -4.025 42.218 11.671 0.50 25.95 H new ATOM 0 HA ASER A 26 -2.026 43.108 10.206 0.50 25.89 H new ATOM 0 HA BSER A 26 -2.028 43.160 10.293 0.50 25.89 H new ATOM 0 HB2ASER A 26 -2.344 43.058 13.010 0.50 25.92 H new ATOM 0 HB2BSER A 26 -2.714 44.137 12.329 0.50 25.92 H new ATOM 0 HB3ASER A 26 -1.013 43.593 12.397 0.50 25.92 H new ATOM 0 HB3BSER A 26 -2.234 42.875 13.109 0.50 25.92 H new ATOM 0 HG ASER A 26 -3.088 44.910 12.645 0.50 25.24 H new ATOM 0 HG BSER A 26 -0.526 44.327 11.722 0.50 25.24 H new ATOM 209 N HIS A 27 -1.404 40.402 11.787 1.00 25.56 N ANISOU 209 N HIS A 27 3187 3231 3293 -15 72 -7 N ATOM 210 CA HIS A 27 -0.528 39.222 11.801 1.00 26.28 C ANISOU 210 CA HIS A 27 3281 3313 3391 -20 78 -3 C ATOM 211 C HIS A 27 -0.416 38.598 10.432 1.00 26.98 C ANISOU 211 C HIS A 27 3371 3394 3488 -26 67 -16 C ATOM 212 O HIS A 27 0.683 38.288 9.977 1.00 27.73 O ANISOU 212 O HIS A 27 3475 3486 3576 -26 65 -18 O ATOM 213 CB HIS A 27 -1.024 38.196 12.813 1.00 26.78 C ANISOU 213 CB HIS A 27 3332 3373 3472 -23 91 10 C ATOM 214 CG HIS A 27 -0.209 36.930 12.845 1.00 27.61 C ANISOU 214 CG HIS A 27 3438 3466 3585 -28 96 14 C ATOM 215 ND1 HIS A 27 -0.609 35.798 12.240 1.00 28.15 N ANISOU 215 ND1 HIS A 27 3498 3521 3675 -37 93 9 N ATOM 216 CD2 HIS A 27 1.031 36.653 13.421 1.00 27.33 C ANISOU 216 CD2 HIS A 27 3413 3430 3540 -25 102 21 C ATOM 217 CE1 HIS A 27 0.320 34.841 12.421 1.00 28.07 C ANISOU 217 CE1 HIS A 27 3494 3503 3668 -38 97 14 C ATOM 218 NE2 HIS A 27 1.321 35.363 13.148 1.00 27.81 N ANISOU 218 NE2 HIS A 27 3472 3478 3616 -31 103 21 N ATOM 0 H AHIS A 27 -2.082 40.352 12.313 0.50 25.56 H new ATOM 0 H BHIS A 27 -2.087 40.339 12.306 0.50 25.56 H new ATOM 0 HA HIS A 27 0.357 39.519 12.065 1.00 26.28 H new ATOM 0 HB2 HIS A 27 -1.018 38.597 13.696 1.00 26.78 H new ATOM 0 HB3 HIS A 27 -1.946 37.972 12.609 1.00 26.78 H new ATOM 0 HD1 HIS A 27 -1.344 35.700 11.805 1.00 28.15 H new ATOM 0 HD2 HIS A 27 1.560 37.247 13.903 1.00 27.33 H new ATOM 0 HE1 HIS A 27 0.276 33.970 12.099 1.00 28.07 H new ATOM 219 N GLU A 28 -1.551 38.430 9.754 1.00 26.72 N ANISOU 219 N GLU A 28 3327 3358 3468 -29 59 -25 N ATOM 220 CA GLU A 28 -1.570 37.885 8.392 1.00 27.49 C ANISOU 220 CA GLU A 28 3425 3448 3572 -31 46 -40 C ATOM 221 C GLU A 28 -0.780 38.763 7.424 1.00 27.40 C ANISOU 221 C GLU A 28 3428 3443 3538 -26 36 -48 C ATOM 222 O GLU A 28 0.014 38.270 6.620 1.00 27.95 O ANISOU 222 O GLU A 28 3505 3510 3604 -26 31 -55 O ATOM 223 CB GLU A 28 -3.010 37.761 7.882 1.00 27.79 C ANISOU 223 CB GLU A 28 3449 3484 3628 -34 37 -50 C ATOM 224 CG GLU A 28 -3.857 36.719 8.593 1.00 27.95 C ANISOU 224 CG GLU A 28 3451 3495 3675 -42 46 -43 C ATOM 225 CD GLU A 28 -5.336 36.824 8.250 1.00 28.41 C ANISOU 225 CD GLU A 28 3492 3552 3749 -43 39 -51 C ATOM 226 OE1 GLU A 28 -5.730 37.753 7.513 1.00 28.60 O ANISOU 226 OE1 GLU A 28 3520 3584 3762 -37 27 -63 O ATOM 227 OE2 GLU A 28 -6.110 35.969 8.720 1.00 30.33 O ANISOU 227 OE2 GLU A 28 3718 3788 4017 -51 45 -46 O ATOM 0 H GLU A 28 -2.328 38.627 10.066 1.00 26.72 H new ATOM 0 HA GLU A 28 -1.156 37.009 8.431 1.00 27.49 H new ATOM 0 HB2 GLU A 28 -3.444 38.624 7.968 1.00 27.79 H new ATOM 0 HB3 GLU A 28 -2.986 37.548 6.936 1.00 27.79 H new ATOM 0 HG2 GLU A 28 -3.537 35.834 8.358 1.00 27.95 H new ATOM 0 HG3 GLU A 28 -3.744 36.816 9.551 1.00 27.95 H new ATOM 228 N TYR A 29 -1.005 40.068 7.516 1.00 27.40 N ANISOU 228 N TYR A 29 3434 3452 3524 -21 33 -47 N ATOM 229 CA TYR A 29 -0.415 41.046 6.601 1.00 27.94 C ANISOU 229 CA TYR A 29 3516 3527 3572 -16 24 -53 C ATOM 230 C TYR A 29 1.099 41.185 6.783 1.00 28.44 C ANISOU 230 C TYR A 29 3592 3593 3621 -16 30 -46 C ATOM 231 O TYR A 29 1.843 41.165 5.802 1.00 29.89 O ANISOU 231 O TYR A 29 3783 3778 3795 -15 25 -51 O ATOM 232 CB TYR A 29 -1.095 42.394 6.833 1.00 27.99 C ANISOU 232 CB TYR A 29 3524 3540 3569 -11 20 -52 C ATOM 233 CG TYR A 29 -0.674 43.536 5.934 1.00 28.26 C ANISOU 233 CG TYR A 29 3573 3580 3585 -6 10 -55 C ATOM 234 CD1 TYR A 29 0.124 44.564 6.426 1.00 28.72 C ANISOU 234 CD1 TYR A 29 3642 3642 3628 -4 12 -47 C ATOM 235 CD2 TYR A 29 -1.116 43.622 4.617 1.00 28.64 C ANISOU 235 CD2 TYR A 29 3623 3628 3630 -3 -3 -67 C ATOM 236 CE1 TYR A 29 0.489 45.634 5.633 1.00 28.81 C ANISOU 236 CE1 TYR A 29 3666 3657 3624 -1 4 -48 C ATOM 237 CE2 TYR A 29 -0.753 44.692 3.810 1.00 28.90 C ANISOU 237 CE2 TYR A 29 3670 3667 3646 2 -11 -68 C ATOM 238 CZ TYR A 29 0.052 45.693 4.324 1.00 29.06 C ANISOU 238 CZ TYR A 29 3700 3689 3652 2 -7 -57 C ATOM 239 OH TYR A 29 0.423 46.764 3.547 1.00 30.95 O ANISOU 239 OH TYR A 29 3952 3932 3875 5 -15 -56 O ATOM 0 H TYR A 29 -1.510 40.418 8.118 1.00 27.40 H new ATOM 0 HA TYR A 29 -0.557 40.737 5.693 1.00 27.94 H new ATOM 0 HB2 TYR A 29 -2.052 42.270 6.736 1.00 27.99 H new ATOM 0 HB3 TYR A 29 -0.935 42.659 7.752 1.00 27.99 H new ATOM 0 HD1 TYR A 29 0.418 44.530 7.308 1.00 28.72 H new ATOM 0 HD2 TYR A 29 -1.662 42.953 4.272 1.00 28.64 H new ATOM 0 HE1 TYR A 29 1.026 46.311 5.978 1.00 28.81 H new ATOM 0 HE2 TYR A 29 -1.049 44.736 2.929 1.00 28.90 H new ATOM 0 HH TYR A 29 0.180 46.632 2.754 1.00 30.95 H new ATOM 240 N TYR A 30 1.541 41.303 8.033 1.00 28.72 N ANISOU 240 N TYR A 30 3628 3630 3655 -16 41 -34 N ATOM 241 CA TYR A 30 2.947 41.590 8.347 1.00 29.01 C ANISOU 241 CA TYR A 30 3675 3670 3678 -15 45 -27 C ATOM 242 C TYR A 30 3.806 40.344 8.552 1.00 30.37 C ANISOU 242 C TYR A 30 3846 3837 3857 -18 53 -25 C ATOM 243 O TYR A 30 4.956 40.312 8.117 1.00 32.43 O ANISOU 243 O TYR A 30 4114 4100 4108 -18 52 -26 O ATOM 244 CB TYR A 30 3.048 42.475 9.594 1.00 27.86 C ANISOU 244 CB TYR A 30 3531 3528 3525 -11 51 -18 C ATOM 245 CG TYR A 30 2.567 43.892 9.380 1.00 27.63 C ANISOU 245 CG TYR A 30 3507 3505 3487 -7 42 -20 C ATOM 246 CD1 TYR A 30 3.268 44.768 8.558 1.00 27.27 C ANISOU 246 CD1 TYR A 30 3473 3461 3429 -7 34 -22 C ATOM 247 CD2 TYR A 30 1.408 44.360 9.995 1.00 27.22 C ANISOU 247 CD2 TYR A 30 3449 3455 3439 -2 41 -20 C ATOM 248 CE1 TYR A 30 2.836 46.068 8.357 1.00 27.44 C ANISOU 248 CE1 TYR A 30 3499 3484 3441 -3 25 -23 C ATOM 249 CE2 TYR A 30 0.970 45.662 9.807 1.00 27.49 C ANISOU 249 CE2 TYR A 30 3488 3493 3464 3 32 -23 C ATOM 250 CZ TYR A 30 1.683 46.510 8.982 1.00 27.87 C ANISOU 250 CZ TYR A 30 3548 3541 3501 2 23 -24 C ATOM 251 OH TYR A 30 1.259 47.803 8.782 1.00 28.26 O ANISOU 251 OH TYR A 30 3604 3592 3542 7 13 -26 O ATOM 0 H TYR A 30 1.037 41.220 8.725 1.00 28.72 H new ATOM 0 HA TYR A 30 3.296 42.050 7.568 1.00 29.01 H new ATOM 0 HB2 TYR A 30 2.531 42.072 10.309 1.00 27.86 H new ATOM 0 HB3 TYR A 30 3.971 42.498 9.890 1.00 27.86 H new ATOM 0 HD1 TYR A 30 4.042 44.475 8.135 1.00 27.27 H new ATOM 0 HD2 TYR A 30 0.919 43.788 10.542 1.00 27.22 H new ATOM 0 HE1 TYR A 30 3.318 46.641 7.805 1.00 27.44 H new ATOM 0 HE2 TYR A 30 0.200 45.963 10.234 1.00 27.49 H new ATOM 0 HH TYR A 30 0.505 47.909 9.137 1.00 28.26 H new ATOM 252 N VAL A 31 3.258 39.333 9.223 1.00 30.21 N ANISOU 252 N VAL A 31 3816 3810 3853 -20 59 -21 N ATOM 253 CA VAL A 31 4.033 38.154 9.620 1.00 31.04 C ANISOU 253 CA VAL A 31 3920 3908 3964 -22 67 -17 C ATOM 254 C VAL A 31 3.885 37.013 8.608 1.00 33.15 C ANISOU 254 C VAL A 31 4184 4167 4245 -25 60 -28 C ATOM 255 O VAL A 31 4.880 36.514 8.086 1.00 32.50 O ANISOU 255 O VAL A 31 4107 4084 4158 -24 58 -32 O ATOM 256 CB VAL A 31 3.642 37.690 11.037 1.00 30.16 C ANISOU 256 CB VAL A 31 3802 3794 3863 -22 79 -4 C ATOM 257 CG1 VAL A 31 4.423 36.447 11.445 1.00 29.54 C ANISOU 257 CG1 VAL A 31 3724 3707 3792 -23 85 1 C ATOM 258 CG2 VAL A 31 3.875 38.819 12.035 1.00 29.91 C ANISOU 258 CG2 VAL A 31 3775 3772 3817 -16 83 4 C ATOM 0 H VAL A 31 2.432 39.309 9.461 1.00 30.21 H new ATOM 0 HA VAL A 31 4.968 38.411 9.633 1.00 31.04 H new ATOM 0 HB VAL A 31 2.700 37.459 11.034 1.00 30.16 H new ATOM 0 HG11 VAL A 31 4.158 36.177 12.338 1.00 29.54 H new ATOM 0 HG12 VAL A 31 4.236 35.728 10.822 1.00 29.54 H new ATOM 0 HG13 VAL A 31 5.373 36.644 11.435 1.00 29.54 H new ATOM 0 HG21 VAL A 31 3.627 38.521 12.924 1.00 29.91 H new ATOM 0 HG22 VAL A 31 4.812 39.069 12.028 1.00 29.91 H new ATOM 0 HG23 VAL A 31 3.334 39.586 11.789 1.00 29.91 H new ATOM 259 N LYS A 32 2.653 36.601 8.323 1.00 34.95 N ANISOU 259 N LYS A 32 4401 4388 4489 -29 56 -33 N ATOM 260 CA LYS A 32 2.424 35.567 7.311 1.00 36.46 C ANISOU 260 CA LYS A 32 4588 4571 4695 -31 46 -46 C ATOM 261 C LYS A 32 2.690 36.071 5.890 1.00 36.86 C ANISOU 261 C LYS A 32 4646 4627 4730 -26 34 -60 C ATOM 262 O LYS A 32 2.958 35.269 4.990 1.00 37.69 O ANISOU 262 O LYS A 32 4753 4729 4841 -25 26 -72 O ATOM 263 CB LYS A 32 0.996 35.025 7.388 1.00 38.11 C ANISOU 263 CB LYS A 32 4782 4770 4927 -36 44 -48 C ATOM 264 CG LYS A 32 0.656 34.316 8.689 1.00 39.67 C ANISOU 264 CG LYS A 32 4971 4960 5142 -42 57 -33 C ATOM 265 CD LYS A 32 -0.221 33.091 8.455 1.00 42.15 C ANISOU 265 CD LYS A 32 5271 5259 5486 -49 53 -37 C ATOM 266 CE LYS A 32 -1.561 33.439 7.822 1.00 43.32 C ANISOU 266 CE LYS A 32 5408 5407 5645 -51 43 -48 C ATOM 267 NZ LYS A 32 -2.092 32.309 7.006 1.00 44.64 N ANISOU 267 NZ LYS A 32 5565 5559 5838 -56 31 -61 N ATOM 0 H LYS A 32 1.941 36.903 8.699 1.00 34.95 H new ATOM 0 HA LYS A 32 3.054 34.856 7.506 1.00 36.46 H new ATOM 0 HB2 LYS A 32 0.376 35.761 7.263 1.00 38.11 H new ATOM 0 HB3 LYS A 32 0.857 34.409 6.652 1.00 38.11 H new ATOM 0 HG2 LYS A 32 1.475 34.047 9.134 1.00 39.67 H new ATOM 0 HG3 LYS A 32 0.199 34.932 9.283 1.00 39.67 H new ATOM 0 HD2 LYS A 32 0.250 32.465 7.882 1.00 42.15 H new ATOM 0 HD3 LYS A 32 -0.374 32.641 9.301 1.00 42.15 H new ATOM 0 HE2 LYS A 32 -2.199 33.665 8.517 1.00 43.32 H new ATOM 0 HE3 LYS A 32 -1.461 34.225 7.262 1.00 43.32 H new ATOM 0 HZ1 LYS A 32 -2.874 32.541 6.650 1.00 44.64 H new ATOM 0 HZ2 LYS A 32 -1.516 32.116 6.356 1.00 44.64 H new ATOM 0 HZ3 LYS A 32 -2.204 31.595 7.525 1.00 44.64 H new ATOM 268 N ASP A 33 2.609 37.390 5.696 1.00 36.97 N ANISOU 268 N ASP A 33 4667 4652 4728 -23 32 -59 N ATOM 269 CA ASP A 33 2.688 38.012 4.369 1.00 37.29 C ANISOU 269 CA ASP A 33 4714 4700 4754 -18 20 -70 C ATOM 270 C ASP A 33 1.617 37.434 3.437 1.00 37.84 C ANISOU 270 C ASP A 33 4776 4764 4838 -17 8 -85 C ATOM 271 O ASP A 33 1.828 37.284 2.232 1.00 36.11 O ANISOU 271 O ASP A 33 4562 4548 4611 -11 -3 -98 O ATOM 272 CB ASP A 33 4.092 37.852 3.769 1.00 37.96 C ANISOU 272 CB ASP A 33 4809 4790 4824 -15 21 -71 C ATOM 273 CG ASP A 33 4.327 38.747 2.561 1.00 38.86 C ANISOU 273 CG ASP A 33 4932 4915 4918 -9 13 -77 C ATOM 274 OD1 ASP A 33 3.566 39.718 2.356 1.00 40.12 O ANISOU 274 OD1 ASP A 33 5093 5078 5073 -8 8 -77 O ATOM 275 OD2 ASP A 33 5.283 38.473 1.803 1.00 40.37 O ANISOU 275 OD2 ASP A 33 5129 5111 5098 -5 12 -81 O ATOM 0 H ASP A 33 2.506 37.954 6.337 1.00 36.97 H new ATOM 0 HA ASP A 33 2.518 38.962 4.468 1.00 37.29 H new ATOM 0 HB2 ASP A 33 4.754 38.054 4.449 1.00 37.96 H new ATOM 0 HB3 ASP A 33 4.224 36.927 3.510 1.00 37.96 H new ATOM 276 N GLN A 34 0.467 37.111 4.023 1.00 36.85 N ANISOU 276 N GLN A 34 4638 4631 4732 -22 8 -84 N ATOM 277 CA GLN A 34 -0.654 36.519 3.309 1.00 37.14 C ANISOU 277 CA GLN A 34 4663 4660 4787 -22 -4 -99 C ATOM 278 C GLN A 34 -1.944 37.085 3.892 1.00 35.20 C ANISOU 278 C GLN A 34 4407 4416 4551 -25 -3 -95 C ATOM 279 O GLN A 34 -2.629 36.403 4.655 1.00 33.89 O ANISOU 279 O GLN A 34 4227 4241 4408 -32 3 -90 O ATOM 280 CB GLN A 34 -0.637 34.992 3.445 1.00 39.39 C ANISOU 280 CB GLN A 34 4939 4930 5095 -28 -4 -102 C ATOM 281 CG GLN A 34 0.481 34.314 2.667 1.00 42.03 C ANISOU 281 CG GLN A 34 5284 5264 5422 -22 -9 -111 C ATOM 282 CD GLN A 34 0.428 32.799 2.746 1.00 44.44 C ANISOU 282 CD GLN A 34 5581 5552 5753 -27 -12 -116 C ATOM 283 OE1 GLN A 34 -0.227 32.227 3.620 1.00 47.36 O ANISOU 283 OE1 GLN A 34 5939 5910 6146 -35 -6 -108 O ATOM 284 NE2 GLN A 34 1.125 32.138 1.828 1.00 46.27 N ANISOU 284 NE2 GLN A 34 5818 5782 5979 -20 -22 -130 N ATOM 0 H GLN A 34 0.316 37.233 4.861 1.00 36.85 H new ATOM 0 HA GLN A 34 -0.591 36.733 2.365 1.00 37.14 H new ATOM 0 HB2 GLN A 34 -0.552 34.761 4.383 1.00 39.39 H new ATOM 0 HB3 GLN A 34 -1.489 34.640 3.142 1.00 39.39 H new ATOM 0 HG2 GLN A 34 0.432 34.586 1.737 1.00 42.03 H new ATOM 0 HG3 GLN A 34 1.336 34.620 3.007 1.00 42.03 H new ATOM 0 HE21 GLN A 34 1.571 32.570 1.233 1.00 46.27 H new ATOM 0 HE22 GLN A 34 1.130 31.278 1.829 1.00 46.27 H new ATOM 285 N PRO A 35 -2.267 38.346 3.551 1.00 34.59 N ANISOU 285 N PRO A 35 4336 4349 4458 -19 -8 -97 N ATOM 286 CA PRO A 35 -3.489 38.946 4.087 1.00 33.08 C ANISOU 286 CA PRO A 35 4134 4160 4274 -20 -8 -95 C ATOM 287 C PRO A 35 -4.740 38.262 3.543 1.00 33.26 C ANISOU 287 C PRO A 35 4141 4176 4321 -22 -19 -109 C ATOM 288 O PRO A 35 -4.825 38.003 2.341 1.00 33.03 O ANISOU 288 O PRO A 35 4115 4145 4291 -17 -34 -125 O ATOM 289 CB PRO A 35 -3.416 40.404 3.609 1.00 33.56 C ANISOU 289 CB PRO A 35 4208 4233 4312 -12 -14 -96 C ATOM 290 CG PRO A 35 -2.514 40.381 2.431 1.00 33.96 C ANISOU 290 CG PRO A 35 4271 4285 4346 -7 -22 -104 C ATOM 291 CD PRO A 35 -1.531 39.276 2.675 1.00 34.07 C ANISOU 291 CD PRO A 35 4286 4292 4365 -12 -14 -100 C ATOM 0 HA PRO A 35 -3.548 38.861 5.052 1.00 33.08 H new ATOM 0 HB2 PRO A 35 -4.295 40.740 3.371 1.00 33.56 H new ATOM 0 HB3 PRO A 35 -3.069 40.984 4.305 1.00 33.56 H new ATOM 0 HG2 PRO A 35 -3.015 40.225 1.615 1.00 33.96 H new ATOM 0 HG3 PRO A 35 -2.060 41.232 2.327 1.00 33.96 H new ATOM 0 HD2 PRO A 35 -1.261 38.849 1.847 1.00 34.07 H new ATOM 0 HD3 PRO A 35 -0.724 39.604 3.101 1.00 34.07 H new ATOM 292 N SER A 36 -5.684 37.965 4.432 1.00 31.37 N ANISOU 292 N SER A 36 3885 3932 4101 -28 -12 -103 N ATOM 293 CA SER A 36 -6.963 37.375 4.042 1.00 31.57 C ANISOU 293 CA SER A 36 3892 3951 4152 -31 -21 -115 C ATOM 294 C SER A 36 -7.955 38.439 3.559 1.00 31.57 C ANISOU 294 C SER A 36 3890 3961 4146 -24 -33 -125 C ATOM 295 O SER A 36 -8.948 38.113 2.903 1.00 31.95 O ANISOU 295 O SER A 36 3926 4005 4211 -24 -46 -140 O ATOM 296 CB SER A 36 -7.566 36.576 5.204 1.00 31.69 C ANISOU 296 CB SER A 36 3889 3959 4194 -42 -8 -102 C ATOM 297 OG SER A 36 -7.984 37.420 6.266 1.00 31.80 O ANISOU 297 OG SER A 36 3898 3983 4200 -40 5 -88 O ATOM 0 H SER A 36 -5.602 38.099 5.277 1.00 31.37 H new ATOM 0 HA SER A 36 -6.791 36.773 3.301 1.00 31.57 H new ATOM 0 HB2 SER A 36 -8.323 36.061 4.884 1.00 31.69 H new ATOM 0 HB3 SER A 36 -6.911 35.942 5.534 1.00 31.69 H new ATOM 0 HG SER A 36 -7.350 37.525 6.807 1.00 31.80 H new ATOM 298 N VAL A 37 -7.700 39.705 3.888 1.00 30.69 N ANISOU 298 N VAL A 37 3789 3860 4010 -17 -29 -117 N ATOM 299 CA VAL A 37 -8.583 40.796 3.463 1.00 30.39 C ANISOU 299 CA VAL A 37 3751 3831 3963 -8 -40 -126 C ATOM 300 C VAL A 37 -7.806 41.928 2.798 1.00 30.79 C ANISOU 300 C VAL A 37 3824 3889 3984 1 -47 -127 C ATOM 301 O VAL A 37 -6.620 42.135 3.081 1.00 29.97 O ANISOU 301 O VAL A 37 3735 3787 3864 0 -38 -116 O ATOM 302 CB VAL A 37 -9.425 41.349 4.636 1.00 29.96 C ANISOU 302 CB VAL A 37 3684 3783 3914 -9 -30 -116 C ATOM 303 CG1 VAL A 37 -10.213 40.220 5.292 1.00 30.14 C ANISOU 303 CG1 VAL A 37 3684 3800 3969 -19 -21 -113 C ATOM 304 CG2 VAL A 37 -8.552 42.071 5.661 1.00 29.07 C ANISOU 304 CG2 VAL A 37 3585 3678 3783 -6 -16 -99 C ATOM 0 H VAL A 37 -7.023 39.955 4.356 1.00 30.69 H new ATOM 0 HA VAL A 37 -9.189 40.416 2.808 1.00 30.39 H new ATOM 0 HB VAL A 37 -10.049 42.000 4.279 1.00 29.96 H new ATOM 0 HG11 VAL A 37 -10.738 40.576 6.026 1.00 30.14 H new ATOM 0 HG12 VAL A 37 -10.805 39.816 4.638 1.00 30.14 H new ATOM 0 HG13 VAL A 37 -9.598 39.550 5.629 1.00 30.14 H new ATOM 0 HG21 VAL A 37 -9.108 42.405 6.382 1.00 29.07 H new ATOM 0 HG22 VAL A 37 -7.895 41.453 6.019 1.00 29.07 H new ATOM 0 HG23 VAL A 37 -8.097 42.813 5.233 1.00 29.07 H new ATOM 305 N GLU A 38 -8.485 42.653 1.910 1.00 31.37 N ANISOU 305 N GLU A 38 3901 3968 4049 10 -63 -140 N ATOM 306 CA GLU A 38 -7.904 43.831 1.269 1.00 32.63 C ANISOU 306 CA GLU A 38 4082 4135 4182 20 -69 -139 C ATOM 307 C GLU A 38 -7.770 44.967 2.279 1.00 31.05 C ANISOU 307 C GLU A 38 3888 3941 3970 22 -61 -126 C ATOM 308 O GLU A 38 -8.475 45.003 3.287 1.00 29.68 O ANISOU 308 O GLU A 38 3700 3768 3807 20 -54 -121 O ATOM 309 CB GLU A 38 -8.755 44.290 0.081 1.00 35.16 C ANISOU 309 CB GLU A 38 4404 4458 4497 30 -89 -156 C ATOM 310 CG GLU A 38 -8.761 43.325 -1.095 1.00 37.41 C ANISOU 310 CG GLU A 38 4687 4738 4789 33 -101 -173 C ATOM 311 CD GLU A 38 -9.452 43.903 -2.319 1.00 40.19 C ANISOU 311 CD GLU A 38 5044 5096 5131 46 -121 -189 C ATOM 312 OE1 GLU A 38 -10.577 43.460 -2.638 1.00 43.12 O ANISOU 312 OE1 GLU A 38 5400 5464 5520 48 -133 -205 O ATOM 313 OE2 GLU A 38 -8.876 44.811 -2.957 1.00 42.03 O ANISOU 313 OE2 GLU A 38 5297 5336 5338 55 -125 -185 O ATOM 0 H GLU A 38 -9.290 42.477 1.664 1.00 31.37 H new ATOM 0 HA GLU A 38 -7.025 43.589 0.939 1.00 32.63 H new ATOM 0 HB2 GLU A 38 -9.668 44.422 0.382 1.00 35.16 H new ATOM 0 HB3 GLU A 38 -8.429 45.152 -0.223 1.00 35.16 H new ATOM 0 HG2 GLU A 38 -7.847 43.092 -1.323 1.00 37.41 H new ATOM 0 HG3 GLU A 38 -9.206 42.504 -0.833 1.00 37.41 H new ATOM 314 N ASP A 39 -6.863 45.894 1.997 1.00 30.15 N ANISOU 314 N ASP A 39 3793 3829 3833 26 -62 -119 N ATOM 315 CA ASP A 39 -6.573 46.995 2.914 1.00 29.40 C ANISOU 315 CA ASP A 39 3705 3738 3726 28 -56 -107 C ATOM 316 C ASP A 39 -7.822 47.799 3.291 1.00 29.53 C ANISOU 316 C ASP A 39 3715 3760 3746 36 -63 -112 C ATOM 317 O ASP A 39 -7.940 48.241 4.431 1.00 30.31 O ANISOU 317 O ASP A 39 3809 3861 3845 36 -55 -104 O ATOM 318 CB ASP A 39 -5.508 47.923 2.317 1.00 29.43 C ANISOU 318 CB ASP A 39 3731 3744 3708 31 -60 -100 C ATOM 319 CG ASP A 39 -4.145 47.251 2.180 1.00 30.32 C ANISOU 319 CG ASP A 39 3850 3853 3816 24 -51 -93 C ATOM 320 OD1 ASP A 39 -3.911 46.193 2.806 1.00 29.48 O ANISOU 320 OD1 ASP A 39 3733 3744 3722 17 -40 -90 O ATOM 321 OD2 ASP A 39 -3.293 47.790 1.441 1.00 30.76 O ANISOU 321 OD2 ASP A 39 3922 3912 3856 26 -54 -89 O ATOM 0 H ASP A 39 -6.399 45.905 1.273 1.00 30.15 H new ATOM 0 HA ASP A 39 -6.235 46.596 3.731 1.00 29.40 H new ATOM 0 HB2 ASP A 39 -5.803 48.227 1.444 1.00 29.43 H new ATOM 0 HB3 ASP A 39 -5.421 48.710 2.877 1.00 29.43 H new ATOM 322 N TYR A 40 -8.755 47.976 2.353 1.00 29.67 N ANISOU 322 N TYR A 40 3730 3779 3766 43 -78 -126 N ATOM 323 CA TYR A 40 -9.965 48.753 2.635 1.00 29.84 C ANISOU 323 CA TYR A 40 3744 3805 3790 51 -86 -132 C ATOM 324 C TYR A 40 -10.797 48.121 3.755 1.00 28.16 C ANISOU 324 C TYR A 40 3507 3595 3597 47 -75 -131 C ATOM 325 O TYR A 40 -11.392 48.832 4.561 1.00 28.38 O ANISOU 325 O TYR A 40 3530 3629 3623 53 -74 -129 O ATOM 326 CB TYR A 40 -10.815 48.984 1.367 1.00 31.05 C ANISOU 326 CB TYR A 40 3897 3959 3940 60 -106 -149 C ATOM 327 CG TYR A 40 -11.678 47.817 0.923 1.00 32.88 C ANISOU 327 CG TYR A 40 4109 4189 4194 57 -110 -163 C ATOM 328 CD1 TYR A 40 -11.223 46.915 -0.033 1.00 33.81 C ANISOU 328 CD1 TYR A 40 4230 4302 4314 54 -114 -170 C ATOM 329 CD2 TYR A 40 -12.965 47.631 1.440 1.00 34.75 C ANISOU 329 CD2 TYR A 40 4325 4429 4451 58 -111 -171 C ATOM 330 CE1 TYR A 40 -12.010 45.856 -0.453 1.00 34.31 C ANISOU 330 CE1 TYR A 40 4275 4361 4399 51 -121 -185 C ATOM 331 CE2 TYR A 40 -13.760 46.572 1.023 1.00 35.07 C ANISOU 331 CE2 TYR A 40 4346 4467 4514 54 -116 -184 C ATOM 332 CZ TYR A 40 -13.277 45.688 0.077 1.00 35.27 C ANISOU 332 CZ TYR A 40 4374 4484 4542 50 -122 -192 C ATOM 333 OH TYR A 40 -14.048 44.626 -0.347 1.00 36.20 O ANISOU 333 OH TYR A 40 4473 4596 4685 46 -130 -206 O ATOM 0 H TYR A 40 -8.708 47.658 1.555 1.00 29.67 H new ATOM 0 HA TYR A 40 -9.671 49.624 2.945 1.00 29.84 H new ATOM 0 HB2 TYR A 40 -11.391 49.749 1.520 1.00 31.05 H new ATOM 0 HB3 TYR A 40 -10.219 49.219 0.638 1.00 31.05 H new ATOM 0 HD1 TYR A 40 -10.374 47.025 -0.397 1.00 33.81 H new ATOM 0 HD2 TYR A 40 -13.293 48.227 2.074 1.00 34.75 H new ATOM 0 HE1 TYR A 40 -11.688 45.259 -1.090 1.00 34.31 H new ATOM 0 HE2 TYR A 40 -14.612 46.458 1.378 1.00 35.07 H new ATOM 0 HH TYR A 40 -14.788 44.640 0.051 1.00 36.20 H new ATOM 334 N VAL A 41 -10.810 46.792 3.816 1.00 28.05 N ANISOU 334 N VAL A 41 3479 3576 3602 36 -68 -131 N ATOM 335 CA VAL A 41 -11.530 46.076 4.870 1.00 26.78 C ANISOU 335 CA VAL A 41 3296 3417 3462 30 -55 -127 C ATOM 336 C VAL A 41 -10.883 46.353 6.230 1.00 26.24 C ANISOU 336 C VAL A 41 3231 3352 3386 29 -38 -109 C ATOM 337 O VAL A 41 -11.562 46.728 7.194 1.00 26.13 O ANISOU 337 O VAL A 41 3207 3347 3376 33 -31 -105 O ATOM 338 CB VAL A 41 -11.563 44.559 4.601 1.00 27.38 C ANISOU 338 CB VAL A 41 3358 3483 3561 18 -51 -130 C ATOM 339 CG1 VAL A 41 -12.184 43.819 5.778 1.00 26.68 C ANISOU 339 CG1 VAL A 41 3248 3396 3495 11 -35 -120 C ATOM 340 CG2 VAL A 41 -12.336 44.261 3.323 1.00 27.24 C ANISOU 340 CG2 VAL A 41 3335 3462 3553 21 -70 -150 C ATOM 0 H VAL A 41 -10.406 46.282 3.253 1.00 28.05 H new ATOM 0 HA VAL A 41 -12.445 46.398 4.877 1.00 26.78 H new ATOM 0 HB VAL A 41 -10.650 44.250 4.490 1.00 27.38 H new ATOM 0 HG11 VAL A 41 -12.197 42.867 5.592 1.00 26.68 H new ATOM 0 HG12 VAL A 41 -11.660 43.985 6.577 1.00 26.68 H new ATOM 0 HG13 VAL A 41 -13.091 44.133 5.916 1.00 26.68 H new ATOM 0 HG21 VAL A 41 -12.348 43.304 3.168 1.00 27.24 H new ATOM 0 HG22 VAL A 41 -13.246 44.585 3.412 1.00 27.24 H new ATOM 0 HG23 VAL A 41 -11.907 44.704 2.574 1.00 27.24 H new ATOM 341 N TYR A 42 -9.566 46.170 6.298 1.00 25.16 N ANISOU 341 N TYR A 42 3110 3211 3240 24 -31 -100 N ATOM 342 CA TYR A 42 -8.799 46.475 7.505 1.00 25.22 C ANISOU 342 CA TYR A 42 3123 3221 3238 25 -17 -85 C ATOM 343 C TYR A 42 -9.011 47.924 7.940 1.00 25.39 C ANISOU 343 C TYR A 42 3154 3251 3244 37 -23 -84 C ATOM 344 O TYR A 42 -9.303 48.192 9.103 1.00 25.32 O ANISOU 344 O TYR A 42 3137 3249 3234 41 -14 -78 O ATOM 345 CB TYR A 42 -7.311 46.209 7.275 1.00 25.19 C ANISOU 345 CB TYR A 42 3136 3212 3224 19 -13 -78 C ATOM 346 CG TYR A 42 -6.427 46.584 8.451 1.00 25.17 C ANISOU 346 CG TYR A 42 3141 3212 3212 21 -2 -64 C ATOM 347 CD1 TYR A 42 -6.176 45.675 9.476 1.00 25.39 C ANISOU 347 CD1 TYR A 42 3159 3239 3248 15 14 -53 C ATOM 348 CD2 TYR A 42 -5.861 47.847 8.543 1.00 24.83 C ANISOU 348 CD2 TYR A 42 3113 3171 3149 28 -8 -62 C ATOM 349 CE1 TYR A 42 -5.372 46.013 10.551 1.00 25.15 C ANISOU 349 CE1 TYR A 42 3136 3212 3207 19 24 -42 C ATOM 350 CE2 TYR A 42 -5.059 48.198 9.616 1.00 25.42 C ANISOU 350 CE2 TYR A 42 3195 3248 3216 30 0 -51 C ATOM 351 CZ TYR A 42 -4.821 47.277 10.617 1.00 24.98 C ANISOU 351 CZ TYR A 42 3130 3193 3168 26 16 -42 C ATOM 352 OH TYR A 42 -4.024 47.625 11.686 1.00 26.72 O ANISOU 352 OH TYR A 42 3356 3416 3379 30 23 -33 O ATOM 0 H TYR A 42 -9.093 45.866 5.647 1.00 25.16 H new ATOM 0 HA TYR A 42 -9.117 45.894 8.214 1.00 25.22 H new ATOM 0 HB2 TYR A 42 -7.187 45.268 7.077 1.00 25.19 H new ATOM 0 HB3 TYR A 42 -7.021 46.704 6.493 1.00 25.19 H new ATOM 0 HD1 TYR A 42 -6.555 44.827 9.438 1.00 25.39 H new ATOM 0 HD2 TYR A 42 -6.023 48.470 7.872 1.00 24.83 H new ATOM 0 HE1 TYR A 42 -5.204 45.393 11.224 1.00 25.15 H new ATOM 0 HE2 TYR A 42 -4.684 49.048 9.662 1.00 25.42 H new ATOM 0 HH TYR A 42 -3.609 48.333 11.507 1.00 26.72 H new ATOM 353 N ASP A 43 -8.866 48.856 7.000 1.00 25.38 N ANISOU 353 N ASP A 43 3167 3248 3228 43 -39 -92 N ATOM 354 CA ASP A 43 -8.985 50.281 7.306 1.00 25.84 C ANISOU 354 CA ASP A 43 3236 3311 3272 54 -47 -92 C ATOM 355 C ASP A 43 -10.370 50.627 7.864 1.00 25.64 C ANISOU 355 C ASP A 43 3195 3295 3253 63 -49 -98 C ATOM 356 O ASP A 43 -10.493 51.458 8.765 1.00 24.80 O ANISOU 356 O ASP A 43 3090 3194 3138 73 -48 -95 O ATOM 357 CB ASP A 43 -8.700 51.130 6.063 1.00 26.98 C ANISOU 357 CB ASP A 43 3399 3451 3402 58 -64 -98 C ATOM 358 CG ASP A 43 -7.253 51.038 5.601 1.00 28.11 C ANISOU 358 CG ASP A 43 3558 3587 3535 51 -61 -89 C ATOM 359 OD1 ASP A 43 -6.396 50.574 6.381 1.00 28.82 O ANISOU 359 OD1 ASP A 43 3647 3676 3626 45 -48 -79 O ATOM 360 OD2 ASP A 43 -6.971 51.430 4.446 1.00 28.84 O ANISOU 360 OD2 ASP A 43 3663 3676 3618 53 -72 -93 O ATOM 0 H ASP A 43 -8.697 48.683 6.175 1.00 25.38 H new ATOM 0 HA ASP A 43 -8.325 50.483 7.987 1.00 25.84 H new ATOM 0 HB2 ASP A 43 -9.283 50.846 5.342 1.00 26.98 H new ATOM 0 HB3 ASP A 43 -8.915 52.056 6.254 1.00 26.98 H new ATOM 361 N ARG A 44 -11.399 49.982 7.324 1.00 25.14 N ANISOU 361 N ARG A 44 3115 3232 3204 61 -53 -108 N ATOM 362 CA ARG A 44 -12.775 50.228 7.746 1.00 26.29 C ANISOU 362 CA ARG A 44 3243 3388 3359 70 -55 -115 C ATOM 363 C ARG A 44 -12.993 49.825 9.198 1.00 25.71 C ANISOU 363 C ARG A 44 3154 3323 3293 69 -36 -104 C ATOM 364 O ARG A 44 -13.559 50.585 9.974 1.00 25.84 O ANISOU 364 O ARG A 44 3167 3350 3303 81 -36 -105 O ATOM 365 CB ARG A 44 -13.756 49.464 6.857 1.00 26.63 C ANISOU 365 CB ARG A 44 3270 3429 3420 65 -62 -128 C ATOM 366 CG ARG A 44 -15.209 49.741 7.183 1.00 27.83 C ANISOU 366 CG ARG A 44 3401 3591 3582 74 -66 -137 C ATOM 367 CD ARG A 44 -16.163 48.951 6.310 1.00 27.72 C ANISOU 367 CD ARG A 44 3369 3574 3588 69 -74 -151 C ATOM 368 NE ARG A 44 -17.533 49.110 6.792 1.00 28.39 N ANISOU 368 NE ARG A 44 3431 3671 3686 76 -74 -158 N ATOM 369 CZ ARG A 44 -18.608 48.565 6.232 1.00 29.21 C ANISOU 369 CZ ARG A 44 3514 3775 3810 73 -81 -171 C ATOM 370 NH1 ARG A 44 -18.500 47.803 5.152 1.00 29.62 N ANISOU 370 NH1 ARG A 44 3566 3816 3872 66 -91 -181 N ATOM 371 NH2 ARG A 44 -19.809 48.785 6.767 1.00 30.42 N ANISOU 371 NH2 ARG A 44 3644 3940 3972 80 -80 -176 N ATOM 0 H ARG A 44 -11.320 49.391 6.704 1.00 25.14 H new ATOM 0 HA ARG A 44 -12.936 51.181 7.661 1.00 26.29 H new ATOM 0 HB2 ARG A 44 -13.590 49.697 5.930 1.00 26.63 H new ATOM 0 HB3 ARG A 44 -13.588 48.513 6.945 1.00 26.63 H new ATOM 0 HG2 ARG A 44 -15.375 49.526 8.114 1.00 27.83 H new ATOM 0 HG3 ARG A 44 -15.386 50.689 7.075 1.00 27.83 H new ATOM 0 HD2 ARG A 44 -16.099 49.255 5.391 1.00 27.72 H new ATOM 0 HD3 ARG A 44 -15.917 48.013 6.317 1.00 27.72 H new ATOM 0 HE ARG A 44 -17.653 49.594 7.493 1.00 28.39 H new ATOM 0 HH11 ARG A 44 -17.727 47.656 4.805 1.00 29.62 H new ATOM 0 HH12 ARG A 44 -19.203 47.456 4.799 1.00 29.62 H new ATOM 0 HH21 ARG A 44 -19.884 49.276 7.469 1.00 30.42 H new ATOM 0 HH22 ARG A 44 -20.509 48.436 6.410 1.00 30.42 H new ATOM 372 N LEU A 45 -12.555 48.621 9.553 1.00 25.66 N ANISOU 372 N LEU A 45 3139 3311 3298 56 -21 -94 N ATOM 373 CA LEU A 45 -12.699 48.131 10.923 1.00 25.83 C ANISOU 373 CA LEU A 45 3147 3341 3327 55 -1 -81 C ATOM 374 C LEU A 45 -11.819 48.920 11.896 1.00 26.15 C ANISOU 374 C LEU A 45 3202 3386 3346 64 4 -72 C ATOM 375 O LEU A 45 -12.216 49.161 13.039 1.00 25.58 O ANISOU 375 O LEU A 45 3122 3326 3271 73 14 -65 O ATOM 376 CB LEU A 45 -12.395 46.628 10.989 1.00 26.12 C ANISOU 376 CB LEU A 45 3174 3370 3382 40 13 -72 C ATOM 377 CG LEU A 45 -13.393 45.744 10.227 1.00 25.76 C ANISOU 377 CG LEU A 45 3108 3319 3361 31 8 -82 C ATOM 378 CD1 LEU A 45 -12.962 44.285 10.216 1.00 26.10 C ANISOU 378 CD1 LEU A 45 3144 3351 3423 15 19 -74 C ATOM 379 CD2 LEU A 45 -14.802 45.873 10.799 1.00 25.66 C ANISOU 379 CD2 LEU A 45 3071 3319 3360 36 13 -84 C ATOM 0 H LEU A 45 -12.171 48.070 9.016 1.00 25.66 H new ATOM 0 HA LEU A 45 -13.620 48.267 11.196 1.00 25.83 H new ATOM 0 HB2 LEU A 45 -11.506 46.473 10.634 1.00 26.12 H new ATOM 0 HB3 LEU A 45 -12.381 46.353 11.919 1.00 26.12 H new ATOM 0 HG LEU A 45 -13.404 46.061 9.310 1.00 25.76 H new ATOM 0 HD11 LEU A 45 -13.614 43.758 9.728 1.00 26.10 H new ATOM 0 HD12 LEU A 45 -12.096 44.206 9.786 1.00 26.10 H new ATOM 0 HD13 LEU A 45 -12.901 43.959 11.127 1.00 26.10 H new ATOM 0 HD21 LEU A 45 -15.408 45.305 10.298 1.00 25.66 H new ATOM 0 HD22 LEU A 45 -14.800 45.601 11.730 1.00 25.66 H new ATOM 0 HD23 LEU A 45 -15.095 46.795 10.732 1.00 25.66 H new ATOM 380 N TYR A 46 -10.643 49.340 11.433 1.00 25.69 N ANISOU 380 N TYR A 46 3167 3320 3275 63 -3 -71 N ATOM 381 CA TYR A 46 -9.734 50.155 12.238 1.00 26.74 C ANISOU 381 CA TYR A 46 3315 3454 3390 71 -2 -64 C ATOM 382 C TYR A 46 -10.381 51.496 12.613 1.00 26.51 C ANISOU 382 C TYR A 46 3289 3434 3350 88 -13 -71 C ATOM 383 O TYR A 46 -10.341 51.909 13.771 1.00 26.74 O ANISOU 383 O TYR A 46 3318 3472 3371 98 -6 -66 O ATOM 384 CB TYR A 46 -8.419 50.377 11.480 1.00 27.23 C ANISOU 384 CB TYR A 46 3399 3505 3443 64 -9 -63 C ATOM 385 CG TYR A 46 -7.355 51.089 12.278 1.00 28.00 C ANISOU 385 CG TYR A 46 3511 3602 3526 70 -8 -56 C ATOM 386 CD1 TYR A 46 -6.429 50.375 13.036 1.00 29.12 C ANISOU 386 CD1 TYR A 46 3653 3743 3668 65 7 -45 C ATOM 387 CD2 TYR A 46 -7.274 52.478 12.279 1.00 28.54 C ANISOU 387 CD2 TYR A 46 3593 3670 3581 81 -22 -61 C ATOM 388 CE1 TYR A 46 -5.453 51.030 13.775 1.00 29.19 C ANISOU 388 CE1 TYR A 46 3675 3752 3664 70 6 -40 C ATOM 389 CE2 TYR A 46 -6.307 53.138 13.011 1.00 28.47 C ANISOU 389 CE2 TYR A 46 3596 3660 3561 86 -23 -56 C ATOM 390 CZ TYR A 46 -5.400 52.411 13.757 1.00 29.39 C ANISOU 390 CZ TYR A 46 3712 3776 3678 81 -9 -46 C ATOM 391 OH TYR A 46 -4.436 53.079 14.480 1.00 31.04 O ANISOU 391 OH TYR A 46 3933 3984 3877 86 -12 -42 O ATOM 0 H TYR A 46 -10.350 49.161 10.645 1.00 25.69 H new ATOM 0 HA TYR A 46 -9.543 49.681 13.062 1.00 26.74 H new ATOM 0 HB2 TYR A 46 -8.073 49.517 11.195 1.00 27.23 H new ATOM 0 HB3 TYR A 46 -8.603 50.889 10.677 1.00 27.23 H new ATOM 0 HD1 TYR A 46 -6.465 49.446 13.047 1.00 29.12 H new ATOM 0 HD2 TYR A 46 -7.882 52.971 11.777 1.00 28.54 H new ATOM 0 HE1 TYR A 46 -4.840 50.544 14.278 1.00 29.19 H new ATOM 0 HE2 TYR A 46 -6.267 54.067 13.002 1.00 28.47 H new ATOM 0 HH TYR A 46 -4.528 53.907 14.372 1.00 31.04 H new ATOM 392 N LYS A 47 -10.991 52.160 11.635 1.00 26.69 N ANISOU 392 N LYS A 47 3316 3455 3371 92 -30 -84 N ATOM 393 CA LYS A 47 -11.709 53.407 11.891 1.00 27.35 C ANISOU 393 CA LYS A 47 3402 3546 3445 109 -42 -92 C ATOM 394 C LYS A 47 -12.838 53.225 12.913 1.00 26.44 C ANISOU 394 C LYS A 47 3264 3446 3336 118 -32 -92 C ATOM 395 O LYS A 47 -13.034 54.080 13.778 1.00 26.10 O ANISOU 395 O LYS A 47 3223 3413 3282 134 -34 -94 O ATOM 396 CB LYS A 47 -12.271 53.989 10.593 1.00 28.44 C ANISOU 396 CB LYS A 47 3546 3678 3582 111 -62 -105 C ATOM 397 CG LYS A 47 -12.962 55.330 10.793 1.00 30.20 C ANISOU 397 CG LYS A 47 3773 3907 3795 130 -77 -115 C ATOM 398 CD LYS A 47 -13.502 55.888 9.489 1.00 31.33 C ANISOU 398 CD LYS A 47 3923 4044 3936 133 -97 -127 C ATOM 399 CE LYS A 47 -14.086 57.275 9.689 1.00 32.93 C ANISOU 399 CE LYS A 47 4133 4250 4128 152 -114 -136 C ATOM 400 NZ LYS A 47 -15.178 57.289 10.698 1.00 34.22 N ANISOU 400 NZ LYS A 47 4276 4431 4296 164 -108 -141 N ATOM 0 H LYS A 47 -11.001 51.905 10.814 1.00 26.69 H new ATOM 0 HA LYS A 47 -11.066 54.028 12.267 1.00 27.35 H new ATOM 0 HB2 LYS A 47 -11.550 54.095 9.953 1.00 28.44 H new ATOM 0 HB3 LYS A 47 -12.902 53.360 10.209 1.00 28.44 H new ATOM 0 HG2 LYS A 47 -13.689 55.227 11.426 1.00 30.20 H new ATOM 0 HG3 LYS A 47 -12.336 55.962 11.180 1.00 30.20 H new ATOM 0 HD2 LYS A 47 -12.791 55.925 8.830 1.00 31.33 H new ATOM 0 HD3 LYS A 47 -14.184 55.294 9.137 1.00 31.33 H new ATOM 0 HE2 LYS A 47 -13.383 57.882 9.968 1.00 32.93 H new ATOM 0 HE3 LYS A 47 -14.426 57.605 8.843 1.00 32.93 H new ATOM 0 HZ1 LYS A 47 -15.569 58.089 10.702 1.00 34.22 H new ATOM 0 HZ2 LYS A 47 -15.780 56.666 10.493 1.00 34.22 H new ATOM 0 HZ3 LYS A 47 -14.840 57.121 11.504 1.00 34.22 H new ATOM 401 N GLU A 48 -13.572 52.115 12.822 1.00 26.46 N ANISOU 401 N GLU A 48 3245 3452 3356 109 -21 -91 N ATOM 402 CA GLU A 48 -14.657 51.850 13.770 1.00 25.59 C ANISOU 402 CA GLU A 48 3111 3358 3253 116 -8 -89 C ATOM 403 C GLU A 48 -14.109 51.810 15.197 1.00 25.87 C ANISOU 403 C GLU A 48 3147 3404 3279 123 8 -75 C ATOM 404 O GLU A 48 -14.707 52.386 16.108 1.00 26.43 O ANISOU 404 O GLU A 48 3211 3490 3342 139 11 -76 O ATOM 405 CB GLU A 48 -15.386 50.539 13.451 1.00 25.62 C ANISOU 405 CB GLU A 48 3092 3362 3282 102 2 -87 C ATOM 406 CG GLU A 48 -16.715 50.407 14.179 1.00 25.85 C ANISOU 406 CG GLU A 48 3092 3408 3320 109 12 -87 C ATOM 407 CD GLU A 48 -17.310 49.015 14.114 1.00 26.08 C ANISOU 407 CD GLU A 48 3097 3436 3376 93 26 -80 C ATOM 408 OE1 GLU A 48 -17.022 48.255 13.163 1.00 25.31 O ANISOU 408 OE1 GLU A 48 3001 3323 3292 78 21 -83 O ATOM 409 OE2 GLU A 48 -18.073 48.669 15.040 1.00 27.03 O ANISOU 409 OE2 GLU A 48 3195 3571 3505 96 43 -71 O ATOM 0 H GLU A 48 -13.460 51.507 12.224 1.00 26.46 H new ATOM 0 HA GLU A 48 -15.300 52.572 13.689 1.00 25.59 H new ATOM 0 HB2 GLU A 48 -15.540 50.484 12.495 1.00 25.62 H new ATOM 0 HB3 GLU A 48 -14.816 49.791 13.690 1.00 25.62 H new ATOM 0 HG2 GLU A 48 -16.591 50.654 15.109 1.00 25.85 H new ATOM 0 HG3 GLU A 48 -17.347 51.038 13.800 1.00 25.85 H new ATOM 410 N LEU A 49 -12.964 51.143 15.374 1.00 25.42 N ANISOU 410 N LEU A 49 3099 3337 3221 112 18 -63 N ATOM 411 CA LEU A 49 -12.291 51.072 16.674 1.00 25.67 C ANISOU 411 CA LEU A 49 3134 3375 3242 118 32 -51 C ATOM 412 C LEU A 49 -11.845 52.455 17.157 1.00 26.24 C ANISOU 412 C LEU A 49 3225 3452 3294 136 19 -57 C ATOM 413 O LEU A 49 -12.074 52.810 18.313 1.00 25.48 O ANISOU 413 O LEU A 49 3124 3370 3188 152 26 -54 O ATOM 414 CB LEU A 49 -11.083 50.122 16.618 1.00 24.97 C ANISOU 414 CB LEU A 49 3054 3274 3158 103 42 -39 C ATOM 415 CG LEU A 49 -10.269 49.975 17.910 1.00 25.03 C ANISOU 415 CG LEU A 49 3067 3289 3155 110 56 -26 C ATOM 416 CD1 LEU A 49 -11.135 49.470 19.053 1.00 25.19 C ANISOU 416 CD1 LEU A 49 3067 3327 3178 118 75 -16 C ATOM 417 CD2 LEU A 49 -9.070 49.060 17.707 1.00 25.13 C ANISOU 417 CD2 LEU A 49 3089 3288 3172 95 63 -17 C ATOM 0 H LEU A 49 -12.557 50.720 14.745 1.00 25.42 H new ATOM 0 HA LEU A 49 -12.936 50.723 17.309 1.00 25.67 H new ATOM 0 HB2 LEU A 49 -11.400 49.243 16.357 1.00 24.97 H new ATOM 0 HB3 LEU A 49 -10.487 50.429 15.917 1.00 24.97 H new ATOM 0 HG LEU A 49 -9.940 50.857 18.146 1.00 25.03 H new ATOM 0 HD11 LEU A 49 -10.596 49.387 19.855 1.00 25.19 H new ATOM 0 HD12 LEU A 49 -11.858 50.097 19.213 1.00 25.19 H new ATOM 0 HD13 LEU A 49 -11.505 48.604 18.821 1.00 25.19 H new ATOM 0 HD21 LEU A 49 -8.575 48.986 18.538 1.00 25.13 H new ATOM 0 HD22 LEU A 49 -9.376 48.181 17.434 1.00 25.13 H new ATOM 0 HD23 LEU A 49 -8.494 49.429 17.020 1.00 25.13 H new ATOM 418 N VAL A 50 -11.218 53.228 16.270 1.00 26.53 N ANISOU 418 N VAL A 50 3281 3475 3324 134 0 -65 N ATOM 419 CA VAL A 50 -10.797 54.597 16.597 1.00 26.79 C ANISOU 419 CA VAL A 50 3332 3507 3341 150 -15 -72 C ATOM 420 C VAL A 50 -11.981 55.415 17.130 1.00 27.36 C ANISOU 420 C VAL A 50 3394 3595 3407 170 -22 -82 C ATOM 421 O VAL A 50 -11.875 56.071 18.173 1.00 26.80 O ANISOU 421 O VAL A 50 3327 3533 3323 188 -23 -83 O ATOM 422 CB VAL A 50 -10.157 55.312 15.384 1.00 26.83 C ANISOU 422 CB VAL A 50 3357 3495 3342 143 -35 -79 C ATOM 423 CG1 VAL A 50 -10.003 56.805 15.649 1.00 27.17 C ANISOU 423 CG1 VAL A 50 3415 3536 3372 159 -54 -87 C ATOM 424 CG2 VAL A 50 -8.803 54.692 15.049 1.00 26.14 C ANISOU 424 CG2 VAL A 50 3280 3394 3257 127 -29 -69 C ATOM 0 H VAL A 50 -11.025 52.980 15.470 1.00 26.53 H new ATOM 0 HA VAL A 50 -10.121 54.530 17.289 1.00 26.79 H new ATOM 0 HB VAL A 50 -10.748 55.198 14.624 1.00 26.83 H new ATOM 0 HG11 VAL A 50 -9.600 57.231 14.876 1.00 27.17 H new ATOM 0 HG12 VAL A 50 -10.875 57.196 15.816 1.00 27.17 H new ATOM 0 HG13 VAL A 50 -9.435 56.939 16.424 1.00 27.17 H new ATOM 0 HG21 VAL A 50 -8.416 55.151 14.287 1.00 26.14 H new ATOM 0 HG22 VAL A 50 -8.210 54.777 15.812 1.00 26.14 H new ATOM 0 HG23 VAL A 50 -8.921 53.753 14.834 1.00 26.14 H new ATOM 425 N ASP A 51 -13.112 55.345 16.430 1.00 27.60 N ANISOU 425 N ASP A 51 3412 3628 3446 169 -26 -90 N ATOM 426 CA ASP A 51 -14.303 56.096 16.826 1.00 27.80 C ANISOU 426 CA ASP A 51 3426 3668 3467 189 -33 -101 C ATOM 427 C ASP A 51 -14.868 55.644 18.175 1.00 27.83 C ANISOU 427 C ASP A 51 3410 3694 3469 200 -13 -93 C ATOM 428 O ASP A 51 -15.319 56.481 18.954 1.00 27.99 O ANISOU 428 O ASP A 51 3430 3729 3477 222 -18 -99 O ATOM 429 CB ASP A 51 -15.372 56.032 15.729 1.00 28.16 C ANISOU 429 CB ASP A 51 3461 3713 3524 185 -42 -111 C ATOM 430 CG ASP A 51 -14.931 56.720 14.443 1.00 28.87 C ANISOU 430 CG ASP A 51 3573 3786 3612 180 -65 -120 C ATOM 431 OD1 ASP A 51 -14.002 57.559 14.493 1.00 29.36 O ANISOU 431 OD1 ASP A 51 3656 3837 3661 184 -76 -120 O ATOM 432 OD2 ASP A 51 -15.506 56.417 13.376 1.00 28.98 O ANISOU 432 OD2 ASP A 51 3581 3795 3636 172 -71 -127 O ATOM 0 H ASP A 51 -13.211 54.868 15.721 1.00 27.60 H new ATOM 0 HA ASP A 51 -14.029 57.020 16.940 1.00 27.80 H new ATOM 0 HB2 ASP A 51 -15.582 55.104 15.540 1.00 28.16 H new ATOM 0 HB3 ASP A 51 -16.187 56.447 16.051 1.00 28.16 H new ATOM 433 N ILE A 52 -14.832 54.339 18.462 1.00 27.17 N ANISOU 433 N ILE A 52 3312 3614 3398 186 9 -79 N ATOM 434 CA ILE A 52 -15.232 53.839 19.788 1.00 27.56 C ANISOU 434 CA ILE A 52 3344 3683 3444 195 31 -67 C ATOM 435 C ILE A 52 -14.302 54.383 20.871 1.00 27.90 C ANISOU 435 C ILE A 52 3403 3731 3468 211 32 -63 C ATOM 436 O ILE A 52 -14.756 54.832 21.924 1.00 28.43 O ANISOU 436 O ILE A 52 3463 3817 3521 232 37 -64 O ATOM 437 CB ILE A 52 -15.243 52.297 19.864 1.00 27.16 C ANISOU 437 CB ILE A 52 3276 3631 3411 176 55 -50 C ATOM 438 CG1 ILE A 52 -16.454 51.731 19.124 1.00 27.42 C ANISOU 438 CG1 ILE A 52 3286 3666 3466 165 57 -54 C ATOM 439 CG2 ILE A 52 -15.300 51.830 21.310 1.00 27.52 C ANISOU 439 CG2 ILE A 52 3310 3695 3450 186 78 -34 C ATOM 440 CD1 ILE A 52 -16.358 50.240 18.854 1.00 26.85 C ANISOU 440 CD1 ILE A 52 3201 3584 3416 142 73 -41 C ATOM 0 H ILE A 52 -14.582 53.729 17.910 1.00 27.17 H new ATOM 0 HA ILE A 52 -16.138 54.153 19.936 1.00 27.56 H new ATOM 0 HB ILE A 52 -14.426 51.978 19.450 1.00 27.16 H new ATOM 0 HG12 ILE A 52 -17.253 51.907 19.645 1.00 27.42 H new ATOM 0 HG13 ILE A 52 -16.556 52.199 18.281 1.00 27.42 H new ATOM 0 HG21 ILE A 52 -15.306 50.860 21.337 1.00 27.52 H new ATOM 0 HG22 ILE A 52 -14.524 52.162 21.788 1.00 27.52 H new ATOM 0 HG23 ILE A 52 -16.106 52.170 21.728 1.00 27.52 H new ATOM 0 HD11 ILE A 52 -17.153 49.944 18.384 1.00 26.85 H new ATOM 0 HD12 ILE A 52 -15.576 50.059 18.310 1.00 26.85 H new ATOM 0 HD13 ILE A 52 -16.284 49.763 19.695 1.00 26.85 H new ATOM 441 N GLU A 53 -12.998 54.340 20.603 1.00 28.44 N ANISOU 441 N GLU A 53 3491 3782 3533 200 27 -60 N ATOM 442 CA GLU A 53 -11.999 54.799 21.569 1.00 27.99 C ANISOU 442 CA GLU A 53 3449 3726 3458 213 26 -57 C ATOM 443 C GLU A 53 -12.066 56.304 21.813 1.00 29.11 C ANISOU 443 C GLU A 53 3605 3871 3585 236 4 -73 C ATOM 444 O GLU A 53 -11.747 56.779 22.905 1.00 29.14 O ANISOU 444 O GLU A 53 3613 3884 3573 255 4 -73 O ATOM 445 CB GLU A 53 -10.597 54.387 21.108 1.00 27.32 C ANISOU 445 CB GLU A 53 3382 3622 3377 196 25 -50 C ATOM 446 CG GLU A 53 -10.353 52.894 21.262 1.00 27.21 C ANISOU 446 CG GLU A 53 3356 3607 3374 179 48 -33 C ATOM 447 CD GLU A 53 -8.951 52.462 20.877 1.00 26.94 C ANISOU 447 CD GLU A 53 3338 3555 3342 164 47 -28 C ATOM 448 OE1 GLU A 53 -8.192 53.285 20.325 1.00 28.21 O ANISOU 448 OE1 GLU A 53 3517 3703 3497 163 29 -36 O ATOM 449 OE2 GLU A 53 -8.611 51.290 21.131 1.00 27.00 O ANISOU 449 OE2 GLU A 53 3339 3561 3357 153 65 -14 O ATOM 0 H GLU A 53 -12.669 54.047 19.864 1.00 28.44 H new ATOM 0 HA GLU A 53 -12.198 54.372 22.417 1.00 27.99 H new ATOM 0 HB2 GLU A 53 -10.478 54.638 20.179 1.00 27.32 H new ATOM 0 HB3 GLU A 53 -9.934 54.875 21.621 1.00 27.32 H new ATOM 0 HG2 GLU A 53 -10.519 52.641 22.183 1.00 27.21 H new ATOM 0 HG3 GLU A 53 -10.993 52.412 20.715 1.00 27.21 H new ATOM 450 N THR A 54 -12.473 57.047 20.790 1.00 29.62 N ANISOU 450 N THR A 54 3675 3926 3654 234 -16 -86 N ATOM 451 CA THR A 54 -12.679 58.485 20.908 1.00 31.62 C ANISOU 451 CA THR A 54 3940 4179 3894 254 -39 -102 C ATOM 452 C THR A 54 -13.877 58.793 21.813 1.00 32.52 C ANISOU 452 C THR A 54 4037 4319 4000 279 -34 -108 C ATOM 453 O THR A 54 -13.800 59.669 22.677 1.00 32.79 O ANISOU 453 O THR A 54 4078 4362 4019 302 -44 -116 O ATOM 454 CB THR A 54 -12.880 59.120 19.517 1.00 31.63 C ANISOU 454 CB THR A 54 3951 4163 3902 246 -60 -112 C ATOM 455 OG1 THR A 54 -11.759 58.793 18.685 1.00 31.74 O ANISOU 455 OG1 THR A 54 3979 4156 3923 224 -62 -105 O ATOM 456 CG2 THR A 54 -13.017 60.637 19.612 1.00 33.33 C ANISOU 456 CG2 THR A 54 4181 4376 4107 267 -86 -128 C ATOM 0 H THR A 54 -12.638 56.731 20.007 1.00 29.62 H new ATOM 0 HA THR A 54 -11.886 58.870 21.312 1.00 31.62 H new ATOM 0 HB THR A 54 -13.699 58.767 19.135 1.00 31.63 H new ATOM 0 HG1 THR A 54 -11.782 57.976 18.491 1.00 31.74 H new ATOM 0 HG21 THR A 54 -13.142 61.007 18.724 1.00 33.33 H new ATOM 0 HG22 THR A 54 -13.782 60.859 20.165 1.00 33.33 H new ATOM 0 HG23 THR A 54 -12.214 61.011 20.007 1.00 33.33 H new ATOM 457 N AGLU A 55 -14.971 58.061 21.613 0.50 32.85 N ANISOU 457 N AGLU A 55 4055 4373 4053 273 -20 -104 N ATOM 458 N BGLU A 55 -14.974 58.065 21.614 0.50 32.89 N ANISOU 458 N BGLU A 55 4060 4378 4058 273 -20 -104 N ATOM 459 CA AGLU A 55 -16.197 58.253 22.388 0.50 33.85 C ANISOU 459 CA AGLU A 55 4162 4526 4174 295 -13 -108 C ATOM 460 CA BGLU A 55 -16.194 58.262 22.398 0.50 33.92 C ANISOU 460 CA BGLU A 55 4171 4535 4183 295 -13 -108 C ATOM 461 C AGLU A 55 -16.097 57.667 23.802 0.50 34.21 C ANISOU 461 C AGLU A 55 4197 4593 4210 306 11 -95 C ATOM 462 C BGLU A 55 -16.098 57.666 23.807 0.50 34.25 C ANISOU 462 C BGLU A 55 4202 4598 4215 306 11 -95 C ATOM 463 O AGLU A 55 -16.686 58.206 24.741 0.50 35.23 O ANISOU 463 O AGLU A 55 4318 4744 4324 332 12 -100 O ATOM 464 O BGLU A 55 -16.691 58.199 24.747 0.50 35.26 O ANISOU 464 O BGLU A 55 4322 4748 4328 332 12 -100 O ATOM 465 CB AGLU A 55 -17.381 57.631 21.647 0.50 34.02 C ANISOU 465 CB AGLU A 55 4160 4553 4213 283 -6 -109 C ATOM 466 CB BGLU A 55 -17.393 57.669 21.655 0.50 34.17 C ANISOU 466 CB BGLU A 55 4180 4572 4232 284 -7 -109 C ATOM 467 CG AGLU A 55 -18.727 57.884 22.303 0.50 34.72 C ANISOU 467 CG AGLU A 55 4227 4669 4298 304 0 -115 C ATOM 468 CG BGLU A 55 -17.747 58.417 20.380 0.50 34.54 C ANISOU 468 CG BGLU A 55 4235 4604 4284 281 -32 -126 C ATOM 469 CD AGLU A 55 -19.092 59.356 22.344 0.50 34.59 C ANISOU 469 CD AGLU A 55 4221 4657 4266 330 -26 -135 C ATOM 470 CD BGLU A 55 -18.279 59.810 20.654 0.50 35.27 C ANISOU 470 CD BGLU A 55 4335 4705 4361 308 -53 -144 C ATOM 471 OE1AGLU A 55 -18.294 60.188 21.859 0.50 34.75 O ANISOU 471 OE1AGLU A 55 4267 4656 4280 330 -48 -144 O ATOM 472 OE1BGLU A 55 -19.301 59.927 21.364 0.50 36.09 O ANISOU 472 OE1BGLU A 55 4419 4833 4461 327 -46 -148 O ATOM 473 OE2AGLU A 55 -20.180 59.681 22.862 0.50 35.33 O ANISOU 473 OE2AGLU A 55 4297 4774 4354 350 -23 -143 O ATOM 474 OE2BGLU A 55 -17.679 60.784 20.155 0.50 34.59 O ANISOU 474 OE2BGLU A 55 4273 4600 4269 312 -77 -154 O ATOM 0 H AGLU A 55 -15.024 57.438 21.023 0.50 32.89 H new ATOM 0 H BGLU A 55 -15.033 57.444 21.022 0.50 32.89 H new ATOM 0 HA AGLU A 55 -16.331 59.209 22.484 0.50 33.92 H new ATOM 0 HA BGLU A 55 -16.312 59.219 22.505 0.50 33.92 H new ATOM 0 HB2AGLU A 55 -17.403 57.980 20.742 0.50 34.17 H new ATOM 0 HB2BGLU A 55 -17.203 56.743 21.436 0.50 34.17 H new ATOM 0 HB3AGLU A 55 -17.240 56.674 21.579 0.50 34.17 H new ATOM 0 HB3BGLU A 55 -18.162 57.669 22.246 0.50 34.17 H new ATOM 0 HG2AGLU A 55 -19.414 57.398 21.821 0.50 34.54 H new ATOM 0 HG2BGLU A 55 -16.960 58.479 19.816 0.50 34.54 H new ATOM 0 HG3AGLU A 55 -18.713 57.533 23.207 0.50 34.54 H new ATOM 0 HG3BGLU A 55 -18.411 57.912 19.886 0.50 34.54 H new ATOM 475 N PHE A 56 -15.349 56.573 23.944 1.00 33.55 N ANISOU 475 N PHE A 56 4113 4503 4133 288 29 -77 N ATOM 476 CA PHE A 56 -15.160 55.894 25.231 1.00 34.07 C ANISOU 476 CA PHE A 56 4169 4586 4189 297 53 -61 C ATOM 477 C PHE A 56 -13.657 55.683 25.517 1.00 33.58 C ANISOU 477 C PHE A 56 4128 4509 4121 291 53 -54 C ATOM 478 O PHE A 56 -13.150 54.574 25.371 1.00 32.55 O ANISOU 478 O PHE A 56 3995 4371 4002 271 69 -38 O ATOM 479 CB PHE A 56 -15.887 54.536 25.215 1.00 34.47 C ANISOU 479 CB PHE A 56 4194 4645 4257 280 80 -43 C ATOM 480 CG PHE A 56 -17.350 54.614 24.842 1.00 34.45 C ANISOU 480 CG PHE A 56 4168 4656 4266 283 81 -50 C ATOM 481 CD1 PHE A 56 -18.329 54.722 25.824 1.00 35.60 C ANISOU 481 CD1 PHE A 56 4294 4831 4402 304 95 -47 C ATOM 482 CD2 PHE A 56 -17.753 54.546 23.509 1.00 35.20 C ANISOU 482 CD2 PHE A 56 4261 4735 4380 264 69 -59 C ATOM 483 CE1 PHE A 56 -19.671 54.782 25.487 1.00 35.29 C ANISOU 483 CE1 PHE A 56 4230 4804 4373 306 96 -53 C ATOM 484 CE2 PHE A 56 -19.095 54.606 23.166 1.00 34.58 C ANISOU 484 CE2 PHE A 56 4159 4667 4311 267 68 -67 C ATOM 485 CZ PHE A 56 -20.055 54.719 24.156 1.00 35.51 C ANISOU 485 CZ PHE A 56 4256 4815 4421 287 82 -64 C ATOM 0 H APHE A 56 -14.932 56.199 23.291 0.50 33.55 H new ATOM 0 H BPHE A 56 -14.933 56.201 23.290 0.50 33.55 H new ATOM 0 HA PHE A 56 -15.533 56.450 25.933 1.00 34.07 H new ATOM 0 HB2 PHE A 56 -15.436 53.948 24.589 1.00 34.47 H new ATOM 0 HB3 PHE A 56 -15.810 54.130 26.092 1.00 34.47 H new ATOM 0 HD1 PHE A 56 -18.079 54.754 26.719 1.00 35.60 H new ATOM 0 HD2 PHE A 56 -17.112 54.459 22.840 1.00 35.20 H new ATOM 0 HE1 PHE A 56 -20.315 54.865 26.153 1.00 35.29 H new ATOM 0 HE2 PHE A 56 -19.349 54.570 22.272 1.00 34.58 H new ATOM 0 HZ PHE A 56 -20.956 54.753 23.929 1.00 35.51 H new ATOM 486 N PRO A 57 -12.934 56.753 25.917 1.00 34.07 N ANISOU 486 N PRO A 57 4210 4567 4166 308 34 -66 N ATOM 487 CA PRO A 57 -11.494 56.647 26.220 1.00 34.10 C ANISOU 487 CA PRO A 57 4233 4558 4165 304 31 -61 C ATOM 488 C PRO A 57 -11.108 55.578 27.253 1.00 34.58 C ANISOU 488 C PRO A 57 4287 4632 4221 306 57 -42 C ATOM 489 O PRO A 57 -10.008 55.019 27.173 1.00 32.98 O ANISOU 489 O PRO A 57 4095 4415 4021 292 61 -33 O ATOM 490 CB PRO A 57 -11.140 58.036 26.752 1.00 34.42 C ANISOU 490 CB PRO A 57 4290 4599 4188 330 7 -78 C ATOM 491 CG PRO A 57 -12.135 58.951 26.140 1.00 34.86 C ANISOU 491 CG PRO A 57 4343 4656 4245 337 -10 -94 C ATOM 492 CD PRO A 57 -13.392 58.153 25.915 1.00 34.70 C ANISOU 492 CD PRO A 57 4297 4651 4236 330 9 -86 C ATOM 0 HA PRO A 57 -11.013 56.370 25.425 1.00 34.10 H new ATOM 0 HB2 PRO A 57 -11.188 58.063 27.720 1.00 34.42 H new ATOM 0 HB3 PRO A 57 -10.236 58.286 26.506 1.00 34.42 H new ATOM 0 HG2 PRO A 57 -12.309 59.707 26.722 1.00 34.86 H new ATOM 0 HG3 PRO A 57 -11.802 59.309 25.302 1.00 34.86 H new ATOM 0 HD2 PRO A 57 -14.044 58.314 26.615 1.00 34.70 H new ATOM 0 HD3 PRO A 57 -13.815 58.387 25.074 1.00 34.70 H new ATOM 493 N ASP A 58 -11.999 55.290 28.203 1.00 34.58 N ANISOU 493 N ASP A 58 4268 4658 4211 323 75 -34 N ATOM 494 CA ASP A 58 -11.764 54.223 29.187 1.00 35.59 C ANISOU 494 CA ASP A 58 4389 4800 4335 325 102 -13 C ATOM 495 C ASP A 58 -11.522 52.858 28.549 1.00 34.86 C ANISOU 495 C ASP A 58 4289 4692 4263 294 120 5 C ATOM 496 O ASP A 58 -10.924 51.978 29.171 1.00 34.92 O ANISOU 496 O ASP A 58 4297 4701 4269 291 137 22 O ATOM 497 CB ASP A 58 -12.949 54.100 30.160 1.00 37.30 C ANISOU 497 CB ASP A 58 4583 5048 4540 347 121 -6 C ATOM 498 CG ASP A 58 -13.020 55.240 31.159 1.00 39.19 C ANISOU 498 CG ASP A 58 4830 5307 4753 384 109 -20 C ATOM 499 OD1 ASP A 58 -12.285 56.238 31.001 1.00 40.38 O ANISOU 499 OD1 ASP A 58 5001 5445 4896 392 83 -38 O ATOM 500 OD2 ASP A 58 -13.828 55.135 32.111 1.00 40.86 O ANISOU 500 OD2 ASP A 58 5025 5549 4951 406 126 -13 O ATOM 0 H ASP A 58 -12.749 55.700 28.297 1.00 34.58 H new ATOM 0 HA ASP A 58 -10.959 54.483 29.662 1.00 35.59 H new ATOM 0 HB2 ASP A 58 -13.775 54.070 29.653 1.00 37.30 H new ATOM 0 HB3 ASP A 58 -12.880 53.260 30.640 1.00 37.30 H new ATOM 501 N LEU A 59 -12.007 52.675 27.321 1.00 33.97 N ANISOU 501 N LEU A 59 4170 4566 4172 272 114 1 N ATOM 502 CA LEU A 59 -11.874 51.404 26.625 1.00 33.69 C ANISOU 502 CA LEU A 59 4128 4515 4159 242 128 15 C ATOM 503 C LEU A 59 -10.528 51.234 25.935 1.00 32.77 C ANISOU 503 C LEU A 59 4032 4374 4047 225 117 13 C ATOM 504 O LEU A 59 -10.228 50.147 25.455 1.00 32.53 O ANISOU 504 O LEU A 59 3998 4330 4033 203 127 24 O ATOM 505 CB LEU A 59 -12.990 51.244 25.591 1.00 33.70 C ANISOU 505 CB LEU A 59 4112 4513 4180 228 125 9 C ATOM 506 CG LEU A 59 -14.417 51.285 26.133 1.00 34.08 C ANISOU 506 CG LEU A 59 4136 4586 4229 241 138 12 C ATOM 507 CD1 LEU A 59 -15.392 50.895 25.031 1.00 33.81 C ANISOU 507 CD1 LEU A 59 4083 4544 4218 222 136 8 C ATOM 508 CD2 LEU A 59 -14.576 50.371 27.342 1.00 34.13 C ANISOU 508 CD2 LEU A 59 4127 4611 4231 247 167 35 C ATOM 0 H LEU A 59 -12.419 53.283 26.873 1.00 33.97 H new ATOM 0 HA LEU A 59 -11.940 50.716 27.306 1.00 33.69 H new ATOM 0 HB2 LEU A 59 -12.895 51.945 24.928 1.00 33.70 H new ATOM 0 HB3 LEU A 59 -12.862 50.400 25.131 1.00 33.70 H new ATOM 0 HG LEU A 59 -14.611 52.189 26.425 1.00 34.08 H new ATOM 0 HD11 LEU A 59 -16.298 50.921 25.376 1.00 33.81 H new ATOM 0 HD12 LEU A 59 -15.310 51.517 24.291 1.00 33.81 H new ATOM 0 HD13 LEU A 59 -15.190 49.998 24.722 1.00 33.81 H new ATOM 0 HD21 LEU A 59 -15.490 50.417 27.665 1.00 34.13 H new ATOM 0 HD22 LEU A 59 -14.369 49.458 27.087 1.00 34.13 H new ATOM 0 HD23 LEU A 59 -13.971 50.655 28.045 1.00 34.13 H new ATOM 509 N ILE A 60 -9.731 52.299 25.870 1.00 32.60 N ANISOU 509 N ILE A 60 4031 4344 4013 235 95 -2 N ATOM 510 CA ILE A 60 -8.408 52.219 25.255 1.00 33.71 C ANISOU 510 CA ILE A 60 4190 4462 4157 219 85 -3 C ATOM 511 C ILE A 60 -7.522 51.342 26.124 1.00 35.27 C ANISOU 511 C ILE A 60 4390 4662 4349 220 101 12 C ATOM 512 O ILE A 60 -7.363 51.595 27.319 1.00 34.76 O ANISOU 512 O ILE A 60 4328 4612 4267 242 106 15 O ATOM 513 CB ILE A 60 -7.750 53.601 25.092 1.00 33.86 C ANISOU 513 CB ILE A 60 4229 4472 4165 230 58 -21 C ATOM 514 CG1 ILE A 60 -8.554 54.465 24.118 1.00 33.26 C ANISOU 514 CG1 ILE A 60 4152 4391 4094 228 40 -35 C ATOM 515 CG2 ILE A 60 -6.321 53.454 24.582 1.00 33.93 C ANISOU 515 CG2 ILE A 60 4255 4461 4177 214 51 -20 C ATOM 516 CD1 ILE A 60 -8.071 55.897 24.025 1.00 33.56 C ANISOU 516 CD1 ILE A 60 4209 4421 4122 241 14 -52 C ATOM 0 H ILE A 60 -9.937 53.076 26.176 1.00 32.60 H new ATOM 0 HA ILE A 60 -8.513 51.843 24.367 1.00 33.71 H new ATOM 0 HB ILE A 60 -7.734 54.032 25.961 1.00 33.86 H new ATOM 0 HG12 ILE A 60 -8.517 54.063 23.236 1.00 33.26 H new ATOM 0 HG13 ILE A 60 -9.485 54.464 24.391 1.00 33.26 H new ATOM 0 HG21 ILE A 60 -5.920 54.332 24.484 1.00 33.93 H new ATOM 0 HG22 ILE A 60 -5.804 52.931 25.214 1.00 33.93 H new ATOM 0 HG23 ILE A 60 -6.329 53.005 23.722 1.00 33.93 H new ATOM 0 HD11 ILE A 60 -8.623 56.384 23.393 1.00 33.56 H new ATOM 0 HD12 ILE A 60 -8.132 56.316 24.898 1.00 33.56 H new ATOM 0 HD13 ILE A 60 -7.149 55.909 23.724 1.00 33.56 H new ATOM 517 N THR A 61 -6.978 50.294 25.519 1.00 35.69 N ANISOU 517 N THR A 61 4444 4700 4417 197 110 22 N ATOM 518 CA THR A 61 -6.044 49.415 26.192 1.00 36.88 C ANISOU 518 CA THR A 61 4600 4850 4565 195 123 36 C ATOM 519 C THR A 61 -4.648 49.738 25.647 1.00 37.38 C ANISOU 519 C THR A 61 4682 4893 4626 187 107 28 C ATOM 520 O THR A 61 -4.520 50.120 24.483 1.00 36.64 O ANISOU 520 O THR A 61 4594 4785 4542 173 92 18 O ATOM 521 CB THR A 61 -6.423 47.945 25.956 1.00 36.70 C ANISOU 521 CB THR A 61 4562 4823 4561 176 144 54 C ATOM 522 OG1 THR A 61 -6.575 47.706 24.551 1.00 36.84 O ANISOU 522 OG1 THR A 61 4578 4822 4597 154 136 47 O ATOM 523 CG2 THR A 61 -7.742 47.618 26.650 1.00 37.22 C ANISOU 523 CG2 THR A 61 4607 4908 4628 185 162 64 C ATOM 0 H THR A 61 -7.143 50.075 24.704 1.00 35.69 H new ATOM 0 HA THR A 61 -6.063 49.552 27.152 1.00 36.88 H new ATOM 0 HB THR A 61 -5.719 47.385 26.318 1.00 36.70 H new ATOM 0 HG1 THR A 61 -6.781 46.902 24.424 1.00 36.84 H new ATOM 0 HG21 THR A 61 -7.969 46.688 26.493 1.00 37.22 H new ATOM 0 HG22 THR A 61 -7.653 47.772 27.604 1.00 37.22 H new ATOM 0 HG23 THR A 61 -8.444 48.186 26.295 1.00 37.22 H new ATOM 524 N PRO A 62 -3.599 49.620 26.491 1.00 38.55 N ANISOU 524 N PRO A 62 4841 5043 4763 196 109 32 N ATOM 525 CA PRO A 62 -2.230 49.886 26.025 1.00 37.99 C ANISOU 525 CA PRO A 62 4786 4956 4692 188 95 25 C ATOM 526 C PRO A 62 -1.816 49.045 24.810 1.00 38.10 C ANISOU 526 C PRO A 62 4801 4952 4724 161 97 29 C ATOM 527 O PRO A 62 -0.974 49.480 24.021 1.00 39.59 O ANISOU 527 O PRO A 62 5001 5126 4916 151 83 20 O ATOM 528 CB PRO A 62 -1.361 49.528 27.239 1.00 38.57 C ANISOU 528 CB PRO A 62 4866 5037 4753 203 103 32 C ATOM 529 CG PRO A 62 -2.268 49.638 28.412 1.00 38.63 C ANISOU 529 CG PRO A 62 4865 5067 4747 226 114 38 C ATOM 530 CD PRO A 62 -3.638 49.274 27.924 1.00 38.96 C ANISOU 530 CD PRO A 62 4889 5113 4800 217 125 43 C ATOM 0 HA PRO A 62 -2.139 50.804 25.724 1.00 37.99 H new ATOM 0 HB2 PRO A 62 -0.999 48.632 27.159 1.00 38.57 H new ATOM 0 HB3 PRO A 62 -0.607 50.133 27.321 1.00 38.57 H new ATOM 0 HG2 PRO A 62 -1.986 49.043 29.124 1.00 38.63 H new ATOM 0 HG3 PRO A 62 -2.258 50.538 28.773 1.00 38.63 H new ATOM 0 HD2 PRO A 62 -3.826 48.332 28.059 1.00 38.96 H new ATOM 0 HD3 PRO A 62 -4.327 49.771 28.392 1.00 38.96 H new ATOM 531 N ASP A 63 -2.409 47.861 24.668 1.00 37.00 N ANISOU 531 N ASP A 63 4648 4812 4597 150 115 42 N ATOM 532 CA ASP A 63 -2.084 46.943 23.575 1.00 36.71 C ANISOU 532 CA ASP A 63 4611 4760 4578 126 117 45 C ATOM 533 C ASP A 63 -3.015 47.057 22.353 1.00 35.49 C ANISOU 533 C ASP A 63 4448 4599 4437 113 110 37 C ATOM 534 O ASP A 63 -2.861 46.302 21.393 1.00 35.83 O ANISOU 534 O ASP A 63 4490 4629 4495 95 111 38 O ATOM 535 CB ASP A 63 -2.105 45.500 24.087 1.00 38.58 C ANISOU 535 CB ASP A 63 4839 4997 4823 121 138 62 C ATOM 536 CG ASP A 63 -3.485 45.063 24.526 1.00 40.17 C ANISOU 536 CG ASP A 63 5021 5210 5031 123 154 73 C ATOM 537 OD1 ASP A 63 -4.048 45.729 25.417 1.00 41.67 O ANISOU 537 OD1 ASP A 63 5208 5418 5208 143 156 73 O ATOM 538 OD2 ASP A 63 -4.003 44.060 23.983 1.00 43.38 O ANISOU 538 OD2 ASP A 63 5417 5609 5457 107 163 80 O ATOM 0 H ASP A 63 -3.013 47.566 25.204 1.00 37.00 H new ATOM 0 HA ASP A 63 -1.198 47.197 23.272 1.00 36.71 H new ATOM 0 HB2 ASP A 63 -1.788 44.907 23.388 1.00 38.58 H new ATOM 0 HB3 ASP A 63 -1.489 45.415 24.832 1.00 38.58 H new ATOM 539 N SER A 64 -3.976 47.977 22.381 1.00 33.64 N ANISOU 539 N SER A 64 4210 4374 4199 123 103 29 N ATOM 540 CA SER A 64 -4.892 48.155 21.239 1.00 31.94 C ANISOU 540 CA SER A 64 3986 4153 3995 112 95 20 C ATOM 541 C SER A 64 -4.124 48.464 19.953 1.00 31.26 C ANISOU 541 C SER A 64 3914 4051 3914 99 79 11 C ATOM 542 O SER A 64 -3.078 49.109 20.007 1.00 30.64 O ANISOU 542 O SER A 64 3851 3968 3825 102 69 7 O ATOM 543 CB SER A 64 -5.875 49.295 21.515 1.00 31.97 C ANISOU 543 CB SER A 64 3987 4170 3991 129 86 11 C ATOM 544 OG SER A 64 -6.681 49.563 20.378 1.00 30.60 O ANISOU 544 OG SER A 64 3808 3991 3828 120 76 1 O ATOM 0 H SER A 64 -4.119 48.507 23.043 1.00 33.64 H new ATOM 0 HA SER A 64 -5.377 47.323 21.124 1.00 31.94 H new ATOM 0 HB2 SER A 64 -6.440 49.063 22.268 1.00 31.97 H new ATOM 0 HB3 SER A 64 -5.386 50.095 21.764 1.00 31.97 H new ATOM 0 HG SER A 64 -7.292 50.099 20.588 1.00 30.60 H new ATOM 545 N PRO A 65 -4.642 48.018 18.789 1.00 30.59 N ANISOU 545 N PRO A 65 3822 3957 3842 84 76 7 N ATOM 546 CA PRO A 65 -3.995 48.363 17.515 1.00 30.36 C ANISOU 546 CA PRO A 65 3806 3915 3814 74 61 -2 C ATOM 547 C PRO A 65 -3.722 49.859 17.327 1.00 30.61 C ANISOU 547 C PRO A 65 3851 3946 3833 83 43 -12 C ATOM 548 O PRO A 65 -2.757 50.226 16.657 1.00 30.66 O ANISOU 548 O PRO A 65 3871 3943 3836 77 34 -15 O ATOM 549 CB PRO A 65 -5.004 47.875 16.475 1.00 30.68 C ANISOU 549 CB PRO A 65 3835 3952 3870 64 59 -7 C ATOM 550 CG PRO A 65 -5.663 46.713 17.129 1.00 31.28 C ANISOU 550 CG PRO A 65 3894 4033 3959 61 77 3 C ATOM 551 CD PRO A 65 -5.767 47.086 18.583 1.00 31.40 C ANISOU 551 CD PRO A 65 3906 4062 3962 77 87 11 C ATOM 0 HA PRO A 65 -3.115 47.960 17.454 1.00 30.36 H new ATOM 0 HB2 PRO A 65 -5.646 48.567 16.251 1.00 30.68 H new ATOM 0 HB3 PRO A 65 -4.566 47.616 15.649 1.00 30.68 H new ATOM 0 HG2 PRO A 65 -6.539 46.546 16.747 1.00 31.28 H new ATOM 0 HG3 PRO A 65 -5.143 45.903 17.011 1.00 31.28 H new ATOM 0 HD2 PRO A 65 -6.618 47.506 18.783 1.00 31.40 H new ATOM 0 HD3 PRO A 65 -5.694 46.307 19.156 1.00 31.40 H new ATOM 552 N THR A 66 -4.561 50.711 17.910 1.00 30.85 N ANISOU 552 N THR A 66 3878 3986 3856 98 39 -17 N ATOM 553 CA THR A 66 -4.402 52.160 17.779 1.00 31.74 C ANISOU 553 CA THR A 66 4004 4097 3958 108 20 -27 C ATOM 554 C THR A 66 -3.170 52.699 18.512 1.00 33.21 C ANISOU 554 C THR A 66 4204 4281 4134 115 15 -26 C ATOM 555 O THR A 66 -2.691 53.790 18.204 1.00 33.63 O ANISOU 555 O THR A 66 4270 4327 4182 118 -1 -33 O ATOM 556 CB THR A 66 -5.638 52.907 18.311 1.00 31.77 C ANISOU 556 CB THR A 66 4000 4114 3958 125 15 -34 C ATOM 557 OG1 THR A 66 -5.837 52.566 19.684 1.00 31.40 O ANISOU 557 OG1 THR A 66 3944 4081 3904 138 29 -27 O ATOM 558 CG2 THR A 66 -6.885 52.544 17.502 1.00 31.80 C ANISOU 558 CG2 THR A 66 3990 4119 3973 119 16 -38 C ATOM 0 H THR A 66 -5.233 50.470 18.389 1.00 30.85 H new ATOM 0 HA THR A 66 -4.290 52.319 16.829 1.00 31.74 H new ATOM 0 HB THR A 66 -5.488 53.861 18.225 1.00 31.77 H new ATOM 0 HG1 THR A 66 -6.594 52.832 19.932 1.00 31.40 H new ATOM 0 HG21 THR A 66 -7.650 53.025 17.854 1.00 31.80 H new ATOM 0 HG22 THR A 66 -6.750 52.787 16.573 1.00 31.80 H new ATOM 0 HG23 THR A 66 -7.046 51.590 17.566 1.00 31.80 H new ATOM 559 N GLN A 67 -2.666 51.940 19.480 1.00 35.12 N ANISOU 559 N GLN A 67 4442 4528 4373 117 30 -17 N ATOM 560 CA GLN A 67 -1.491 52.354 20.249 1.00 37.71 C ANISOU 560 CA GLN A 67 4782 4855 4692 125 26 -16 C ATOM 561 C GLN A 67 -0.175 52.059 19.513 1.00 38.71 C ANISOU 561 C GLN A 67 4918 4967 4823 109 23 -14 C ATOM 562 O GLN A 67 0.892 52.450 19.985 1.00 42.26 O ANISOU 562 O GLN A 67 5376 5414 5266 113 18 -15 O ATOM 563 CB GLN A 67 -1.490 51.681 21.628 1.00 38.82 C ANISOU 563 CB GLN A 67 4916 5009 4827 137 42 -8 C ATOM 564 CG GLN A 67 -2.775 51.869 22.429 1.00 39.98 C ANISOU 564 CG GLN A 67 5050 5172 4968 154 48 -8 C ATOM 565 CD GLN A 67 -3.141 53.325 22.647 1.00 41.63 C ANISOU 565 CD GLN A 67 5266 5385 5167 171 29 -21 C ATOM 566 OE1 GLN A 67 -4.021 53.869 21.973 1.00 41.80 O ANISOU 566 OE1 GLN A 67 5284 5406 5192 171 20 -29 O ATOM 567 NE2 GLN A 67 -2.458 53.969 23.585 1.00 41.67 N ANISOU 567 NE2 GLN A 67 5279 5393 5159 187 21 -26 N ATOM 0 H GLN A 67 -2.990 51.177 19.710 1.00 35.12 H new ATOM 0 HA GLN A 67 -1.549 53.316 20.360 1.00 37.71 H new ATOM 0 HB2 GLN A 67 -1.332 50.731 21.511 1.00 38.82 H new ATOM 0 HB3 GLN A 67 -0.747 52.030 22.145 1.00 38.82 H new ATOM 0 HG2 GLN A 67 -3.504 51.425 21.968 1.00 39.98 H new ATOM 0 HG3 GLN A 67 -2.678 51.434 23.291 1.00 39.98 H new ATOM 0 HE21 GLN A 67 -1.852 53.557 24.035 1.00 41.67 H new ATOM 0 HE22 GLN A 67 -2.622 54.798 23.743 1.00 41.67 H new ATOM 568 N ARG A 68 -0.258 51.383 18.364 1.00 38.39 N ANISOU 568 N ARG A 68 4874 4919 4792 92 27 -12 N ATOM 569 CA ARG A 68 0.912 51.045 17.537 1.00 37.86 C ANISOU 569 CA ARG A 68 4815 4841 4728 77 25 -10 C ATOM 570 C ARG A 68 1.564 52.250 16.856 1.00 38.61 C ANISOU 570 C ARG A 68 4923 4927 4820 75 8 -15 C ATOM 571 O ARG A 68 2.787 52.316 16.741 1.00 37.30 O ANISOU 571 O ARG A 68 4764 4754 4652 69 6 -13 O ATOM 572 CB ARG A 68 0.507 50.082 16.413 1.00 37.60 C ANISOU 572 CB ARG A 68 4776 4804 4706 63 31 -8 C ATOM 573 CG ARG A 68 -0.005 48.721 16.854 1.00 37.57 C ANISOU 573 CG ARG A 68 4759 4805 4712 60 48 -1 C ATOM 574 CD ARG A 68 1.112 47.703 16.901 1.00 36.75 C ANISOU 574 CD ARG A 68 4657 4696 4610 52 58 6 C ATOM 575 NE ARG A 68 0.684 46.355 16.549 1.00 36.52 N ANISOU 575 NE ARG A 68 4618 4664 4594 42 69 10 N ATOM 576 CZ ARG A 68 1.505 45.312 16.501 1.00 35.26 C ANISOU 576 CZ ARG A 68 4459 4499 4439 35 77 16 C ATOM 577 NH1 ARG A 68 1.033 44.114 16.182 1.00 36.02 N ANISOU 577 NH1 ARG A 68 4546 4591 4549 27 85 19 N ATOM 578 NH2 ARG A 68 2.802 45.464 16.776 1.00 33.60 N ANISOU 578 NH2 ARG A 68 4259 4287 4221 37 75 17 N ATOM 0 H ARG A 68 -1.003 51.104 18.037 1.00 38.39 H new ATOM 0 HA ARG A 68 1.548 50.653 18.156 1.00 37.86 H new ATOM 0 HB2 ARG A 68 -0.180 50.509 15.878 1.00 37.60 H new ATOM 0 HB3 ARG A 68 1.274 49.947 15.835 1.00 37.60 H new ATOM 0 HG2 ARG A 68 -0.415 48.796 17.730 1.00 37.57 H new ATOM 0 HG3 ARG A 68 -0.695 48.419 16.243 1.00 37.57 H new ATOM 0 HD2 ARG A 68 1.818 47.979 16.295 1.00 36.75 H new ATOM 0 HD3 ARG A 68 1.492 47.691 17.793 1.00 36.75 H new ATOM 0 HE ARG A 68 -0.146 46.228 16.362 1.00 36.52 H new ATOM 0 HH11 ARG A 68 0.197 44.014 16.007 1.00 36.02 H new ATOM 0 HH12 ARG A 68 1.563 43.437 16.150 1.00 36.02 H new ATOM 0 HH21 ARG A 68 3.109 46.240 16.985 1.00 33.60 H new ATOM 0 HH22 ARG A 68 3.331 44.786 16.744 1.00 33.60 H new ATOM 579 N VAL A 69 0.741 53.186 16.384 1.00 38.47 N ANISOU 579 N VAL A 69 4908 4909 4801 79 -4 -22 N ATOM 580 CA VAL A 69 1.191 54.220 15.438 1.00 38.61 C ANISOU 580 CA VAL A 69 4937 4915 4817 73 -20 -26 C ATOM 581 C VAL A 69 2.210 55.214 16.000 1.00 38.27 C ANISOU 581 C VAL A 69 4905 4866 4770 78 -31 -27 C ATOM 582 O VAL A 69 2.825 55.959 15.242 1.00 39.92 O ANISOU 582 O VAL A 69 5124 5065 4981 71 -42 -26 O ATOM 583 CB VAL A 69 0.002 55.020 14.855 1.00 39.91 C ANISOU 583 CB VAL A 69 5103 5080 4982 79 -32 -33 C ATOM 584 CG1 VAL A 69 -0.936 54.095 14.091 1.00 40.80 C ANISOU 584 CG1 VAL A 69 5205 5196 5100 72 -24 -33 C ATOM 585 CG2 VAL A 69 -0.739 55.767 15.957 1.00 40.23 C ANISOU 585 CG2 VAL A 69 5142 5128 5017 98 -38 -39 C ATOM 0 H VAL A 69 -0.090 53.243 16.599 1.00 38.47 H new ATOM 0 HA VAL A 69 1.639 53.711 14.744 1.00 38.61 H new ATOM 0 HB VAL A 69 0.349 55.679 14.233 1.00 39.91 H new ATOM 0 HG11 VAL A 69 -1.676 54.609 13.731 1.00 40.80 H new ATOM 0 HG12 VAL A 69 -0.453 53.673 13.364 1.00 40.80 H new ATOM 0 HG13 VAL A 69 -1.278 53.413 14.691 1.00 40.80 H new ATOM 0 HG21 VAL A 69 -1.479 56.261 15.572 1.00 40.23 H new ATOM 0 HG22 VAL A 69 -1.078 55.132 16.607 1.00 40.23 H new ATOM 0 HG23 VAL A 69 -0.132 56.384 16.395 1.00 40.23 H new ATOM 586 N GLY A 70 2.378 55.236 17.319 1.00 36.70 N ANISOU 586 N GLY A 70 4704 4674 4567 91 -29 -28 N ATOM 587 CA GLY A 70 3.373 56.095 17.947 1.00 36.39 C ANISOU 587 CA GLY A 70 4673 4628 4525 96 -41 -31 C ATOM 588 C GLY A 70 2.865 57.511 18.138 1.00 35.32 C ANISOU 588 C GLY A 70 4544 4488 4386 109 -60 -40 C ATOM 589 O GLY A 70 1.775 57.862 17.682 1.00 36.51 O ANISOU 589 O GLY A 70 4694 4642 4538 112 -65 -44 O ATOM 0 H GLY A 70 1.922 54.758 17.870 1.00 36.70 H new ATOM 0 HA2 GLY A 70 3.623 55.723 18.808 1.00 36.39 H new ATOM 0 HA3 GLY A 70 4.175 56.111 17.402 1.00 36.39 H new ATOM 590 N GLY A 71 3.675 58.323 18.806 1.00 33.93 N ANISOU 590 N GLY A 71 4375 4307 4210 116 -73 -45 N ATOM 591 CA GLY A 71 3.282 59.673 19.199 1.00 33.16 C ANISOU 591 CA GLY A 71 4285 4205 4111 130 -94 -55 C ATOM 592 C GLY A 71 3.770 59.988 20.595 1.00 32.28 C ANISOU 592 C GLY A 71 4174 4097 3994 148 -100 -62 C ATOM 593 O GLY A 71 4.190 61.108 20.866 1.00 32.38 O ANISOU 593 O GLY A 71 4194 4099 4009 154 -120 -70 O ATOM 0 H GLY A 71 4.472 58.107 19.046 1.00 33.93 H new ATOM 0 HA2 GLY A 71 3.647 60.316 18.571 1.00 33.16 H new ATOM 0 HA3 GLY A 71 2.316 59.757 19.163 1.00 33.16 H new ATOM 594 N LYS A 72 3.717 58.997 21.483 1.00 31.60 N ANISOU 594 N LYS A 72 4080 4026 3901 156 -84 -60 N ATOM 595 CA LYS A 72 4.236 59.154 22.835 1.00 31.39 C ANISOU 595 CA LYS A 72 4054 4006 3867 174 -88 -66 C ATOM 596 C LYS A 72 5.738 59.420 22.803 1.00 30.03 C ANISOU 596 C LYS A 72 3888 3820 3703 165 -97 -66 C ATOM 597 O LYS A 72 6.453 58.872 21.961 1.00 27.96 O ANISOU 597 O LYS A 72 3625 3550 3448 144 -89 -57 O ATOM 598 CB LYS A 72 3.939 57.910 23.684 1.00 33.33 C ANISOU 598 CB LYS A 72 4290 4270 4104 183 -66 -59 C ATOM 599 CG LYS A 72 4.467 57.999 25.108 1.00 35.06 C ANISOU 599 CG LYS A 72 4510 4497 4312 205 -69 -65 C ATOM 600 CD LYS A 72 3.665 57.143 26.079 1.00 37.03 C ANISOU 600 CD LYS A 72 4752 4769 4550 222 -51 -60 C ATOM 601 CE LYS A 72 4.063 57.396 27.531 1.00 38.47 C ANISOU 601 CE LYS A 72 4936 4962 4719 248 -56 -68 C ATOM 602 NZ LYS A 72 3.775 58.783 28.001 1.00 38.58 N ANISOU 602 NZ LYS A 72 4957 4975 4728 269 -81 -85 N ATOM 0 H LYS A 72 3.382 58.222 21.319 1.00 31.60 H new ATOM 0 HA LYS A 72 3.791 59.915 23.240 1.00 31.39 H new ATOM 0 HB2 LYS A 72 2.980 57.769 23.712 1.00 33.33 H new ATOM 0 HB3 LYS A 72 4.327 57.133 23.252 1.00 33.33 H new ATOM 0 HG2 LYS A 72 5.395 57.718 25.124 1.00 35.06 H new ATOM 0 HG3 LYS A 72 4.445 58.923 25.401 1.00 35.06 H new ATOM 0 HD2 LYS A 72 2.720 57.329 25.967 1.00 37.03 H new ATOM 0 HD3 LYS A 72 3.797 56.206 25.867 1.00 37.03 H new ATOM 0 HE2 LYS A 72 3.594 56.766 28.101 1.00 38.47 H new ATOM 0 HE3 LYS A 72 5.011 57.219 27.633 1.00 38.47 H new ATOM 0 HZ1 LYS A 72 3.863 58.821 28.886 1.00 38.58 H new ATOM 0 HZ2 LYS A 72 4.347 59.350 27.622 1.00 38.58 H new ATOM 0 HZ3 LYS A 72 2.943 59.006 27.776 1.00 38.58 H new ATOM 603 N VAL A 73 6.193 60.277 23.714 1.00 29.49 N ANISOU 603 N VAL A 73 3825 3749 3633 181 -115 -78 N ATOM 604 CA VAL A 73 7.606 60.604 23.876 1.00 29.55 C ANISOU 604 CA VAL A 73 3836 3743 3648 175 -126 -81 C ATOM 605 C VAL A 73 7.988 60.359 25.335 1.00 30.62 C ANISOU 605 C VAL A 73 3970 3891 3773 198 -127 -88 C ATOM 606 O VAL A 73 7.348 60.884 26.246 1.00 30.22 O ANISOU 606 O VAL A 73 3921 3849 3712 222 -136 -99 O ATOM 607 CB VAL A 73 7.906 62.078 23.511 1.00 29.57 C ANISOU 607 CB VAL A 73 3847 3726 3662 173 -153 -89 C ATOM 608 CG1 VAL A 73 9.403 62.349 23.568 1.00 29.29 C ANISOU 608 CG1 VAL A 73 3813 3677 3638 162 -163 -90 C ATOM 609 CG2 VAL A 73 7.358 62.428 22.135 1.00 29.86 C ANISOU 609 CG2 VAL A 73 3887 3753 3706 155 -154 -82 C ATOM 0 H VAL A 73 5.679 60.692 24.265 1.00 29.49 H new ATOM 0 HA VAL A 73 8.123 60.044 23.276 1.00 29.55 H new ATOM 0 HB VAL A 73 7.462 62.641 24.164 1.00 29.57 H new ATOM 0 HG11 VAL A 73 9.573 63.276 23.337 1.00 29.29 H new ATOM 0 HG12 VAL A 73 9.730 62.174 24.464 1.00 29.29 H new ATOM 0 HG13 VAL A 73 9.861 61.770 22.939 1.00 29.29 H new ATOM 0 HG21 VAL A 73 7.560 63.355 21.932 1.00 29.86 H new ATOM 0 HG22 VAL A 73 7.768 61.855 21.468 1.00 29.86 H new ATOM 0 HG23 VAL A 73 6.397 62.297 22.126 1.00 29.86 H new ATOM 610 N LEU A 74 9.015 59.545 25.558 1.00 30.71 N ANISOU 610 N LEU A 74 3978 3904 3785 191 -117 -83 N ATOM 611 CA LEU A 74 9.489 59.272 26.914 1.00 32.43 C ANISOU 611 CA LEU A 74 4196 4133 3993 213 -118 -90 C ATOM 612 C LEU A 74 10.562 60.278 27.326 1.00 32.97 C ANISOU 612 C LEU A 74 4269 4188 4071 218 -144 -104 C ATOM 613 O LEU A 74 11.226 60.880 26.481 1.00 32.11 O ANISOU 613 O LEU A 74 4162 4060 3978 198 -155 -103 O ATOM 614 CB LEU A 74 10.035 57.842 27.021 1.00 33.21 C ANISOU 614 CB LEU A 74 4289 4241 4089 206 -95 -78 C ATOM 615 CG LEU A 74 9.085 56.697 26.644 1.00 34.33 C ANISOU 615 CG LEU A 74 4424 4394 4224 199 -69 -64 C ATOM 616 CD1 LEU A 74 9.773 55.354 26.851 1.00 34.30 C ANISOU 616 CD1 LEU A 74 4417 4397 4219 194 -51 -54 C ATOM 617 CD2 LEU A 74 7.788 56.755 27.434 1.00 35.51 C ANISOU 617 CD2 LEU A 74 4572 4561 4360 222 -65 -66 C ATOM 0 H LEU A 74 9.452 59.140 24.938 1.00 30.71 H new ATOM 0 HA LEU A 74 8.735 59.361 27.518 1.00 32.43 H new ATOM 0 HB2 LEU A 74 10.822 57.778 26.457 1.00 33.21 H new ATOM 0 HB3 LEU A 74 10.329 57.700 27.935 1.00 33.21 H new ATOM 0 HG LEU A 74 8.859 56.799 25.706 1.00 34.33 H new ATOM 0 HD11 LEU A 74 9.165 54.638 26.610 1.00 34.30 H new ATOM 0 HD12 LEU A 74 10.565 55.306 26.293 1.00 34.30 H new ATOM 0 HD13 LEU A 74 10.028 55.261 27.782 1.00 34.30 H new ATOM 0 HD21 LEU A 74 7.215 56.018 27.170 1.00 35.51 H new ATOM 0 HD22 LEU A 74 7.983 56.689 28.382 1.00 35.51 H new ATOM 0 HD23 LEU A 74 7.337 57.595 27.255 1.00 35.51 H new ATOM 618 N SER A 75 10.714 60.461 28.636 1.00 33.91 N ANISOU 618 N SER A 75 4390 4316 4178 245 -153 -116 N ATOM 619 CA SER A 75 11.758 61.315 29.200 1.00 35.54 C ANISOU 619 CA SER A 75 4600 4511 4393 253 -178 -132 C ATOM 620 C SER A 75 13.073 60.545 29.276 1.00 34.55 C ANISOU 620 C SER A 75 4471 4385 4273 243 -171 -127 C ATOM 621 O SER A 75 14.156 61.118 29.152 1.00 34.17 O ANISOU 621 O SER A 75 4422 4320 4240 234 -188 -135 O ATOM 622 CB SER A 75 11.346 61.790 30.598 1.00 37.30 C ANISOU 622 CB SER A 75 4827 4747 4600 290 -192 -148 C ATOM 623 OG SER A 75 9.968 62.132 30.622 1.00 40.80 O ANISOU 623 OG SER A 75 5270 5198 5032 302 -191 -149 O ATOM 0 H SER A 75 10.211 60.091 29.227 1.00 33.91 H new ATOM 0 HA SER A 75 11.878 62.089 28.628 1.00 35.54 H new ATOM 0 HB2 SER A 75 11.523 61.092 31.248 1.00 37.30 H new ATOM 0 HB3 SER A 75 11.880 62.558 30.855 1.00 37.30 H new ATOM 0 HG SER A 75 9.756 62.389 31.393 1.00 40.80 H new ATOM 624 N GLY A 76 12.961 59.241 29.491 1.00 33.43 N ANISOU 624 N GLY A 76 4324 4258 4118 244 -146 -116 N ATOM 625 CA GLY A 76 14.108 58.342 29.490 1.00 33.11 C ANISOU 625 CA GLY A 76 4280 4218 4082 234 -136 -110 C ATOM 626 C GLY A 76 13.608 56.915 29.513 1.00 32.22 C ANISOU 626 C GLY A 76 4164 4121 3957 233 -107 -94 C ATOM 627 O GLY A 76 12.408 56.681 29.667 1.00 32.54 O ANISOU 627 O GLY A 76 4204 4173 3986 242 -95 -89 O ATOM 0 H GLY A 76 12.211 58.849 29.643 1.00 33.43 H new ATOM 0 HA2 GLY A 76 14.653 58.494 28.702 1.00 33.11 H new ATOM 0 HA3 GLY A 76 14.670 58.514 30.262 1.00 33.11 H new ATOM 628 N PHE A 77 14.518 55.960 29.346 1.00 31.83 N ANISOU 628 N PHE A 77 4111 4072 3911 223 -95 -87 N ATOM 629 CA PHE A 77 14.172 54.552 29.468 1.00 31.55 C ANISOU 629 CA PHE A 77 4073 4050 3865 223 -69 -73 C ATOM 630 C PHE A 77 14.431 54.084 30.889 1.00 31.65 C ANISOU 630 C PHE A 77 4088 4077 3860 251 -67 -76 C ATOM 631 O PHE A 77 15.516 54.301 31.427 1.00 32.44 O ANISOU 631 O PHE A 77 4190 4175 3963 259 -81 -87 O ATOM 632 CB PHE A 77 15.000 53.691 28.511 1.00 30.34 C ANISOU 632 CB PHE A 77 3916 3890 3723 198 -57 -63 C ATOM 633 CG PHE A 77 14.778 54.009 27.059 1.00 29.19 C ANISOU 633 CG PHE A 77 3768 3731 3591 171 -56 -57 C ATOM 634 CD1 PHE A 77 15.843 54.368 26.243 1.00 28.58 C ANISOU 634 CD1 PHE A 77 3689 3642 3529 152 -64 -59 C ATOM 635 CD2 PHE A 77 13.502 53.951 26.511 1.00 29.31 C ANISOU 635 CD2 PHE A 77 3783 3749 3604 166 -47 -50 C ATOM 636 CE1 PHE A 77 15.638 54.668 24.906 1.00 28.76 C ANISOU 636 CE1 PHE A 77 3711 3655 3563 129 -62 -52 C ATOM 637 CE2 PHE A 77 13.291 54.245 25.173 1.00 28.58 C ANISOU 637 CE2 PHE A 77 3689 3646 3522 144 -47 -45 C ATOM 638 CZ PHE A 77 14.362 54.605 24.368 1.00 28.41 C ANISOU 638 CZ PHE A 77 3668 3613 3515 126 -54 -46 C ATOM 0 H PHE A 77 15.344 56.109 29.161 1.00 31.83 H new ATOM 0 HA PHE A 77 13.233 54.456 29.244 1.00 31.55 H new ATOM 0 HB2 PHE A 77 15.941 53.806 28.718 1.00 30.34 H new ATOM 0 HB3 PHE A 77 14.788 52.757 28.665 1.00 30.34 H new ATOM 0 HD1 PHE A 77 16.702 54.407 26.597 1.00 28.58 H new ATOM 0 HD2 PHE A 77 12.781 53.712 27.048 1.00 29.31 H new ATOM 0 HE1 PHE A 77 16.357 54.912 24.369 1.00 28.76 H new ATOM 0 HE2 PHE A 77 12.433 54.201 24.816 1.00 28.58 H new ATOM 0 HZ PHE A 77 14.224 54.804 23.470 1.00 28.41 H new ATOM 639 N GLU A 78 13.429 53.458 31.493 1.00 33.80 N ANISOU 639 N GLU A 78 4360 4365 4117 266 -51 -68 N ATOM 640 CA GLU A 78 13.611 52.766 32.759 1.00 34.94 C ANISOU 640 CA GLU A 78 4507 4525 4244 292 -43 -66 C ATOM 641 C GLU A 78 14.490 51.550 32.508 1.00 34.02 C ANISOU 641 C GLU A 78 4389 4407 4132 279 -29 -55 C ATOM 642 O GLU A 78 14.442 50.963 31.425 1.00 31.99 O ANISOU 642 O GLU A 78 4127 4140 3886 253 -17 -45 O ATOM 643 CB GLU A 78 12.269 52.304 33.328 1.00 37.61 C ANISOU 643 CB GLU A 78 4844 4881 4566 307 -25 -54 C ATOM 644 CG GLU A 78 11.392 53.421 33.868 1.00 40.55 C ANISOU 644 CG GLU A 78 5217 5261 4928 328 -38 -66 C ATOM 645 CD GLU A 78 10.331 52.908 34.822 1.00 42.70 C ANISOU 645 CD GLU A 78 5488 5556 5180 352 -21 -56 C ATOM 646 OE1 GLU A 78 9.557 52.007 34.431 1.00 45.68 O ANISOU 646 OE1 GLU A 78 5859 5937 5558 340 3 -37 O ATOM 647 OE2 GLU A 78 10.274 53.402 35.968 1.00 46.64 O ANISOU 647 OE2 GLU A 78 5991 6068 5661 384 -31 -66 O ATOM 0 H GLU A 78 12.628 53.423 31.182 1.00 33.80 H new ATOM 0 HA GLU A 78 14.021 53.369 33.399 1.00 34.94 H new ATOM 0 HB2 GLU A 78 11.782 51.833 32.634 1.00 37.61 H new ATOM 0 HB3 GLU A 78 12.435 51.667 34.040 1.00 37.61 H new ATOM 0 HG2 GLU A 78 11.946 54.073 34.324 1.00 40.55 H new ATOM 0 HG3 GLU A 78 10.964 53.880 33.128 1.00 40.55 H new ATOM 648 N LYS A 79 15.297 51.183 33.499 1.00 32.70 N ANISOU 648 N LYS A 79 4225 4247 3955 298 -32 -60 N ATOM 649 CA LYS A 79 16.028 49.914 33.457 1.00 32.95 C ANISOU 649 CA LYS A 79 4255 4278 3986 292 -17 -49 C ATOM 650 C LYS A 79 15.054 48.738 33.350 1.00 30.95 C ANISOU 650 C LYS A 79 4000 4032 3727 288 10 -28 C ATOM 651 O LYS A 79 13.937 48.795 33.869 1.00 31.07 O ANISOU 651 O LYS A 79 4015 4059 3731 301 18 -21 O ATOM 652 CB LYS A 79 16.915 49.751 34.698 1.00 34.20 C ANISOU 652 CB LYS A 79 4418 4445 4131 319 -26 -57 C ATOM 653 CG LYS A 79 18.400 49.953 34.452 1.00 36.00 C ANISOU 653 CG LYS A 79 4645 4663 4372 311 -42 -70 C ATOM 654 CD LYS A 79 18.755 51.364 34.019 1.00 36.95 C ANISOU 654 CD LYS A 79 4763 4770 4507 302 -67 -88 C ATOM 655 CE LYS A 79 19.198 51.419 32.566 1.00 38.31 C ANISOU 655 CE LYS A 79 4929 4926 4701 267 -65 -84 C ATOM 656 NZ LYS A 79 20.001 52.644 32.301 1.00 39.61 N ANISOU 656 NZ LYS A 79 5090 5077 4881 260 -91 -101 N ATOM 0 H LYS A 79 15.437 51.653 34.206 1.00 32.70 H new ATOM 0 HA LYS A 79 16.598 49.923 32.672 1.00 32.95 H new ATOM 0 HB2 LYS A 79 16.623 50.383 35.374 1.00 34.20 H new ATOM 0 HB3 LYS A 79 16.779 48.863 35.063 1.00 34.20 H new ATOM 0 HG2 LYS A 79 18.887 49.739 35.263 1.00 36.00 H new ATOM 0 HG3 LYS A 79 18.696 49.329 33.771 1.00 36.00 H new ATOM 0 HD2 LYS A 79 17.987 51.943 34.144 1.00 36.95 H new ATOM 0 HD3 LYS A 79 19.464 51.707 34.586 1.00 36.95 H new ATOM 0 HE2 LYS A 79 19.723 50.631 32.354 1.00 38.31 H new ATOM 0 HE3 LYS A 79 18.420 51.406 31.986 1.00 38.31 H new ATOM 0 HZ1 LYS A 79 19.622 53.112 31.646 1.00 39.61 H new ATOM 0 HZ2 LYS A 79 20.036 53.141 33.038 1.00 39.61 H new ATOM 0 HZ3 LYS A 79 20.826 52.412 32.060 1.00 39.61 H new ATOM 657 N ALA A 80 15.488 47.675 32.675 1.00 29.15 N ANISOU 657 N ALA A 80 3770 3798 3509 269 23 -17 N ATOM 658 CA ALA A 80 14.668 46.483 32.476 1.00 28.68 C ANISOU 658 CA ALA A 80 3708 3741 3449 262 47 3 C ATOM 659 C ALA A 80 15.443 45.247 32.937 1.00 28.21 C ANISOU 659 C ALA A 80 3650 3683 3384 267 58 12 C ATOM 660 O ALA A 80 16.163 44.634 32.150 1.00 25.96 O ANISOU 660 O ALA A 80 3365 3388 3112 249 60 13 O ATOM 661 CB ALA A 80 14.274 46.341 31.011 1.00 28.48 C ANISOU 661 CB ALA A 80 3676 3703 3441 231 53 8 C ATOM 0 H ALA A 80 16.269 47.626 32.319 1.00 29.15 H new ATOM 0 HA ALA A 80 13.857 46.568 33.001 1.00 28.68 H new ATOM 0 HB1 ALA A 80 13.731 45.545 30.897 1.00 28.48 H new ATOM 0 HB2 ALA A 80 13.767 47.120 30.735 1.00 28.48 H new ATOM 0 HB3 ALA A 80 15.073 46.267 30.466 1.00 28.48 H new ATOM 662 N PRO A 81 15.322 44.894 34.231 1.00 27.83 N ANISOU 662 N PRO A 81 3608 3649 3318 295 64 17 N ATOM 663 CA PRO A 81 15.982 43.687 34.720 1.00 27.68 C ANISOU 663 CA PRO A 81 3592 3631 3293 302 74 27 C ATOM 664 C PRO A 81 15.508 42.413 34.024 1.00 27.88 C ANISOU 664 C PRO A 81 3614 3649 3330 282 95 47 C ATOM 665 O PRO A 81 14.334 42.292 33.669 1.00 28.10 O ANISOU 665 O PRO A 81 3637 3677 3362 272 107 58 O ATOM 666 CB PRO A 81 15.590 43.649 36.203 1.00 28.32 C ANISOU 666 CB PRO A 81 3679 3730 3350 336 79 33 C ATOM 667 CG PRO A 81 15.314 45.066 36.555 1.00 27.99 C ANISOU 667 CG PRO A 81 3637 3695 3302 349 61 16 C ATOM 668 CD PRO A 81 14.687 45.653 35.323 1.00 28.18 C ANISOU 668 CD PRO A 81 3655 3709 3345 322 59 13 C ATOM 0 HA PRO A 81 16.937 43.717 34.555 1.00 27.68 H new ATOM 0 HB2 PRO A 81 14.810 43.091 36.347 1.00 28.32 H new ATOM 0 HB3 PRO A 81 16.305 43.283 36.747 1.00 28.32 H new ATOM 0 HG2 PRO A 81 14.718 45.129 37.318 1.00 27.99 H new ATOM 0 HG3 PRO A 81 16.129 45.535 36.792 1.00 27.99 H new ATOM 0 HD2 PRO A 81 13.723 45.543 35.324 1.00 28.18 H new ATOM 0 HD3 PRO A 81 14.864 46.604 35.249 1.00 28.18 H new ATOM 669 N HIS A 82 16.428 41.469 33.846 1.00 28.27 N ANISOU 669 N HIS A 82 3666 3691 3384 277 98 50 N ATOM 670 CA HIS A 82 16.104 40.154 33.319 1.00 28.97 C ANISOU 670 CA HIS A 82 3753 3771 3483 261 116 67 C ATOM 671 C HIS A 82 16.196 39.163 34.447 1.00 30.66 C ANISOU 671 C HIS A 82 3973 3992 3683 282 128 83 C ATOM 672 O HIS A 82 17.291 38.753 34.824 1.00 30.18 O ANISOU 672 O HIS A 82 3918 3931 3618 293 123 78 O ATOM 673 CB HIS A 82 17.056 39.788 32.187 1.00 28.23 C ANISOU 673 CB HIS A 82 3656 3664 3406 240 110 59 C ATOM 674 CG HIS A 82 17.020 40.762 31.032 1.00 27.70 C ANISOU 674 CG HIS A 82 3583 3590 3351 219 99 46 C ATOM 675 ND1 HIS A 82 15.927 40.930 30.263 1.00 27.40 N ANISOU 675 ND1 HIS A 82 3540 3548 3322 203 105 52 N ATOM 676 CD2 HIS A 82 17.987 41.635 30.541 1.00 26.89 C ANISOU 676 CD2 HIS A 82 3479 3483 3253 213 81 29 C ATOM 677 CE1 HIS A 82 16.181 41.859 29.323 1.00 26.98 C ANISOU 677 CE1 HIS A 82 3484 3490 3278 188 92 38 C ATOM 678 NE2 HIS A 82 17.439 42.292 29.492 1.00 26.80 N ANISOU 678 NE2 HIS A 82 3462 3466 3253 194 78 25 N ATOM 0 H HIS A 82 17.261 41.577 34.030 1.00 28.27 H new ATOM 0 HA HIS A 82 15.205 40.148 32.954 1.00 28.97 H new ATOM 0 HB2 HIS A 82 17.960 39.744 32.536 1.00 28.23 H new ATOM 0 HB3 HIS A 82 16.834 38.902 31.861 1.00 28.23 H new ATOM 0 HD2 HIS A 82 18.849 41.746 30.872 1.00 26.89 H new ATOM 0 HE1 HIS A 82 15.587 42.150 28.669 1.00 26.98 H new ATOM 0 HE2 HIS A 82 17.832 42.888 29.013 1.00 26.80 H new ATOM 679 N ASP A 83 15.042 38.791 35.003 1.00 33.04 N ANISOU 679 N ASP A 83 4274 4302 3979 290 145 101 N ATOM 680 CA ASP A 83 14.980 37.871 36.150 1.00 35.67 C ANISOU 680 CA ASP A 83 4613 4643 4297 311 160 120 C ATOM 681 C ASP A 83 15.662 36.544 35.815 1.00 34.49 C ANISOU 681 C ASP A 83 4467 4480 4159 301 166 129 C ATOM 682 O ASP A 83 16.366 35.967 36.647 1.00 36.04 O ANISOU 682 O ASP A 83 4672 4679 4342 321 167 134 O ATOM 683 CB ASP A 83 13.525 37.610 36.578 1.00 37.39 C ANISOU 683 CB ASP A 83 4825 4869 4511 314 180 141 C ATOM 684 CG ASP A 83 12.777 38.883 36.974 1.00 40.26 C ANISOU 684 CG ASP A 83 5186 5249 4863 327 174 132 C ATOM 685 OD1 ASP A 83 13.425 39.907 37.279 1.00 41.77 O ANISOU 685 OD1 ASP A 83 5381 5445 5043 341 155 112 O ATOM 686 OD2 ASP A 83 11.527 38.860 36.969 1.00 42.23 O ANISOU 686 OD2 ASP A 83 5428 5504 5115 323 188 146 O ATOM 0 H ASP A 83 14.273 39.062 34.729 1.00 33.04 H new ATOM 0 HA ASP A 83 15.448 38.293 36.887 1.00 35.67 H new ATOM 0 HB2 ASP A 83 13.052 37.177 35.850 1.00 37.39 H new ATOM 0 HB3 ASP A 83 13.520 36.993 37.326 1.00 37.39 H new ATOM 687 N ILE A 84 15.423 36.067 34.595 1.00 33.90 N ANISOU 687 N ILE A 84 4385 4389 4105 273 170 131 N ATOM 688 CA ILE A 84 16.144 34.945 34.013 1.00 32.57 C ANISOU 688 CA ILE A 84 4220 4206 3951 261 171 134 C ATOM 689 C ILE A 84 17.129 35.561 33.019 1.00 32.42 C ANISOU 689 C ILE A 84 4198 4180 3940 247 153 110 C ATOM 690 O ILE A 84 16.699 36.205 32.059 1.00 31.63 O ANISOU 690 O ILE A 84 4091 4076 3851 229 148 102 O ATOM 691 CB ILE A 84 15.184 33.991 33.278 1.00 32.58 C ANISOU 691 CB ILE A 84 4215 4194 3971 239 186 150 C ATOM 692 CG1 ILE A 84 14.148 33.417 34.250 1.00 32.79 C ANISOU 692 CG1 ILE A 84 4241 4227 3991 250 206 176 C ATOM 693 CG2 ILE A 84 15.947 32.861 32.603 1.00 32.36 C ANISOU 693 CG2 ILE A 84 4189 4149 3958 227 185 150 C ATOM 694 CD1 ILE A 84 13.019 32.686 33.561 1.00 33.25 C ANISOU 694 CD1 ILE A 84 4290 4273 4070 228 220 192 C ATOM 0 H ILE A 84 14.823 36.396 34.074 1.00 33.90 H new ATOM 0 HA ILE A 84 16.591 34.423 34.698 1.00 32.57 H new ATOM 0 HB ILE A 84 14.724 34.501 32.593 1.00 32.58 H new ATOM 0 HG12 ILE A 84 14.591 32.810 34.863 1.00 32.79 H new ATOM 0 HG13 ILE A 84 13.779 34.139 34.783 1.00 32.79 H new ATOM 0 HG21 ILE A 84 15.322 32.275 32.148 1.00 32.36 H new ATOM 0 HG22 ILE A 84 16.571 33.231 31.959 1.00 32.36 H new ATOM 0 HG23 ILE A 84 16.435 32.356 33.271 1.00 32.36 H new ATOM 0 HD11 ILE A 84 12.399 32.348 34.226 1.00 33.25 H new ATOM 0 HD12 ILE A 84 12.554 33.295 32.966 1.00 33.25 H new ATOM 0 HD13 ILE A 84 13.378 31.945 33.048 1.00 33.25 H new ATOM 695 N PRO A 85 18.447 35.391 33.244 1.00 33.43 N ANISOU 695 N PRO A 85 4331 4308 4063 257 142 99 N ATOM 696 CA PRO A 85 19.427 36.076 32.388 1.00 32.98 C ANISOU 696 CA PRO A 85 4270 4247 4013 245 125 77 C ATOM 697 C PRO A 85 19.295 35.760 30.901 1.00 33.27 C ANISOU 697 C PRO A 85 4300 4270 4070 217 127 75 C ATOM 698 O PRO A 85 18.879 34.658 30.535 1.00 32.72 O ANISOU 698 O PRO A 85 4231 4192 4011 208 138 88 O ATOM 699 CB PRO A 85 20.780 35.556 32.898 1.00 34.05 C ANISOU 699 CB PRO A 85 4412 4383 4142 261 118 71 C ATOM 700 CG PRO A 85 20.511 35.028 34.262 1.00 34.59 C ANISOU 700 CG PRO A 85 4489 4459 4193 286 127 85 C ATOM 701 CD PRO A 85 19.104 34.521 34.237 1.00 34.27 C ANISOU 701 CD PRO A 85 4447 4417 4158 278 146 107 C ATOM 0 HA PRO A 85 19.306 37.037 32.445 1.00 32.98 H new ATOM 0 HB2 PRO A 85 21.129 34.862 32.317 1.00 34.05 H new ATOM 0 HB3 PRO A 85 21.441 36.266 32.922 1.00 34.05 H new ATOM 0 HG2 PRO A 85 21.132 34.318 34.488 1.00 34.59 H new ATOM 0 HG3 PRO A 85 20.618 35.722 34.931 1.00 34.59 H new ATOM 0 HD2 PRO A 85 19.065 33.587 33.977 1.00 34.27 H new ATOM 0 HD3 PRO A 85 18.683 34.591 35.108 1.00 34.27 H new ATOM 702 N MET A 86 19.642 36.733 30.063 1.00 33.06 N ANISOU 702 N MET A 86 4268 4244 4050 204 115 59 N ATOM 703 CA MET A 86 19.765 36.512 28.626 1.00 33.60 C ANISOU 703 CA MET A 86 4330 4302 4134 180 114 54 C ATOM 704 C MET A 86 21.203 36.097 28.345 1.00 34.51 C ANISOU 704 C MET A 86 4445 4415 4251 181 106 43 C ATOM 705 O MET A 86 22.062 36.928 28.051 1.00 35.57 O ANISOU 705 O MET A 86 4576 4553 4386 178 94 28 O ATOM 706 CB MET A 86 19.396 37.771 27.844 1.00 32.97 C ANISOU 706 CB MET A 86 4245 4224 4060 166 106 44 C ATOM 707 CG MET A 86 17.931 38.150 27.971 1.00 33.00 C ANISOU 707 CG MET A 86 4247 4229 4063 164 113 54 C ATOM 708 SD MET A 86 17.453 39.549 26.941 1.00 32.85 S ANISOU 708 SD MET A 86 4221 4209 4049 148 103 43 S ATOM 709 CE MET A 86 17.519 38.828 25.302 1.00 33.11 C ANISOU 709 CE MET A 86 4250 4232 4100 123 107 42 C ATOM 0 H MET A 86 19.812 37.539 30.311 1.00 33.06 H new ATOM 0 HA MET A 86 19.153 35.816 28.341 1.00 33.60 H new ATOM 0 HB2 MET A 86 19.943 38.509 28.155 1.00 32.97 H new ATOM 0 HB3 MET A 86 19.609 37.636 26.907 1.00 32.97 H new ATOM 0 HG2 MET A 86 17.385 37.384 27.735 1.00 33.00 H new ATOM 0 HG3 MET A 86 17.739 38.361 28.898 1.00 33.00 H new ATOM 0 HE1 MET A 86 18.239 39.237 24.797 1.00 33.11 H new ATOM 0 HE2 MET A 86 17.676 37.874 25.374 1.00 33.11 H new ATOM 0 HE3 MET A 86 16.677 38.983 24.846 1.00 33.11 H new ATOM 710 N TYR A 87 21.447 34.795 28.456 1.00 35.30 N ANISOU 710 N TYR A 87 4550 4509 4354 184 113 51 N ATOM 711 CA TYR A 87 22.789 34.219 28.291 1.00 35.75 C ANISOU 711 CA TYR A 87 4607 4564 4411 188 107 42 C ATOM 712 C TYR A 87 23.330 34.381 26.869 1.00 34.64 C ANISOU 712 C TYR A 87 4459 4421 4282 169 102 30 C ATOM 713 O TYR A 87 22.573 34.583 25.930 1.00 32.57 O ANISOU 713 O TYR A 87 4193 4155 4029 151 105 31 O ATOM 714 CB TYR A 87 22.775 32.730 28.662 1.00 37.11 C ANISOU 714 CB TYR A 87 4787 4729 4585 196 116 55 C ATOM 715 CG TYR A 87 21.749 31.926 27.893 1.00 37.64 C ANISOU 715 CG TYR A 87 4852 4784 4666 180 127 66 C ATOM 716 CD1 TYR A 87 22.021 31.457 26.612 1.00 38.15 C ANISOU 716 CD1 TYR A 87 4911 4840 4743 163 125 59 C ATOM 717 CD2 TYR A 87 20.497 31.649 28.442 1.00 38.85 C ANISOU 717 CD2 TYR A 87 5008 4935 4820 181 139 84 C ATOM 718 CE1 TYR A 87 21.081 30.734 25.900 1.00 39.57 C ANISOU 718 CE1 TYR A 87 5090 5009 4937 149 132 67 C ATOM 719 CE2 TYR A 87 19.552 30.925 27.735 1.00 39.22 C ANISOU 719 CE2 TYR A 87 5051 4969 4882 165 148 94 C ATOM 720 CZ TYR A 87 19.851 30.470 26.465 1.00 39.08 C ANISOU 720 CZ TYR A 87 5028 4941 4877 150 143 85 C ATOM 721 OH TYR A 87 18.927 29.749 25.751 1.00 40.40 O ANISOU 721 OH TYR A 87 5192 5096 5061 135 149 92 O ATOM 0 H TYR A 87 20.838 34.213 28.630 1.00 35.30 H new ATOM 0 HA TYR A 87 23.378 34.708 28.887 1.00 35.75 H new ATOM 0 HB2 TYR A 87 23.655 32.356 28.501 1.00 37.11 H new ATOM 0 HB3 TYR A 87 22.598 32.642 29.612 1.00 37.11 H new ATOM 0 HD1 TYR A 87 22.849 31.633 26.228 1.00 38.15 H new ATOM 0 HD2 TYR A 87 20.294 31.955 29.296 1.00 38.85 H new ATOM 0 HE1 TYR A 87 21.278 30.427 25.044 1.00 39.57 H new ATOM 0 HE2 TYR A 87 18.721 30.746 28.113 1.00 39.22 H new ATOM 0 HH TYR A 87 19.193 28.956 25.668 1.00 40.40 H new ATOM 722 N SER A 88 24.650 34.296 26.733 1.00 34.79 N ANISOU 722 N SER A 88 4475 4443 4301 173 93 18 N ATOM 723 CA SER A 88 25.298 34.262 25.424 1.00 35.19 C ANISOU 723 CA SER A 88 4518 4492 4361 157 90 7 C ATOM 724 C SER A 88 25.874 32.872 25.218 1.00 33.42 C ANISOU 724 C SER A 88 4297 4262 4140 161 92 8 C ATOM 725 O SER A 88 26.169 32.168 26.179 1.00 34.66 O ANISOU 725 O SER A 88 4461 4418 4290 178 93 12 O ATOM 726 CB SER A 88 26.404 35.312 25.325 1.00 36.55 C ANISOU 726 CB SER A 88 4684 4674 4532 156 78 -8 C ATOM 727 OG SER A 88 27.440 35.056 26.256 1.00 38.04 O ANISOU 727 OG SER A 88 4874 4867 4714 175 71 -14 O ATOM 0 H SER A 88 25.196 34.256 27.396 1.00 34.79 H new ATOM 0 HA SER A 88 24.645 34.465 24.736 1.00 35.19 H new ATOM 0 HB2 SER A 88 26.768 35.318 24.426 1.00 36.55 H new ATOM 0 HB3 SER A 88 26.032 36.193 25.486 1.00 36.55 H new ATOM 0 HG SER A 88 28.035 35.644 26.182 1.00 38.04 H new ATOM 728 N LEU A 89 26.029 32.485 23.959 1.00 33.25 N ANISOU 728 N LEU A 89 4270 4237 4126 147 93 3 N ATOM 729 CA LEU A 89 26.499 31.148 23.621 1.00 32.42 C ANISOU 729 CA LEU A 89 4167 4126 4026 151 95 1 C ATOM 730 C LEU A 89 28.017 31.111 23.517 1.00 31.86 C ANISOU 730 C LEU A 89 4091 4063 3951 158 87 -13 C ATOM 731 O LEU A 89 28.649 32.113 23.187 1.00 30.88 O ANISOU 731 O LEU A 89 3959 3949 3826 153 81 -23 O ATOM 732 CB LEU A 89 25.896 30.701 22.283 1.00 33.22 C ANISOU 732 CB LEU A 89 4265 4219 4137 134 98 1 C ATOM 733 CG LEU A 89 24.374 30.734 22.146 1.00 33.78 C ANISOU 733 CG LEU A 89 4338 4282 4215 124 106 13 C ATOM 734 CD1 LEU A 89 23.942 30.267 20.761 1.00 33.99 C ANISOU 734 CD1 LEU A 89 4361 4303 4252 110 106 9 C ATOM 735 CD2 LEU A 89 23.722 29.892 23.229 1.00 33.56 C ANISOU 735 CD2 LEU A 89 4319 4245 4188 135 112 28 C ATOM 0 H LEU A 89 25.866 32.986 23.279 1.00 33.25 H new ATOM 0 HA LEU A 89 26.218 30.547 24.328 1.00 32.42 H new ATOM 0 HB2 LEU A 89 26.271 31.260 21.585 1.00 33.22 H new ATOM 0 HB3 LEU A 89 26.192 29.794 22.110 1.00 33.22 H new ATOM 0 HG LEU A 89 24.080 31.652 22.256 1.00 33.78 H new ATOM 0 HD11 LEU A 89 22.975 30.296 20.697 1.00 33.99 H new ATOM 0 HD12 LEU A 89 24.328 30.849 20.088 1.00 33.99 H new ATOM 0 HD13 LEU A 89 24.248 29.358 20.616 1.00 33.99 H new ATOM 0 HD21 LEU A 89 22.758 29.924 23.128 1.00 33.56 H new ATOM 0 HD22 LEU A 89 24.025 28.974 23.151 1.00 33.56 H new ATOM 0 HD23 LEU A 89 23.967 30.240 24.101 1.00 33.56 H new ATOM 736 N ASN A 90 28.599 29.946 23.791 1.00 31.17 N ANISOU 736 N ASN A 90 4008 3971 3863 171 86 -14 N ATOM 737 CA ASN A 90 29.988 29.693 23.421 1.00 31.81 C ANISOU 737 CA ASN A 90 4083 4060 3943 176 79 -29 C ATOM 738 C ASN A 90 30.096 29.767 21.907 1.00 31.02 C ANISOU 738 C ASN A 90 3973 3962 3849 160 80 -37 C ATOM 739 O ASN A 90 29.145 29.415 21.201 1.00 29.53 O ANISOU 739 O ASN A 90 3787 3765 3668 149 85 -31 O ATOM 740 CB ASN A 90 30.448 28.311 23.899 1.00 33.11 C ANISOU 740 CB ASN A 90 4256 4217 4107 192 78 -28 C ATOM 741 CG ASN A 90 30.546 28.209 25.409 1.00 34.75 C ANISOU 741 CG ASN A 90 4474 4424 4306 212 76 -21 C ATOM 742 OD1 ASN A 90 30.280 27.153 25.985 1.00 37.76 O ANISOU 742 OD1 ASN A 90 4865 4794 4686 223 80 -11 O ATOM 743 ND2 ASN A 90 30.935 29.298 26.059 1.00 35.51 N ANISOU 743 ND2 ASN A 90 4566 4532 4395 217 71 -26 N ATOM 0 H ASN A 90 28.208 29.291 24.189 1.00 31.17 H new ATOM 0 HA ASN A 90 30.556 30.357 23.842 1.00 31.81 H new ATOM 0 HB2 ASN A 90 29.829 27.639 23.574 1.00 33.11 H new ATOM 0 HB3 ASN A 90 31.314 28.111 23.509 1.00 33.11 H new ATOM 0 HD21 ASN A 90 31.010 29.284 26.916 1.00 35.51 H new ATOM 0 HD22 ASN A 90 31.113 30.018 25.624 1.00 35.51 H new ATOM 744 N ASP A 91 31.241 30.233 21.413 1.00 30.82 N ANISOU 744 N ASP A 91 3938 3950 3823 158 74 -50 N ATOM 745 CA ASP A 91 31.465 30.379 19.974 1.00 30.76 C ANISOU 745 CA ASP A 91 3920 3949 3819 145 76 -57 C ATOM 746 C ASP A 91 32.357 29.271 19.420 1.00 31.18 C ANISOU 746 C ASP A 91 3971 4005 3872 153 74 -67 C ATOM 747 O ASP A 91 33.217 28.737 20.123 1.00 32.45 O ANISOU 747 O ASP A 91 4132 4167 4029 169 69 -73 O ATOM 748 CB ASP A 91 32.106 31.737 19.661 1.00 31.59 C ANISOU 748 CB ASP A 91 4012 4068 3923 135 73 -63 C ATOM 749 CG ASP A 91 31.114 32.893 19.694 1.00 32.43 C ANISOU 749 CG ASP A 91 4120 4171 4031 123 75 -54 C ATOM 750 OD1 ASP A 91 31.573 34.048 19.795 1.00 34.95 O ANISOU 750 OD1 ASP A 91 4431 4498 4350 117 71 -57 O ATOM 751 OD2 ASP A 91 29.892 32.665 19.600 1.00 32.11 O ANISOU 751 OD2 ASP A 91 4087 4120 3992 118 80 -45 O ATOM 0 H ASP A 91 31.908 30.473 21.900 1.00 30.82 H new ATOM 0 HA ASP A 91 30.596 30.318 19.548 1.00 30.76 H new ATOM 0 HB2 ASP A 91 32.814 31.908 20.301 1.00 31.59 H new ATOM 0 HB3 ASP A 91 32.519 31.698 18.784 1.00 31.59 H new ATOM 752 N GLY A 92 32.127 28.932 18.154 1.00 30.33 N ANISOU 752 N GLY A 92 3860 3898 3768 144 76 -71 N ATOM 753 CA GLY A 92 33.008 28.059 17.380 1.00 31.17 C ANISOU 753 CA GLY A 92 3961 4010 3873 152 74 -83 C ATOM 754 C GLY A 92 33.345 28.745 16.072 1.00 31.33 C ANISOU 754 C GLY A 92 3968 4045 3890 140 77 -89 C ATOM 755 O GLY A 92 32.564 29.566 15.578 1.00 30.17 O ANISOU 755 O GLY A 92 3819 3898 3744 125 81 -83 O ATOM 0 H GLY A 92 31.442 29.208 17.712 1.00 30.33 H new ATOM 0 HA2 GLY A 92 33.818 27.871 17.879 1.00 31.17 H new ATOM 0 HA3 GLY A 92 32.574 27.208 17.211 1.00 31.17 H new ATOM 756 N PHE A 93 34.514 28.429 15.516 1.00 32.09 N ANISOU 756 N PHE A 93 4054 4156 3983 147 75 -102 N ATOM 757 CA PHE A 93 34.983 29.065 14.278 1.00 33.13 C ANISOU 757 CA PHE A 93 4172 4305 4111 137 79 -107 C ATOM 758 C PHE A 93 35.408 28.087 13.179 1.00 33.63 C ANISOU 758 C PHE A 93 4232 4375 4170 145 79 -118 C ATOM 759 O PHE A 93 35.487 28.468 12.006 1.00 34.14 O ANISOU 759 O PHE A 93 4288 4453 4230 137 84 -120 O ATOM 760 CB PHE A 93 36.133 30.021 14.601 1.00 33.66 C ANISOU 760 CB PHE A 93 4225 4388 4177 135 79 -110 C ATOM 761 CG PHE A 93 35.758 31.087 15.586 1.00 34.14 C ANISOU 761 CG PHE A 93 4288 4443 4242 128 77 -100 C ATOM 762 CD1 PHE A 93 35.129 32.248 15.162 1.00 34.50 C ANISOU 762 CD1 PHE A 93 4331 4488 4288 111 81 -91 C ATOM 763 CD2 PHE A 93 36.009 30.919 16.942 1.00 34.81 C ANISOU 763 CD2 PHE A 93 4378 4520 4326 140 71 -101 C ATOM 764 CE1 PHE A 93 34.765 33.226 16.072 1.00 35.11 C ANISOU 764 CE1 PHE A 93 4411 4560 4370 106 78 -85 C ATOM 765 CE2 PHE A 93 35.647 31.893 17.857 1.00 35.37 C ANISOU 765 CE2 PHE A 93 4452 4586 4400 136 68 -94 C ATOM 766 CZ PHE A 93 35.024 33.049 17.421 1.00 35.07 C ANISOU 766 CZ PHE A 93 4411 4549 4365 118 71 -86 C ATOM 0 H PHE A 93 35.056 27.845 15.840 1.00 32.09 H new ATOM 0 HA PHE A 93 34.221 29.545 13.917 1.00 33.13 H new ATOM 0 HB2 PHE A 93 36.880 29.512 14.953 1.00 33.66 H new ATOM 0 HB3 PHE A 93 36.437 30.440 13.781 1.00 33.66 H new ATOM 0 HD1 PHE A 93 34.950 32.371 14.258 1.00 34.50 H new ATOM 0 HD2 PHE A 93 36.426 30.142 17.239 1.00 34.81 H new ATOM 0 HE1 PHE A 93 34.346 34.002 15.777 1.00 35.11 H new ATOM 0 HE2 PHE A 93 35.822 31.771 18.762 1.00 35.37 H new ATOM 0 HZ PHE A 93 34.780 33.706 18.032 1.00 35.07 H new ATOM 767 N SER A 94 35.672 26.836 13.547 1.00 33.34 N ANISOU 767 N SER A 94 4203 4331 4135 161 73 -126 N ATOM 768 CA SER A 94 36.181 25.845 12.603 1.00 34.50 C ANISOU 768 CA SER A 94 4346 4485 4278 172 70 -139 C ATOM 769 C SER A 94 35.321 24.593 12.586 1.00 33.91 C ANISOU 769 C SER A 94 4286 4388 4209 179 65 -140 C ATOM 770 O SER A 94 34.483 24.388 13.462 1.00 33.03 O ANISOU 770 O SER A 94 4187 4257 4106 177 63 -130 O ATOM 771 CB SER A 94 37.609 25.462 12.987 1.00 34.91 C ANISOU 771 CB SER A 94 4389 4549 4325 188 66 -151 C ATOM 772 OG SER A 94 37.644 24.894 14.288 1.00 35.58 O ANISOU 772 OG SER A 94 4486 4619 4415 199 60 -149 O ATOM 0 H SER A 94 35.562 26.539 14.347 1.00 33.34 H new ATOM 0 HA SER A 94 36.161 26.241 11.718 1.00 34.50 H new ATOM 0 HB2 SER A 94 37.963 24.829 12.343 1.00 34.91 H new ATOM 0 HB3 SER A 94 38.179 26.247 12.956 1.00 34.91 H new ATOM 0 HG SER A 94 38.435 24.688 14.483 1.00 35.58 H new ATOM 773 N LYS A 95 35.547 23.751 11.585 1.00 34.86 N ANISOU 773 N LYS A 95 4406 4513 4327 188 61 -153 N ATOM 774 CA LYS A 95 34.938 22.429 11.545 1.00 35.38 C ANISOU 774 CA LYS A 95 4484 4558 4401 197 53 -158 C ATOM 775 C LYS A 95 35.335 21.630 12.792 1.00 35.75 C ANISOU 775 C LYS A 95 4540 4590 4452 211 47 -157 C ATOM 776 O LYS A 95 34.507 20.930 13.373 1.00 34.20 O ANISOU 776 O LYS A 95 4358 4370 4267 212 43 -149 O ATOM 777 CB LYS A 95 35.352 21.692 10.270 1.00 36.01 C ANISOU 777 CB LYS A 95 4560 4648 4475 209 48 -176 C ATOM 778 CG LYS A 95 34.492 20.489 9.942 1.00 36.91 C ANISOU 778 CG LYS A 95 4686 4739 4600 214 38 -181 C ATOM 779 CD LYS A 95 34.826 19.940 8.563 1.00 37.40 C ANISOU 779 CD LYS A 95 4742 4813 4654 225 32 -200 C ATOM 780 CE LYS A 95 33.966 18.739 8.215 1.00 37.66 C ANISOU 780 CE LYS A 95 4787 4821 4700 231 20 -207 C ATOM 781 NZ LYS A 95 34.383 18.127 6.923 1.00 38.79 N ANISOU 781 NZ LYS A 95 4926 4977 4835 246 12 -228 N ATOM 0 H LYS A 95 36.055 23.929 10.914 1.00 34.86 H new ATOM 0 HA LYS A 95 33.973 22.526 11.538 1.00 35.38 H new ATOM 0 HB2 LYS A 95 35.320 22.312 9.525 1.00 36.01 H new ATOM 0 HB3 LYS A 95 36.274 21.403 10.360 1.00 36.01 H new ATOM 0 HG2 LYS A 95 34.627 19.799 10.610 1.00 36.91 H new ATOM 0 HG3 LYS A 95 33.555 20.738 9.977 1.00 36.91 H new ATOM 0 HD2 LYS A 95 34.697 20.634 7.898 1.00 37.40 H new ATOM 0 HD3 LYS A 95 35.762 19.688 8.533 1.00 37.40 H new ATOM 0 HE2 LYS A 95 34.029 18.079 8.923 1.00 37.66 H new ATOM 0 HE3 LYS A 95 33.036 19.010 8.161 1.00 37.66 H new ATOM 0 HZ1 LYS A 95 33.863 17.427 6.744 1.00 38.79 H new ATOM 0 HZ2 LYS A 95 34.305 18.728 6.271 1.00 38.79 H new ATOM 0 HZ3 LYS A 95 35.230 17.860 6.980 1.00 38.79 H new ATOM 782 N GLU A 96 36.598 21.756 13.200 1.00 36.65 N ANISOU 782 N GLU A 96 4646 4720 4560 222 46 -164 N ATOM 783 CA GLU A 96 37.106 21.119 14.418 1.00 37.08 C ANISOU 783 CA GLU A 96 4709 4764 4616 237 39 -163 C ATOM 784 C GLU A 96 36.304 21.518 15.659 1.00 35.40 C ANISOU 784 C GLU A 96 4507 4536 4409 229 43 -145 C ATOM 785 O GLU A 96 35.931 20.663 16.468 1.00 33.59 O ANISOU 785 O GLU A 96 4292 4286 4186 238 38 -138 O ATOM 786 CB GLU A 96 38.585 21.474 14.615 1.00 39.54 C ANISOU 786 CB GLU A 96 5005 5098 4918 247 39 -174 C ATOM 787 CG GLU A 96 39.260 20.754 15.772 1.00 42.19 C ANISOU 787 CG GLU A 96 5349 5426 5254 266 30 -177 C ATOM 788 CD GLU A 96 40.778 20.812 15.690 1.00 44.68 C ANISOU 788 CD GLU A 96 5650 5766 5562 279 27 -194 C ATOM 789 OE1 GLU A 96 41.322 21.863 15.280 1.00 47.27 O ANISOU 789 OE1 GLU A 96 5960 6116 5885 270 33 -196 O ATOM 790 OE2 GLU A 96 41.429 19.804 16.040 1.00 47.13 O ANISOU 790 OE2 GLU A 96 5965 6072 5872 300 18 -204 O ATOM 0 H GLU A 96 37.188 22.216 12.776 1.00 36.65 H new ATOM 0 HA GLU A 96 37.009 20.160 14.306 1.00 37.08 H new ATOM 0 HB2 GLU A 96 39.066 21.270 13.798 1.00 39.54 H new ATOM 0 HB3 GLU A 96 38.660 22.431 14.757 1.00 39.54 H new ATOM 0 HG2 GLU A 96 38.969 21.149 16.609 1.00 42.19 H new ATOM 0 HG3 GLU A 96 38.975 19.827 15.782 1.00 42.19 H new ATOM 791 N ASP A 97 36.036 22.814 15.802 1.00 33.72 N ANISOU 791 N ASP A 97 4287 4331 4193 214 50 -136 N ATOM 792 CA ASP A 97 35.271 23.319 16.948 1.00 32.97 C ANISOU 792 CA ASP A 97 4201 4224 4102 209 54 -119 C ATOM 793 C ASP A 97 33.870 22.712 17.001 1.00 31.58 C ANISOU 793 C ASP A 97 4038 4025 3935 202 55 -107 C ATOM 794 O ASP A 97 33.376 22.368 18.073 1.00 30.42 O ANISOU 794 O ASP A 97 3903 3863 3793 207 55 -95 O ATOM 795 CB ASP A 97 35.159 24.849 16.903 1.00 33.17 C ANISOU 795 CB ASP A 97 4216 4263 4123 193 60 -114 C ATOM 796 CG ASP A 97 36.487 25.551 17.137 1.00 34.29 C ANISOU 796 CG ASP A 97 4345 4426 4259 198 58 -122 C ATOM 797 OD1 ASP A 97 37.457 24.905 17.590 1.00 35.12 O ANISOU 797 OD1 ASP A 97 4448 4534 4361 214 52 -132 O ATOM 798 OD2 ASP A 97 36.558 26.766 16.874 1.00 33.71 O ANISOU 798 OD2 ASP A 97 4261 4364 4185 184 62 -120 O ATOM 0 H ASP A 97 36.287 23.421 15.247 1.00 33.72 H new ATOM 0 HA ASP A 97 35.754 23.056 17.747 1.00 32.97 H new ATOM 0 HB2 ASP A 97 34.805 25.117 16.040 1.00 33.17 H new ATOM 0 HB3 ASP A 97 34.522 25.141 17.574 1.00 33.17 H new ATOM 799 N ILE A 98 33.236 22.577 15.840 1.00 31.11 N ANISOU 799 N ILE A 98 3977 3964 3881 192 56 -110 N ATOM 800 CA ILE A 98 31.859 22.085 15.775 1.00 31.08 C ANISOU 800 CA ILE A 98 3983 3938 3888 184 57 -100 C ATOM 801 C ILE A 98 31.784 20.576 16.025 1.00 31.11 C ANISOU 801 C ILE A 98 3998 3921 3902 197 49 -102 C ATOM 802 O ILE A 98 30.912 20.110 16.757 1.00 30.82 O ANISOU 802 O ILE A 98 3971 3863 3875 195 51 -87 O ATOM 803 CB ILE A 98 31.191 22.452 14.433 1.00 31.53 C ANISOU 803 CB ILE A 98 4034 3999 3947 171 59 -105 C ATOM 804 CG1 ILE A 98 31.121 23.977 14.273 1.00 31.36 C ANISOU 804 CG1 ILE A 98 4003 3994 3917 157 66 -99 C ATOM 805 CG2 ILE A 98 29.797 21.850 14.353 1.00 31.02 C ANISOU 805 CG2 ILE A 98 3978 3912 3897 163 58 -96 C ATOM 806 CD1 ILE A 98 30.314 24.675 15.350 1.00 31.51 C ANISOU 806 CD1 ILE A 98 4027 4006 3939 149 72 -82 C ATOM 0 H ILE A 98 33.584 22.765 15.076 1.00 31.11 H new ATOM 0 HA ILE A 98 31.367 22.526 16.485 1.00 31.08 H new ATOM 0 HB ILE A 98 31.727 22.088 13.711 1.00 31.53 H new ATOM 0 HG12 ILE A 98 32.023 24.335 14.275 1.00 31.36 H new ATOM 0 HG13 ILE A 98 30.735 24.185 13.408 1.00 31.36 H new ATOM 0 HG21 ILE A 98 29.390 22.088 13.506 1.00 31.02 H new ATOM 0 HG22 ILE A 98 29.857 20.884 14.422 1.00 31.02 H new ATOM 0 HG23 ILE A 98 29.254 22.193 15.080 1.00 31.02 H new ATOM 0 HD11 ILE A 98 30.313 25.631 15.186 1.00 31.51 H new ATOM 0 HD12 ILE A 98 29.402 24.344 15.337 1.00 31.51 H new ATOM 0 HD13 ILE A 98 30.710 24.497 16.218 1.00 31.51 H new ATOM 807 N PHE A 99 32.703 19.818 15.433 1.00 31.18 N ANISOU 807 N PHE A 99 4003 3934 3907 210 41 -118 N ATOM 808 CA PHE A 99 32.758 18.374 15.670 1.00 31.45 C ANISOU 808 CA PHE A 99 4050 3949 3952 224 32 -122 C ATOM 809 C PHE A 99 33.182 18.060 17.109 1.00 29.97 C ANISOU 809 C PHE A 99 3871 3754 3763 237 32 -111 C ATOM 810 O PHE A 99 32.683 17.109 17.710 1.00 30.57 O ANISOU 810 O PHE A 99 3960 3806 3850 242 29 -102 O ATOM 811 CB PHE A 99 33.677 17.683 14.647 1.00 32.78 C ANISOU 811 CB PHE A 99 4212 4127 4116 238 22 -144 C ATOM 812 CG PHE A 99 33.006 17.404 13.329 1.00 34.05 C ANISOU 812 CG PHE A 99 4370 4283 4282 231 19 -154 C ATOM 813 CD1 PHE A 99 32.614 18.447 12.495 1.00 34.05 C ANISOU 813 CD1 PHE A 99 4361 4300 4277 216 26 -154 C ATOM 814 CD2 PHE A 99 32.750 16.101 12.924 1.00 34.91 C ANISOU 814 CD2 PHE A 99 4488 4372 4404 240 7 -163 C ATOM 815 CE1 PHE A 99 31.985 18.193 11.288 1.00 34.21 C ANISOU 815 CE1 PHE A 99 4380 4318 4302 212 21 -163 C ATOM 816 CE2 PHE A 99 32.123 15.841 11.714 1.00 35.41 C ANISOU 816 CE2 PHE A 99 4549 4432 4473 236 1 -173 C ATOM 817 CZ PHE A 99 31.739 16.889 10.896 1.00 35.26 C ANISOU 817 CZ PHE A 99 4520 4431 4446 222 9 -174 C ATOM 0 H PHE A 99 33.302 20.116 14.893 1.00 31.18 H new ATOM 0 HA PHE A 99 31.863 18.019 15.550 1.00 31.45 H new ATOM 0 HB2 PHE A 99 34.455 18.241 14.494 1.00 32.78 H new ATOM 0 HB3 PHE A 99 33.996 16.848 15.022 1.00 32.78 H new ATOM 0 HD1 PHE A 99 32.777 19.326 12.752 1.00 34.05 H new ATOM 0 HD2 PHE A 99 33.002 15.393 13.471 1.00 34.91 H new ATOM 0 HE1 PHE A 99 31.728 18.899 10.740 1.00 34.21 H new ATOM 0 HE2 PHE A 99 31.961 14.963 11.453 1.00 35.41 H new ATOM 0 HZ PHE A 99 31.317 16.717 10.085 1.00 35.26 H new ATOM 818 N ALA A 100 34.087 18.867 17.661 1.00 28.81 N ANISOU 818 N ALA A 100 3717 3626 3603 242 35 -114 N ATOM 819 CA ALA A 100 34.476 18.745 19.071 1.00 28.81 C ANISOU 819 CA ALA A 100 3726 3622 3599 254 34 -104 C ATOM 820 C ALA A 100 33.286 19.000 20.003 1.00 28.49 C ANISOU 820 C ALA A 100 3695 3566 3563 246 42 -81 C ATOM 821 O ALA A 100 33.113 18.297 21.001 1.00 28.93 O ANISOU 821 O ALA A 100 3763 3606 3622 256 42 -69 O ATOM 822 CB ALA A 100 35.627 19.686 19.396 1.00 28.98 C ANISOU 822 CB ALA A 100 3736 3668 3606 260 35 -113 C ATOM 0 H ALA A 100 34.491 19.496 17.235 1.00 28.81 H new ATOM 0 HA ALA A 100 34.775 17.834 19.217 1.00 28.81 H new ATOM 0 HB1 ALA A 100 35.869 19.591 20.330 1.00 28.98 H new ATOM 0 HB2 ALA A 100 36.391 19.467 18.840 1.00 28.98 H new ATOM 0 HB3 ALA A 100 35.355 20.601 19.224 1.00 28.98 H new ATOM 823 N PHE A 101 32.465 19.999 19.675 1.00 27.71 N ANISOU 823 N PHE A 101 3590 3473 3465 227 50 -74 N ATOM 824 CA PHE A 101 31.239 20.275 20.434 1.00 27.35 C ANISOU 824 CA PHE A 101 3552 3415 3425 218 59 -53 C ATOM 825 C PHE A 101 30.343 19.036 20.448 1.00 26.92 C ANISOU 825 C PHE A 101 3508 3333 3387 217 58 -42 C ATOM 826 O PHE A 101 29.911 18.586 21.514 1.00 26.12 O ANISOU 826 O PHE A 101 3418 3218 3288 223 61 -25 O ATOM 827 CB PHE A 101 30.514 21.503 19.853 1.00 27.25 C ANISOU 827 CB PHE A 101 3530 3413 3412 198 66 -51 C ATOM 828 CG PHE A 101 29.063 21.613 20.240 1.00 27.16 C ANISOU 828 CG PHE A 101 3524 3387 3409 186 73 -32 C ATOM 829 CD1 PHE A 101 28.064 21.209 19.359 1.00 27.27 C ANISOU 829 CD1 PHE A 101 3537 3387 3436 173 74 -30 C ATOM 830 CD2 PHE A 101 28.691 22.138 21.474 1.00 27.60 C ANISOU 830 CD2 PHE A 101 3585 3443 3459 189 80 -16 C ATOM 831 CE1 PHE A 101 26.728 21.316 19.703 1.00 27.56 C ANISOU 831 CE1 PHE A 101 3577 3412 3482 162 81 -13 C ATOM 832 CE2 PHE A 101 27.355 22.246 21.822 1.00 27.74 C ANISOU 832 CE2 PHE A 101 3606 3450 3484 179 88 2 C ATOM 833 CZ PHE A 101 26.371 21.837 20.937 1.00 27.38 C ANISOU 833 CZ PHE A 101 3558 3391 3453 165 89 3 C ATOM 0 H PHE A 101 32.599 20.532 19.013 1.00 27.71 H new ATOM 0 HA PHE A 101 31.469 20.483 21.353 1.00 27.35 H new ATOM 0 HB2 PHE A 101 30.976 22.305 20.144 1.00 27.25 H new ATOM 0 HB3 PHE A 101 30.578 21.474 18.886 1.00 27.25 H new ATOM 0 HD1 PHE A 101 28.298 20.863 18.528 1.00 27.27 H new ATOM 0 HD2 PHE A 101 29.346 22.419 22.071 1.00 27.60 H new ATOM 0 HE1 PHE A 101 26.070 21.039 19.107 1.00 27.56 H new ATOM 0 HE2 PHE A 101 27.118 22.594 22.651 1.00 27.74 H new ATOM 0 HZ PHE A 101 25.474 21.912 21.170 1.00 27.38 H new ATOM 834 N ASP A 102 30.103 18.469 19.267 1.00 26.89 N ANISOU 834 N ASP A 102 3502 3323 3393 211 52 -53 N ATOM 835 CA ASP A 102 29.300 17.253 19.138 1.00 27.06 C ANISOU 835 CA ASP A 102 3531 3316 3433 209 48 -47 C ATOM 836 C ASP A 102 29.890 16.088 19.937 1.00 27.30 C ANISOU 836 C ASP A 102 3575 3333 3467 228 42 -43 C ATOM 837 O ASP A 102 29.155 15.336 20.569 1.00 27.94 O ANISOU 837 O ASP A 102 3665 3390 3561 227 44 -25 O ATOM 838 CB ASP A 102 29.156 16.860 17.666 1.00 27.23 C ANISOU 838 CB ASP A 102 3547 3336 3463 203 40 -64 C ATOM 839 CG ASP A 102 28.422 15.542 17.471 1.00 27.82 C ANISOU 839 CG ASP A 102 3630 3380 3560 203 33 -61 C ATOM 840 OD1 ASP A 102 27.216 15.466 17.779 1.00 27.63 O ANISOU 840 OD1 ASP A 102 3609 3339 3550 190 39 -43 O ATOM 841 OD2 ASP A 102 29.056 14.574 16.981 1.00 28.07 O ANISOU 841 OD2 ASP A 102 3665 3405 3596 215 20 -76 O ATOM 0 H ASP A 102 30.400 18.777 18.521 1.00 26.89 H new ATOM 0 HA ASP A 102 28.423 17.448 19.505 1.00 27.06 H new ATOM 0 HB2 ASP A 102 28.681 17.562 17.194 1.00 27.23 H new ATOM 0 HB3 ASP A 102 30.037 16.796 17.266 1.00 27.23 H new ATOM 842 N GLU A 103 31.211 15.946 19.910 1.00 28.62 N ANISOU 842 N GLU A 103 3740 3512 3622 244 35 -59 N ATOM 843 CA GLU A 103 31.871 14.892 20.674 1.00 29.61 C ANISOU 843 CA GLU A 103 3877 3626 3748 264 27 -57 C ATOM 844 C GLU A 103 31.604 15.061 22.168 1.00 29.62 C ANISOU 844 C GLU A 103 3889 3622 3745 270 36 -34 C ATOM 845 O GLU A 103 31.336 14.084 22.861 1.00 29.79 O ANISOU 845 O GLU A 103 3923 3622 3775 278 35 -20 O ATOM 846 CB GLU A 103 33.372 14.885 20.408 1.00 31.66 C ANISOU 846 CB GLU A 103 4131 3904 3994 282 19 -80 C ATOM 847 CG GLU A 103 34.099 13.699 21.023 1.00 33.86 C ANISOU 847 CG GLU A 103 4422 4170 4274 304 8 -82 C ATOM 848 CD GLU A 103 35.604 13.845 20.952 1.00 34.87 C ANISOU 848 CD GLU A 103 4543 4320 4387 322 1 -103 C ATOM 849 OE1 GLU A 103 36.269 13.630 21.987 1.00 37.75 O ANISOU 849 OE1 GLU A 103 4915 4686 4743 339 -2 -99 O ATOM 850 OE2 GLU A 103 36.123 14.193 19.873 1.00 35.97 O ANISOU 850 OE2 GLU A 103 4668 4478 4521 319 -2 -123 O ATOM 0 H GLU A 103 31.743 16.448 19.457 1.00 28.62 H new ATOM 0 HA GLU A 103 31.504 14.042 20.386 1.00 29.61 H new ATOM 0 HB2 GLU A 103 33.522 14.884 19.450 1.00 31.66 H new ATOM 0 HB3 GLU A 103 33.757 15.705 20.755 1.00 31.66 H new ATOM 0 HG2 GLU A 103 33.829 13.603 21.950 1.00 33.86 H new ATOM 0 HG3 GLU A 103 33.833 12.887 20.564 1.00 33.86 H new ATOM 851 N ARG A 104 31.670 16.300 22.656 1.00 28.97 N ANISOU 851 N ARG A 104 3800 3560 3648 266 44 -30 N ATOM 852 CA ARG A 104 31.423 16.570 24.075 1.00 29.52 C ANISOU 852 CA ARG A 104 3879 3629 3710 273 52 -10 C ATOM 853 C ARG A 104 29.962 16.295 24.449 1.00 28.65 C ANISOU 853 C ARG A 104 3775 3499 3613 261 62 15 C ATOM 854 O ARG A 104 29.683 15.771 25.526 1.00 28.50 O ANISOU 854 O ARG A 104 3768 3468 3594 270 67 35 O ATOM 855 CB ARG A 104 31.824 18.008 24.444 1.00 30.49 C ANISOU 855 CB ARG A 104 3992 3778 3815 273 56 -14 C ATOM 856 CG ARG A 104 33.328 18.266 24.407 1.00 31.77 C ANISOU 856 CG ARG A 104 4148 3959 3965 288 47 -36 C ATOM 857 CD ARG A 104 33.710 19.576 25.088 1.00 32.52 C ANISOU 857 CD ARG A 104 4236 4075 4045 290 50 -37 C ATOM 858 NE ARG A 104 33.025 20.736 24.516 1.00 32.95 N ANISOU 858 NE ARG A 104 4280 4139 4101 269 57 -36 N ATOM 859 CZ ARG A 104 33.384 21.378 23.404 1.00 32.93 C ANISOU 859 CZ ARG A 104 4263 4150 4099 256 55 -51 C ATOM 860 NH1 ARG A 104 32.671 22.421 22.996 1.00 34.00 N ANISOU 860 NH1 ARG A 104 4391 4292 4236 238 61 -48 N ATOM 861 NH2 ARG A 104 34.445 21.000 22.692 1.00 33.25 N ANISOU 861 NH2 ARG A 104 4296 4199 4138 263 47 -70 N ATOM 0 H ARG A 104 31.855 16.996 22.186 1.00 28.97 H new ATOM 0 HA ARG A 104 31.979 15.964 24.589 1.00 29.52 H new ATOM 0 HB2 ARG A 104 31.385 18.622 23.834 1.00 30.49 H new ATOM 0 HB3 ARG A 104 31.493 18.207 25.334 1.00 30.49 H new ATOM 0 HG2 ARG A 104 33.790 17.532 24.841 1.00 31.77 H new ATOM 0 HG3 ARG A 104 33.628 18.284 23.485 1.00 31.77 H new ATOM 0 HD2 ARG A 104 33.501 19.517 26.033 1.00 32.52 H new ATOM 0 HD3 ARG A 104 34.669 19.705 25.017 1.00 32.52 H new ATOM 0 HE ARG A 104 32.332 21.028 24.933 1.00 32.95 H new ATOM 0 HH11 ARG A 104 31.985 22.676 23.448 1.00 34.00 H new ATOM 0 HH12 ARG A 104 32.895 22.841 22.280 1.00 34.00 H new ATOM 0 HH21 ARG A 104 34.916 20.327 22.947 1.00 33.25 H new ATOM 0 HH22 ARG A 104 34.658 21.429 21.978 1.00 33.25 H new ATOM 862 N VAL A 105 29.040 16.639 23.552 1.00 27.38 N ANISOU 862 N VAL A 105 3605 3335 3463 240 66 15 N ATOM 863 CA VAL A 105 27.613 16.370 23.747 1.00 27.75 C ANISOU 863 CA VAL A 105 3655 3362 3525 226 75 36 C ATOM 864 C VAL A 105 27.341 14.862 23.809 1.00 27.95 C ANISOU 864 C VAL A 105 3692 3359 3570 230 70 46 C ATOM 865 O VAL A 105 26.654 14.388 24.711 1.00 28.49 O ANISOU 865 O VAL A 105 3768 3412 3646 230 78 70 O ATOM 866 CB VAL A 105 26.774 17.011 22.621 1.00 27.59 C ANISOU 866 CB VAL A 105 3623 3346 3513 204 77 30 C ATOM 867 CG1 VAL A 105 25.335 16.511 22.640 1.00 27.75 C ANISOU 867 CG1 VAL A 105 3645 3344 3555 189 84 49 C ATOM 868 CG2 VAL A 105 26.819 18.529 22.738 1.00 27.23 C ANISOU 868 CG2 VAL A 105 3568 3325 3451 199 84 27 C ATOM 0 H VAL A 105 29.223 17.036 22.811 1.00 27.38 H new ATOM 0 HA VAL A 105 27.352 16.766 24.593 1.00 27.75 H new ATOM 0 HB VAL A 105 27.160 16.748 21.771 1.00 27.59 H new ATOM 0 HG11 VAL A 105 24.836 16.932 21.922 1.00 27.75 H new ATOM 0 HG12 VAL A 105 25.325 15.549 22.519 1.00 27.75 H new ATOM 0 HG13 VAL A 105 24.926 16.734 23.491 1.00 27.75 H new ATOM 0 HG21 VAL A 105 26.290 18.924 22.028 1.00 27.23 H new ATOM 0 HG22 VAL A 105 26.458 18.798 23.597 1.00 27.23 H new ATOM 0 HG23 VAL A 105 27.737 18.832 22.664 1.00 27.23 H new ATOM 869 N ARG A 106 27.884 14.120 22.849 1.00 28.12 N ANISOU 869 N ARG A 106 3712 3373 3600 233 57 26 N ATOM 870 CA ARG A 106 27.695 12.666 22.799 1.00 28.63 C ANISOU 870 CA ARG A 106 3787 3407 3685 237 49 31 C ATOM 871 C ARG A 106 28.331 11.976 24.015 1.00 29.27 C ANISOU 871 C ARG A 106 3882 3480 3759 258 48 44 C ATOM 872 O ARG A 106 27.780 11.005 24.536 1.00 30.49 O ANISOU 872 O ARG A 106 4048 3608 3930 258 49 64 O ATOM 873 CB ARG A 106 28.227 12.088 21.480 1.00 28.46 C ANISOU 873 CB ARG A 106 3761 3382 3672 239 32 4 C ATOM 874 CG ARG A 106 27.394 12.487 20.265 1.00 28.10 C ANISOU 874 CG ARG A 106 3703 3336 3636 219 32 -6 C ATOM 875 CD ARG A 106 27.833 11.791 18.983 1.00 27.95 C ANISOU 875 CD ARG A 106 3681 3312 3625 223 15 -33 C ATOM 876 NE ARG A 106 29.139 12.237 18.489 1.00 27.99 N ANISOU 876 NE ARG A 106 3680 3345 3610 237 10 -57 N ATOM 877 CZ ARG A 106 30.276 11.544 18.560 1.00 28.42 C ANISOU 877 CZ ARG A 106 3741 3401 3658 257 -1 -70 C ATOM 878 NH1 ARG A 106 31.390 12.068 18.060 1.00 28.26 N ANISOU 878 NH1 ARG A 106 3712 3408 3619 267 -4 -91 N ATOM 879 NH2 ARG A 106 30.321 10.344 19.138 1.00 29.04 N ANISOU 879 NH2 ARG A 106 3832 3453 3749 268 -9 -62 N ATOM 0 H ARG A 106 28.368 14.437 22.213 1.00 28.12 H new ATOM 0 HA ARG A 106 26.742 12.489 22.835 1.00 28.63 H new ATOM 0 HB2 ARG A 106 29.141 12.386 21.349 1.00 28.46 H new ATOM 0 HB3 ARG A 106 28.250 11.120 21.544 1.00 28.46 H new ATOM 0 HG2 ARG A 106 26.462 12.279 20.436 1.00 28.10 H new ATOM 0 HG3 ARG A 106 27.452 13.447 20.141 1.00 28.10 H new ATOM 0 HD2 ARG A 106 27.864 10.834 19.138 1.00 27.95 H new ATOM 0 HD3 ARG A 106 27.166 11.945 18.296 1.00 27.95 H new ATOM 0 HE ARG A 106 29.175 13.014 18.121 1.00 27.99 H new ATOM 0 HH11 ARG A 106 31.373 12.847 17.695 1.00 28.26 H new ATOM 0 HH12 ARG A 106 32.128 11.629 18.101 1.00 28.26 H new ATOM 0 HH21 ARG A 106 29.607 10.002 19.475 1.00 29.04 H new ATOM 0 HH22 ARG A 106 31.064 9.912 19.174 1.00 29.04 H new ATOM 880 N LYS A 107 29.462 12.497 24.483 1.00 29.32 N ANISOU 880 N LYS A 107 3889 3509 3743 275 46 34 N ATOM 881 CA LYS A 107 30.092 11.996 25.707 1.00 30.03 C ANISOU 881 CA LYS A 107 3993 3595 3822 297 46 46 C ATOM 882 C LYS A 107 29.163 12.164 26.914 1.00 30.78 C ANISOU 882 C LYS A 107 4095 3683 3916 294 62 79 C ATOM 883 O LYS A 107 28.978 11.235 27.700 1.00 30.90 O ANISOU 883 O LYS A 107 4124 3678 3937 304 63 99 O ATOM 884 CB LYS A 107 31.422 12.714 25.958 1.00 30.99 C ANISOU 884 CB LYS A 107 4111 3745 3920 314 41 27 C ATOM 885 CG LYS A 107 32.223 12.168 27.129 1.00 32.01 C ANISOU 885 CG LYS A 107 4254 3872 4037 340 37 34 C ATOM 886 CD LYS A 107 33.550 12.883 27.293 1.00 33.58 C ANISOU 886 CD LYS A 107 4446 4099 4214 356 30 13 C ATOM 887 CE LYS A 107 34.327 12.310 28.463 1.00 35.04 C ANISOU 887 CE LYS A 107 4646 4282 4387 383 25 19 C ATOM 888 NZ LYS A 107 35.515 13.133 28.825 1.00 37.26 N ANISOU 888 NZ LYS A 107 4920 4591 4647 399 19 0 N ATOM 0 H LYS A 107 29.884 13.145 24.106 1.00 29.32 H new ATOM 0 HA LYS A 107 30.265 11.049 25.588 1.00 30.03 H new ATOM 0 HB2 LYS A 107 31.964 12.656 25.156 1.00 30.99 H new ATOM 0 HB3 LYS A 107 31.244 13.655 26.113 1.00 30.99 H new ATOM 0 HG2 LYS A 107 31.705 12.258 27.944 1.00 32.01 H new ATOM 0 HG3 LYS A 107 32.381 11.220 26.997 1.00 32.01 H new ATOM 0 HD2 LYS A 107 34.071 12.797 26.480 1.00 33.58 H new ATOM 0 HD3 LYS A 107 33.397 13.830 27.433 1.00 33.58 H new ATOM 0 HE2 LYS A 107 33.740 12.240 29.232 1.00 35.04 H new ATOM 0 HE3 LYS A 107 34.616 11.410 28.244 1.00 35.04 H new ATOM 0 HZ1 LYS A 107 35.937 12.759 29.513 1.00 37.26 H new ATOM 0 HZ2 LYS A 107 36.067 13.180 28.129 1.00 37.26 H new ATOM 0 HZ3 LYS A 107 35.251 13.953 29.049 1.00 37.26 H new ATOM 889 N ALA A 108 28.569 13.348 27.049 1.00 30.59 N ANISOU 889 N ALA A 108 4062 3677 3883 282 73 84 N ATOM 890 CA ALA A 108 27.696 13.638 28.185 1.00 31.19 C ANISOU 890 CA ALA A 108 4143 3752 3954 282 89 113 C ATOM 891 C ALA A 108 26.381 12.862 28.129 1.00 31.53 C ANISOU 891 C ALA A 108 4189 3768 4023 265 97 137 C ATOM 892 O ALA A 108 25.916 12.363 29.153 1.00 33.40 O ANISOU 892 O ALA A 108 4436 3993 4261 272 107 165 O ATOM 893 CB ALA A 108 27.427 15.138 28.278 1.00 30.92 C ANISOU 893 CB ALA A 108 4099 3745 3906 274 97 110 C ATOM 0 H ALA A 108 28.659 13.998 26.493 1.00 30.59 H new ATOM 0 HA ALA A 108 28.162 13.345 28.984 1.00 31.19 H new ATOM 0 HB1 ALA A 108 26.847 15.317 29.035 1.00 30.92 H new ATOM 0 HB2 ALA A 108 28.266 15.611 28.395 1.00 30.92 H new ATOM 0 HB3 ALA A 108 26.997 15.441 27.463 1.00 30.92 H new ATOM 894 N ILE A 109 25.794 12.746 26.940 1.00 31.07 N ANISOU 894 N ILE A 109 4121 3700 3985 245 93 126 N ATOM 895 CA ILE A 109 24.478 12.113 26.779 1.00 31.67 C ANISOU 895 CA ILE A 109 4195 3751 4088 227 99 146 C ATOM 896 C ILE A 109 24.569 10.594 26.595 1.00 32.38 C ANISOU 896 C ILE A 109 4295 3807 4200 230 89 150 C ATOM 897 O ILE A 109 23.686 9.860 27.049 1.00 32.25 O ANISOU 897 O ILE A 109 4282 3767 4203 223 96 177 O ATOM 898 CB ILE A 109 23.708 12.718 25.582 1.00 31.45 C ANISOU 898 CB ILE A 109 4152 3726 4071 204 98 133 C ATOM 899 CG1 ILE A 109 23.488 14.225 25.779 1.00 31.84 C ANISOU 899 CG1 ILE A 109 4191 3805 4100 199 109 131 C ATOM 900 CG2 ILE A 109 22.367 12.023 25.387 1.00 31.79 C ANISOU 900 CG2 ILE A 109 4192 3743 4145 185 103 151 C ATOM 901 CD1 ILE A 109 22.768 14.594 27.061 1.00 32.33 C ANISOU 901 CD1 ILE A 109 4258 3872 4155 201 127 161 C ATOM 0 H ILE A 109 26.142 13.029 26.206 1.00 31.07 H new ATOM 0 HA ILE A 109 23.998 12.290 27.603 1.00 31.67 H new ATOM 0 HB ILE A 109 24.248 12.581 24.788 1.00 31.45 H new ATOM 0 HG12 ILE A 109 24.350 14.670 25.766 1.00 31.84 H new ATOM 0 HG13 ILE A 109 22.980 14.567 25.027 1.00 31.84 H new ATOM 0 HG21 ILE A 109 21.904 12.419 24.632 1.00 31.79 H new ATOM 0 HG22 ILE A 109 22.513 11.079 25.217 1.00 31.79 H new ATOM 0 HG23 ILE A 109 21.829 12.128 26.187 1.00 31.79 H new ATOM 0 HD11 ILE A 109 22.669 15.558 27.111 1.00 32.33 H new ATOM 0 HD12 ILE A 109 21.892 14.178 27.072 1.00 32.33 H new ATOM 0 HD13 ILE A 109 23.282 14.283 27.822 1.00 32.33 H new ATOM 902 N GLY A 110 25.618 10.133 25.914 1.00 33.09 N ANISOU 902 N GLY A 110 4387 3896 4289 241 71 124 N ATOM 903 CA GLY A 110 25.855 8.697 25.710 1.00 33.59 C ANISOU 903 CA GLY A 110 4460 3929 4373 248 58 124 C ATOM 904 C GLY A 110 25.196 8.085 24.481 1.00 34.12 C ANISOU 904 C GLY A 110 4521 3974 4470 230 47 112 C ATOM 905 O GLY A 110 25.091 6.865 24.376 1.00 33.62 O ANISOU 905 O GLY A 110 4465 3879 4429 232 37 116 O ATOM 0 H GLY A 110 26.213 10.641 25.557 1.00 33.09 H new ATOM 0 HA2 GLY A 110 26.812 8.550 25.650 1.00 33.59 H new ATOM 0 HA3 GLY A 110 25.543 8.220 26.495 1.00 33.59 H new ATOM 906 N LYS A 111 24.757 8.929 23.551 1.00 34.15 N ANISOU 906 N LYS A 111 4509 3992 4473 215 48 96 N ATOM 907 CA LYS A 111 24.164 8.480 22.294 1.00 34.34 C ANISOU 907 CA LYS A 111 4526 4000 4523 200 36 81 C ATOM 908 C LYS A 111 24.221 9.612 21.268 1.00 34.50 C ANISOU 908 C LYS A 111 4532 4048 4529 192 35 57 C ATOM 909 O LYS A 111 24.542 10.751 21.623 1.00 33.93 O ANISOU 909 O LYS A 111 4455 4004 4432 194 46 57 O ATOM 910 CB LYS A 111 22.712 8.035 22.509 1.00 35.76 C ANISOU 910 CB LYS A 111 4702 4152 4731 180 44 106 C ATOM 911 CG LYS A 111 21.800 9.102 23.099 1.00 36.32 C ANISOU 911 CG LYS A 111 4766 4241 4794 166 65 127 C ATOM 912 CD LYS A 111 20.355 8.633 23.163 1.00 37.53 C ANISOU 912 CD LYS A 111 4913 4368 4979 145 72 150 C ATOM 913 CE LYS A 111 19.478 9.662 23.860 1.00 38.83 C ANISOU 913 CE LYS A 111 5070 4551 5133 135 94 172 C ATOM 914 NZ LYS A 111 18.056 9.227 23.936 1.00 39.92 N ANISOU 914 NZ LYS A 111 5200 4665 5302 114 102 195 N ATOM 0 H LYS A 111 24.795 9.784 23.632 1.00 34.15 H new ATOM 0 HA LYS A 111 24.669 7.720 21.963 1.00 34.34 H new ATOM 0 HB2 LYS A 111 22.345 7.748 21.658 1.00 35.76 H new ATOM 0 HB3 LYS A 111 22.707 7.262 23.095 1.00 35.76 H new ATOM 0 HG2 LYS A 111 22.106 9.333 23.990 1.00 36.32 H new ATOM 0 HG3 LYS A 111 21.855 9.908 22.563 1.00 36.32 H new ATOM 0 HD2 LYS A 111 20.023 8.475 22.266 1.00 37.53 H new ATOM 0 HD3 LYS A 111 20.306 7.788 23.637 1.00 37.53 H new ATOM 0 HE2 LYS A 111 19.815 9.819 24.756 1.00 38.83 H new ATOM 0 HE3 LYS A 111 19.532 10.506 23.385 1.00 38.83 H new ATOM 0 HZ1 LYS A 111 17.576 9.852 24.349 1.00 39.92 H new ATOM 0 HZ2 LYS A 111 17.739 9.104 23.114 1.00 39.92 H new ATOM 0 HZ3 LYS A 111 18.003 8.464 24.391 1.00 39.92 H new ATOM 915 N PRO A 112 23.930 9.305 19.989 1.00 33.94 N ANISOU 915 N PRO A 112 4454 3968 4474 183 22 35 N ATOM 916 CA PRO A 112 23.808 10.392 19.020 1.00 33.81 C ANISOU 916 CA PRO A 112 4424 3977 4446 174 23 17 C ATOM 917 C PRO A 112 22.648 11.315 19.374 1.00 33.39 C ANISOU 917 C PRO A 112 4363 3930 4393 155 40 36 C ATOM 918 O PRO A 112 21.646 10.872 19.949 1.00 32.56 O ANISOU 918 O PRO A 112 4259 3804 4309 145 47 60 O ATOM 919 CB PRO A 112 23.550 9.665 17.698 1.00 33.96 C ANISOU 919 CB PRO A 112 4438 3979 4484 170 4 -6 C ATOM 920 CG PRO A 112 24.134 8.308 17.900 1.00 33.96 C ANISOU 920 CG PRO A 112 4451 3955 4499 185 -10 -8 C ATOM 921 CD PRO A 112 23.856 7.987 19.334 1.00 34.30 C ANISOU 921 CD PRO A 112 4504 3983 4547 185 3 25 C ATOM 0 HA PRO A 112 24.593 10.961 18.991 1.00 33.81 H new ATOM 0 HB2 PRO A 112 22.602 9.616 17.501 1.00 33.96 H new ATOM 0 HB3 PRO A 112 23.971 10.124 16.954 1.00 33.96 H new ATOM 0 HG2 PRO A 112 23.727 7.657 17.307 1.00 33.96 H new ATOM 0 HG3 PRO A 112 25.086 8.303 17.716 1.00 33.96 H new ATOM 0 HD2 PRO A 112 22.984 7.578 19.448 1.00 34.30 H new ATOM 0 HD3 PRO A 112 24.509 7.368 19.697 1.00 34.30 H new ATOM 922 N VAL A 113 22.800 12.589 19.035 1.00 33.07 N ANISOU 922 N VAL A 113 4313 3919 4331 152 46 26 N ATOM 923 CA VAL A 113 21.866 13.625 19.442 1.00 32.83 C ANISOU 923 CA VAL A 113 4276 3900 4297 138 61 43 C ATOM 924 C VAL A 113 21.520 14.475 18.222 1.00 32.06 C ANISOU 924 C VAL A 113 4167 3819 4197 126 58 24 C ATOM 925 O VAL A 113 22.407 14.857 17.455 1.00 31.89 O ANISOU 925 O VAL A 113 4143 3815 4160 133 50 1 O ATOM 926 CB VAL A 113 22.484 14.500 20.556 1.00 33.79 C ANISOU 926 CB VAL A 113 4401 4045 4392 148 74 54 C ATOM 927 CG1 VAL A 113 21.560 15.647 20.930 1.00 33.91 C ANISOU 927 CG1 VAL A 113 4409 4073 4400 135 88 68 C ATOM 928 CG2 VAL A 113 22.791 13.655 21.787 1.00 33.02 C ANISOU 928 CG2 VAL A 113 4317 3933 4296 161 77 74 C ATOM 0 H VAL A 113 23.455 12.877 18.558 1.00 33.07 H new ATOM 0 HA VAL A 113 21.059 13.220 19.796 1.00 32.83 H new ATOM 0 HB VAL A 113 23.311 14.875 20.215 1.00 33.79 H new ATOM 0 HG11 VAL A 113 21.971 16.179 21.629 1.00 33.91 H new ATOM 0 HG12 VAL A 113 21.403 16.203 20.151 1.00 33.91 H new ATOM 0 HG13 VAL A 113 20.715 15.292 21.249 1.00 33.91 H new ATOM 0 HG21 VAL A 113 23.178 14.217 22.477 1.00 33.02 H new ATOM 0 HG22 VAL A 113 21.972 13.255 22.118 1.00 33.02 H new ATOM 0 HG23 VAL A 113 23.419 12.955 21.551 1.00 33.02 H new ATOM 929 N ALA A 114 20.227 14.736 18.040 1.00 30.70 N ANISOU 929 N ALA A 114 3987 3639 4039 109 63 33 N ATOM 930 CA ALA A 114 19.745 15.583 16.954 1.00 29.19 C ANISOU 930 CA ALA A 114 3785 3461 3845 98 61 18 C ATOM 931 C ALA A 114 19.891 17.046 17.356 1.00 27.84 C ANISOU 931 C ALA A 114 3610 3319 3649 96 73 22 C ATOM 932 O ALA A 114 19.755 17.390 18.535 1.00 27.12 O ANISOU 932 O ALA A 114 3522 3231 3550 98 86 43 O ATOM 933 CB ALA A 114 18.292 15.264 16.630 1.00 29.36 C ANISOU 933 CB ALA A 114 3799 3462 3893 80 61 26 C ATOM 0 H ALA A 114 19.604 14.425 18.545 1.00 30.70 H new ATOM 0 HA ALA A 114 20.273 15.413 16.159 1.00 29.19 H new ATOM 0 HB1 ALA A 114 17.988 15.835 15.907 1.00 29.36 H new ATOM 0 HB2 ALA A 114 18.217 14.335 16.361 1.00 29.36 H new ATOM 0 HB3 ALA A 114 17.744 15.418 17.415 1.00 29.36 H new ATOM 934 N TYR A 115 20.163 17.895 16.366 1.00 26.94 N ANISOU 934 N TYR A 115 3490 3225 3522 94 69 4 N ATOM 935 CA TYR A 115 20.386 19.323 16.588 1.00 26.12 C ANISOU 935 CA TYR A 115 3382 3146 3395 93 78 5 C ATOM 936 C TYR A 115 19.400 20.167 15.803 1.00 25.79 C ANISOU 936 C TYR A 115 3331 3112 3356 78 80 1 C ATOM 937 O TYR A 115 19.194 19.942 14.606 1.00 25.32 O ANISOU 937 O TYR A 115 3268 3049 3303 74 70 -15 O ATOM 938 CB TYR A 115 21.798 19.718 16.154 1.00 26.61 C ANISOU 938 CB TYR A 115 3444 3230 3437 104 73 -13 C ATOM 939 CG TYR A 115 22.889 19.076 16.970 1.00 26.65 C ANISOU 939 CG TYR A 115 3458 3233 3435 121 72 -11 C ATOM 940 CD1 TYR A 115 23.179 19.525 18.251 1.00 27.01 C ANISOU 940 CD1 TYR A 115 3508 3286 3470 127 81 4 C ATOM 941 CD2 TYR A 115 23.641 18.020 16.455 1.00 27.46 C ANISOU 941 CD2 TYR A 115 3564 3327 3543 132 60 -26 C ATOM 942 CE1 TYR A 115 24.181 18.941 19.004 1.00 27.21 C ANISOU 942 CE1 TYR A 115 3540 3309 3487 144 79 5 C ATOM 943 CE2 TYR A 115 24.646 17.427 17.200 1.00 27.32 C ANISOU 943 CE2 TYR A 115 3554 3308 3519 148 58 -25 C ATOM 944 CZ TYR A 115 24.913 17.890 18.474 1.00 27.24 C ANISOU 944 CZ TYR A 115 3548 3305 3498 154 67 -9 C ATOM 945 OH TYR A 115 25.910 17.305 19.223 1.00 28.46 O ANISOU 945 OH TYR A 115 3711 3458 3645 171 64 -9 O ATOM 0 H TYR A 115 20.224 17.657 15.542 1.00 26.94 H new ATOM 0 HA TYR A 115 20.266 19.484 17.537 1.00 26.12 H new ATOM 0 HB2 TYR A 115 21.919 19.478 15.222 1.00 26.61 H new ATOM 0 HB3 TYR A 115 21.887 20.682 16.213 1.00 26.61 H new ATOM 0 HD1 TYR A 115 22.691 20.231 18.609 1.00 27.01 H new ATOM 0 HD2 TYR A 115 23.464 17.709 15.597 1.00 27.46 H new ATOM 0 HE1 TYR A 115 24.363 19.252 19.861 1.00 27.21 H new ATOM 0 HE2 TYR A 115 25.138 16.722 16.845 1.00 27.32 H new ATOM 0 HH TYR A 115 26.320 16.742 18.753 1.00 28.46 H new ATOM 946 N CYS A 116 18.815 21.155 16.474 1.00 24.82 N ANISOU 946 N CYS A 116 3206 2998 3226 72 91 15 N ATOM 947 CA CYS A 116 18.019 22.170 15.797 1.00 25.17 C ANISOU 947 CA CYS A 116 3242 3053 3267 60 92 11 C ATOM 948 C CYS A 116 18.979 23.277 15.386 1.00 24.46 C ANISOU 948 C CYS A 116 3151 2988 3154 65 91 -1 C ATOM 949 O CYS A 116 19.630 23.886 16.244 1.00 24.06 O ANISOU 949 O CYS A 116 3103 2949 3089 71 97 6 O ATOM 950 CB CYS A 116 16.940 22.725 16.719 1.00 25.09 C ANISOU 950 CB CYS A 116 3229 3042 3261 53 104 31 C ATOM 951 SG CYS A 116 15.838 23.917 15.913 1.00 27.11 S ANISOU 951 SG CYS A 116 3476 3309 3516 39 105 27 S ATOM 0 H CYS A 116 18.868 21.255 17.327 1.00 24.82 H new ATOM 0 HA CYS A 116 17.567 21.790 15.027 1.00 25.17 H new ATOM 0 HB2 CYS A 116 16.411 21.989 17.064 1.00 25.09 H new ATOM 0 HB3 CYS A 116 17.364 23.151 17.480 1.00 25.09 H new ATOM 0 HG CYS A 116 16.097 25.024 16.296 1.00 27.11 H new ATOM 952 N CYS A 117 19.055 23.530 14.081 1.00 23.80 N ANISOU 952 N CYS A 117 3063 2912 3068 61 84 -18 N ATOM 953 CA CYS A 117 19.990 24.499 13.519 1.00 24.23 C ANISOU 953 CA CYS A 117 3116 2989 3103 64 83 -29 C ATOM 954 C CYS A 117 19.238 25.717 13.019 1.00 23.49 C ANISOU 954 C CYS A 117 3017 2906 3004 54 85 -28 C ATOM 955 O CYS A 117 18.241 25.592 12.303 1.00 24.54 O ANISOU 955 O CYS A 117 3146 3031 3148 46 81 -31 O ATOM 956 CB CYS A 117 20.779 23.867 12.379 1.00 24.93 C ANISOU 956 CB CYS A 117 3203 3080 3189 71 73 -48 C ATOM 957 SG CYS A 117 21.890 22.569 12.963 1.00 26.83 S ANISOU 957 SG CYS A 117 3451 3312 3433 87 68 -51 S ATOM 0 H CYS A 117 18.562 23.141 13.494 1.00 23.80 H new ATOM 0 HA CYS A 117 20.610 24.775 14.213 1.00 24.23 H new ATOM 0 HB2 CYS A 117 20.163 23.496 11.728 1.00 24.93 H new ATOM 0 HB3 CYS A 117 21.294 24.552 11.924 1.00 24.93 H new ATOM 0 HG CYS A 117 22.500 22.116 12.034 1.00 26.83 H new ATOM 958 N GLU A 118 19.718 26.893 13.408 1.00 23.18 N ANISOU 958 N GLU A 118 2976 2882 2948 54 91 -24 N ATOM 959 CA GLU A 118 19.044 28.143 13.118 1.00 23.45 C ANISOU 959 CA GLU A 118 3006 2926 2977 44 93 -22 C ATOM 960 C GLU A 118 20.065 29.184 12.689 1.00 22.69 C ANISOU 960 C GLU A 118 2909 2850 2864 46 93 -28 C ATOM 961 O GLU A 118 21.235 29.085 13.031 1.00 23.02 O ANISOU 961 O GLU A 118 2951 2898 2898 53 93 -31 O ATOM 962 CB GLU A 118 18.298 28.629 14.367 1.00 23.62 C ANISOU 962 CB GLU A 118 3030 2945 3001 42 101 -5 C ATOM 963 CG GLU A 118 17.289 27.627 14.909 1.00 24.85 C ANISOU 963 CG GLU A 118 3186 3081 3174 40 104 5 C ATOM 964 CD GLU A 118 16.720 28.017 16.258 1.00 26.37 C ANISOU 964 CD GLU A 118 3380 3274 3366 41 113 22 C ATOM 965 OE1 GLU A 118 16.629 27.136 17.134 1.00 28.01 O ANISOU 965 OE1 GLU A 118 3591 3470 3582 46 118 33 O ATOM 966 OE2 GLU A 118 16.360 29.195 16.442 1.00 27.89 O ANISOU 966 OE2 GLU A 118 3570 3477 3550 38 116 25 O ATOM 0 H GLU A 118 20.450 26.984 13.851 1.00 23.18 H new ATOM 0 HA GLU A 118 18.406 28.006 12.400 1.00 23.45 H new ATOM 0 HB2 GLU A 118 18.945 28.832 15.061 1.00 23.62 H new ATOM 0 HB3 GLU A 118 17.838 29.457 14.157 1.00 23.62 H new ATOM 0 HG2 GLU A 118 16.562 27.534 14.273 1.00 24.85 H new ATOM 0 HG3 GLU A 118 17.714 26.758 14.983 1.00 24.85 H new ATOM 967 N LEU A 119 19.611 30.190 11.952 1.00 22.54 N ANISOU 967 N LEU A 119 2886 2839 2839 38 92 -30 N ATOM 968 CA LEU A 119 20.466 31.319 11.602 1.00 21.70 C ANISOU 968 CA LEU A 119 2777 2750 2719 37 93 -33 C ATOM 969 C LEU A 119 20.657 32.235 12.814 1.00 21.58 C ANISOU 969 C LEU A 119 2763 2739 2699 37 97 -23 C ATOM 970 O LEU A 119 19.712 32.488 13.572 1.00 22.23 O ANISOU 970 O LEU A 119 2847 2813 2785 34 99 -13 O ATOM 971 CB LEU A 119 19.866 32.095 10.424 1.00 21.72 C ANISOU 971 CB LEU A 119 2777 2758 2716 29 90 -36 C ATOM 972 CG LEU A 119 19.600 31.272 9.162 1.00 21.82 C ANISOU 972 CG LEU A 119 2789 2769 2732 30 85 -48 C ATOM 973 CD1 LEU A 119 19.167 32.170 8.009 1.00 21.90 C ANISOU 973 CD1 LEU A 119 2797 2788 2735 25 82 -51 C ATOM 974 CD2 LEU A 119 20.834 30.465 8.785 1.00 21.97 C ANISOU 974 CD2 LEU A 119 2807 2794 2747 40 83 -58 C ATOM 0 H LEU A 119 18.810 30.239 11.644 1.00 22.54 H new ATOM 0 HA LEU A 119 21.335 30.982 11.334 1.00 21.70 H new ATOM 0 HB2 LEU A 119 19.031 32.496 10.712 1.00 21.72 H new ATOM 0 HB3 LEU A 119 20.466 32.822 10.197 1.00 21.72 H new ATOM 0 HG LEU A 119 18.875 30.655 9.347 1.00 21.82 H new ATOM 0 HD11 LEU A 119 19.004 31.629 7.221 1.00 21.90 H new ATOM 0 HD12 LEU A 119 18.354 32.640 8.252 1.00 21.90 H new ATOM 0 HD13 LEU A 119 19.867 32.814 7.819 1.00 21.90 H new ATOM 0 HD21 LEU A 119 20.651 29.949 7.984 1.00 21.97 H new ATOM 0 HD22 LEU A 119 21.576 31.067 8.619 1.00 21.97 H new ATOM 0 HD23 LEU A 119 21.062 29.864 9.511 1.00 21.97 H new ATOM 975 N LYS A 120 21.883 32.703 13.010 1.00 20.99 N ANISOU 975 N LYS A 120 2686 2675 2615 41 97 -25 N ATOM 976 CA LYS A 120 22.176 33.659 14.068 1.00 20.99 C ANISOU 976 CA LYS A 120 2686 2679 2610 42 98 -18 C ATOM 977 C LYS A 120 21.931 35.058 13.514 1.00 20.90 C ANISOU 977 C LYS A 120 2672 2676 2594 32 97 -17 C ATOM 978 O LYS A 120 22.711 35.565 12.721 1.00 20.68 O ANISOU 978 O LYS A 120 2640 2658 2560 29 96 -22 O ATOM 979 CB LYS A 120 23.604 33.505 14.587 1.00 20.90 C ANISOU 979 CB LYS A 120 2673 2676 2594 50 97 -23 C ATOM 980 CG LYS A 120 23.829 34.217 15.912 1.00 21.84 C ANISOU 980 CG LYS A 120 2793 2795 2709 55 97 -17 C ATOM 981 CD LYS A 120 25.241 34.014 16.435 1.00 23.27 C ANISOU 981 CD LYS A 120 2972 2983 2886 65 95 -23 C ATOM 982 CE LYS A 120 25.387 34.608 17.822 1.00 24.73 C ANISOU 982 CE LYS A 120 3160 3169 3068 73 92 -19 C ATOM 983 NZ LYS A 120 25.088 36.068 17.830 1.00 25.52 N ANISOU 983 NZ LYS A 120 3257 3272 3166 65 90 -17 N ATOM 0 H LYS A 120 22.565 32.477 12.537 1.00 20.99 H new ATOM 0 HA LYS A 120 21.596 33.497 14.828 1.00 20.99 H new ATOM 0 HB2 LYS A 120 23.805 32.562 14.693 1.00 20.90 H new ATOM 0 HB3 LYS A 120 24.223 33.855 13.927 1.00 20.90 H new ATOM 0 HG2 LYS A 120 23.659 35.166 15.801 1.00 21.84 H new ATOM 0 HG3 LYS A 120 23.192 33.889 16.566 1.00 21.84 H new ATOM 0 HD2 LYS A 120 25.449 33.067 16.460 1.00 23.27 H new ATOM 0 HD3 LYS A 120 25.877 34.428 15.832 1.00 23.27 H new ATOM 0 HE2 LYS A 120 24.789 34.152 18.434 1.00 24.73 H new ATOM 0 HE3 LYS A 120 26.290 34.460 18.144 1.00 24.73 H new ATOM 0 HZ1 LYS A 120 25.772 36.509 18.190 1.00 25.52 H new ATOM 0 HZ2 LYS A 120 24.960 36.350 16.996 1.00 25.52 H new ATOM 0 HZ3 LYS A 120 24.353 36.218 18.310 1.00 25.52 H new ATOM 984 N ILE A 121 20.818 35.658 13.918 1.00 20.96 N ANISOU 984 N ILE A 121 2682 2677 2604 28 97 -10 N ATOM 985 CA ILE A 121 20.374 36.934 13.363 1.00 20.93 C ANISOU 985 CA ILE A 121 2677 2678 2597 19 95 -9 C ATOM 986 C ILE A 121 21.186 38.058 13.996 1.00 21.51 C ANISOU 986 C ILE A 121 2749 2759 2666 20 92 -7 C ATOM 987 O ILE A 121 21.283 38.145 15.220 1.00 21.12 O ANISOU 987 O ILE A 121 2702 2707 2616 27 92 -4 O ATOM 988 CB ILE A 121 18.878 37.181 13.653 1.00 20.58 C ANISOU 988 CB ILE A 121 2636 2627 2558 17 95 -3 C ATOM 989 CG1 ILE A 121 18.022 35.976 13.235 1.00 20.97 C ANISOU 989 CG1 ILE A 121 2686 2667 2616 16 97 -4 C ATOM 990 CG2 ILE A 121 18.412 38.458 12.972 1.00 20.41 C ANISOU 990 CG2 ILE A 121 2613 2608 2532 9 91 -2 C ATOM 991 CD1 ILE A 121 18.138 35.603 11.767 1.00 21.78 C ANISOU 991 CD1 ILE A 121 2787 2772 2718 12 94 -13 C ATOM 0 H ILE A 121 20.297 35.338 14.523 1.00 20.96 H new ATOM 0 HA ILE A 121 20.503 36.911 12.402 1.00 20.93 H new ATOM 0 HB ILE A 121 18.767 37.291 14.610 1.00 20.58 H new ATOM 0 HG12 ILE A 121 18.276 35.210 13.773 1.00 20.97 H new ATOM 0 HG13 ILE A 121 17.093 36.168 13.436 1.00 20.97 H new ATOM 0 HG21 ILE A 121 17.472 38.602 13.162 1.00 20.41 H new ATOM 0 HG22 ILE A 121 18.927 39.209 13.305 1.00 20.41 H new ATOM 0 HG23 ILE A 121 18.540 38.379 12.014 1.00 20.41 H new ATOM 0 HD11 ILE A 121 17.572 34.838 11.582 1.00 21.78 H new ATOM 0 HD12 ILE A 121 17.857 36.353 11.219 1.00 21.78 H new ATOM 0 HD13 ILE A 121 19.059 35.380 11.561 1.00 21.78 H new ATOM 992 N ASP A 122 21.772 38.917 13.169 1.00 22.19 N ANISOU 992 N ASP A 122 2831 2852 2747 13 90 -9 N ATOM 993 CA ASP A 122 22.666 39.958 13.678 1.00 23.89 C ANISOU 993 CA ASP A 122 3043 3072 2961 12 86 -8 C ATOM 994 C ASP A 122 21.937 41.298 13.784 1.00 24.92 C ANISOU 994 C ASP A 122 3177 3200 3093 6 82 -3 C ATOM 995 O ASP A 122 21.933 42.085 12.847 1.00 25.77 O ANISOU 995 O ASP A 122 3283 3311 3200 -3 80 -1 O ATOM 996 CB ASP A 122 23.910 40.069 12.784 1.00 24.89 C ANISOU 996 CB ASP A 122 3163 3210 3086 7 88 -11 C ATOM 997 CG ASP A 122 25.103 40.691 13.499 1.00 25.91 C ANISOU 997 CG ASP A 122 3286 3343 3216 9 84 -13 C ATOM 998 OD1 ASP A 122 26.139 40.902 12.842 1.00 28.69 O ANISOU 998 OD1 ASP A 122 3630 3705 3567 4 85 -14 O ATOM 999 OD2 ASP A 122 25.019 40.978 14.706 1.00 26.78 O ANISOU 999 OD2 ASP A 122 3399 3449 3329 15 79 -13 O ATOM 0 H ASP A 122 21.668 38.917 12.315 1.00 22.19 H new ATOM 0 HA ASP A 122 22.954 39.712 14.571 1.00 23.89 H new ATOM 0 HB2 ASP A 122 24.154 39.185 12.467 1.00 24.89 H new ATOM 0 HB3 ASP A 122 23.694 40.601 12.002 1.00 24.89 H new ATOM 1000 N GLY A 123 21.321 41.541 14.937 1.00 24.89 N ANISOU 1000 N GLY A 123 3176 3190 3090 12 79 -1 N ATOM 1001 CA GLY A 123 20.576 42.778 15.190 1.00 24.92 C ANISOU 1001 CA GLY A 123 3183 3190 3094 10 73 2 C ATOM 1002 C GLY A 123 20.698 43.193 16.644 1.00 25.85 C ANISOU 1002 C GLY A 123 3303 3307 3211 20 68 1 C ATOM 1003 O GLY A 123 21.788 43.151 17.207 1.00 28.08 O ANISOU 1003 O GLY A 123 3583 3593 3494 25 66 -3 O ATOM 0 H GLY A 123 21.322 40.992 15.599 1.00 24.89 H new ATOM 0 HA2 GLY A 123 20.912 43.486 14.618 1.00 24.92 H new ATOM 0 HA3 GLY A 123 19.642 42.650 14.963 1.00 24.92 H new ATOM 1004 N LEU A 124 19.581 43.593 17.248 1.00 24.92 N ANISOU 1004 N LEU A 124 3189 3186 3093 25 66 3 N ATOM 1005 CA LEU A 124 19.521 43.904 18.676 1.00 25.12 C ANISOU 1005 CA LEU A 124 3218 3212 3116 38 62 2 C ATOM 1006 C LEU A 124 18.736 42.791 19.377 1.00 23.89 C ANISOU 1006 C LEU A 124 3065 3056 2958 48 71 7 C ATOM 1007 O LEU A 124 17.590 42.532 19.025 1.00 23.44 O ANISOU 1007 O LEU A 124 3009 2996 2903 44 76 12 O ATOM 1008 CB LEU A 124 18.840 45.258 18.881 1.00 26.24 C ANISOU 1008 CB LEU A 124 3363 3351 3258 38 53 2 C ATOM 1009 CG LEU A 124 18.887 45.910 20.265 1.00 28.18 C ANISOU 1009 CG LEU A 124 3611 3598 3499 53 45 -2 C ATOM 1010 CD1 LEU A 124 20.301 46.373 20.579 1.00 29.20 C ANISOU 1010 CD1 LEU A 124 3736 3727 3631 54 36 -9 C ATOM 1011 CD2 LEU A 124 17.915 47.078 20.336 1.00 29.59 C ANISOU 1011 CD2 LEU A 124 3792 3773 3677 54 36 -3 C ATOM 0 H LEU A 124 18.831 43.692 16.838 1.00 24.92 H new ATOM 0 HA LEU A 124 20.414 43.957 19.051 1.00 25.12 H new ATOM 0 HB2 LEU A 124 19.232 45.882 18.250 1.00 26.24 H new ATOM 0 HB3 LEU A 124 17.907 45.156 18.637 1.00 26.24 H new ATOM 0 HG LEU A 124 18.622 45.253 20.927 1.00 28.18 H new ATOM 0 HD11 LEU A 124 20.320 46.784 21.457 1.00 29.20 H new ATOM 0 HD12 LEU A 124 20.901 45.611 20.566 1.00 29.20 H new ATOM 0 HD13 LEU A 124 20.585 47.019 19.914 1.00 29.20 H new ATOM 0 HD21 LEU A 124 17.956 47.480 21.218 1.00 29.59 H new ATOM 0 HD22 LEU A 124 18.154 47.739 19.668 1.00 29.59 H new ATOM 0 HD23 LEU A 124 17.014 46.760 20.168 1.00 29.59 H new ATOM 1012 N ALA A 125 19.357 42.118 20.343 1.00 22.91 N ANISOU 1012 N ALA A 125 2942 2933 2830 60 73 7 N ATOM 1013 CA ALA A 125 18.654 41.096 21.113 1.00 22.49 C ANISOU 1013 CA ALA A 125 2892 2879 2775 70 83 14 C ATOM 1014 C ALA A 125 17.555 41.742 21.953 1.00 22.01 C ANISOU 1014 C ALA A 125 2834 2820 2710 78 82 18 C ATOM 1015 O ALA A 125 17.767 42.789 22.570 1.00 22.31 O ANISOU 1015 O ALA A 125 2873 2862 2743 86 73 13 O ATOM 1016 CB ALA A 125 19.616 40.323 22.004 1.00 23.01 C ANISOU 1016 CB ALA A 125 2959 2947 2836 82 84 14 C ATOM 0 H ALA A 125 20.179 42.237 20.567 1.00 22.91 H new ATOM 0 HA ALA A 125 18.252 40.468 20.492 1.00 22.49 H new ATOM 0 HB1 ALA A 125 19.126 39.652 22.504 1.00 23.01 H new ATOM 0 HB2 ALA A 125 20.289 39.890 21.455 1.00 23.01 H new ATOM 0 HB3 ALA A 125 20.048 40.934 22.621 1.00 23.01 H new ATOM 1017 N ILE A 126 16.390 41.102 21.973 1.00 21.47 N ANISOU 1017 N ILE A 126 2765 2750 2644 77 91 26 N ATOM 1018 CA ILE A 126 15.232 41.615 22.692 1.00 21.86 C ANISOU 1018 CA ILE A 126 2815 2802 2688 85 93 31 C ATOM 1019 C ILE A 126 14.547 40.525 23.512 1.00 22.31 C ANISOU 1019 C ILE A 126 2871 2860 2744 94 106 43 C ATOM 1020 O ILE A 126 14.672 39.334 23.216 1.00 22.22 O ANISOU 1020 O ILE A 126 2860 2843 2740 89 114 48 O ATOM 1021 CB ILE A 126 14.212 42.265 21.730 1.00 21.46 C ANISOU 1021 CB ILE A 126 2762 2750 2644 73 91 30 C ATOM 1022 CG1 ILE A 126 13.850 41.315 20.582 1.00 21.99 C ANISOU 1022 CG1 ILE A 126 2824 2810 2720 59 97 32 C ATOM 1023 CG2 ILE A 126 14.788 43.566 21.180 1.00 21.49 C ANISOU 1023 CG2 ILE A 126 2766 2753 2646 68 77 20 C ATOM 1024 CD1 ILE A 126 12.605 41.718 19.807 1.00 21.10 C ANISOU 1024 CD1 ILE A 126 2709 2695 2613 50 96 32 C ATOM 0 H ILE A 126 16.250 40.356 21.568 1.00 21.47 H new ATOM 0 HA ILE A 126 15.562 42.294 23.301 1.00 21.86 H new ATOM 0 HB ILE A 126 13.399 42.455 22.224 1.00 21.46 H new ATOM 0 HG12 ILE A 126 14.599 41.266 19.968 1.00 21.99 H new ATOM 0 HG13 ILE A 126 13.720 40.424 20.942 1.00 21.99 H new ATOM 0 HG21 ILE A 126 14.148 43.974 20.576 1.00 21.49 H new ATOM 0 HG22 ILE A 126 14.973 44.174 21.913 1.00 21.49 H new ATOM 0 HG23 ILE A 126 15.610 43.379 20.700 1.00 21.49 H new ATOM 0 HD11 ILE A 126 12.440 41.073 19.101 1.00 21.10 H new ATOM 0 HD12 ILE A 126 11.843 41.741 20.407 1.00 21.10 H new ATOM 0 HD13 ILE A 126 12.736 42.597 19.418 1.00 21.10 H new ATOM 1025 N SER A 127 13.829 40.954 24.545 1.00 22.24 N ANISOU 1025 N SER A 127 2864 2859 2728 108 108 47 N ATOM 1026 CA SER A 127 12.976 40.072 25.337 1.00 23.50 C ANISOU 1026 CA SER A 127 3022 3020 2886 116 123 62 C ATOM 1027 C SER A 127 11.579 40.687 25.402 1.00 23.69 C ANISOU 1027 C SER A 127 3041 3049 2909 116 125 65 C ATOM 1028 O SER A 127 11.436 41.880 25.700 1.00 23.60 O ANISOU 1028 O SER A 127 3031 3044 2890 124 116 57 O ATOM 1029 CB SER A 127 13.551 39.886 26.742 1.00 24.55 C ANISOU 1029 CB SER A 127 3161 3161 3006 137 125 66 C ATOM 1030 OG SER A 127 12.933 38.802 27.402 1.00 25.92 O ANISOU 1030 OG SER A 127 3334 3335 3179 143 140 82 O ATOM 0 H SER A 127 13.823 41.773 24.809 1.00 22.24 H new ATOM 0 HA SER A 127 12.931 39.196 24.922 1.00 23.50 H new ATOM 0 HB2 SER A 127 14.507 39.732 26.686 1.00 24.55 H new ATOM 0 HB3 SER A 127 13.424 40.698 27.257 1.00 24.55 H new ATOM 0 HG SER A 127 12.312 39.088 27.889 1.00 25.92 H new ATOM 1031 N LEU A 128 10.564 39.881 25.098 1.00 23.72 N ANISOU 1031 N LEU A 128 3039 3049 2924 108 137 75 N ATOM 1032 CA LEU A 128 9.177 40.338 25.058 1.00 24.55 C ANISOU 1032 CA LEU A 128 3137 3158 3031 106 140 78 C ATOM 1033 C LEU A 128 8.352 39.604 26.110 1.00 25.73 C ANISOU 1033 C LEU A 128 3282 3314 3178 117 157 95 C ATOM 1034 O LEU A 128 8.198 38.391 26.039 1.00 25.78 O ANISOU 1034 O LEU A 128 3286 3313 3196 110 168 107 O ATOM 1035 CB LEU A 128 8.580 40.088 23.678 1.00 24.06 C ANISOU 1035 CB LEU A 128 3069 3087 2985 86 139 75 C ATOM 1036 CG LEU A 128 9.375 40.642 22.499 1.00 23.82 C ANISOU 1036 CG LEU A 128 3043 3051 2957 75 125 61 C ATOM 1037 CD1 LEU A 128 8.739 40.194 21.192 1.00 23.62 C ANISOU 1037 CD1 LEU A 128 3012 3017 2947 58 125 59 C ATOM 1038 CD2 LEU A 128 9.467 42.159 22.593 1.00 23.10 C ANISOU 1038 CD2 LEU A 128 2955 2965 2856 81 113 51 C ATOM 0 H LEU A 128 10.662 39.048 24.908 1.00 23.72 H new ATOM 0 HA LEU A 128 9.160 41.290 25.245 1.00 24.55 H new ATOM 0 HB2 LEU A 128 8.479 39.131 23.557 1.00 24.06 H new ATOM 0 HB3 LEU A 128 7.690 40.472 23.655 1.00 24.06 H new ATOM 0 HG LEU A 128 10.280 40.293 22.525 1.00 23.82 H new ATOM 0 HD11 LEU A 128 9.248 40.549 20.446 1.00 23.62 H new ATOM 0 HD12 LEU A 128 8.736 39.225 21.149 1.00 23.62 H new ATOM 0 HD13 LEU A 128 7.827 40.522 21.146 1.00 23.62 H new ATOM 0 HD21 LEU A 128 9.974 42.500 21.839 1.00 23.10 H new ATOM 0 HD22 LEU A 128 8.575 42.539 22.580 1.00 23.10 H new ATOM 0 HD23 LEU A 128 9.911 42.406 23.419 1.00 23.10 H new ATOM 1039 N ARG A 129 7.817 40.351 27.073 1.00 27.69 N ANISOU 1039 N ARG A 129 3531 3577 3414 133 158 97 N ATOM 1040 CA ARG A 129 7.043 39.770 28.169 1.00 29.21 C ANISOU 1040 CA ARG A 129 3719 3778 3601 146 175 115 C ATOM 1041 C ARG A 129 5.549 39.822 27.886 1.00 29.25 C ANISOU 1041 C ARG A 129 3712 3787 3616 139 183 121 C ATOM 1042 O ARG A 129 5.013 40.875 27.536 1.00 28.30 O ANISOU 1042 O ARG A 129 3588 3671 3493 139 174 110 O ATOM 1043 CB ARG A 129 7.341 40.513 29.470 1.00 30.78 C ANISOU 1043 CB ARG A 129 3925 3994 3778 172 173 113 C ATOM 1044 CG ARG A 129 6.655 39.938 30.700 1.00 32.75 C ANISOU 1044 CG ARG A 129 4170 4256 4017 189 191 133 C ATOM 1045 CD ARG A 129 7.118 40.661 31.950 1.00 34.37 C ANISOU 1045 CD ARG A 129 4383 4477 4198 218 186 129 C ATOM 1046 NE ARG A 129 8.527 40.399 32.234 1.00 35.72 N ANISOU 1046 NE ARG A 129 4565 4643 4362 224 178 123 N ATOM 1047 CZ ARG A 129 9.267 41.071 33.117 1.00 36.94 C ANISOU 1047 CZ ARG A 129 4729 4809 4499 247 168 114 C ATOM 1048 NH1 ARG A 129 10.536 40.737 33.295 1.00 37.32 N ANISOU 1048 NH1 ARG A 129 4786 4851 4544 251 161 109 N ATOM 1049 NH2 ARG A 129 8.753 42.076 33.821 1.00 37.75 N ANISOU 1049 NH2 ARG A 129 4831 4927 4586 267 163 107 N ATOM 0 H ARG A 129 7.892 41.207 27.110 1.00 27.69 H new ATOM 0 HA ARG A 129 7.304 38.840 28.254 1.00 29.21 H new ATOM 0 HB2 ARG A 129 8.300 40.510 29.618 1.00 30.78 H new ATOM 0 HB3 ARG A 129 7.073 41.440 29.368 1.00 30.78 H new ATOM 0 HG2 ARG A 129 5.693 40.021 30.609 1.00 32.75 H new ATOM 0 HG3 ARG A 129 6.853 38.991 30.775 1.00 32.75 H new ATOM 0 HD2 ARG A 129 6.981 41.615 31.842 1.00 34.37 H new ATOM 0 HD3 ARG A 129 6.578 40.381 32.705 1.00 34.37 H new ATOM 0 HE ARG A 129 8.908 39.763 31.799 1.00 35.72 H new ATOM 0 HH11 ARG A 129 10.878 40.090 32.843 1.00 37.32 H new ATOM 0 HH12 ARG A 129 11.018 41.167 33.863 1.00 37.32 H new ATOM 0 HH21 ARG A 129 7.931 42.302 33.710 1.00 37.75 H new ATOM 0 HH22 ARG A 129 9.243 42.500 34.387 1.00 37.75 H new ATOM 1050 N TYR A 130 4.883 38.681 28.046 1.00 29.47 N ANISOU 1050 N TYR A 130 3731 3810 3655 133 200 139 N ATOM 1051 CA TYR A 130 3.439 38.604 27.878 1.00 30.14 C ANISOU 1051 CA TYR A 130 3802 3900 3751 126 209 147 C ATOM 1052 C TYR A 130 2.810 38.116 29.175 1.00 31.43 C ANISOU 1052 C TYR A 130 3959 4075 3906 141 229 168 C ATOM 1053 O TYR A 130 3.330 37.205 29.814 1.00 30.55 O ANISOU 1053 O TYR A 130 3853 3962 3794 146 239 183 O ATOM 1054 CB TYR A 130 3.080 37.701 26.694 1.00 29.98 C ANISOU 1054 CB TYR A 130 3774 3861 3756 101 210 148 C ATOM 1055 CG TYR A 130 3.468 38.322 25.369 1.00 28.72 C ANISOU 1055 CG TYR A 130 3618 3691 3602 88 192 127 C ATOM 1056 CD1 TYR A 130 2.510 38.893 24.535 1.00 28.44 C ANISOU 1056 CD1 TYR A 130 3574 3656 3575 79 185 118 C ATOM 1057 CD2 TYR A 130 4.802 38.374 24.969 1.00 28.42 C ANISOU 1057 CD2 TYR A 130 3592 3647 3560 87 181 116 C ATOM 1058 CE1 TYR A 130 2.868 39.481 23.334 1.00 27.82 C ANISOU 1058 CE1 TYR A 130 3500 3570 3499 69 169 100 C ATOM 1059 CE2 TYR A 130 5.169 38.967 23.778 1.00 28.10 C ANISOU 1059 CE2 TYR A 130 3554 3599 3522 76 165 99 C ATOM 1060 CZ TYR A 130 4.201 39.519 22.962 1.00 27.32 C ANISOU 1060 CZ TYR A 130 3448 3500 3430 68 160 92 C ATOM 1061 OH TYR A 130 4.567 40.105 21.778 1.00 25.45 O ANISOU 1061 OH TYR A 130 3216 3258 3196 58 145 77 O ATOM 0 H TYR A 130 5.255 37.934 28.254 1.00 29.47 H new ATOM 0 HA TYR A 130 3.085 39.485 27.678 1.00 30.14 H new ATOM 0 HB2 TYR A 130 3.528 36.846 26.793 1.00 29.98 H new ATOM 0 HB3 TYR A 130 2.126 37.524 26.701 1.00 29.98 H new ATOM 0 HD1 TYR A 130 1.615 38.879 24.789 1.00 28.44 H new ATOM 0 HD2 TYR A 130 5.457 38.002 25.515 1.00 28.42 H new ATOM 0 HE1 TYR A 130 2.217 39.848 22.780 1.00 27.82 H new ATOM 0 HE2 TYR A 130 6.064 38.995 23.526 1.00 28.10 H new ATOM 0 HH TYR A 130 3.887 40.423 21.401 1.00 25.45 H new ATOM 1062 N GLU A 131 1.718 38.767 29.574 1.00 34.07 N ANISOU 1062 N GLU A 131 4285 4426 4235 149 234 170 N ATOM 1063 CA GLU A 131 0.948 38.378 30.757 1.00 36.19 C ANISOU 1063 CA GLU A 131 4545 4710 4496 164 255 192 C ATOM 1064 C GLU A 131 -0.461 38.035 30.313 1.00 36.86 C ANISOU 1064 C GLU A 131 4611 4794 4601 149 266 201 C ATOM 1065 O GLU A 131 -1.165 38.882 29.758 1.00 36.78 O ANISOU 1065 O GLU A 131 4593 4788 4593 146 257 188 O ATOM 1066 CB GLU A 131 0.934 39.502 31.791 1.00 38.54 C ANISOU 1066 CB GLU A 131 4848 5031 4766 192 252 186 C ATOM 1067 CG GLU A 131 2.263 39.653 32.516 1.00 40.79 C ANISOU 1067 CG GLU A 131 5150 5318 5031 210 245 182 C ATOM 1068 CD GLU A 131 2.312 40.824 33.482 1.00 43.42 C ANISOU 1068 CD GLU A 131 5489 5673 5337 239 237 172 C ATOM 1069 OE1 GLU A 131 1.448 41.728 33.405 1.00 46.48 O ANISOU 1069 OE1 GLU A 131 5869 6072 5721 244 233 163 O ATOM 1070 OE2 GLU A 131 3.240 40.844 34.317 1.00 45.70 O ANISOU 1070 OE2 GLU A 131 5790 5968 5608 258 234 171 O ATOM 0 H GLU A 131 1.400 39.452 29.163 1.00 34.07 H new ATOM 0 HA GLU A 131 1.358 37.607 31.179 1.00 36.19 H new ATOM 0 HB2 GLU A 131 0.714 40.338 31.351 1.00 38.54 H new ATOM 0 HB3 GLU A 131 0.234 39.330 32.440 1.00 38.54 H new ATOM 0 HG2 GLU A 131 2.449 38.836 33.004 1.00 40.79 H new ATOM 0 HG3 GLU A 131 2.969 39.758 31.859 1.00 40.79 H new ATOM 1071 N ASN A 132 -0.856 36.782 30.535 1.00 37.69 N ANISOU 1071 N ASN A 132 4706 4891 4721 139 284 224 N ATOM 1072 CA ASN A 132 -2.143 36.269 30.073 1.00 39.05 C ANISOU 1072 CA ASN A 132 4858 5059 4918 122 295 233 C ATOM 1073 C ASN A 132 -2.393 36.601 28.595 1.00 37.79 C ANISOU 1073 C ASN A 132 4695 4886 4777 102 277 212 C ATOM 1074 O ASN A 132 -3.494 36.999 28.201 1.00 38.61 O ANISOU 1074 O ASN A 132 4784 4995 4890 96 276 207 O ATOM 1075 CB ASN A 132 -3.279 36.787 30.969 1.00 41.48 C ANISOU 1075 CB ASN A 132 5153 5393 5215 138 309 244 C ATOM 1076 CG ASN A 132 -3.046 36.500 32.450 1.00 43.42 C ANISOU 1076 CG ASN A 132 5403 5655 5438 161 328 266 C ATOM 1077 OD1 ASN A 132 -3.452 37.283 33.312 1.00 46.62 O ANISOU 1077 OD1 ASN A 132 5807 6086 5822 184 333 267 O ATOM 1078 ND2 ASN A 132 -2.395 35.376 32.753 1.00 44.67 N ANISOU 1078 ND2 ASN A 132 5568 5801 5603 157 337 283 N ATOM 0 H ASN A 132 -0.382 36.204 30.960 1.00 37.69 H new ATOM 0 HA ASN A 132 -2.121 35.302 30.141 1.00 39.05 H new ATOM 0 HB2 ASN A 132 -3.375 37.744 30.841 1.00 41.48 H new ATOM 0 HB3 ASN A 132 -4.114 36.379 30.693 1.00 41.48 H new ATOM 0 HD21 ASN A 132 -2.244 35.175 33.575 1.00 44.67 H new ATOM 0 HD22 ASN A 132 -2.126 34.853 32.126 1.00 44.67 H new ATOM 1079 N GLY A 133 -1.350 36.438 27.785 1.00 35.60 N ANISOU 1079 N GLY A 133 4431 4592 4505 92 262 198 N ATOM 1080 CA GLY A 133 -1.437 36.630 26.340 1.00 35.15 C ANISOU 1080 CA GLY A 133 4372 4521 4464 74 245 179 C ATOM 1081 C GLY A 133 -1.300 38.060 25.838 1.00 33.88 C ANISOU 1081 C GLY A 133 4218 4367 4288 80 226 156 C ATOM 1082 O GLY A 133 -1.437 38.291 24.642 1.00 33.98 O ANISOU 1082 O GLY A 133 4229 4369 4311 67 213 140 O ATOM 0 H GLY A 133 -0.567 36.212 28.060 1.00 35.60 H new ATOM 0 HA2 GLY A 133 -0.747 36.093 25.920 1.00 35.15 H new ATOM 0 HA3 GLY A 133 -2.291 36.282 26.038 1.00 35.15 H new ATOM 1083 N VAL A 134 -1.026 39.013 26.730 1.00 33.19 N ANISOU 1083 N VAL A 134 4139 4297 4176 101 225 153 N ATOM 1084 CA VAL A 134 -0.949 40.431 26.354 1.00 32.80 C ANISOU 1084 CA VAL A 134 4095 4254 4113 109 207 133 C ATOM 1085 C VAL A 134 0.465 40.993 26.516 1.00 31.40 C ANISOU 1085 C VAL A 134 3936 4074 3919 118 194 122 C ATOM 1086 O VAL A 134 1.099 40.803 27.554 1.00 30.10 O ANISOU 1086 O VAL A 134 3779 3917 3740 133 200 130 O ATOM 1087 CB VAL A 134 -1.905 41.290 27.204 1.00 33.35 C ANISOU 1087 CB VAL A 134 4158 4346 4169 127 212 134 C ATOM 1088 CG1 VAL A 134 -1.837 42.752 26.773 1.00 33.22 C ANISOU 1088 CG1 VAL A 134 4148 4333 4141 134 191 113 C ATOM 1089 CG2 VAL A 134 -3.328 40.759 27.098 1.00 34.02 C ANISOU 1089 CG2 VAL A 134 4221 4434 4271 118 225 145 C ATOM 0 H VAL A 134 -0.880 38.860 27.564 1.00 33.19 H new ATOM 0 HA VAL A 134 -1.206 40.472 25.420 1.00 32.80 H new ATOM 0 HB VAL A 134 -1.628 41.237 28.132 1.00 33.35 H new ATOM 0 HG11 VAL A 134 -2.444 43.278 27.317 1.00 33.22 H new ATOM 0 HG12 VAL A 134 -0.932 43.082 26.888 1.00 33.22 H new ATOM 0 HG13 VAL A 134 -2.092 42.827 25.840 1.00 33.22 H new ATOM 0 HG21 VAL A 134 -3.919 41.308 27.637 1.00 34.02 H new ATOM 0 HG22 VAL A 134 -3.616 40.787 26.172 1.00 34.02 H new ATOM 0 HG23 VAL A 134 -3.357 39.844 27.417 1.00 34.02 H new ATOM 1090 N PHE A 135 0.938 41.707 25.495 1.00 30.35 N ANISOU 1090 N PHE A 135 3811 3933 3788 110 175 104 N ATOM 1091 CA PHE A 135 2.268 42.330 25.523 1.00 29.31 C ANISOU 1091 CA PHE A 135 3695 3799 3643 116 162 93 C ATOM 1092 C PHE A 135 2.356 43.407 26.609 1.00 29.00 C ANISOU 1092 C PHE A 135 3661 3775 3582 139 157 89 C ATOM 1093 O PHE A 135 1.655 44.415 26.539 1.00 29.23 O ANISOU 1093 O PHE A 135 3687 3812 3607 146 149 80 O ATOM 1094 CB PHE A 135 2.580 42.934 24.145 1.00 28.86 C ANISOU 1094 CB PHE A 135 3642 3730 3593 101 145 77 C ATOM 1095 CG PHE A 135 3.950 43.558 24.030 1.00 28.69 C ANISOU 1095 CG PHE A 135 3634 3705 3562 104 131 66 C ATOM 1096 CD1 PHE A 135 4.095 44.868 23.585 1.00 28.73 C ANISOU 1096 CD1 PHE A 135 3644 3709 3560 105 114 52 C ATOM 1097 CD2 PHE A 135 5.094 42.836 24.346 1.00 28.19 C ANISOU 1097 CD2 PHE A 135 3577 3636 3496 104 134 70 C ATOM 1098 CE1 PHE A 135 5.350 45.447 23.468 1.00 28.69 C ANISOU 1098 CE1 PHE A 135 3650 3700 3550 106 102 43 C ATOM 1099 CE2 PHE A 135 6.349 43.410 24.227 1.00 27.81 C ANISOU 1099 CE2 PHE A 135 3540 3586 3442 106 122 61 C ATOM 1100 CZ PHE A 135 6.480 44.713 23.786 1.00 28.14 C ANISOU 1100 CZ PHE A 135 3585 3627 3479 106 106 47 C ATOM 0 H PHE A 135 0.501 41.845 24.768 1.00 30.35 H new ATOM 0 HA PHE A 135 2.924 41.647 25.733 1.00 29.31 H new ATOM 0 HB2 PHE A 135 2.496 42.239 23.474 1.00 28.86 H new ATOM 0 HB3 PHE A 135 1.912 43.607 23.941 1.00 28.86 H new ATOM 0 HD1 PHE A 135 3.340 45.363 23.363 1.00 28.73 H new ATOM 0 HD2 PHE A 135 5.016 41.957 24.641 1.00 28.19 H new ATOM 0 HE1 PHE A 135 5.432 46.326 23.177 1.00 28.69 H new ATOM 0 HE2 PHE A 135 7.107 42.916 24.445 1.00 27.81 H new ATOM 0 HZ PHE A 135 7.324 45.095 23.703 1.00 28.14 H new ATOM 1101 N VAL A 136 3.223 43.194 27.600 1.00 28.24 N ANISOU 1101 N VAL A 136 3573 3685 3473 154 160 93 N ATOM 1102 CA VAL A 136 3.357 44.121 28.734 1.00 28.77 C ANISOU 1102 CA VAL A 136 3646 3768 3519 179 155 89 C ATOM 1103 C VAL A 136 4.748 44.743 28.910 1.00 28.26 C ANISOU 1103 C VAL A 136 3595 3699 3445 187 139 76 C ATOM 1104 O VAL A 136 4.861 45.824 29.485 1.00 29.32 O ANISOU 1104 O VAL A 136 3734 3842 3565 204 127 65 O ATOM 1105 CB VAL A 136 2.938 43.449 30.062 1.00 29.22 C ANISOU 1105 CB VAL A 136 3698 3840 3565 197 175 107 C ATOM 1106 CG1 VAL A 136 1.479 43.022 29.998 1.00 29.58 C ANISOU 1106 CG1 VAL A 136 3727 3891 3619 192 191 120 C ATOM 1107 CG2 VAL A 136 3.838 42.266 30.378 1.00 29.81 C ANISOU 1107 CG2 VAL A 136 3777 3907 3641 195 185 119 C ATOM 0 H VAL A 136 3.748 42.514 27.637 1.00 28.24 H new ATOM 0 HA VAL A 136 2.756 44.849 28.510 1.00 28.77 H new ATOM 0 HB VAL A 136 3.037 44.095 30.779 1.00 29.22 H new ATOM 0 HG11 VAL A 136 1.227 42.602 30.835 1.00 29.58 H new ATOM 0 HG12 VAL A 136 0.920 43.800 29.846 1.00 29.58 H new ATOM 0 HG13 VAL A 136 1.358 42.391 29.271 1.00 29.58 H new ATOM 0 HG21 VAL A 136 3.558 41.860 31.213 1.00 29.81 H new ATOM 0 HG22 VAL A 136 3.776 41.612 29.664 1.00 29.81 H new ATOM 0 HG23 VAL A 136 4.756 42.570 30.458 1.00 29.81 H new ATOM 1108 N ARG A 137 5.806 44.078 28.440 1.00 27.69 N ANISOU 1108 N ARG A 137 3528 3614 3380 174 138 76 N ATOM 1109 CA ARG A 137 7.148 44.666 28.507 1.00 26.44 C ANISOU 1109 CA ARG A 137 3380 3451 3215 179 122 63 C ATOM 1110 C ARG A 137 8.030 44.208 27.353 1.00 25.51 C ANISOU 1110 C ARG A 137 3264 3317 3111 157 117 59 C ATOM 1111 O ARG A 137 8.067 43.021 27.026 1.00 24.98 O ANISOU 1111 O ARG A 137 3195 3244 3054 146 129 70 O ATOM 1112 CB ARG A 137 7.841 44.332 29.830 1.00 26.61 C ANISOU 1112 CB ARG A 137 3408 3482 3221 201 126 68 C ATOM 1113 CG ARG A 137 9.000 45.266 30.157 1.00 27.11 C ANISOU 1113 CG ARG A 137 3480 3545 3275 212 106 52 C ATOM 1114 CD ARG A 137 9.835 44.788 31.335 1.00 27.77 C ANISOU 1114 CD ARG A 137 3570 3636 3345 232 109 55 C ATOM 1115 NE ARG A 137 10.815 43.787 30.921 1.00 27.87 N ANISOU 1115 NE ARG A 137 3585 3637 3366 220 113 59 N ATOM 1116 CZ ARG A 137 11.858 43.380 31.640 1.00 28.57 C ANISOU 1116 CZ ARG A 137 3680 3728 3447 232 112 59 C ATOM 1117 NH1 ARG A 137 12.682 42.470 31.129 1.00 28.62 N ANISOU 1117 NH1 ARG A 137 3688 3724 3463 220 115 62 N ATOM 1118 NH2 ARG A 137 12.098 43.874 32.853 1.00 28.90 N ANISOU 1118 NH2 ARG A 137 3727 3783 3470 259 106 54 N ATOM 0 H ARG A 137 5.771 43.296 28.083 1.00 27.69 H new ATOM 0 HA ARG A 137 7.026 45.626 28.443 1.00 26.44 H new ATOM 0 HB2 ARG A 137 7.190 44.372 30.548 1.00 26.61 H new ATOM 0 HB3 ARG A 137 8.169 43.420 29.795 1.00 26.61 H new ATOM 0 HG2 ARG A 137 9.570 45.351 29.377 1.00 27.11 H new ATOM 0 HG3 ARG A 137 8.651 46.150 30.352 1.00 27.11 H new ATOM 0 HD2 ARG A 137 10.292 45.543 31.738 1.00 27.77 H new ATOM 0 HD3 ARG A 137 9.254 44.413 32.015 1.00 27.77 H new ATOM 0 HE ARG A 137 10.709 43.430 30.146 1.00 27.87 H new ATOM 0 HH11 ARG A 137 12.537 42.152 30.343 1.00 28.62 H new ATOM 0 HH12 ARG A 137 13.359 42.199 31.584 1.00 28.62 H new ATOM 0 HH21 ARG A 137 11.574 44.468 33.187 1.00 28.90 H new ATOM 0 HH22 ARG A 137 12.777 43.599 33.303 1.00 28.90 H new ATOM 1119 N GLY A 138 8.717 45.167 26.739 1.00 24.43 N ANISOU 1119 N GLY A 138 3133 3174 2976 152 100 45 N ATOM 1120 CA GLY A 138 9.735 44.890 25.729 1.00 24.20 C ANISOU 1120 CA GLY A 138 3106 3132 2957 134 94 40 C ATOM 1121 C GLY A 138 11.043 45.464 26.223 1.00 23.38 C ANISOU 1121 C GLY A 138 3009 3029 2846 143 82 31 C ATOM 1122 O GLY A 138 11.089 46.611 26.676 1.00 24.24 O ANISOU 1122 O GLY A 138 3121 3142 2948 154 68 21 O ATOM 0 H GLY A 138 8.604 46.005 26.898 1.00 24.43 H new ATOM 0 HA2 GLY A 138 9.817 43.935 25.582 1.00 24.20 H new ATOM 0 HA3 GLY A 138 9.488 45.288 24.879 1.00 24.20 H new ATOM 1123 N ALA A 139 12.113 44.679 26.135 1.00 23.26 N ANISOU 1123 N ALA A 139 2996 3009 2834 139 84 32 N ATOM 1124 CA ALA A 139 13.388 45.085 26.700 1.00 23.25 C ANISOU 1124 CA ALA A 139 2999 3008 2826 149 73 23 C ATOM 1125 C ALA A 139 14.547 44.699 25.797 1.00 23.10 C ANISOU 1125 C ALA A 139 2980 2980 2816 133 70 20 C ATOM 1126 O ALA A 139 14.501 43.668 25.117 1.00 23.21 O ANISOU 1126 O ALA A 139 2991 2990 2837 121 81 27 O ATOM 1127 CB ALA A 139 13.574 44.474 28.087 1.00 23.83 C ANISOU 1127 CB ALA A 139 3076 3091 2886 171 80 29 C ATOM 0 H ALA A 139 12.118 43.909 25.752 1.00 23.26 H new ATOM 0 HA ALA A 139 13.381 46.052 26.778 1.00 23.25 H new ATOM 0 HB1 ALA A 139 14.428 44.753 28.452 1.00 23.83 H new ATOM 0 HB2 ALA A 139 12.860 44.774 28.671 1.00 23.83 H new ATOM 0 HB3 ALA A 139 13.552 43.507 28.020 1.00 23.83 H new ATOM 1128 N THR A 140 15.574 45.544 25.789 1.00 22.85 N ANISOU 1128 N THR A 140 2950 2947 2785 134 55 8 N ATOM 1129 CA THR A 140 16.848 45.203 25.167 1.00 22.99 C ANISOU 1129 CA THR A 140 2966 2959 2809 123 53 5 C ATOM 1130 C THR A 140 17.597 44.247 26.089 1.00 23.93 C ANISOU 1130 C THR A 140 3088 3083 2923 137 58 7 C ATOM 1131 O THR A 140 17.279 44.135 27.277 1.00 23.20 O ANISOU 1131 O THR A 140 2998 2997 2818 156 60 9 O ATOM 1132 CB THR A 140 17.729 46.443 24.966 1.00 22.83 C ANISOU 1132 CB THR A 140 2946 2936 2794 119 35 -7 C ATOM 1133 OG1 THR A 140 18.061 47.011 26.242 1.00 22.79 O ANISOU 1133 OG1 THR A 140 2944 2936 2780 140 24 -15 O ATOM 1134 CG2 THR A 140 17.018 47.489 24.108 1.00 22.84 C ANISOU 1134 CG2 THR A 140 2947 2932 2801 107 28 -9 C ATOM 0 H THR A 140 15.552 46.328 26.143 1.00 22.85 H new ATOM 0 HA THR A 140 16.664 44.804 24.302 1.00 22.99 H new ATOM 0 HB THR A 140 18.539 46.171 24.507 1.00 22.83 H new ATOM 0 HG1 THR A 140 18.687 47.563 26.149 1.00 22.79 H new ATOM 0 HG21 THR A 140 17.594 48.261 23.996 1.00 22.84 H new ATOM 0 HG22 THR A 140 16.813 47.110 23.239 1.00 22.84 H new ATOM 0 HG23 THR A 140 16.195 47.760 24.544 1.00 22.84 H new ATOM 1135 N ARG A 141 18.606 43.576 25.545 1.00 24.78 N ANISOU 1135 N ARG A 141 3194 3187 3036 128 60 5 N ATOM 1136 CA ARG A 141 19.410 42.635 26.319 1.00 26.64 C ANISOU 1136 CA ARG A 141 3431 3426 3266 141 63 7 C ATOM 1137 C ARG A 141 20.283 43.358 27.342 1.00 25.88 C ANISOU 1137 C ARG A 141 3336 3334 3162 158 49 -4 C ATOM 1138 O ARG A 141 20.445 42.885 28.471 1.00 25.81 O ANISOU 1138 O ARG A 141 3333 3332 3143 178 51 -2 O ATOM 1139 CB ARG A 141 20.288 41.791 25.386 1.00 28.74 C ANISOU 1139 CB ARG A 141 3693 3686 3539 128 67 6 C ATOM 1140 CG ARG A 141 20.864 40.544 26.039 1.00 31.36 C ANISOU 1140 CG ARG A 141 4029 4021 3867 140 74 10 C ATOM 1141 CD ARG A 141 21.844 39.827 25.127 1.00 33.41 C ANISOU 1141 CD ARG A 141 4285 4276 4134 129 75 6 C ATOM 1142 NE ARG A 141 23.218 40.250 25.399 1.00 36.81 N ANISOU 1142 NE ARG A 141 4712 4710 4563 134 64 -5 N ATOM 1143 CZ ARG A 141 24.083 39.623 26.198 1.00 37.92 C ANISOU 1143 CZ ARG A 141 4855 4854 4699 149 62 -8 C ATOM 1144 NH1 ARG A 141 23.768 38.494 26.834 1.00 39.61 N ANISOU 1144 NH1 ARG A 141 5076 5068 4907 161 72 1 N ATOM 1145 NH2 ARG A 141 25.299 40.130 26.355 1.00 40.42 N ANISOU 1145 NH2 ARG A 141 5167 5174 5016 153 50 -20 N ATOM 0 H ARG A 141 18.844 43.652 24.722 1.00 24.78 H new ATOM 0 HA ARG A 141 18.801 42.052 26.800 1.00 26.64 H new ATOM 0 HB2 ARG A 141 19.763 41.528 24.614 1.00 28.74 H new ATOM 0 HB3 ARG A 141 21.018 42.340 25.059 1.00 28.74 H new ATOM 0 HG2 ARG A 141 21.311 40.789 26.864 1.00 31.36 H new ATOM 0 HG3 ARG A 141 20.142 39.941 26.275 1.00 31.36 H new ATOM 0 HD2 ARG A 141 21.766 38.868 25.253 1.00 33.41 H new ATOM 0 HD3 ARG A 141 21.623 40.011 24.201 1.00 33.41 H new ATOM 0 HE ARG A 141 23.492 40.966 25.009 1.00 36.81 H new ATOM 0 HH11 ARG A 141 22.987 38.148 26.735 1.00 39.61 H new ATOM 0 HH12 ARG A 141 24.346 38.112 27.343 1.00 39.61 H new ATOM 0 HH21 ARG A 141 25.520 40.853 25.945 1.00 40.42 H new ATOM 0 HH22 ARG A 141 25.866 39.736 26.867 1.00 40.42 H new ATOM 1146 N GLY A 142 20.830 44.510 26.957 1.00 25.03 N ANISOU 1146 N GLY A 142 3226 3224 3061 151 35 -15 N ATOM 1147 CA GLY A 142 21.804 45.208 27.787 1.00 25.77 C ANISOU 1147 CA GLY A 142 3319 3320 3152 165 19 -28 C ATOM 1148 C GLY A 142 23.012 44.317 28.010 1.00 26.43 C ANISOU 1148 C GLY A 142 3402 3406 3235 170 20 -31 C ATOM 1149 O GLY A 142 23.569 43.780 27.053 1.00 26.07 O ANISOU 1149 O GLY A 142 3350 3356 3197 154 25 -29 O ATOM 0 H GLY A 142 20.648 44.904 26.215 1.00 25.03 H new ATOM 0 HA2 GLY A 142 22.075 46.035 27.358 1.00 25.77 H new ATOM 0 HA3 GLY A 142 21.405 45.447 28.638 1.00 25.77 H new ATOM 1150 N ASP A 143 23.405 44.127 29.269 1.00 26.61 N ANISOU 1150 N ASP A 143 3429 3435 3247 193 15 -35 N ATOM 1151 CA ASP A 143 24.514 43.223 29.582 1.00 26.85 C ANISOU 1151 CA ASP A 143 3458 3468 3275 201 16 -38 C ATOM 1152 C ASP A 143 24.076 41.770 29.810 1.00 26.71 C ANISOU 1152 C ASP A 143 3447 3452 3250 207 34 -24 C ATOM 1153 O ASP A 143 24.899 40.929 30.185 1.00 27.61 O ANISOU 1153 O ASP A 143 3563 3568 3361 217 35 -25 O ATOM 1154 CB ASP A 143 25.313 43.740 30.784 1.00 27.24 C ANISOU 1154 CB ASP A 143 3510 3524 3318 224 0 -52 C ATOM 1155 CG ASP A 143 24.518 43.736 32.080 1.00 27.56 C ANISOU 1155 CG ASP A 143 3559 3571 3339 251 1 -48 C ATOM 1156 OD1 ASP A 143 25.081 44.216 33.086 1.00 28.81 O ANISOU 1156 OD1 ASP A 143 3721 3736 3491 272 -14 -60 O ATOM 1157 OD2 ASP A 143 23.361 43.261 32.107 1.00 26.79 O ANISOU 1157 OD2 ASP A 143 3467 3476 3236 251 16 -33 O ATOM 0 H ASP A 143 23.047 44.508 29.952 1.00 26.61 H new ATOM 0 HA ASP A 143 25.084 43.215 28.797 1.00 26.85 H new ATOM 0 HB2 ASP A 143 26.106 43.193 30.897 1.00 27.24 H new ATOM 0 HB3 ASP A 143 25.615 44.643 30.600 1.00 27.24 H new ATOM 1158 N GLY A 144 22.792 41.484 29.590 1.00 26.37 N ANISOU 1158 N GLY A 144 3406 3407 3205 202 47 -10 N ATOM 1159 CA GLY A 144 22.224 40.151 29.801 1.00 26.48 C ANISOU 1159 CA GLY A 144 3426 3421 3215 206 64 6 C ATOM 1160 C GLY A 144 21.494 40.005 31.129 1.00 26.31 C ANISOU 1160 C GLY A 144 3412 3408 3178 230 70 15 C ATOM 1161 O GLY A 144 20.703 39.076 31.307 1.00 25.13 O ANISOU 1161 O GLY A 144 3265 3257 3026 231 86 31 O ATOM 0 H GLY A 144 22.221 42.064 29.312 1.00 26.37 H new ATOM 0 HA2 GLY A 144 21.609 39.951 29.078 1.00 26.48 H new ATOM 0 HA3 GLY A 144 22.936 39.493 29.757 1.00 26.48 H new ATOM 1162 N THR A 145 21.774 40.912 32.065 1.00 26.54 N ANISOU 1162 N THR A 145 3443 3445 3197 249 57 4 N ATOM 1163 CA THR A 145 21.104 40.936 33.370 1.00 27.14 C ANISOU 1163 CA THR A 145 3526 3532 3254 274 61 11 C ATOM 1164 C THR A 145 20.204 42.157 33.526 1.00 27.12 C ANISOU 1164 C THR A 145 3522 3534 3249 277 55 6 C ATOM 1165 O THR A 145 19.125 42.058 34.116 1.00 27.15 O ANISOU 1165 O THR A 145 3529 3545 3242 288 65 18 O ATOM 1166 CB THR A 145 22.128 40.899 34.516 1.00 28.15 C ANISOU 1166 CB THR A 145 3659 3667 3369 301 50 2 C ATOM 1167 OG1 THR A 145 22.858 39.674 34.443 1.00 29.79 O ANISOU 1167 OG1 THR A 145 3870 3872 3579 301 57 8 O ATOM 1168 CG2 THR A 145 21.436 40.986 35.879 1.00 29.12 C ANISOU 1168 CG2 THR A 145 3790 3804 3470 331 54 9 C ATOM 0 H THR A 145 22.360 41.533 31.962 1.00 26.54 H new ATOM 0 HA THR A 145 20.548 40.142 33.414 1.00 27.14 H new ATOM 0 HB THR A 145 22.722 41.660 34.424 1.00 28.15 H new ATOM 0 HG1 THR A 145 23.421 39.646 35.065 1.00 29.79 H new ATOM 0 HG21 THR A 145 22.103 40.961 36.583 1.00 29.12 H new ATOM 0 HG22 THR A 145 20.937 41.816 35.936 1.00 29.12 H new ATOM 0 HG23 THR A 145 20.829 40.237 35.982 1.00 29.12 H new ATOM 1169 N VAL A 146 20.651 43.298 33.005 1.00 26.75 N ANISOU 1169 N VAL A 146 3471 3482 3211 268 37 -10 N ATOM 1170 CA VAL A 146 19.838 44.512 32.979 1.00 27.28 C ANISOU 1170 CA VAL A 146 3536 3551 3277 268 29 -16 C ATOM 1171 C VAL A 146 19.898 45.167 31.607 1.00 26.39 C ANISOU 1171 C VAL A 146 3416 3426 3183 239 23 -21 C ATOM 1172 O VAL A 146 20.981 45.471 31.107 1.00 26.95 O ANISOU 1172 O VAL A 146 3484 3491 3266 229 12 -32 O ATOM 1173 CB VAL A 146 20.309 45.554 34.015 1.00 28.30 C ANISOU 1173 CB VAL A 146 3668 3686 3397 292 8 -33 C ATOM 1174 CG1 VAL A 146 19.334 46.724 34.056 1.00 29.32 C ANISOU 1174 CG1 VAL A 146 3798 3818 3525 295 1 -38 C ATOM 1175 CG2 VAL A 146 20.427 44.928 35.396 1.00 28.64 C ANISOU 1175 CG2 VAL A 146 3719 3743 3419 323 13 -29 C ATOM 0 H VAL A 146 21.432 43.390 32.657 1.00 26.75 H new ATOM 0 HA VAL A 146 18.933 44.236 33.192 1.00 27.28 H new ATOM 0 HB VAL A 146 21.185 45.876 33.749 1.00 28.30 H new ATOM 0 HG11 VAL A 146 19.636 47.375 34.709 1.00 29.32 H new ATOM 0 HG12 VAL A 146 19.291 47.141 33.181 1.00 29.32 H new ATOM 0 HG13 VAL A 146 18.453 46.403 34.304 1.00 29.32 H new ATOM 0 HG21 VAL A 146 20.724 45.598 36.031 1.00 28.64 H new ATOM 0 HG22 VAL A 146 19.563 44.584 35.670 1.00 28.64 H new ATOM 0 HG23 VAL A 146 21.070 44.202 35.369 1.00 28.64 H new ATOM 1176 N GLY A 147 18.727 45.394 31.022 1.00 25.64 N ANISOU 1176 N GLY A 147 3320 3329 3092 227 31 -14 N ATOM 1177 CA GLY A 147 18.598 46.138 29.770 1.00 25.17 C ANISOU 1177 CA GLY A 147 3256 3260 3048 203 24 -18 C ATOM 1178 C GLY A 147 17.745 47.380 29.934 1.00 25.45 C ANISOU 1178 C GLY A 147 3292 3296 3081 208 14 -24 C ATOM 1179 O GLY A 147 17.595 47.900 31.044 1.00 24.71 O ANISOU 1179 O GLY A 147 3202 3211 2975 232 6 -31 O ATOM 0 H GLY A 147 17.978 45.119 31.342 1.00 25.64 H new ATOM 0 HA2 GLY A 147 19.479 46.391 29.453 1.00 25.17 H new ATOM 0 HA3 GLY A 147 18.206 45.565 29.093 1.00 25.17 H new ATOM 1180 N GLU A 148 17.192 47.862 28.824 1.00 24.74 N ANISOU 1180 N GLU A 148 3199 3199 3002 188 14 -23 N ATOM 1181 CA GLU A 148 16.360 49.061 28.824 1.00 24.84 C ANISOU 1181 CA GLU A 148 3212 3210 3014 191 3 -28 C ATOM 1182 C GLU A 148 14.937 48.718 28.433 1.00 24.49 C ANISOU 1182 C GLU A 148 3167 3169 2968 186 18 -17 C ATOM 1183 O GLU A 148 14.705 47.893 27.544 1.00 22.99 O ANISOU 1183 O GLU A 148 2974 2976 2786 168 31 -7 O ATOM 1184 CB GLU A 148 16.920 50.104 27.860 1.00 25.12 C ANISOU 1184 CB GLU A 148 3247 3234 3065 173 -13 -37 C ATOM 1185 CG GLU A 148 18.208 50.760 28.322 1.00 25.94 C ANISOU 1185 CG GLU A 148 3349 3333 3172 179 -31 -51 C ATOM 1186 CD GLU A 148 18.773 51.716 27.289 1.00 26.27 C ANISOU 1186 CD GLU A 148 3388 3362 3231 158 -44 -56 C ATOM 1187 OE1 GLU A 148 18.892 51.330 26.104 1.00 26.42 O ANISOU 1187 OE1 GLU A 148 3403 3376 3259 136 -35 -48 O ATOM 1188 OE2 GLU A 148 19.100 52.864 27.651 1.00 27.20 O ANISOU 1188 OE2 GLU A 148 3507 3474 3354 164 -65 -68 O ATOM 0 H GLU A 148 17.289 47.502 28.049 1.00 24.74 H new ATOM 0 HA GLU A 148 16.362 49.429 29.721 1.00 24.84 H new ATOM 0 HB2 GLU A 148 17.075 49.683 27.000 1.00 25.12 H new ATOM 0 HB3 GLU A 148 16.251 50.793 27.722 1.00 25.12 H new ATOM 0 HG2 GLU A 148 18.045 51.241 29.149 1.00 25.94 H new ATOM 0 HG3 GLU A 148 18.865 50.074 28.518 1.00 25.94 H new ATOM 1189 N ASN A 149 13.984 49.352 29.115 1.00 23.93 N ANISOU 1189 N ASN A 149 3098 3107 2888 202 14 -19 N ATOM 1190 CA ASN A 149 12.574 49.147 28.847 1.00 24.75 C ANISOU 1190 CA ASN A 149 3199 3215 2991 199 27 -10 C ATOM 1191 C ASN A 149 12.174 49.964 27.618 1.00 24.78 C ANISOU 1191 C ASN A 149 3201 3208 3007 180 18 -14 C ATOM 1192 O ASN A 149 11.995 51.184 27.700 1.00 25.73 O ANISOU 1192 O ASN A 149 3324 3326 3127 186 1 -25 O ATOM 1193 CB ASN A 149 11.742 49.533 30.081 1.00 25.38 C ANISOU 1193 CB ASN A 149 3279 3309 3053 227 26 -11 C ATOM 1194 CG ASN A 149 10.288 49.117 29.972 1.00 26.14 C ANISOU 1194 CG ASN A 149 3371 3414 3148 226 43 1 C ATOM 1195 OD1 ASN A 149 9.672 48.699 30.958 1.00 27.77 O ANISOU 1195 OD1 ASN A 149 3575 3634 3341 245 54 9 O ATOM 1196 ND2 ASN A 149 9.727 49.225 28.783 1.00 25.19 N ANISOU 1196 ND2 ASN A 149 3247 3284 3041 204 44 3 N ATOM 0 H ASN A 149 14.144 49.913 29.747 1.00 23.93 H new ATOM 0 HA ASN A 149 12.402 48.211 28.661 1.00 24.75 H new ATOM 0 HB2 ASN A 149 12.132 49.123 30.869 1.00 25.38 H new ATOM 0 HB3 ASN A 149 11.789 50.493 30.209 1.00 25.38 H new ATOM 0 HD21 ASN A 149 8.904 49.001 28.674 1.00 25.19 H new ATOM 0 HD22 ASN A 149 10.184 49.520 28.117 1.00 25.19 H new ATOM 1197 N ILE A 150 12.058 49.279 26.482 1.00 24.39 N ANISOU 1197 N ILE A 150 3148 3152 2968 158 29 -6 N ATOM 1198 CA ILE A 150 11.684 49.910 25.214 1.00 23.66 C ANISOU 1198 CA ILE A 150 3055 3050 2886 140 22 -8 C ATOM 1199 C ILE A 150 10.317 49.416 24.720 1.00 24.04 C ANISOU 1199 C ILE A 150 3098 3102 2936 134 35 0 C ATOM 1200 O ILE A 150 10.088 49.292 23.515 1.00 23.72 O ANISOU 1200 O ILE A 150 3055 3054 2904 115 37 3 O ATOM 1201 CB ILE A 150 12.781 49.696 24.135 1.00 23.39 C ANISOU 1201 CB ILE A 150 3020 3005 2862 119 21 -8 C ATOM 1202 CG1 ILE A 150 13.074 48.208 23.931 1.00 23.06 C ANISOU 1202 CG1 ILE A 150 2974 2964 2822 112 38 1 C ATOM 1203 CG2 ILE A 150 14.058 50.426 24.530 1.00 23.44 C ANISOU 1203 CG2 ILE A 150 3028 3007 2870 123 5 -18 C ATOM 1204 CD1 ILE A 150 13.722 47.906 22.593 1.00 23.42 C ANISOU 1204 CD1 ILE A 150 3018 3002 2877 91 39 2 C ATOM 0 H ILE A 150 12.194 48.432 26.423 1.00 24.39 H new ATOM 0 HA ILE A 150 11.608 50.863 25.375 1.00 23.66 H new ATOM 0 HB ILE A 150 12.451 50.058 23.298 1.00 23.39 H new ATOM 0 HG12 ILE A 150 13.655 47.898 24.643 1.00 23.06 H new ATOM 0 HG13 ILE A 150 12.246 47.708 24.003 1.00 23.06 H new ATOM 0 HG21 ILE A 150 14.735 50.285 23.850 1.00 23.44 H new ATOM 0 HG22 ILE A 150 13.876 51.375 24.613 1.00 23.44 H new ATOM 0 HG23 ILE A 150 14.378 50.083 25.379 1.00 23.44 H new ATOM 0 HD11 ILE A 150 13.884 46.952 22.519 1.00 23.42 H new ATOM 0 HD12 ILE A 150 13.133 48.190 21.877 1.00 23.42 H new ATOM 0 HD13 ILE A 150 14.564 48.382 22.526 1.00 23.42 H new ATOM 1205 N THR A 151 9.406 49.175 25.664 1.00 24.29 N ANISOU 1205 N THR A 151 3126 3144 2958 150 44 5 N ATOM 1206 CA THR A 151 8.083 48.611 25.387 1.00 24.47 C ANISOU 1206 CA THR A 151 3143 3172 2983 146 57 14 C ATOM 1207 C THR A 151 7.324 49.404 24.328 1.00 24.66 C ANISOU 1207 C THR A 151 3165 3190 3014 135 48 8 C ATOM 1208 O THR A 151 6.794 48.824 23.377 1.00 24.67 O ANISOU 1208 O THR A 151 3162 3187 3025 119 56 13 O ATOM 1209 CB THR A 151 7.207 48.571 26.659 1.00 24.75 C ANISOU 1209 CB THR A 151 3175 3222 3006 168 65 18 C ATOM 1210 OG1 THR A 151 7.850 47.789 27.674 1.00 24.32 O ANISOU 1210 OG1 THR A 151 3122 3174 2943 181 74 25 O ATOM 1211 CG2 THR A 151 5.844 47.972 26.352 1.00 25.53 C ANISOU 1211 CG2 THR A 151 3265 3326 3111 162 80 28 C ATOM 0 H THR A 151 9.542 49.337 26.498 1.00 24.29 H new ATOM 0 HA THR A 151 8.248 47.712 25.062 1.00 24.47 H new ATOM 0 HB THR A 151 7.089 49.480 26.975 1.00 24.75 H new ATOM 0 HG1 THR A 151 7.396 47.818 28.380 1.00 24.32 H new ATOM 0 HG21 THR A 151 5.308 47.955 27.161 1.00 25.53 H new ATOM 0 HG22 THR A 151 5.397 48.511 25.680 1.00 25.53 H new ATOM 0 HG23 THR A 151 5.955 47.068 26.019 1.00 25.53 H new ATOM 1212 N GLU A 152 7.280 50.725 24.495 1.00 25.52 N ANISOU 1212 N GLU A 152 3279 3298 3119 143 31 -3 N ATOM 1213 CA GLU A 152 6.498 51.579 23.595 1.00 26.34 C ANISOU 1213 CA GLU A 152 3384 3397 3229 136 22 -8 C ATOM 1214 C GLU A 152 7.064 51.567 22.178 1.00 24.89 C ANISOU 1214 C GLU A 152 3202 3200 3056 113 18 -8 C ATOM 1215 O GLU A 152 6.314 51.497 21.205 1.00 24.77 O ANISOU 1215 O GLU A 152 3184 3182 3047 102 20 -6 O ATOM 1216 CB GLU A 152 6.412 53.014 24.132 1.00 28.24 C ANISOU 1216 CB GLU A 152 3629 3637 3462 152 2 -20 C ATOM 1217 CG GLU A 152 5.769 53.141 25.509 1.00 31.07 C ANISOU 1217 CG GLU A 152 3986 4011 3807 177 5 -22 C ATOM 1218 CD GLU A 152 4.436 52.420 25.634 1.00 33.42 C ANISOU 1218 CD GLU A 152 4274 4321 4103 180 22 -13 C ATOM 1219 OE1 GLU A 152 3.674 52.337 24.640 1.00 36.61 O ANISOU 1219 OE1 GLU A 152 4673 4721 4516 166 25 -11 O ATOM 1220 OE2 GLU A 152 4.142 51.926 26.742 1.00 37.52 O ANISOU 1220 OE2 GLU A 152 4790 4856 4612 197 34 -8 O ATOM 0 H GLU A 152 7.693 51.147 25.120 1.00 25.52 H new ATOM 0 HA GLU A 152 5.600 51.214 23.558 1.00 26.34 H new ATOM 0 HB2 GLU A 152 7.307 53.386 24.171 1.00 28.24 H new ATOM 0 HB3 GLU A 152 5.908 53.553 23.502 1.00 28.24 H new ATOM 0 HG2 GLU A 152 6.380 52.790 26.176 1.00 31.07 H new ATOM 0 HG3 GLU A 152 5.639 54.081 25.710 1.00 31.07 H new ATOM 1221 N ASN A 153 8.389 51.621 22.070 1.00 23.91 N ANISOU 1221 N ASN A 153 3082 3068 2934 107 13 -9 N ATOM 1222 CA ASN A 153 9.058 51.512 20.773 1.00 23.94 C ANISOU 1222 CA ASN A 153 3087 3062 2947 87 11 -7 C ATOM 1223 C ASN A 153 8.750 50.195 20.065 1.00 23.53 C ANISOU 1223 C ASN A 153 3030 3012 2900 75 28 1 C ATOM 1224 O ASN A 153 8.469 50.182 18.865 1.00 23.14 O ANISOU 1224 O ASN A 153 2979 2956 2855 62 27 1 O ATOM 1225 CB ASN A 153 10.574 51.703 20.933 1.00 23.75 C ANISOU 1225 CB ASN A 153 3066 3033 2925 84 5 -10 C ATOM 1226 CG ASN A 153 10.953 53.151 21.211 1.00 23.63 C ANISOU 1226 CG ASN A 153 3057 3012 2910 89 -15 -18 C ATOM 1227 OD1 ASN A 153 10.118 54.048 21.103 1.00 24.06 O ANISOU 1227 OD1 ASN A 153 3114 3064 2964 94 -25 -22 O ATOM 1228 ND2 ASN A 153 12.215 53.386 21.564 1.00 23.10 N ANISOU 1228 ND2 ASN A 153 2991 2941 2846 89 -22 -22 N ATOM 0 H ASN A 153 8.922 51.721 22.738 1.00 23.91 H new ATOM 0 HA ASN A 153 8.708 52.221 20.211 1.00 23.94 H new ATOM 0 HB2 ASN A 153 10.893 51.143 21.658 1.00 23.75 H new ATOM 0 HB3 ASN A 153 11.022 51.404 20.126 1.00 23.75 H new ATOM 0 HD21 ASN A 153 12.473 54.190 21.726 1.00 23.10 H new ATOM 0 HD22 ASN A 153 12.772 52.734 21.630 1.00 23.10 H new ATOM 1229 N LEU A 154 8.789 49.091 20.805 1.00 23.81 N ANISOU 1229 N LEU A 154 3061 3053 2933 81 41 7 N ATOM 1230 CA LEU A 154 8.544 47.770 20.215 1.00 23.55 C ANISOU 1230 CA LEU A 154 3022 3018 2906 70 55 14 C ATOM 1231 C LEU A 154 7.080 47.560 19.790 1.00 24.09 C ANISOU 1231 C LEU A 154 3085 3089 2979 68 60 16 C ATOM 1232 O LEU A 154 6.804 46.780 18.880 1.00 24.46 O ANISOU 1232 O LEU A 154 3127 3131 3034 56 66 18 O ATOM 1233 CB LEU A 154 9.021 46.652 21.157 1.00 23.38 C ANISOU 1233 CB LEU A 154 3000 3002 2883 77 67 20 C ATOM 1234 CG LEU A 154 10.540 46.444 21.105 1.00 23.20 C ANISOU 1234 CG LEU A 154 2981 2976 2860 74 65 18 C ATOM 1235 CD1 LEU A 154 11.018 45.613 22.285 1.00 22.53 C ANISOU 1235 CD1 LEU A 154 2896 2896 2770 86 73 23 C ATOM 1236 CD2 LEU A 154 10.953 45.783 19.795 1.00 23.77 C ANISOU 1236 CD2 LEU A 154 3052 3041 2940 57 68 19 C ATOM 0 H LEU A 154 8.955 49.081 21.649 1.00 23.81 H new ATOM 0 HA LEU A 154 9.068 47.729 19.400 1.00 23.55 H new ATOM 0 HB2 LEU A 154 8.758 46.866 22.066 1.00 23.38 H new ATOM 0 HB3 LEU A 154 8.576 45.823 20.921 1.00 23.38 H new ATOM 0 HG LEU A 154 10.959 47.317 21.156 1.00 23.20 H new ATOM 0 HD11 LEU A 154 11.979 45.495 22.230 1.00 22.53 H new ATOM 0 HD12 LEU A 154 10.795 46.067 23.112 1.00 22.53 H new ATOM 0 HD13 LEU A 154 10.585 44.745 22.266 1.00 22.53 H new ATOM 0 HD21 LEU A 154 11.915 45.661 19.783 1.00 23.77 H new ATOM 0 HD22 LEU A 154 10.517 44.920 19.716 1.00 23.77 H new ATOM 0 HD23 LEU A 154 10.690 46.347 19.051 1.00 23.77 H new ATOM 1237 N ARG A 155 6.151 48.269 20.428 1.00 25.49 N ANISOU 1237 N ARG A 155 3261 3273 3152 80 57 14 N ATOM 1238 CA ARG A 155 4.763 48.279 19.970 1.00 25.84 C ANISOU 1238 CA ARG A 155 3298 3319 3200 77 59 14 C ATOM 1239 C ARG A 155 4.663 48.779 18.528 1.00 25.12 C ANISOU 1239 C ARG A 155 3209 3219 3114 64 49 8 C ATOM 1240 O ARG A 155 3.817 48.310 17.779 1.00 26.23 O ANISOU 1240 O ARG A 155 3345 3360 3263 57 52 8 O ATOM 1241 CB ARG A 155 3.872 49.142 20.871 1.00 27.82 C ANISOU 1241 CB ARG A 155 3548 3580 3444 95 55 10 C ATOM 1242 CG ARG A 155 3.554 48.541 22.229 1.00 29.54 C ANISOU 1242 CG ARG A 155 3760 3810 3655 109 68 18 C ATOM 1243 CD ARG A 155 2.543 49.396 22.986 1.00 30.89 C ANISOU 1243 CD ARG A 155 3928 3993 3818 127 64 14 C ATOM 1244 NE ARG A 155 2.643 49.246 24.442 1.00 32.28 N ANISOU 1244 NE ARG A 155 4103 4181 3981 147 72 19 N ATOM 1245 CZ ARG A 155 2.162 48.224 25.152 1.00 33.59 C ANISOU 1245 CZ ARG A 155 4260 4356 4146 152 91 32 C ATOM 1246 NH1 ARG A 155 2.319 48.208 26.468 1.00 35.01 N ANISOU 1246 NH1 ARG A 155 4442 4549 4313 172 97 36 N ATOM 1247 NH2 ARG A 155 1.532 47.213 24.566 1.00 34.75 N ANISOU 1247 NH2 ARG A 155 4398 4500 4307 137 104 41 N ATOM 0 H ARG A 155 6.303 48.749 21.125 1.00 25.49 H new ATOM 0 HA ARG A 155 4.448 47.362 20.013 1.00 25.84 H new ATOM 0 HB2 ARG A 155 4.306 49.999 21.006 1.00 27.82 H new ATOM 0 HB3 ARG A 155 3.038 49.316 20.407 1.00 27.82 H new ATOM 0 HG2 ARG A 155 3.202 47.644 22.115 1.00 29.54 H new ATOM 0 HG3 ARG A 155 4.369 48.462 22.749 1.00 29.54 H new ATOM 0 HD2 ARG A 155 2.675 50.328 22.752 1.00 30.89 H new ATOM 0 HD3 ARG A 155 1.647 49.157 22.702 1.00 30.89 H new ATOM 0 HE ARG A 155 3.046 49.870 24.875 1.00 32.28 H new ATOM 0 HH11 ARG A 155 2.729 48.854 26.860 1.00 35.01 H new ATOM 0 HH12 ARG A 155 2.011 47.551 26.930 1.00 35.01 H new ATOM 0 HH21 ARG A 155 1.427 47.208 23.712 1.00 34.75 H new ATOM 0 HH22 ARG A 155 1.229 46.563 25.040 1.00 34.75 H new ATOM 1248 N THR A 156 5.529 49.717 18.139 1.00 23.66 N ANISOU 1248 N THR A 156 3033 3029 2926 62 36 3 N ATOM 1249 CA THR A 156 5.510 50.262 16.772 1.00 23.07 C ANISOU 1249 CA THR A 156 2964 2948 2855 50 27 -1 C ATOM 1250 C THR A 156 6.032 49.265 15.738 1.00 23.03 C ANISOU 1250 C THR A 156 2957 2938 2856 36 34 2 C ATOM 1251 O THR A 156 5.811 49.446 14.543 1.00 22.62 O ANISOU 1251 O THR A 156 2907 2883 2806 28 29 0 O ATOM 1252 CB THR A 156 6.332 51.564 16.623 1.00 23.10 C ANISOU 1252 CB THR A 156 2977 2945 2856 50 12 -4 C ATOM 1253 OG1 THR A 156 7.735 51.260 16.599 1.00 23.20 O ANISOU 1253 OG1 THR A 156 2992 2954 2869 43 14 -2 O ATOM 1254 CG2 THR A 156 6.022 52.562 17.756 1.00 22.51 C ANISOU 1254 CG2 THR A 156 2905 2873 2776 66 2 -9 C ATOM 0 H THR A 156 6.136 50.053 18.648 1.00 23.66 H new ATOM 0 HA THR A 156 4.573 50.453 16.607 1.00 23.07 H new ATOM 0 HB THR A 156 6.080 51.982 15.785 1.00 23.10 H new ATOM 0 HG1 THR A 156 7.960 50.915 17.331 1.00 23.20 H new ATOM 0 HG21 THR A 156 6.552 53.365 17.634 1.00 22.51 H new ATOM 0 HG22 THR A 156 5.080 52.791 17.737 1.00 22.51 H new ATOM 0 HG23 THR A 156 6.239 52.159 18.611 1.00 22.51 H new ATOM 1255 N VAL A 157 6.737 48.231 16.197 1.00 22.52 N ANISOU 1255 N VAL A 157 2890 2875 2793 35 44 7 N ATOM 1256 CA VAL A 157 7.275 47.200 15.311 1.00 22.21 C ANISOU 1256 CA VAL A 157 2849 2832 2758 24 51 9 C ATOM 1257 C VAL A 157 6.162 46.195 15.013 1.00 22.28 C ANISOU 1257 C VAL A 157 2850 2841 2776 21 58 9 C ATOM 1258 O VAL A 157 5.760 45.430 15.882 1.00 22.25 O ANISOU 1258 O VAL A 157 2840 2840 2775 26 68 14 O ATOM 1259 CB VAL A 157 8.517 46.531 15.936 1.00 22.00 C ANISOU 1259 CB VAL A 157 2823 2805 2730 25 57 12 C ATOM 1260 CG1 VAL A 157 9.104 45.482 15.003 1.00 21.73 C ANISOU 1260 CG1 VAL A 157 2788 2769 2701 15 63 12 C ATOM 1261 CG2 VAL A 157 9.556 47.594 16.259 1.00 20.92 C ANISOU 1261 CG2 VAL A 157 2692 2668 2587 27 48 10 C ATOM 0 H VAL A 157 6.916 48.108 17.029 1.00 22.52 H new ATOM 0 HA VAL A 157 7.573 47.594 14.476 1.00 22.21 H new ATOM 0 HB VAL A 157 8.249 46.082 16.753 1.00 22.00 H new ATOM 0 HG11 VAL A 157 9.882 45.078 15.419 1.00 21.73 H new ATOM 0 HG12 VAL A 157 8.440 44.798 14.826 1.00 21.73 H new ATOM 0 HG13 VAL A 157 9.365 45.901 14.168 1.00 21.73 H new ATOM 0 HG21 VAL A 157 10.337 47.174 16.652 1.00 20.92 H new ATOM 0 HG22 VAL A 157 9.812 48.054 15.445 1.00 20.92 H new ATOM 0 HG23 VAL A 157 9.182 48.232 16.887 1.00 20.92 H new ATOM 1262 N ARG A 158 5.666 46.213 13.778 1.00 23.06 N ANISOU 1262 N ARG A 158 2947 2936 2877 14 54 5 N ATOM 1263 CA ARG A 158 4.401 45.549 13.443 1.00 23.89 C ANISOU 1263 CA ARG A 158 3044 3041 2992 12 57 3 C ATOM 1264 C ARG A 158 4.407 44.020 13.573 1.00 23.18 C ANISOU 1264 C ARG A 158 2946 2948 2912 7 68 7 C ATOM 1265 O ARG A 158 3.358 43.426 13.794 1.00 22.57 O ANISOU 1265 O ARG A 158 2859 2870 2845 7 73 8 O ATOM 1266 CB ARG A 158 3.936 45.975 12.048 1.00 24.68 C ANISOU 1266 CB ARG A 158 3146 3139 3091 7 47 -4 C ATOM 1267 CG ARG A 158 3.606 47.457 11.931 1.00 26.10 C ANISOU 1267 CG ARG A 158 3332 3320 3263 11 35 -7 C ATOM 1268 CD ARG A 158 2.456 47.838 12.849 1.00 27.08 C ANISOU 1268 CD ARG A 158 3450 3449 3389 21 35 -7 C ATOM 1269 NE ARG A 158 1.823 49.100 12.467 1.00 28.17 N ANISOU 1269 NE ARG A 158 3594 3588 3523 25 22 -13 N ATOM 1270 CZ ARG A 158 2.191 50.308 12.897 1.00 28.98 C ANISOU 1270 CZ ARG A 158 3704 3690 3616 32 14 -13 C ATOM 1271 NH1 ARG A 158 1.523 51.378 12.481 1.00 29.36 N ANISOU 1271 NH1 ARG A 158 3757 3738 3662 36 1 -18 N ATOM 1272 NH2 ARG A 158 3.220 50.469 13.731 1.00 29.14 N ANISOU 1272 NH2 ARG A 158 3729 3711 3634 34 16 -9 N ATOM 0 H ARG A 158 6.047 46.606 13.114 1.00 23.06 H new ATOM 0 HA ARG A 158 3.769 45.848 14.115 1.00 23.89 H new ATOM 0 HB2 ARG A 158 4.629 45.756 11.405 1.00 24.68 H new ATOM 0 HB3 ARG A 158 3.151 45.458 11.807 1.00 24.68 H new ATOM 0 HG2 ARG A 158 4.389 47.984 12.154 1.00 26.10 H new ATOM 0 HG3 ARG A 158 3.374 47.668 11.013 1.00 26.10 H new ATOM 0 HD2 ARG A 158 1.792 47.131 12.839 1.00 27.08 H new ATOM 0 HD3 ARG A 158 2.783 47.907 13.760 1.00 27.08 H new ATOM 0 HE ARG A 158 1.160 49.060 11.921 1.00 28.17 H new ATOM 0 HH11 ARG A 158 0.861 51.288 11.940 1.00 29.36 H new ATOM 0 HH12 ARG A 158 1.753 52.161 12.753 1.00 29.36 H new ATOM 0 HH21 ARG A 158 3.663 49.785 14.004 1.00 29.14 H new ATOM 0 HH22 ARG A 158 3.440 51.257 13.995 1.00 29.14 H new ATOM 1273 N SER A 159 5.579 43.391 13.479 1.00 22.60 N ANISOU 1273 N SER A 159 2877 2872 2838 4 71 9 N ATOM 1274 CA SER A 159 5.681 41.936 13.646 1.00 22.50 C ANISOU 1274 CA SER A 159 2858 2854 2835 1 80 12 C ATOM 1275 C SER A 159 5.536 41.488 15.103 1.00 22.12 C ANISOU 1275 C SER A 159 2807 2809 2789 8 91 22 C ATOM 1276 O SER A 159 5.313 40.305 15.359 1.00 21.75 O ANISOU 1276 O SER A 159 2754 2757 2753 6 100 27 O ATOM 1277 CB SER A 159 7.010 41.423 13.096 1.00 22.38 C ANISOU 1277 CB SER A 159 2849 2837 2817 -3 80 10 C ATOM 1278 OG SER A 159 8.091 42.075 13.736 1.00 21.51 O ANISOU 1278 OG SER A 159 2746 2731 2697 2 80 13 O ATOM 0 H SER A 159 6.326 43.785 13.320 1.00 22.60 H new ATOM 0 HA SER A 159 4.942 41.556 13.146 1.00 22.50 H new ATOM 0 HB2 SER A 159 7.075 40.465 13.233 1.00 22.38 H new ATOM 0 HB3 SER A 159 7.052 41.577 12.139 1.00 22.38 H new ATOM 0 HG SER A 159 8.779 42.010 13.259 1.00 21.51 H new ATOM 1279 N VAL A 160 5.687 42.422 16.045 1.00 22.52 N ANISOU 1279 N VAL A 160 2861 2866 2829 17 91 25 N ATOM 1280 CA VAL A 160 5.536 42.127 17.464 1.00 23.25 C ANISOU 1280 CA VAL A 160 2951 2963 2919 27 101 34 C ATOM 1281 C VAL A 160 4.045 42.008 17.756 1.00 23.64 C ANISOU 1281 C VAL A 160 2990 3016 2977 28 106 38 C ATOM 1282 O VAL A 160 3.307 42.973 17.554 1.00 24.63 O ANISOU 1282 O VAL A 160 3114 3146 3099 31 99 33 O ATOM 1283 CB VAL A 160 6.166 43.230 18.344 1.00 22.83 C ANISOU 1283 CB VAL A 160 2905 2917 2851 38 96 33 C ATOM 1284 CG1 VAL A 160 5.895 42.984 19.823 1.00 23.37 C ANISOU 1284 CG1 VAL A 160 2971 2994 2916 52 106 43 C ATOM 1285 CG2 VAL A 160 7.665 43.314 18.086 1.00 23.18 C ANISOU 1285 CG2 VAL A 160 2958 2959 2891 36 91 30 C ATOM 0 H VAL A 160 5.880 43.243 15.875 1.00 22.52 H new ATOM 0 HA VAL A 160 5.997 41.300 17.674 1.00 23.25 H new ATOM 0 HB VAL A 160 5.755 44.076 18.105 1.00 22.83 H new ATOM 0 HG11 VAL A 160 6.302 43.691 20.349 1.00 23.37 H new ATOM 0 HG12 VAL A 160 4.938 42.975 19.980 1.00 23.37 H new ATOM 0 HG13 VAL A 160 6.273 42.130 20.084 1.00 23.37 H new ATOM 0 HG21 VAL A 160 8.051 44.008 18.642 1.00 23.18 H new ATOM 0 HG22 VAL A 160 8.078 42.463 18.299 1.00 23.18 H new ATOM 0 HG23 VAL A 160 7.822 43.524 17.152 1.00 23.18 H new ATOM 1286 N PRO A 161 3.591 40.827 18.220 1.00 23.97 N ANISOU 1286 N PRO A 161 3024 3055 3030 26 118 48 N ATOM 1287 CA PRO A 161 2.158 40.696 18.464 1.00 24.78 C ANISOU 1287 CA PRO A 161 3114 3161 3141 26 125 52 C ATOM 1288 C PRO A 161 1.742 41.428 19.739 1.00 26.06 C ANISOU 1288 C PRO A 161 3275 3337 3292 41 130 59 C ATOM 1289 O PRO A 161 2.462 41.396 20.743 1.00 24.98 O ANISOU 1289 O PRO A 161 3143 3204 3144 52 135 65 O ATOM 1290 CB PRO A 161 1.964 39.184 18.604 1.00 24.75 C ANISOU 1290 CB PRO A 161 3102 3148 3154 19 136 63 C ATOM 1291 CG PRO A 161 3.260 38.687 19.130 1.00 24.60 C ANISOU 1291 CG PRO A 161 3092 3126 3128 23 140 68 C ATOM 1292 CD PRO A 161 4.323 39.594 18.570 1.00 23.80 C ANISOU 1292 CD PRO A 161 3003 3026 3013 24 127 56 C ATOM 0 HA PRO A 161 1.617 41.085 17.759 1.00 24.78 H new ATOM 0 HB2 PRO A 161 1.235 38.976 19.209 1.00 24.75 H new ATOM 0 HB3 PRO A 161 1.750 38.775 17.751 1.00 24.75 H new ATOM 0 HG2 PRO A 161 3.268 38.703 20.100 1.00 24.60 H new ATOM 0 HG3 PRO A 161 3.413 37.768 18.860 1.00 24.60 H new ATOM 0 HD2 PRO A 161 5.021 39.768 19.221 1.00 23.80 H new ATOM 0 HD3 PRO A 161 4.751 39.202 17.793 1.00 23.80 H new ATOM 1293 N MET A 162 0.600 42.106 19.686 1.00 27.97 N ANISOU 1293 N MET A 162 3508 3584 3533 44 127 55 N ATOM 1294 CA MET A 162 0.055 42.778 20.864 1.00 29.89 C ANISOU 1294 CA MET A 162 3749 3843 3766 60 133 60 C ATOM 1295 C MET A 162 -0.697 41.766 21.729 1.00 31.25 C ANISOU 1295 C MET A 162 3908 4020 3947 62 152 77 C ATOM 1296 O MET A 162 -0.763 41.910 22.954 1.00 31.50 O ANISOU 1296 O MET A 162 3940 4064 3967 77 161 86 O ATOM 1297 CB MET A 162 -0.900 43.903 20.456 1.00 32.00 C ANISOU 1297 CB MET A 162 4013 4116 4030 64 122 50 C ATOM 1298 CG MET A 162 -0.287 45.032 19.634 1.00 32.46 C ANISOU 1298 CG MET A 162 4084 4170 4080 63 103 36 C ATOM 1299 SD MET A 162 1.007 46.021 20.421 1.00 34.65 S ANISOU 1299 SD MET A 162 4377 4451 4338 77 95 32 S ATOM 1300 CE MET A 162 0.742 45.690 22.148 1.00 33.94 C ANISOU 1300 CE MET A 162 4281 4375 4238 95 111 44 C ATOM 0 H MET A 162 0.123 42.190 18.975 1.00 27.97 H new ATOM 0 HA MET A 162 0.791 43.161 21.366 1.00 29.89 H new ATOM 0 HB2 MET A 162 -1.630 43.516 19.948 1.00 32.00 H new ATOM 0 HB3 MET A 162 -1.285 44.284 21.260 1.00 32.00 H new ATOM 0 HG2 MET A 162 0.080 44.648 18.823 1.00 32.46 H new ATOM 0 HG3 MET A 162 -1.002 45.631 19.366 1.00 32.46 H new ATOM 0 HE1 MET A 162 0.594 46.525 22.619 1.00 33.94 H new ATOM 0 HE2 MET A 162 -0.035 45.118 22.253 1.00 33.94 H new ATOM 0 HE3 MET A 162 1.522 45.246 22.516 1.00 33.94 H new ATOM 1301 N ARG A 163 -1.278 40.762 21.072 1.00 32.65 N ANISOU 1301 N ARG A 163 4075 4187 4145 47 156 80 N ATOM 1302 CA ARG A 163 -1.945 39.651 21.746 1.00 34.10 C ANISOU 1302 CA ARG A 163 4245 4371 4342 44 174 98 C ATOM 1303 C ARG A 163 -1.625 38.330 21.054 1.00 33.09 C ANISOU 1303 C ARG A 163 4115 4224 4233 28 176 101 C ATOM 1304 O ARG A 163 -1.501 38.275 19.828 1.00 31.42 O ANISOU 1304 O ARG A 163 3905 4001 4031 17 163 87 O ATOM 1305 CB ARG A 163 -3.464 39.867 21.782 1.00 36.33 C ANISOU 1305 CB ARG A 163 4510 4662 4633 44 179 99 C ATOM 1306 CG ARG A 163 -3.970 40.532 23.056 1.00 39.25 C ANISOU 1306 CG ARG A 163 4876 5052 4987 63 189 108 C ATOM 1307 CD ARG A 163 -5.487 40.463 23.161 1.00 41.43 C ANISOU 1307 CD ARG A 163 5130 5337 5275 62 198 113 C ATOM 1308 NE ARG A 163 -5.966 40.782 24.507 1.00 43.54 N ANISOU 1308 NE ARG A 163 5391 5624 5527 80 212 126 N ATOM 1309 CZ ARG A 163 -6.113 39.907 25.502 1.00 44.91 C ANISOU 1309 CZ ARG A 163 5558 5804 5704 83 233 148 C ATOM 1310 NH1 ARG A 163 -6.558 40.329 26.680 1.00 46.34 N ANISOU 1310 NH1 ARG A 163 5734 6007 5868 103 246 158 N ATOM 1311 NH2 ARG A 163 -5.815 38.617 25.340 1.00 46.39 N ANISOU 1311 NH2 ARG A 163 5742 5975 5909 68 242 161 N ATOM 0 H ARG A 163 -1.295 40.708 20.214 1.00 32.65 H new ATOM 0 HA ARG A 163 -1.615 39.615 22.657 1.00 34.10 H new ATOM 0 HB2 ARG A 163 -3.721 40.411 21.021 1.00 36.33 H new ATOM 0 HB3 ARG A 163 -3.905 39.009 21.680 1.00 36.33 H new ATOM 0 HG2 ARG A 163 -3.572 40.100 23.828 1.00 39.25 H new ATOM 0 HG3 ARG A 163 -3.686 41.459 23.072 1.00 39.25 H new ATOM 0 HD2 ARG A 163 -5.882 41.080 22.525 1.00 41.43 H new ATOM 0 HD3 ARG A 163 -5.786 39.573 22.916 1.00 41.43 H new ATOM 0 HE ARG A 163 -6.169 41.602 24.669 1.00 43.54 H new ATOM 0 HH11 ARG A 163 -6.748 41.160 26.795 1.00 46.34 H new ATOM 0 HH12 ARG A 163 -6.656 39.772 27.327 1.00 46.34 H new ATOM 0 HH21 ARG A 163 -5.522 38.335 24.582 1.00 46.39 H new ATOM 0 HH22 ARG A 163 -5.916 38.067 25.993 1.00 46.39 H new ATOM 1312 N LEU A 164 -1.490 37.274 21.852 1.00 33.90 N ANISOU 1312 N LEU A 164 4215 4324 4343 28 191 119 N ATOM 1313 CA LEU A 164 -1.226 35.931 21.338 1.00 34.39 C ANISOU 1313 CA LEU A 164 4274 4367 4426 13 193 123 C ATOM 1314 C LEU A 164 -2.545 35.183 21.174 1.00 36.01 C ANISOU 1314 C LEU A 164 4459 4566 4657 2 201 131 C ATOM 1315 O LEU A 164 -3.592 35.649 21.628 1.00 36.89 O ANISOU 1315 O LEU A 164 4559 4690 4769 6 208 136 O ATOM 1316 CB LEU A 164 -0.304 35.159 22.288 1.00 33.73 C ANISOU 1316 CB LEU A 164 4199 4281 4336 20 205 138 C ATOM 1317 CG LEU A 164 0.920 35.918 22.809 1.00 34.17 C ANISOU 1317 CG LEU A 164 4272 4346 4365 35 200 133 C ATOM 1318 CD1 LEU A 164 1.760 35.016 23.698 1.00 33.25 C ANISOU 1318 CD1 LEU A 164 4164 4226 4246 41 210 148 C ATOM 1319 CD2 LEU A 164 1.745 36.475 21.657 1.00 33.66 C ANISOU 1319 CD2 LEU A 164 4218 4275 4296 30 181 113 C ATOM 0 H LEU A 164 -1.549 37.316 22.709 1.00 33.90 H new ATOM 0 HA LEU A 164 -0.784 36.006 20.478 1.00 34.39 H new ATOM 0 HB2 LEU A 164 -0.828 34.866 23.050 1.00 33.73 H new ATOM 0 HB3 LEU A 164 0.004 34.360 21.832 1.00 33.73 H new ATOM 0 HG LEU A 164 0.613 36.669 23.341 1.00 34.17 H new ATOM 0 HD11 LEU A 164 2.531 35.507 24.021 1.00 33.25 H new ATOM 0 HD12 LEU A 164 1.228 34.718 24.452 1.00 33.25 H new ATOM 0 HD13 LEU A 164 2.058 34.246 23.189 1.00 33.25 H new ATOM 0 HD21 LEU A 164 2.513 36.951 22.009 1.00 33.66 H new ATOM 0 HD22 LEU A 164 2.047 35.746 21.093 1.00 33.66 H new ATOM 0 HD23 LEU A 164 1.201 37.084 21.134 1.00 33.66 H new ATOM 1320 N THR A 165 -2.488 34.020 20.531 1.00 36.90 N ANISOU 1320 N THR A 165 4568 4659 4793 -13 199 132 N ATOM 1321 CA THR A 165 -3.687 33.218 20.273 1.00 38.00 C ANISOU 1321 CA THR A 165 4687 4789 4961 -27 204 138 C ATOM 1322 C THR A 165 -4.239 32.562 21.541 1.00 40.34 C ANISOU 1322 C THR A 165 4972 5089 5265 -25 227 165 C ATOM 1323 O THR A 165 -5.399 32.151 21.572 1.00 41.17 O ANISOU 1323 O THR A 165 5057 5192 5393 -34 234 174 O ATOM 1324 CB THR A 165 -3.406 32.107 19.247 1.00 37.17 C ANISOU 1324 CB THR A 165 4582 4660 4881 -41 194 130 C ATOM 1325 OG1 THR A 165 -2.372 31.254 19.746 1.00 36.38 O ANISOU 1325 OG1 THR A 165 4493 4550 4779 -40 200 141 O ATOM 1326 CG2 THR A 165 -2.986 32.698 17.903 1.00 36.62 C ANISOU 1326 CG2 THR A 165 4522 4588 4804 -43 173 104 C ATOM 0 H THR A 165 -1.760 33.673 20.233 1.00 36.90 H new ATOM 0 HA THR A 165 -4.346 33.839 19.926 1.00 38.00 H new ATOM 0 HB THR A 165 -4.219 31.596 19.112 1.00 37.17 H new ATOM 0 HG1 THR A 165 -2.208 30.653 19.182 1.00 36.38 H new ATOM 0 HG21 THR A 165 -2.814 31.980 17.273 1.00 36.62 H new ATOM 0 HG22 THR A 165 -3.696 33.264 17.562 1.00 36.62 H new ATOM 0 HG23 THR A 165 -2.180 33.225 18.019 1.00 36.62 H new ATOM 1327 N GLU A 166 -3.401 32.452 22.570 1.00 41.68 N ANISOU 1327 N GLU A 166 5154 5264 5417 -13 238 179 N ATOM 1328 CA GLU A 166 -3.795 31.865 23.847 1.00 43.50 C ANISOU 1328 CA GLU A 166 5377 5501 5650 -8 260 207 C ATOM 1329 C GLU A 166 -3.325 32.763 24.990 1.00 43.49 C ANISOU 1329 C GLU A 166 5387 5523 5615 15 268 213 C ATOM 1330 O GLU A 166 -2.302 33.437 24.868 1.00 43.70 O ANISOU 1330 O GLU A 166 5431 5554 5621 24 256 199 O ATOM 1331 CB GLU A 166 -3.210 30.459 23.992 1.00 44.78 C ANISOU 1331 CB GLU A 166 5543 5643 5830 -16 266 221 C ATOM 1332 CG GLU A 166 -1.688 30.404 23.941 1.00 45.85 C ANISOU 1332 CG GLU A 166 5700 5772 5946 -8 257 213 C ATOM 1333 CD GLU A 166 -1.141 28.992 23.850 1.00 47.05 C ANISOU 1333 CD GLU A 166 5858 5902 6119 -17 258 223 C ATOM 1334 OE1 GLU A 166 -0.042 28.750 24.394 1.00 47.34 O ANISOU 1334 OE1 GLU A 166 5909 5937 6139 -7 260 228 O ATOM 1335 OE2 GLU A 166 -1.800 28.127 23.233 1.00 48.01 O ANISOU 1335 OE2 GLU A 166 5966 6005 6272 -34 256 224 O ATOM 0 H GLU A 166 -2.583 32.718 22.546 1.00 41.68 H new ATOM 0 HA GLU A 166 -4.762 31.794 23.879 1.00 43.50 H new ATOM 0 HB2 GLU A 166 -3.509 30.081 24.834 1.00 44.78 H new ATOM 0 HB3 GLU A 166 -3.567 29.897 23.286 1.00 44.78 H new ATOM 0 HG2 GLU A 166 -1.378 30.914 23.177 1.00 45.85 H new ATOM 0 HG3 GLU A 166 -1.328 30.833 24.733 1.00 45.85 H new ATOM 1336 N PRO A 167 -4.067 32.772 26.111 1.00 43.24 N ANISOU 1336 N PRO A 167 5344 5507 5578 24 287 234 N ATOM 1337 CA PRO A 167 -3.757 33.669 27.218 1.00 42.86 C ANISOU 1337 CA PRO A 167 5305 5482 5497 48 294 238 C ATOM 1338 C PRO A 167 -2.659 33.134 28.146 1.00 42.45 C ANISOU 1338 C PRO A 167 5269 5430 5430 60 302 253 C ATOM 1339 O PRO A 167 -2.895 32.941 29.342 1.00 44.47 O ANISOU 1339 O PRO A 167 5522 5700 5675 74 321 275 O ATOM 1340 CB PRO A 167 -5.100 33.774 27.947 1.00 43.61 C ANISOU 1340 CB PRO A 167 5380 5595 5596 53 313 256 C ATOM 1341 CG PRO A 167 -5.706 32.430 27.752 1.00 43.56 C ANISOU 1341 CG PRO A 167 5357 5571 5623 32 324 274 C ATOM 1342 CD PRO A 167 -5.291 31.989 26.373 1.00 43.39 C ANISOU 1342 CD PRO A 167 5340 5523 5623 13 304 255 C ATOM 0 HA PRO A 167 -3.402 34.519 26.913 1.00 42.86 H new ATOM 0 HB2 PRO A 167 -4.981 33.979 28.888 1.00 43.61 H new ATOM 0 HB3 PRO A 167 -5.656 34.475 27.572 1.00 43.61 H new ATOM 0 HG2 PRO A 167 -5.393 31.806 28.426 1.00 43.56 H new ATOM 0 HG3 PRO A 167 -6.672 32.469 27.829 1.00 43.56 H new ATOM 0 HD2 PRO A 167 -5.118 31.035 26.341 1.00 43.39 H new ATOM 0 HD3 PRO A 167 -5.981 32.175 25.717 1.00 43.39 H new ATOM 1343 N ILE A 168 -1.464 32.912 27.600 1.00 40.77 N ANISOU 1343 N ILE A 168 5073 5204 5216 57 288 240 N ATOM 1344 CA ILE A 168 -0.332 32.425 28.393 1.00 39.99 C ANISOU 1344 CA ILE A 168 4990 5103 5103 69 293 250 C ATOM 1345 C ILE A 168 0.586 33.564 28.829 1.00 38.81 C ANISOU 1345 C ILE A 168 4855 4969 4920 90 283 236 C ATOM 1346 O ILE A 168 0.646 34.618 28.188 1.00 37.27 O ANISOU 1346 O ILE A 168 4663 4778 4718 90 267 214 O ATOM 1347 CB ILE A 168 0.504 31.355 27.648 1.00 41.02 C ANISOU 1347 CB ILE A 168 5127 5207 5250 55 285 247 C ATOM 1348 CG1 ILE A 168 1.114 31.909 26.353 1.00 40.80 C ANISOU 1348 CG1 ILE A 168 5107 5171 5224 46 262 218 C ATOM 1349 CG2 ILE A 168 -0.344 30.126 27.352 1.00 41.92 C ANISOU 1349 CG2 ILE A 168 5226 5303 5398 35 294 263 C ATOM 1350 CD1 ILE A 168 2.061 30.941 25.677 1.00 41.43 C ANISOU 1350 CD1 ILE A 168 5196 5230 5317 36 253 212 C ATOM 0 H ILE A 168 -1.286 33.038 26.768 1.00 40.77 H new ATOM 0 HA ILE A 168 -0.725 32.012 29.178 1.00 39.99 H new ATOM 0 HB ILE A 168 1.236 31.099 28.231 1.00 41.02 H new ATOM 0 HG12 ILE A 168 0.400 32.136 25.737 1.00 40.80 H new ATOM 0 HG13 ILE A 168 1.589 32.731 26.552 1.00 40.80 H new ATOM 0 HG21 ILE A 168 0.193 29.466 26.886 1.00 41.92 H new ATOM 0 HG22 ILE A 168 -0.668 29.748 28.184 1.00 41.92 H new ATOM 0 HG23 ILE A 168 -1.098 30.379 26.797 1.00 41.92 H new ATOM 0 HD11 ILE A 168 2.413 31.344 24.868 1.00 41.43 H new ATOM 0 HD12 ILE A 168 2.793 30.731 26.278 1.00 41.43 H new ATOM 0 HD13 ILE A 168 1.585 30.127 25.451 1.00 41.43 H new ATOM 1351 N SER A 169 1.293 33.339 29.930 1.00 37.28 N ANISOU 1351 N SER A 169 4673 4783 4708 108 291 248 N ATOM 1352 CA SER A 169 2.316 34.259 30.396 1.00 36.21 C ANISOU 1352 CA SER A 169 4554 4660 4545 128 280 235 C ATOM 1353 C SER A 169 3.667 33.672 30.019 1.00 35.60 C ANISOU 1353 C SER A 169 4490 4566 4469 124 270 227 C ATOM 1354 O SER A 169 3.977 32.545 30.394 1.00 35.16 O ANISOU 1354 O SER A 169 4438 4501 4422 123 279 244 O ATOM 1355 CB SER A 169 2.221 34.457 31.907 1.00 36.34 C ANISOU 1355 CB SER A 169 4573 4699 4537 154 294 251 C ATOM 1356 OG SER A 169 1.054 35.182 32.242 1.00 36.95 O ANISOU 1356 OG SER A 169 4637 4794 4608 161 301 254 O ATOM 0 H SER A 169 1.191 32.645 30.428 1.00 37.28 H new ATOM 0 HA SER A 169 2.197 35.129 29.984 1.00 36.21 H new ATOM 0 HB2 SER A 169 2.211 33.595 32.351 1.00 36.34 H new ATOM 0 HB3 SER A 169 3.005 34.931 32.226 1.00 36.34 H new ATOM 0 HG SER A 169 1.015 35.281 33.075 1.00 36.95 H new ATOM 1357 N VAL A 170 4.456 34.431 29.264 1.00 33.68 N ANISOU 1357 N VAL A 170 4255 4321 4222 121 250 203 N ATOM 1358 CA VAL A 170 5.721 33.936 28.733 1.00 32.87 C ANISOU 1358 CA VAL A 170 4164 4204 4123 116 239 194 C ATOM 1359 C VAL A 170 6.664 35.098 28.414 1.00 31.64 C ANISOU 1359 C VAL A 170 4017 4054 3951 122 221 170 C ATOM 1360 O VAL A 170 6.216 36.213 28.129 1.00 31.19 O ANISOU 1360 O VAL A 170 3956 4005 3888 123 213 159 O ATOM 1361 CB VAL A 170 5.471 33.070 27.477 1.00 33.21 C ANISOU 1361 CB VAL A 170 4199 4225 4193 91 236 191 C ATOM 1362 CG1 VAL A 170 4.960 33.923 26.325 1.00 33.11 C ANISOU 1362 CG1 VAL A 170 4181 4212 4187 79 224 172 C ATOM 1363 CG2 VAL A 170 6.721 32.298 27.086 1.00 33.45 C ANISOU 1363 CG2 VAL A 170 4241 4242 4228 88 229 185 C ATOM 0 H VAL A 170 4.274 35.243 29.046 1.00 33.68 H new ATOM 0 HA VAL A 170 6.145 33.383 29.408 1.00 32.87 H new ATOM 0 HB VAL A 170 4.784 32.420 27.691 1.00 33.21 H new ATOM 0 HG11 VAL A 170 4.810 33.362 25.548 1.00 33.11 H new ATOM 0 HG12 VAL A 170 4.127 34.349 26.582 1.00 33.11 H new ATOM 0 HG13 VAL A 170 5.617 34.603 26.110 1.00 33.11 H new ATOM 0 HG21 VAL A 170 6.538 31.764 26.297 1.00 33.45 H new ATOM 0 HG22 VAL A 170 7.440 32.921 26.895 1.00 33.45 H new ATOM 0 HG23 VAL A 170 6.984 31.716 27.816 1.00 33.45 H new ATOM 1364 N GLU A 171 7.966 34.824 28.492 1.00 30.27 N ANISOU 1364 N GLU A 171 3855 3875 3771 127 214 165 N ATOM 1365 CA GLU A 171 9.012 35.809 28.240 1.00 29.12 C ANISOU 1365 CA GLU A 171 3718 3734 3613 133 197 144 C ATOM 1366 C GLU A 171 9.768 35.325 27.005 1.00 27.92 C ANISOU 1366 C GLU A 171 3567 3566 3475 115 187 133 C ATOM 1367 O GLU A 171 10.541 34.376 27.083 1.00 27.44 O ANISOU 1367 O GLU A 171 3512 3497 3418 116 189 137 O ATOM 1368 CB GLU A 171 9.940 35.899 29.457 1.00 30.88 C ANISOU 1368 CB GLU A 171 3951 3967 3815 156 197 147 C ATOM 1369 CG GLU A 171 11.037 36.957 29.374 1.00 31.48 C ANISOU 1369 CG GLU A 171 4034 4048 3879 163 179 126 C ATOM 1370 CD GLU A 171 10.554 38.361 29.701 1.00 32.73 C ANISOU 1370 CD GLU A 171 4191 4220 4026 173 171 117 C ATOM 1371 OE1 GLU A 171 10.991 39.317 29.023 1.00 32.79 O ANISOU 1371 OE1 GLU A 171 4199 4225 4033 167 156 99 O ATOM 1372 OE2 GLU A 171 9.748 38.519 30.641 1.00 33.91 O ANISOU 1372 OE2 GLU A 171 4338 4382 4165 188 181 127 O ATOM 0 H GLU A 171 8.269 34.046 28.697 1.00 30.27 H new ATOM 0 HA GLU A 171 8.648 36.696 28.090 1.00 29.12 H new ATOM 0 HB2 GLU A 171 9.400 36.077 30.243 1.00 30.88 H new ATOM 0 HB3 GLU A 171 10.357 35.033 29.590 1.00 30.88 H new ATOM 0 HG2 GLU A 171 11.752 36.719 29.984 1.00 31.48 H new ATOM 0 HG3 GLU A 171 11.413 36.953 28.480 1.00 31.48 H new ATOM 1373 N VAL A 172 9.527 35.971 25.866 1.00 25.89 N ANISOU 1373 N VAL A 172 3306 3306 3225 101 177 119 N ATOM 1374 CA VAL A 172 9.982 35.462 24.574 1.00 25.31 C ANISOU 1374 CA VAL A 172 3232 3219 3166 85 170 110 C ATOM 1375 C VAL A 172 11.180 36.249 24.057 1.00 24.27 C ANISOU 1375 C VAL A 172 3106 3089 3025 85 156 92 C ATOM 1376 O VAL A 172 11.156 37.475 24.026 1.00 24.14 O ANISOU 1376 O VAL A 172 3091 3081 3000 88 147 84 O ATOM 1377 CB VAL A 172 8.844 35.527 23.542 1.00 25.31 C ANISOU 1377 CB VAL A 172 3222 3213 3181 68 169 107 C ATOM 1378 CG1 VAL A 172 9.249 34.832 22.249 1.00 25.85 C ANISOU 1378 CG1 VAL A 172 3291 3268 3264 53 162 98 C ATOM 1379 CG2 VAL A 172 7.579 34.901 24.122 1.00 25.29 C ANISOU 1379 CG2 VAL A 172 3211 3211 3189 68 184 124 C ATOM 0 H VAL A 172 9.097 36.714 25.820 1.00 25.89 H new ATOM 0 HA VAL A 172 10.252 34.539 24.702 1.00 25.31 H new ATOM 0 HB VAL A 172 8.663 36.457 23.335 1.00 25.31 H new ATOM 0 HG11 VAL A 172 8.520 34.883 21.612 1.00 25.85 H new ATOM 0 HG12 VAL A 172 10.033 35.268 21.879 1.00 25.85 H new ATOM 0 HG13 VAL A 172 9.453 33.901 22.432 1.00 25.85 H new ATOM 0 HG21 VAL A 172 6.866 34.945 23.466 1.00 25.29 H new ATOM 0 HG22 VAL A 172 7.751 33.974 24.349 1.00 25.29 H new ATOM 0 HG23 VAL A 172 7.315 35.385 24.920 1.00 25.29 H new ATOM 1380 N ARG A 173 12.219 35.540 23.624 1.00 23.71 N ANISOU 1380 N ARG A 173 3039 3011 2957 82 152 88 N ATOM 1381 CA ARG A 173 13.459 36.188 23.238 1.00 23.97 C ANISOU 1381 CA ARG A 173 3076 3047 2982 82 140 74 C ATOM 1382 C ARG A 173 13.818 35.986 21.780 1.00 22.87 C ANISOU 1382 C ARG A 173 2935 2901 2853 67 134 63 C ATOM 1383 O ARG A 173 13.515 34.957 21.178 1.00 22.25 O ANISOU 1383 O ARG A 173 2855 2813 2788 59 137 65 O ATOM 1384 CB ARG A 173 14.586 35.726 24.155 1.00 25.91 C ANISOU 1384 CB ARG A 173 3330 3296 3220 97 141 76 C ATOM 1385 CG ARG A 173 14.518 36.448 25.490 1.00 27.56 C ANISOU 1385 CG ARG A 173 3543 3517 3414 115 142 80 C ATOM 1386 CD ARG A 173 14.835 35.563 26.667 1.00 28.71 C ANISOU 1386 CD ARG A 173 3693 3663 3552 131 150 91 C ATOM 1387 NE ARG A 173 14.702 36.310 27.918 1.00 29.72 N ANISOU 1387 NE ARG A 173 3825 3805 3664 151 150 94 N ATOM 1388 CZ ARG A 173 15.304 35.990 29.061 1.00 30.74 C ANISOU 1388 CZ ARG A 173 3960 3939 3780 170 153 99 C ATOM 1389 NH1 ARG A 173 16.096 34.926 29.137 1.00 31.77 N ANISOU 1389 NH1 ARG A 173 4096 4063 3913 173 155 103 N ATOM 1390 NH2 ARG A 173 15.114 36.744 30.134 1.00 30.56 N ANISOU 1390 NH2 ARG A 173 3940 3929 3741 189 151 100 N ATOM 0 H ARG A 173 12.222 34.683 23.548 1.00 23.71 H new ATOM 0 HA ARG A 173 13.327 37.143 23.341 1.00 23.97 H new ATOM 0 HB2 ARG A 173 14.523 34.768 24.296 1.00 25.91 H new ATOM 0 HB3 ARG A 173 15.443 35.895 23.733 1.00 25.91 H new ATOM 0 HG2 ARG A 173 15.138 37.194 25.479 1.00 27.56 H new ATOM 0 HG3 ARG A 173 13.629 36.820 25.604 1.00 27.56 H new ATOM 0 HD2 ARG A 173 14.237 34.799 26.675 1.00 28.71 H new ATOM 0 HD3 ARG A 173 15.737 35.217 26.585 1.00 28.71 H new ATOM 0 HE ARG A 173 14.198 37.007 27.914 1.00 29.72 H new ATOM 0 HH11 ARG A 173 16.225 34.435 28.443 1.00 31.77 H new ATOM 0 HH12 ARG A 173 16.480 34.728 29.881 1.00 31.77 H new ATOM 0 HH21 ARG A 173 14.604 37.435 30.089 1.00 30.56 H new ATOM 0 HH22 ARG A 173 15.500 36.542 30.875 1.00 30.56 H new ATOM 1391 N GLY A 174 14.471 36.994 21.225 1.00 22.45 N ANISOU 1391 N GLY A 174 2883 2852 2794 64 124 51 N ATOM 1392 CA GLY A 174 14.785 37.000 19.817 1.00 22.46 C ANISOU 1392 CA GLY A 174 2883 2851 2801 51 118 42 C ATOM 1393 C GLY A 174 15.641 38.178 19.435 1.00 22.00 C ANISOU 1393 C GLY A 174 2825 2799 2735 50 108 32 C ATOM 1394 O GLY A 174 16.381 38.722 20.261 1.00 21.26 O ANISOU 1394 O GLY A 174 2735 2711 2634 59 105 30 O ATOM 0 H GLY A 174 14.742 37.688 21.655 1.00 22.45 H new ATOM 0 HA2 GLY A 174 15.245 36.178 19.586 1.00 22.46 H new ATOM 0 HA3 GLY A 174 13.963 37.019 19.303 1.00 22.46 H new ATOM 1395 N AGLU A 175 15.569 38.555 18.161 0.50 22.04 N ANISOU 1395 N AGLU A 175 2828 2803 2744 38 103 26 N ATOM 1396 N BGLU A 175 15.495 38.595 18.182 0.50 22.00 N ANISOU 1396 N BGLU A 175 2823 2798 2738 38 103 26 N ATOM 1397 CA AGLU A 175 16.278 39.725 17.658 0.50 22.54 C ANISOU 1397 CA AGLU A 175 2892 2872 2801 34 95 19 C ATOM 1398 CA BGLU A 175 16.271 39.684 17.627 0.50 22.49 C ANISOU 1398 CA BGLU A 175 2885 2866 2795 34 95 19 C ATOM 1399 C AGLU A 175 15.343 40.655 16.921 0.50 21.88 C ANISOU 1399 C AGLU A 175 2807 2788 2719 26 91 18 C ATOM 1400 C BGLU A 175 15.355 40.650 16.896 0.50 21.85 C ANISOU 1400 C BGLU A 175 2803 2784 2715 26 91 18 C ATOM 1401 O AGLU A 175 14.381 40.215 16.289 0.50 21.81 O ANISOU 1401 O AGLU A 175 2796 2775 2715 20 93 19 O ATOM 1402 O BGLU A 175 14.403 40.224 16.241 0.50 21.78 O ANISOU 1402 O BGLU A 175 2792 2771 2711 20 93 18 O ATOM 1403 CB AGLU A 175 17.407 39.333 16.705 0.50 23.76 C ANISOU 1403 CB AGLU A 175 3044 3027 2955 28 93 13 C ATOM 1404 CB BGLU A 175 17.289 39.129 16.639 0.50 23.66 C ANISOU 1404 CB BGLU A 175 3032 3014 2944 28 94 13 C ATOM 1405 CG AGLU A 175 18.794 39.508 17.290 0.50 24.51 C ANISOU 1405 CG AGLU A 175 3139 3127 3046 34 91 9 C ATOM 1406 CG BGLU A 175 18.483 40.034 16.420 0.50 24.63 C ANISOU 1406 CG BGLU A 175 3153 3143 3061 26 88 8 C ATOM 1407 CD AGLU A 175 19.145 38.393 18.240 0.50 25.79 C ANISOU 1407 CD AGLU A 175 3303 3287 3207 46 96 12 C ATOM 1408 CD BGLU A 175 19.564 39.813 17.453 0.50 25.17 C ANISOU 1408 CD BGLU A 175 3223 3215 3128 36 88 7 C ATOM 1409 OE1AGLU A 175 20.016 38.588 19.114 0.50 26.83 O ANISOU 1409 OE1AGLU A 175 3436 3423 3335 55 93 10 O ATOM 1410 OE1BGLU A 175 19.341 39.032 18.400 0.50 27.02 O ANISOU 1410 OE1BGLU A 175 3460 3447 3362 46 92 11 O ATOM 1411 OE2AGLU A 175 18.545 37.313 18.101 0.50 27.13 O ANISOU 1411 OE2AGLU A 175 3474 3451 3383 45 101 16 O ATOM 1412 OE2BGLU A 175 20.640 40.414 17.311 0.50 26.59 O ANISOU 1412 OE2BGLU A 175 3399 3399 3305 34 83 2 O ATOM 0 H AGLU A 175 15.108 38.139 17.566 0.50 22.00 H new ATOM 0 H BGLU A 175 14.936 38.247 17.629 0.50 22.00 H new ATOM 0 HA AGLU A 175 16.649 40.174 18.434 0.50 22.49 H new ATOM 0 HA BGLU A 175 16.725 40.148 18.348 0.50 22.49 H new ATOM 0 HB2AGLU A 175 17.290 38.406 16.444 0.50 23.66 H new ATOM 0 HB2BGLU A 175 17.601 38.268 16.958 0.50 23.66 H new ATOM 0 HB3AGLU A 175 17.337 39.866 15.898 0.50 23.66 H new ATOM 0 HB3BGLU A 175 16.850 38.974 15.788 0.50 23.66 H new ATOM 0 HG2AGLU A 175 19.446 39.539 16.573 0.50 24.63 H new ATOM 0 HG2BGLU A 175 18.847 39.878 15.535 0.50 24.63 H new ATOM 0 HG3AGLU A 175 18.844 40.357 17.756 0.50 24.63 H new ATOM 0 HG3BGLU A 175 18.195 40.960 16.449 0.50 24.63 H new ATOM 1413 N CYS A 176 15.642 41.944 17.020 1.00 21.58 N ANISOU 1413 N CYS A 176 2771 2754 2676 26 83 15 N ATOM 1414 CA CYS A 176 15.003 42.969 16.210 1.00 21.65 C ANISOU 1414 CA CYS A 176 2780 2762 2684 18 77 14 C ATOM 1415 C CYS A 176 16.097 43.537 15.312 1.00 21.42 C ANISOU 1415 C CYS A 176 2750 2735 2654 10 72 10 C ATOM 1416 O CYS A 176 17.201 43.808 15.775 1.00 22.15 O ANISOU 1416 O CYS A 176 2843 2830 2745 13 69 9 O ATOM 1417 CB CYS A 176 14.405 44.060 17.089 1.00 22.19 C ANISOU 1417 CB CYS A 176 2850 2831 2749 25 71 14 C ATOM 1418 SG CYS A 176 13.566 45.353 16.153 1.00 22.60 S ANISOU 1418 SG CYS A 176 2904 2882 2802 18 62 12 S ATOM 0 H ACYS A 176 16.230 42.251 17.567 0.50 21.58 H new ATOM 0 H BCYS A 176 16.217 42.250 17.581 0.50 21.58 H new ATOM 0 HA CYS A 176 14.272 42.602 15.689 1.00 21.65 H new ATOM 0 HB2 CYS A 176 13.776 43.658 17.709 1.00 22.19 H new ATOM 0 HB3 CYS A 176 15.110 44.461 17.621 1.00 22.19 H new ATOM 0 HG CYS A 176 13.181 44.906 15.108 1.00 22.60 H new ATOM 1419 N TYR A 177 15.799 43.682 14.027 1.00 20.76 N ANISOU 1419 N TYR A 177 2666 2651 2570 1 71 9 N ATOM 1420 CA TYR A 177 16.783 44.111 13.048 1.00 20.34 C ANISOU 1420 CA TYR A 177 2612 2602 2515 -7 69 8 C ATOM 1421 C TYR A 177 16.173 45.094 12.054 1.00 20.37 C ANISOU 1421 C TYR A 177 2618 2604 2517 -14 63 10 C ATOM 1422 O TYR A 177 14.949 45.205 11.940 1.00 20.45 O ANISOU 1422 O TYR A 177 2630 2611 2528 -13 62 10 O ATOM 1423 CB TYR A 177 17.352 42.889 12.302 1.00 20.02 C ANISOU 1423 CB TYR A 177 2568 2564 2474 -8 75 6 C ATOM 1424 CG TYR A 177 16.333 42.163 11.447 1.00 19.71 C ANISOU 1424 CG TYR A 177 2530 2523 2437 -10 77 4 C ATOM 1425 CD1 TYR A 177 15.561 41.131 11.965 1.00 19.85 C ANISOU 1425 CD1 TYR A 177 2547 2535 2461 -5 81 3 C ATOM 1426 CD2 TYR A 177 16.133 42.522 10.118 1.00 20.05 C ANISOU 1426 CD2 TYR A 177 2574 2569 2476 -16 75 2 C ATOM 1427 CE1 TYR A 177 14.623 40.470 11.181 1.00 19.66 C ANISOU 1427 CE1 TYR A 177 2522 2508 2441 -7 81 0 C ATOM 1428 CE2 TYR A 177 15.190 41.873 9.333 1.00 20.17 C ANISOU 1428 CE2 TYR A 177 2589 2582 2493 -16 75 -2 C ATOM 1429 CZ TYR A 177 14.445 40.842 9.867 1.00 20.35 C ANISOU 1429 CZ TYR A 177 2610 2598 2524 -12 77 -4 C ATOM 1430 OH TYR A 177 13.511 40.177 9.099 1.00 20.49 O ANISOU 1430 OH TYR A 177 2626 2612 2546 -13 76 -9 O ATOM 0 H TYR A 177 15.018 43.534 13.699 1.00 20.76 H new ATOM 0 HA TYR A 177 17.502 44.562 13.517 1.00 20.34 H new ATOM 0 HB2 TYR A 177 18.087 43.178 11.739 1.00 20.02 H new ATOM 0 HB3 TYR A 177 17.719 42.268 12.950 1.00 20.02 H new ATOM 0 HD1 TYR A 177 15.674 40.878 12.853 1.00 19.85 H new ATOM 0 HD2 TYR A 177 16.640 43.209 9.749 1.00 20.05 H new ATOM 0 HE1 TYR A 177 14.117 39.779 11.543 1.00 19.66 H new ATOM 0 HE2 TYR A 177 15.061 42.133 8.449 1.00 20.17 H new ATOM 0 HH TYR A 177 13.568 40.436 8.302 1.00 20.49 H new ATOM 1431 N MET A 178 17.039 45.794 11.328 1.00 20.93 N ANISOU 1431 N MET A 178 2688 2678 2585 -21 61 12 N ATOM 1432 CA MET A 178 16.622 46.629 10.209 1.00 20.80 C ANISOU 1432 CA MET A 178 2675 2661 2565 -28 57 15 C ATOM 1433 C MET A 178 17.032 45.924 8.918 1.00 20.68 C ANISOU 1433 C MET A 178 2658 2654 2546 -31 63 15 C ATOM 1434 O MET A 178 18.214 45.660 8.720 1.00 20.44 O ANISOU 1434 O MET A 178 2623 2629 2513 -33 68 15 O ATOM 1435 CB MET A 178 17.287 48.002 10.284 1.00 20.70 C ANISOU 1435 CB MET A 178 2664 2647 2555 -33 50 20 C ATOM 1436 CG MET A 178 16.899 48.927 9.138 1.00 21.30 C ANISOU 1436 CG MET A 178 2744 2722 2628 -40 46 26 C ATOM 1437 SD MET A 178 17.409 50.639 9.331 1.00 21.21 S ANISOU 1437 SD MET A 178 2734 2703 2621 -47 36 33 S ATOM 1438 CE MET A 178 16.577 51.105 10.856 1.00 21.64 C ANISOU 1438 CE MET A 178 2792 2749 2680 -37 26 26 C ATOM 0 H MET A 178 17.887 45.797 11.472 1.00 20.93 H new ATOM 0 HA MET A 178 15.661 46.761 10.237 1.00 20.80 H new ATOM 0 HB2 MET A 178 17.050 48.423 11.125 1.00 20.70 H new ATOM 0 HB3 MET A 178 18.250 47.887 10.286 1.00 20.70 H new ATOM 0 HG2 MET A 178 17.283 48.581 8.317 1.00 21.30 H new ATOM 0 HG3 MET A 178 15.935 48.901 9.033 1.00 21.30 H new ATOM 0 HE1 MET A 178 16.203 51.995 10.762 1.00 21.64 H new ATOM 0 HE2 MET A 178 15.865 50.473 11.042 1.00 21.64 H new ATOM 0 HE3 MET A 178 17.214 51.098 11.587 1.00 21.64 H new ATOM 1439 N PRO A 179 16.062 45.608 8.034 1.00 20.83 N ANISOU 1439 N PRO A 179 2679 2673 2561 -31 63 12 N ATOM 1440 CA PRO A 179 16.429 44.988 6.757 1.00 21.20 C ANISOU 1440 CA PRO A 179 2725 2728 2602 -31 67 10 C ATOM 1441 C PRO A 179 17.492 45.790 6.008 1.00 21.23 C ANISOU 1441 C PRO A 179 2727 2739 2599 -38 69 18 C ATOM 1442 O PRO A 179 17.505 47.025 6.078 1.00 21.27 O ANISOU 1442 O PRO A 179 2736 2740 2605 -43 64 25 O ATOM 1443 CB PRO A 179 15.109 44.979 5.974 1.00 21.44 C ANISOU 1443 CB PRO A 179 2760 2756 2631 -30 63 7 C ATOM 1444 CG PRO A 179 14.048 45.013 7.020 1.00 21.34 C ANISOU 1444 CG PRO A 179 2748 2735 2626 -27 59 5 C ATOM 1445 CD PRO A 179 14.609 45.821 8.152 1.00 21.23 C ANISOU 1445 CD PRO A 179 2734 2718 2615 -28 58 10 C ATOM 0 HA PRO A 179 16.817 44.107 6.878 1.00 21.20 H new ATOM 0 HB2 PRO A 179 15.045 45.745 5.382 1.00 21.44 H new ATOM 0 HB3 PRO A 179 15.033 44.186 5.421 1.00 21.44 H new ATOM 0 HG2 PRO A 179 13.235 45.415 6.677 1.00 21.34 H new ATOM 0 HG3 PRO A 179 13.820 44.117 7.313 1.00 21.34 H new ATOM 0 HD2 PRO A 179 14.377 46.759 8.071 1.00 21.23 H new ATOM 0 HD3 PRO A 179 14.271 45.518 9.009 1.00 21.23 H new ATOM 1446 N LYS A 180 18.370 45.090 5.295 1.00 21.29 N ANISOU 1446 N LYS A 180 2731 2757 2601 -37 75 16 N ATOM 1447 CA LYS A 180 19.492 45.719 4.593 1.00 21.66 C ANISOU 1447 CA LYS A 180 2775 2814 2642 -42 80 24 C ATOM 1448 C LYS A 180 19.054 46.828 3.632 1.00 22.31 C ANISOU 1448 C LYS A 180 2862 2896 2717 -47 77 34 C ATOM 1449 O LYS A 180 19.699 47.872 3.553 1.00 21.70 O ANISOU 1449 O LYS A 180 2784 2820 2642 -55 77 44 O ATOM 1450 CB LYS A 180 20.280 44.676 3.800 1.00 22.16 C ANISOU 1450 CB LYS A 180 2833 2890 2697 -38 87 20 C ATOM 1451 CG LYS A 180 20.995 43.612 4.624 1.00 22.58 C ANISOU 1451 CG LYS A 180 2880 2944 2756 -33 91 12 C ATOM 1452 CD LYS A 180 21.627 42.594 3.687 1.00 22.93 C ANISOU 1452 CD LYS A 180 2920 3001 2791 -26 97 6 C ATOM 1453 CE LYS A 180 22.059 41.318 4.379 1.00 23.48 C ANISOU 1453 CE LYS A 180 2986 3069 2865 -19 98 -4 C ATOM 1454 NZ LYS A 180 22.384 40.269 3.372 1.00 23.19 N ANISOU 1454 NZ LYS A 180 2948 3044 2820 -10 101 -13 N ATOM 0 H LYS A 180 18.334 44.236 5.203 1.00 21.29 H new ATOM 0 HA LYS A 180 20.046 46.119 5.282 1.00 21.66 H new ATOM 0 HB2 LYS A 180 19.671 44.232 3.189 1.00 22.16 H new ATOM 0 HB3 LYS A 180 20.939 45.137 3.258 1.00 22.16 H new ATOM 0 HG2 LYS A 180 21.676 44.022 5.180 1.00 22.58 H new ATOM 0 HG3 LYS A 180 20.368 43.173 5.220 1.00 22.58 H new ATOM 0 HD2 LYS A 180 20.994 42.374 2.986 1.00 22.93 H new ATOM 0 HD3 LYS A 180 22.398 42.996 3.257 1.00 22.93 H new ATOM 0 HE2 LYS A 180 22.834 41.491 4.937 1.00 23.48 H new ATOM 0 HE3 LYS A 180 21.352 41.005 4.965 1.00 23.48 H new ATOM 0 HZ1 LYS A 180 22.921 39.661 3.739 1.00 23.19 H new ATOM 0 HZ2 LYS A 180 21.633 39.875 3.100 1.00 23.19 H new ATOM 0 HZ3 LYS A 180 22.792 40.643 2.675 1.00 23.19 H new ATOM 1455 N GLN A 181 17.971 46.590 2.896 1.00 22.93 N ANISOU 1455 N GLN A 181 2947 2974 2790 -42 74 29 N ATOM 1456 CA GLN A 181 17.469 47.576 1.932 1.00 23.88 C ANISOU 1456 CA GLN A 181 3075 3097 2903 -44 70 37 C ATOM 1457 C GLN A 181 16.997 48.857 2.624 1.00 22.97 C ANISOU 1457 C GLN A 181 2963 2968 2795 -50 62 44 C ATOM 1458 O GLN A 181 17.225 49.960 2.119 1.00 23.16 O ANISOU 1458 O GLN A 181 2992 2992 2817 -56 60 56 O ATOM 1459 CB GLN A 181 16.352 46.975 1.067 1.00 25.56 C ANISOU 1459 CB GLN A 181 3291 3311 3108 -36 66 28 C ATOM 1460 CG GLN A 181 16.830 45.873 0.125 1.00 27.45 C ANISOU 1460 CG GLN A 181 3528 3564 3337 -29 72 22 C ATOM 1461 CD GLN A 181 15.698 45.012 -0.412 1.00 29.79 C ANISOU 1461 CD GLN A 181 3828 3860 3632 -19 66 8 C ATOM 1462 OE1 GLN A 181 14.677 45.523 -0.859 1.00 31.39 O ANISOU 1462 OE1 GLN A 181 4037 4059 3832 -17 59 7 O ATOM 1463 NE2 GLN A 181 15.875 43.691 -0.361 1.00 31.26 N ANISOU 1463 NE2 GLN A 181 4009 4048 3821 -13 68 -4 N ATOM 0 H GLN A 181 17.510 45.865 2.937 1.00 22.93 H new ATOM 0 HA GLN A 181 18.208 47.817 1.351 1.00 23.88 H new ATOM 0 HB2 GLN A 181 15.662 46.617 1.647 1.00 25.56 H new ATOM 0 HB3 GLN A 181 15.943 47.682 0.544 1.00 25.56 H new ATOM 0 HG2 GLN A 181 17.304 46.275 -0.620 1.00 27.45 H new ATOM 0 HG3 GLN A 181 17.464 45.308 0.593 1.00 27.45 H new ATOM 0 HE21 GLN A 181 16.604 43.367 -0.041 1.00 31.26 H new ATOM 0 HE22 GLN A 181 15.260 43.163 -0.648 1.00 31.26 H new ATOM 1464 N SER A 182 16.347 48.706 3.777 1.00 22.85 N ANISOU 1464 N SER A 182 2949 2943 2790 -48 57 37 N ATOM 1465 CA SER A 182 15.890 49.849 4.570 1.00 22.52 C ANISOU 1465 CA SER A 182 2911 2889 2755 -50 48 41 C ATOM 1466 C SER A 182 17.052 50.641 5.160 1.00 21.80 C ANISOU 1466 C SER A 182 2816 2795 2671 -58 47 49 C ATOM 1467 O SER A 182 16.996 51.869 5.226 1.00 21.29 O ANISOU 1467 O SER A 182 2756 2722 2610 -63 40 56 O ATOM 1468 CB SER A 182 14.949 49.390 5.686 1.00 23.25 C ANISOU 1468 CB SER A 182 3004 2975 2856 -44 44 31 C ATOM 1469 OG SER A 182 13.735 48.894 5.141 1.00 24.74 O ANISOU 1469 OG SER A 182 3195 3164 3041 -39 42 25 O ATOM 0 H SER A 182 16.159 47.941 4.121 1.00 22.85 H new ATOM 0 HA SER A 182 15.409 50.437 3.968 1.00 22.52 H new ATOM 0 HB2 SER A 182 15.378 48.699 6.215 1.00 23.25 H new ATOM 0 HB3 SER A 182 14.763 50.130 6.284 1.00 23.25 H new ATOM 0 HG SER A 182 13.881 48.165 4.749 1.00 24.74 H new ATOM 1470 N PHE A 183 18.088 49.931 5.599 1.00 20.42 N ANISOU 1470 N PHE A 183 2634 2626 2499 -59 54 46 N ATOM 1471 CA PHE A 183 19.288 50.550 6.151 1.00 20.71 C ANISOU 1471 CA PHE A 183 2665 2661 2544 -65 54 52 C ATOM 1472 C PHE A 183 19.963 51.482 5.147 1.00 20.98 C ANISOU 1472 C PHE A 183 2698 2698 2576 -76 56 66 C ATOM 1473 O PHE A 183 20.281 52.634 5.465 1.00 20.13 O ANISOU 1473 O PHE A 183 2590 2581 2477 -83 49 73 O ATOM 1474 CB PHE A 183 20.282 49.478 6.606 1.00 20.96 C ANISOU 1474 CB PHE A 183 2687 2700 2576 -63 62 46 C ATOM 1475 CG PHE A 183 21.679 49.992 6.806 1.00 21.29 C ANISOU 1475 CG PHE A 183 2720 2744 2624 -71 63 52 C ATOM 1476 CD1 PHE A 183 22.680 49.691 5.893 1.00 21.50 C ANISOU 1476 CD1 PHE A 183 2740 2784 2646 -75 73 57 C ATOM 1477 CD2 PHE A 183 21.992 50.795 7.894 1.00 21.71 C ANISOU 1477 CD2 PHE A 183 2772 2787 2690 -73 54 51 C ATOM 1478 CE1 PHE A 183 23.966 50.170 6.072 1.00 21.95 C ANISOU 1478 CE1 PHE A 183 2786 2843 2711 -83 75 63 C ATOM 1479 CE2 PHE A 183 23.275 51.276 8.076 1.00 22.00 C ANISOU 1479 CE2 PHE A 183 2799 2825 2735 -81 54 56 C ATOM 1480 CZ PHE A 183 24.263 50.963 7.166 1.00 21.93 C ANISOU 1480 CZ PHE A 183 2782 2829 2722 -86 65 62 C ATOM 0 H PHE A 183 18.114 49.072 5.585 1.00 20.42 H new ATOM 0 HA PHE A 183 19.011 51.081 6.914 1.00 20.71 H new ATOM 0 HB2 PHE A 183 19.967 49.089 7.437 1.00 20.96 H new ATOM 0 HB3 PHE A 183 20.300 48.765 5.948 1.00 20.96 H new ATOM 0 HD1 PHE A 183 22.485 49.162 5.153 1.00 21.50 H new ATOM 0 HD2 PHE A 183 21.329 51.012 8.509 1.00 21.71 H new ATOM 0 HE1 PHE A 183 24.631 49.959 5.457 1.00 21.95 H new ATOM 0 HE2 PHE A 183 23.472 51.810 8.811 1.00 22.00 H new ATOM 0 HZ PHE A 183 25.127 51.284 7.288 1.00 21.93 H new ATOM 1481 N VAL A 184 20.202 50.978 3.936 1.00 21.15 N ANISOU 1481 N VAL A 184 2718 2732 2585 -75 65 70 N ATOM 1482 CA VAL A 184 20.895 51.796 2.940 1.00 21.93 C ANISOU 1482 CA VAL A 184 2815 2836 2680 -84 70 85 C ATOM 1483 C VAL A 184 20.069 53.030 2.575 1.00 21.91 C ANISOU 1483 C VAL A 184 2823 2823 2678 -88 61 94 C ATOM 1484 O VAL A 184 20.619 54.124 2.432 1.00 22.28 O ANISOU 1484 O VAL A 184 2870 2864 2732 -98 59 108 O ATOM 1485 CB VAL A 184 21.319 50.997 1.681 1.00 22.12 C ANISOU 1485 CB VAL A 184 2836 2879 2689 -81 83 87 C ATOM 1486 CG1 VAL A 184 22.347 49.934 2.062 1.00 22.69 C ANISOU 1486 CG1 VAL A 184 2897 2962 2763 -78 91 80 C ATOM 1487 CG2 VAL A 184 20.119 50.373 0.975 1.00 22.31 C ANISOU 1487 CG2 VAL A 184 2869 2907 2701 -70 81 79 C ATOM 0 H VAL A 184 19.979 50.189 3.676 1.00 21.15 H new ATOM 0 HA VAL A 184 21.721 52.094 3.353 1.00 21.93 H new ATOM 0 HB VAL A 184 21.725 51.615 1.053 1.00 22.12 H new ATOM 0 HG11 VAL A 184 22.608 49.438 1.271 1.00 22.69 H new ATOM 0 HG12 VAL A 184 23.128 50.362 2.447 1.00 22.69 H new ATOM 0 HG13 VAL A 184 21.959 49.326 2.711 1.00 22.69 H new ATOM 0 HG21 VAL A 184 20.421 49.883 0.195 1.00 22.31 H new ATOM 0 HG22 VAL A 184 19.666 49.767 1.582 1.00 22.31 H new ATOM 0 HG23 VAL A 184 19.506 51.072 0.699 1.00 22.31 H new ATOM 1488 N ALA A 185 18.753 52.858 2.442 1.00 22.07 N ANISOU 1488 N ALA A 185 2853 2840 2693 -79 55 87 N ATOM 1489 CA ALA A 185 17.844 53.979 2.198 1.00 22.15 C ANISOU 1489 CA ALA A 185 2874 2839 2704 -80 44 93 C ATOM 1490 C ALA A 185 17.856 54.998 3.338 1.00 21.70 C ANISOU 1490 C ALA A 185 2818 2765 2662 -85 32 94 C ATOM 1491 O ALA A 185 17.893 56.203 3.103 1.00 22.10 O ANISOU 1491 O ALA A 185 2874 2806 2718 -92 25 105 O ATOM 1492 CB ALA A 185 16.428 53.470 1.974 1.00 22.43 C ANISOU 1492 CB ALA A 185 2917 2874 2732 -69 39 82 C ATOM 0 H ALA A 185 18.364 52.093 2.490 1.00 22.07 H new ATOM 0 HA ALA A 185 18.159 54.432 1.400 1.00 22.15 H new ATOM 0 HB1 ALA A 185 15.836 54.221 1.814 1.00 22.43 H new ATOM 0 HB2 ALA A 185 16.414 52.878 1.206 1.00 22.43 H new ATOM 0 HB3 ALA A 185 16.130 52.986 2.760 1.00 22.43 H new ATOM 1493 N LEU A 186 17.820 54.510 4.575 1.00 21.84 N ANISOU 1493 N LEU A 186 2832 2779 2688 -81 29 81 N ATOM 1494 CA LEU A 186 17.847 55.388 5.744 1.00 21.98 C ANISOU 1494 CA LEU A 186 2850 2783 2720 -82 17 79 C ATOM 1495 C LEU A 186 19.118 56.231 5.786 1.00 22.27 C ANISOU 1495 C LEU A 186 2880 2814 2767 -94 16 90 C ATOM 1496 O LEU A 186 19.061 57.435 6.022 1.00 22.44 O ANISOU 1496 O LEU A 186 2906 2821 2798 -99 4 95 O ATOM 1497 CB LEU A 186 17.724 54.561 7.028 1.00 22.19 C ANISOU 1497 CB LEU A 186 2872 2810 2750 -73 17 64 C ATOM 1498 CG LEU A 186 17.838 55.330 8.348 1.00 22.47 C ANISOU 1498 CG LEU A 186 2908 2833 2797 -71 4 59 C ATOM 1499 CD1 LEU A 186 16.774 56.416 8.426 1.00 23.96 C ANISOU 1499 CD1 LEU A 186 3106 3010 2988 -68 -10 59 C ATOM 1500 CD2 LEU A 186 17.711 54.355 9.512 1.00 22.38 C ANISOU 1500 CD2 LEU A 186 2891 2825 2785 -60 6 47 C ATOM 0 H LEU A 186 17.780 53.671 4.760 1.00 21.84 H new ATOM 0 HA LEU A 186 17.092 55.993 5.676 1.00 21.98 H new ATOM 0 HB2 LEU A 186 16.868 54.105 7.015 1.00 22.19 H new ATOM 0 HB3 LEU A 186 18.411 53.876 7.015 1.00 22.19 H new ATOM 0 HG LEU A 186 18.705 55.763 8.395 1.00 22.47 H new ATOM 0 HD11 LEU A 186 16.859 56.893 9.266 1.00 23.96 H new ATOM 0 HD12 LEU A 186 16.890 57.036 7.689 1.00 23.96 H new ATOM 0 HD13 LEU A 186 15.894 56.012 8.372 1.00 23.96 H new ATOM 0 HD21 LEU A 186 17.783 54.839 10.349 1.00 22.38 H new ATOM 0 HD22 LEU A 186 16.850 53.910 9.469 1.00 22.38 H new ATOM 0 HD23 LEU A 186 18.419 53.694 9.460 1.00 22.38 H new ATOM 1501 N ASN A 187 20.262 55.593 5.546 1.00 22.14 N ANISOU 1501 N ASN A 187 2854 2809 2750 -99 28 93 N ATOM 1502 CA ASN A 187 21.533 56.293 5.556 1.00 23.01 C ANISOU 1502 CA ASN A 187 2955 2916 2872 -112 28 104 C ATOM 1503 C ASN A 187 21.592 57.401 4.518 1.00 23.47 C ANISOU 1503 C ASN A 187 3018 2969 2931 -123 27 122 C ATOM 1504 O ASN A 187 22.161 58.463 4.783 1.00 24.33 O ANISOU 1504 O ASN A 187 3124 3065 3055 -133 19 131 O ATOM 1505 CB ASN A 187 22.712 55.320 5.385 1.00 23.08 C ANISOU 1505 CB ASN A 187 2950 2940 2878 -114 42 103 C ATOM 1506 CG ASN A 187 23.349 54.927 6.712 1.00 23.48 C ANISOU 1506 CG ASN A 187 2993 2989 2940 -111 38 91 C ATOM 1507 OD1 ASN A 187 22.890 55.335 7.790 1.00 23.18 O ANISOU 1507 OD1 ASN A 187 2960 2939 2910 -105 25 82 O ATOM 1508 ND2 ASN A 187 24.418 54.137 6.641 1.00 22.11 N ANISOU 1508 ND2 ASN A 187 2807 2828 2764 -112 49 89 N ATOM 0 H ASN A 187 20.318 54.752 5.375 1.00 22.14 H new ATOM 0 HA ASN A 187 21.610 56.712 6.427 1.00 23.01 H new ATOM 0 HB2 ASN A 187 22.403 54.521 4.930 1.00 23.08 H new ATOM 0 HB3 ASN A 187 23.384 55.729 4.817 1.00 23.08 H new ATOM 0 HD21 ASN A 187 24.819 53.890 7.361 1.00 22.11 H new ATOM 0 HD22 ASN A 187 24.708 53.874 5.875 1.00 22.11 H new ATOM 1509 N GLU A 188 20.995 57.168 3.350 1.00 23.45 N ANISOU 1509 N GLU A 188 3023 2976 2913 -119 35 129 N ATOM 1510 CA GLU A 188 20.961 58.199 2.314 1.00 24.63 C ANISOU 1510 CA GLU A 188 3178 3120 3060 -128 35 148 C ATOM 1511 C GLU A 188 20.078 59.362 2.762 1.00 25.24 C ANISOU 1511 C GLU A 188 3267 3177 3146 -127 16 148 C ATOM 1512 O GLU A 188 20.433 60.522 2.575 1.00 26.12 O ANISOU 1512 O GLU A 188 3381 3276 3269 -138 10 163 O ATOM 1513 CB GLU A 188 20.490 57.624 0.969 1.00 24.65 C ANISOU 1513 CB GLU A 188 3187 3140 3041 -121 46 153 C ATOM 1514 CG GLU A 188 20.388 58.644 -0.159 1.00 25.40 C ANISOU 1514 CG GLU A 188 3289 3231 3130 -127 46 174 C ATOM 1515 CD GLU A 188 21.660 59.445 -0.378 1.00 25.98 C ANISOU 1515 CD GLU A 188 3354 3303 3216 -143 52 195 C ATOM 1516 OE1 GLU A 188 22.762 58.895 -0.196 1.00 25.86 O ANISOU 1516 OE1 GLU A 188 3324 3298 3205 -149 63 195 O ATOM 1517 OE2 GLU A 188 21.563 60.641 -0.732 1.00 26.82 O ANISOU 1517 OE2 GLU A 188 3467 3395 3329 -152 46 212 O ATOM 0 H GLU A 188 20.608 56.429 3.139 1.00 23.45 H new ATOM 0 HA GLU A 188 21.862 58.532 2.181 1.00 24.63 H new ATOM 0 HB2 GLU A 188 21.102 56.922 0.699 1.00 24.65 H new ATOM 0 HB3 GLU A 188 19.622 57.211 1.094 1.00 24.65 H new ATOM 0 HG2 GLU A 188 20.161 58.183 -0.981 1.00 25.40 H new ATOM 0 HG3 GLU A 188 19.660 59.255 0.034 1.00 25.40 H new ATOM 1518 N GLU A 189 18.937 59.045 3.364 1.00 25.97 N ANISOU 1518 N GLU A 189 3367 3266 3236 -115 8 132 N ATOM 1519 CA GLU A 189 18.057 60.062 3.924 1.00 27.77 C ANISOU 1519 CA GLU A 189 3604 3475 3471 -111 -11 128 C ATOM 1520 C GLU A 189 18.808 60.917 4.947 1.00 27.48 C ANISOU 1520 C GLU A 189 3563 3422 3455 -119 -22 128 C ATOM 1521 O GLU A 189 18.762 62.144 4.893 1.00 26.70 O ANISOU 1521 O GLU A 189 3470 3307 3367 -125 -35 137 O ATOM 1522 CB GLU A 189 16.835 59.397 4.555 1.00 30.06 C ANISOU 1522 CB GLU A 189 3899 3767 3754 -96 -16 109 C ATOM 1523 CG GLU A 189 15.724 60.350 4.951 1.00 33.07 C ANISOU 1523 CG GLU A 189 4292 4134 4139 -89 -33 104 C ATOM 1524 CD GLU A 189 14.494 59.613 5.438 1.00 35.00 C ANISOU 1524 CD GLU A 189 4538 4383 4375 -74 -35 88 C ATOM 1525 OE1 GLU A 189 14.001 58.713 4.724 1.00 40.36 O ANISOU 1525 OE1 GLU A 189 5217 5075 5042 -70 -25 85 O ATOM 1526 OE2 GLU A 189 14.014 59.938 6.537 1.00 39.34 O ANISOU 1526 OE2 GLU A 189 5089 4925 4932 -67 -46 77 O ATOM 0 H GLU A 189 18.653 58.239 3.459 1.00 25.97 H new ATOM 0 HA GLU A 189 17.756 60.649 3.212 1.00 27.77 H new ATOM 0 HB2 GLU A 189 16.478 58.746 3.930 1.00 30.06 H new ATOM 0 HB3 GLU A 189 17.120 58.907 5.343 1.00 30.06 H new ATOM 0 HG2 GLU A 189 16.042 60.944 5.649 1.00 33.07 H new ATOM 0 HG3 GLU A 189 15.488 60.905 4.191 1.00 33.07 H new ATOM 1527 N ARG A 190 19.518 60.258 5.860 1.00 27.47 N ANISOU 1527 N ARG A 190 3551 3426 3460 -118 -19 118 N ATOM 1528 CA ARG A 190 20.324 60.943 6.874 1.00 28.33 C ANISOU 1528 CA ARG A 190 3653 3522 3589 -123 -31 115 C ATOM 1529 C ARG A 190 21.420 61.823 6.250 1.00 29.39 C ANISOU 1529 C ARG A 190 3781 3648 3737 -142 -30 134 C ATOM 1530 O ARG A 190 21.639 62.955 6.690 1.00 30.42 O ANISOU 1530 O ARG A 190 3912 3759 3885 -148 -46 137 O ATOM 1531 CB ARG A 190 20.933 59.919 7.845 1.00 28.41 C ANISOU 1531 CB ARG A 190 3653 3542 3601 -118 -26 100 C ATOM 1532 CG ARG A 190 19.900 59.251 8.742 1.00 28.71 C ANISOU 1532 CG ARG A 190 3696 3583 3630 -100 -30 82 C ATOM 1533 CD ARG A 190 20.516 58.211 9.660 1.00 28.89 C ANISOU 1533 CD ARG A 190 3709 3615 3652 -94 -24 70 C ATOM 1534 NE ARG A 190 21.357 58.819 10.690 1.00 29.48 N ANISOU 1534 NE ARG A 190 3778 3680 3744 -95 -36 65 N ATOM 1535 CZ ARG A 190 20.912 59.406 11.801 1.00 29.82 C ANISOU 1535 CZ ARG A 190 3825 3712 3793 -85 -53 53 C ATOM 1536 NH1 ARG A 190 21.784 59.928 12.657 1.00 30.61 N ANISOU 1536 NH1 ARG A 190 3918 3803 3908 -87 -65 47 N ATOM 1537 NH2 ARG A 190 19.613 59.477 12.072 1.00 30.32 N ANISOU 1537 NH2 ARG A 190 3900 3774 3848 -73 -59 47 N ATOM 0 H ARG A 190 19.547 59.400 5.911 1.00 27.47 H new ATOM 0 HA ARG A 190 19.734 61.536 7.366 1.00 28.33 H new ATOM 0 HB2 ARG A 190 21.399 59.237 7.336 1.00 28.41 H new ATOM 0 HB3 ARG A 190 21.595 60.362 8.399 1.00 28.41 H new ATOM 0 HG2 ARG A 190 19.454 59.927 9.276 1.00 28.71 H new ATOM 0 HG3 ARG A 190 19.221 58.831 8.191 1.00 28.71 H new ATOM 0 HD2 ARG A 190 19.811 57.695 10.082 1.00 28.89 H new ATOM 0 HD3 ARG A 190 21.046 57.591 9.135 1.00 28.89 H new ATOM 0 HE ARG A 190 22.208 58.796 10.569 1.00 29.48 H new ATOM 0 HH11 ARG A 190 22.627 59.885 12.492 1.00 30.61 H new ATOM 0 HH12 ARG A 190 21.505 60.309 13.376 1.00 30.61 H new ATOM 0 HH21 ARG A 190 19.041 59.140 11.525 1.00 30.32 H new ATOM 0 HH22 ARG A 190 19.345 59.860 12.794 1.00 30.32 H new ATOM 1538 N GLU A 191 22.085 61.310 5.217 1.00 30.01 N ANISOU 1538 N GLU A 191 3853 3742 3807 -149 -11 147 N ATOM 1539 CA GLU A 191 23.104 62.071 4.489 1.00 31.56 C ANISOU 1539 CA GLU A 191 4042 3935 4015 -167 -6 169 C ATOM 1540 C GLU A 191 22.519 63.388 3.984 1.00 31.04 C ANISOU 1540 C GLU A 191 3989 3850 3954 -173 -18 183 C ATOM 1541 O GLU A 191 23.114 64.457 4.170 1.00 31.09 O ANISOU 1541 O GLU A 191 3992 3839 3983 -186 -28 194 O ATOM 1542 CB GLU A 191 23.638 61.253 3.304 1.00 33.72 C ANISOU 1542 CB GLU A 191 4309 4232 4272 -170 17 181 C ATOM 1543 CG GLU A 191 25.007 61.687 2.810 1.00 37.00 C ANISOU 1543 CG GLU A 191 4710 4650 4699 -188 26 201 C ATOM 1544 CD GLU A 191 26.124 61.166 3.694 1.00 38.85 C ANISOU 1544 CD GLU A 191 4926 4889 4946 -191 28 190 C ATOM 1545 OE1 GLU A 191 26.409 59.948 3.654 1.00 41.99 O ANISOU 1545 OE1 GLU A 191 5317 5306 5330 -183 41 181 O ATOM 1546 OE2 GLU A 191 26.720 61.978 4.428 1.00 41.80 O ANISOU 1546 OE2 GLU A 191 5292 5245 5343 -201 16 190 O ATOM 0 H GLU A 191 21.960 60.514 4.918 1.00 30.01 H new ATOM 0 HA GLU A 191 23.836 62.261 5.096 1.00 31.56 H new ATOM 0 HB2 GLU A 191 23.680 60.319 3.562 1.00 33.72 H new ATOM 0 HB3 GLU A 191 23.006 61.316 2.571 1.00 33.72 H new ATOM 0 HG2 GLU A 191 25.138 61.368 1.903 1.00 37.00 H new ATOM 0 HG3 GLU A 191 25.046 62.656 2.779 1.00 37.00 H new ATOM 1547 N GLU A 192 21.343 63.298 3.365 1.00 29.98 N ANISOU 1547 N GLU A 192 3869 3720 3803 -163 -18 183 N ATOM 1548 CA GLU A 192 20.651 64.459 2.799 1.00 30.32 C ANISOU 1548 CA GLU A 192 3926 3746 3847 -165 -29 196 C ATOM 1549 C GLU A 192 20.161 65.425 3.890 1.00 31.33 C ANISOU 1549 C GLU A 192 4061 3849 3993 -161 -54 185 C ATOM 1550 O GLU A 192 20.093 66.634 3.663 1.00 30.53 O ANISOU 1550 O GLU A 192 3967 3728 3904 -169 -67 197 O ATOM 1551 CB GLU A 192 19.494 64.002 1.891 1.00 29.72 C ANISOU 1551 CB GLU A 192 3864 3683 3747 -152 -24 196 C ATOM 1552 CG GLU A 192 19.942 63.212 0.654 1.00 29.71 C ANISOU 1552 CG GLU A 192 3858 3705 3727 -154 -1 208 C ATOM 1553 CD GLU A 192 18.805 62.499 -0.071 1.00 29.54 C ANISOU 1553 CD GLU A 192 3847 3697 3681 -138 3 201 C ATOM 1554 OE1 GLU A 192 17.637 62.905 0.063 1.00 28.76 O ANISOU 1554 OE1 GLU A 192 3761 3588 3579 -129 -11 193 O ATOM 1555 OE2 GLU A 192 19.076 61.520 -0.799 1.00 29.95 O ANISOU 1555 OE2 GLU A 192 3894 3770 3716 -134 20 202 O ATOM 0 H GLU A 192 20.920 62.557 3.260 1.00 29.98 H new ATOM 0 HA GLU A 192 21.289 64.951 2.259 1.00 30.32 H new ATOM 0 HB2 GLU A 192 18.886 63.453 2.410 1.00 29.72 H new ATOM 0 HB3 GLU A 192 18.995 64.782 1.601 1.00 29.72 H new ATOM 0 HG2 GLU A 192 20.378 63.818 0.035 1.00 29.71 H new ATOM 0 HG3 GLU A 192 20.604 62.556 0.923 1.00 29.71 H new ATOM 1556 N ASN A 193 19.839 64.893 5.071 1.00 31.36 N ANISOU 1556 N ASN A 193 4062 3854 3998 -150 -62 161 N ATOM 1557 CA ASN A 193 19.459 65.721 6.229 1.00 33.31 C ANISOU 1557 CA ASN A 193 4315 4082 4261 -144 -85 148 C ATOM 1558 C ASN A 193 20.645 66.325 6.987 1.00 33.58 C ANISOU 1558 C ASN A 193 4337 4101 4320 -155 -95 148 C ATOM 1559 O ASN A 193 20.447 67.057 7.963 1.00 34.60 O ANISOU 1559 O ASN A 193 4470 4213 4464 -150 -117 135 O ATOM 1560 CB ASN A 193 18.630 64.901 7.226 1.00 33.96 C ANISOU 1560 CB ASN A 193 4398 4172 4332 -124 -89 123 C ATOM 1561 CG ASN A 193 17.291 64.472 6.672 1.00 35.30 C ANISOU 1561 CG ASN A 193 4579 4352 4482 -112 -84 119 C ATOM 1562 OD1 ASN A 193 16.772 65.061 5.726 1.00 38.22 O ANISOU 1562 OD1 ASN A 193 4959 4717 4847 -114 -86 132 O ATOM 1563 ND2 ASN A 193 16.712 63.437 7.276 1.00 36.10 N ANISOU 1563 ND2 ASN A 193 4678 4466 4572 -99 -79 103 N ATOM 0 H ASN A 193 19.833 64.047 5.227 1.00 31.36 H new ATOM 0 HA ASN A 193 18.946 66.454 5.854 1.00 33.31 H new ATOM 0 HB2 ASN A 193 19.133 64.114 7.486 1.00 33.96 H new ATOM 0 HB3 ASN A 193 18.488 65.426 8.029 1.00 33.96 H new ATOM 0 HD21 ASN A 193 15.945 63.156 7.007 1.00 36.10 H new ATOM 0 HD22 ASN A 193 17.105 63.049 7.935 1.00 36.10 H new ATOM 1564 N GLY A 194 21.867 66.015 6.561 1.00 33.39 N ANISOU 1564 N GLY A 194 4299 4085 4302 -170 -81 160 N ATOM 1565 CA GLY A 194 23.066 66.457 7.267 1.00 34.47 C ANISOU 1565 CA GLY A 194 4422 4211 4464 -181 -89 159 C ATOM 1566 C GLY A 194 23.259 65.770 8.610 1.00 34.93 C ANISOU 1566 C GLY A 194 4473 4275 4523 -168 -95 134 C ATOM 1567 O GLY A 194 23.891 66.329 9.511 1.00 35.18 O ANISOU 1567 O GLY A 194 4498 4293 4577 -171 -111 126 O ATOM 0 H GLY A 194 22.024 65.545 5.858 1.00 33.39 H new ATOM 0 HA2 GLY A 194 23.842 66.289 6.710 1.00 34.47 H new ATOM 0 HA3 GLY A 194 23.018 67.416 7.405 1.00 34.47 H new ATOM 1568 N GLN A 195 22.718 64.560 8.738 1.00 35.04 N ANISOU 1568 N GLN A 195 4489 4310 4516 -154 -82 123 N ATOM 1569 CA GLN A 195 22.861 63.757 9.953 1.00 34.45 C ANISOU 1569 CA GLN A 195 4408 4242 4439 -141 -84 101 C ATOM 1570 C GLN A 195 23.984 62.750 9.774 1.00 33.83 C ANISOU 1570 C GLN A 195 4313 4181 4358 -147 -66 104 C ATOM 1571 O GLN A 195 24.307 62.366 8.649 1.00 34.17 O ANISOU 1571 O GLN A 195 4353 4237 4393 -157 -48 119 O ATOM 1572 CB GLN A 195 21.571 63.005 10.266 1.00 34.51 C ANISOU 1572 CB GLN A 195 4427 4261 4426 -122 -82 88 C ATOM 1573 CG GLN A 195 20.388 63.881 10.628 1.00 35.17 C ANISOU 1573 CG GLN A 195 4524 4329 4509 -111 -101 81 C ATOM 1574 CD GLN A 195 19.105 63.082 10.733 1.00 35.92 C ANISOU 1574 CD GLN A 195 4627 4437 4583 -95 -95 71 C ATOM 1575 OE1 GLN A 195 18.557 62.632 9.724 1.00 35.76 O ANISOU 1575 OE1 GLN A 195 4612 4427 4550 -96 -82 80 O ATOM 1576 NE2 GLN A 195 18.621 62.891 11.961 1.00 36.50 N ANISOU 1576 NE2 GLN A 195 4702 4511 4655 -78 -104 53 N ATOM 0 H GLN A 195 22.256 64.180 8.121 1.00 35.04 H new ATOM 0 HA GLN A 195 23.063 64.357 10.688 1.00 34.45 H new ATOM 0 HB2 GLN A 195 21.333 62.465 9.496 1.00 34.51 H new ATOM 0 HB3 GLN A 195 21.739 62.393 11.000 1.00 34.51 H new ATOM 0 HG2 GLN A 195 20.562 64.326 11.472 1.00 35.17 H new ATOM 0 HG3 GLN A 195 20.283 64.575 9.958 1.00 35.17 H new ATOM 0 HE21 GLN A 195 19.031 63.221 12.641 1.00 36.50 H new ATOM 0 HE22 GLN A 195 17.898 62.438 12.073 1.00 36.50 H new ATOM 1577 N ASP A 196 24.574 62.325 10.888 1.00 32.47 N ANISOU 1577 N ASP A 196 4133 4012 4192 -140 -71 88 N ATOM 1578 CA ASP A 196 25.612 61.299 10.863 1.00 32.97 C ANISOU 1578 CA ASP A 196 4182 4093 4253 -143 -56 87 C ATOM 1579 C ASP A 196 24.990 59.983 10.409 1.00 30.59 C ANISOU 1579 C ASP A 196 3885 3812 3926 -133 -37 85 C ATOM 1580 O ASP A 196 23.912 59.624 10.859 1.00 30.35 O ANISOU 1580 O ASP A 196 3865 3783 3884 -118 -40 74 O ATOM 1581 CB ASP A 196 26.244 61.127 12.247 1.00 34.44 C ANISOU 1581 CB ASP A 196 4360 4277 4450 -134 -67 68 C ATOM 1582 CG ASP A 196 27.071 62.328 12.666 1.00 36.69 C ANISOU 1582 CG ASP A 196 4637 4542 4762 -145 -86 69 C ATOM 1583 OD1 ASP A 196 27.780 62.903 11.811 1.00 39.07 O ANISOU 1583 OD1 ASP A 196 4929 4838 5076 -165 -82 86 O ATOM 1584 OD2 ASP A 196 27.018 62.689 13.857 1.00 38.36 O ANISOU 1584 OD2 ASP A 196 4850 4743 4982 -134 -106 51 O ATOM 0 H ASP A 196 24.386 62.620 11.673 1.00 32.47 H new ATOM 0 HA ASP A 196 26.311 61.569 10.246 1.00 32.97 H new ATOM 0 HB2 ASP A 196 25.544 60.977 12.902 1.00 34.44 H new ATOM 0 HB3 ASP A 196 26.806 60.336 12.246 1.00 34.44 H new ATOM 1585 N ILE A 197 25.653 59.286 9.497 1.00 29.41 N ANISOU 1585 N ILE A 197 3727 3678 3770 -141 -18 95 N ATOM 1586 CA ILE A 197 25.143 57.998 9.019 1.00 28.32 C ANISOU 1586 CA ILE A 197 3593 3559 3610 -131 -2 92 C ATOM 1587 C ILE A 197 25.422 56.907 10.050 1.00 27.07 C ANISOU 1587 C ILE A 197 3428 3408 3447 -118 0 75 C ATOM 1588 O ILE A 197 26.296 57.062 10.910 1.00 28.22 O ANISOU 1588 O ILE A 197 3565 3551 3607 -119 -8 67 O ATOM 1589 CB ILE A 197 25.743 57.603 7.652 1.00 29.42 C ANISOU 1589 CB ILE A 197 3725 3713 3740 -141 17 107 C ATOM 1590 CG1 ILE A 197 27.260 57.420 7.742 1.00 30.13 C ANISOU 1590 CG1 ILE A 197 3796 3810 3841 -150 24 110 C ATOM 1591 CG2 ILE A 197 25.382 58.643 6.594 1.00 30.07 C ANISOU 1591 CG2 ILE A 197 3814 3787 3823 -152 17 126 C ATOM 1592 CD1 ILE A 197 27.866 56.779 6.515 1.00 30.70 C ANISOU 1592 CD1 ILE A 197 3860 3903 3901 -155 44 122 C ATOM 0 H ILE A 197 26.395 59.535 9.141 1.00 29.41 H new ATOM 0 HA ILE A 197 24.185 58.093 8.898 1.00 28.32 H new ATOM 0 HB ILE A 197 25.361 56.751 7.390 1.00 29.42 H new ATOM 0 HG12 ILE A 197 27.675 58.285 7.884 1.00 30.13 H new ATOM 0 HG13 ILE A 197 27.467 56.876 8.518 1.00 30.13 H new ATOM 0 HG21 ILE A 197 25.764 58.383 5.741 1.00 30.07 H new ATOM 0 HG22 ILE A 197 24.417 58.700 6.512 1.00 30.07 H new ATOM 0 HG23 ILE A 197 25.735 59.508 6.856 1.00 30.07 H new ATOM 0 HD11 ILE A 197 28.825 56.692 6.635 1.00 30.70 H new ATOM 0 HD12 ILE A 197 27.476 55.901 6.382 1.00 30.70 H new ATOM 0 HD13 ILE A 197 27.687 57.332 5.739 1.00 30.70 H new ATOM 1593 N PHE A 198 24.674 55.813 9.962 1.00 24.79 N ANISOU 1593 N PHE A 198 3146 3131 3142 -107 9 68 N ATOM 1594 CA PHE A 198 24.908 54.638 10.801 1.00 24.45 C ANISOU 1594 CA PHE A 198 3099 3096 3093 -95 13 54 C ATOM 1595 C PHE A 198 25.985 53.758 10.173 1.00 23.82 C ANISOU 1595 C PHE A 198 3008 3034 3011 -99 28 58 C ATOM 1596 O PHE A 198 25.993 53.546 8.957 1.00 24.02 O ANISOU 1596 O PHE A 198 3033 3068 3027 -105 40 68 O ATOM 1597 CB PHE A 198 23.622 53.835 10.976 1.00 24.04 C ANISOU 1597 CB PHE A 198 3059 3049 3028 -81 16 47 C ATOM 1598 CG PHE A 198 22.580 54.537 11.790 1.00 23.96 C ANISOU 1598 CG PHE A 198 3058 3026 3020 -73 2 41 C ATOM 1599 CD1 PHE A 198 21.398 54.981 11.205 1.00 23.68 C ANISOU 1599 CD1 PHE A 198 3032 2985 2979 -73 0 46 C ATOM 1600 CD2 PHE A 198 22.777 54.751 13.149 1.00 23.88 C ANISOU 1600 CD2 PHE A 198 3047 3010 3017 -64 -9 30 C ATOM 1601 CE1 PHE A 198 20.433 55.626 11.962 1.00 24.46 C ANISOU 1601 CE1 PHE A 198 3140 3074 3079 -64 -13 39 C ATOM 1602 CE2 PHE A 198 21.818 55.400 13.905 1.00 24.24 C ANISOU 1602 CE2 PHE A 198 3101 3045 3063 -55 -22 24 C ATOM 1603 CZ PHE A 198 20.648 55.839 13.309 1.00 24.26 C ANISOU 1603 CZ PHE A 198 3113 3044 3061 -55 -24 29 C ATOM 0 H PHE A 198 24.016 55.729 9.415 1.00 24.79 H new ATOM 0 HA PHE A 198 25.206 54.938 11.674 1.00 24.45 H new ATOM 0 HB2 PHE A 198 23.255 53.632 10.101 1.00 24.04 H new ATOM 0 HB3 PHE A 198 23.834 52.988 11.398 1.00 24.04 H new ATOM 0 HD1 PHE A 198 21.254 54.843 10.297 1.00 23.68 H new ATOM 0 HD2 PHE A 198 23.560 54.455 13.553 1.00 23.88 H new ATOM 0 HE1 PHE A 198 19.643 55.914 11.564 1.00 24.46 H new ATOM 0 HE2 PHE A 198 21.959 55.541 14.813 1.00 24.24 H new ATOM 0 HZ PHE A 198 20.005 56.279 13.817 1.00 24.26 H new ATOM 1604 N ALA A 199 26.875 53.231 11.006 1.00 23.23 N ANISOU 1604 N ALA A 199 2924 2963 2941 -94 28 48 N ATOM 1605 CA ALA A 199 28.005 52.428 10.534 1.00 23.01 C ANISOU 1605 CA ALA A 199 2883 2950 2910 -97 40 49 C ATOM 1606 C ALA A 199 27.539 51.135 9.853 1.00 23.07 C ANISOU 1606 C ALA A 199 2894 2970 2899 -89 54 48 C ATOM 1607 O ALA A 199 28.170 50.663 8.902 1.00 24.11 O ANISOU 1607 O ALA A 199 3019 3117 3026 -93 67 53 O ATOM 1608 CB ALA A 199 28.951 52.118 11.692 1.00 23.69 C ANISOU 1608 CB ALA A 199 2959 3036 3004 -91 34 37 C ATOM 0 H ALA A 199 26.844 53.327 11.860 1.00 23.23 H new ATOM 0 HA ALA A 199 28.482 52.948 9.868 1.00 23.01 H new ATOM 0 HB1 ALA A 199 29.695 51.586 11.369 1.00 23.69 H new ATOM 0 HB2 ALA A 199 29.286 52.947 12.068 1.00 23.69 H new ATOM 0 HB3 ALA A 199 28.474 51.623 12.376 1.00 23.69 H new ATOM 1609 N ASN A 200 26.424 50.584 10.327 1.00 22.31 N ANISOU 1609 N ASN A 200 2810 2871 2796 -78 52 40 N ATOM 1610 CA ASN A 200 25.874 49.334 9.801 1.00 21.77 C ANISOU 1610 CA ASN A 200 2746 2812 2714 -70 62 37 C ATOM 1611 C ASN A 200 24.411 49.154 10.250 1.00 21.51 C ANISOU 1611 C ASN A 200 2726 2770 2676 -61 57 32 C ATOM 1612 O ASN A 200 23.918 49.952 11.046 1.00 21.80 O ANISOU 1612 O ASN A 200 2767 2796 2719 -59 47 30 O ATOM 1613 CB ASN A 200 26.747 48.167 10.268 1.00 21.84 C ANISOU 1613 CB ASN A 200 2747 2830 2721 -61 68 27 C ATOM 1614 CG ASN A 200 26.848 48.083 11.774 1.00 21.72 C ANISOU 1614 CG ASN A 200 2733 2807 2712 -52 58 18 C ATOM 1615 OD1 ASN A 200 25.836 47.955 12.462 1.00 21.51 O ANISOU 1615 OD1 ASN A 200 2717 2774 2684 -44 54 14 O ATOM 1616 ND2 ASN A 200 28.072 48.143 12.297 1.00 21.88 N ANISOU 1616 ND2 ASN A 200 2742 2830 2740 -52 56 14 N ATOM 0 H ASN A 200 25.962 50.926 10.967 1.00 22.31 H new ATOM 0 HA ASN A 200 25.877 49.360 8.831 1.00 21.77 H new ATOM 0 HB2 ASN A 200 26.382 47.337 9.925 1.00 21.84 H new ATOM 0 HB3 ASN A 200 27.636 48.262 9.892 1.00 21.84 H new ATOM 0 HD21 ASN A 200 28.179 48.092 13.149 1.00 21.88 H new ATOM 0 HD22 ASN A 200 28.755 48.233 11.783 1.00 21.88 H new ATOM 1617 N PRO A 201 23.711 48.122 9.739 1.00 21.24 N ANISOU 1617 N PRO A 201 2697 2742 2633 -55 65 29 N ATOM 1618 CA PRO A 201 22.302 47.948 10.140 1.00 21.08 C ANISOU 1618 CA PRO A 201 2687 2714 2610 -48 61 25 C ATOM 1619 C PRO A 201 22.070 47.649 11.634 1.00 20.77 C ANISOU 1619 C PRO A 201 2649 2668 2574 -37 56 18 C ATOM 1620 O PRO A 201 20.999 47.953 12.145 1.00 19.70 O ANISOU 1620 O PRO A 201 2520 2526 2439 -33 51 17 O ATOM 1621 CB PRO A 201 21.831 46.765 9.280 1.00 20.75 C ANISOU 1621 CB PRO A 201 2646 2679 2559 -44 70 23 C ATOM 1622 CG PRO A 201 22.751 46.759 8.102 1.00 21.31 C ANISOU 1622 CG PRO A 201 2711 2761 2625 -51 77 28 C ATOM 1623 CD PRO A 201 24.079 47.216 8.637 1.00 21.40 C ANISOU 1623 CD PRO A 201 2713 2774 2643 -55 76 30 C ATOM 0 HA PRO A 201 21.815 48.776 10.005 1.00 21.08 H new ATOM 0 HB2 PRO A 201 21.883 45.930 9.771 1.00 20.75 H new ATOM 0 HB3 PRO A 201 20.907 46.876 9.005 1.00 20.75 H new ATOM 0 HG2 PRO A 201 22.816 45.873 7.713 1.00 21.31 H new ATOM 0 HG3 PRO A 201 22.431 47.352 7.405 1.00 21.31 H new ATOM 0 HD2 PRO A 201 24.614 46.470 8.951 1.00 21.40 H new ATOM 0 HD3 PRO A 201 24.600 47.672 7.958 1.00 21.40 H new ATOM 1624 N ARG A 202 23.048 47.061 12.322 1.00 21.80 N ANISOU 1624 N ARG A 202 2773 2803 2707 -32 58 13 N ATOM 1625 CA ARG A 202 22.912 46.818 13.765 1.00 22.50 C ANISOU 1625 CA ARG A 202 2865 2887 2797 -21 53 7 C ATOM 1626 C ARG A 202 22.855 48.135 14.539 1.00 22.22 C ANISOU 1626 C ARG A 202 2830 2843 2767 -21 40 6 C ATOM 1627 O ARG A 202 21.993 48.320 15.404 1.00 21.70 O ANISOU 1627 O ARG A 202 2771 2773 2700 -11 35 4 O ATOM 1628 CB ARG A 202 24.071 45.978 14.288 1.00 23.67 C ANISOU 1628 CB ARG A 202 3006 3041 2946 -15 56 1 C ATOM 1629 CG ARG A 202 24.121 44.553 13.757 1.00 25.06 C ANISOU 1629 CG ARG A 202 3182 3224 3117 -11 66 0 C ATOM 1630 CD ARG A 202 25.554 44.187 13.400 1.00 27.22 C ANISOU 1630 CD ARG A 202 3446 3507 3391 -13 70 -3 C ATOM 1631 NE ARG A 202 25.812 44.359 11.981 1.00 27.92 N ANISOU 1631 NE ARG A 202 3530 3603 3477 -23 76 2 N ATOM 1632 CZ ARG A 202 27.000 44.577 11.420 1.00 27.99 C ANISOU 1632 CZ ARG A 202 3528 3621 3486 -29 79 3 C ATOM 1633 NH1 ARG A 202 28.114 44.704 12.135 1.00 29.46 N ANISOU 1633 NH1 ARG A 202 3705 3809 3678 -28 75 -1 N ATOM 1634 NH2 ARG A 202 27.067 44.687 10.105 1.00 28.20 N ANISOU 1634 NH2 ARG A 202 3552 3656 3508 -37 85 9 N ATOM 0 H ARG A 202 23.791 46.797 11.980 1.00 21.80 H new ATOM 0 HA ARG A 202 22.082 46.334 13.900 1.00 22.50 H new ATOM 0 HB2 ARG A 202 24.903 46.423 14.062 1.00 23.67 H new ATOM 0 HB3 ARG A 202 24.020 45.947 15.256 1.00 23.67 H new ATOM 0 HG2 ARG A 202 23.778 43.938 14.424 1.00 25.06 H new ATOM 0 HG3 ARG A 202 23.553 44.470 12.975 1.00 25.06 H new ATOM 0 HD2 ARG A 202 26.167 44.739 13.910 1.00 27.22 H new ATOM 0 HD3 ARG A 202 25.726 43.266 13.652 1.00 27.22 H new ATOM 0 HE ARG A 202 25.134 44.316 11.454 1.00 27.92 H new ATOM 0 HH11 ARG A 202 28.084 44.646 12.992 1.00 29.46 H new ATOM 0 HH12 ARG A 202 28.865 44.844 11.740 1.00 29.46 H new ATOM 0 HH21 ARG A 202 26.353 44.618 9.631 1.00 28.20 H new ATOM 0 HH22 ARG A 202 27.825 44.828 9.723 1.00 28.20 H new ATOM 1635 N ASN A 203 23.784 49.039 14.240 1.00 21.39 N ANISOU 1635 N ASN A 203 2720 2738 2671 -30 35 9 N ATOM 1636 CA ASN A 203 23.769 50.368 14.853 1.00 21.47 C ANISOU 1636 CA ASN A 203 2731 2738 2689 -31 21 8 C ATOM 1637 C ASN A 203 22.500 51.126 14.480 1.00 20.63 C ANISOU 1637 C ASN A 203 2633 2624 2580 -34 16 12 C ATOM 1638 O ASN A 203 21.934 51.840 15.304 1.00 20.66 O ANISOU 1638 O ASN A 203 2642 2620 2587 -27 5 8 O ATOM 1639 CB ASN A 203 25.016 51.175 14.473 1.00 22.02 C ANISOU 1639 CB ASN A 203 2790 2806 2770 -44 16 11 C ATOM 1640 CG ASN A 203 26.252 50.738 15.243 1.00 21.98 C ANISOU 1640 CG ASN A 203 2776 2806 2769 -39 15 3 C ATOM 1641 OD1 ASN A 203 26.267 49.677 15.858 1.00 21.98 O ANISOU 1641 OD1 ASN A 203 2778 2812 2763 -26 19 -3 O ATOM 1642 ND2 ASN A 203 27.300 51.555 15.197 1.00 22.76 N ANISOU 1642 ND2 ASN A 203 2864 2901 2881 -48 8 4 N ATOM 0 H ASN A 203 24.429 48.905 13.688 1.00 21.39 H new ATOM 0 HA ASN A 203 23.778 50.246 15.815 1.00 21.47 H new ATOM 0 HB2 ASN A 203 25.181 51.080 13.522 1.00 22.02 H new ATOM 0 HB3 ASN A 203 24.851 52.116 14.640 1.00 22.02 H new ATOM 0 HD21 ASN A 203 28.026 51.347 15.609 1.00 22.76 H new ATOM 0 HD22 ASN A 203 27.252 52.291 14.755 1.00 22.76 H new ATOM 1643 N ALA A 204 22.037 50.951 13.246 1.00 19.80 N ANISOU 1643 N ALA A 204 2530 2522 2470 -42 24 19 N ATOM 1644 CA ALA A 204 20.805 51.605 12.813 1.00 19.75 C ANISOU 1644 CA ALA A 204 2532 2509 2461 -43 20 23 C ATOM 1645 C ALA A 204 19.589 51.077 13.571 1.00 19.48 C ANISOU 1645 C ALA A 204 2504 2474 2421 -30 20 17 C ATOM 1646 O ALA A 204 18.721 51.860 13.953 1.00 20.40 O ANISOU 1646 O ALA A 204 2627 2584 2539 -26 11 16 O ATOM 1647 CB ALA A 204 20.603 51.456 11.308 1.00 19.49 C ANISOU 1647 CB ALA A 204 2501 2482 2423 -52 28 31 C ATOM 0 H ALA A 204 22.417 50.462 12.649 1.00 19.80 H new ATOM 0 HA ALA A 204 20.895 52.549 13.018 1.00 19.75 H new ATOM 0 HB1 ALA A 204 19.780 51.898 11.046 1.00 19.49 H new ATOM 0 HB2 ALA A 204 21.350 51.861 10.839 1.00 19.49 H new ATOM 0 HB3 ALA A 204 20.551 50.515 11.080 1.00 19.49 H new ATOM 1648 N ALA A 205 19.522 49.761 13.786 1.00 19.10 N ANISOU 1648 N ALA A 205 2455 2434 2369 -23 30 14 N ATOM 1649 CA ALA A 205 18.443 49.172 14.591 1.00 19.66 C ANISOU 1649 CA ALA A 205 2529 2504 2435 -11 32 10 C ATOM 1650 C ALA A 205 18.532 49.656 16.040 1.00 20.04 C ANISOU 1650 C ALA A 205 2579 2550 2485 0 23 5 C ATOM 1651 O ALA A 205 17.522 50.013 16.643 1.00 20.35 O ANISOU 1651 O ALA A 205 2623 2587 2522 9 18 3 O ATOM 1652 CB ALA A 205 18.477 47.650 14.536 1.00 19.74 C ANISOU 1652 CB ALA A 205 2538 2521 2442 -8 44 9 C ATOM 0 H ALA A 205 20.088 49.192 13.477 1.00 19.10 H new ATOM 0 HA ALA A 205 17.598 49.464 14.215 1.00 19.66 H new ATOM 0 HB1 ALA A 205 17.755 47.290 15.075 1.00 19.74 H new ATOM 0 HB2 ALA A 205 18.371 47.357 13.617 1.00 19.74 H new ATOM 0 HB3 ALA A 205 19.326 47.332 14.880 1.00 19.74 H new ATOM 1653 N ALA A 206 19.743 49.676 16.594 1.00 21.12 N ANISOU 1653 N ALA A 206 2711 2688 2625 2 20 1 N ATOM 1654 CA ALA A 206 19.951 50.143 17.972 1.00 21.61 C ANISOU 1654 CA ALA A 206 2775 2748 2688 15 10 -6 C ATOM 1655 C ALA A 206 19.591 51.618 18.136 1.00 21.93 C ANISOU 1655 C ALA A 206 2819 2780 2734 14 -6 -8 C ATOM 1656 O ALA A 206 18.910 51.996 19.098 1.00 21.73 O ANISOU 1656 O ALA A 206 2798 2754 2705 28 -13 -13 O ATOM 1657 CB ALA A 206 21.395 49.903 18.410 1.00 21.24 C ANISOU 1657 CB ALA A 206 2721 2704 2646 16 8 -10 C ATOM 0 H ALA A 206 20.460 49.424 16.192 1.00 21.12 H new ATOM 0 HA ALA A 206 19.357 49.629 18.541 1.00 21.61 H new ATOM 0 HB1 ALA A 206 21.514 50.217 19.320 1.00 21.24 H new ATOM 0 HB2 ALA A 206 21.593 48.954 18.367 1.00 21.24 H new ATOM 0 HB3 ALA A 206 21.996 50.385 17.821 1.00 21.24 H new ATOM 1658 N GLY A 207 20.038 52.451 17.196 1.00 21.94 N ANISOU 1658 N GLY A 207 2818 2775 2743 0 -11 -3 N ATOM 1659 CA GLY A 207 19.719 53.873 17.203 1.00 22.56 C ANISOU 1659 CA GLY A 207 2901 2843 2828 -3 -26 -4 C ATOM 1660 C GLY A 207 18.220 54.096 17.166 1.00 23.06 C ANISOU 1660 C GLY A 207 2973 2906 2885 4 -27 -4 C ATOM 1661 O GLY A 207 17.696 54.939 17.895 1.00 24.54 O ANISOU 1661 O GLY A 207 3164 3087 3073 14 -41 -10 O ATOM 0 H GLY A 207 20.534 52.205 16.538 1.00 21.94 H new ATOM 0 HA2 GLY A 207 20.091 54.287 17.997 1.00 22.56 H new ATOM 0 HA3 GLY A 207 20.132 54.304 16.438 1.00 22.56 H new ATOM 1662 N SER A 208 17.540 53.320 16.327 1.00 22.93 N ANISOU 1662 N SER A 208 2956 2894 2862 -1 -14 2 N ATOM 1663 CA SER A 208 16.091 53.411 16.169 1.00 22.97 C ANISOU 1663 CA SER A 208 2967 2899 2861 4 -14 2 C ATOM 1664 C SER A 208 15.338 53.016 17.443 1.00 23.66 C ANISOU 1664 C SER A 208 3055 2991 2942 22 -13 -4 C ATOM 1665 O SER A 208 14.395 53.705 17.851 1.00 23.51 O ANISOU 1665 O SER A 208 3041 2971 2922 31 -22 -8 O ATOM 1666 CB SER A 208 15.630 52.535 14.997 1.00 23.11 C ANISOU 1666 CB SER A 208 2984 2922 2875 -4 -1 8 C ATOM 1667 OG SER A 208 16.254 52.921 13.784 1.00 23.45 O ANISOU 1667 OG SER A 208 3027 2963 2921 -18 0 15 O ATOM 0 H SER A 208 17.908 52.722 15.830 1.00 22.93 H new ATOM 0 HA SER A 208 15.882 54.340 15.985 1.00 22.97 H new ATOM 0 HB2 SER A 208 15.834 51.606 15.186 1.00 23.11 H new ATOM 0 HB3 SER A 208 14.667 52.600 14.902 1.00 23.11 H new ATOM 0 HG SER A 208 17.034 52.611 13.759 1.00 23.45 H new ATOM 1668 N LEU A 209 15.755 51.921 18.075 1.00 23.77 N ANISOU 1668 N LEU A 209 3065 3012 2952 28 -3 -5 N ATOM 1669 CA LEU A 209 15.047 51.400 19.251 1.00 24.77 C ANISOU 1669 CA LEU A 209 3193 3146 3072 45 0 -8 C ATOM 1670 C LEU A 209 15.363 52.168 20.527 1.00 25.66 C ANISOU 1670 C LEU A 209 3309 3259 3184 61 -13 -16 C ATOM 1671 O LEU A 209 14.646 52.035 21.522 1.00 26.03 O ANISOU 1671 O LEU A 209 3356 3311 3222 77 -12 -18 O ATOM 1672 CB LEU A 209 15.325 49.904 19.446 1.00 24.97 C ANISOU 1672 CB LEU A 209 3214 3178 3094 47 16 -4 C ATOM 1673 CG LEU A 209 14.610 48.996 18.435 1.00 25.22 C ANISOU 1673 CG LEU A 209 3244 3211 3127 37 28 2 C ATOM 1674 CD1 LEU A 209 15.027 47.549 18.632 1.00 26.40 C ANISOU 1674 CD1 LEU A 209 3390 3364 3275 39 41 5 C ATOM 1675 CD2 LEU A 209 13.096 49.145 18.533 1.00 26.31 C ANISOU 1675 CD2 LEU A 209 3384 3350 3262 43 30 3 C ATOM 0 H LEU A 209 16.445 51.463 17.842 1.00 23.77 H new ATOM 0 HA LEU A 209 14.102 51.526 19.073 1.00 24.77 H new ATOM 0 HB2 LEU A 209 16.281 49.752 19.383 1.00 24.97 H new ATOM 0 HB3 LEU A 209 15.055 49.649 20.342 1.00 24.97 H new ATOM 0 HG LEU A 209 14.875 49.272 17.543 1.00 25.22 H new ATOM 0 HD11 LEU A 209 14.567 46.989 17.987 1.00 26.40 H new ATOM 0 HD12 LEU A 209 15.985 47.468 18.505 1.00 26.40 H new ATOM 0 HD13 LEU A 209 14.795 47.265 19.530 1.00 26.40 H new ATOM 0 HD21 LEU A 209 12.671 48.562 17.885 1.00 26.31 H new ATOM 0 HD22 LEU A 209 12.804 48.903 19.426 1.00 26.31 H new ATOM 0 HD23 LEU A 209 12.849 50.065 18.351 1.00 26.31 H new ATOM 1676 N ARG A 210 16.425 52.968 20.493 1.00 26.05 N ANISOU 1676 N ARG A 210 3357 3301 3240 56 -25 -20 N ATOM 1677 CA ARG A 210 16.791 53.818 21.622 1.00 27.89 C ANISOU 1677 CA ARG A 210 3592 3531 3474 70 -41 -30 C ATOM 1678 C ARG A 210 16.379 55.295 21.459 1.00 27.25 C ANISOU 1678 C ARG A 210 3516 3440 3400 69 -60 -35 C ATOM 1679 O ARG A 210 16.808 56.149 22.238 1.00 27.56 O ANISOU 1679 O ARG A 210 3556 3473 3442 79 -77 -45 O ATOM 1680 CB ARG A 210 18.285 53.661 21.918 1.00 29.21 C ANISOU 1680 CB ARG A 210 3754 3698 3648 68 -45 -34 C ATOM 1681 CG ARG A 210 18.644 52.230 22.308 1.00 30.32 C ANISOU 1681 CG ARG A 210 3892 3848 3781 73 -29 -31 C ATOM 1682 CD ARG A 210 20.035 52.104 22.915 1.00 32.03 C ANISOU 1682 CD ARG A 210 4104 4066 4001 78 -35 -38 C ATOM 1683 NE ARG A 210 20.111 52.731 24.235 1.00 33.98 N ANISOU 1683 NE ARG A 210 4353 4313 4244 98 -51 -50 N ATOM 1684 CZ ARG A 210 20.654 53.920 24.500 1.00 34.94 C ANISOU 1684 CZ ARG A 210 4475 4426 4376 99 -71 -59 C ATOM 1685 NH1 ARG A 210 20.647 54.381 25.745 1.00 36.18 N ANISOU 1685 NH1 ARG A 210 4634 4584 4527 121 -85 -71 N ATOM 1686 NH2 ARG A 210 21.215 54.654 23.545 1.00 37.26 N ANISOU 1686 NH2 ARG A 210 4764 4708 4684 79 -78 -57 N ATOM 0 H ARG A 210 16.952 53.033 19.817 1.00 26.05 H new ATOM 0 HA ARG A 210 16.280 53.513 22.388 1.00 27.89 H new ATOM 0 HB2 ARG A 210 18.798 53.921 21.136 1.00 29.21 H new ATOM 0 HB3 ARG A 210 18.537 54.264 22.635 1.00 29.21 H new ATOM 0 HG2 ARG A 210 17.989 51.900 22.943 1.00 30.32 H new ATOM 0 HG3 ARG A 210 18.588 51.663 21.523 1.00 30.32 H new ATOM 0 HD2 ARG A 210 20.272 51.166 22.988 1.00 32.03 H new ATOM 0 HD3 ARG A 210 20.684 52.516 22.324 1.00 32.03 H new ATOM 0 HE ARG A 210 19.777 52.295 24.897 1.00 33.98 H new ATOM 0 HH11 ARG A 210 20.294 53.914 26.375 1.00 36.18 H new ATOM 0 HH12 ARG A 210 20.996 55.147 25.922 1.00 36.18 H new ATOM 0 HH21 ARG A 210 21.233 54.365 22.735 1.00 37.26 H new ATOM 0 HH22 ARG A 210 21.560 55.418 23.737 1.00 37.26 H new ATOM 1687 N AGLN A 211 15.541 55.584 20.462 0.50 27.05 N ANISOU 1687 N AGLN A 211 3492 3410 3375 59 -57 -29 N ATOM 1688 N BGLN A 211 15.546 55.590 20.462 0.50 27.71 N ANISOU 1688 N BGLN A 211 3576 3494 3458 59 -57 -29 N ATOM 1689 CA AGLN A 211 14.931 56.907 20.330 0.50 26.89 C ANISOU 1689 CA AGLN A 211 3478 3380 3358 61 -74 -33 C ATOM 1690 CA BGLN A 211 14.952 56.921 20.334 0.50 27.95 C ANISOU 1690 CA BGLN A 211 3612 3514 3493 61 -74 -33 C ATOM 1691 C AGLN A 211 13.789 57.034 21.329 0.50 26.65 C ANISOU 1691 C AGLN A 211 3451 3357 3318 83 -77 -40 C ATOM 1692 C BGLN A 211 13.789 57.043 21.314 0.50 27.22 C ANISOU 1692 C BGLN A 211 3523 3429 3390 82 -78 -40 C ATOM 1693 O AGLN A 211 12.998 56.102 21.492 0.50 26.00 O ANISOU 1693 O AGLN A 211 3366 3286 3225 89 -62 -36 O ATOM 1694 O BGLN A 211 12.987 56.116 21.450 0.50 26.48 O ANISOU 1694 O BGLN A 211 3428 3348 3287 88 -62 -36 O ATOM 1695 CB AGLN A 211 14.400 57.127 18.914 0.50 27.01 C ANISOU 1695 CB AGLN A 211 3496 3391 3377 44 -70 -23 C ATOM 1696 CB BGLN A 211 14.468 57.168 18.905 0.50 29.00 C ANISOU 1696 CB BGLN A 211 3747 3642 3629 44 -71 -23 C ATOM 1697 CG AGLN A 211 15.484 57.358 17.880 0.50 27.08 C ANISOU 1697 CG AGLN A 211 3501 3391 3396 24 -70 -15 C ATOM 1698 CG BGLN A 211 15.586 57.440 17.913 0.50 29.97 C ANISOU 1698 CG BGLN A 211 3867 3756 3763 24 -71 -16 C ATOM 1699 CD AGLN A 211 16.573 58.280 18.387 0.50 26.77 C ANISOU 1699 CD AGLN A 211 3461 3342 3369 23 -86 -21 C ATOM 1700 CD BGLN A 211 16.191 58.820 18.070 0.50 30.63 C ANISOU 1700 CD BGLN A 211 3953 3825 3859 21 -92 -19 C ATOM 1701 OE1AGLN A 211 16.326 59.455 18.670 0.50 26.92 O ANISOU 1701 OE1AGLN A 211 3485 3349 3394 27 -105 -26 O ATOM 1702 OE1BGLN A 211 17.319 58.969 18.545 0.50 32.25 O ANISOU 1702 OE1BGLN A 211 4154 4027 4073 19 -98 -23 O ATOM 1703 NE2AGLN A 211 17.787 57.753 18.508 0.50 26.34 N ANISOU 1703 NE2AGLN A 211 3399 3289 3319 17 -81 -20 N ATOM 1704 NE2BGLN A 211 15.440 59.841 17.675 0.50 31.19 N ANISOU 1704 NE2BGLN A 211 4032 3887 3934 20 -104 -19 N ATOM 0 H AGLN A 211 15.313 55.025 19.850 0.50 27.71 H new ATOM 0 H BGLN A 211 15.312 55.034 19.849 0.50 27.71 H new ATOM 0 HA AGLN A 211 15.607 57.579 20.509 0.50 27.95 H new ATOM 0 HA BGLN A 211 15.625 57.589 20.539 0.50 27.95 H new ATOM 0 HB2AGLN A 211 13.874 56.355 18.652 0.50 29.00 H new ATOM 0 HB2BGLN A 211 13.964 56.395 18.606 0.50 29.00 H new ATOM 0 HB3AGLN A 211 13.801 57.890 18.918 0.50 29.00 H new ATOM 0 HB3BGLN A 211 13.858 57.922 18.906 0.50 29.00 H new ATOM 0 HG2AGLN A 211 15.875 56.507 17.628 0.50 29.97 H new ATOM 0 HG2BGLN A 211 16.281 56.773 18.025 0.50 29.97 H new ATOM 0 HG3AGLN A 211 15.089 57.737 17.079 0.50 29.97 H new ATOM 0 HG3BGLN A 211 15.242 57.343 17.011 0.50 29.97 H new ATOM 0 HE21AGLN A 211 17.921 56.929 18.301 0.50 31.19 H new ATOM 0 HE21BGLN A 211 14.657 59.698 17.348 0.50 31.19 H new ATOM 0 HE22AGLN A 211 18.439 58.236 18.794 0.50 31.19 H new ATOM 0 HE22BGLN A 211 15.736 60.645 17.746 0.50 31.19 H new ATOM 1705 N LEU A 212 13.707 58.181 22.000 1.00 26.62 N ANISOU 1705 N LEU A 212 3451 3346 3316 95 -98 -51 N ATOM 1706 CA LEU A 212 12.674 58.411 23.008 1.00 26.96 C ANISOU 1706 CA LEU A 212 3498 3399 3348 118 -103 -59 C ATOM 1707 C LEU A 212 11.334 58.774 22.370 1.00 26.86 C ANISOU 1707 C LEU A 212 3488 3385 3332 117 -102 -56 C ATOM 1708 O LEU A 212 10.284 58.552 22.972 1.00 26.34 O ANISOU 1708 O LEU A 212 3421 3331 3255 134 -97 -59 O ATOM 1709 CB LEU A 212 13.109 59.512 23.982 1.00 26.99 C ANISOU 1709 CB LEU A 212 3505 3396 3355 134 -127 -74 C ATOM 1710 CG LEU A 212 14.314 59.165 24.864 1.00 27.05 C ANISOU 1710 CG LEU A 212 3510 3406 3364 141 -129 -80 C ATOM 1711 CD1 LEU A 212 14.854 60.411 25.550 1.00 27.41 C ANISOU 1711 CD1 LEU A 212 3558 3439 3417 153 -157 -95 C ATOM 1712 CD2 LEU A 212 13.938 58.098 25.879 1.00 27.14 C ANISOU 1712 CD2 LEU A 212 3519 3436 3357 161 -114 -80 C ATOM 0 H ALEU A 212 14.244 58.843 21.885 0.50 26.62 H new ATOM 0 H BLEU A 212 14.248 58.841 21.894 0.50 26.62 H new ATOM 0 HA LEU A 212 12.556 57.582 23.498 1.00 26.96 H new ATOM 0 HB2 LEU A 212 13.319 60.310 23.472 1.00 26.99 H new ATOM 0 HB3 LEU A 212 12.358 59.731 24.556 1.00 26.99 H new ATOM 0 HG LEU A 212 15.018 58.809 24.300 1.00 27.05 H new ATOM 0 HD11 LEU A 212 15.615 60.172 26.103 1.00 27.41 H new ATOM 0 HD12 LEU A 212 15.131 61.055 24.880 1.00 27.41 H new ATOM 0 HD13 LEU A 212 14.161 60.801 26.105 1.00 27.41 H new ATOM 0 HD21 LEU A 212 14.709 57.889 26.429 1.00 27.14 H new ATOM 0 HD22 LEU A 212 13.219 58.425 26.442 1.00 27.14 H new ATOM 0 HD23 LEU A 212 13.646 57.298 25.415 1.00 27.14 H new ATOM 1713 N ASP A 213 11.376 59.323 21.158 1.00 26.37 N ANISOU 1713 N ASP A 213 3428 3311 3280 99 -107 -51 N ATOM 1714 CA ASP A 213 10.166 59.738 20.453 1.00 26.45 C ANISOU 1714 CA ASP A 213 3442 3320 3288 98 -108 -49 C ATOM 1715 C ASP A 213 9.682 58.601 19.563 1.00 25.98 C ANISOU 1715 C ASP A 213 3378 3268 3225 86 -87 -38 C ATOM 1716 O ASP A 213 10.300 58.307 18.539 1.00 26.63 O ANISOU 1716 O ASP A 213 3459 3346 3313 67 -80 -29 O ATOM 1717 CB ASP A 213 10.444 60.987 19.614 1.00 26.75 C ANISOU 1717 CB ASP A 213 3486 3339 3337 86 -126 -48 C ATOM 1718 CG ASP A 213 9.193 61.536 18.938 1.00 27.08 C ANISOU 1718 CG ASP A 213 3534 3379 3377 88 -131 -48 C ATOM 1719 OD1 ASP A 213 8.113 60.914 19.040 1.00 26.08 O ANISOU 1719 OD1 ASP A 213 3404 3265 3241 96 -120 -48 O ATOM 1720 OD2 ASP A 213 9.289 62.611 18.310 1.00 29.06 O ANISOU 1720 OD2 ASP A 213 3792 3614 3637 81 -146 -47 O ATOM 0 H ASP A 213 12.104 59.465 20.723 1.00 26.37 H new ATOM 0 HA ASP A 213 9.476 59.952 21.101 1.00 26.45 H new ATOM 0 HB2 ASP A 213 10.828 61.674 20.182 1.00 26.75 H new ATOM 0 HB3 ASP A 213 11.106 60.776 18.937 1.00 26.75 H new ATOM 1721 N THR A 214 8.570 57.978 19.949 1.00 25.46 N ANISOU 1721 N THR A 214 3309 3216 3150 97 -76 -39 N ATOM 1722 CA THR A 214 8.038 56.816 19.224 1.00 25.62 C ANISOU 1722 CA THR A 214 3323 3243 3169 87 -57 -30 C ATOM 1723 C THR A 214 7.592 57.133 17.792 1.00 26.64 C ANISOU 1723 C THR A 214 3455 3365 3302 73 -59 -26 C ATOM 1724 O THR A 214 7.536 56.235 16.951 1.00 26.40 O ANISOU 1724 O THR A 214 3421 3338 3273 61 -46 -19 O ATOM 1725 CB THR A 214 6.853 56.160 19.963 1.00 25.43 C ANISOU 1725 CB THR A 214 3293 3234 3136 102 -46 -31 C ATOM 1726 OG1 THR A 214 5.786 57.109 20.112 1.00 25.33 O ANISOU 1726 OG1 THR A 214 3283 3222 3121 114 -58 -39 O ATOM 1727 CG2 THR A 214 7.280 55.642 21.337 1.00 25.36 C ANISOU 1727 CG2 THR A 214 3281 3234 3120 117 -40 -33 C ATOM 0 H THR A 214 8.103 58.212 20.633 1.00 25.46 H new ATOM 0 HA THR A 214 8.787 56.201 19.183 1.00 25.62 H new ATOM 0 HB THR A 214 6.546 55.406 19.435 1.00 25.43 H new ATOM 0 HG1 THR A 214 5.942 57.605 20.772 1.00 25.33 H new ATOM 0 HG21 THR A 214 6.519 55.235 21.780 1.00 25.36 H new ATOM 0 HG22 THR A 214 7.983 54.982 21.230 1.00 25.36 H new ATOM 0 HG23 THR A 214 7.609 56.380 21.873 1.00 25.36 H new ATOM 1728 N LYS A 215 7.276 58.399 17.520 1.00 27.93 N ANISOU 1728 N LYS A 215 3626 3519 3468 75 -77 -30 N ATOM 1729 CA LYS A 215 6.946 58.836 16.162 1.00 29.40 C ANISOU 1729 CA LYS A 215 3816 3697 3657 63 -81 -25 C ATOM 1730 C LYS A 215 8.126 58.601 15.226 1.00 29.10 C ANISOU 1730 C LYS A 215 3779 3652 3624 44 -76 -16 C ATOM 1731 O LYS A 215 7.941 58.155 14.090 1.00 29.49 O ANISOU 1731 O LYS A 215 3829 3703 3673 33 -68 -9 O ATOM 1732 CB LYS A 215 6.556 60.317 16.150 1.00 30.69 C ANISOU 1732 CB LYS A 215 3989 3850 3823 70 -103 -31 C ATOM 1733 CG LYS A 215 6.112 60.847 14.789 1.00 32.23 C ANISOU 1733 CG LYS A 215 4190 4036 4019 60 -108 -26 C ATOM 1734 CD LYS A 215 5.885 62.349 14.834 1.00 33.02 C ANISOU 1734 CD LYS A 215 4300 4122 4124 67 -131 -31 C ATOM 1735 CE LYS A 215 5.550 62.913 13.460 1.00 34.06 C ANISOU 1735 CE LYS A 215 4441 4245 4257 57 -137 -24 C ATOM 1736 NZ LYS A 215 5.504 64.402 13.458 1.00 35.49 N ANISOU 1736 NZ LYS A 215 4632 4409 4444 62 -160 -26 N ATOM 0 H LYS A 215 7.247 59.024 18.111 1.00 27.93 H new ATOM 0 HA LYS A 215 6.190 58.314 15.852 1.00 29.40 H new ATOM 0 HB2 LYS A 215 5.838 60.455 16.787 1.00 30.69 H new ATOM 0 HB3 LYS A 215 7.313 60.841 16.457 1.00 30.69 H new ATOM 0 HG2 LYS A 215 6.785 60.639 14.122 1.00 32.23 H new ATOM 0 HG3 LYS A 215 5.295 60.401 14.516 1.00 32.23 H new ATOM 0 HD2 LYS A 215 5.163 62.548 15.450 1.00 33.02 H new ATOM 0 HD3 LYS A 215 6.680 62.786 15.178 1.00 33.02 H new ATOM 0 HE2 LYS A 215 6.212 62.611 12.818 1.00 34.06 H new ATOM 0 HE3 LYS A 215 4.693 62.564 13.169 1.00 34.06 H new ATOM 0 HZ1 LYS A 215 5.306 64.692 12.640 1.00 35.49 H new ATOM 0 HZ2 LYS A 215 4.882 64.681 14.030 1.00 35.49 H new ATOM 0 HZ3 LYS A 215 6.297 64.724 13.703 1.00 35.49 H new ATOM 1737 N ILE A 216 9.331 58.905 15.708 1.00 28.94 N ANISOU 1737 N ILE A 216 3760 3627 3610 41 -81 -16 N ATOM 1738 CA ILE A 216 10.561 58.671 14.949 1.00 28.81 C ANISOU 1738 CA ILE A 216 3742 3606 3599 24 -75 -6 C ATOM 1739 C ILE A 216 10.756 57.166 14.759 1.00 27.66 C ANISOU 1739 C ILE A 216 3589 3472 3449 19 -55 -3 C ATOM 1740 O ILE A 216 11.030 56.699 13.645 1.00 26.99 O ANISOU 1740 O ILE A 216 3503 3389 3364 7 -46 5 O ATOM 1741 CB ILE A 216 11.798 59.279 15.652 1.00 30.02 C ANISOU 1741 CB ILE A 216 3895 3751 3761 23 -85 -9 C ATOM 1742 CG1 ILE A 216 11.693 60.808 15.695 1.00 30.37 C ANISOU 1742 CG1 ILE A 216 3947 3779 3812 25 -107 -12 C ATOM 1743 CG2 ILE A 216 13.082 58.858 14.948 1.00 30.15 C ANISOU 1743 CG2 ILE A 216 3907 3767 3783 5 -76 1 C ATOM 1744 CD1 ILE A 216 12.846 61.493 16.393 1.00 31.05 C ANISOU 1744 CD1 ILE A 216 4032 3855 3911 24 -121 -16 C ATOM 0 H ILE A 216 9.459 59.253 16.484 1.00 28.94 H new ATOM 0 HA ILE A 216 10.473 59.109 14.088 1.00 28.81 H new ATOM 0 HB ILE A 216 11.824 58.943 16.562 1.00 30.02 H new ATOM 0 HG12 ILE A 216 11.634 61.143 14.787 1.00 30.37 H new ATOM 0 HG13 ILE A 216 10.867 61.052 16.142 1.00 30.37 H new ATOM 0 HG21 ILE A 216 13.844 59.249 15.403 1.00 30.15 H new ATOM 0 HG22 ILE A 216 13.158 57.891 14.964 1.00 30.15 H new ATOM 0 HG23 ILE A 216 13.063 59.166 14.028 1.00 30.15 H new ATOM 0 HD11 ILE A 216 12.708 62.453 16.379 1.00 31.05 H new ATOM 0 HD12 ILE A 216 12.896 61.187 17.312 1.00 31.05 H new ATOM 0 HD13 ILE A 216 13.674 61.279 15.936 1.00 31.05 H new ATOM 1745 N VAL A 217 10.586 56.412 15.844 1.00 26.33 N ANISOU 1745 N VAL A 217 3415 3313 3276 31 -48 -8 N ATOM 1746 CA VAL A 217 10.764 54.961 15.817 1.00 26.52 C ANISOU 1746 CA VAL A 217 3433 3346 3297 28 -30 -5 C ATOM 1747 C VAL A 217 9.808 54.320 14.804 1.00 26.83 C ANISOU 1747 C VAL A 217 3470 3389 3334 23 -21 -1 C ATOM 1748 O VAL A 217 10.213 53.472 14.009 1.00 26.59 O ANISOU 1748 O VAL A 217 3437 3361 3303 13 -10 3 O ATOM 1749 CB VAL A 217 10.538 54.327 17.210 1.00 26.38 C ANISOU 1749 CB VAL A 217 3411 3337 3275 43 -24 -9 C ATOM 1750 CG1 VAL A 217 10.858 52.845 17.176 1.00 26.53 C ANISOU 1750 CG1 VAL A 217 3424 3364 3293 39 -7 -4 C ATOM 1751 CG2 VAL A 217 11.379 55.031 18.268 1.00 26.52 C ANISOU 1751 CG2 VAL A 217 3430 3352 3294 52 -36 -15 C ATOM 0 H VAL A 217 10.365 56.726 16.614 1.00 26.33 H new ATOM 0 HA VAL A 217 11.681 54.792 15.551 1.00 26.52 H new ATOM 0 HB VAL A 217 9.603 54.435 17.445 1.00 26.38 H new ATOM 0 HG11 VAL A 217 10.712 52.462 18.055 1.00 26.53 H new ATOM 0 HG12 VAL A 217 10.282 52.404 16.532 1.00 26.53 H new ATOM 0 HG13 VAL A 217 11.785 52.720 16.919 1.00 26.53 H new ATOM 0 HG21 VAL A 217 11.223 54.619 19.132 1.00 26.52 H new ATOM 0 HG22 VAL A 217 12.318 54.954 18.039 1.00 26.52 H new ATOM 0 HG23 VAL A 217 11.132 55.968 18.307 1.00 26.52 H new ATOM 1752 N ALA A 218 8.548 54.751 14.817 1.00 26.84 N ANISOU 1752 N ALA A 218 3474 3392 3333 30 -26 -5 N ATOM 1753 CA ALA A 218 7.541 54.237 13.887 1.00 28.37 C ANISOU 1753 CA ALA A 218 3665 3589 3526 26 -20 -4 C ATOM 1754 C ALA A 218 7.908 54.444 12.411 1.00 29.09 C ANISOU 1754 C ALA A 218 3761 3675 3617 13 -22 1 C ATOM 1755 O ALA A 218 7.531 53.629 11.566 1.00 30.03 O ANISOU 1755 O ALA A 218 3877 3798 3735 8 -14 2 O ATOM 1756 CB ALA A 218 6.184 54.866 14.177 1.00 29.16 C ANISOU 1756 CB ALA A 218 3766 3690 3623 38 -28 -10 C ATOM 0 H ALA A 218 8.253 55.347 15.362 1.00 26.84 H new ATOM 0 HA ALA A 218 7.502 53.279 14.032 1.00 28.37 H new ATOM 0 HB1 ALA A 218 5.526 54.518 13.555 1.00 29.16 H new ATOM 0 HB2 ALA A 218 5.915 54.652 15.084 1.00 29.16 H new ATOM 0 HB3 ALA A 218 6.245 55.829 14.077 1.00 29.16 H new ATOM 1757 N LYS A 219 8.635 55.518 12.103 1.00 30.07 N ANISOU 1757 N LYS A 219 3892 3791 3743 8 -32 4 N ATOM 1758 CA LYS A 219 9.064 55.800 10.722 1.00 30.71 C ANISOU 1758 CA LYS A 219 3978 3868 3823 -4 -33 12 C ATOM 1759 C LYS A 219 10.139 54.832 10.223 1.00 30.32 C ANISOU 1759 C LYS A 219 3923 3824 3773 -13 -20 17 C ATOM 1760 O LYS A 219 10.307 54.650 9.020 1.00 29.38 O ANISOU 1760 O LYS A 219 3806 3707 3650 -21 -16 22 O ATOM 1761 CB LYS A 219 9.621 57.219 10.600 1.00 32.65 C ANISOU 1761 CB LYS A 219 4231 4103 4073 -8 -47 16 C ATOM 1762 CG LYS A 219 8.614 58.331 10.834 1.00 34.81 C ANISOU 1762 CG LYS A 219 4511 4368 4346 2 -63 11 C ATOM 1763 CD LYS A 219 9.324 59.668 11.018 1.00 36.08 C ANISOU 1763 CD LYS A 219 4679 4515 4515 -2 -78 15 C ATOM 1764 CE LYS A 219 8.356 60.812 11.279 1.00 37.42 C ANISOU 1764 CE LYS A 219 4857 4677 4686 9 -96 9 C ATOM 1765 NZ LYS A 219 7.725 61.322 10.030 1.00 37.74 N ANISOU 1765 NZ LYS A 219 4905 4713 4722 6 -100 14 N ATOM 0 H LYS A 219 8.894 56.101 12.679 1.00 30.07 H new ATOM 0 HA LYS A 219 8.269 55.693 10.177 1.00 30.71 H new ATOM 0 HB2 LYS A 219 10.348 57.321 11.234 1.00 32.65 H new ATOM 0 HB3 LYS A 219 10.001 57.327 9.714 1.00 32.65 H new ATOM 0 HG2 LYS A 219 8.003 58.384 10.082 1.00 34.81 H new ATOM 0 HG3 LYS A 219 8.081 58.131 11.619 1.00 34.81 H new ATOM 0 HD2 LYS A 219 9.947 59.600 11.758 1.00 36.08 H new ATOM 0 HD3 LYS A 219 9.846 59.865 10.225 1.00 36.08 H new ATOM 0 HE2 LYS A 219 7.663 60.513 11.889 1.00 37.42 H new ATOM 0 HE3 LYS A 219 8.828 61.537 11.719 1.00 37.42 H new ATOM 0 HZ1 LYS A 219 7.169 61.988 10.229 1.00 37.74 H new ATOM 0 HZ2 LYS A 219 8.357 61.619 9.478 1.00 37.74 H new ATOM 0 HZ3 LYS A 219 7.272 60.665 9.636 1.00 37.74 H new ATOM 1766 N ARG A 220 10.880 54.237 11.152 1.00 28.86 N ANISOU 1766 N ARG A 220 3732 3641 3590 -12 -14 15 N ATOM 1767 CA ARG A 220 11.959 53.317 10.803 1.00 28.21 C ANISOU 1767 CA ARG A 220 3645 3565 3508 -19 -2 19 C ATOM 1768 C ARG A 220 11.363 51.955 10.452 1.00 26.79 C ANISOU 1768 C ARG A 220 3461 3393 3326 -18 9 16 C ATOM 1769 O ARG A 220 10.293 51.596 10.954 1.00 27.70 O ANISOU 1769 O ARG A 220 3574 3509 3441 -10 10 11 O ATOM 1770 CB ARG A 220 12.940 53.184 11.973 1.00 28.48 C ANISOU 1770 CB ARG A 220 3675 3599 3547 -17 -1 17 C ATOM 1771 CG ARG A 220 13.551 54.496 12.457 1.00 29.34 C ANISOU 1771 CG ARG A 220 3788 3699 3662 -18 -15 18 C ATOM 1772 CD ARG A 220 14.707 54.973 11.592 1.00 30.20 C ANISOU 1772 CD ARG A 220 3896 3805 3774 -31 -15 26 C ATOM 1773 NE ARG A 220 15.124 56.340 11.924 1.00 31.00 N ANISOU 1773 NE ARG A 220 4000 3894 3884 -34 -30 28 N ATOM 1774 CZ ARG A 220 15.958 56.688 12.910 1.00 32.62 C ANISOU 1774 CZ ARG A 220 4202 4094 4097 -32 -37 23 C ATOM 1775 NH1 ARG A 220 16.513 55.780 13.709 1.00 32.48 N ANISOU 1775 NH1 ARG A 220 4178 4085 4079 -26 -30 18 N ATOM 1776 NH2 ARG A 220 16.246 57.971 13.101 1.00 33.37 N ANISOU 1776 NH2 ARG A 220 4301 4177 4202 -34 -53 24 N ATOM 0 H ARG A 220 10.773 54.354 11.997 1.00 28.86 H new ATOM 0 HA ARG A 220 12.444 53.662 10.037 1.00 28.21 H new ATOM 0 HB2 ARG A 220 12.480 52.764 12.716 1.00 28.48 H new ATOM 0 HB3 ARG A 220 13.658 52.587 11.709 1.00 28.48 H new ATOM 0 HG2 ARG A 220 12.863 55.180 12.473 1.00 29.34 H new ATOM 0 HG3 ARG A 220 13.862 54.384 13.369 1.00 29.34 H new ATOM 0 HD2 ARG A 220 15.460 54.372 11.702 1.00 30.20 H new ATOM 0 HD3 ARG A 220 14.447 54.934 10.658 1.00 30.20 H new ATOM 0 HE ARG A 220 14.803 56.975 11.441 1.00 31.00 H new ATOM 0 HH11 ARG A 220 16.338 54.945 13.598 1.00 32.48 H new ATOM 0 HH12 ARG A 220 17.046 56.028 14.336 1.00 32.48 H new ATOM 0 HH21 ARG A 220 15.897 58.570 12.593 1.00 33.37 H new ATOM 0 HH22 ARG A 220 16.781 58.202 13.733 1.00 33.37 H new ATOM 1777 N AASN A 221 12.040 51.207 9.586 0.50 25.46 N ANISOU 1777 N AASN A 221 3290 3229 3155 -24 18 19 N ATOM 1778 N BASN A 221 12.049 51.207 9.593 0.50 25.79 N ANISOU 1778 N BASN A 221 3332 3271 3197 -24 18 19 N ATOM 1779 CA AASN A 221 11.593 49.868 9.211 0.50 24.87 C ANISOU 1779 CA AASN A 221 3210 3159 3078 -23 27 15 C ATOM 1780 CA BASN A 221 11.613 49.870 9.201 0.50 25.39 C ANISOU 1780 CA BASN A 221 3276 3225 3144 -23 27 15 C ATOM 1781 C AASN A 221 12.357 48.812 9.994 0.50 24.21 C ANISOU 1781 C AASN A 221 3122 3080 2999 -21 35 14 C ATOM 1782 C BASN A 221 12.362 48.807 9.992 0.50 24.49 C ANISOU 1782 C BASN A 221 3157 3115 3034 -21 35 14 C ATOM 1783 O AASN A 221 13.537 48.567 9.729 0.50 23.99 O ANISOU 1783 O AASN A 221 3091 3054 2969 -26 40 16 O ATOM 1784 O BASN A 221 13.540 48.550 9.730 0.50 24.25 O ANISOU 1784 O BASN A 221 3124 3087 3002 -26 40 16 O ATOM 1785 CB AASN A 221 11.781 49.621 7.718 0.50 25.26 C ANISOU 1785 CB AASN A 221 3261 3213 3122 -28 29 17 C ATOM 1786 CB BASN A 221 11.847 49.648 7.709 0.50 26.23 C ANISOU 1786 CB BASN A 221 3385 3336 3245 -29 29 17 C ATOM 1787 CG AASN A 221 11.045 48.383 7.240 0.50 25.39 C ANISOU 1787 CG AASN A 221 3275 3233 3139 -25 34 10 C ATOM 1788 CG BASN A 221 10.965 50.526 6.844 0.50 26.80 C ANISOU 1788 CG BASN A 221 3463 3406 3313 -28 21 18 C ATOM 1789 OD1AASN A 221 9.892 48.149 7.612 0.50 26.33 O ANISOU 1789 OD1AASN A 221 3391 3349 3262 -21 32 5 O ATOM 1790 OD1BASN A 221 9.964 51.072 7.310 0.50 28.45 O ANISOU 1790 OD1BASN A 221 3675 3611 3525 -24 13 15 O ATOM 1791 ND2AASN A 221 11.704 47.584 6.409 0.50 25.45 N ANISOU 1791 ND2AASN A 221 3281 3247 3144 -28 40 9 N ATOM 1792 ND2BASN A 221 11.335 50.669 5.577 0.50 27.73 N ANISOU 1792 ND2BASN A 221 3585 3528 3424 -33 21 23 N ATOM 0 H AASN A 221 12.767 51.459 9.201 0.50 25.79 H new ATOM 0 H BASN A 221 12.781 51.461 9.220 0.50 25.79 H new ATOM 0 HA AASN A 221 10.648 49.807 9.421 0.50 25.39 H new ATOM 0 HA BASN A 221 10.665 49.798 9.391 0.50 25.39 H new ATOM 0 HB2AASN A 221 11.466 50.393 7.223 0.50 26.23 H new ATOM 0 HB2BASN A 221 12.778 49.826 7.501 0.50 26.23 H new ATOM 0 HB3AASN A 221 12.727 49.527 7.525 0.50 26.23 H new ATOM 0 HB3BASN A 221 11.681 48.717 7.494 0.50 26.23 H new ATOM 0 HD21AASN A 221 11.328 46.871 6.109 0.50 27.73 H new ATOM 0 HD21BASN A 221 10.869 51.159 5.046 0.50 27.73 H new ATOM 0 HD22AASN A 221 12.507 47.779 6.171 0.50 27.73 H new ATOM 0 HD22BASN A 221 12.041 50.272 5.288 0.50 27.73 H new ATOM 1793 N LEU A 222 11.682 48.203 10.965 1.00 23.38 N ANISOU 1793 N LEU A 222 3013 2974 2897 -14 38 10 N ATOM 1794 CA LEU A 222 12.286 47.179 11.813 1.00 22.40 C ANISOU 1794 CA LEU A 222 2884 2851 2774 -11 47 10 C ATOM 1795 C LEU A 222 11.475 45.897 11.718 1.00 21.79 C ANISOU 1795 C LEU A 222 2803 2774 2702 -9 54 8 C ATOM 1796 O LEU A 222 10.271 45.928 11.446 1.00 21.95 O ANISOU 1796 O LEU A 222 2823 2794 2724 -8 52 6 O ATOM 1797 CB LEU A 222 12.336 47.657 13.266 1.00 21.93 C ANISOU 1797 CB LEU A 222 2826 2791 2716 -2 44 10 C ATOM 1798 CG LEU A 222 13.139 48.937 13.510 1.00 21.92 C ANISOU 1798 CG LEU A 222 2827 2787 2713 -3 34 11 C ATOM 1799 CD1 LEU A 222 12.886 49.477 14.908 1.00 22.50 C ANISOU 1799 CD1 LEU A 222 2902 2860 2787 8 29 8 C ATOM 1800 CD2 LEU A 222 14.627 48.707 13.277 1.00 21.62 C ANISOU 1800 CD2 LEU A 222 2787 2750 2676 -9 37 12 C ATOM 0 H ALEU A 222 10.860 48.372 11.151 0.50 23.38 H new ATOM 0 H BLEU A 222 10.860 48.375 11.151 0.50 23.38 H new ATOM 0 HA LEU A 222 13.192 47.011 11.510 1.00 22.40 H new ATOM 0 HB2 LEU A 222 11.428 47.800 13.575 1.00 21.93 H new ATOM 0 HB3 LEU A 222 12.713 46.948 13.811 1.00 21.93 H new ATOM 0 HG LEU A 222 12.839 49.602 12.871 1.00 21.92 H new ATOM 0 HD11 LEU A 222 13.404 50.287 15.041 1.00 22.50 H new ATOM 0 HD12 LEU A 222 11.942 49.676 15.012 1.00 22.50 H new ATOM 0 HD13 LEU A 222 13.150 48.813 15.564 1.00 22.50 H new ATOM 0 HD21 LEU A 222 15.111 49.532 13.438 1.00 21.62 H new ATOM 0 HD22 LEU A 222 14.947 48.021 13.883 1.00 21.62 H new ATOM 0 HD23 LEU A 222 14.771 48.422 12.361 1.00 21.62 H new ATOM 1801 N ASN A 223 12.136 44.765 11.931 1.00 21.24 N ANISOU 1801 N ASN A 223 2730 2706 2634 -8 61 8 N ATOM 1802 CA ASN A 223 11.447 43.479 11.977 1.00 21.39 C ANISOU 1802 CA ASN A 223 2744 2722 2659 -7 68 6 C ATOM 1803 C ASN A 223 12.046 42.583 13.057 1.00 20.36 C ANISOU 1803 C ASN A 223 2613 2592 2533 -2 75 9 C ATOM 1804 O ASN A 223 13.051 42.936 13.694 1.00 21.03 O ANISOU 1804 O ASN A 223 2699 2679 2612 1 75 11 O ATOM 1805 CB ASN A 223 11.483 42.787 10.602 1.00 21.39 C ANISOU 1805 CB ASN A 223 2744 2723 2661 -12 68 1 C ATOM 1806 CG ASN A 223 10.186 42.057 10.276 1.00 21.92 C ANISOU 1806 CG ASN A 223 2806 2785 2736 -12 68 -2 C ATOM 1807 OD1 ASN A 223 9.500 41.565 11.164 1.00 22.55 O ANISOU 1807 OD1 ASN A 223 2882 2862 2824 -10 72 1 O ATOM 1808 ND2 ASN A 223 9.850 41.981 8.990 1.00 23.22 N ANISOU 1808 ND2 ASN A 223 2972 2950 2900 -15 63 -8 N ATOM 0 H ASN A 223 12.986 44.719 12.052 1.00 21.24 H new ATOM 0 HA ASN A 223 10.518 43.642 12.204 1.00 21.39 H new ATOM 0 HB2 ASN A 223 11.658 43.449 9.915 1.00 21.39 H new ATOM 0 HB3 ASN A 223 12.219 42.156 10.581 1.00 21.39 H new ATOM 0 HD21 ASN A 223 9.128 41.575 8.757 1.00 23.22 H new ATOM 0 HD22 ASN A 223 10.355 42.338 8.392 1.00 23.22 H new ATOM 1809 N THR A 224 11.412 41.438 13.281 1.00 20.17 N ANISOU 1809 N THR A 224 2584 2563 2515 -1 81 10 N ATOM 1810 CA THR A 224 11.817 40.541 14.353 1.00 19.80 C ANISOU 1810 CA THR A 224 2537 2516 2472 5 89 15 C ATOM 1811 C THR A 224 11.819 39.074 13.942 1.00 20.07 C ANISOU 1811 C THR A 224 2568 2543 2515 3 93 14 C ATOM 1812 O THR A 224 11.075 38.654 13.055 1.00 19.97 O ANISOU 1812 O THR A 224 2552 2526 2509 -2 91 10 O ATOM 1813 CB THR A 224 10.896 40.676 15.591 1.00 19.97 C ANISOU 1813 CB THR A 224 2557 2537 2495 12 93 22 C ATOM 1814 OG1 THR A 224 9.558 40.288 15.249 1.00 20.02 O ANISOU 1814 OG1 THR A 224 2556 2539 2510 9 95 22 O ATOM 1815 CG2 THR A 224 10.901 42.105 16.142 1.00 19.97 C ANISOU 1815 CG2 THR A 224 2559 2542 2485 18 87 21 C ATOM 0 H THR A 224 10.741 41.162 12.820 1.00 20.17 H new ATOM 0 HA THR A 224 12.723 40.811 14.568 1.00 19.80 H new ATOM 0 HB THR A 224 11.238 40.089 16.283 1.00 19.97 H new ATOM 0 HG1 THR A 224 9.198 40.895 14.793 1.00 20.02 H new ATOM 0 HG21 THR A 224 10.316 42.156 16.914 1.00 19.97 H new ATOM 0 HG22 THR A 224 11.803 42.348 16.403 1.00 19.97 H new ATOM 0 HG23 THR A 224 10.587 42.717 15.458 1.00 19.97 H new ATOM 1816 N PHE A 225 12.678 38.309 14.604 1.00 20.39 N ANISOU 1816 N PHE A 225 2610 2583 2556 8 98 16 N ATOM 1817 CA PHE A 225 12.571 36.858 14.640 1.00 20.79 C ANISOU 1817 CA PHE A 225 2658 2625 2616 8 103 18 C ATOM 1818 C PHE A 225 12.708 36.436 16.099 1.00 21.30 C ANISOU 1818 C PHE A 225 2723 2688 2680 17 111 28 C ATOM 1819 O PHE A 225 13.655 36.852 16.767 1.00 21.34 O ANISOU 1819 O PHE A 225 2732 2699 2676 23 110 28 O ATOM 1820 CB PHE A 225 13.681 36.192 13.825 1.00 21.02 C ANISOU 1820 CB PHE A 225 2689 2654 2645 7 100 10 C ATOM 1821 CG PHE A 225 13.544 36.340 12.331 1.00 20.94 C ANISOU 1821 CG PHE A 225 2677 2646 2634 1 94 1 C ATOM 1822 CD1 PHE A 225 14.574 36.913 11.582 1.00 20.75 C ANISOU 1822 CD1 PHE A 225 2655 2630 2599 0 91 -5 C ATOM 1823 CD2 PHE A 225 12.419 35.871 11.666 1.00 21.73 C ANISOU 1823 CD2 PHE A 225 2774 2739 2744 -4 91 -3 C ATOM 1824 CE1 PHE A 225 14.469 37.031 10.208 1.00 21.05 C ANISOU 1824 CE1 PHE A 225 2692 2671 2634 -4 86 -12 C ATOM 1825 CE2 PHE A 225 12.312 35.990 10.291 1.00 21.33 C ANISOU 1825 CE2 PHE A 225 2723 2691 2692 -7 85 -12 C ATOM 1826 CZ PHE A 225 13.335 36.569 9.565 1.00 21.46 C ANISOU 1826 CZ PHE A 225 2743 2717 2695 -6 82 -17 C ATOM 0 H PHE A 225 13.345 38.621 15.049 1.00 20.39 H new ATOM 0 HA PHE A 225 11.722 36.586 14.259 1.00 20.79 H new ATOM 0 HB2 PHE A 225 14.534 36.566 14.098 1.00 21.02 H new ATOM 0 HB3 PHE A 225 13.703 35.247 14.043 1.00 21.02 H new ATOM 0 HD1 PHE A 225 15.340 37.219 12.012 1.00 20.75 H new ATOM 0 HD2 PHE A 225 11.731 35.473 12.149 1.00 21.73 H new ATOM 0 HE1 PHE A 225 15.158 37.419 9.719 1.00 21.05 H new ATOM 0 HE2 PHE A 225 11.551 35.680 9.856 1.00 21.33 H new ATOM 0 HZ PHE A 225 13.261 36.648 8.641 1.00 21.46 H new ATOM 1827 N LEU A 226 11.771 35.627 16.592 1.00 21.90 N ANISOU 1827 N LEU A 226 2797 2758 2768 17 117 36 N ATOM 1828 CA LEU A 226 11.822 35.099 17.960 1.00 22.36 C ANISOU 1828 CA LEU A 226 2855 2814 2825 26 126 48 C ATOM 1829 C LEU A 226 12.174 33.614 17.900 1.00 23.04 C ANISOU 1829 C LEU A 226 2942 2889 2922 25 129 50 C ATOM 1830 O LEU A 226 11.709 32.911 17.002 1.00 23.60 O ANISOU 1830 O LEU A 226 3009 2951 3007 17 127 46 O ATOM 1831 CB LEU A 226 10.480 35.279 18.676 1.00 22.15 C ANISOU 1831 CB LEU A 226 2824 2789 2803 27 133 58 C ATOM 1832 CG LEU A 226 10.070 36.688 19.111 1.00 22.10 C ANISOU 1832 CG LEU A 226 2818 2794 2786 32 131 58 C ATOM 1833 CD1 LEU A 226 11.113 37.310 20.038 1.00 21.26 C ANISOU 1833 CD1 LEU A 226 2718 2695 2663 44 129 58 C ATOM 1834 CD2 LEU A 226 9.811 37.590 17.910 1.00 22.01 C ANISOU 1834 CD2 LEU A 226 2806 2784 2774 23 121 46 C ATOM 0 H LEU A 226 11.085 35.367 16.143 1.00 21.90 H new ATOM 0 HA LEU A 226 12.495 35.588 18.459 1.00 22.36 H new ATOM 0 HB2 LEU A 226 9.785 34.936 18.092 1.00 22.15 H new ATOM 0 HB3 LEU A 226 10.489 34.717 19.466 1.00 22.15 H new ATOM 0 HG LEU A 226 9.240 36.605 19.606 1.00 22.10 H new ATOM 0 HD11 LEU A 226 10.827 38.200 20.296 1.00 21.26 H new ATOM 0 HD12 LEU A 226 11.211 36.759 20.831 1.00 21.26 H new ATOM 0 HD13 LEU A 226 11.964 37.366 19.576 1.00 21.26 H new ATOM 0 HD21 LEU A 226 9.554 38.473 18.218 1.00 22.01 H new ATOM 0 HD22 LEU A 226 10.617 37.657 17.375 1.00 22.01 H new ATOM 0 HD23 LEU A 226 9.097 37.215 17.372 1.00 22.01 H new ATOM 1835 N ATYR A 227 12.966 33.136 18.852 0.70 24.61 N ANISOU 1835 N ATYR A 227 3145 3088 3116 35 134 57 N ATOM 1836 N BTYR A 227 12.994 33.157 18.847 0.30 23.66 N ANISOU 1836 N BTYR A 227 3026 2969 2996 35 134 56 N ATOM 1837 CA ATYR A 227 13.448 31.751 18.804 0.70 26.36 C ANISOU 1837 CA ATYR A 227 3369 3298 3347 36 135 58 C ATOM 1838 CA BTYR A 227 13.544 31.796 18.813 0.30 24.38 C ANISOU 1838 CA BTYR A 227 3120 3049 3096 36 135 58 C ATOM 1839 C ATYR A 227 13.459 30.981 20.131 0.70 26.47 C ANISOU 1839 C ATYR A 227 3387 3308 3362 46 145 74 C ATOM 1840 C BTYR A 227 13.462 30.992 20.122 0.30 25.27 C ANISOU 1840 C BTYR A 227 3235 3156 3210 45 145 74 C ATOM 1841 O ATYR A 227 13.735 29.784 20.127 0.70 26.48 O ANISOU 1841 O ATYR A 227 3390 3297 3373 46 146 77 O ATOM 1842 O BTYR A 227 13.660 29.777 20.095 0.30 25.42 O ANISOU 1842 O BTYR A 227 3256 3163 3240 45 146 77 O ATOM 1843 CB ATYR A 227 14.850 31.717 18.187 0.70 27.75 C ANISOU 1843 CB ATYR A 227 3550 3478 3516 38 128 45 C ATOM 1844 CB BTYR A 227 15.006 31.845 18.350 0.30 24.12 C ANISOU 1844 CB BTYR A 227 3091 3020 3053 40 128 46 C ATOM 1845 CG ATYR A 227 15.818 32.657 18.861 0.70 29.13 C ANISOU 1845 CG ATYR A 227 3729 3666 3674 47 126 44 C ATOM 1846 CG BTYR A 227 15.928 32.560 19.312 0.30 23.87 C ANISOU 1846 CG BTYR A 227 3064 3000 3005 52 128 47 C ATOM 1847 CD1ATYR A 227 16.316 32.386 20.132 0.70 30.21 C ANISOU 1847 CD1ATYR A 227 3870 3805 3804 60 131 52 C ATOM 1848 CD1BTYR A 227 16.378 31.938 20.466 0.30 23.97 C ANISOU 1848 CD1BTYR A 227 3082 3012 3015 64 133 56 C ATOM 1849 CD2ATYR A 227 16.220 33.828 18.237 0.70 30.42 C ANISOU 1849 CD2ATYR A 227 3891 3839 3829 44 119 34 C ATOM 1850 CD2BTYR A 227 16.351 33.855 19.062 0.30 23.60 C ANISOU 1850 CD2BTYR A 227 3029 2977 2961 51 122 39 C ATOM 1851 CE1ATYR A 227 17.192 33.253 20.758 0.70 31.34 C ANISOU 1851 CE1ATYR A 227 4017 3959 3933 69 127 48 C ATOM 1852 CE1BTYR A 227 17.218 32.589 21.350 0.30 23.96 C ANISOU 1852 CE1BTYR A 227 3084 3020 2999 76 131 55 C ATOM 1853 CE2ATYR A 227 17.102 34.697 18.852 0.70 31.05 C ANISOU 1853 CE2ATYR A 227 3973 3929 3896 51 117 32 C ATOM 1854 CE2BTYR A 227 17.190 34.515 19.938 0.30 23.57 C ANISOU 1854 CE2BTYR A 227 3029 2982 2945 61 120 38 C ATOM 1855 CZ ATYR A 227 17.579 34.408 20.116 0.70 31.70 C ANISOU 1855 CZ ATYR A 227 4059 4013 3972 64 120 38 C ATOM 1856 CZ BTYR A 227 17.617 33.880 21.082 0.30 23.74 C ANISOU 1856 CZ BTYR A 227 3055 3004 2963 74 124 45 C ATOM 1857 OH ATYR A 227 18.454 35.265 20.747 0.70 34.57 O ANISOU 1857 OH ATYR A 227 4425 4386 4325 72 115 34 O ATOM 1858 OH BTYR A 227 18.455 34.537 21.953 0.30 23.42 O ANISOU 1858 OH BTYR A 227 3017 2971 2910 86 121 43 O ATOM 0 H ATYR A 227 13.237 33.589 19.531 0.70 23.66 H new ATOM 0 H BTYR A 227 13.247 33.622 19.524 0.30 23.66 H new ATOM 0 HA ATYR A 227 12.793 31.288 18.258 0.70 24.38 H new ATOM 0 HA BTYR A 227 12.972 31.321 18.190 0.30 24.38 H new ATOM 0 HB2ATYR A 227 15.198 30.813 18.238 0.70 24.12 H new ATOM 0 HB2BTYR A 227 15.326 30.938 18.222 0.30 24.12 H new ATOM 0 HB3ATYR A 227 14.789 31.945 17.246 0.70 24.12 H new ATOM 0 HB3BTYR A 227 15.048 32.286 17.487 0.30 24.12 H new ATOM 0 HD1ATYR A 227 16.055 31.607 20.568 0.70 23.97 H new ATOM 0 HD1BTYR A 227 16.110 31.067 20.649 0.30 23.97 H new ATOM 0 HD2ATYR A 227 15.891 34.032 17.391 0.70 23.60 H new ATOM 0 HD2BTYR A 227 16.065 34.288 18.290 0.30 23.60 H new ATOM 0 HE1ATYR A 227 17.518 33.058 21.607 0.70 23.96 H new ATOM 0 HE1BTYR A 227 17.512 32.158 22.120 0.30 23.96 H new ATOM 0 HE2ATYR A 227 17.373 35.473 18.417 0.70 23.57 H new ATOM 0 HE2BTYR A 227 17.465 35.384 19.756 0.30 23.57 H new ATOM 0 HH ATYR A 227 18.607 35.925 20.250 0.70 23.42 H new ATOM 0 HH BTYR A 227 18.612 35.309 21.662 0.30 23.42 H new ATOM 1859 N THR A 228 13.188 31.640 21.254 1.00 26.04 N ANISOU 1859 N THR A 228 3333 3263 3297 54 151 84 N ATOM 1860 CA THR A 228 13.126 30.930 22.542 1.00 27.41 C ANISOU 1860 CA THR A 228 3511 3435 3470 65 162 101 C ATOM 1861 C THR A 228 12.332 31.691 23.590 1.00 28.26 C ANISOU 1861 C THR A 228 3616 3553 3567 73 170 112 C ATOM 1862 O THR A 228 11.822 32.782 23.326 1.00 26.70 O ANISOU 1862 O THR A 228 3415 3365 3365 70 167 106 O ATOM 1863 CB THR A 228 14.537 30.606 23.096 1.00 28.20 C ANISOU 1863 CB THR A 228 3619 3536 3558 78 159 98 C ATOM 1864 OG1 THR A 228 14.434 29.569 24.081 1.00 29.79 O ANISOU 1864 OG1 THR A 228 3825 3731 3763 87 169 115 O ATOM 1865 CG2 THR A 228 15.187 31.833 23.714 1.00 28.09 C ANISOU 1865 CG2 THR A 228 3609 3538 3524 90 155 92 C ATOM 0 H ATHR A 228 13.038 32.486 21.299 0.70 26.04 H new ATOM 0 H BTHR A 228 13.035 32.485 21.303 0.30 26.04 H new ATOM 0 HA THR A 228 12.664 30.097 22.357 1.00 27.41 H new ATOM 0 HB THR A 228 15.093 30.312 22.358 1.00 28.20 H new ATOM 0 HG1 THR A 228 15.198 29.391 24.382 1.00 29.79 H new ATOM 0 HG21 THR A 228 16.066 31.599 24.051 1.00 28.09 H new ATOM 0 HG22 THR A 228 15.273 32.527 23.042 1.00 28.09 H new ATOM 0 HG23 THR A 228 14.637 32.157 24.445 1.00 28.09 H new ATOM 1866 N VAL A 229 12.201 31.085 24.769 1.00 30.11 N ANISOU 1866 N VAL A 229 3854 3788 3799 84 181 129 N ATOM 1867 CA VAL A 229 11.584 31.745 25.916 1.00 30.58 C ANISOU 1867 CA VAL A 229 3913 3861 3846 97 190 141 C ATOM 1868 C VAL A 229 12.439 31.519 27.159 1.00 31.30 C ANISOU 1868 C VAL A 229 4014 3958 3920 117 193 149 C ATOM 1869 O VAL A 229 13.259 30.597 27.198 1.00 31.81 O ANISOU 1869 O VAL A 229 4085 4014 3988 120 192 150 O ATOM 1870 CB VAL A 229 10.146 31.249 26.178 1.00 31.68 C ANISOU 1870 CB VAL A 229 4043 3996 3998 90 203 159 C ATOM 1871 CG1 VAL A 229 9.280 31.436 24.941 1.00 31.59 C ANISOU 1871 CG1 VAL A 229 4021 3977 4003 71 198 150 C ATOM 1872 CG2 VAL A 229 10.139 29.794 26.619 1.00 31.56 C ANISOU 1872 CG2 VAL A 229 4029 3967 3995 90 214 177 C ATOM 0 H VAL A 229 12.467 30.282 24.925 1.00 30.11 H new ATOM 0 HA VAL A 229 11.531 32.692 25.712 1.00 30.58 H new ATOM 0 HB VAL A 229 9.774 31.782 26.898 1.00 31.68 H new ATOM 0 HG11 VAL A 229 8.382 31.119 25.124 1.00 31.59 H new ATOM 0 HG12 VAL A 229 9.249 32.377 24.706 1.00 31.59 H new ATOM 0 HG13 VAL A 229 9.656 30.931 24.203 1.00 31.59 H new ATOM 0 HG21 VAL A 229 9.226 29.508 26.777 1.00 31.56 H new ATOM 0 HG22 VAL A 229 10.535 29.243 25.925 1.00 31.56 H new ATOM 0 HG23 VAL A 229 10.652 29.701 27.437 1.00 31.56 H new ATOM 1873 N ALA A 230 12.246 32.372 28.162 1.00 30.61 N ANISOU 1873 N ALA A 230 3928 3887 3815 133 196 152 N ATOM 1874 CA ALA A 230 13.022 32.315 29.396 1.00 31.64 C ANISOU 1874 CA ALA A 230 4068 4026 3927 155 198 158 C ATOM 1875 C ALA A 230 12.632 31.095 30.226 1.00 32.83 C ANISOU 1875 C ALA A 230 4221 4172 4081 162 214 182 C ATOM 1876 O ALA A 230 13.470 30.513 30.919 1.00 32.66 O ANISOU 1876 O ALA A 230 4209 4149 4050 176 215 187 O ATOM 1877 CB ALA A 230 12.814 33.582 30.207 1.00 31.73 C ANISOU 1877 CB ALA A 230 4081 4057 3919 171 196 154 C ATOM 0 H ALA A 230 11.660 33.001 28.145 1.00 30.61 H new ATOM 0 HA ALA A 230 13.960 32.240 29.161 1.00 31.64 H new ATOM 0 HB1 ALA A 230 13.334 33.532 31.024 1.00 31.73 H new ATOM 0 HB2 ALA A 230 13.101 34.350 29.688 1.00 31.73 H new ATOM 0 HB3 ALA A 230 11.874 33.674 30.428 1.00 31.73 H new ATOM 1878 N ASP A 231 11.356 30.727 30.141 1.00 34.13 N ANISOU 1878 N ASP A 231 4376 4332 4258 151 227 198 N ATOM 1879 CA ASP A 231 10.788 29.635 30.924 1.00 36.59 C ANISOU 1879 CA ASP A 231 4688 4638 4576 155 244 224 C ATOM 1880 C ASP A 231 9.753 28.897 30.075 1.00 36.95 C ANISOU 1880 C ASP A 231 4722 4667 4651 131 250 233 C ATOM 1881 O ASP A 231 8.702 29.449 29.748 1.00 37.02 O ANISOU 1881 O ASP A 231 4719 4681 4665 122 253 232 O ATOM 1882 CB ASP A 231 10.144 30.196 32.198 1.00 37.89 C ANISOU 1882 CB ASP A 231 4852 4823 4721 175 257 239 C ATOM 1883 CG ASP A 231 9.658 29.112 33.149 1.00 39.17 C ANISOU 1883 CG ASP A 231 5015 4982 4885 182 277 270 C ATOM 1884 OD1 ASP A 231 9.358 29.451 34.311 1.00 41.69 O ANISOU 1884 OD1 ASP A 231 5336 5321 5184 202 288 284 O ATOM 1885 OD2 ASP A 231 9.577 27.931 32.751 1.00 40.62 O ANISOU 1885 OD2 ASP A 231 5198 5146 5091 168 281 281 O ATOM 0 H ASP A 231 10.789 31.110 29.620 1.00 34.13 H new ATOM 0 HA ASP A 231 11.486 29.012 31.182 1.00 36.59 H new ATOM 0 HB2 ASP A 231 10.787 30.758 32.658 1.00 37.89 H new ATOM 0 HB3 ASP A 231 9.396 30.763 31.953 1.00 37.89 H new ATOM 1886 N PHE A 232 10.054 27.647 29.729 1.00 37.29 N ANISOU 1886 N PHE A 232 4767 4690 4711 123 251 239 N ATOM 1887 CA PHE A 232 9.165 26.834 28.891 1.00 38.09 C ANISOU 1887 CA PHE A 232 4858 4772 4843 100 254 245 C ATOM 1888 C PHE A 232 7.997 26.201 29.662 1.00 39.49 C ANISOU 1888 C PHE A 232 5027 4947 5031 98 274 275 C ATOM 1889 O PHE A 232 7.227 25.431 29.089 1.00 40.51 O ANISOU 1889 O PHE A 232 5145 5058 5187 80 277 282 O ATOM 1890 CB PHE A 232 9.970 25.755 28.147 1.00 37.59 C ANISOU 1890 CB PHE A 232 4800 4686 4795 92 244 238 C ATOM 1891 CG PHE A 232 10.708 26.274 26.942 1.00 36.88 C ANISOU 1891 CG PHE A 232 4713 4597 4705 85 225 208 C ATOM 1892 CD1 PHE A 232 10.056 26.410 25.726 1.00 37.01 C ANISOU 1892 CD1 PHE A 232 4718 4605 4739 67 218 196 C ATOM 1893 CD2 PHE A 232 12.045 26.638 27.027 1.00 36.66 C ANISOU 1893 CD2 PHE A 232 4695 4576 4659 98 215 194 C ATOM 1894 CE1 PHE A 232 10.725 26.894 24.612 1.00 36.57 C ANISOU 1894 CE1 PHE A 232 4664 4550 4680 61 202 170 C ATOM 1895 CE2 PHE A 232 12.720 27.121 25.917 1.00 35.81 C ANISOU 1895 CE2 PHE A 232 4587 4469 4550 91 199 169 C ATOM 1896 CZ PHE A 232 12.057 27.250 24.708 1.00 35.69 C ANISOU 1896 CZ PHE A 232 4563 4448 4551 73 194 158 C ATOM 0 H PHE A 232 10.775 27.245 29.971 1.00 37.29 H new ATOM 0 HA PHE A 232 8.764 27.442 28.250 1.00 38.09 H new ATOM 0 HB2 PHE A 232 10.608 25.358 28.761 1.00 37.59 H new ATOM 0 HB3 PHE A 232 9.367 25.048 27.868 1.00 37.59 H new ATOM 0 HD1 PHE A 232 9.159 26.174 25.657 1.00 37.01 H new ATOM 0 HD2 PHE A 232 12.493 26.557 27.838 1.00 36.66 H new ATOM 0 HE1 PHE A 232 10.278 26.979 23.801 1.00 36.57 H new ATOM 0 HE2 PHE A 232 13.617 27.358 25.984 1.00 35.81 H new ATOM 0 HZ PHE A 232 12.507 27.576 23.962 1.00 35.69 H new ATOM 1897 N GLY A 233 7.859 26.538 30.945 1.00 41.07 N ANISOU 1897 N GLY A 233 5231 5165 5210 118 287 292 N ATOM 1898 CA GLY A 233 6.752 26.061 31.784 1.00 42.32 C ANISOU 1898 CA GLY A 233 5380 5326 5374 118 309 322 C ATOM 1899 C GLY A 233 5.366 26.046 31.154 1.00 43.09 C ANISOU 1899 C GLY A 233 5458 5418 5497 97 315 327 C ATOM 1900 O GLY A 233 4.705 25.007 31.154 1.00 43.42 O ANISOU 1900 O GLY A 233 5491 5443 5563 84 326 347 O ATOM 0 H GLY A 233 8.409 27.054 31.358 1.00 41.07 H new ATOM 0 HA2 GLY A 233 6.961 25.160 32.075 1.00 42.32 H new ATOM 0 HA3 GLY A 233 6.716 26.615 32.579 1.00 42.32 H new ATOM 1901 N PRO A 234 4.908 27.197 30.620 1.00 43.48 N ANISOU 1901 N PRO A 234 5499 5480 5540 94 307 308 N ATOM 1902 CA PRO A 234 3.580 27.288 30.001 1.00 43.64 C ANISOU 1902 CA PRO A 234 5501 5498 5583 75 311 309 C ATOM 1903 C PRO A 234 3.525 26.841 28.533 1.00 43.34 C ANISOU 1903 C PRO A 234 5458 5437 5574 52 296 291 C ATOM 1904 O PRO A 234 2.457 26.895 27.919 1.00 44.26 O ANISOU 1904 O PRO A 234 5557 5549 5709 36 296 289 O ATOM 1905 CB PRO A 234 3.246 28.776 30.120 1.00 43.77 C ANISOU 1905 CB PRO A 234 5514 5539 5577 86 308 295 C ATOM 1906 CG PRO A 234 4.567 29.458 30.095 1.00 43.46 C ANISOU 1906 CG PRO A 234 5491 5506 5514 99 292 274 C ATOM 1907 CD PRO A 234 5.591 28.504 30.642 1.00 43.52 C ANISOU 1907 CD PRO A 234 5513 5504 5518 108 295 285 C ATOM 0 HA PRO A 234 2.954 26.692 30.440 1.00 43.64 H new ATOM 0 HB2 PRO A 234 2.682 29.071 29.388 1.00 43.77 H new ATOM 0 HB3 PRO A 234 2.766 28.966 30.941 1.00 43.77 H new ATOM 0 HG2 PRO A 234 4.797 29.720 29.190 1.00 43.46 H new ATOM 0 HG3 PRO A 234 4.540 30.269 30.627 1.00 43.46 H new ATOM 0 HD2 PRO A 234 6.394 28.494 30.098 1.00 43.52 H new ATOM 0 HD3 PRO A 234 5.860 28.749 31.541 1.00 43.52 H new ATOM 1908 N MET A 235 4.659 26.410 27.981 1.00 42.41 N ANISOU 1908 N MET A 235 5352 5305 5456 51 282 277 N ATOM 1909 CA MET A 235 4.725 25.906 26.612 1.00 42.09 C ANISOU 1909 CA MET A 235 5308 5243 5440 32 266 259 C ATOM 1910 C MET A 235 4.494 24.394 26.586 1.00 41.37 C ANISOU 1910 C MET A 235 5214 5126 5379 20 271 276 C ATOM 1911 O MET A 235 4.877 23.687 27.520 1.00 40.37 O ANISOU 1911 O MET A 235 5095 4996 5248 29 282 297 O ATOM 1912 CB MET A 235 6.097 26.211 26.001 1.00 43.01 C ANISOU 1912 CB MET A 235 5440 5361 5543 38 248 235 C ATOM 1913 CG MET A 235 6.491 27.682 26.021 1.00 44.35 C ANISOU 1913 CG MET A 235 5614 5553 5685 49 241 218 C ATOM 1914 SD MET A 235 5.721 28.640 24.704 1.00 46.01 S ANISOU 1914 SD MET A 235 5813 5766 5903 34 229 196 S ATOM 1915 CE MET A 235 6.592 28.014 23.268 1.00 43.73 C ANISOU 1915 CE MET A 235 5530 5459 5628 23 210 174 C ATOM 0 H MET A 235 5.414 26.402 28.393 1.00 42.41 H new ATOM 0 HA MET A 235 4.032 26.346 26.095 1.00 42.09 H new ATOM 0 HB2 MET A 235 6.770 25.702 26.479 1.00 43.01 H new ATOM 0 HB3 MET A 235 6.105 25.899 25.082 1.00 43.01 H new ATOM 0 HG2 MET A 235 6.246 28.065 26.878 1.00 44.35 H new ATOM 0 HG3 MET A 235 7.455 27.754 25.944 1.00 44.35 H new ATOM 0 HE1 MET A 235 6.310 28.503 22.479 1.00 43.73 H new ATOM 0 HE2 MET A 235 7.547 28.128 23.394 1.00 43.73 H new ATOM 0 HE3 MET A 235 6.391 27.072 23.153 1.00 43.73 H new ATOM 1916 N LYS A 236 3.874 23.911 25.513 1.00 40.60 N ANISOU 1916 N LYS A 236 5105 5011 5311 0 262 267 N ATOM 1917 CA LYS A 236 3.682 22.474 25.301 1.00 40.80 C ANISOU 1917 CA LYS A 236 5126 5007 5368 -12 263 279 C ATOM 1918 C LYS A 236 4.913 21.798 24.693 1.00 38.73 C ANISOU 1918 C LYS A 236 4879 4729 5108 -10 246 263 C ATOM 1919 O LYS A 236 5.070 20.583 24.806 1.00 37.22 O ANISOU 1919 O LYS A 236 4691 4515 4937 -14 247 275 O ATOM 1920 CB LYS A 236 2.464 22.223 24.402 1.00 42.80 C ANISOU 1920 CB LYS A 236 5361 5248 5654 -34 258 274 C ATOM 1921 CG LYS A 236 1.146 22.724 24.979 1.00 44.84 C ANISOU 1921 CG LYS A 236 5601 5519 5916 -38 275 291 C ATOM 1922 CD LYS A 236 0.668 21.859 26.139 1.00 46.64 C ANISOU 1922 CD LYS A 236 5824 5741 6156 -38 297 328 C ATOM 1923 CE LYS A 236 -0.280 22.614 27.058 1.00 47.77 C ANISOU 1923 CE LYS A 236 5955 5909 6286 -32 318 346 C ATOM 1924 NZ LYS A 236 -0.586 21.839 28.295 1.00 49.23 N ANISOU 1924 NZ LYS A 236 6137 6092 6475 -28 341 385 N ATOM 0 H LYS A 236 3.552 24.405 24.887 1.00 40.60 H new ATOM 0 HA LYS A 236 3.534 22.082 26.176 1.00 40.80 H new ATOM 0 HB2 LYS A 236 2.614 22.652 23.545 1.00 42.80 H new ATOM 0 HB3 LYS A 236 2.390 21.271 24.234 1.00 42.80 H new ATOM 0 HG2 LYS A 236 1.253 23.639 25.281 1.00 44.84 H new ATOM 0 HG3 LYS A 236 0.471 22.732 24.283 1.00 44.84 H new ATOM 0 HD2 LYS A 236 0.222 21.071 25.792 1.00 46.64 H new ATOM 0 HD3 LYS A 236 1.434 21.550 26.648 1.00 46.64 H new ATOM 0 HE2 LYS A 236 0.114 23.467 27.300 1.00 47.77 H new ATOM 0 HE3 LYS A 236 -1.104 22.807 26.585 1.00 47.77 H new ATOM 0 HZ1 LYS A 236 -1.141 22.307 28.809 1.00 49.23 H new ATOM 0 HZ2 LYS A 236 -0.968 21.066 28.074 1.00 49.23 H new ATOM 0 HZ3 LYS A 236 0.168 21.681 28.741 1.00 49.23 H new ATOM 1925 N ALA A 237 5.780 22.582 24.051 1.00 35.69 N ANISOU 1925 N ALA A 237 4502 4355 4701 -3 232 237 N ATOM 1926 CA ALA A 237 6.927 22.045 23.308 1.00 34.85 C ANISOU 1926 CA ALA A 237 4408 4237 4597 -1 215 218 C ATOM 1927 C ALA A 237 7.868 21.213 24.180 1.00 34.14 C ANISOU 1927 C ALA A 237 4332 4139 4500 12 220 232 C ATOM 1928 O ALA A 237 8.149 21.579 25.321 1.00 32.86 O ANISOU 1928 O ALA A 237 4176 3992 4316 26 232 248 O ATOM 1929 CB ALA A 237 7.702 23.182 22.655 1.00 34.31 C ANISOU 1929 CB ALA A 237 4346 4187 4503 6 203 192 C ATOM 0 H ALA A 237 5.722 23.440 24.033 1.00 35.69 H new ATOM 0 HA ALA A 237 6.568 21.451 22.631 1.00 34.85 H new ATOM 0 HB1 ALA A 237 8.458 22.820 22.166 1.00 34.31 H new ATOM 0 HB2 ALA A 237 7.121 23.660 22.043 1.00 34.31 H new ATOM 0 HB3 ALA A 237 8.022 23.791 23.339 1.00 34.31 H new ATOM 1930 N LYS A 238 8.341 20.093 23.635 1.00 34.19 N ANISOU 1930 N LYS A 238 4344 4123 4526 7 209 226 N ATOM 1931 CA LYS A 238 9.337 19.251 24.305 1.00 34.31 C ANISOU 1931 CA LYS A 238 4373 4128 4535 20 210 236 C ATOM 1932 C LYS A 238 10.691 19.253 23.585 1.00 32.57 C ANISOU 1932 C LYS A 238 4165 3910 4303 29 192 210 C ATOM 1933 O LYS A 238 11.654 18.637 24.055 1.00 31.58 O ANISOU 1933 O LYS A 238 4051 3778 4170 42 190 213 O ATOM 1934 CB LYS A 238 8.820 17.813 24.434 1.00 36.51 C ANISOU 1934 CB LYS A 238 4648 4376 4847 10 213 255 C ATOM 1935 CG LYS A 238 7.723 17.639 25.476 1.00 38.43 C ANISOU 1935 CG LYS A 238 4883 4618 5100 5 234 289 C ATOM 1936 CD LYS A 238 7.964 16.413 26.348 1.00 40.72 C ANISOU 1936 CD LYS A 238 5182 4888 5402 10 243 316 C ATOM 1937 CE LYS A 238 7.014 16.387 27.535 1.00 42.30 C ANISOU 1937 CE LYS A 238 5374 5094 5603 10 268 353 C ATOM 1938 NZ LYS A 238 7.303 15.256 28.461 1.00 44.10 N ANISOU 1938 NZ LYS A 238 5612 5304 5839 16 277 382 N ATOM 0 H LYS A 238 8.094 19.798 22.866 1.00 34.19 H new ATOM 0 HA LYS A 238 9.477 19.630 25.187 1.00 34.31 H new ATOM 0 HB2 LYS A 238 8.483 17.522 23.572 1.00 36.51 H new ATOM 0 HB3 LYS A 238 9.563 17.231 24.660 1.00 36.51 H new ATOM 0 HG2 LYS A 238 7.679 18.430 26.035 1.00 38.43 H new ATOM 0 HG3 LYS A 238 6.865 17.557 25.032 1.00 38.43 H new ATOM 0 HD2 LYS A 238 7.847 15.609 25.819 1.00 40.72 H new ATOM 0 HD3 LYS A 238 8.881 16.413 26.664 1.00 40.72 H new ATOM 0 HE2 LYS A 238 7.081 17.225 28.019 1.00 42.30 H new ATOM 0 HE3 LYS A 238 6.101 16.316 27.215 1.00 42.30 H new ATOM 0 HZ1 LYS A 238 6.729 15.274 29.141 1.00 44.10 H new ATOM 0 HZ2 LYS A 238 7.220 14.485 28.024 1.00 44.10 H new ATOM 0 HZ3 LYS A 238 8.133 15.332 28.773 1.00 44.10 H new ATOM 1939 N THR A 239 10.756 19.933 22.441 1.00 30.10 N ANISOU 1939 N THR A 239 3846 3604 3986 23 180 183 N ATOM 1940 CA THR A 239 11.996 20.094 21.693 1.00 28.98 C ANISOU 1940 CA THR A 239 3713 3468 3830 31 164 158 C ATOM 1941 C THR A 239 12.084 21.527 21.190 1.00 28.71 C ANISOU 1941 C THR A 239 3676 3459 3776 31 162 141 C ATOM 1942 O THR A 239 11.082 22.245 21.189 1.00 28.23 O ANISOU 1942 O THR A 239 3605 3406 3716 23 168 146 O ATOM 1943 CB THR A 239 12.069 19.148 20.479 1.00 28.14 C ANISOU 1943 CB THR A 239 3605 3341 3747 23 148 140 C ATOM 1944 OG1 THR A 239 11.195 19.611 19.439 1.00 27.97 O ANISOU 1944 OG1 THR A 239 3572 3321 3737 9 141 127 O ATOM 1945 CG2 THR A 239 11.688 17.719 20.874 1.00 27.65 C ANISOU 1945 CG2 THR A 239 3544 3250 3714 19 149 158 C ATOM 0 H THR A 239 10.077 20.315 22.077 1.00 30.10 H new ATOM 0 HA THR A 239 12.731 19.880 22.289 1.00 28.98 H new ATOM 0 HB THR A 239 12.983 19.145 20.155 1.00 28.14 H new ATOM 0 HG1 THR A 239 11.279 19.120 18.763 1.00 27.97 H new ATOM 0 HG21 THR A 239 11.741 17.143 20.095 1.00 27.65 H new ATOM 0 HG22 THR A 239 12.299 17.398 21.556 1.00 27.65 H new ATOM 0 HG23 THR A 239 10.782 17.710 21.221 1.00 27.65 H new ATOM 1946 N AGLN A 240 13.277 21.926 20.755 0.50 28.66 N ANISOU 1946 N AGLN A 240 3675 3463 3750 40 152 122 N ATOM 1947 N BGLN A 240 13.278 21.933 20.763 0.50 28.29 N ANISOU 1947 N BGLN A 240 3629 3418 3704 40 152 122 N ATOM 1948 CA AGLN A 240 13.505 23.273 20.236 0.50 28.55 C ANISOU 1948 CA AGLN A 240 3660 3472 3718 40 148 107 C ATOM 1949 CA BGLN A 240 13.500 23.281 20.237 0.50 27.96 C ANISOU 1949 CA BGLN A 240 3585 3397 3643 40 148 107 C ATOM 1950 C AGLN A 240 12.768 23.492 18.918 0.50 28.41 C ANISOU 1950 C AGLN A 240 3632 3451 3712 26 139 91 C ATOM 1951 C BGLN A 240 12.769 23.495 18.915 0.50 28.07 C ANISOU 1951 C BGLN A 240 3589 3408 3669 26 139 91 C ATOM 1952 O AGLN A 240 12.186 24.553 18.701 0.50 27.93 O ANISOU 1952 O AGLN A 240 3565 3402 3643 21 141 88 O ATOM 1953 O BGLN A 240 12.191 24.557 18.692 0.50 27.63 O ANISOU 1953 O BGLN A 240 3528 3365 3606 21 141 88 O ATOM 1954 CB AGLN A 240 14.998 23.523 20.031 0.50 28.77 C ANISOU 1954 CB AGLN A 240 3695 3511 3726 52 140 91 C ATOM 1955 CB BGLN A 240 14.994 23.546 20.044 0.50 27.69 C ANISOU 1955 CB BGLN A 240 3558 3374 3588 52 140 91 C ATOM 1956 CG AGLN A 240 15.351 24.995 19.909 0.50 29.02 C ANISOU 1956 CG AGLN A 240 3726 3566 3735 54 139 81 C ATOM 1957 CG BGLN A 240 15.297 24.866 19.349 0.50 27.50 C ANISOU 1957 CG BGLN A 240 3531 3370 3547 50 135 75 C ATOM 1958 CD AGLN A 240 15.169 25.732 21.218 0.50 29.27 C ANISOU 1958 CD AGLN A 240 3759 3609 3752 62 151 97 C ATOM 1959 CD BGLN A 240 14.828 26.066 20.147 0.50 27.23 C ANISOU 1959 CD BGLN A 240 3494 3351 3499 52 144 84 C ATOM 1960 OE1AGLN A 240 15.512 25.218 22.285 0.50 29.09 O ANISOU 1960 OE1AGLN A 240 3743 3584 3726 74 157 110 O ATOM 1961 OE1BGLN A 240 14.327 25.926 21.266 0.50 27.46 O ANISOU 1961 OE1BGLN A 240 3526 3380 3529 56 155 103 O ATOM 1962 NE2AGLN A 240 14.627 26.943 21.147 0.50 29.89 N ANISOU 1962 NE2AGLN A 240 3832 3701 3822 58 152 95 N ATOM 1963 NE2BGLN A 240 14.984 27.258 19.574 0.50 27.10 N ANISOU 1963 NE2BGLN A 240 3476 3351 3471 49 139 72 N ATOM 0 H AGLN A 240 13.976 21.425 20.752 0.50 28.29 H new ATOM 0 H BGLN A 240 13.981 21.437 20.769 0.50 28.29 H new ATOM 0 HA AGLN A 240 13.160 23.899 20.891 0.50 27.96 H new ATOM 0 HA BGLN A 240 13.144 23.906 20.888 0.50 27.96 H new ATOM 0 HB2AGLN A 240 15.489 23.140 20.775 0.50 27.69 H new ATOM 0 HB2BGLN A 240 15.430 23.538 20.910 0.50 27.69 H new ATOM 0 HB3AGLN A 240 15.290 23.060 19.230 0.50 27.69 H new ATOM 0 HB3BGLN A 240 15.379 22.821 19.526 0.50 27.69 H new ATOM 0 HG2AGLN A 240 16.271 25.083 19.615 0.50 27.50 H new ATOM 0 HG2BGLN A 240 16.253 24.936 19.198 0.50 27.50 H new ATOM 0 HG3AGLN A 240 14.795 25.405 19.228 0.50 27.50 H new ATOM 0 HG3BGLN A 240 14.870 24.874 18.478 0.50 27.50 H new ATOM 0 HE21AGLN A 240 14.400 27.269 20.384 0.50 27.10 H new ATOM 0 HE21BGLN A 240 15.338 27.316 18.792 0.50 27.10 H new ATOM 0 HE22AGLN A 240 14.503 27.401 21.864 0.50 27.10 H new ATOM 0 HE22BGLN A 240 14.731 27.969 19.986 0.50 27.10 H new ATOM 1964 N PHE A 241 12.797 22.486 18.045 1.00 28.31 N ANISOU 1964 N PHE A 241 3618 3420 3717 22 129 81 N ATOM 1965 CA PHE A 241 12.089 22.550 16.768 1.00 29.32 C ANISOU 1965 CA PHE A 241 3738 3543 3859 10 118 65 C ATOM 1966 C PHE A 241 10.591 22.742 17.003 1.00 28.89 C ANISOU 1966 C PHE A 241 3673 3484 3820 -2 126 78 C ATOM 1967 O PHE A 241 9.967 23.581 16.363 1.00 28.61 O ANISOU 1967 O PHE A 241 3631 3458 3782 -8 123 69 O ATOM 1968 CB PHE A 241 12.344 21.291 15.933 1.00 30.40 C ANISOU 1968 CB PHE A 241 3876 3660 4015 10 105 52 C ATOM 1969 CG PHE A 241 11.970 21.440 14.482 1.00 32.16 C ANISOU 1969 CG PHE A 241 4092 3882 4243 4 91 30 C ATOM 1970 CD1 PHE A 241 10.768 20.935 13.999 1.00 33.78 C ANISOU 1970 CD1 PHE A 241 4289 4071 4476 -8 85 29 C ATOM 1971 CD2 PHE A 241 12.820 22.089 13.601 1.00 33.24 C ANISOU 1971 CD2 PHE A 241 4234 4038 4360 10 83 11 C ATOM 1972 CE1 PHE A 241 10.425 21.071 12.665 1.00 34.30 C ANISOU 1972 CE1 PHE A 241 4349 4138 4546 -12 71 7 C ATOM 1973 CE2 PHE A 241 12.484 22.228 12.264 1.00 33.75 C ANISOU 1973 CE2 PHE A 241 4292 4103 4427 7 71 -9 C ATOM 1974 CZ PHE A 241 11.285 21.718 11.795 1.00 34.06 C ANISOU 1974 CZ PHE A 241 4323 4125 4492 -3 64 -11 C ATOM 0 H APHE A 241 13.225 21.752 18.175 0.50 28.31 H new ATOM 0 H BPHE A 241 13.223 21.751 18.177 0.50 28.31 H new ATOM 0 HA PHE A 241 12.428 23.311 16.272 1.00 29.32 H new ATOM 0 HB2 PHE A 241 13.283 21.057 15.994 1.00 30.40 H new ATOM 0 HB3 PHE A 241 11.843 20.553 16.314 1.00 30.40 H new ATOM 0 HD1 PHE A 241 10.187 20.500 14.580 1.00 33.78 H new ATOM 0 HD2 PHE A 241 13.626 22.435 13.911 1.00 33.24 H new ATOM 0 HE1 PHE A 241 9.618 20.728 12.354 1.00 34.30 H new ATOM 0 HE2 PHE A 241 13.064 22.664 11.682 1.00 33.75 H new ATOM 0 HZ PHE A 241 11.058 21.810 10.898 1.00 34.06 H new ATOM 1975 N GLU A 242 10.032 21.986 17.944 1.00 29.05 N ANISOU 1975 N GLU A 242 3691 3490 3857 -4 136 100 N ATOM 1976 CA GLU A 242 8.634 22.162 18.356 1.00 29.70 C ANISOU 1976 CA GLU A 242 3762 3571 3954 -15 146 116 C ATOM 1977 C GLU A 242 8.383 23.547 18.943 1.00 28.59 C ANISOU 1977 C GLU A 242 3619 3454 3789 -11 157 121 C ATOM 1978 O GLU A 242 7.328 24.139 18.716 1.00 29.57 O ANISOU 1978 O GLU A 242 3733 3584 3919 -19 159 121 O ATOM 1979 CB GLU A 242 8.232 21.104 19.386 1.00 30.69 C ANISOU 1979 CB GLU A 242 3886 3678 4098 -17 158 142 C ATOM 1980 CG GLU A 242 7.966 19.735 18.782 1.00 32.14 C ANISOU 1980 CG GLU A 242 4065 3831 4314 -26 147 138 C ATOM 1981 CD GLU A 242 7.725 18.665 19.830 1.00 33.72 C ANISOU 1981 CD GLU A 242 4266 4013 4532 -28 159 166 C ATOM 1982 OE1 GLU A 242 7.550 19.004 21.021 1.00 34.72 O ANISOU 1982 OE1 GLU A 242 4395 4151 4647 -22 177 190 O ATOM 1983 OE2 GLU A 242 7.705 17.475 19.456 1.00 35.82 O ANISOU 1983 OE2 GLU A 242 4532 4252 4825 -33 149 165 O ATOM 0 H GLU A 242 10.447 21.359 18.362 1.00 29.05 H new ATOM 0 HA GLU A 242 8.094 22.062 17.556 1.00 29.70 H new ATOM 0 HB2 GLU A 242 8.936 21.025 20.049 1.00 30.69 H new ATOM 0 HB3 GLU A 242 7.436 21.404 19.852 1.00 30.69 H new ATOM 0 HG2 GLU A 242 7.194 19.789 18.198 1.00 32.14 H new ATOM 0 HG3 GLU A 242 8.721 19.477 18.231 1.00 32.14 H new ATOM 1984 N ALA A 243 9.343 24.048 19.715 1.00 28.27 N ANISOU 1984 N ALA A 243 3589 3428 3724 3 162 125 N ATOM 1985 CA ALA A 243 9.223 25.373 20.319 1.00 27.83 C ANISOU 1985 CA ALA A 243 3533 3396 3645 9 170 129 C ATOM 1986 C ALA A 243 9.097 26.463 19.251 1.00 27.45 C ANISOU 1986 C ALA A 243 3481 3359 3589 4 159 109 C ATOM 1987 O ALA A 243 8.277 27.369 19.387 1.00 27.42 O ANISOU 1987 O ALA A 243 3471 3366 3580 2 164 111 O ATOM 1988 CB ALA A 243 10.405 25.654 21.236 1.00 27.11 C ANISOU 1988 CB ALA A 243 3454 3316 3530 25 173 133 C ATOM 0 H ALA A 243 10.074 23.636 19.902 1.00 28.27 H new ATOM 0 HA ALA A 243 8.412 25.384 20.850 1.00 27.83 H new ATOM 0 HB1 ALA A 243 10.309 26.536 21.627 1.00 27.11 H new ATOM 0 HB2 ALA A 243 10.433 24.989 21.942 1.00 27.11 H new ATOM 0 HB3 ALA A 243 11.228 25.616 20.724 1.00 27.11 H new ATOM 1989 N LEU A 244 9.890 26.364 18.186 1.00 26.83 N ANISOU 1989 N LEU A 244 3407 3279 3508 4 146 89 N ATOM 1990 CA LEU A 244 9.803 27.325 17.079 1.00 27.00 C ANISOU 1990 CA LEU A 244 3426 3311 3521 0 136 71 C ATOM 1991 C LEU A 244 8.432 27.275 16.401 1.00 27.25 C ANISOU 1991 C LEU A 244 3446 3335 3572 -13 133 68 C ATOM 1992 O LEU A 244 7.863 28.315 16.080 1.00 27.16 O ANISOU 1992 O LEU A 244 3431 3336 3554 -15 132 63 O ATOM 1993 CB LEU A 244 10.913 27.092 16.049 1.00 27.40 C ANISOU 1993 CB LEU A 244 3482 3361 3566 2 124 52 C ATOM 1994 CG LEU A 244 12.346 27.352 16.533 1.00 27.59 C ANISOU 1994 CG LEU A 244 3517 3396 3570 14 125 50 C ATOM 1995 CD1 LEU A 244 13.350 26.764 15.554 1.00 28.67 C ANISOU 1995 CD1 LEU A 244 3657 3530 3706 17 114 33 C ATOM 1996 CD2 LEU A 244 12.606 28.839 16.740 1.00 27.77 C ANISOU 1996 CD2 LEU A 244 3540 3439 3571 17 127 48 C ATOM 0 H LEU A 244 10.484 25.751 18.082 1.00 26.83 H new ATOM 0 HA LEU A 244 9.921 28.209 17.460 1.00 27.00 H new ATOM 0 HB2 LEU A 244 10.856 26.174 15.741 1.00 27.40 H new ATOM 0 HB3 LEU A 244 10.742 27.660 15.281 1.00 27.40 H new ATOM 0 HG LEU A 244 12.453 26.914 17.392 1.00 27.59 H new ATOM 0 HD11 LEU A 244 14.250 26.935 15.872 1.00 28.67 H new ATOM 0 HD12 LEU A 244 13.210 25.807 15.482 1.00 28.67 H new ATOM 0 HD13 LEU A 244 13.231 27.174 14.683 1.00 28.67 H new ATOM 0 HD21 LEU A 244 13.518 28.969 17.045 1.00 27.77 H new ATOM 0 HD22 LEU A 244 12.475 29.310 15.902 1.00 27.77 H new ATOM 0 HD23 LEU A 244 11.991 29.186 17.405 1.00 27.77 H new ATOM 1997 N GLU A 245 7.901 26.067 16.202 1.00 28.05 N ANISOU 1997 N GLU A 245 3542 3416 3699 -20 131 71 N ATOM 1998 CA GLU A 245 6.570 25.894 15.601 1.00 30.04 C ANISOU 1998 CA GLU A 245 3781 3659 3973 -32 127 68 C ATOM 1999 C GLU A 245 5.495 26.518 16.486 1.00 28.75 C ANISOU 1999 C GLU A 245 3609 3504 3811 -35 141 85 C ATOM 2000 O GLU A 245 4.568 27.168 15.988 1.00 29.34 O ANISOU 2000 O GLU A 245 3675 3584 3889 -40 138 78 O ATOM 2001 CB GLU A 245 6.243 24.408 15.395 1.00 32.80 C ANISOU 2001 CB GLU A 245 4125 3983 4353 -39 123 70 C ATOM 2002 CG GLU A 245 7.232 23.635 14.532 1.00 35.46 C ANISOU 2002 CG GLU A 245 4471 4310 4692 -35 108 53 C ATOM 2003 CD GLU A 245 6.963 23.718 13.040 1.00 38.00 C ANISOU 2003 CD GLU A 245 4788 4630 5019 -38 91 28 C ATOM 2004 OE1 GLU A 245 6.361 24.712 12.570 1.00 40.35 O ANISOU 2004 OE1 GLU A 245 5081 4941 5308 -41 90 21 O ATOM 2005 OE2 GLU A 245 7.377 22.775 12.328 1.00 40.92 O ANISOU 2005 OE2 GLU A 245 5161 4986 5400 -37 78 15 O ATOM 0 H GLU A 245 8.295 25.331 16.408 1.00 28.05 H new ATOM 0 HA GLU A 245 6.583 26.339 14.739 1.00 30.04 H new ATOM 0 HB2 GLU A 245 6.192 23.980 16.264 1.00 32.80 H new ATOM 0 HB3 GLU A 245 5.363 24.339 14.993 1.00 32.80 H new ATOM 0 HG2 GLU A 245 8.126 23.968 14.707 1.00 35.46 H new ATOM 0 HG3 GLU A 245 7.219 22.703 14.800 1.00 35.46 H new ATOM 2006 N GLU A 246 5.634 26.313 17.795 1.00 28.54 N ANISOU 2006 N GLU A 246 3585 3479 3780 -29 156 106 N ATOM 2007 CA GLU A 246 4.668 26.798 18.783 1.00 28.79 C ANISOU 2007 CA GLU A 246 3609 3521 3811 -29 170 124 C ATOM 2008 C GLU A 246 4.697 28.324 18.885 1.00 28.24 C ANISOU 2008 C GLU A 246 3541 3473 3714 -22 170 118 C ATOM 2009 O GLU A 246 3.650 28.967 18.983 1.00 27.67 O ANISOU 2009 O GLU A 246 3458 3410 3644 -25 174 121 O ATOM 2010 CB GLU A 246 4.945 26.168 20.156 1.00 29.91 C ANISOU 2010 CB GLU A 246 3754 3659 3950 -22 186 149 C ATOM 2011 CG GLU A 246 3.866 26.423 21.202 1.00 30.84 C ANISOU 2011 CG GLU A 246 3862 3786 4071 -22 203 171 C ATOM 2012 CD GLU A 246 4.053 25.611 22.476 1.00 31.97 C ANISOU 2012 CD GLU A 246 4009 3925 4215 -15 219 197 C ATOM 2013 OE1 GLU A 246 3.165 25.682 23.355 1.00 33.40 O ANISOU 2013 OE1 GLU A 246 4180 4112 4398 -14 236 218 O ATOM 2014 OE2 GLU A 246 5.079 24.909 22.620 1.00 33.09 O ANISOU 2014 OE2 GLU A 246 4162 4057 4354 -9 216 198 O ATOM 0 H GLU A 246 6.296 25.885 18.138 1.00 28.54 H new ATOM 0 HA GLU A 246 3.782 26.534 18.488 1.00 28.79 H new ATOM 0 HB2 GLU A 246 5.050 25.210 20.044 1.00 29.91 H new ATOM 0 HB3 GLU A 246 5.790 26.509 20.490 1.00 29.91 H new ATOM 0 HG2 GLU A 246 3.859 27.367 21.426 1.00 30.84 H new ATOM 0 HG3 GLU A 246 2.999 26.216 20.819 1.00 30.84 H new ATOM 2015 N LEU A 247 5.895 28.904 18.861 1.00 27.43 N ANISOU 2015 N LEU A 247 3451 3381 3589 -12 165 109 N ATOM 2016 CA LEU A 247 6.027 30.368 18.853 1.00 26.92 C ANISOU 2016 CA LEU A 247 3391 3337 3503 -6 163 101 C ATOM 2017 C LEU A 247 5.355 30.962 17.613 1.00 26.95 C ANISOU 2017 C LEU A 247 3388 3342 3512 -14 151 84 C ATOM 2018 O LEU A 247 4.684 31.998 17.698 1.00 27.54 O ANISOU 2018 O LEU A 247 3458 3428 3578 -13 152 83 O ATOM 2019 CB LEU A 247 7.502 30.787 18.932 1.00 26.10 C ANISOU 2019 CB LEU A 247 3299 3240 3377 4 158 93 C ATOM 2020 CG LEU A 247 8.191 30.572 20.285 1.00 26.07 C ANISOU 2020 CG LEU A 247 3302 3241 3361 17 168 107 C ATOM 2021 CD1 LEU A 247 9.690 30.833 20.175 1.00 26.22 C ANISOU 2021 CD1 LEU A 247 3333 3265 3363 25 160 97 C ATOM 2022 CD2 LEU A 247 7.568 31.438 21.372 1.00 26.29 C ANISOU 2022 CD2 LEU A 247 3329 3284 3377 26 177 119 C ATOM 0 H LEU A 247 6.641 28.476 18.849 1.00 27.43 H new ATOM 0 HA LEU A 247 5.577 30.717 19.638 1.00 26.92 H new ATOM 0 HB2 LEU A 247 7.996 30.296 18.256 1.00 26.10 H new ATOM 0 HB3 LEU A 247 7.565 31.727 18.703 1.00 26.10 H new ATOM 0 HG LEU A 247 8.060 29.645 20.539 1.00 26.07 H new ATOM 0 HD11 LEU A 247 10.107 30.692 21.039 1.00 26.22 H new ATOM 0 HD12 LEU A 247 10.078 30.225 19.526 1.00 26.22 H new ATOM 0 HD13 LEU A 247 9.839 31.748 19.890 1.00 26.22 H new ATOM 0 HD21 LEU A 247 8.024 31.280 22.213 1.00 26.29 H new ATOM 0 HD22 LEU A 247 7.653 32.373 21.129 1.00 26.29 H new ATOM 0 HD23 LEU A 247 6.629 31.213 21.467 1.00 26.29 H new ATOM 2023 N SER A 248 5.520 30.299 16.471 1.00 27.64 N ANISOU 2023 N SER A 248 3474 3416 3611 -22 140 71 N ATOM 2024 CA SER A 248 4.876 30.719 15.231 1.00 27.87 C ANISOU 2024 CA SER A 248 3498 3446 3646 -29 128 55 C ATOM 2025 C SER A 248 3.356 30.583 15.344 1.00 28.17 C ANISOU 2025 C SER A 248 3521 3479 3704 -36 132 61 C ATOM 2026 O SER A 248 2.626 31.483 14.949 1.00 27.95 O ANISOU 2026 O SER A 248 3488 3460 3672 -38 128 54 O ATOM 2027 CB SER A 248 5.395 29.898 14.050 1.00 28.74 C ANISOU 2027 CB SER A 248 3611 3544 3765 -32 116 39 C ATOM 2028 OG SER A 248 4.851 30.345 12.822 1.00 30.32 O ANISOU 2028 OG SER A 248 3807 3746 3967 -36 103 23 O ATOM 0 H SER A 248 6.007 29.595 16.394 1.00 27.64 H new ATOM 0 HA SER A 248 5.093 31.652 15.076 1.00 27.87 H new ATOM 0 HB2 SER A 248 6.363 29.956 14.016 1.00 28.74 H new ATOM 0 HB3 SER A 248 5.171 28.963 14.182 1.00 28.74 H new ATOM 0 HG SER A 248 4.216 30.874 12.973 1.00 30.32 H new ATOM 2029 N ALA A 249 2.900 29.462 15.902 1.00 28.36 N ANISOU 2029 N ALA A 249 3538 3490 3749 -42 140 74 N ATOM 2030 CA ALA A 249 1.469 29.191 16.070 1.00 28.87 C ANISOU 2030 CA ALA A 249 3585 3548 3835 -51 145 83 C ATOM 2031 C ALA A 249 0.763 30.247 16.918 1.00 29.18 C ANISOU 2031 C ALA A 249 3619 3605 3862 -46 156 93 C ATOM 2032 O ALA A 249 -0.358 30.658 16.587 1.00 29.75 O ANISOU 2032 O ALA A 249 3679 3681 3943 -51 154 89 O ATOM 2033 CB ALA A 249 1.261 27.812 16.679 1.00 29.15 C ANISOU 2033 CB ALA A 249 3615 3566 3896 -57 154 99 C ATOM 0 H ALA A 249 3.411 28.835 16.195 1.00 28.36 H new ATOM 0 HA ALA A 249 1.072 29.222 15.185 1.00 28.87 H new ATOM 0 HB1 ALA A 249 0.311 27.645 16.785 1.00 29.15 H new ATOM 0 HB2 ALA A 249 1.644 27.139 16.095 1.00 29.15 H new ATOM 0 HB3 ALA A 249 1.695 27.772 17.546 1.00 29.15 H new ATOM 2034 N ILE A 250 1.407 30.685 18.002 1.00 28.32 N ANISOU 2034 N ILE A 250 3520 3509 3733 -34 167 105 N ATOM 2035 CA ILE A 250 0.785 31.647 18.925 1.00 28.59 C ANISOU 2035 CA ILE A 250 3549 3561 3752 -26 178 115 C ATOM 2036 C ILE A 250 0.906 33.111 18.487 1.00 28.00 C ANISOU 2036 C ILE A 250 3480 3502 3656 -20 167 100 C ATOM 2037 O ILE A 250 0.269 33.982 19.085 1.00 29.63 O ANISOU 2037 O ILE A 250 3682 3722 3853 -13 173 104 O ATOM 2038 CB ILE A 250 1.250 31.473 20.392 1.00 29.02 C ANISOU 2038 CB ILE A 250 3609 3623 3794 -15 194 136 C ATOM 2039 CG1 ILE A 250 2.730 31.826 20.578 1.00 28.19 C ANISOU 2039 CG1 ILE A 250 3522 3523 3666 -4 189 130 C ATOM 2040 CG2 ILE A 250 0.940 30.060 20.877 1.00 29.43 C ANISOU 2040 CG2 ILE A 250 3654 3659 3869 -22 205 155 C ATOM 2041 CD1 ILE A 250 3.254 31.528 21.968 1.00 28.73 C ANISOU 2041 CD1 ILE A 250 3597 3597 3722 9 203 148 C ATOM 0 H ILE A 250 2.201 30.440 18.223 1.00 28.32 H new ATOM 0 HA ILE A 250 -0.158 31.425 18.885 1.00 28.59 H new ATOM 0 HB ILE A 250 0.753 32.101 20.939 1.00 29.02 H new ATOM 0 HG12 ILE A 250 3.256 31.333 19.929 1.00 28.19 H new ATOM 0 HG13 ILE A 250 2.856 32.769 20.388 1.00 28.19 H new ATOM 0 HG21 ILE A 250 1.235 29.961 21.796 1.00 29.43 H new ATOM 0 HG22 ILE A 250 -0.016 29.902 20.826 1.00 29.43 H new ATOM 0 HG23 ILE A 250 1.404 29.417 20.318 1.00 29.43 H new ATOM 0 HD11 ILE A 250 4.191 31.773 22.020 1.00 28.73 H new ATOM 0 HD12 ILE A 250 2.750 32.039 22.620 1.00 28.73 H new ATOM 0 HD13 ILE A 250 3.157 30.581 22.155 1.00 28.73 H new ATOM 2042 N GLY A 251 1.709 33.377 17.454 1.00 26.94 N ANISOU 2042 N GLY A 251 3356 3365 3515 -21 153 82 N ATOM 2043 CA GLY A 251 1.668 34.669 16.757 1.00 25.96 C ANISOU 2043 CA GLY A 251 3235 3251 3376 -18 142 67 C ATOM 2044 C GLY A 251 2.969 35.427 16.564 1.00 25.26 C ANISOU 2044 C GLY A 251 3162 3169 3265 -11 134 59 C ATOM 2045 O GLY A 251 2.944 36.555 16.081 1.00 24.73 O ANISOU 2045 O GLY A 251 3100 3111 3187 -9 126 49 O ATOM 0 H GLY A 251 2.286 32.822 17.140 1.00 26.94 H new ATOM 0 HA2 GLY A 251 1.280 34.520 15.880 1.00 25.96 H new ATOM 0 HA3 GLY A 251 1.058 35.247 17.242 1.00 25.96 H new ATOM 2046 N PHE A 252 4.098 34.821 16.935 1.00 24.96 N ANISOU 2046 N PHE A 252 3132 3127 3223 -8 138 63 N ATOM 2047 CA PHE A 252 5.408 35.448 16.762 1.00 23.71 C ANISOU 2047 CA PHE A 252 2987 2975 3046 -2 131 56 C ATOM 2048 C PHE A 252 5.976 35.164 15.379 1.00 23.38 C ANISOU 2048 C PHE A 252 2949 2926 3007 -9 120 41 C ATOM 2049 O PHE A 252 5.729 34.111 14.808 1.00 23.87 O ANISOU 2049 O PHE A 252 3006 2977 3085 -16 118 38 O ATOM 2050 CB PHE A 252 6.392 34.940 17.824 1.00 23.46 C ANISOU 2050 CB PHE A 252 2962 2944 3007 6 140 66 C ATOM 2051 CG PHE A 252 6.037 35.361 19.214 1.00 23.58 C ANISOU 2051 CG PHE A 252 2976 2968 3013 16 150 79 C ATOM 2052 CD1 PHE A 252 5.459 34.467 20.107 1.00 23.49 C ANISOU 2052 CD1 PHE A 252 2959 2954 3013 18 163 96 C ATOM 2053 CD2 PHE A 252 6.255 36.670 19.627 1.00 23.41 C ANISOU 2053 CD2 PHE A 252 2961 2961 2975 25 146 75 C ATOM 2054 CE1 PHE A 252 5.121 34.868 21.391 1.00 23.59 C ANISOU 2054 CE1 PHE A 252 2971 2978 3015 30 174 108 C ATOM 2055 CE2 PHE A 252 5.920 37.075 20.906 1.00 23.32 C ANISOU 2055 CE2 PHE A 252 2948 2960 2953 38 155 86 C ATOM 2056 CZ PHE A 252 5.343 36.173 21.790 1.00 23.55 C ANISOU 2056 CZ PHE A 252 2971 2987 2989 40 169 102 C ATOM 0 H PHE A 252 4.125 34.039 17.292 1.00 24.96 H new ATOM 0 HA PHE A 252 5.288 36.405 16.861 1.00 23.71 H new ATOM 0 HB2 PHE A 252 6.427 33.971 17.786 1.00 23.46 H new ATOM 0 HB3 PHE A 252 7.281 35.264 17.612 1.00 23.46 H new ATOM 0 HD1 PHE A 252 5.297 33.591 19.841 1.00 23.49 H new ATOM 0 HD2 PHE A 252 6.631 37.281 19.036 1.00 23.41 H new ATOM 0 HE1 PHE A 252 4.745 34.258 21.984 1.00 23.59 H new ATOM 0 HE2 PHE A 252 6.081 37.951 21.174 1.00 23.32 H new ATOM 0 HZ PHE A 252 5.107 36.446 22.647 1.00 23.55 H new ATOM 2057 N ARG A 253 6.750 36.110 14.855 1.00 22.27 N ANISOU 2057 N ARG A 253 2817 2794 2851 -7 112 32 N ATOM 2058 CA ARG A 253 7.504 35.879 13.632 1.00 22.19 C ANISOU 2058 CA ARG A 253 2811 2781 2839 -10 103 20 C ATOM 2059 C ARG A 253 8.734 35.024 13.951 1.00 21.93 C ANISOU 2059 C ARG A 253 2783 2745 2805 -7 107 22 C ATOM 2060 O ARG A 253 9.543 35.384 14.811 1.00 22.82 O ANISOU 2060 O ARG A 253 2900 2863 2906 0 111 28 O ATOM 2061 CB ARG A 253 7.918 37.208 13.006 1.00 21.56 C ANISOU 2061 CB ARG A 253 2737 2712 2744 -9 96 13 C ATOM 2062 CG ARG A 253 8.569 37.080 11.644 1.00 21.60 C ANISOU 2062 CG ARG A 253 2745 2717 2745 -12 88 1 C ATOM 2063 CD ARG A 253 8.479 38.398 10.904 1.00 21.82 C ANISOU 2063 CD ARG A 253 2777 2753 2762 -13 80 -4 C ATOM 2064 NE ARG A 253 9.016 38.326 9.546 1.00 22.70 N ANISOU 2064 NE ARG A 253 2891 2866 2867 -15 73 -13 N ATOM 2065 CZ ARG A 253 10.265 38.630 9.197 1.00 22.28 C ANISOU 2065 CZ ARG A 253 2843 2819 2802 -14 73 -14 C ATOM 2066 NH1 ARG A 253 10.628 38.542 7.920 1.00 22.71 N ANISOU 2066 NH1 ARG A 253 2900 2877 2850 -14 68 -22 N ATOM 2067 NH2 ARG A 253 11.154 39.015 10.106 1.00 22.26 N ANISOU 2067 NH2 ARG A 253 2844 2820 2793 -12 78 -8 N ATOM 0 H ARG A 253 6.851 36.894 15.195 1.00 22.27 H new ATOM 0 HA ARG A 253 6.947 35.407 12.993 1.00 22.19 H new ATOM 0 HB2 ARG A 253 7.134 37.774 12.926 1.00 21.56 H new ATOM 0 HB3 ARG A 253 8.533 37.658 13.606 1.00 21.56 H new ATOM 0 HG2 ARG A 253 9.498 36.819 11.744 1.00 21.60 H new ATOM 0 HG3 ARG A 253 8.132 36.382 11.132 1.00 21.60 H new ATOM 0 HD2 ARG A 253 7.552 38.679 10.866 1.00 21.82 H new ATOM 0 HD3 ARG A 253 8.961 39.077 11.402 1.00 21.82 H new ATOM 0 HE ARG A 253 8.483 38.067 8.923 1.00 22.70 H new ATOM 0 HH11 ARG A 253 10.058 38.290 7.327 1.00 22.71 H new ATOM 0 HH12 ARG A 253 11.433 38.737 7.687 1.00 22.71 H new ATOM 0 HH21 ARG A 253 10.926 39.071 10.933 1.00 22.26 H new ATOM 0 HH22 ARG A 253 11.957 39.208 9.867 1.00 22.26 H new ATOM 2068 N THR A 254 8.852 33.889 13.268 1.00 22.48 N ANISOU 2068 N THR A 254 2851 2804 2886 -10 104 16 N ATOM 2069 CA THR A 254 9.994 32.988 13.432 1.00 22.90 C ANISOU 2069 CA THR A 254 2908 2853 2938 -7 105 16 C ATOM 2070 C THR A 254 10.720 32.839 12.107 1.00 22.93 C ANISOU 2070 C THR A 254 2915 2859 2938 -7 96 1 C ATOM 2071 O THR A 254 10.141 33.046 11.041 1.00 23.48 O ANISOU 2071 O THR A 254 2982 2929 3010 -11 88 -8 O ATOM 2072 CB THR A 254 9.555 31.595 13.920 1.00 23.38 C ANISOU 2072 CB THR A 254 2966 2899 3019 -8 110 24 C ATOM 2073 OG1 THR A 254 8.686 30.993 12.952 1.00 24.08 O ANISOU 2073 OG1 THR A 254 3047 2977 3124 -16 103 15 O ATOM 2074 CG2 THR A 254 8.832 31.702 15.247 1.00 23.91 C ANISOU 2074 CG2 THR A 254 3029 2966 3089 -7 121 41 C ATOM 0 H THR A 254 8.272 33.617 12.695 1.00 22.48 H new ATOM 0 HA THR A 254 10.581 33.375 14.100 1.00 22.90 H new ATOM 0 HB THR A 254 10.346 31.045 14.035 1.00 23.38 H new ATOM 0 HG1 THR A 254 8.073 31.532 12.752 1.00 24.08 H new ATOM 0 HG21 THR A 254 8.562 30.818 15.541 1.00 23.91 H new ATOM 0 HG22 THR A 254 9.424 32.095 15.907 1.00 23.91 H new ATOM 0 HG23 THR A 254 8.046 32.262 15.144 1.00 23.91 H new ATOM 2075 N ASN A 255 11.993 32.469 12.181 1.00 23.33 N ANISOU 2075 N ASN A 255 2971 2912 2981 -2 96 -1 N ATOM 2076 CA ASN A 255 12.812 32.361 10.982 1.00 23.67 C ANISOU 2076 CA ASN A 255 3017 2960 3018 0 89 -14 C ATOM 2077 C ASN A 255 12.567 31.028 10.280 1.00 24.49 C ANISOU 2077 C ASN A 255 3118 3051 3136 -1 83 -23 C ATOM 2078 O ASN A 255 12.697 29.974 10.894 1.00 25.00 O ANISOU 2078 O ASN A 255 3183 3105 3212 1 85 -19 O ATOM 2079 CB ASN A 255 14.287 32.525 11.322 1.00 23.20 C ANISOU 2079 CB ASN A 255 2961 2909 2944 6 92 -14 C ATOM 2080 CG ASN A 255 15.154 32.544 10.090 1.00 23.38 C ANISOU 2080 CG ASN A 255 2985 2941 2957 8 86 -26 C ATOM 2081 OD1 ASN A 255 15.466 31.500 9.536 1.00 23.28 O ANISOU 2081 OD1 ASN A 255 2972 2923 2949 11 82 -35 O ATOM 2082 ND2 ASN A 255 15.520 33.737 9.634 1.00 22.99 N ANISOU 2082 ND2 ASN A 255 2937 2905 2894 6 85 -27 N ATOM 0 H ASN A 255 12.400 32.277 12.914 1.00 23.33 H new ATOM 0 HA ASN A 255 12.558 33.075 10.376 1.00 23.67 H new ATOM 0 HB2 ASN A 255 14.414 33.349 11.818 1.00 23.20 H new ATOM 0 HB3 ASN A 255 14.567 31.799 11.902 1.00 23.20 H new ATOM 0 HD21 ASN A 255 15.996 33.797 8.921 1.00 22.99 H new ATOM 0 HD22 ASN A 255 15.280 34.449 10.052 1.00 22.99 H new ATOM 2083 N PRO A 256 12.212 31.076 8.985 1.00 25.86 N ANISOU 2083 N PRO A 256 3290 3226 3309 -2 74 -36 N ATOM 2084 CA PRO A 256 11.814 29.872 8.253 1.00 26.49 C ANISOU 2084 CA PRO A 256 3367 3293 3404 -2 65 -47 C ATOM 2085 C PRO A 256 12.968 28.997 7.748 1.00 27.16 C ANISOU 2085 C PRO A 256 3456 3379 3486 6 61 -57 C ATOM 2086 O PRO A 256 12.718 27.945 7.155 1.00 28.88 O ANISOU 2086 O PRO A 256 3672 3585 3718 8 52 -68 O ATOM 2087 CB PRO A 256 11.022 30.446 7.077 1.00 26.58 C ANISOU 2087 CB PRO A 256 3376 3309 3413 -4 57 -57 C ATOM 2088 CG PRO A 256 11.677 31.752 6.803 1.00 26.23 C ANISOU 2088 CG PRO A 256 3336 3284 3347 -2 60 -56 C ATOM 2089 CD PRO A 256 12.101 32.286 8.147 1.00 26.08 C ANISOU 2089 CD PRO A 256 3319 3268 3323 -4 71 -40 C ATOM 0 HA PRO A 256 11.325 29.266 8.831 1.00 26.49 H new ATOM 0 HB2 PRO A 256 11.060 29.861 6.304 1.00 26.58 H new ATOM 0 HB3 PRO A 256 10.085 30.559 7.301 1.00 26.58 H new ATOM 0 HG2 PRO A 256 12.441 31.642 6.215 1.00 26.23 H new ATOM 0 HG3 PRO A 256 11.066 32.363 6.363 1.00 26.23 H new ATOM 0 HD2 PRO A 256 12.946 32.760 8.092 1.00 26.08 H new ATOM 0 HD3 PRO A 256 11.449 32.909 8.505 1.00 26.08 H new ATOM 2090 N GLU A 257 14.212 29.411 7.980 1.00 26.72 N ANISOU 2090 N GLU A 257 3404 3335 3413 12 66 -55 N ATOM 2091 CA GLU A 257 15.373 28.691 7.459 1.00 26.97 C ANISOU 2091 CA GLU A 257 3439 3371 3439 21 62 -66 C ATOM 2092 C GLU A 257 15.900 27.610 8.410 1.00 27.07 C ANISOU 2092 C GLU A 257 3453 3372 3461 25 64 -61 C ATOM 2093 O GLU A 257 16.902 26.965 8.105 1.00 27.85 O ANISOU 2093 O GLU A 257 3554 3473 3556 34 61 -70 O ATOM 2094 CB GLU A 257 16.502 29.674 7.118 1.00 26.77 C ANISOU 2094 CB GLU A 257 3414 3367 3391 24 66 -67 C ATOM 2095 CG GLU A 257 16.090 30.877 6.274 1.00 26.89 C ANISOU 2095 CG GLU A 257 3429 3394 3394 20 65 -68 C ATOM 2096 CD GLU A 257 15.500 30.510 4.924 1.00 27.72 C ANISOU 2096 CD GLU A 257 3533 3500 3501 23 55 -82 C ATOM 2097 OE1 GLU A 257 14.701 31.310 4.389 1.00 26.87 O ANISOU 2097 OE1 GLU A 257 3425 3396 3389 18 52 -82 O ATOM 2098 OE2 GLU A 257 15.832 29.430 4.393 1.00 28.34 O ANISOU 2098 OE2 GLU A 257 3611 3574 3583 30 48 -94 O ATOM 0 H GLU A 257 14.406 30.111 8.440 1.00 26.72 H new ATOM 0 HA GLU A 257 15.070 28.237 6.657 1.00 26.97 H new ATOM 0 HB2 GLU A 257 16.890 29.997 7.946 1.00 26.77 H new ATOM 0 HB3 GLU A 257 17.199 29.191 6.647 1.00 26.77 H new ATOM 0 HG2 GLU A 257 15.441 31.401 6.769 1.00 26.89 H new ATOM 0 HG3 GLU A 257 16.865 31.444 6.135 1.00 26.89 H new ATOM 2099 N ARG A 258 15.242 27.396 9.548 1.00 28.28 N ANISOU 2099 N ARG A 258 3605 3512 3627 20 70 -47 N ATOM 2100 CA ARG A 258 15.727 26.396 10.501 1.00 29.65 C ANISOU 2100 CA ARG A 258 3783 3674 3810 25 73 -40 C ATOM 2101 C ARG A 258 15.631 24.985 9.924 1.00 30.51 C ANISOU 2101 C ARG A 258 3892 3766 3935 29 63 -51 C ATOM 2102 O ARG A 258 14.817 24.725 9.029 1.00 30.30 O ANISOU 2102 O ARG A 258 3861 3732 3919 25 54 -61 O ATOM 2103 CB ARG A 258 15.000 26.478 11.853 1.00 31.45 C ANISOU 2103 CB ARG A 258 4010 3893 4046 21 83 -21 C ATOM 2104 CG ARG A 258 13.584 25.918 11.899 1.00 33.22 C ANISOU 2104 CG ARG A 258 4229 4101 4294 12 82 -15 C ATOM 2105 CD ARG A 258 12.542 27.013 11.806 1.00 34.73 C ANISOU 2105 CD ARG A 258 4415 4299 4482 4 85 -11 C ATOM 2106 NE ARG A 258 11.227 26.589 12.289 1.00 36.13 N ANISOU 2106 NE ARG A 258 4585 4462 4681 -4 89 -1 N ATOM 2107 CZ ARG A 258 10.179 27.404 12.412 1.00 37.12 C ANISOU 2107 CZ ARG A 258 4705 4592 4808 -11 93 5 C ATOM 2108 NH1 ARG A 258 9.019 26.934 12.855 1.00 37.91 N ANISOU 2108 NH1 ARG A 258 4797 4679 4928 -18 97 15 N ATOM 2109 NH2 ARG A 258 10.286 28.692 12.096 1.00 36.48 N ANISOU 2109 NH2 ARG A 258 4625 4528 4707 -10 92 1 N ATOM 0 H ARG A 258 14.526 27.810 9.785 1.00 28.28 H new ATOM 0 HA ARG A 258 16.662 26.598 10.662 1.00 29.65 H new ATOM 0 HB2 ARG A 258 15.534 26.009 12.513 1.00 31.45 H new ATOM 0 HB3 ARG A 258 14.967 27.409 12.124 1.00 31.45 H new ATOM 0 HG2 ARG A 258 13.460 25.291 11.169 1.00 33.22 H new ATOM 0 HG3 ARG A 258 13.459 25.422 12.723 1.00 33.22 H new ATOM 0 HD2 ARG A 258 12.839 27.780 12.320 1.00 34.73 H new ATOM 0 HD3 ARG A 258 12.465 27.303 10.883 1.00 34.73 H new ATOM 0 HE ARG A 258 11.124 25.763 12.507 1.00 36.13 H new ATOM 0 HH11 ARG A 258 8.943 26.103 13.063 1.00 37.91 H new ATOM 0 HH12 ARG A 258 8.344 27.461 12.934 1.00 37.91 H new ATOM 0 HH21 ARG A 258 11.035 29.004 11.810 1.00 36.48 H new ATOM 0 HH22 ARG A 258 9.606 29.213 12.177 1.00 36.48 H new ATOM 2110 N AGLN A 259 16.461 24.086 10.446 0.50 30.27 N ANISOU 2110 N AGLN A 259 3866 3728 3907 37 63 -50 N ATOM 2111 N BGLN A 259 16.480 24.092 10.425 0.50 29.85 N ANISOU 2111 N BGLN A 259 3812 3675 3854 37 62 -51 N ATOM 2112 CA AGLN A 259 16.466 22.689 10.019 0.50 30.83 C ANISOU 2112 CA AGLN A 259 3937 3780 3995 41 52 -60 C ATOM 2113 CA BGLN A 259 16.457 22.687 10.027 0.50 30.18 C ANISOU 2113 CA BGLN A 259 3855 3698 3913 41 52 -60 C ATOM 2114 C AGLN A 259 16.851 21.781 11.182 0.50 30.62 C ANISOU 2114 C AGLN A 259 3916 3739 3978 46 56 -48 C ATOM 2115 C BGLN A 259 16.821 21.801 11.210 0.50 30.24 C ANISOU 2115 C BGLN A 259 3868 3690 3930 46 56 -47 C ATOM 2116 O AGLN A 259 17.773 22.093 11.939 0.50 29.76 O ANISOU 2116 O AGLN A 259 3812 3641 3855 53 63 -41 O ATOM 2117 O BGLN A 259 17.693 22.148 12.009 0.50 29.47 O ANISOU 2117 O BGLN A 259 3775 3604 3819 52 64 -40 O ATOM 2118 CB AGLN A 259 17.445 22.498 8.858 0.50 31.34 C ANISOU 2118 CB AGLN A 259 4004 3857 4047 52 42 -82 C ATOM 2119 CB BGLN A 259 17.436 22.430 8.880 0.50 30.17 C ANISOU 2119 CB BGLN A 259 3855 3707 3900 52 41 -82 C ATOM 2120 CG AGLN A 259 17.558 21.064 8.363 0.50 32.21 C ANISOU 2120 CG AGLN A 259 4116 3949 4174 60 28 -95 C ATOM 2121 CG BGLN A 259 16.962 22.913 7.518 0.50 30.40 C ANISOU 2121 CG BGLN A 259 3881 3746 3924 51 34 -97 C ATOM 2122 CD AGLN A 259 18.655 20.887 7.331 0.50 32.79 C ANISOU 2122 CD AGLN A 259 4190 4037 4230 74 19 -116 C ATOM 2123 CD BGLN A 259 17.858 22.432 6.393 0.50 30.32 C ANISOU 2123 CD BGLN A 259 3872 3745 3903 64 23 -118 C ATOM 2124 OE1AGLN A 259 18.744 21.645 6.362 0.50 33.22 O ANISOU 2124 OE1AGLN A 259 4242 4111 4269 75 18 -126 O ATOM 2125 OE1BGLN A 259 18.491 21.382 6.497 0.50 31.68 O ANISOU 2125 OE1BGLN A 259 4047 3908 4082 74 17 -125 O ATOM 2126 NE2AGLN A 259 19.498 19.880 7.531 0.50 33.38 N ANISOU 2126 NE2AGLN A 259 4270 4105 4309 86 14 -122 N ATOM 2127 NE2BGLN A 259 17.917 23.199 5.310 0.50 30.97 N ANISOU 2127 NE2BGLN A 259 3952 3847 3969 66 21 -128 N ATOM 0 H AGLN A 259 17.037 24.268 11.058 0.50 29.85 H new ATOM 0 H BGLN A 259 17.085 24.283 11.005 0.50 29.85 H new ATOM 0 HA AGLN A 259 15.574 22.452 9.721 0.50 30.18 H new ATOM 0 HA BGLN A 259 15.560 22.474 9.726 0.50 30.18 H new ATOM 0 HB2AGLN A 259 17.169 23.063 8.120 0.50 30.17 H new ATOM 0 HB2BGLN A 259 18.279 22.863 9.088 0.50 30.17 H new ATOM 0 HB3AGLN A 259 18.323 22.803 9.136 0.50 30.17 H new ATOM 0 HB3BGLN A 259 17.612 21.477 8.828 0.50 30.17 H new ATOM 0 HG2AGLN A 259 17.730 20.478 9.117 0.50 30.40 H new ATOM 0 HG2BGLN A 259 16.057 22.601 7.364 0.50 30.40 H new ATOM 0 HG3AGLN A 259 16.710 20.790 7.979 0.50 30.40 H new ATOM 0 HG3BGLN A 259 16.933 23.883 7.513 0.50 30.40 H new ATOM 0 HE21AGLN A 259 19.405 19.372 8.218 0.50 30.97 H new ATOM 0 HE21BGLN A 259 17.460 23.927 5.273 0.50 30.97 H new ATOM 0 HE22AGLN A 259 20.137 19.737 6.973 0.50 30.97 H new ATOM 0 HE22BGLN A 259 18.412 22.968 4.646 0.50 30.97 H new ATOM 2128 N LEU A 260 16.147 20.658 11.319 1.00 30.54 N ANISOU 2128 N LEU A 260 3906 3704 3994 42 50 -45 N ATOM 2129 CA LEU A 260 16.479 19.652 12.331 1.00 31.54 C ANISOU 2129 CA LEU A 260 4039 3813 4131 47 53 -33 C ATOM 2130 C LEU A 260 17.470 18.658 11.717 1.00 32.41 C ANISOU 2130 C LEU A 260 4153 3917 4242 60 39 -51 C ATOM 2131 O LEU A 260 17.148 17.979 10.739 1.00 33.18 O ANISOU 2131 O LEU A 260 4250 4004 4354 60 25 -67 O ATOM 2132 CB LEU A 260 15.214 18.932 12.811 1.00 31.43 C ANISOU 2132 CB LEU A 260 4021 3774 4147 36 54 -18 C ATOM 2133 CG LEU A 260 15.376 17.893 13.924 1.00 31.42 C ANISOU 2133 CG LEU A 260 4026 3752 4160 39 59 0 C ATOM 2134 CD1 LEU A 260 16.054 18.498 15.146 1.00 31.14 C ANISOU 2134 CD1 LEU A 260 3997 3733 4103 47 73 16 C ATOM 2135 CD2 LEU A 260 14.023 17.305 14.298 1.00 31.91 C ANISOU 2135 CD2 LEU A 260 4082 3791 4252 25 62 16 C ATOM 0 H ALEU A 260 15.467 20.458 10.832 0.50 30.54 H new ATOM 0 H BLEU A 260 15.487 20.443 10.812 0.50 30.54 H new ATOM 0 HA LEU A 260 16.881 20.080 13.103 1.00 31.54 H new ATOM 0 HB2 LEU A 260 14.584 19.603 13.117 1.00 31.43 H new ATOM 0 HB3 LEU A 260 14.811 18.492 12.046 1.00 31.43 H new ATOM 0 HG LEU A 260 15.944 17.180 13.592 1.00 31.42 H new ATOM 0 HD11 LEU A 260 16.144 17.821 15.835 1.00 31.14 H new ATOM 0 HD12 LEU A 260 16.933 18.827 14.899 1.00 31.14 H new ATOM 0 HD13 LEU A 260 15.518 19.232 15.484 1.00 31.14 H new ATOM 0 HD21 LEU A 260 14.139 16.649 15.003 1.00 31.91 H new ATOM 0 HD22 LEU A 260 13.437 18.013 14.609 1.00 31.91 H new ATOM 0 HD23 LEU A 260 13.630 16.878 13.521 1.00 31.91 H new ATOM 2136 N CYS A 261 18.668 18.582 12.291 1.00 32.68 N ANISOU 2136 N CYS A 261 4194 3960 4261 72 43 -49 N ATOM 2137 CA CYS A 261 19.741 17.729 11.772 1.00 34.13 C ANISOU 2137 CA CYS A 261 4383 4143 4442 87 31 -67 C ATOM 2138 C CYS A 261 19.997 16.525 12.682 1.00 35.83 C ANISOU 2138 C CYS A 261 4607 4335 4673 94 29 -57 C ATOM 2139 O CYS A 261 20.034 16.662 13.901 1.00 34.12 O ANISOU 2139 O CYS A 261 4394 4117 4453 93 40 -36 O ATOM 2140 CB CYS A 261 21.018 18.551 11.616 1.00 34.07 C ANISOU 2140 CB CYS A 261 4376 4165 4406 97 35 -75 C ATOM 2141 SG CYS A 261 20.858 19.921 10.444 1.00 33.37 S ANISOU 2141 SG CYS A 261 4278 4102 4299 90 36 -87 S ATOM 0 H CYS A 261 18.885 19.025 12.996 1.00 32.68 H new ATOM 0 HA CYS A 261 19.464 17.388 10.907 1.00 34.13 H new ATOM 0 HB2 CYS A 261 21.274 18.904 12.482 1.00 34.07 H new ATOM 0 HB3 CYS A 261 21.736 17.968 11.324 1.00 34.07 H new ATOM 0 HG CYS A 261 21.079 20.957 11.007 1.00 33.37 H new ATOM 2142 N GLN A 262 20.182 15.348 12.078 1.00 38.62 N ANISOU 2142 N GLN A 262 4962 4670 5040 101 13 -71 N ATOM 2143 CA GLN A 262 20.341 14.094 12.838 1.00 40.03 C ANISOU 2143 CA GLN A 262 5149 4822 5237 107 9 -62 C ATOM 2144 C GLN A 262 21.788 13.745 13.196 1.00 40.55 C ANISOU 2144 C GLN A 262 5224 4897 5287 126 6 -69 C ATOM 2145 O GLN A 262 22.030 12.877 14.044 1.00 40.96 O ANISOU 2145 O GLN A 262 5283 4930 5348 132 5 -57 O ATOM 2146 CB GLN A 262 19.712 12.930 12.066 1.00 41.98 C ANISOU 2146 CB GLN A 262 5396 5041 5513 105 -9 -74 C ATOM 2147 CG GLN A 262 18.203 13.037 11.917 1.00 42.91 C ANISOU 2147 CG GLN A 262 5506 5144 5654 86 -8 -65 C ATOM 2148 CD GLN A 262 17.480 13.071 13.252 1.00 43.74 C ANISOU 2148 CD GLN A 262 5612 5238 5771 74 9 -33 C ATOM 2149 OE1 GLN A 262 17.906 12.440 14.221 1.00 44.51 O ANISOU 2149 OE1 GLN A 262 5717 5323 5872 80 13 -18 O ATOM 2150 NE2 GLN A 262 16.379 13.814 13.309 1.00 44.48 N ANISOU 2150 NE2 GLN A 262 5696 5335 5869 58 18 -22 N ATOM 0 H GLN A 262 20.219 15.250 11.224 1.00 38.62 H new ATOM 0 HA GLN A 262 19.883 14.242 13.680 1.00 40.03 H new ATOM 0 HB2 GLN A 262 20.113 12.884 11.184 1.00 41.98 H new ATOM 0 HB3 GLN A 262 19.926 12.099 12.519 1.00 41.98 H new ATOM 0 HG2 GLN A 262 17.988 13.840 11.417 1.00 42.91 H new ATOM 0 HG3 GLN A 262 17.879 12.284 11.398 1.00 42.91 H new ATOM 0 HE21 GLN A 262 16.112 14.241 12.612 1.00 44.48 H new ATOM 0 HE22 GLN A 262 15.934 13.868 14.043 1.00 44.48 H new ATOM 2151 N SER A 263 22.741 14.405 12.546 1.00 39.00 N ANISOU 2151 N SER A 263 5024 4729 5066 135 5 -86 N ATOM 2152 CA SER A 263 24.159 14.221 12.839 1.00 38.47 C ANISOU 2152 CA SER A 263 4961 4674 4981 153 3 -94 C ATOM 2153 C SER A 263 24.894 15.544 12.673 1.00 37.87 C ANISOU 2153 C SER A 263 4878 4633 4877 154 13 -98 C ATOM 2154 O SER A 263 24.378 16.475 12.047 1.00 37.47 O ANISOU 2154 O SER A 263 4820 4595 4820 143 17 -100 O ATOM 2155 CB SER A 263 24.763 13.174 11.901 1.00 39.04 C ANISOU 2155 CB SER A 263 5036 4739 5059 168 -15 -119 C ATOM 2156 OG SER A 263 24.867 13.679 10.579 1.00 38.35 O ANISOU 2156 OG SER A 263 4940 4671 4959 169 -21 -140 O ATOM 0 H SER A 263 22.583 14.974 11.921 1.00 39.00 H new ATOM 0 HA SER A 263 24.252 13.913 13.754 1.00 38.47 H new ATOM 0 HB2 SER A 263 25.641 12.914 12.222 1.00 39.04 H new ATOM 0 HB3 SER A 263 24.212 12.375 11.904 1.00 39.04 H new ATOM 0 HG SER A 263 25.201 13.092 10.080 1.00 38.35 H new ATOM 2157 N ILE A 264 26.101 15.618 13.230 1.00 38.40 N ANISOU 2157 N ILE A 264 4948 4713 4928 168 15 -100 N ATOM 2158 CA ILE A 264 26.940 16.807 13.096 1.00 37.87 C ANISOU 2158 CA ILE A 264 4874 4678 4837 169 23 -105 C ATOM 2159 C ILE A 264 27.385 17.001 11.643 1.00 37.56 C ANISOU 2159 C ILE A 264 4827 4658 4788 173 16 -128 C ATOM 2160 O ILE A 264 27.690 18.121 11.230 1.00 35.77 O ANISOU 2160 O ILE A 264 4592 4456 4545 168 24 -130 O ATOM 2161 CB ILE A 264 28.162 16.757 14.045 1.00 37.92 C ANISOU 2161 CB ILE A 264 4884 4694 4831 184 25 -103 C ATOM 2162 CG1 ILE A 264 28.759 18.157 14.259 1.00 37.88 C ANISOU 2162 CG1 ILE A 264 4871 4717 4806 180 36 -101 C ATOM 2163 CG2 ILE A 264 29.213 15.778 13.528 1.00 39.55 C ANISOU 2163 CG2 ILE A 264 5091 4901 5035 203 12 -123 C ATOM 2164 CD1 ILE A 264 27.848 19.123 14.990 1.00 37.15 C ANISOU 2164 CD1 ILE A 264 4778 4624 4713 166 47 -81 C ATOM 0 H ILE A 264 26.455 14.985 13.693 1.00 38.40 H new ATOM 0 HA ILE A 264 26.402 17.572 13.355 1.00 37.87 H new ATOM 0 HB ILE A 264 27.857 16.436 14.908 1.00 37.92 H new ATOM 0 HG12 ILE A 264 29.587 18.071 14.757 1.00 37.88 H new ATOM 0 HG13 ILE A 264 28.986 18.535 13.395 1.00 37.88 H new ATOM 0 HG21 ILE A 264 29.968 15.763 14.137 1.00 39.55 H new ATOM 0 HG22 ILE A 264 28.827 14.890 13.469 1.00 39.55 H new ATOM 0 HG23 ILE A 264 29.512 16.059 12.649 1.00 39.55 H new ATOM 0 HD11 ILE A 264 28.294 19.979 15.085 1.00 37.15 H new ATOM 0 HD12 ILE A 264 27.028 19.240 14.485 1.00 37.15 H new ATOM 0 HD13 ILE A 264 27.638 18.769 15.868 1.00 37.15 H new ATOM 2165 N ASP A 265 27.412 15.914 10.873 1.00 37.40 N ANISOU 2165 N ASP A 265 4809 4625 4777 182 2 -144 N ATOM 2166 CA ASP A 265 27.728 15.999 9.447 1.00 38.25 C ANISOU 2166 CA ASP A 265 4910 4750 4875 188 -5 -166 C ATOM 2167 C ASP A 265 26.606 16.722 8.694 1.00 36.58 C ANISOU 2167 C ASP A 265 4693 4541 4666 173 -2 -165 C ATOM 2168 O ASP A 265 26.872 17.537 7.812 1.00 36.36 O ANISOU 2168 O ASP A 265 4658 4538 4621 172 1 -173 O ATOM 2169 CB ASP A 265 27.996 14.607 8.867 1.00 40.07 C ANISOU 2169 CB ASP A 265 5144 4965 5115 205 -23 -186 C ATOM 2170 CG ASP A 265 29.089 13.870 9.621 1.00 41.28 C ANISOU 2170 CG ASP A 265 5304 5115 5267 221 -27 -188 C ATOM 2171 OD1 ASP A 265 28.790 13.288 10.689 1.00 42.97 O ANISOU 2171 OD1 ASP A 265 5527 5305 5496 220 -27 -173 O ATOM 2172 OD2 ASP A 265 30.250 13.885 9.163 1.00 43.60 O ANISOU 2172 OD2 ASP A 265 5592 5430 5543 237 -29 -204 O ATOM 0 H ASP A 265 27.250 15.118 11.156 1.00 37.40 H new ATOM 0 HA ASP A 265 28.540 16.519 9.337 1.00 38.25 H new ATOM 0 HB2 ASP A 265 27.179 14.085 8.894 1.00 40.07 H new ATOM 0 HB3 ASP A 265 28.249 14.691 7.934 1.00 40.07 H new ATOM 2173 N GLU A 266 25.357 16.444 9.060 1.00 35.32 N ANISOU 2173 N GLU A 266 4536 4356 4527 160 -3 -153 N ATOM 2174 CA GLU A 266 24.219 17.197 8.526 1.00 34.51 C ANISOU 2174 CA GLU A 266 4429 4255 4428 144 0 -148 C ATOM 2175 C GLU A 266 24.268 18.660 8.974 1.00 32.25 C ANISOU 2175 C GLU A 266 4138 3990 4125 134 17 -134 C ATOM 2176 O GLU A 266 23.955 19.554 8.195 1.00 31.58 O ANISOU 2176 O GLU A 266 4048 3921 4031 127 20 -137 O ATOM 2177 CB GLU A 266 22.889 16.571 8.942 1.00 36.36 C ANISOU 2177 CB GLU A 266 4667 4458 4690 133 -3 -137 C ATOM 2178 CG GLU A 266 22.557 15.290 8.192 1.00 37.69 C ANISOU 2178 CG GLU A 266 4838 4604 4878 139 -22 -154 C ATOM 2179 CD GLU A 266 21.278 14.638 8.674 1.00 39.09 C ANISOU 2179 CD GLU A 266 5017 4749 5087 126 -25 -142 C ATOM 2180 OE1 GLU A 266 21.161 13.405 8.531 1.00 41.30 O ANISOU 2180 OE1 GLU A 266 5301 5004 5388 132 -40 -150 O ATOM 2181 OE2 GLU A 266 20.389 15.346 9.195 1.00 39.75 O ANISOU 2181 OE2 GLU A 266 5097 4831 5175 110 -13 -123 O ATOM 0 H GLU A 266 25.145 15.823 9.616 1.00 35.32 H new ATOM 0 HA GLU A 266 24.284 17.164 7.559 1.00 34.51 H new ATOM 0 HB2 GLU A 266 22.912 16.383 9.893 1.00 36.36 H new ATOM 0 HB3 GLU A 266 22.178 17.215 8.798 1.00 36.36 H new ATOM 0 HG2 GLU A 266 22.477 15.486 7.245 1.00 37.69 H new ATOM 0 HG3 GLU A 266 23.291 14.664 8.291 1.00 37.69 H new ATOM 2182 N VAL A 267 24.666 18.893 10.223 1.00 29.78 N ANISOU 2182 N VAL A 267 3829 3678 3810 133 26 -118 N ATOM 2183 CA VAL A 267 24.848 20.258 10.728 1.00 28.44 C ANISOU 2183 CA VAL A 267 3655 3527 3624 126 40 -106 C ATOM 2184 C VAL A 267 25.884 21.001 9.882 1.00 28.06 C ANISOU 2184 C VAL A 267 3599 3508 3555 131 41 -119 C ATOM 2185 O VAL A 267 25.702 22.170 9.546 1.00 27.16 O ANISOU 2185 O VAL A 267 3480 3410 3431 122 48 -115 O ATOM 2186 CB VAL A 267 25.284 20.266 12.212 1.00 27.47 C ANISOU 2186 CB VAL A 267 3538 3401 3501 129 47 -91 C ATOM 2187 CG1 VAL A 267 25.682 21.674 12.654 1.00 27.88 C ANISOU 2187 CG1 VAL A 267 3584 3473 3534 124 57 -83 C ATOM 2188 CG2 VAL A 267 24.180 19.700 13.097 1.00 27.86 C ANISOU 2188 CG2 VAL A 267 3593 3423 3568 123 49 -73 C ATOM 0 H VAL A 267 24.837 18.275 10.797 1.00 29.78 H new ATOM 0 HA VAL A 267 23.992 20.709 10.664 1.00 28.44 H new ATOM 0 HB VAL A 267 26.064 19.697 12.306 1.00 27.47 H new ATOM 0 HG11 VAL A 267 25.951 21.657 13.586 1.00 27.88 H new ATOM 0 HG12 VAL A 267 26.421 21.987 12.110 1.00 27.88 H new ATOM 0 HG13 VAL A 267 24.926 22.273 12.547 1.00 27.88 H new ATOM 0 HG21 VAL A 267 24.469 19.712 14.023 1.00 27.86 H new ATOM 0 HG22 VAL A 267 23.380 20.240 13.001 1.00 27.86 H new ATOM 0 HG23 VAL A 267 23.988 18.787 12.831 1.00 27.86 H new ATOM 2189 N TRP A 268 26.969 20.319 9.526 1.00 28.32 N ANISOU 2189 N TRP A 268 3632 3548 3582 147 34 -134 N ATOM 2190 CA TRP A 268 28.013 20.950 8.733 1.00 29.00 C ANISOU 2190 CA TRP A 268 3709 3662 3647 153 37 -145 C ATOM 2191 C TRP A 268 27.507 21.369 7.373 1.00 28.64 C ANISOU 2191 C TRP A 268 3659 3627 3596 148 35 -154 C ATOM 2192 O TRP A 268 27.801 22.476 6.913 1.00 28.62 O ANISOU 2192 O TRP A 268 3649 3647 3578 143 43 -152 O ATOM 2193 CB TRP A 268 29.239 20.047 8.602 1.00 29.79 C ANISOU 2193 CB TRP A 268 3809 3769 3742 172 30 -161 C ATOM 2194 CG TRP A 268 30.415 20.805 8.048 1.00 30.88 C ANISOU 2194 CG TRP A 268 3935 3938 3859 177 36 -168 C ATOM 2195 CD1 TRP A 268 31.013 20.652 6.803 1.00 31.80 C ANISOU 2195 CD1 TRP A 268 4045 4074 3963 187 32 -185 C ATOM 2196 CD2 TRP A 268 31.141 21.907 8.688 1.00 31.12 C ANISOU 2196 CD2 TRP A 268 3959 3986 3879 171 47 -158 C ATOM 2197 NE1 TRP A 268 32.041 21.545 6.642 1.00 31.93 N ANISOU 2197 NE1 TRP A 268 4050 4118 3963 188 42 -185 N ATOM 2198 CE2 TRP A 268 32.172 22.325 7.738 1.00 31.73 C ANISOU 2198 CE2 TRP A 268 4024 4091 3939 178 50 -169 C ATOM 2199 CE3 TRP A 268 31.052 22.558 9.916 1.00 31.63 C ANISOU 2199 CE3 TRP A 268 4026 4046 3947 163 53 -142 C ATOM 2200 CZ2 TRP A 268 33.060 23.352 8.023 1.00 32.04 C ANISOU 2200 CZ2 TRP A 268 4054 4152 3969 174 59 -164 C ATOM 2201 CZ3 TRP A 268 31.950 23.592 10.192 1.00 31.58 C ANISOU 2201 CZ3 TRP A 268 4010 4060 3929 161 61 -139 C ATOM 2202 CH2 TRP A 268 32.933 23.979 9.265 1.00 32.23 C ANISOU 2202 CH2 TRP A 268 4080 4168 3998 165 64 -149 C ATOM 0 H TRP A 268 27.117 19.497 9.732 1.00 28.32 H new ATOM 0 HA TRP A 268 28.282 21.753 9.207 1.00 29.00 H new ATOM 0 HB2 TRP A 268 29.468 19.679 9.470 1.00 29.79 H new ATOM 0 HB3 TRP A 268 29.032 19.298 8.022 1.00 29.79 H new ATOM 0 HD1 TRP A 268 30.751 20.028 6.165 1.00 31.80 H new ATOM 0 HE1 TRP A 268 32.535 21.601 5.940 1.00 31.93 H new ATOM 0 HE3 TRP A 268 30.408 22.310 10.539 1.00 31.63 H new ATOM 0 HZ2 TRP A 268 33.712 23.612 7.413 1.00 32.04 H new ATOM 0 HZ3 TRP A 268 31.896 24.035 11.008 1.00 31.58 H new ATOM 0 HH2 TRP A 268 33.514 24.671 9.484 1.00 32.23 H new ATOM 2203 N ALA A 269 26.724 20.505 6.728 1.00 28.58 N ANISOU 2203 N ALA A 269 3655 3604 3601 151 24 -164 N ATOM 2204 CA ALA A 269 26.126 20.823 5.421 1.00 28.13 C ANISOU 2204 CA ALA A 269 3595 3556 3539 148 20 -174 C ATOM 2205 C ALA A 269 25.208 22.043 5.489 1.00 27.54 C ANISOU 2205 C ALA A 269 3518 3484 3463 130 30 -159 C ATOM 2206 O ALA A 269 25.190 22.871 4.572 1.00 27.14 O ANISOU 2206 O ALA A 269 3463 3452 3398 128 33 -162 O ATOM 2207 CB ALA A 269 25.359 19.624 4.884 1.00 28.54 C ANISOU 2207 CB ALA A 269 3652 3585 3608 154 5 -187 C ATOM 0 H ALA A 269 26.523 19.725 7.028 1.00 28.58 H new ATOM 0 HA ALA A 269 26.854 21.038 4.817 1.00 28.13 H new ATOM 0 HB1 ALA A 269 24.971 19.847 4.024 1.00 28.54 H new ATOM 0 HB2 ALA A 269 25.964 18.873 4.780 1.00 28.54 H new ATOM 0 HB3 ALA A 269 24.653 19.387 5.505 1.00 28.54 H new ATOM 2208 N TYR A 270 24.451 22.145 6.578 1.00 26.47 N ANISOU 2208 N TYR A 270 3386 3329 3341 119 34 -143 N ATOM 2209 CA TYR A 270 23.593 23.305 6.830 1.00 25.93 C ANISOU 2209 CA TYR A 270 3316 3263 3272 103 42 -128 C ATOM 2210 C TYR A 270 24.426 24.582 6.943 1.00 25.57 C ANISOU 2210 C TYR A 270 3266 3243 3208 100 53 -121 C ATOM 2211 O TYR A 270 24.059 25.616 6.382 1.00 25.91 O ANISOU 2211 O TYR A 270 3305 3297 3242 92 57 -118 O ATOM 2212 CB TYR A 270 22.773 23.083 8.105 1.00 25.47 C ANISOU 2212 CB TYR A 270 3262 3183 3231 94 46 -111 C ATOM 2213 CG TYR A 270 21.829 24.205 8.464 1.00 25.10 C ANISOU 2213 CG TYR A 270 3214 3137 3185 80 54 -97 C ATOM 2214 CD1 TYR A 270 20.525 24.216 7.996 1.00 25.33 C ANISOU 2214 CD1 TYR A 270 3243 3156 3226 71 50 -97 C ATOM 2215 CD2 TYR A 270 22.235 25.243 9.296 1.00 24.96 C ANISOU 2215 CD2 TYR A 270 3196 3132 3158 76 64 -84 C ATOM 2216 CE1 TYR A 270 19.651 25.238 8.326 1.00 24.68 C ANISOU 2216 CE1 TYR A 270 3159 3076 3144 59 57 -84 C ATOM 2217 CE2 TYR A 270 21.371 26.272 9.627 1.00 24.74 C ANISOU 2217 CE2 TYR A 270 3166 3104 3129 64 70 -72 C ATOM 2218 CZ TYR A 270 20.079 26.262 9.148 1.00 24.71 C ANISOU 2218 CZ TYR A 270 3162 3091 3136 56 67 -72 C ATOM 2219 OH TYR A 270 19.219 27.286 9.481 1.00 24.14 O ANISOU 2219 OH TYR A 270 3089 3021 3064 45 72 -61 O ATOM 0 H TYR A 270 24.419 21.545 7.193 1.00 26.47 H new ATOM 0 HA TYR A 270 22.985 23.409 6.081 1.00 25.93 H new ATOM 0 HB2 TYR A 270 22.259 22.267 8.004 1.00 25.47 H new ATOM 0 HB3 TYR A 270 23.384 22.944 8.845 1.00 25.47 H new ATOM 0 HD1 TYR A 270 20.231 23.523 7.449 1.00 25.33 H new ATOM 0 HD2 TYR A 270 23.101 25.246 9.635 1.00 24.96 H new ATOM 0 HE1 TYR A 270 18.781 25.235 7.996 1.00 24.68 H new ATOM 0 HE2 TYR A 270 21.661 26.968 10.171 1.00 24.74 H new ATOM 0 HH TYR A 270 18.498 27.196 9.059 1.00 24.14 H new ATOM 2220 N ILE A 271 25.541 24.504 7.665 1.00 25.89 N ANISOU 2220 N ILE A 271 3305 3289 3242 107 57 -119 N ATOM 2221 CA ILE A 271 26.449 25.640 7.811 1.00 25.32 C ANISOU 2221 CA ILE A 271 3227 3239 3155 104 66 -114 C ATOM 2222 C ILE A 271 26.966 26.082 6.442 1.00 25.96 C ANISOU 2222 C ILE A 271 3300 3343 3220 107 67 -124 C ATOM 2223 O ILE A 271 26.922 27.269 6.111 1.00 25.06 O ANISOU 2223 O ILE A 271 3182 3242 3097 98 73 -117 O ATOM 2224 CB ILE A 271 27.627 25.312 8.753 1.00 25.16 C ANISOU 2224 CB ILE A 271 3206 3222 3133 114 67 -114 C ATOM 2225 CG1 ILE A 271 27.116 25.195 10.192 1.00 24.35 C ANISOU 2225 CG1 ILE A 271 3110 3101 3040 110 69 -100 C ATOM 2226 CG2 ILE A 271 28.714 26.370 8.640 1.00 25.58 C ANISOU 2226 CG2 ILE A 271 3249 3299 3170 112 74 -113 C ATOM 2227 CD1 ILE A 271 28.159 24.716 11.185 1.00 23.95 C ANISOU 2227 CD1 ILE A 271 3061 3050 2988 122 69 -100 C ATOM 0 H ILE A 271 25.792 23.795 8.082 1.00 25.89 H new ATOM 0 HA ILE A 271 25.950 26.369 8.212 1.00 25.32 H new ATOM 0 HB ILE A 271 28.017 24.463 8.493 1.00 25.16 H new ATOM 0 HG12 ILE A 271 26.785 26.061 10.478 1.00 24.35 H new ATOM 0 HG13 ILE A 271 26.363 24.584 10.209 1.00 24.35 H new ATOM 0 HG21 ILE A 271 29.445 26.148 9.238 1.00 25.58 H new ATOM 0 HG22 ILE A 271 29.041 26.402 7.727 1.00 25.58 H new ATOM 0 HG23 ILE A 271 28.350 27.236 8.883 1.00 25.58 H new ATOM 0 HD11 ILE A 271 27.765 24.667 12.070 1.00 23.95 H new ATOM 0 HD12 ILE A 271 28.476 23.837 10.923 1.00 23.95 H new ATOM 0 HD13 ILE A 271 28.904 25.337 11.197 1.00 23.95 H new ATOM 2228 N GLU A 272 27.432 25.114 5.654 1.00 26.40 N ANISOU 2228 N GLU A 272 3356 3403 3273 121 60 -140 N ATOM 2229 CA GLU A 272 27.909 25.374 4.294 1.00 27.76 C ANISOU 2229 CA GLU A 272 3521 3597 3428 127 60 -151 C ATOM 2230 C GLU A 272 26.813 25.976 3.410 1.00 27.23 C ANISOU 2230 C GLU A 272 3455 3531 3359 119 60 -149 C ATOM 2231 O GLU A 272 27.062 26.941 2.682 1.00 26.35 O ANISOU 2231 O GLU A 272 3339 3440 3233 115 67 -145 O ATOM 2232 CB GLU A 272 28.446 24.086 3.659 1.00 29.32 C ANISOU 2232 CB GLU A 272 3720 3797 3625 146 50 -171 C ATOM 2233 CG GLU A 272 29.716 23.565 4.320 1.00 30.84 C ANISOU 2233 CG GLU A 272 3908 3994 3814 158 51 -175 C ATOM 2234 CD GLU A 272 30.201 22.249 3.735 1.00 32.27 C ANISOU 2234 CD GLU A 272 4092 4175 3996 178 39 -195 C ATOM 2235 OE1 GLU A 272 31.433 22.061 3.655 1.00 34.48 O ANISOU 2235 OE1 GLU A 272 4365 4473 4265 190 41 -203 O ATOM 2236 OE2 GLU A 272 29.363 21.402 3.359 1.00 33.48 O ANISOU 2236 OE2 GLU A 272 4252 4310 4160 182 28 -204 O ATOM 0 H GLU A 272 27.481 24.289 5.892 1.00 26.40 H new ATOM 0 HA GLU A 272 28.627 26.023 4.359 1.00 27.76 H new ATOM 0 HB2 GLU A 272 27.761 23.401 3.706 1.00 29.32 H new ATOM 0 HB3 GLU A 272 28.622 24.247 2.719 1.00 29.32 H new ATOM 0 HG2 GLU A 272 30.417 24.230 4.229 1.00 30.84 H new ATOM 0 HG3 GLU A 272 29.555 23.450 5.270 1.00 30.84 H new ATOM 2237 N GLU A 273 25.611 25.407 3.488 1.00 26.69 N ANISOU 2237 N GLU A 273 3394 3440 3306 116 51 -151 N ATOM 2238 CA GLU A 273 24.458 25.868 2.703 1.00 27.14 C ANISOU 2238 CA GLU A 273 3453 3495 3364 109 48 -151 C ATOM 2239 C GLU A 273 24.165 27.344 2.959 1.00 26.73 C ANISOU 2239 C GLU A 273 3399 3452 3306 94 59 -134 C ATOM 2240 O GLU A 273 23.988 28.123 2.020 1.00 27.00 O ANISOU 2240 O GLU A 273 3431 3500 3328 92 61 -133 O ATOM 2241 CB GLU A 273 23.207 25.026 3.024 1.00 27.89 C ANISOU 2241 CB GLU A 273 3554 3562 3482 105 38 -153 C ATOM 2242 CG GLU A 273 21.947 25.433 2.258 1.00 28.94 C ANISOU 2242 CG GLU A 273 3687 3691 3617 99 33 -155 C ATOM 2243 CD GLU A 273 20.689 24.695 2.697 1.00 30.35 C ANISOU 2243 CD GLU A 273 3870 3842 3822 93 25 -155 C ATOM 2244 OE1 GLU A 273 20.773 23.763 3.530 1.00 31.77 O ANISOU 2244 OE1 GLU A 273 4052 4003 4017 94 22 -153 O ATOM 2245 OE2 GLU A 273 19.597 25.054 2.208 1.00 30.94 O ANISOU 2245 OE2 GLU A 273 3944 3911 3900 86 21 -155 O ATOM 0 H GLU A 273 25.437 24.738 4.000 1.00 26.69 H new ATOM 0 HA GLU A 273 24.683 25.758 1.766 1.00 27.14 H new ATOM 0 HB2 GLU A 273 23.401 24.095 2.832 1.00 27.89 H new ATOM 0 HB3 GLU A 273 23.026 25.088 3.975 1.00 27.89 H new ATOM 0 HG2 GLU A 273 21.807 26.386 2.368 1.00 28.94 H new ATOM 0 HG3 GLU A 273 22.090 25.275 1.312 1.00 28.94 H new ATOM 2246 N TYR A 274 24.121 27.731 4.229 1.00 25.85 N ANISOU 2246 N TYR A 274 3288 3330 3203 84 65 -120 N ATOM 2247 CA TYR A 274 23.714 29.091 4.570 1.00 24.62 C ANISOU 2247 CA TYR A 274 3132 3179 3044 71 72 -105 C ATOM 2248 C TYR A 274 24.842 30.117 4.550 1.00 24.50 C ANISOU 2248 C TYR A 274 3110 3184 3014 68 81 -98 C ATOM 2249 O TYR A 274 24.572 31.314 4.510 1.00 24.18 O ANISOU 2249 O TYR A 274 3068 3149 2969 58 86 -88 O ATOM 2250 CB TYR A 274 22.896 29.113 5.870 1.00 24.43 C ANISOU 2250 CB TYR A 274 3112 3134 3035 62 73 -93 C ATOM 2251 CG TYR A 274 21.482 28.698 5.576 1.00 24.29 C ANISOU 2251 CG TYR A 274 3097 3100 3030 58 66 -96 C ATOM 2252 CD1 TYR A 274 20.556 29.624 5.102 1.00 24.51 C ANISOU 2252 CD1 TYR A 274 3126 3131 3057 50 67 -91 C ATOM 2253 CD2 TYR A 274 21.088 27.368 5.685 1.00 25.13 C ANISOU 2253 CD2 TYR A 274 3207 3189 3152 64 59 -103 C ATOM 2254 CE1 TYR A 274 19.262 29.246 4.782 1.00 25.12 C ANISOU 2254 CE1 TYR A 274 3204 3194 3145 47 60 -95 C ATOM 2255 CE2 TYR A 274 19.791 26.977 5.379 1.00 25.21 C ANISOU 2255 CE2 TYR A 274 3218 3183 3176 60 52 -106 C ATOM 2256 CZ TYR A 274 18.884 27.919 4.923 1.00 25.40 C ANISOU 2256 CZ TYR A 274 3241 3212 3198 51 52 -103 C ATOM 2257 OH TYR A 274 17.599 27.548 4.610 1.00 26.54 O ANISOU 2257 OH TYR A 274 3385 3341 3357 47 45 -106 O ATOM 0 H TYR A 274 24.319 27.231 4.900 1.00 25.85 H new ATOM 0 HA TYR A 274 23.132 29.384 3.852 1.00 24.62 H new ATOM 0 HB2 TYR A 274 23.291 28.514 6.523 1.00 24.43 H new ATOM 0 HB3 TYR A 274 22.909 30.002 6.257 1.00 24.43 H new ATOM 0 HD1 TYR A 274 20.811 30.512 4.998 1.00 24.51 H new ATOM 0 HD2 TYR A 274 21.703 26.730 5.967 1.00 25.13 H new ATOM 0 HE1 TYR A 274 18.652 29.877 4.475 1.00 25.12 H new ATOM 0 HE2 TYR A 274 19.533 26.089 5.480 1.00 25.21 H new ATOM 0 HH TYR A 274 17.116 28.233 4.553 1.00 26.54 H new ATOM 2258 N HIS A 275 26.095 29.669 4.548 1.00 25.33 N ANISOU 2258 N HIS A 275 3210 3301 3113 78 83 -105 N ATOM 2259 CA HIS A 275 27.190 30.590 4.229 1.00 25.77 C ANISOU 2259 CA HIS A 275 3257 3379 3155 76 91 -100 C ATOM 2260 C HIS A 275 27.017 31.063 2.805 1.00 26.58 C ANISOU 2260 C HIS A 275 3358 3497 3244 76 93 -102 C ATOM 2261 O HIS A 275 27.165 32.247 2.515 1.00 26.03 O ANISOU 2261 O HIS A 275 3284 3439 3167 67 100 -91 O ATOM 2262 CB HIS A 275 28.563 29.950 4.428 1.00 25.76 C ANISOU 2262 CB HIS A 275 3250 3389 3150 88 93 -108 C ATOM 2263 CG HIS A 275 29.686 30.956 4.611 1.00 25.75 C ANISOU 2263 CG HIS A 275 3237 3405 3141 82 101 -100 C ATOM 2264 ND1 HIS A 275 30.937 30.592 4.939 1.00 26.66 N ANISOU 2264 ND1 HIS A 275 3345 3530 3253 90 103 -105 N ATOM 2265 CD2 HIS A 275 29.694 32.349 4.530 1.00 25.96 C ANISOU 2265 CD2 HIS A 275 3260 3439 3164 68 108 -87 C ATOM 2266 CE1 HIS A 275 31.712 31.686 5.041 1.00 26.54 C ANISOU 2266 CE1 HIS A 275 3320 3530 3235 82 111 -96 C ATOM 2267 NE2 HIS A 275 30.951 32.760 4.798 1.00 27.03 N ANISOU 2267 NE2 HIS A 275 3384 3589 3297 68 114 -84 N ATOM 0 H HIS A 275 26.331 28.861 4.723 1.00 25.33 H new ATOM 0 HA HIS A 275 27.152 31.343 4.839 1.00 25.77 H new ATOM 0 HB2 HIS A 275 28.531 29.369 5.204 1.00 25.76 H new ATOM 0 HB3 HIS A 275 28.764 29.389 3.662 1.00 25.76 H new ATOM 0 HD1 HIS A 275 31.201 29.783 5.064 1.00 26.66 H new ATOM 0 HD2 HIS A 275 28.967 32.893 4.329 1.00 25.96 H new ATOM 0 HE1 HIS A 275 32.619 31.695 5.245 1.00 26.54 H new ATOM 2268 N GLU A 276 26.672 30.144 1.908 1.00 28.14 N ANISOU 2268 N GLU A 276 3558 3695 3438 88 86 -116 N ATOM 2269 CA GLU A 276 26.430 30.486 0.508 1.00 29.62 C ANISOU 2269 CA GLU A 276 3745 3898 3611 92 87 -119 C ATOM 2270 C GLU A 276 25.160 31.330 0.330 1.00 28.20 C ANISOU 2270 C GLU A 276 3571 3710 3435 80 85 -111 C ATOM 2271 O GLU A 276 25.147 32.265 -0.473 1.00 28.51 O ANISOU 2271 O GLU A 276 3609 3764 3461 77 91 -104 O ATOM 2272 CB GLU A 276 26.353 29.212 -0.342 1.00 32.25 C ANISOU 2272 CB GLU A 276 4080 4232 3941 109 77 -140 C ATOM 2273 CG GLU A 276 26.230 29.448 -1.842 1.00 35.72 C ANISOU 2273 CG GLU A 276 4519 4690 4362 118 76 -146 C ATOM 2274 CD GLU A 276 27.491 29.999 -2.487 1.00 38.05 C ANISOU 2274 CD GLU A 276 4804 5016 4636 123 88 -141 C ATOM 2275 OE1 GLU A 276 27.398 30.479 -3.640 1.00 42.25 O ANISOU 2275 OE1 GLU A 276 5336 5566 5151 128 92 -141 O ATOM 2276 OE2 GLU A 276 28.574 29.953 -1.861 1.00 39.88 O ANISOU 2276 OE2 GLU A 276 5029 5254 4869 123 95 -139 O ATOM 0 H GLU A 276 26.572 29.310 2.091 1.00 28.14 H new ATOM 0 HA GLU A 276 27.177 31.026 0.206 1.00 29.62 H new ATOM 0 HB2 GLU A 276 27.146 28.679 -0.176 1.00 32.25 H new ATOM 0 HB3 GLU A 276 25.592 28.687 -0.047 1.00 32.25 H new ATOM 0 HG2 GLU A 276 25.996 28.611 -2.274 1.00 35.72 H new ATOM 0 HG3 GLU A 276 25.499 30.065 -2.004 1.00 35.72 H new ATOM 2277 N LYS A 277 24.107 31.019 1.082 1.00 27.03 N ANISOU 2277 N LYS A 277 3429 3538 3304 74 79 -110 N ATOM 2278 CA LYS A 277 22.844 31.771 0.989 1.00 26.34 C ANISOU 2278 CA LYS A 277 3346 3441 3220 64 77 -102 C ATOM 2279 C LYS A 277 22.861 33.136 1.696 1.00 24.94 C ANISOU 2279 C LYS A 277 3168 3265 3043 49 85 -85 C ATOM 2280 O LYS A 277 21.986 33.966 1.450 1.00 24.60 O ANISOU 2280 O LYS A 277 3129 3220 3000 42 84 -78 O ATOM 2281 CB LYS A 277 21.680 30.939 1.535 1.00 26.76 C ANISOU 2281 CB LYS A 277 3404 3469 3292 62 67 -108 C ATOM 2282 CG LYS A 277 21.273 29.778 0.642 1.00 27.81 C ANISOU 2282 CG LYS A 277 3539 3598 3428 74 56 -126 C ATOM 2283 CD LYS A 277 20.084 29.038 1.232 1.00 27.95 C ANISOU 2283 CD LYS A 277 3561 3590 3469 70 47 -129 C ATOM 2284 CE LYS A 277 19.693 27.834 0.392 1.00 29.12 C ANISOU 2284 CE LYS A 277 3710 3731 3624 82 33 -148 C ATOM 2285 NZ LYS A 277 18.470 27.171 0.921 1.00 29.89 N ANISOU 2285 NZ LYS A 277 3808 3801 3746 76 25 -149 N ATOM 0 H LYS A 277 24.098 30.377 1.654 1.00 27.03 H new ATOM 0 HA LYS A 277 22.727 31.950 0.043 1.00 26.34 H new ATOM 0 HB2 LYS A 277 21.924 30.593 2.408 1.00 26.76 H new ATOM 0 HB3 LYS A 277 20.913 31.519 1.664 1.00 26.76 H new ATOM 0 HG2 LYS A 277 21.049 30.107 -0.242 1.00 27.81 H new ATOM 0 HG3 LYS A 277 22.020 29.168 0.536 1.00 27.81 H new ATOM 0 HD2 LYS A 277 20.298 28.748 2.132 1.00 27.95 H new ATOM 0 HD3 LYS A 277 19.329 29.643 1.301 1.00 27.95 H new ATOM 0 HE2 LYS A 277 19.540 28.114 -0.524 1.00 29.12 H new ATOM 0 HE3 LYS A 277 20.425 27.198 0.376 1.00 29.12 H new ATOM 0 HZ1 LYS A 277 17.993 26.844 0.244 1.00 29.89 H new ATOM 0 HZ2 LYS A 277 18.704 26.508 1.467 1.00 29.89 H new ATOM 0 HZ3 LYS A 277 17.981 27.764 1.369 1.00 29.89 H new ATOM 2286 N ARG A 278 23.844 33.355 2.563 1.00 23.90 N ANISOU 2286 N ARG A 278 3032 3136 2913 47 91 -78 N ATOM 2287 CA ARG A 278 23.948 34.589 3.362 1.00 23.59 C ANISOU 2287 CA ARG A 278 2992 3096 2876 34 96 -63 C ATOM 2288 C ARG A 278 23.683 35.865 2.557 1.00 23.01 C ANISOU 2288 C ARG A 278 2918 3032 2793 26 99 -54 C ATOM 2289 O ARG A 278 22.885 36.710 2.958 1.00 22.97 O ANISOU 2289 O ARG A 278 2917 3018 2793 17 98 -45 O ATOM 2290 CB ARG A 278 25.339 34.668 3.997 1.00 22.95 C ANISOU 2290 CB ARG A 278 2903 3023 2793 35 102 -61 C ATOM 2291 CG ARG A 278 25.511 35.778 5.012 1.00 22.54 C ANISOU 2291 CG ARG A 278 2849 2967 2747 24 105 -48 C ATOM 2292 CD ARG A 278 26.948 35.843 5.482 1.00 22.47 C ANISOU 2292 CD ARG A 278 2832 2969 2737 26 109 -48 C ATOM 2293 NE ARG A 278 27.093 36.613 6.716 1.00 21.94 N ANISOU 2293 NE ARG A 278 2765 2895 2678 19 108 -40 N ATOM 2294 CZ ARG A 278 28.264 36.902 7.286 1.00 22.29 C ANISOU 2294 CZ ARG A 278 2800 2945 2723 19 110 -39 C ATOM 2295 NH1 ARG A 278 29.399 36.496 6.729 1.00 21.74 N ANISOU 2295 NH1 ARG A 278 2721 2891 2647 25 114 -45 N ATOM 2296 NH2 ARG A 278 28.304 37.603 8.417 1.00 22.00 N ANISOU 2296 NH2 ARG A 278 2764 2901 2695 15 107 -34 N ATOM 0 H ARG A 278 24.477 32.792 2.710 1.00 23.90 H new ATOM 0 HA ARG A 278 23.257 34.540 4.041 1.00 23.59 H new ATOM 0 HB2 ARG A 278 25.533 33.821 4.427 1.00 22.95 H new ATOM 0 HB3 ARG A 278 25.996 34.786 3.293 1.00 22.95 H new ATOM 0 HG2 ARG A 278 25.254 36.627 4.619 1.00 22.54 H new ATOM 0 HG3 ARG A 278 24.923 35.627 5.769 1.00 22.54 H new ATOM 0 HD2 ARG A 278 27.281 34.943 5.624 1.00 22.47 H new ATOM 0 HD3 ARG A 278 27.496 36.242 4.788 1.00 22.47 H new ATOM 0 HE ARG A 278 26.378 36.898 7.099 1.00 21.94 H new ATOM 0 HH11 ARG A 278 29.381 36.044 5.997 1.00 21.74 H new ATOM 0 HH12 ARG A 278 30.152 36.685 7.100 1.00 21.74 H new ATOM 0 HH21 ARG A 278 27.573 37.871 8.783 1.00 22.00 H new ATOM 0 HH22 ARG A 278 29.061 37.788 8.782 1.00 22.00 H new ATOM 2297 N SER A 279 24.354 35.997 1.417 1.00 23.26 N ANISOU 2297 N SER A 279 2945 3083 2809 31 104 -55 N ATOM 2298 CA SER A 279 24.250 37.203 0.595 1.00 23.49 C ANISOU 2298 CA SER A 279 2975 3123 2828 25 108 -44 C ATOM 2299 C SER A 279 22.860 37.435 0.008 1.00 23.71 C ANISOU 2299 C SER A 279 3011 3143 2855 24 101 -45 C ATOM 2300 O SER A 279 22.532 38.560 -0.365 1.00 24.05 O ANISOU 2300 O SER A 279 3057 3189 2893 17 103 -34 O ATOM 2301 CB SER A 279 25.267 37.155 -0.545 1.00 24.05 C ANISOU 2301 CB SER A 279 3039 3218 2881 32 115 -45 C ATOM 2302 OG SER A 279 24.989 36.069 -1.415 1.00 25.29 O ANISOU 2302 OG SER A 279 3198 3380 3030 47 110 -60 O ATOM 0 H SER A 279 24.879 35.395 1.098 1.00 23.26 H new ATOM 0 HA SER A 279 24.433 37.944 1.194 1.00 23.49 H new ATOM 0 HB2 SER A 279 25.244 37.988 -1.041 1.00 24.05 H new ATOM 0 HB3 SER A 279 26.162 37.065 -0.183 1.00 24.05 H new ATOM 2303 N THR A 280 22.054 36.379 -0.080 1.00 23.95 N ANISOU 2303 N THR A 280 3045 3163 2891 32 93 -59 N ATOM 2304 CA THR A 280 20.720 36.465 -0.671 1.00 24.34 C ANISOU 2304 CA THR A 280 3102 3205 2941 33 85 -63 C ATOM 2305 C THR A 280 19.642 36.874 0.334 1.00 23.88 C ANISOU 2305 C THR A 280 3047 3127 2898 23 81 -57 C ATOM 2306 O THR A 280 18.520 37.166 -0.058 1.00 24.70 O ANISOU 2306 O THR A 280 3156 3226 3004 21 75 -58 O ATOM 2307 CB THR A 280 20.290 35.121 -1.305 1.00 24.87 C ANISOU 2307 CB THR A 280 3171 3270 3010 46 76 -81 C ATOM 2308 OG1 THR A 280 20.022 34.164 -0.273 1.00 25.78 O ANISOU 2308 OG1 THR A 280 3286 3366 3143 45 71 -87 O ATOM 2309 CG2 THR A 280 21.374 34.589 -2.250 1.00 26.26 C ANISOU 2309 CG2 THR A 280 3343 3466 3169 59 79 -90 C ATOM 0 H THR A 280 22.265 35.594 0.201 1.00 23.95 H new ATOM 0 HA THR A 280 20.793 37.153 -1.350 1.00 24.34 H new ATOM 0 HB THR A 280 19.484 35.269 -1.824 1.00 24.87 H new ATOM 0 HG1 THR A 280 20.727 34.009 0.156 1.00 25.78 H new ATOM 0 HG21 THR A 280 21.083 33.747 -2.635 1.00 26.26 H new ATOM 0 HG22 THR A 280 21.529 35.232 -2.959 1.00 26.26 H new ATOM 0 HG23 THR A 280 22.196 34.450 -1.754 1.00 26.26 H new ATOM 2310 N LEU A 281 19.971 36.888 1.626 1.00 23.07 N ANISOU 2310 N LEU A 281 2943 3016 2807 17 84 -51 N ATOM 2311 CA LEU A 281 18.976 37.173 2.655 1.00 22.81 C ANISOU 2311 CA LEU A 281 2913 2967 2788 9 81 -46 C ATOM 2312 C LEU A 281 18.817 38.681 2.830 1.00 22.52 C ANISOU 2312 C LEU A 281 2878 2932 2748 0 83 -33 C ATOM 2313 O LEU A 281 19.796 39.424 2.688 1.00 22.86 O ANISOU 2313 O LEU A 281 2918 2985 2782 -3 88 -26 O ATOM 2314 CB LEU A 281 19.382 36.523 3.981 1.00 22.48 C ANISOU 2314 CB LEU A 281 2869 2916 2758 10 83 -46 C ATOM 2315 CG LEU A 281 19.621 35.007 3.944 1.00 23.14 C ANISOU 2315 CG LEU A 281 2951 2994 2846 19 81 -58 C ATOM 2316 CD1 LEU A 281 20.099 34.530 5.308 1.00 23.34 C ANISOU 2316 CD1 LEU A 281 2975 3010 2881 19 84 -54 C ATOM 2317 CD2 LEU A 281 18.386 34.229 3.511 1.00 22.89 C ANISOU 2317 CD2 LEU A 281 2923 2951 2825 21 72 -67 C ATOM 0 H LEU A 281 20.763 36.735 1.925 1.00 23.07 H new ATOM 0 HA LEU A 281 18.125 36.801 2.377 1.00 22.81 H new ATOM 0 HB2 LEU A 281 20.193 36.952 4.296 1.00 22.48 H new ATOM 0 HB3 LEU A 281 18.691 36.707 4.636 1.00 22.48 H new ATOM 0 HG LEU A 281 20.305 34.836 3.278 1.00 23.14 H new ATOM 0 HD11 LEU A 281 20.249 33.572 5.282 1.00 23.34 H new ATOM 0 HD12 LEU A 281 20.927 34.980 5.537 1.00 23.34 H new ATOM 0 HD13 LEU A 281 19.426 34.733 5.976 1.00 23.34 H new ATOM 0 HD21 LEU A 281 18.587 33.280 3.504 1.00 22.89 H new ATOM 0 HD22 LEU A 281 17.661 34.401 4.132 1.00 22.89 H new ATOM 0 HD23 LEU A 281 18.122 34.510 2.621 1.00 22.89 H new ATOM 2318 N PRO A 282 17.583 39.146 3.125 1.00 22.37 N ANISOU 2318 N PRO A 282 2863 2902 2736 -4 78 -31 N ATOM 2319 CA PRO A 282 17.338 40.582 3.306 1.00 21.98 C ANISOU 2319 CA PRO A 282 2817 2853 2684 -12 78 -20 C ATOM 2320 C PRO A 282 17.696 41.090 4.710 1.00 21.58 C ANISOU 2320 C PRO A 282 2764 2795 2641 -17 80 -13 C ATOM 2321 O PRO A 282 17.578 42.282 4.976 1.00 21.82 O ANISOU 2321 O PRO A 282 2796 2823 2670 -22 78 -4 O ATOM 2322 CB PRO A 282 15.835 40.708 3.054 1.00 22.13 C ANISOU 2322 CB PRO A 282 2839 2863 2707 -11 70 -23 C ATOM 2323 CG PRO A 282 15.286 39.405 3.512 1.00 22.20 C ANISOU 2323 CG PRO A 282 2846 2862 2728 -7 68 -33 C ATOM 2324 CD PRO A 282 16.328 38.369 3.195 1.00 22.25 C ANISOU 2324 CD PRO A 282 2848 2874 2730 -1 72 -39 C ATOM 0 HA PRO A 282 17.889 41.117 2.713 1.00 21.98 H new ATOM 0 HB2 PRO A 282 15.452 41.449 3.549 1.00 22.13 H new ATOM 0 HB3 PRO A 282 15.644 40.865 2.116 1.00 22.13 H new ATOM 0 HG2 PRO A 282 15.097 39.425 4.463 1.00 22.20 H new ATOM 0 HG3 PRO A 282 14.451 39.204 3.061 1.00 22.20 H new ATOM 0 HD2 PRO A 282 16.370 37.684 3.881 1.00 22.25 H new ATOM 0 HD3 PRO A 282 16.140 37.919 2.356 1.00 22.25 H new ATOM 2325 N TYR A 283 18.137 40.182 5.578 1.00 21.18 N ANISOU 2325 N TYR A 283 2711 2741 2597 -13 82 -16 N ATOM 2326 CA TYR A 283 18.584 40.511 6.928 1.00 21.25 C ANISOU 2326 CA TYR A 283 2718 2745 2612 -15 84 -11 C ATOM 2327 C TYR A 283 19.991 39.948 7.131 1.00 21.20 C ANISOU 2327 C TYR A 283 2706 2745 2603 -11 89 -13 C ATOM 2328 O TYR A 283 20.372 38.961 6.495 1.00 20.72 O ANISOU 2328 O TYR A 283 2644 2690 2540 -6 90 -20 O ATOM 2329 CB TYR A 283 17.628 39.921 7.962 1.00 21.34 C ANISOU 2329 CB TYR A 283 2731 2744 2634 -12 83 -12 C ATOM 2330 CG TYR A 283 17.345 38.451 7.739 1.00 21.43 C ANISOU 2330 CG TYR A 283 2741 2750 2650 -6 83 -20 C ATOM 2331 CD1 TYR A 283 16.246 38.040 6.993 1.00 21.47 C ANISOU 2331 CD1 TYR A 283 2747 2751 2659 -6 79 -25 C ATOM 2332 CD2 TYR A 283 18.187 37.476 8.256 1.00 21.63 C ANISOU 2332 CD2 TYR A 283 2764 2775 2678 -1 87 -23 C ATOM 2333 CE1 TYR A 283 15.989 36.700 6.772 1.00 21.49 C ANISOU 2333 CE1 TYR A 283 2749 2748 2669 -2 78 -33 C ATOM 2334 CE2 TYR A 283 17.943 36.135 8.042 1.00 21.14 C ANISOU 2334 CE2 TYR A 283 2702 2707 2622 4 86 -30 C ATOM 2335 CZ TYR A 283 16.843 35.749 7.296 1.00 21.74 C ANISOU 2335 CZ TYR A 283 2779 2777 2704 3 81 -35 C ATOM 2336 OH TYR A 283 16.612 34.411 7.093 1.00 21.87 O ANISOU 2336 OH TYR A 283 2795 2785 2730 7 78 -43 O ATOM 0 H TYR A 283 18.185 39.343 5.395 1.00 21.18 H new ATOM 0 HA TYR A 283 18.596 41.474 7.041 1.00 21.25 H new ATOM 0 HB2 TYR A 283 18.004 40.042 8.848 1.00 21.34 H new ATOM 0 HB3 TYR A 283 16.792 40.413 7.939 1.00 21.34 H new ATOM 0 HD1 TYR A 283 15.673 38.679 6.636 1.00 21.47 H new ATOM 0 HD2 TYR A 283 18.929 37.731 8.756 1.00 21.63 H new ATOM 0 HE1 TYR A 283 15.247 36.441 6.275 1.00 21.49 H new ATOM 0 HE2 TYR A 283 18.515 35.494 8.397 1.00 21.14 H new ATOM 0 HH TYR A 283 15.983 34.315 6.545 1.00 21.87 H new ATOM 2337 N GLU A 284 20.753 40.570 8.025 1.00 21.07 N ANISOU 2337 N GLU A 284 2687 2729 2588 -13 89 -8 N ATOM 2338 CA GLU A 284 22.116 40.137 8.309 1.00 21.88 C ANISOU 2338 CA GLU A 284 2785 2840 2691 -10 93 -11 C ATOM 2339 C GLU A 284 22.148 38.970 9.294 1.00 21.44 C ANISOU 2339 C GLU A 284 2730 2776 2640 -1 93 -16 C ATOM 2340 O GLU A 284 21.351 38.909 10.235 1.00 20.67 O ANISOU 2340 O GLU A 284 2636 2668 2548 0 92 -13 O ATOM 2341 CB GLU A 284 22.943 41.292 8.879 1.00 22.67 C ANISOU 2341 CB GLU A 284 2881 2942 2792 -15 92 -4 C ATOM 2342 CG GLU A 284 23.074 42.485 7.947 1.00 23.41 C ANISOU 2342 CG GLU A 284 2973 3042 2881 -25 92 3 C ATOM 2343 CD GLU A 284 24.073 43.503 8.454 1.00 24.15 C ANISOU 2343 CD GLU A 284 3061 3137 2979 -31 90 8 C ATOM 2344 OE1 GLU A 284 24.983 43.860 7.682 1.00 26.14 O ANISOU 2344 OE1 GLU A 284 3305 3399 3227 -37 95 13 O ATOM 2345 OE2 GLU A 284 23.967 43.934 9.622 1.00 24.41 O ANISOU 2345 OE2 GLU A 284 3095 3161 3018 -30 85 8 O ATOM 0 H GLU A 284 20.496 41.252 8.482 1.00 21.07 H new ATOM 0 HA GLU A 284 22.498 39.843 7.467 1.00 21.88 H new ATOM 0 HB2 GLU A 284 22.538 41.587 9.710 1.00 22.67 H new ATOM 0 HB3 GLU A 284 23.830 40.965 9.096 1.00 22.67 H new ATOM 0 HG2 GLU A 284 23.346 42.178 7.068 1.00 23.41 H new ATOM 0 HG3 GLU A 284 22.208 42.909 7.844 1.00 23.41 H new ATOM 2346 N ILE A 285 23.080 38.050 9.070 1.00 21.43 N ANISOU 2346 N ILE A 285 2725 2782 2637 5 96 -22 N ATOM 2347 CA ILE A 285 23.373 36.996 10.040 1.00 21.54 C ANISOU 2347 CA ILE A 285 2740 2790 2656 14 96 -26 C ATOM 2348 C ILE A 285 24.863 37.022 10.365 1.00 21.99 C ANISOU 2348 C ILE A 285 2790 2856 2710 17 97 -28 C ATOM 2349 O ILE A 285 25.670 37.410 9.529 1.00 22.01 O ANISOU 2349 O ILE A 285 2785 2870 2706 14 100 -29 O ATOM 2350 CB ILE A 285 22.939 35.605 9.524 1.00 21.44 C ANISOU 2350 CB ILE A 285 2730 2772 2646 20 96 -33 C ATOM 2351 CG1 ILE A 285 23.781 35.164 8.317 1.00 21.64 C ANISOU 2351 CG1 ILE A 285 2750 2809 2663 23 97 -41 C ATOM 2352 CG2 ILE A 285 21.461 35.640 9.160 1.00 20.88 C ANISOU 2352 CG2 ILE A 285 2663 2692 2580 15 93 -31 C ATOM 2353 CD1 ILE A 285 23.392 33.808 7.760 1.00 21.86 C ANISOU 2353 CD1 ILE A 285 2780 2831 2694 31 94 -51 C ATOM 0 H ILE A 285 23.559 38.017 8.356 1.00 21.43 H new ATOM 0 HA ILE A 285 22.862 37.163 10.848 1.00 21.54 H new ATOM 0 HB ILE A 285 23.084 34.956 10.230 1.00 21.44 H new ATOM 0 HG12 ILE A 285 23.697 35.828 7.615 1.00 21.64 H new ATOM 0 HG13 ILE A 285 24.715 35.142 8.576 1.00 21.64 H new ATOM 0 HG21 ILE A 285 21.187 34.768 8.836 1.00 20.88 H new ATOM 0 HG22 ILE A 285 20.940 35.872 9.945 1.00 20.88 H new ATOM 0 HG23 ILE A 285 21.314 36.303 8.467 1.00 20.88 H new ATOM 0 HD11 ILE A 285 23.961 33.593 7.004 1.00 21.86 H new ATOM 0 HD12 ILE A 285 23.500 33.132 8.448 1.00 21.86 H new ATOM 0 HD13 ILE A 285 22.466 33.830 7.472 1.00 21.86 H new ATOM 2354 N ASP A 286 25.233 36.646 11.585 1.00 23.26 N ANISOU 2354 N ASP A 286 2951 3011 2874 24 96 -29 N ATOM 2355 CA ASP A 286 26.655 36.592 11.930 1.00 24.17 C ANISOU 2355 CA ASP A 286 3060 3136 2988 29 96 -33 C ATOM 2356 C ASP A 286 27.137 35.148 12.084 1.00 23.66 C ANISOU 2356 C ASP A 286 2997 3071 2924 41 97 -41 C ATOM 2357 O ASP A 286 28.300 34.909 12.407 1.00 22.05 O ANISOU 2357 O ASP A 286 2787 2873 2718 48 96 -46 O ATOM 2358 CB ASP A 286 26.978 37.432 13.174 1.00 26.21 C ANISOU 2358 CB ASP A 286 3317 3392 3249 30 93 -30 C ATOM 2359 CG ASP A 286 26.271 36.950 14.414 1.00 27.13 C ANISOU 2359 CG ASP A 286 3442 3496 3368 38 91 -27 C ATOM 2360 OD1 ASP A 286 26.885 36.990 15.506 1.00 30.08 O ANISOU 2360 OD1 ASP A 286 3817 3871 3743 47 88 -28 O ATOM 2361 OD2 ASP A 286 25.102 36.536 14.310 1.00 29.26 O ANISOU 2361 OD2 ASP A 286 3719 3758 3640 38 93 -24 O ATOM 0 H ASP A 286 24.693 36.422 12.216 1.00 23.26 H new ATOM 0 HA ASP A 286 27.143 36.986 11.190 1.00 24.17 H new ATOM 0 HB2 ASP A 286 27.936 37.417 13.328 1.00 26.21 H new ATOM 0 HB3 ASP A 286 26.732 38.355 13.007 1.00 26.21 H new ATOM 2362 N GLY A 287 26.243 34.194 11.829 1.00 22.67 N ANISOU 2362 N GLY A 287 2877 2935 2801 44 97 -42 N ATOM 2363 CA GLY A 287 26.587 32.784 11.926 1.00 22.90 C ANISOU 2363 CA GLY A 287 2909 2961 2833 55 95 -49 C ATOM 2364 C GLY A 287 25.394 31.859 12.053 1.00 22.71 C ANISOU 2364 C GLY A 287 2893 2920 2816 57 94 -47 C ATOM 2365 O GLY A 287 24.298 32.173 11.587 1.00 21.70 O ANISOU 2365 O GLY A 287 2767 2787 2692 49 94 -44 O ATOM 0 H GLY A 287 25.429 34.347 11.597 1.00 22.67 H new ATOM 0 HA2 GLY A 287 27.097 32.531 11.140 1.00 22.90 H new ATOM 0 HA3 GLY A 287 27.166 32.655 12.693 1.00 22.90 H new ATOM 2366 N ILE A 288 25.633 30.713 12.689 1.00 22.64 N ANISOU 2366 N ILE A 288 2887 2901 2812 67 93 -50 N ATOM 2367 CA ILE A 288 24.666 29.625 12.805 1.00 22.87 C ANISOU 2367 CA ILE A 288 2924 2914 2852 69 91 -48 C ATOM 2368 C ILE A 288 24.603 29.178 14.251 1.00 22.91 C ANISOU 2368 C ILE A 288 2934 2908 2861 76 93 -39 C ATOM 2369 O ILE A 288 25.644 28.966 14.881 1.00 23.02 O ANISOU 2369 O ILE A 288 2949 2927 2871 86 92 -41 O ATOM 2370 CB ILE A 288 25.105 28.400 11.960 1.00 23.00 C ANISOU 2370 CB ILE A 288 2940 2928 2870 77 86 -60 C ATOM 2371 CG1 ILE A 288 25.283 28.782 10.486 1.00 23.39 C ANISOU 2371 CG1 ILE A 288 2984 2992 2912 73 85 -70 C ATOM 2372 CG2 ILE A 288 24.124 27.243 12.113 1.00 23.31 C ANISOU 2372 CG2 ILE A 288 2986 2947 2924 78 83 -58 C ATOM 2373 CD1 ILE A 288 24.033 29.310 9.827 1.00 22.98 C ANISOU 2373 CD1 ILE A 288 2932 2935 2863 63 85 -67 C ATOM 0 H ILE A 288 26.383 30.544 13.075 1.00 22.64 H new ATOM 0 HA ILE A 288 23.807 29.948 12.491 1.00 22.87 H new ATOM 0 HB ILE A 288 25.965 28.103 12.296 1.00 23.00 H new ATOM 0 HG12 ILE A 288 25.980 29.453 10.419 1.00 23.39 H new ATOM 0 HG13 ILE A 288 25.590 28.004 9.996 1.00 23.39 H new ATOM 0 HG21 ILE A 288 24.422 26.493 11.575 1.00 23.31 H new ATOM 0 HG22 ILE A 288 24.081 26.976 13.045 1.00 23.31 H new ATOM 0 HG23 ILE A 288 23.244 27.523 11.816 1.00 23.31 H new ATOM 0 HD11 ILE A 288 24.223 29.529 8.901 1.00 22.98 H new ATOM 0 HD12 ILE A 288 23.338 28.634 9.863 1.00 22.98 H new ATOM 0 HD13 ILE A 288 23.733 30.107 10.292 1.00 22.98 H new ATOM 2374 N VAL A 289 23.393 29.009 14.781 1.00 22.61 N ANISOU 2374 N VAL A 289 2901 2856 2832 72 95 -29 N ATOM 2375 CA VAL A 289 23.237 28.484 16.133 1.00 22.92 C ANISOU 2375 CA VAL A 289 2947 2886 2875 80 98 -18 C ATOM 2376 C VAL A 289 22.839 27.014 16.047 1.00 22.99 C ANISOU 2376 C VAL A 289 2960 2877 2897 83 97 -17 C ATOM 2377 O VAL A 289 21.951 26.648 15.280 1.00 23.55 O ANISOU 2377 O VAL A 289 3030 2940 2979 76 95 -19 O ATOM 2378 CB VAL A 289 22.203 29.288 16.941 1.00 23.06 C ANISOU 2378 CB VAL A 289 2966 2902 2893 75 104 -5 C ATOM 2379 CG1 VAL A 289 22.130 28.773 18.364 1.00 24.37 C ANISOU 2379 CG1 VAL A 289 3139 3061 3060 85 108 7 C ATOM 2380 CG2 VAL A 289 22.584 30.762 16.963 1.00 23.72 C ANISOU 2380 CG2 VAL A 289 3046 3001 2967 71 103 -7 C ATOM 0 H VAL A 289 22.656 29.191 14.377 1.00 22.61 H new ATOM 0 HA VAL A 289 24.082 28.567 16.602 1.00 22.92 H new ATOM 0 HB VAL A 289 21.337 29.183 16.516 1.00 23.06 H new ATOM 0 HG11 VAL A 289 21.475 29.288 18.861 1.00 24.37 H new ATOM 0 HG12 VAL A 289 21.869 27.839 18.357 1.00 24.37 H new ATOM 0 HG13 VAL A 289 22.999 28.862 18.786 1.00 24.37 H new ATOM 0 HG21 VAL A 289 21.926 31.259 17.474 1.00 23.72 H new ATOM 0 HG22 VAL A 289 23.457 30.865 17.373 1.00 23.72 H new ATOM 0 HG23 VAL A 289 22.612 31.103 16.055 1.00 23.72 H new ATOM 2381 N ILE A 290 23.542 26.184 16.814 1.00 23.42 N ANISOU 2381 N ILE A 290 3020 2927 2952 96 96 -16 N ATOM 2382 CA ILE A 290 23.354 24.740 16.822 1.00 23.27 C ANISOU 2382 CA ILE A 290 3006 2890 2946 101 93 -15 C ATOM 2383 C ILE A 290 22.945 24.376 18.238 1.00 22.89 C ANISOU 2383 C ILE A 290 2965 2831 2901 106 99 3 C ATOM 2384 O ILE A 290 23.714 24.592 19.168 1.00 22.58 O ANISOU 2384 O ILE A 290 2929 2799 2851 117 101 6 O ATOM 2385 CB ILE A 290 24.666 24.003 16.466 1.00 24.47 C ANISOU 2385 CB ILE A 290 3159 3045 3094 113 85 -29 C ATOM 2386 CG1 ILE A 290 25.204 24.455 15.103 1.00 24.86 C ANISOU 2386 CG1 ILE A 290 3200 3110 3135 109 81 -46 C ATOM 2387 CG2 ILE A 290 24.457 22.492 16.465 1.00 25.10 C ANISOU 2387 CG2 ILE A 290 3246 3104 3188 119 80 -29 C ATOM 2388 CD1 ILE A 290 26.686 24.209 14.925 1.00 26.49 C ANISOU 2388 CD1 ILE A 290 3405 3329 3332 122 77 -59 C ATOM 0 H ILE A 290 24.154 26.453 17.355 1.00 23.42 H new ATOM 0 HA ILE A 290 22.688 24.481 16.166 1.00 23.27 H new ATOM 0 HB ILE A 290 25.320 24.229 17.146 1.00 24.47 H new ATOM 0 HG12 ILE A 290 24.720 23.990 14.402 1.00 24.86 H new ATOM 0 HG13 ILE A 290 25.025 25.402 14.991 1.00 24.86 H new ATOM 0 HG21 ILE A 290 25.291 22.050 16.240 1.00 25.10 H new ATOM 0 HG22 ILE A 290 24.167 22.205 17.345 1.00 25.10 H new ATOM 0 HG23 ILE A 290 23.781 22.259 15.810 1.00 25.10 H new ATOM 0 HD11 ILE A 290 26.962 24.515 14.047 1.00 26.49 H new ATOM 0 HD12 ILE A 290 27.179 24.694 15.606 1.00 26.49 H new ATOM 0 HD13 ILE A 290 26.869 23.260 15.008 1.00 26.49 H new ATOM 2389 N LYS A 291 21.738 23.841 18.396 1.00 22.58 N ANISOU 2389 N LYS A 291 2927 2775 2876 99 103 15 N ATOM 2390 CA LYS A 291 21.187 23.519 19.711 1.00 23.52 C ANISOU 2390 CA LYS A 291 3053 2885 3000 103 111 36 C ATOM 2391 C LYS A 291 20.784 22.052 19.764 1.00 22.65 C ANISOU 2391 C LYS A 291 2947 2750 2908 104 110 43 C ATOM 2392 O LYS A 291 20.146 21.563 18.839 1.00 22.29 O ANISOU 2392 O LYS A 291 2898 2693 2879 94 105 37 O ATOM 2393 CB LYS A 291 19.940 24.362 19.969 1.00 24.76 C ANISOU 2393 CB LYS A 291 3204 3044 3157 93 120 47 C ATOM 2394 CG LYS A 291 20.191 25.860 20.032 1.00 25.69 C ANISOU 2394 CG LYS A 291 3319 3183 3259 92 121 42 C ATOM 2395 CD LYS A 291 18.876 26.624 20.042 1.00 27.03 C ANISOU 2395 CD LYS A 291 3484 3355 3432 81 127 51 C ATOM 2396 CE LYS A 291 19.075 28.092 19.699 1.00 28.03 C ANISOU 2396 CE LYS A 291 3607 3499 3546 77 124 42 C ATOM 2397 NZ LYS A 291 17.778 28.822 19.576 1.00 29.60 N ANISOU 2397 NZ LYS A 291 3800 3698 3748 67 128 48 N ATOM 0 H LYS A 291 21.213 23.653 17.741 1.00 22.58 H new ATOM 0 HA LYS A 291 21.864 23.703 20.380 1.00 23.52 H new ATOM 0 HB2 LYS A 291 19.293 24.184 19.269 1.00 24.76 H new ATOM 0 HB3 LYS A 291 19.539 24.078 20.805 1.00 24.76 H new ATOM 0 HG2 LYS A 291 20.701 26.074 20.829 1.00 25.69 H new ATOM 0 HG3 LYS A 291 20.725 26.136 19.271 1.00 25.69 H new ATOM 0 HD2 LYS A 291 18.264 26.223 19.405 1.00 27.03 H new ATOM 0 HD3 LYS A 291 18.465 26.549 20.917 1.00 27.03 H new ATOM 0 HE2 LYS A 291 19.617 28.512 20.385 1.00 28.03 H new ATOM 0 HE3 LYS A 291 19.566 28.164 18.865 1.00 28.03 H new ATOM 0 HZ1 LYS A 291 17.927 29.642 19.263 1.00 29.60 H new ATOM 0 HZ2 LYS A 291 17.243 28.384 19.016 1.00 29.60 H new ATOM 0 HZ3 LYS A 291 17.390 28.876 20.375 1.00 29.60 H new ATOM 2398 N VAL A 292 21.132 21.358 20.847 1.00 23.03 N ANISOU 2398 N VAL A 292 3004 2792 2956 116 113 55 N ATOM 2399 CA VAL A 292 20.567 20.028 21.094 1.00 23.35 C ANISOU 2399 CA VAL A 292 3050 2807 3017 115 114 68 C ATOM 2400 C VAL A 292 19.046 20.168 21.063 1.00 23.88 C ANISOU 2400 C VAL A 292 3110 2865 3099 99 122 82 C ATOM 2401 O VAL A 292 18.487 21.012 21.759 1.00 23.00 O ANISOU 2401 O VAL A 292 2996 2765 2979 97 132 95 O ATOM 2402 CB VAL A 292 21.021 19.456 22.451 1.00 23.46 C ANISOU 2402 CB VAL A 292 3074 2815 3024 131 119 85 C ATOM 2403 CG1 VAL A 292 20.258 18.180 22.793 1.00 24.02 C ANISOU 2403 CG1 VAL A 292 3149 2859 3118 127 122 103 C ATOM 2404 CG2 VAL A 292 22.523 19.210 22.437 1.00 23.61 C ANISOU 2404 CG2 VAL A 292 3099 2842 3031 147 110 69 C ATOM 0 H VAL A 292 21.686 21.633 21.445 1.00 23.03 H new ATOM 0 HA VAL A 292 20.877 19.410 20.413 1.00 23.35 H new ATOM 0 HB VAL A 292 20.822 20.107 23.142 1.00 23.46 H new ATOM 0 HG11 VAL A 292 20.562 17.841 23.650 1.00 24.02 H new ATOM 0 HG12 VAL A 292 19.309 18.373 22.840 1.00 24.02 H new ATOM 0 HG13 VAL A 292 20.418 17.513 22.107 1.00 24.02 H new ATOM 0 HG21 VAL A 292 22.800 18.850 23.294 1.00 23.61 H new ATOM 0 HG22 VAL A 292 22.741 18.577 21.735 1.00 23.61 H new ATOM 0 HG23 VAL A 292 22.987 20.046 22.273 1.00 23.61 H new ATOM 2405 N ASN A 293 18.377 19.370 20.233 1.00 24.35 N ANISOU 2405 N ASN A 293 3165 2905 3181 88 116 78 N ATOM 2406 CA ASN A 293 16.940 19.554 20.004 1.00 24.67 C ANISOU 2406 CA ASN A 293 3197 2938 3238 72 121 87 C ATOM 2407 C ASN A 293 16.062 19.217 21.215 1.00 25.73 C ANISOU 2407 C ASN A 293 3332 3063 3382 70 136 117 C ATOM 2408 O ASN A 293 15.182 19.988 21.576 1.00 24.65 O ANISOU 2408 O ASN A 293 3188 2935 3242 63 146 128 O ATOM 2409 CB ASN A 293 16.476 18.738 18.795 1.00 25.56 C ANISOU 2409 CB ASN A 293 3305 3032 3375 61 109 74 C ATOM 2410 CG ASN A 293 15.091 19.141 18.311 1.00 25.82 C ANISOU 2410 CG ASN A 293 3326 3062 3423 45 111 77 C ATOM 2411 OD1 ASN A 293 14.769 20.331 18.221 1.00 24.83 O ANISOU 2411 OD1 ASN A 293 3195 2955 3283 41 116 75 O ATOM 2412 ND2 ASN A 293 14.263 18.145 17.978 1.00 25.44 N ANISOU 2412 ND2 ASN A 293 3274 2989 3404 35 106 80 N ATOM 0 H ASN A 293 18.731 18.720 19.795 1.00 24.35 H new ATOM 0 HA ASN A 293 16.828 20.503 19.835 1.00 24.67 H new ATOM 0 HB2 ASN A 293 17.112 18.849 18.071 1.00 25.56 H new ATOM 0 HB3 ASN A 293 16.472 17.796 19.027 1.00 25.56 H new ATOM 0 HD21 ASN A 293 13.473 18.321 17.688 1.00 25.44 H new ATOM 0 HD22 ASN A 293 14.521 17.328 18.053 1.00 25.44 H new ATOM 2413 N GLU A 294 16.306 18.064 21.829 1.00 27.32 N ANISOU 2413 N GLU A 294 3541 3245 3594 76 136 130 N ATOM 2414 CA GLU A 294 15.458 17.559 22.915 1.00 29.16 C ANISOU 2414 CA GLU A 294 3775 3466 3838 74 151 160 C ATOM 2415 C GLU A 294 15.660 18.346 24.215 1.00 29.03 C ANISOU 2415 C GLU A 294 3763 3470 3796 87 165 176 C ATOM 2416 O GLU A 294 16.778 18.447 24.717 1.00 28.07 O ANISOU 2416 O GLU A 294 3651 3359 3654 104 163 172 O ATOM 2417 CB GLU A 294 15.749 16.068 23.157 1.00 31.11 C ANISOU 2417 CB GLU A 294 4031 3686 4104 78 146 169 C ATOM 2418 CG GLU A 294 15.429 15.161 21.976 1.00 33.07 C ANISOU 2418 CG GLU A 294 4274 3910 4382 66 131 155 C ATOM 2419 CD GLU A 294 13.946 14.886 21.802 1.00 34.77 C ANISOU 2419 CD GLU A 294 4478 4109 4626 47 136 168 C ATOM 2420 OE1 GLU A 294 13.176 15.090 22.763 1.00 38.09 O ANISOU 2420 OE1 GLU A 294 4895 4531 5048 43 154 195 O ATOM 2421 OE2 GLU A 294 13.547 14.450 20.702 1.00 36.90 O ANISOU 2421 OE2 GLU A 294 4740 4363 4918 36 122 152 O ATOM 0 H GLU A 294 16.966 17.550 21.631 1.00 27.32 H new ATOM 0 HA GLU A 294 14.534 17.674 22.642 1.00 29.16 H new ATOM 0 HB2 GLU A 294 16.687 15.966 23.384 1.00 31.11 H new ATOM 0 HB3 GLU A 294 15.237 15.771 23.926 1.00 31.11 H new ATOM 0 HG2 GLU A 294 15.772 15.567 21.164 1.00 33.07 H new ATOM 0 HG3 GLU A 294 15.895 14.318 22.090 1.00 33.07 H new ATOM 2422 N PHE A 295 14.580 18.908 24.756 1.00 29.55 N ANISOU 2422 N PHE A 295 3821 3543 3862 80 179 194 N ATOM 2423 CA PHE A 295 14.662 19.654 26.016 1.00 30.15 C ANISOU 2423 CA PHE A 295 3902 3639 3913 94 192 209 C ATOM 2424 C PHE A 295 15.162 18.783 27.164 1.00 30.58 C ANISOU 2424 C PHE A 295 3969 3686 3963 110 199 230 C ATOM 2425 O PHE A 295 15.884 19.268 28.031 1.00 30.38 O ANISOU 2425 O PHE A 295 3952 3678 3912 129 202 232 O ATOM 2426 CB PHE A 295 13.308 20.267 26.412 1.00 30.68 C ANISOU 2426 CB PHE A 295 3958 3714 3983 85 207 226 C ATOM 2427 CG PHE A 295 12.884 21.456 25.579 1.00 31.12 C ANISOU 2427 CG PHE A 295 4004 3786 4035 75 202 207 C ATOM 2428 CD1 PHE A 295 13.779 22.144 24.756 1.00 31.25 C ANISOU 2428 CD1 PHE A 295 4022 3813 4038 77 188 180 C ATOM 2429 CD2 PHE A 295 11.577 21.920 25.665 1.00 31.55 C ANISOU 2429 CD2 PHE A 295 4047 3844 4097 64 212 218 C ATOM 2430 CE1 PHE A 295 13.364 23.241 24.017 1.00 30.87 C ANISOU 2430 CE1 PHE A 295 3966 3778 3986 68 184 165 C ATOM 2431 CE2 PHE A 295 11.160 23.020 24.928 1.00 31.36 C ANISOU 2431 CE2 PHE A 295 4013 3833 4068 56 207 201 C ATOM 2432 CZ PHE A 295 12.054 23.679 24.102 1.00 31.11 C ANISOU 2432 CZ PHE A 295 3985 3811 4024 58 193 175 C ATOM 0 H PHE A 295 13.792 18.870 24.412 1.00 29.55 H new ATOM 0 HA PHE A 295 15.300 20.368 25.858 1.00 30.15 H new ATOM 0 HB2 PHE A 295 12.625 19.581 26.346 1.00 30.68 H new ATOM 0 HB3 PHE A 295 13.349 20.538 27.343 1.00 30.68 H new ATOM 0 HD1 PHE A 295 14.664 21.863 24.703 1.00 31.25 H new ATOM 0 HD2 PHE A 295 10.973 21.487 26.224 1.00 31.55 H new ATOM 0 HE1 PHE A 295 13.967 23.683 23.464 1.00 30.87 H new ATOM 0 HE2 PHE A 295 10.280 23.314 24.989 1.00 31.36 H new ATOM 0 HZ PHE A 295 11.775 24.414 23.605 1.00 31.11 H new ATOM 2433 N ALA A 296 14.772 17.510 27.173 1.00 31.66 N ANISOU 2433 N ALA A 296 4107 3797 4125 103 201 245 N ATOM 2434 CA ALA A 296 15.233 16.576 28.204 1.00 32.55 C ANISOU 2434 CA ALA A 296 4233 3899 4236 118 207 266 C ATOM 2435 C ALA A 296 16.757 16.532 28.232 1.00 32.52 C ANISOU 2435 C ALA A 296 4243 3902 4213 137 194 247 C ATOM 2436 O ALA A 296 17.372 16.530 29.301 1.00 33.64 O ANISOU 2436 O ALA A 296 4396 4053 4334 157 199 259 O ATOM 2437 CB ALA A 296 14.677 15.184 27.952 1.00 33.71 C ANISOU 2437 CB ALA A 296 4379 4012 4417 106 206 281 C ATOM 0 H ALA A 296 14.240 17.165 26.591 1.00 31.66 H new ATOM 0 HA ALA A 296 14.910 16.887 29.064 1.00 32.55 H new ATOM 0 HB1 ALA A 296 14.992 14.580 28.643 1.00 33.71 H new ATOM 0 HB2 ALA A 296 13.708 15.215 27.967 1.00 33.71 H new ATOM 0 HB3 ALA A 296 14.976 14.868 27.085 1.00 33.71 H new ATOM 2438 N LEU A 297 17.359 16.515 27.047 1.00 32.44 N ANISOU 2438 N LEU A 297 4229 3888 4207 132 177 219 N ATOM 2439 CA LEU A 297 18.809 16.444 26.924 1.00 31.30 C ANISOU 2439 CA LEU A 297 4095 3751 4047 148 163 199 C ATOM 2440 C LEU A 297 19.457 17.795 27.228 1.00 30.62 C ANISOU 2440 C LEU A 297 4008 3695 3931 159 164 186 C ATOM 2441 O LEU A 297 20.524 17.847 27.835 1.00 29.76 O ANISOU 2441 O LEU A 297 3908 3596 3803 179 160 181 O ATOM 2442 CB LEU A 297 19.196 15.926 25.538 1.00 31.55 C ANISOU 2442 CB LEU A 297 4123 3769 4095 140 146 173 C ATOM 2443 CG LEU A 297 18.636 14.536 25.206 1.00 31.85 C ANISOU 2443 CG LEU A 297 4162 3773 4165 130 142 183 C ATOM 2444 CD1 LEU A 297 19.000 14.108 23.793 1.00 31.21 C ANISOU 2444 CD1 LEU A 297 4078 3683 4099 124 123 154 C ATOM 2445 CD2 LEU A 297 19.116 13.501 26.216 1.00 31.94 C ANISOU 2445 CD2 LEU A 297 4188 3770 4178 146 144 202 C ATOM 0 H LEU A 297 16.941 16.544 26.296 1.00 32.44 H new ATOM 0 HA LEU A 297 19.146 15.816 27.583 1.00 31.30 H new ATOM 0 HB2 LEU A 297 18.885 16.557 24.870 1.00 31.55 H new ATOM 0 HB3 LEU A 297 20.163 15.898 25.473 1.00 31.55 H new ATOM 0 HG LEU A 297 17.669 14.594 25.259 1.00 31.85 H new ATOM 0 HD11 LEU A 297 18.632 13.228 23.616 1.00 31.21 H new ATOM 0 HD12 LEU A 297 18.635 14.744 23.158 1.00 31.21 H new ATOM 0 HD13 LEU A 297 19.965 14.078 23.702 1.00 31.21 H new ATOM 0 HD21 LEU A 297 18.751 12.632 25.987 1.00 31.94 H new ATOM 0 HD22 LEU A 297 20.085 13.458 26.200 1.00 31.94 H new ATOM 0 HD23 LEU A 297 18.818 13.753 27.104 1.00 31.94 H new ATOM 2446 N GLN A 298 18.807 18.887 26.828 1.00 29.62 N ANISOU 2446 N GLN A 298 3870 3583 3801 148 167 180 N ATOM 2447 CA GLN A 298 19.265 20.221 27.223 1.00 29.85 C ANISOU 2447 CA GLN A 298 3898 3640 3803 157 168 171 C ATOM 2448 C GLN A 298 19.346 20.347 28.748 1.00 30.77 C ANISOU 2448 C GLN A 298 4023 3766 3901 176 179 191 C ATOM 2449 O GLN A 298 20.322 20.873 29.273 1.00 29.65 O ANISOU 2449 O GLN A 298 3887 3640 3737 193 175 182 O ATOM 2450 CB GLN A 298 18.336 21.312 26.686 1.00 29.51 C ANISOU 2450 CB GLN A 298 3843 3608 3762 141 172 166 C ATOM 2451 CG GLN A 298 18.394 21.551 25.189 1.00 28.35 C ANISOU 2451 CG GLN A 298 3687 3459 3625 126 160 142 C ATOM 2452 CD GLN A 298 17.540 22.740 24.770 1.00 28.56 C ANISOU 2452 CD GLN A 298 3703 3498 3649 114 163 138 C ATOM 2453 OE1 GLN A 298 17.126 23.542 25.611 1.00 28.28 O ANISOU 2453 OE1 GLN A 298 3667 3476 3600 119 172 149 O ATOM 2454 NE2 GLN A 298 17.269 22.857 23.470 1.00 28.13 N ANISOU 2454 NE2 GLN A 298 3642 3440 3607 99 155 122 N ATOM 0 H GLN A 298 18.105 18.879 26.332 1.00 29.62 H new ATOM 0 HA GLN A 298 20.149 20.339 26.841 1.00 29.85 H new ATOM 0 HB2 GLN A 298 17.424 21.083 26.925 1.00 29.51 H new ATOM 0 HB3 GLN A 298 18.547 22.144 27.138 1.00 29.51 H new ATOM 0 HG2 GLN A 298 19.314 21.704 24.922 1.00 28.35 H new ATOM 0 HG3 GLN A 298 18.092 20.756 24.723 1.00 28.35 H new ATOM 0 HE21 GLN A 298 17.575 22.278 22.913 1.00 28.13 H new ATOM 0 HE22 GLN A 298 16.788 23.512 23.188 1.00 28.13 H new ATOM 2455 N AASP A 299 18.311 19.868 29.439 0.50 32.02 N ANISOU 2455 N AASP A 299 4183 3916 4068 174 194 219 N ATOM 2456 N BASP A 299 18.316 19.863 29.442 0.50 31.62 N ANISOU 2456 N BASP A 299 4132 3865 4018 174 194 219 N ATOM 2457 CA AASP A 299 18.252 19.918 30.902 0.50 33.40 C ANISOU 2457 CA AASP A 299 4366 4100 4225 193 207 241 C ATOM 2458 CA BASP A 299 18.261 19.936 30.904 0.50 32.73 C ANISOU 2458 CA BASP A 299 4281 4015 4139 193 207 241 C ATOM 2459 C AASP A 299 19.369 19.094 31.541 0.50 33.78 C ANISOU 2459 C AASP A 299 4429 4142 4264 214 201 244 C ATOM 2460 C BASP A 299 19.358 19.086 31.554 0.50 33.41 C ANISOU 2460 C BASP A 299 4382 4095 4217 214 202 244 C ATOM 2461 O AASP A 299 19.995 19.524 32.513 0.50 33.94 O ANISOU 2461 O AASP A 299 4458 4180 4260 236 202 245 O ATOM 2462 O BASP A 299 19.960 19.494 32.551 0.50 33.67 O ANISOU 2462 O BASP A 299 4424 4145 4226 236 203 247 O ATOM 2463 CB AASP A 299 16.896 19.408 31.394 0.50 34.41 C ANISOU 2463 CB AASP A 299 4489 4217 4367 184 225 272 C ATOM 2464 CB BASP A 299 16.884 19.490 31.402 0.50 33.17 C ANISOU 2464 CB BASP A 299 4332 4062 4209 184 225 272 C ATOM 2465 CG AASP A 299 15.742 20.251 30.894 0.50 35.14 C ANISOU 2465 CG AASP A 299 4567 4318 4468 166 231 271 C ATOM 2466 CG BASP A 299 16.640 19.852 32.856 0.50 33.48 C ANISOU 2466 CG BASP A 299 4378 4119 4226 204 240 295 C ATOM 2467 OD1AASP A 299 14.597 19.750 30.890 0.50 36.13 O ANISOU 2467 OD1AASP A 299 4685 4430 4613 152 242 291 O ATOM 2468 OD1BASP A 299 17.233 20.838 33.339 0.50 33.56 O ANISOU 2468 OD1BASP A 299 4390 4151 4209 220 236 282 O ATOM 2469 OD2AASP A 299 15.984 21.410 30.498 0.50 35.80 O ANISOU 2469 OD2AASP A 299 4645 4419 4537 165 223 250 O ATOM 2470 OD2BASP A 299 15.846 19.152 33.516 0.50 34.55 O ANISOU 2470 OD2BASP A 299 4514 4245 4370 203 256 325 O ATOM 0 H AASP A 299 17.623 19.505 29.073 0.50 31.62 H new ATOM 0 H BASP A 299 17.633 19.485 29.082 0.50 31.62 H new ATOM 0 HA AASP A 299 18.369 20.844 31.166 0.50 32.73 H new ATOM 0 HA BASP A 299 18.412 20.859 31.160 0.50 32.73 H new ATOM 0 HB2AASP A 299 16.773 18.491 31.101 0.50 33.17 H new ATOM 0 HB2BASP A 299 16.198 19.898 30.852 0.50 33.17 H new ATOM 0 HB3AASP A 299 16.890 19.400 32.364 0.50 33.17 H new ATOM 0 HB3BASP A 299 16.801 18.530 31.294 0.50 33.17 H new ATOM 2471 N GLU A 300 19.613 17.912 30.983 1.00 33.83 N ANISOU 2471 N GLU A 300 4439 4124 4290 208 195 243 N ATOM 2472 CA GLU A 300 20.679 17.030 31.453 1.00 35.07 C ANISOU 2472 CA GLU A 300 4610 4273 4442 227 187 244 C ATOM 2473 C GLU A 300 22.048 17.705 31.313 1.00 33.85 C ANISOU 2473 C GLU A 300 4458 4137 4266 241 173 215 C ATOM 2474 O GLU A 300 22.843 17.704 32.249 1.00 34.55 O ANISOU 2474 O GLU A 300 4557 4235 4334 264 172 218 O ATOM 2475 CB GLU A 300 20.647 15.719 30.661 1.00 37.17 C ANISOU 2475 CB GLU A 300 4878 4509 4737 215 180 244 C ATOM 2476 CG GLU A 300 21.554 14.625 31.199 1.00 39.62 C ANISOU 2476 CG GLU A 300 5204 4805 5045 234 173 249 C ATOM 2477 CD GLU A 300 21.558 13.385 30.322 1.00 41.24 C ANISOU 2477 CD GLU A 300 5410 4979 5279 223 162 245 C ATOM 2478 OE1 GLU A 300 22.623 12.738 30.217 1.00 43.53 O ANISOU 2478 OE1 GLU A 300 5709 5262 5567 237 149 232 O ATOM 2479 OE2 GLU A 300 20.505 13.055 29.732 1.00 42.74 O ANISOU 2479 OE2 GLU A 300 5591 5152 5495 201 166 253 O ATOM 0 H AGLU A 300 19.165 17.598 30.320 0.50 33.83 H new ATOM 0 H BGLU A 300 19.173 17.604 30.312 0.50 33.83 H new ATOM 0 HA GLU A 300 20.535 16.840 32.393 1.00 35.07 H new ATOM 0 HB2 GLU A 300 19.736 15.387 30.646 1.00 37.17 H new ATOM 0 HB3 GLU A 300 20.896 15.905 29.742 1.00 37.17 H new ATOM 0 HG2 GLU A 300 22.459 14.967 31.273 1.00 39.62 H new ATOM 0 HG3 GLU A 300 21.268 14.383 32.094 1.00 39.62 H new ATOM 2480 N LEU A 301 22.296 18.305 30.153 1.00 31.70 N ANISOU 2480 N LEU A 301 4175 3871 3999 228 162 189 N ATOM 2481 CA LEU A 301 23.567 18.980 29.878 1.00 30.86 C ANISOU 2481 CA LEU A 301 4067 3782 3875 238 149 162 C ATOM 2482 C LEU A 301 23.752 20.218 30.753 1.00 30.34 C ANISOU 2482 C LEU A 301 4002 3742 3785 251 153 161 C ATOM 2483 O LEU A 301 24.837 20.464 31.284 1.00 30.29 O ANISOU 2483 O LEU A 301 4000 3748 3761 270 145 150 O ATOM 2484 CB LEU A 301 23.667 19.358 28.392 1.00 30.18 C ANISOU 2484 CB LEU A 301 3969 3697 3800 219 139 137 C ATOM 2485 CG LEU A 301 24.005 18.191 27.457 1.00 30.10 C ANISOU 2485 CG LEU A 301 3961 3667 3809 214 129 127 C ATOM 2486 CD1 LEU A 301 23.583 18.466 26.020 1.00 29.49 C ANISOU 2486 CD1 LEU A 301 3871 3587 3746 193 124 111 C ATOM 2487 CD2 LEU A 301 25.491 17.877 27.531 1.00 30.00 C ANISOU 2487 CD2 LEU A 301 3954 3660 3785 233 117 110 C ATOM 0 H LEU A 301 21.735 18.334 29.502 1.00 31.70 H new ATOM 0 HA LEU A 301 24.279 18.357 30.094 1.00 30.86 H new ATOM 0 HB2 LEU A 301 22.824 19.747 28.112 1.00 30.18 H new ATOM 0 HB3 LEU A 301 24.344 20.045 28.290 1.00 30.18 H new ATOM 0 HG LEU A 301 23.501 17.418 27.757 1.00 30.10 H new ATOM 0 HD11 LEU A 301 23.814 17.706 25.464 1.00 29.49 H new ATOM 0 HD12 LEU A 301 22.625 18.611 25.986 1.00 29.49 H new ATOM 0 HD13 LEU A 301 24.041 19.256 25.694 1.00 29.49 H new ATOM 0 HD21 LEU A 301 25.696 17.138 26.937 1.00 30.00 H new ATOM 0 HD22 LEU A 301 26.001 18.658 27.263 1.00 30.00 H new ATOM 0 HD23 LEU A 301 25.726 17.635 28.440 1.00 30.00 H new ATOM 2488 N GLY A 302 22.686 20.997 30.894 1.00 30.46 N ANISOU 2488 N GLY A 302 4009 3764 3799 241 163 171 N ATOM 2489 CA GLY A 302 22.706 22.178 31.743 1.00 30.76 C ANISOU 2489 CA GLY A 302 4047 3825 3815 253 166 170 C ATOM 2490 C GLY A 302 23.598 23.288 31.223 1.00 30.55 C ANISOU 2490 C GLY A 302 4014 3816 3779 253 153 142 C ATOM 2491 O GLY A 302 23.951 23.327 30.041 1.00 29.32 O ANISOU 2491 O GLY A 302 3851 3656 3634 238 144 124 O ATOM 0 H GLY A 302 21.934 20.856 30.501 1.00 30.46 H new ATOM 0 HA2 GLY A 302 21.802 22.517 31.834 1.00 30.76 H new ATOM 0 HA3 GLY A 302 23.004 21.924 32.630 1.00 30.76 H new ATOM 2492 N PHE A 303 23.959 24.190 32.127 1.00 30.95 N ANISOU 2492 N PHE A 303 4067 3885 3808 270 151 139 N ATOM 2493 CA PHE A 303 24.811 25.322 31.819 1.00 31.74 C ANISOU 2493 CA PHE A 303 4159 4000 3899 271 138 114 C ATOM 2494 C PHE A 303 26.109 25.190 32.593 1.00 32.71 C ANISOU 2494 C PHE A 303 4290 4131 4006 296 128 104 C ATOM 2495 O PHE A 303 26.147 24.569 33.662 1.00 31.82 O ANISOU 2495 O PHE A 303 4189 4017 3883 316 133 119 O ATOM 2496 CB PHE A 303 24.138 26.634 32.245 1.00 32.14 C ANISOU 2496 CB PHE A 303 4205 4066 3939 271 141 115 C ATOM 2497 CG PHE A 303 22.968 27.040 31.389 1.00 32.12 C ANISOU 2497 CG PHE A 303 4193 4060 3951 247 148 118 C ATOM 2498 CD1 PHE A 303 21.798 26.293 31.381 1.00 32.53 C ANISOU 2498 CD1 PHE A 303 4246 4099 4014 238 162 140 C ATOM 2499 CD2 PHE A 303 23.027 28.192 30.613 1.00 32.93 C ANISOU 2499 CD2 PHE A 303 4286 4170 4055 234 140 101 C ATOM 2500 CE1 PHE A 303 20.715 26.676 30.603 1.00 32.88 C ANISOU 2500 CE1 PHE A 303 4281 4141 4072 216 167 142 C ATOM 2501 CE2 PHE A 303 21.947 28.579 29.837 1.00 32.50 C ANISOU 2501 CE2 PHE A 303 4224 4113 4012 213 146 104 C ATOM 2502 CZ PHE A 303 20.792 27.818 29.827 1.00 32.86 C ANISOU 2502 CZ PHE A 303 4270 4147 4069 205 159 124 C ATOM 0 H PHE A 303 23.710 24.158 32.950 1.00 30.95 H new ATOM 0 HA PHE A 303 24.974 25.334 30.863 1.00 31.74 H new ATOM 0 HB2 PHE A 303 23.838 26.547 33.163 1.00 32.14 H new ATOM 0 HB3 PHE A 303 24.799 27.344 32.228 1.00 32.14 H new ATOM 0 HD1 PHE A 303 21.739 25.526 31.904 1.00 32.53 H new ATOM 0 HD2 PHE A 303 23.800 28.709 30.615 1.00 32.93 H new ATOM 0 HE1 PHE A 303 19.938 26.165 30.603 1.00 32.88 H new ATOM 0 HE2 PHE A 303 21.998 29.352 29.322 1.00 32.50 H new ATOM 0 HZ PHE A 303 20.070 28.074 29.300 1.00 32.86 H new ATOM 2503 N THR A 304 27.167 25.786 32.052 1.00 33.38 N ANISOU 2503 N THR A 304 4367 4225 4090 294 114 80 N ATOM 2504 CA THR A 304 28.359 26.084 32.834 1.00 35.36 C ANISOU 2504 CA THR A 304 4621 4488 4325 317 103 67 C ATOM 2505 C THR A 304 28.088 27.408 33.545 1.00 36.54 C ANISOU 2505 C THR A 304 4768 4654 4462 325 101 64 C ATOM 2506 O THR A 304 26.971 27.931 33.486 1.00 35.32 O ANISOU 2506 O THR A 304 4611 4499 4309 314 110 74 O ATOM 2507 CB THR A 304 29.616 26.214 31.951 1.00 35.64 C ANISOU 2507 CB THR A 304 4647 4526 4367 312 89 42 C ATOM 2508 OG1 THR A 304 29.493 27.360 31.103 1.00 35.41 O ANISOU 2508 OG1 THR A 304 4605 4505 4344 293 86 29 O ATOM 2509 CG2 THR A 304 29.820 24.967 31.102 1.00 35.51 C ANISOU 2509 CG2 THR A 304 4632 4495 4364 304 90 42 C ATOM 0 H THR A 304 27.213 26.027 31.228 1.00 33.38 H new ATOM 0 HA THR A 304 28.534 25.361 33.457 1.00 35.36 H new ATOM 0 HB THR A 304 30.387 26.317 32.531 1.00 35.64 H new ATOM 0 HG1 THR A 304 30.180 27.429 30.624 1.00 35.41 H new ATOM 0 HG21 THR A 304 30.615 25.073 30.557 1.00 35.51 H new ATOM 0 HG22 THR A 304 29.926 24.195 31.680 1.00 35.51 H new ATOM 0 HG23 THR A 304 29.049 24.837 30.527 1.00 35.51 H new ATOM 2510 N VAL A 305 29.101 27.956 34.208 1.00 39.14 N ANISOU 2510 N VAL A 305 5098 4995 4778 344 88 48 N ATOM 2511 CA VAL A 305 28.969 29.277 34.830 1.00 40.55 C ANISOU 2511 CA VAL A 305 5274 5189 4946 352 82 41 C ATOM 2512 C VAL A 305 28.689 30.341 33.765 1.00 41.32 C ANISOU 2512 C VAL A 305 5357 5288 5055 326 79 29 C ATOM 2513 O VAL A 305 27.953 31.296 34.017 1.00 41.63 O ANISOU 2513 O VAL A 305 5394 5333 5090 324 80 31 O ATOM 2514 CB VAL A 305 30.235 29.688 35.614 1.00 41.63 C ANISOU 2514 CB VAL A 305 5411 5337 5069 376 65 22 C ATOM 2515 CG1 VAL A 305 29.942 30.900 36.489 1.00 41.93 C ANISOU 2515 CG1 VAL A 305 5449 5389 5094 389 59 17 C ATOM 2516 CG2 VAL A 305 30.746 28.542 36.472 1.00 42.92 C ANISOU 2516 CG2 VAL A 305 5588 5498 5221 401 66 30 C ATOM 0 H VAL A 305 29.870 27.585 34.311 1.00 39.14 H new ATOM 0 HA VAL A 305 28.229 29.216 35.454 1.00 40.55 H new ATOM 0 HB VAL A 305 30.924 29.917 34.970 1.00 41.63 H new ATOM 0 HG11 VAL A 305 30.743 31.149 36.976 1.00 41.93 H new ATOM 0 HG12 VAL A 305 29.660 31.642 35.931 1.00 41.93 H new ATOM 0 HG13 VAL A 305 29.236 30.682 37.118 1.00 41.93 H new ATOM 0 HG21 VAL A 305 31.539 28.826 36.952 1.00 42.92 H new ATOM 0 HG22 VAL A 305 30.060 28.282 37.107 1.00 42.92 H new ATOM 0 HG23 VAL A 305 30.965 27.786 35.905 1.00 42.92 H new ATOM 2517 N LYS A 306 29.264 30.145 32.577 1.00 40.83 N ANISOU 2517 N LYS A 306 5285 5219 5007 308 75 18 N ATOM 2518 CA LYS A 306 29.242 31.145 31.503 1.00 41.44 C ANISOU 2518 CA LYS A 306 5350 5300 5096 284 71 6 C ATOM 2519 C LYS A 306 28.146 30.960 30.450 1.00 40.27 C ANISOU 2519 C LYS A 306 5198 5141 4960 260 82 16 C ATOM 2520 O LYS A 306 27.654 31.950 29.904 1.00 41.41 O ANISOU 2520 O LYS A 306 5335 5289 5110 245 82 13 O ATOM 2521 CB LYS A 306 30.596 31.170 30.786 1.00 43.40 C ANISOU 2521 CB LYS A 306 5588 5550 5351 280 60 -14 C ATOM 2522 CG LYS A 306 31.676 31.972 31.500 1.00 45.08 C ANISOU 2522 CG LYS A 306 5796 5775 5556 296 44 -31 C ATOM 2523 CD LYS A 306 32.861 32.252 30.585 1.00 46.20 C ANISOU 2523 CD LYS A 306 5924 5921 5709 284 35 -50 C ATOM 2524 CE LYS A 306 32.513 33.266 29.502 1.00 46.92 C ANISOU 2524 CE LYS A 306 6003 6012 5811 258 36 -53 C ATOM 2525 NZ LYS A 306 33.698 33.638 28.683 1.00 48.25 N ANISOU 2525 NZ LYS A 306 6156 6187 5989 248 28 -69 N ATOM 0 H LYS A 306 29.681 29.422 32.369 1.00 40.83 H new ATOM 0 HA LYS A 306 29.047 31.981 31.954 1.00 41.44 H new ATOM 0 HB2 LYS A 306 30.907 30.258 30.675 1.00 43.40 H new ATOM 0 HB3 LYS A 306 30.471 31.537 29.897 1.00 43.40 H new ATOM 0 HG2 LYS A 306 31.303 32.811 31.814 1.00 45.08 H new ATOM 0 HG3 LYS A 306 31.978 31.485 32.283 1.00 45.08 H new ATOM 0 HD2 LYS A 306 33.605 32.584 31.112 1.00 46.20 H new ATOM 0 HD3 LYS A 306 33.153 31.425 30.172 1.00 46.20 H new ATOM 0 HE2 LYS A 306 31.825 32.898 28.925 1.00 46.92 H new ATOM 0 HE3 LYS A 306 32.142 34.063 29.913 1.00 46.92 H new ATOM 0 HZ1 LYS A 306 33.457 34.230 28.063 1.00 48.25 H new ATOM 0 HZ2 LYS A 306 34.321 33.996 29.208 1.00 48.25 H new ATOM 0 HZ3 LYS A 306 34.026 32.911 28.287 1.00 48.25 H new ATOM 2526 N ALA A 307 27.778 29.715 30.139 1.00 37.41 N ANISOU 2526 N ALA A 307 4841 4767 4605 256 92 28 N ATOM 2527 CA ALA A 307 26.884 29.465 28.998 1.00 35.69 C ANISOU 2527 CA ALA A 307 4619 4540 4402 233 100 34 C ATOM 2528 C ALA A 307 26.312 28.045 28.943 1.00 33.36 C ANISOU 2528 C ALA A 307 4332 4229 4115 232 109 50 C ATOM 2529 O ALA A 307 26.769 27.158 29.671 1.00 33.51 O ANISOU 2529 O ALA A 307 4360 4244 4129 249 109 56 O ATOM 2530 CB ALA A 307 27.622 29.769 27.701 1.00 34.51 C ANISOU 2530 CB ALA A 307 4458 4392 4261 217 92 17 C ATOM 0 H ALA A 307 28.028 29.011 30.566 1.00 37.41 H new ATOM 0 HA ALA A 307 26.123 30.055 29.116 1.00 35.69 H new ATOM 0 HB1 ALA A 307 27.034 29.605 26.948 1.00 34.51 H new ATOM 0 HB2 ALA A 307 27.900 30.698 27.697 1.00 34.51 H new ATOM 0 HB3 ALA A 307 28.403 29.198 27.631 1.00 34.51 H new ATOM 2531 N PRO A 308 25.320 27.822 28.056 1.00 32.21 N ANISOU 2531 N PRO A 308 4181 4073 3982 212 116 57 N ATOM 2532 CA PRO A 308 24.748 26.483 27.918 1.00 30.72 C ANISOU 2532 CA PRO A 308 3998 3867 3805 209 124 71 C ATOM 2533 C PRO A 308 25.781 25.466 27.433 1.00 29.53 C ANISOU 2533 C PRO A 308 3850 3709 3660 213 116 61 C ATOM 2534 O PRO A 308 26.667 25.813 26.657 1.00 28.83 O ANISOU 2534 O PRO A 308 3754 3628 3571 210 107 42 O ATOM 2535 CB PRO A 308 23.641 26.660 26.865 1.00 31.23 C ANISOU 2535 CB PRO A 308 4056 3925 3885 186 129 73 C ATOM 2536 CG PRO A 308 23.465 28.125 26.672 1.00 31.69 C ANISOU 2536 CG PRO A 308 4107 3998 3937 179 126 65 C ATOM 2537 CD PRO A 308 24.737 28.780 27.097 1.00 31.89 C ANISOU 2537 CD PRO A 308 4132 4037 3949 192 116 50 C ATOM 0 HA PRO A 308 24.424 26.142 28.766 1.00 30.72 H new ATOM 0 HB2 PRO A 308 23.887 26.230 26.031 1.00 31.23 H new ATOM 0 HB3 PRO A 308 22.814 26.250 27.163 1.00 31.23 H new ATOM 0 HG2 PRO A 308 23.269 28.327 25.744 1.00 31.69 H new ATOM 0 HG3 PRO A 308 22.719 28.453 27.198 1.00 31.69 H new ATOM 0 HD2 PRO A 308 25.328 28.934 26.343 1.00 31.89 H new ATOM 0 HD3 PRO A 308 24.573 29.642 27.510 1.00 31.89 H new ATOM 2538 N AARG A 309 25.675 24.227 27.906 0.50 29.44 N ANISOU 2538 N AARG A 309 3849 3684 3653 222 120 74 N ATOM 2539 N BARG A 309 25.663 24.229 27.904 0.50 28.66 N ANISOU 2539 N BARG A 309 3750 3585 3555 222 120 74 N ATOM 2540 CA AARG A 309 26.506 23.137 27.390 0.50 29.54 C ANISOU 2540 CA AARG A 309 3864 3687 3673 226 113 65 C ATOM 2541 CA BARG A 309 26.492 23.133 27.408 0.50 28.27 C ANISOU 2541 CA BARG A 309 3704 3526 3513 227 113 65 C ATOM 2542 C AARG A 309 25.803 22.380 26.262 0.50 28.82 C ANISOU 2542 C AARG A 309 3770 3579 3603 208 114 66 C ATOM 2543 C BARG A 309 25.788 22.363 26.289 0.50 28.13 C ANISOU 2543 C BARG A 309 3682 3491 3515 209 114 66 C ATOM 2544 O AARG A 309 26.345 21.403 25.747 0.50 28.41 O ANISOU 2544 O AARG A 309 3720 3516 3558 211 107 58 O ATOM 2545 O BARG A 309 26.313 21.361 25.807 0.50 27.89 O ANISOU 2545 O BARG A 309 3654 3449 3492 212 108 60 O ATOM 2546 CB AARG A 309 26.899 22.168 28.512 0.50 30.56 C ANISOU 2546 CB AARG A 309 4007 3809 3797 248 114 77 C ATOM 2547 CB BARG A 309 26.875 22.195 28.559 0.50 28.21 C ANISOU 2547 CB BARG A 309 3709 3511 3498 248 114 78 C ATOM 2548 CG AARG A 309 27.848 22.775 29.532 0.50 31.49 C ANISOU 2548 CG AARG A 309 4128 3944 3894 269 108 71 C ATOM 2549 CG BARG A 309 27.764 22.868 29.593 0.50 28.15 C ANISOU 2549 CG BARG A 309 3704 3521 3470 269 109 72 C ATOM 2550 CD AARG A 309 28.642 21.720 30.290 0.50 32.42 C ANISOU 2550 CD AARG A 309 4258 4054 4005 292 104 75 C ATOM 2551 CD BARG A 309 28.378 21.888 30.579 0.50 27.95 C ANISOU 2551 CD BARG A 309 3694 3490 3437 293 107 80 C ATOM 2552 NE AARG A 309 27.815 20.593 30.705 0.50 33.15 N ANISOU 2552 NE AARG A 309 4361 4127 4107 293 113 99 N ATOM 2553 NE BARG A 309 27.437 21.445 31.600 0.50 27.35 N ANISOU 2553 NE BARG A 309 3627 3406 3358 300 120 108 N ATOM 2554 CZ AARG A 309 28.079 19.321 30.419 0.50 33.38 C ANISOU 2554 CZ AARG A 309 4398 4139 4148 296 110 101 C ATOM 2555 CZ BARG A 309 27.800 21.000 32.799 0.50 27.67 C ANISOU 2555 CZ BARG A 309 3681 3448 3385 325 121 119 C ATOM 2556 NH1AARG A 309 27.266 18.367 30.843 0.50 33.86 N ANISOU 2556 NH1AARG A 309 4467 4179 4218 295 119 126 N ATOM 2557 NH1BARG A 309 29.081 20.955 33.126 0.50 27.67 N ANISOU 2557 NH1BARG A 309 3684 3456 3373 344 108 103 N ATOM 2558 NH2AARG A 309 29.164 18.999 29.723 0.50 33.75 N ANISOU 2558 NH2AARG A 309 4441 4186 4197 299 97 79 N ATOM 2559 NH2BARG A 309 26.884 20.607 33.672 0.50 27.66 N ANISOU 2559 NH2BARG A 309 3688 3440 3381 330 134 147 N ATOM 0 H AARG A 309 25.127 23.994 28.527 0.50 28.66 H new ATOM 0 H BARG A 309 25.104 24.001 28.516 0.50 28.66 H new ATOM 0 HA AARG A 309 27.312 23.537 27.028 0.50 28.27 H new ATOM 0 HA BARG A 309 27.302 23.513 27.034 0.50 28.27 H new ATOM 0 HB2AARG A 309 26.096 21.868 28.966 0.50 28.21 H new ATOM 0 HB2BARG A 309 26.068 21.874 28.991 0.50 28.21 H new ATOM 0 HB3AARG A 309 27.314 21.383 28.121 0.50 28.21 H new ATOM 0 HB3BARG A 309 27.333 21.419 28.200 0.50 28.21 H new ATOM 0 HG2AARG A 309 28.462 23.375 29.081 0.50 28.15 H new ATOM 0 HG2BARG A 309 28.474 23.348 29.138 0.50 28.15 H new ATOM 0 HG3AARG A 309 27.341 23.309 30.163 0.50 28.15 H new ATOM 0 HG3BARG A 309 27.243 23.526 30.080 0.50 28.15 H new ATOM 0 HD2AARG A 309 29.365 21.398 29.729 0.50 27.95 H new ATOM 0 HD2BARG A 309 28.711 21.116 30.095 0.50 27.95 H new ATOM 0 HD3AARG A 309 29.049 22.125 31.072 0.50 27.95 H new ATOM 0 HD3BARG A 309 29.142 22.304 31.008 0.50 27.95 H new ATOM 0 HE AARG A 309 27.109 20.762 31.166 0.50 27.35 H new ATOM 0 HE BARG A 309 26.597 21.473 31.416 0.50 27.35 H new ATOM 0 HH11AARG A 309 26.568 18.570 31.303 0.50 27.67 H new ATOM 0 HH11BARG A 309 29.678 21.213 32.563 0.50 27.67 H new ATOM 0 HH12AARG A 309 27.436 17.544 30.659 0.50 27.67 H new ATOM 0 HH12BARG A 309 29.317 20.667 33.901 0.50 27.67 H new ATOM 0 HH21AARG A 309 29.701 19.615 29.454 0.50 27.66 H new ATOM 0 HH21BARG A 309 26.050 20.639 33.464 0.50 27.66 H new ATOM 0 HH22AARG A 309 29.329 18.175 29.541 0.50 27.66 H new ATOM 0 HH22BARG A 309 27.123 20.320 34.446 0.50 27.66 H new ATOM 2560 N TRP A 310 24.617 22.849 25.870 1.00 27.58 N ANISOU 2560 N TRP A 310 3606 3419 3453 191 121 73 N ATOM 2561 CA TRP A 310 23.806 22.199 24.827 1.00 27.24 C ANISOU 2561 CA TRP A 310 3560 3360 3430 174 122 74 C ATOM 2562 C TRP A 310 23.694 23.004 23.555 1.00 26.05 C ANISOU 2562 C TRP A 310 3398 3218 3283 158 117 57 C ATOM 2563 O TRP A 310 22.939 22.633 22.647 1.00 25.69 O ANISOU 2563 O TRP A 310 3347 3160 3252 144 117 56 O ATOM 2564 CB TRP A 310 22.413 21.870 25.368 1.00 28.02 C ANISOU 2564 CB TRP A 310 3661 3446 3540 167 134 98 C ATOM 2565 CG TRP A 310 21.733 23.008 26.085 1.00 29.22 C ANISOU 2565 CG TRP A 310 3810 3613 3681 166 143 108 C ATOM 2566 CD1 TRP A 310 21.737 23.268 27.452 1.00 30.13 C ANISOU 2566 CD1 TRP A 310 3931 3736 3780 182 150 123 C ATOM 2567 CD2 TRP A 310 20.917 24.078 25.496 1.00 29.84 C ANISOU 2567 CD2 TRP A 310 3878 3699 3760 151 145 104 C ATOM 2568 NE1 TRP A 310 21.010 24.393 27.740 1.00 30.50 N ANISOU 2568 NE1 TRP A 310 3973 3796 3820 179 156 127 N ATOM 2569 CE2 TRP A 310 20.488 24.926 26.613 1.00 30.30 C ANISOU 2569 CE2 TRP A 310 3938 3771 3805 160 153 116 C ATOM 2570 CE3 TRP A 310 20.518 24.409 24.205 1.00 29.89 C ANISOU 2570 CE3 TRP A 310 3875 3704 3777 133 141 91 C ATOM 2571 CZ2 TRP A 310 19.696 26.047 26.420 1.00 30.18 C ANISOU 2571 CZ2 TRP A 310 3914 3765 3786 150 156 115 C ATOM 2572 CZ3 TRP A 310 19.712 25.539 24.025 1.00 30.06 C ANISOU 2572 CZ3 TRP A 310 3890 3736 3795 124 144 92 C ATOM 2573 CH2 TRP A 310 19.315 26.339 25.107 1.00 30.23 C ANISOU 2573 CH2 TRP A 310 3912 3769 3804 131 152 103 C ATOM 0 H ATRP A 310 24.256 23.556 26.201 0.50 27.58 H new ATOM 0 H BTRP A 310 24.266 23.569 26.183 0.50 27.58 H new ATOM 0 HA TRP A 310 24.273 21.382 24.591 1.00 27.24 H new ATOM 0 HB2 TRP A 310 21.851 21.587 24.630 1.00 28.02 H new ATOM 0 HB3 TRP A 310 22.484 21.117 25.976 1.00 28.02 H new ATOM 0 HD1 TRP A 310 22.175 22.747 28.086 1.00 30.13 H new ATOM 0 HE1 TRP A 310 20.901 24.716 28.530 1.00 30.50 H new ATOM 0 HE3 TRP A 310 20.781 23.891 23.478 1.00 29.89 H new ATOM 0 HZ2 TRP A 310 19.430 26.582 27.133 1.00 30.18 H new ATOM 0 HZ3 TRP A 310 19.433 25.765 23.167 1.00 30.06 H new ATOM 0 HH2 TRP A 310 18.783 27.085 24.946 1.00 30.23 H new ATOM 2574 N ALA A 311 24.458 24.091 23.448 1.00 24.37 N ANISOU 2574 N ALA A 311 3180 3024 3055 160 113 44 N ATOM 2575 CA ALA A 311 24.453 24.907 22.232 1.00 24.03 C ANISOU 2575 CA ALA A 311 3127 2991 3014 146 109 29 C ATOM 2576 C ALA A 311 25.810 25.524 21.930 1.00 23.43 C ANISOU 2576 C ALA A 311 3046 2932 2926 152 102 12 C ATOM 2577 O ALA A 311 26.648 25.669 22.813 1.00 22.75 O ANISOU 2577 O ALA A 311 2963 2853 2829 166 99 11 O ATOM 2578 CB ALA A 311 23.385 25.993 22.322 1.00 24.12 C ANISOU 2578 CB ALA A 311 3134 3007 3023 135 116 37 C ATOM 0 H ALA A 311 24.985 24.373 24.066 1.00 24.37 H new ATOM 0 HA ALA A 311 24.245 24.310 21.496 1.00 24.03 H new ATOM 0 HB1 ALA A 311 23.394 26.524 21.510 1.00 24.12 H new ATOM 0 HB2 ALA A 311 22.513 25.582 22.429 1.00 24.12 H new ATOM 0 HB3 ALA A 311 23.568 26.565 23.084 1.00 24.12 H new ATOM 2579 N ILE A 312 26.016 25.857 20.658 1.00 23.24 N ANISOU 2579 N ILE A 312 3013 2913 2904 141 98 -2 N ATOM 2580 CA ILE A 312 27.193 26.584 20.201 1.00 23.12 C ANISOU 2580 CA ILE A 312 2990 2915 2878 143 92 -17 C ATOM 2581 C ILE A 312 26.790 27.481 19.031 1.00 22.96 C ANISOU 2581 C ILE A 312 2961 2903 2860 126 93 -23 C ATOM 2582 O ILE A 312 25.898 27.137 18.248 1.00 22.69 O ANISOU 2582 O ILE A 312 2926 2860 2834 116 94 -21 O ATOM 2583 CB ILE A 312 28.328 25.616 19.776 1.00 23.47 C ANISOU 2583 CB ILE A 312 3033 2960 2923 153 86 -30 C ATOM 2584 CG1 ILE A 312 29.642 26.365 19.561 1.00 23.68 C ANISOU 2584 CG1 ILE A 312 3051 3006 2940 157 81 -44 C ATOM 2585 CG2 ILE A 312 27.947 24.845 18.515 1.00 23.92 C ANISOU 2585 CG2 ILE A 312 3089 3009 2990 146 83 -37 C ATOM 2586 CD1 ILE A 312 30.838 25.436 19.431 1.00 23.77 C ANISOU 2586 CD1 ILE A 312 3061 3020 2949 171 75 -56 C ATOM 0 H ILE A 312 25.465 25.663 20.027 1.00 23.24 H new ATOM 0 HA ILE A 312 27.535 27.123 20.931 1.00 23.12 H new ATOM 0 HB ILE A 312 28.454 24.981 20.498 1.00 23.47 H new ATOM 0 HG12 ILE A 312 29.572 26.908 18.761 1.00 23.68 H new ATOM 0 HG13 ILE A 312 29.789 26.971 20.304 1.00 23.68 H new ATOM 0 HG21 ILE A 312 28.671 24.248 18.270 1.00 23.92 H new ATOM 0 HG22 ILE A 312 27.144 24.327 18.682 1.00 23.92 H new ATOM 0 HG23 ILE A 312 27.784 25.469 17.791 1.00 23.92 H new ATOM 0 HD11 ILE A 312 31.643 25.961 19.297 1.00 23.77 H new ATOM 0 HD12 ILE A 312 30.928 24.909 20.240 1.00 23.77 H new ATOM 0 HD13 ILE A 312 30.708 24.845 18.673 1.00 23.77 H new ATOM 2587 N ALA A 313 27.444 28.633 18.926 1.00 23.42 N ANISOU 2587 N ALA A 313 3011 2976 2909 123 91 -29 N ATOM 2588 CA ALA A 313 27.258 29.525 17.787 1.00 23.15 C ANISOU 2588 CA ALA A 313 2969 2951 2875 109 92 -34 C ATOM 2589 C ALA A 313 28.488 29.428 16.892 1.00 23.88 C ANISOU 2589 C ALA A 313 3054 3057 2964 111 88 -48 C ATOM 2590 O ALA A 313 29.600 29.722 17.331 1.00 23.91 O ANISOU 2590 O ALA A 313 3053 3070 2962 118 85 -53 O ATOM 2591 CB ALA A 313 27.058 30.958 18.256 1.00 23.18 C ANISOU 2591 CB ALA A 313 2970 2962 2874 103 92 -29 C ATOM 0 H ALA A 313 28.006 28.919 19.511 1.00 23.42 H new ATOM 0 HA ALA A 313 26.466 29.262 17.292 1.00 23.15 H new ATOM 0 HB1 ALA A 313 26.936 31.536 17.487 1.00 23.18 H new ATOM 0 HB2 ALA A 313 26.273 31.006 18.824 1.00 23.18 H new ATOM 0 HB3 ALA A 313 27.837 31.247 18.757 1.00 23.18 H new ATOM 2592 N TYR A 314 28.293 28.981 15.656 1.00 24.33 N ANISOU 2592 N TYR A 314 3108 3113 3024 105 88 -54 N ATOM 2593 CA TYR A 314 29.359 28.977 14.667 1.00 24.62 C ANISOU 2593 CA TYR A 314 3135 3165 3054 107 86 -66 C ATOM 2594 C TYR A 314 29.366 30.355 14.025 1.00 24.47 C ANISOU 2594 C TYR A 314 3108 3159 3031 94 89 -65 C ATOM 2595 O TYR A 314 28.370 30.756 13.436 1.00 24.14 O ANISOU 2595 O TYR A 314 3068 3113 2991 83 91 -60 O ATOM 2596 CB TYR A 314 29.116 27.906 13.609 1.00 25.76 C ANISOU 2596 CB TYR A 314 3281 3304 3202 109 84 -74 C ATOM 2597 CG TYR A 314 30.186 27.857 12.541 1.00 26.12 C ANISOU 2597 CG TYR A 314 3318 3368 3240 113 83 -88 C ATOM 2598 CD1 TYR A 314 30.011 28.506 11.322 1.00 26.40 C ANISOU 2598 CD1 TYR A 314 3346 3415 3270 104 86 -90 C ATOM 2599 CD2 TYR A 314 31.374 27.177 12.756 1.00 27.33 C ANISOU 2599 CD2 TYR A 314 3467 3527 3389 127 79 -97 C ATOM 2600 CE1 TYR A 314 30.991 28.472 10.344 1.00 27.53 C ANISOU 2600 CE1 TYR A 314 3480 3577 3404 108 86 -100 C ATOM 2601 CE2 TYR A 314 32.358 27.127 11.785 1.00 28.21 C ANISOU 2601 CE2 TYR A 314 3568 3657 3493 131 80 -109 C ATOM 2602 CZ TYR A 314 32.166 27.772 10.578 1.00 28.36 C ANISOU 2602 CZ TYR A 314 3581 3688 3506 122 84 -110 C ATOM 2603 OH TYR A 314 33.153 27.723 9.614 1.00 30.55 O ANISOU 2603 OH TYR A 314 3847 3986 3774 127 85 -120 O ATOM 0 H TYR A 314 27.543 28.673 15.370 1.00 24.33 H new ATOM 0 HA TYR A 314 30.211 28.778 15.085 1.00 24.62 H new ATOM 0 HB2 TYR A 314 29.062 27.040 14.043 1.00 25.76 H new ATOM 0 HB3 TYR A 314 28.257 28.066 13.188 1.00 25.76 H new ATOM 0 HD1 TYR A 314 29.222 28.971 11.161 1.00 26.40 H new ATOM 0 HD2 TYR A 314 31.512 26.746 13.568 1.00 27.33 H new ATOM 0 HE1 TYR A 314 30.863 28.915 9.536 1.00 27.53 H new ATOM 0 HE2 TYR A 314 33.147 26.661 11.944 1.00 28.21 H new ATOM 0 HH TYR A 314 32.842 27.988 8.880 1.00 30.55 H new ATOM 2604 N ALYS A 315 30.484 31.067 14.134 0.50 24.92 N ANISOU 2604 N ALYS A 315 3156 3230 3083 94 89 -68 N ATOM 2605 N BLYS A 315 30.479 31.073 14.152 0.50 25.04 N ANISOU 2605 N BLYS A 315 3171 3245 3098 94 89 -68 N ATOM 2606 CA ALYS A 315 30.575 32.444 13.650 0.50 25.10 C ANISOU 2606 CA ALYS A 315 3170 3263 3103 81 91 -65 C ATOM 2607 CA BLYS A 315 30.587 32.440 13.644 0.50 25.29 C ANISOU 2607 CA BLYS A 315 3194 3288 3127 81 91 -65 C ATOM 2608 C ALYS A 315 31.186 32.508 12.251 0.50 24.98 C ANISOU 2608 C ALYS A 315 3146 3264 3083 77 94 -71 C ATOM 2609 C BLYS A 315 31.168 32.469 12.234 0.50 25.08 C ANISOU 2609 C BLYS A 315 3159 3277 3095 77 94 -71 C ATOM 2610 O ALYS A 315 32.278 31.988 12.022 0.50 25.23 O ANISOU 2610 O ALYS A 315 3169 3305 3110 86 94 -80 O ATOM 2611 O BLYS A 315 32.219 31.880 11.981 0.50 25.28 O ANISOU 2611 O BLYS A 315 3176 3311 3116 86 94 -80 O ATOM 2612 CB ALYS A 315 31.412 33.280 14.621 0.50 25.63 C ANISOU 2612 CB ALYS A 315 3231 3335 3170 82 88 -64 C ATOM 2613 CB BLYS A 315 31.466 33.282 14.572 0.50 26.01 C ANISOU 2613 CB BLYS A 315 3279 3385 3218 82 88 -65 C ATOM 2614 CG ALYS A 315 31.015 33.103 16.078 0.50 26.03 C ANISOU 2614 CG ALYS A 315 3293 3375 3224 91 85 -60 C ATOM 2615 CG BLYS A 315 30.819 33.627 15.903 0.50 26.53 C ANISOU 2615 CG BLYS A 315 3354 3439 3287 85 86 -58 C ATOM 2616 CD ALYS A 315 29.631 33.666 16.359 0.50 26.38 C ANISOU 2616 CD ALYS A 315 3345 3409 3270 83 87 -49 C ATOM 2617 CD BLYS A 315 29.582 34.491 15.720 0.50 27.09 C ANISOU 2617 CD BLYS A 315 3429 3504 3360 73 87 -48 C ATOM 2618 CE ALYS A 315 29.695 35.130 16.766 0.50 26.69 C ANISOU 2618 CE ALYS A 315 3379 3451 3309 76 84 -46 C ATOM 2619 CE BLYS A 315 28.976 34.881 17.061 0.50 27.69 C ANISOU 2619 CE BLYS A 315 3513 3571 3436 78 85 -42 C ATOM 2620 NZ ALYS A 315 30.334 35.981 15.729 0.50 26.84 N ANISOU 2620 NZ ALYS A 315 3387 3482 3328 64 84 -48 N ATOM 2621 NZ BLYS A 315 29.811 35.866 17.805 0.50 28.46 N ANISOU 2621 NZ BLYS A 315 3605 3675 3534 80 79 -45 N ATOM 0 H ALYS A 315 31.208 30.768 14.489 0.50 25.04 H new ATOM 0 H BLYS A 315 31.192 30.783 14.534 0.50 25.04 H new ATOM 0 HA ALYS A 315 29.675 32.803 13.599 0.50 25.29 H new ATOM 0 HA BLYS A 315 29.691 32.812 13.614 0.50 25.29 H new ATOM 0 HB2ALYS A 315 32.347 33.042 14.517 0.50 26.01 H new ATOM 0 HB2BLYS A 315 32.292 32.803 14.741 0.50 26.01 H new ATOM 0 HB3ALYS A 315 31.330 34.217 14.383 0.50 26.01 H new ATOM 0 HB3BLYS A 315 31.703 34.105 14.117 0.50 26.01 H new ATOM 0 HG2ALYS A 315 31.033 32.160 16.306 0.50 26.53 H new ATOM 0 HG2BLYS A 315 30.578 32.810 16.367 0.50 26.53 H new ATOM 0 HG3ALYS A 315 31.665 33.545 16.646 0.50 26.53 H new ATOM 0 HG3BLYS A 315 31.459 34.093 16.463 0.50 26.53 H new ATOM 0 HD2ALYS A 315 29.076 33.573 15.569 0.50 27.09 H new ATOM 0 HD2BLYS A 315 29.814 35.291 15.223 0.50 27.09 H new ATOM 0 HD3ALYS A 315 29.208 33.151 17.064 0.50 27.09 H new ATOM 0 HD3BLYS A 315 28.924 34.011 15.193 0.50 27.09 H new ATOM 0 HE2ALYS A 315 28.797 35.454 16.938 0.50 27.69 H new ATOM 0 HE2BLYS A 315 28.093 35.255 16.916 0.50 27.69 H new ATOM 0 HE3ALYS A 315 30.190 35.211 17.596 0.50 27.69 H new ATOM 0 HE3BLYS A 315 28.861 34.085 17.603 0.50 27.69 H new ATOM 0 HZ1ALYS A 315 30.210 36.839 15.931 0.50 28.46 H new ATOM 0 HZ1BLYS A 315 29.283 36.433 18.242 0.50 28.46 H new ATOM 0 HZ2ALYS A 315 31.206 35.807 15.698 0.50 28.46 H new ATOM 0 HZ2BLYS A 315 30.330 35.436 18.386 0.50 28.46 H new ATOM 0 HZ3ALYS A 315 29.969 35.807 14.936 0.50 28.46 H new ATOM 0 HZ3BLYS A 315 30.320 36.318 17.231 0.50 28.46 H new ATOM 2622 N PHE A 316 30.474 33.147 11.321 1.00 24.62 N ANISOU 2622 N PHE A 316 3099 3220 3035 66 98 -66 N ATOM 2623 CA PHE A 316 30.997 33.422 9.984 1.00 24.54 C ANISOU 2623 CA PHE A 316 3080 3227 3017 62 102 -69 C ATOM 2624 C PHE A 316 31.913 34.641 10.068 1.00 24.71 C ANISOU 2624 C PHE A 316 3090 3261 3038 53 105 -65 C ATOM 2625 O PHE A 316 31.916 35.356 11.075 1.00 23.79 O ANISOU 2625 O PHE A 316 2974 3138 2928 49 101 -60 O ATOM 2626 CB PHE A 316 29.872 33.773 8.997 1.00 24.16 C ANISOU 2626 CB PHE A 316 3037 3176 2967 53 104 -64 C ATOM 2627 CG PHE A 316 28.976 32.625 8.619 1.00 23.75 C ANISOU 2627 CG PHE A 316 2994 3114 2917 60 101 -70 C ATOM 2628 CD1 PHE A 316 27.605 32.825 8.500 1.00 23.90 C ANISOU 2628 CD1 PHE A 316 3021 3120 2940 53 99 -65 C ATOM 2629 CD2 PHE A 316 29.487 31.366 8.346 1.00 24.06 C ANISOU 2629 CD2 PHE A 316 3033 3155 2955 73 98 -82 C ATOM 2630 CE1 PHE A 316 26.765 31.787 8.133 1.00 23.77 C ANISOU 2630 CE1 PHE A 316 3011 3093 2928 58 95 -71 C ATOM 2631 CE2 PHE A 316 28.652 30.326 7.980 1.00 23.86 C ANISOU 2631 CE2 PHE A 316 3016 3117 2934 78 93 -88 C ATOM 2632 CZ PHE A 316 27.290 30.539 7.872 1.00 24.21 C ANISOU 2632 CZ PHE A 316 3066 3148 2983 70 92 -83 C ATOM 0 H APHE A 316 29.673 33.433 11.449 0.50 24.62 H new ATOM 0 H BPHE A 316 29.685 33.461 11.460 0.50 24.62 H new ATOM 0 HA PHE A 316 31.461 32.628 9.674 1.00 24.54 H new ATOM 0 HB2 PHE A 316 29.328 34.476 9.385 1.00 24.16 H new ATOM 0 HB3 PHE A 316 30.270 34.135 8.190 1.00 24.16 H new ATOM 0 HD1 PHE A 316 27.248 33.667 8.669 1.00 23.90 H new ATOM 0 HD2 PHE A 316 30.403 31.219 8.410 1.00 24.06 H new ATOM 0 HE1 PHE A 316 25.849 31.931 8.063 1.00 23.77 H new ATOM 0 HE2 PHE A 316 29.006 29.484 7.807 1.00 23.86 H new ATOM 0 HZ PHE A 316 26.728 29.841 7.623 1.00 24.21 H new ATOM 2633 N PRO A 317 32.682 34.906 8.997 1.00 24.87 N ANISOU 2633 N PRO A 317 3098 3299 3052 51 110 -66 N ATOM 2634 CA PRO A 317 33.369 36.188 8.923 1.00 24.84 C ANISOU 2634 CA PRO A 317 3083 3306 3050 39 113 -58 C ATOM 2635 C PRO A 317 32.382 37.344 9.047 1.00 25.08 C ANISOU 2635 C PRO A 317 3120 3325 3085 25 112 -46 C ATOM 2636 O PRO A 317 31.201 37.176 8.729 1.00 24.72 O ANISOU 2636 O PRO A 317 3085 3270 3037 24 111 -44 O ATOM 2637 CB PRO A 317 33.988 36.167 7.522 1.00 25.02 C ANISOU 2637 CB PRO A 317 3095 3349 3063 38 122 -59 C ATOM 2638 CG PRO A 317 34.206 34.719 7.241 1.00 25.12 C ANISOU 2638 CG PRO A 317 3110 3365 3069 55 121 -72 C ATOM 2639 CD PRO A 317 33.045 34.019 7.876 1.00 25.12 C ANISOU 2639 CD PRO A 317 3127 3344 3074 60 114 -75 C ATOM 0 HA PRO A 317 34.018 36.311 9.633 1.00 24.84 H new ATOM 0 HB2 PRO A 317 33.397 36.570 6.867 1.00 25.02 H new ATOM 0 HB3 PRO A 317 34.821 36.663 7.495 1.00 25.02 H new ATOM 0 HG2 PRO A 317 34.239 34.548 6.287 1.00 25.12 H new ATOM 0 HG3 PRO A 317 35.047 34.412 7.614 1.00 25.12 H new ATOM 0 HD2 PRO A 317 32.309 33.910 7.253 1.00 25.12 H new ATOM 0 HD3 PRO A 317 33.288 33.132 8.186 1.00 25.12 H new ATOM 2640 N PRO A 318 32.856 38.518 9.496 1.00 25.73 N ANISOU 2640 N PRO A 318 3195 3408 3174 15 111 -40 N ATOM 2641 CA PRO A 318 31.934 39.647 9.626 1.00 25.65 C ANISOU 2641 CA PRO A 318 3191 3386 3168 3 108 -29 C ATOM 2642 C PRO A 318 31.284 39.996 8.294 1.00 25.18 C ANISOU 2642 C PRO A 318 3133 3331 3101 -4 114 -22 C ATOM 2643 O PRO A 318 31.882 39.776 7.235 1.00 24.16 O ANISOU 2643 O PRO A 318 2997 3219 2964 -4 121 -22 O ATOM 2644 CB PRO A 318 32.826 40.792 10.116 1.00 26.51 C ANISOU 2644 CB PRO A 318 3288 3497 3286 -6 105 -25 C ATOM 2645 CG PRO A 318 34.211 40.397 9.756 1.00 26.48 C ANISOU 2645 CG PRO A 318 3269 3511 3282 -3 110 -30 C ATOM 2646 CD PRO A 318 34.252 38.901 9.770 1.00 26.40 C ANISOU 2646 CD PRO A 318 3264 3504 3264 14 111 -42 C ATOM 0 HA PRO A 318 31.199 39.455 10.229 1.00 25.65 H new ATOM 0 HB2 PRO A 318 32.581 41.631 9.694 1.00 26.51 H new ATOM 0 HB3 PRO A 318 32.737 40.919 11.073 1.00 26.51 H new ATOM 0 HG2 PRO A 318 34.450 40.739 8.880 1.00 26.48 H new ATOM 0 HG3 PRO A 318 34.849 40.764 10.388 1.00 26.48 H new ATOM 0 HD2 PRO A 318 34.857 38.554 9.096 1.00 26.40 H new ATOM 0 HD3 PRO A 318 34.555 38.560 10.626 1.00 26.40 H new ATOM 2647 N GLU A 319 30.067 40.530 8.355 1.00 25.13 N ANISOU 2647 N GLU A 319 3139 3313 3097 -10 110 -16 N ATOM 2648 CA GLU A 319 29.352 40.983 7.164 1.00 26.00 C ANISOU 2648 CA GLU A 319 3253 3426 3200 -17 114 -9 C ATOM 2649 C GLU A 319 30.224 41.875 6.287 1.00 26.38 C ANISOU 2649 C GLU A 319 3289 3488 3245 -26 121 1 C ATOM 2650 O GLU A 319 30.198 41.759 5.063 1.00 26.62 O ANISOU 2650 O GLU A 319 3319 3532 3265 -26 128 4 O ATOM 2651 CB GLU A 319 28.079 41.744 7.551 1.00 26.45 C ANISOU 2651 CB GLU A 319 3320 3467 3261 -22 108 -3 C ATOM 2652 CG GLU A 319 26.989 40.874 8.164 1.00 26.09 C ANISOU 2652 CG GLU A 319 3287 3410 3218 -14 104 -9 C ATOM 2653 CD GLU A 319 27.025 40.838 9.682 1.00 26.87 C ANISOU 2653 CD GLU A 319 3387 3498 3324 -9 98 -12 C ATOM 2654 OE1 GLU A 319 28.106 41.023 10.280 1.00 27.40 O ANISOU 2654 OE1 GLU A 319 3447 3570 3396 -8 97 -14 O ATOM 2655 OE2 GLU A 319 25.960 40.612 10.285 1.00 27.85 O ANISOU 2655 OE2 GLU A 319 3521 3611 3452 -6 95 -12 O ATOM 0 H GLU A 319 29.632 40.640 9.089 1.00 25.13 H new ATOM 0 HA GLU A 319 29.115 40.190 6.658 1.00 26.00 H new ATOM 0 HB2 GLU A 319 28.312 42.444 8.181 1.00 26.45 H new ATOM 0 HB3 GLU A 319 27.723 42.181 6.761 1.00 26.45 H new ATOM 0 HG2 GLU A 319 26.123 41.202 7.876 1.00 26.09 H new ATOM 0 HG3 GLU A 319 27.077 39.970 7.824 1.00 26.09 H new ATOM 2656 N GLU A 320 31.010 42.743 6.923 1.00 26.71 N ANISOU 2656 N GLU A 320 3323 3529 3298 -35 119 6 N ATOM 2657 CA GLU A 320 31.839 43.721 6.214 1.00 27.40 C ANISOU 2657 CA GLU A 320 3398 3628 3387 -47 125 18 C ATOM 2658 C GLU A 320 32.946 43.063 5.372 1.00 28.51 C ANISOU 2658 C GLU A 320 3524 3789 3518 -42 136 15 C ATOM 2659 O GLU A 320 33.431 43.666 4.411 1.00 28.64 O ANISOU 2659 O GLU A 320 3532 3819 3530 -50 145 27 O ATOM 2660 CB GLU A 320 32.454 44.724 7.205 1.00 27.02 C ANISOU 2660 CB GLU A 320 3341 3569 3354 -56 118 21 C ATOM 2661 CG GLU A 320 31.430 45.583 7.949 1.00 26.76 C ANISOU 2661 CG GLU A 320 3321 3517 3330 -61 106 24 C ATOM 2662 CD GLU A 320 30.869 44.932 9.205 1.00 26.48 C ANISOU 2662 CD GLU A 320 3294 3469 3296 -49 98 12 C ATOM 2663 OE1 GLU A 320 31.032 43.710 9.384 1.00 26.11 O ANISOU 2663 OE1 GLU A 320 3248 3428 3244 -37 100 2 O ATOM 2664 OE2 GLU A 320 30.253 45.645 10.023 1.00 26.51 O ANISOU 2664 OE2 GLU A 320 3306 3460 3308 -50 88 12 O ATOM 0 H GLU A 320 31.078 42.782 7.779 1.00 26.71 H new ATOM 0 HA GLU A 320 31.253 44.190 5.599 1.00 27.40 H new ATOM 0 HB2 GLU A 320 32.985 44.237 7.855 1.00 27.02 H new ATOM 0 HB3 GLU A 320 33.061 45.308 6.723 1.00 27.02 H new ATOM 0 HG2 GLU A 320 31.844 46.426 8.191 1.00 26.76 H new ATOM 0 HG3 GLU A 320 30.697 45.789 7.348 1.00 26.76 H new ATOM 2665 N ALA A 321 33.335 41.841 5.745 1.00 29.10 N ANISOU 2665 N ALA A 321 3598 3869 3590 -28 135 1 N ATOM 2666 CA ALA A 321 34.337 41.052 5.014 1.00 29.80 C ANISOU 2666 CA ALA A 321 3675 3980 3669 -20 144 -4 C ATOM 2667 C ALA A 321 33.767 40.323 3.795 1.00 31.18 C ANISOU 2667 C ALA A 321 3856 4164 3826 -11 150 -7 C ATOM 2668 O ALA A 321 34.528 39.770 2.993 1.00 31.75 O ANISOU 2668 O ALA A 321 3919 4257 3888 -3 158 -11 O ATOM 2669 CB ALA A 321 34.996 40.044 5.948 1.00 30.23 C ANISOU 2669 CB ALA A 321 3725 4033 3727 -7 139 -20 C ATOM 0 H ALA A 321 33.021 41.441 6.438 1.00 29.10 H new ATOM 0 HA ALA A 321 34.993 41.686 4.683 1.00 29.80 H new ATOM 0 HB1 ALA A 321 35.655 39.529 5.456 1.00 30.23 H new ATOM 0 HB2 ALA A 321 35.432 40.514 6.676 1.00 30.23 H new ATOM 0 HB3 ALA A 321 34.322 39.446 6.307 1.00 30.23 H new ATOM 2670 N GLU A 322 32.441 40.302 3.668 1.00 30.79 N ANISOU 2670 N GLU A 322 3823 4101 3775 -10 145 -6 N ATOM 2671 CA GLU A 322 31.775 39.693 2.517 1.00 32.60 C ANISOU 2671 CA GLU A 322 4059 4338 3989 -2 147 -10 C ATOM 2672 C GLU A 322 30.975 40.785 1.804 1.00 35.61 C ANISOU 2672 C GLU A 322 4446 4716 4366 -12 149 4 C ATOM 2673 O GLU A 322 29.762 40.688 1.603 1.00 36.52 O ANISOU 2673 O GLU A 322 4575 4821 4479 -10 144 3 O ATOM 2674 CB GLU A 322 30.955 38.479 2.970 1.00 30.54 C ANISOU 2674 CB GLU A 322 3810 4063 3729 11 139 -25 C ATOM 2675 CG GLU A 322 31.883 37.379 3.474 1.00 29.95 C ANISOU 2675 CG GLU A 322 3730 3994 3657 23 138 -38 C ATOM 2676 CD GLU A 322 31.203 36.124 3.988 1.00 28.89 C ANISOU 2676 CD GLU A 322 3607 3845 3526 34 129 -51 C ATOM 2677 OE1 GLU A 322 31.935 35.266 4.514 1.00 28.28 O ANISOU 2677 OE1 GLU A 322 3525 3769 3451 44 127 -61 O ATOM 2678 OE2 GLU A 322 29.970 35.980 3.878 1.00 27.79 O ANISOU 2678 OE2 GLU A 322 3479 3692 3388 34 124 -52 O ATOM 0 H GLU A 322 31.902 40.640 4.247 1.00 30.79 H new ATOM 0 HA GLU A 322 32.406 39.338 1.871 1.00 32.60 H new ATOM 0 HB2 GLU A 322 30.339 38.740 3.673 1.00 30.54 H new ATOM 0 HB3 GLU A 322 30.420 38.148 2.232 1.00 30.54 H new ATOM 0 HG2 GLU A 322 32.482 37.129 2.753 1.00 29.95 H new ATOM 0 HG3 GLU A 322 32.432 37.744 4.186 1.00 29.95 H new ATOM 2679 N THR A 323 31.727 41.823 1.431 1.00 40.64 N ANISOU 2679 N THR A 323 5073 5364 5004 -24 157 19 N ATOM 2680 CA THR A 323 31.246 43.079 0.840 1.00 44.61 C ANISOU 2680 CA THR A 323 5579 5864 5505 -36 159 37 C ATOM 2681 C THR A 323 29.927 43.580 1.418 1.00 46.19 C ANISOU 2681 C THR A 323 5795 6041 5713 -41 148 38 C ATOM 2682 O THR A 323 29.919 44.500 2.236 1.00 48.39 O ANISOU 2682 O THR A 323 6074 6307 6007 -53 143 44 O ATOM 2683 CB THR A 323 31.179 43.006 -0.703 1.00 46.93 C ANISOU 2683 CB THR A 323 5873 6178 5778 -30 169 43 C ATOM 2684 OG1 THR A 323 31.163 44.334 -1.242 1.00 49.85 O ANISOU 2684 OG1 THR A 323 6243 6550 6148 -44 174 63 O ATOM 2685 CG2 THR A 323 29.944 42.250 -1.173 1.00 47.62 C ANISOU 2685 CG2 THR A 323 5977 6261 5856 -18 162 31 C ATOM 0 H THR A 323 32.582 41.814 1.521 1.00 40.64 H new ATOM 0 HA THR A 323 31.913 43.738 1.089 1.00 44.61 H new ATOM 0 HB THR A 323 31.961 42.527 -1.018 1.00 46.93 H new ATOM 0 HG1 THR A 323 31.128 44.296 -2.080 1.00 49.85 H new ATOM 0 HG21 THR A 323 29.931 42.222 -2.143 1.00 47.62 H new ATOM 0 HG22 THR A 323 29.966 41.345 -0.824 1.00 47.62 H new ATOM 0 HG23 THR A 323 29.147 42.701 -0.852 1.00 47.62 H new TER 2686 THR A 323 HETATM 2687 C1 1X7 A 401 21.606 34.765 20.202 1.00 34.97 C ANISOU 2687 C1 1X7 A 401 4474 4445 4369 79 104 13 C HETATM 2688 C2 1X7 A 401 20.963 34.559 18.915 1.00 34.68 C ANISOU 2688 C2 1X7 A 401 4434 4404 4339 66 105 11 C HETATM 2689 C3 1X7 A 401 20.337 33.305 18.852 1.00 34.25 C ANISOU 2689 C3 1X7 A 401 4381 4338 4293 66 110 17 C HETATM 2690 N6 1X7 A 401 20.227 35.029 16.680 1.00 33.05 N ANISOU 2690 N6 1X7 A 401 4222 4198 4139 45 103 4 N HETATM 2691 C7 1X7 A 401 20.887 35.404 17.768 1.00 33.50 C ANISOU 2691 C7 1X7 A 401 4280 4259 4190 54 102 6 C HETATM 2692 C9 1X7 A 401 18.958 31.659 17.537 1.00 35.25 C ANISOU 2692 C9 1X7 A 401 4507 4446 4441 54 113 18 C HETATM 2693 C13 1X7 A 401 21.468 33.763 21.057 1.00 35.10 C ANISOU 2693 C13 1X7 A 401 4495 4455 4385 90 109 21 C HETATM 2694 C4 1X7 A 401 19.659 32.949 17.652 1.00 34.15 C ANISOU 2694 C4 1X7 A 401 4366 4320 4289 55 110 14 C HETATM 2695 C5 1X7 A 401 19.619 33.859 16.595 1.00 33.67 C ANISOU 2695 C5 1X7 A 401 4301 4265 4225 45 106 7 C HETATM 2696 N8 1X7 A 401 21.498 36.642 17.785 1.00 34.34 N ANISOU 2696 N8 1X7 A 401 4384 4374 4291 52 97 2 N HETATM 2697 O10 1X7 A 401 19.067 30.832 18.412 1.00 35.52 O ANISOU 2697 O10 1X7 A 401 4545 4474 4478 62 117 25 O HETATM 2698 N11 1X7 A 401 18.178 31.397 16.471 1.00 36.88 N ANISOU 2698 N11 1X7 A 401 4711 4647 4657 44 112 14 N HETATM 2699 S12 1X7 A 401 20.563 32.434 20.371 1.00 35.70 S ANISOU 2699 S12 1X7 A 401 4572 4518 4475 82 115 26 S HETATM 2700 BR1 1X7 A 401 22.152 33.715 22.814 0.50 33.91 BR ANISOU 2700 BR1 1X7 A 401 4351 4310 4224 112 108 25 BR HETATM 2701 O3P NMN A 402 -0.392 48.645 10.558 1.00 29.63 O ANISOU 2701 O3P NMN A 402 3766 3772 3719 21 13 -26 O HETATM 2702 P NMN A 402 -1.357 49.869 10.448 1.00 29.36 P ANISOU 2702 P NMN A 402 3734 3740 3680 30 1 -32 P HETATM 2703 O1P NMN A 402 -2.626 49.639 11.339 1.00 29.82 O ANISOU 2703 O1P NMN A 402 3779 3806 3747 37 6 -34 O HETATM 2704 O2P NMN A 402 -0.619 51.164 10.939 1.00 30.09 O ANISOU 2704 O2P NMN A 402 3840 3832 3762 36 -7 -29 O HETATM 2705 O5R NMN A 402 -1.740 50.021 8.889 1.00 30.24 O ANISOU 2705 O5R NMN A 402 3850 3849 3791 27 -11 -40 O HETATM 2706 C5R NMN A 402 -0.862 50.655 7.949 1.00 30.20 C ANISOU 2706 C5R NMN A 402 3860 3840 3776 24 -18 -38 C HETATM 2707 C4R NMN A 402 -1.081 50.188 6.502 1.00 30.39 C ANISOU 2707 C4R NMN A 402 3885 3863 3800 21 -23 -45 C HETATM 2708 O4R NMN A 402 -0.993 48.745 6.387 1.00 29.48 O ANISOU 2708 O4R NMN A 402 3760 3747 3695 14 -14 -46 O HETATM 2709 C3R NMN A 402 -2.468 50.604 5.952 1.00 31.66 C ANISOU 2709 C3R NMN A 402 4042 4025 3963 28 -35 -55 C HETATM 2710 O3R NMN A 402 -2.351 50.963 4.570 1.00 32.90 O ANISOU 2710 O3R NMN A 402 4210 4181 4111 29 -45 -58 O HETATM 2711 C2R NMN A 402 -3.295 49.311 6.115 1.00 30.68 C ANISOU 2711 C2R NMN A 402 3900 3902 3854 25 -28 -61 C HETATM 2712 O2R NMN A 402 -4.350 49.204 5.155 1.00 32.49 O ANISOU 2712 O2R NMN A 402 4125 4133 4088 29 -39 -73 O HETATM 2713 C1R NMN A 402 -2.238 48.213 5.873 1.00 29.41 C ANISOU 2713 C1R NMN A 402 3740 3739 3695 16 -19 -57 C HETATM 2714 N1 NMN A 402 -2.616 46.997 6.600 1.00 28.46 N ANISOU 2714 N1 NMN A 402 3604 3617 3591 12 -8 -56 N HETATM 2715 C2 NMN A 402 -3.348 46.089 5.970 1.00 27.68 C ANISOU 2715 C2 NMN A 402 3495 3517 3505 10 -11 -65 C HETATM 2716 C3 NMN A 402 -3.743 44.914 6.622 1.00 26.82 C ANISOU 2716 C3 NMN A 402 3371 3404 3414 4 -1 -64 C HETATM 2717 C7 NMN A 402 -4.562 43.898 5.914 1.00 26.58 C ANISOU 2717 C7 NMN A 402 3328 3370 3401 1 -6 -74 C HETATM 2718 O7 NMN A 402 -5.029 42.969 6.531 1.00 26.02 O ANISOU 2718 O7 NMN A 402 3243 3296 3349 -5 2 -72 O HETATM 2719 N7 NMN A 402 -4.804 43.982 4.589 1.00 25.87 N ANISOU 2719 N7 NMN A 402 3243 3279 3308 4 -20 -87 N HETATM 2720 C4 NMN A 402 -3.344 44.726 7.959 1.00 26.99 C ANISOU 2720 C4 NMN A 402 3390 3428 3438 3 13 -51 C HETATM 2721 C5 NMN A 402 -2.585 45.705 8.585 1.00 27.00 C ANISOU 2721 C5 NMN A 402 3402 3433 3423 7 15 -44 C HETATM 2722 C6 NMN A 402 -2.234 46.839 7.865 1.00 27.83 C ANISOU 2722 C6 NMN A 402 3522 3539 3514 11 3 -47 C HETATM 0 HN72 NMN A 402 -5.281 43.382 4.200 1.00 25.87 H new HETATM 0 HN71 NMN A 402 -4.481 44.636 4.133 1.00 25.87 H new HETATM 0 H5R2 NMN A 402 -0.989 51.616 7.995 1.00 30.20 H new HETATM 0 H5R1 NMN A 402 0.057 50.478 8.204 1.00 30.20 H new HETATM 0 H4RC NMN A 402 -0.379 50.616 5.987 1.00 30.39 H new HETATM 0 H3RO NMN A 402 -3.069 51.313 4.310 1.00 32.90 H new HETATM 0 H3RC NMN A 402 -2.862 51.368 6.402 1.00 31.66 H new HETATM 0 H2RO NMN A 402 -5.033 49.598 5.444 1.00 32.49 H new HETATM 0 H2RC NMN A 402 -3.740 49.264 6.975 1.00 30.68 H new HETATM 0 H1RC NMN A 402 -2.161 47.981 4.934 1.00 29.41 H new HETATM 0 HC6 NMN A 402 -1.701 47.528 8.291 1.00 27.83 H new HETATM 0 HC5 NMN A 402 -2.305 45.599 9.508 1.00 27.00 H new HETATM 0 HC4 NMN A 402 -3.597 43.921 8.437 1.00 26.99 H new HETATM 0 HC2 NMN A 402 -3.613 46.240 5.049 1.00 27.68 H new HETATM 2723 C ACT A 403 31.939 27.669 6.414 1.00 32.99 C ANISOU 2723 C ACT A 403 4155 4311 4069 123 87 -130 C HETATM 2724 O ACT A 403 31.431 28.035 5.341 1.00 33.99 O ANISOU 2724 O ACT A 403 4280 4445 4188 119 89 -130 O HETATM 2725 OXT ACT A 403 32.265 28.491 7.293 1.00 32.90 O ANISOU 2725 OXT ACT A 403 4140 4301 4061 115 92 -120 O HETATM 2726 CH3 ACT A 403 32.159 26.208 6.655 1.00 32.56 C ANISOU 2726 CH3 ACT A 403 4106 4246 4019 139 78 -143 C HETATM 0 H3 ACT A 403 31.309 25.742 6.619 1.00 32.56 H new HETATM 0 H2 ACT A 403 32.751 25.853 5.974 1.00 32.56 H new HETATM 0 H1 ACT A 403 32.560 26.081 7.529 1.00 32.56 H new HETATM 2727 NA NA A 404 8.142 51.187 11.451 1.00 36.18 NA ANISOU 2727 NA NA A 404 4644 4586 4516 2 10 4 NA HETATM 2728 NA NA A 405 26.312 34.075 -1.670 1.00 28.15 NA ANISOU 2728 NA NA A 405 3553 3755 3387 71 109 -84 NA HETATM 2729 O HOH A 501 -15.076 56.367 28.725 1.00 38.88 O ANISOU 2729 O HOH A 501 4774 5254 4746 364 78 -51 O HETATM 2730 O HOH A 502 15.297 30.659 14.387 1.00 32.49 O ANISOU 2730 O HOH A 502 4145 4070 4131 21 107 9 O HETATM 2731 O HOH A 503 26.763 34.452 0.785 1.00 22.97 O ANISOU 2731 O HOH A 503 2894 3076 2758 53 111 -72 O HETATM 2732 O HOH A 504 10.110 55.561 23.592 1.00 26.10 O ANISOU 2732 O HOH A 504 3379 3329 3210 136 -50 -42 O HETATM 2733 O HOH A 505 7.253 38.687 16.384 1.00 20.94 O ANISOU 2733 O HOH A 505 2658 2649 2650 10 112 37 O HETATM 2734 O HOH A 506 19.664 45.429 12.288 1.00 19.82 O ANISOU 2734 O HOH A 506 2539 2545 2447 -19 64 10 O HETATM 2735 O HOH A 507 24.840 38.629 6.746 1.00 22.01 O ANISOU 2735 O HOH A 507 2785 2885 2692 0 103 -23 O HETATM 2736 O HOH A 508 26.972 27.767 24.657 1.00 26.27 O ANISOU 2736 O HOH A 508 3408 3322 3251 180 99 15 O HETATM 2737 O HOH A 509 22.580 37.628 5.517 1.00 25.63 O ANISOU 2737 O HOH A 509 3256 3333 3150 5 97 -31 O HETATM 2738 O HOH A 510 14.479 47.944 -1.746 1.00 43.31 O ANISOU 2738 O HOH A 510 5559 5569 5329 -24 55 31 O HETATM 2739 O HOH A 511 19.757 43.186 8.841 1.00 21.72 O ANISOU 2739 O HOH A 511 2776 2802 2675 -24 80 5 O HETATM 2740 O HOH A 512 -21.244 48.789 31.871 1.00 44.55 O ANISOU 2740 O HOH A 512 5285 6097 5545 314 301 113 O HETATM 2741 O HOH A 513 2.767 39.167 15.202 1.00 26.02 O ANISOU 2741 O HOH A 513 3272 3291 3324 -3 107 31 O HETATM 2742 O HOH A 514 10.848 41.972 28.606 1.00 26.79 O ANISOU 2742 O HOH A 514 3440 3474 3266 170 128 71 O HETATM 2743 O HOH A 515 27.981 35.830 -2.338 1.00 40.18 O ANISOU 2743 O HOH A 515 5060 5314 4891 60 130 -60 O HETATM 2744 O HOH A 516 9.850 52.696 24.428 1.00 26.45 O ANISOU 2744 O HOH A 516 3411 3395 3241 141 -7 -23 O HETATM 2745 O HOH A 517 29.767 50.961 16.495 1.00 23.78 O ANISOU 2745 O HOH A 517 2972 3040 3024 -40 1 -13 O HETATM 2746 O HOH A 518 -23.885 53.459 28.902 1.00 39.54 O ANISOU 2746 O HOH A 518 4651 5467 4906 357 190 -9 O HETATM 2747 O HOH A 519 9.134 49.067 11.967 1.00 27.06 O ANISOU 2747 O HOH A 519 3479 3436 3365 -1 29 6 O HETATM 2748 O HOH A 520 -0.876 46.734 12.652 1.00 29.33 O ANISOU 2748 O HOH A 520 3706 3740 3699 22 41 -14 O HETATM 2749 O HOH A 521 18.180 13.572 19.859 1.00 35.85 O ANISOU 2749 O HOH A 521 4642 4247 4733 92 83 90 O HETATM 2750 O HOH A 522 3.392 33.719 13.576 1.00 26.44 O ANISOU 2750 O HOH A 522 3312 3292 3443 -30 110 29 O HETATM 2751 O HOH A 523 25.261 40.245 4.306 1.00 42.02 O ANISOU 2751 O HOH A 523 5314 5445 5207 -11 111 -10 O HETATM 2752 O HOH A 524 27.822 45.141 15.074 1.00 26.73 O ANISOU 2752 O HOH A 524 3368 3447 3342 -9 56 -12 O HETATM 2753 O HOH A 525 23.711 37.167 -3.504 1.00 28.92 O ANISOU 2753 O HOH A 525 3668 3854 3466 50 108 -54 O HETATM 2754 O HOH A 526 28.878 17.363 5.998 1.00 37.32 O ANISOU 2754 O HOH A 526 4768 4704 4709 202 -7 -211 O HETATM 2755 O HOH A 527 -17.506 53.237 16.035 1.00 29.49 O ANISOU 2755 O HOH A 527 3562 3904 3737 162 0 -98 O HETATM 2756 O HOH A 528 -5.633 40.275 6.029 1.00 27.57 O ANISOU 2756 O HOH A 528 3414 3473 3588 -19 4 -81 O HETATM 2757 O HOH A 529 21.386 45.597 24.366 1.00 33.39 O ANISOU 2757 O HOH A 529 4273 4270 4143 107 28 -20 O HETATM 2758 O HOH A 530 18.210 16.158 20.655 1.00 28.16 O ANISOU 2758 O HOH A 530 3661 3327 3712 92 106 97 O HETATM 2759 O HOH A 531 7.945 44.294 12.000 1.00 23.87 O ANISOU 2759 O HOH A 531 3053 3034 2983 -3 61 4 O HETATM 2760 O HOH A 532 8.818 52.113 26.869 1.00 33.31 O ANISOU 2760 O HOH A 532 4278 4293 4086 185 6 -21 O HETATM 2761 O HOH A 533 14.562 33.907 5.361 1.00 29.85 O ANISOU 2761 O HOH A 533 3804 3787 3750 6 65 -58 O HETATM 2762 O HOH A 534 11.388 18.085 17.210 1.00 33.59 O ANISOU 2762 O HOH A 534 4281 3999 4483 1 108 89 O HETATM 2763 O HOH A 535 6.918 47.505 11.610 1.00 27.24 O ANISOU 2763 O HOH A 535 3491 3462 3397 2 38 0 O HETATM 2764 O HOH A 536 -25.900 49.588 22.193 1.00 30.37 O ANISOU 2764 O HOH A 536 3427 4187 3927 194 157 -28 O HETATM 2765 O HOH A 537 -20.829 43.232 19.430 1.00 35.33 O ANISOU 2765 O HOH A 537 4112 4659 4653 51 173 31 O HETATM 2766 O HOH A 538 25.632 47.078 32.767 1.00 42.84 O ANISOU 2766 O HOH A 538 5487 5502 5290 261 -55 -91 O HETATM 2767 O HOH A 539 -1.889 32.724 32.253 1.00 56.87 O ANISOU 2767 O HOH A 539 7112 7302 7193 123 351 314 O HETATM 2768 O HOH A 540 16.403 65.323 0.304 1.00 35.44 O ANISOU 2768 O HOH A 540 4630 4392 4442 -129 -46 202 O HETATM 2769 O HOH A 541 33.439 31.360 23.139 1.00 45.68 O ANISOU 2769 O HOH A 541 5810 5853 5695 182 58 -67 O HETATM 2770 O HOH A 542 -15.780 52.190 9.733 1.00 30.75 O ANISOU 2770 O HOH A 542 3775 3988 3922 107 -60 -129 O HETATM 2771 O HOH A 543 13.671 39.418 30.510 1.00 32.65 O ANISOU 2771 O HOH A 543 4200 4215 3992 199 139 86 O HETATM 2772 O HOH A 544 26.384 44.187 17.237 1.00 40.44 O ANISOU 2772 O HOH A 544 5123 5173 5071 19 52 -18 O HETATM 2773 O HOH A 545 5.718 58.106 12.494 1.00 33.50 O ANISOU 2773 O HOH A 545 4339 4215 4174 35 -68 -11 O HETATM 2774 O HOH A 546 15.881 26.004 25.427 1.00 32.01 O ANISOU 2774 O HOH A 546 4126 3978 4058 108 177 142 O HETATM 2775 O HOH A 547 -7.993 47.904 -0.540 1.00 33.42 O ANISOU 2775 O HOH A 547 4229 4252 4216 52 -102 -141 O HETATM 2776 O HOH A 548 8.720 32.302 29.638 1.00 31.31 O ANISOU 2776 O HOH A 548 3996 3992 3910 135 235 198 O HETATM 2777 O HOH A 549 13.127 46.653 3.306 1.00 47.99 O ANISOU 2777 O HOH A 549 6136 6121 5975 -30 48 10 O HETATM 2778 O HOH A 550 25.039 53.421 3.865 1.00 29.48 O ANISOU 2778 O HOH A 550 3735 3793 3672 -118 78 110 O HETATM 2779 O HOH A 551 -15.028 53.584 7.105 1.00 35.90 O ANISOU 2779 O HOH A 551 4470 4619 4550 113 -101 -146 O HETATM 2780 O HOH A 552 22.402 40.330 19.239 1.00 35.93 O ANISOU 2780 O HOH A 552 4581 4587 4482 55 77 -3 O HETATM 2781 O HOH A 553 15.090 15.370 18.309 1.00 33.20 O ANISOU 2781 O HOH A 553 4271 3922 4420 46 92 86 O HETATM 2782 O HOH A 554 23.294 54.231 1.758 1.00 26.74 O ANISOU 2782 O HOH A 554 3411 3447 3301 -116 79 129 O HETATM 2783 O HOH A 555 28.220 47.855 15.264 1.00 23.87 O ANISOU 2783 O HOH A 555 3000 3073 2999 -26 37 -7 O HETATM 2784 O HOH A 556 9.038 50.801 14.111 1.00 28.34 O ANISOU 2784 O HOH A 556 3646 3597 3525 16 16 3 O HETATM 2785 O HOH A 557 30.894 42.962 12.141 1.00 28.49 O ANISOU 2785 O HOH A 557 3559 3711 3554 -16 84 -15 O HETATM 2786 O HOH A 558 31.056 16.144 27.795 1.00 33.83 O ANISOU 2786 O HOH A 558 4457 4163 4235 310 67 44 O HETATM 2787 O HOH A 559 -9.790 41.631 21.952 1.00 39.51 O ANISOU 2787 O HOH A 559 4831 5117 5065 56 190 92 O HETATM 2788 O HOH A 560 -17.947 50.445 9.251 1.00 28.50 O ANISOU 2788 O HOH A 560 3437 3710 3681 95 -54 -141 O HETATM 2789 O HOH A 561 13.793 60.834 20.035 1.00 38.44 O ANISOU 2789 O HOH A 561 4958 4806 4839 66 -131 -46 O HETATM 2790 O HOH A 562 12.379 35.297 6.503 1.00 31.73 O ANISOU 2790 O HOH A 562 4040 4015 4001 -6 66 -43 O HETATM 2791 O HOH A 563 16.328 25.266 5.265 1.00 33.95 O ANISOU 2791 O HOH A 563 4323 4235 4340 46 31 -112 O HETATM 2792 O HOH A 564 30.653 48.233 10.836 1.00 25.37 O ANISOU 2792 O HOH A 564 3155 3296 3189 -70 70 22 O HETATM 2793 O HOH A 565 -2.079 45.319 15.666 1.00 30.78 O ANISOU 2793 O HOH A 565 3862 3938 3894 34 74 7 O HETATM 2794 O HOH A 566 16.285 29.272 1.483 1.00 37.96 O ANISOU 2794 O HOH A 566 4830 4816 4775 49 32 -125 O HETATM 2795 O HOH A 567 10.810 43.774 6.550 1.00 37.35 O ANISOU 2795 O HOH A 567 4772 4752 4666 -20 52 -9 O HETATM 2796 O HOH A 568 14.111 20.067 9.349 1.00 36.20 O ANISOU 2796 O HOH A 568 4610 4398 4745 28 28 -69 O HETATM 2797 O HOH A 569 20.042 48.815 25.907 1.00 29.60 O ANISOU 2797 O HOH A 569 3801 3787 3658 131 -7 -36 O HETATM 2798 O HOH A 570 23.849 37.992 16.506 1.00 34.68 O ANISOU 2798 O HOH A 570 4414 4435 4329 42 88 -12 O HETATM 2799 O HOH A 571 -4.548 51.883 3.364 1.00 32.01 O ANISOU 2799 O HOH A 571 4095 4071 3996 44 -70 -77 O HETATM 2800 O HOH A 572 6.684 23.013 30.102 1.00 51.63 O ANISOU 2800 O HOH A 572 6553 6434 6628 74 301 333 O HETATM 2801 O HOH A 573 6.673 47.828 30.764 1.00 37.88 O ANISOU 2801 O HOH A 573 4838 4931 4622 240 90 35 O HETATM 2802 O HOH A 574 6.522 32.572 11.715 1.00 34.35 O ANISOU 2802 O HOH A 574 4337 4287 4429 -25 93 4 O HETATM 2803 O HOH A 575 -6.727 37.838 17.079 1.00 42.05 O ANISOU 2803 O HOH A 575 5185 5339 5455 -18 148 62 O HETATM 2804 O HOH A 576 -4.795 44.699 20.930 1.00 35.61 O ANISOU 2804 O HOH A 576 4431 4601 4499 77 131 49 O HETATM 2805 O HOH A 577 -4.130 45.807 13.820 1.00 30.48 O ANISOU 2805 O HOH A 577 3812 3899 3871 29 55 -13 O HETATM 2806 O HOH A 578 -21.855 43.795 26.199 1.00 36.24 O ANISOU 2806 O HOH A 578 4184 4898 4687 132 289 126 O HETATM 2807 O HOH A 579 25.064 13.717 17.430 1.00 30.80 O ANISOU 2807 O HOH A 579 4017 3684 4001 171 31 -27 O HETATM 2808 O HOH A 580 28.190 36.478 1.887 1.00 26.08 O ANISOU 2808 O HOH A 580 3275 3479 3156 31 124 -47 O HETATM 2809 O HOH A 581 31.846 14.618 16.525 1.00 30.70 O ANISOU 2809 O HOH A 581 3990 3778 3898 248 9 -113 O HETATM 2810 O HOH A 582 -14.853 50.718 2.749 1.00 47.58 O ANISOU 2810 O HOH A 582 5949 6074 6055 87 -124 -174 O HETATM 2811 O HOH A 583 6.120 50.842 12.092 1.00 38.38 O ANISOU 2811 O HOH A 583 4915 4869 4798 13 11 -3 O HETATM 2812 O HOH A 584 25.400 21.943 1.749 1.00 40.39 O ANISOU 2812 O HOH A 584 5138 5152 5058 155 13 -203 O HETATM 2813 O HOH A 585 17.517 28.782 22.139 1.00 37.18 O ANISOU 2813 O HOH A 585 4768 4661 4697 87 143 75 O HETATM 2814 O HOH A 586 34.262 30.706 10.548 1.00 33.82 O ANISOU 2814 O HOH A 586 4240 4423 4186 103 96 -102 O HETATM 2815 O HOH A 587 19.977 23.444 30.358 1.00 36.91 O ANISOU 2815 O HOH A 587 4800 4604 4619 205 182 178 O HETATM 2816 O HOH A 588 7.937 65.110 14.165 1.00 44.10 O ANISOU 2816 O HOH A 588 5723 5479 5554 47 -171 -20 O HETATM 2817 O HOH A 589 -0.907 33.213 15.173 1.00 36.07 O ANISOU 2817 O HOH A 589 4483 4508 4714 -43 133 57 O HETATM 2818 O HOH A 590 28.320 32.962 -2.030 1.00 38.08 O ANISOU 2818 O HOH A 590 4797 5041 4632 90 115 -98 O HETATM 2819 O HOH A 591 18.607 54.154 30.042 1.00 36.92 O ANISOU 2819 O HOH A 591 4748 4715 4567 216 -94 -92 O HETATM 2820 O HOH A 592 8.816 15.371 21.165 1.00 43.54 O ANISOU 2820 O HOH A 592 5531 5196 5815 -19 159 203 O HETATM 2821 O HOH A 593 25.038 33.414 -3.423 1.00 35.23 O ANISOU 2821 O HOH A 593 4459 4656 4269 88 97 -102 O HETATM 2822 O HOH A 594 17.045 32.371 12.929 1.00 26.51 O ANISOU 2822 O HOH A 594 3388 3340 3346 21 99 -9 O HETATM 2823 O HOH A 595 24.818 51.772 0.131 0.50 26.99 O ANISOU 2823 O HOH A 595 3425 3528 3303 -102 112 123 O HETATM 2824 O HOH A 596 14.522 52.181 8.452 1.00 26.11 O ANISOU 2824 O HOH A 596 3372 3312 3237 -42 19 34 O HETATM 2825 O HOH A 597 9.505 33.511 32.471 1.00 39.21 O ANISOU 2825 O HOH A 597 5013 5032 4854 193 240 206 O HETATM 2826 O HOH A 598 4.810 22.842 18.099 1.00 38.88 O ANISOU 2826 O HOH A 598 4883 4729 5161 -48 158 132 O HETATM 2827 O HOH A 599 10.781 45.787 34.378 1.00 34.82 O ANISOU 2827 O HOH A 599 4478 4560 4192 301 94 42 O HETATM 2828 O HOH A 600 29.145 25.042 23.819 1.00 35.48 O ANISOU 2828 O HOH A 600 4579 4477 4425 200 87 -6 O HETATM 2829 O HOH A 601 29.072 8.632 26.580 1.00 36.79 O ANISOU 2829 O HOH A 601 4883 4368 4728 306 38 91 O HETATM 2830 O HOH A 602 -8.637 53.695 8.882 1.00 34.85 O ANISOU 2830 O HOH A 602 4406 4458 4378 82 -64 -87 O HETATM 2831 O HOH A 603 0.803 30.940 31.426 1.00 40.80 O ANISOU 2831 O HOH A 603 5112 5219 5173 107 331 306 O HETATM 2832 O HOH A 604 6.688 43.759 9.532 1.00 37.08 O ANISOU 2832 O HOH A 604 4723 4704 4661 -11 52 -9 O HETATM 2833 O HOH A 605 8.804 55.254 6.838 1.00 44.06 O ANISOU 2833 O HOH A 605 5676 5566 5499 -21 -24 25 O HETATM 2834 O HOH A 606 31.673 33.698 23.192 1.00 44.64 O ANISOU 2834 O HOH A 606 5678 5718 5566 158 61 -54 O HETATM 2835 O HOH A 607 20.971 5.852 20.121 1.00 43.24 O ANISOU 2835 O HOH A 607 5638 5025 5764 148 6 83 O HETATM 2836 O HOH A 608 38.840 27.836 15.881 1.00 46.21 O ANISOU 2836 O HOH A 608 5808 5988 5761 182 63 -139 O HETATM 2837 O HOH A 609 32.599 41.163 13.965 1.00 46.05 O ANISOU 2837 O HOH A 609 5776 5941 5779 12 79 -37 O HETATM 2838 O HOH A 610 -9.692 58.736 22.989 1.00 38.87 O ANISOU 2838 O HOH A 610 4890 5089 4788 267 -37 -90 O HETATM 2839 O HOH A 611 24.004 56.823 0.948 1.00 31.96 O ANISOU 2839 O HOH A 611 4073 4091 3978 -141 75 168 O HETATM 2840 O HOH A 612 21.107 34.184 -6.075 1.00 47.19 O ANISOU 2840 O HOH A 612 5999 6160 5770 98 69 -114 O HETATM 2841 O HOH A 613 36.390 18.224 22.841 1.00 48.60 O ANISOU 2841 O HOH A 613 6254 6128 6083 308 25 -92 O HETATM 2842 O HOH A 614 30.906 14.209 29.941 1.00 39.17 O ANISOU 2842 O HOH A 614 5167 4806 4909 344 71 86 O HETATM 2843 O HOH A 615 34.481 35.030 3.600 1.00 32.88 O ANISOU 2843 O HOH A 615 4079 4395 4020 55 140 -68 O HETATM 2844 O HOH A 616 27.176 55.230 3.038 1.00 43.91 O ANISOU 2844 O HOH A 616 5542 5622 5520 -148 86 145 O HETATM 2845 O HOH A 617 -6.153 56.671 17.295 1.00 38.73 O ANISOU 2845 O HOH A 617 4912 4982 4821 150 -43 -65 O HETATM 2846 O HOH A 618 7.093 37.849 7.582 1.00 35.57 O ANISOU 2846 O HOH A 618 4514 4489 4511 -19 58 -31 O HETATM 2847 O HOH A 619 11.182 48.468 33.307 1.00 37.88 O ANISOU 2847 O HOH A 619 4868 4933 4593 291 48 2 O HETATM 2848 O HOH A 620 12.738 36.868 2.233 1.00 48.66 O ANISOU 2848 O HOH A 620 6193 6193 6101 4 50 -64 O HETATM 2849 O HOH A 621 -17.425 54.373 13.364 1.00 35.79 O ANISOU 2849 O HOH A 621 4390 4674 4533 158 -46 -126 O HETATM 2850 O HOH A 622 21.915 51.351 35.532 1.00 54.61 O ANISOU 2850 O HOH A 622 6998 7006 6745 332 -103 -121 O HETATM 2851 O HOH A 623 23.443 27.144 -0.617 1.00 37.60 O ANISOU 2851 O HOH A 623 4776 4857 4655 115 44 -165 O HETATM 2852 O HOH A 624 3.321 26.532 13.461 1.00 43.19 O ANISOU 2852 O HOH A 624 5414 5318 5679 -57 108 43 O HETATM 2853 O HOH A 625 11.113 52.853 29.851 1.00 30.75 O ANISOU 2853 O HOH A 625 3966 3980 3738 237 -21 -44 O HETATM 2854 O HOH A 626 29.452 27.560 1.527 1.00 33.26 O ANISOU 2854 O HOH A 626 4195 4367 4074 129 80 -151 O HETATM 2855 O HOH A 627 29.020 57.547 11.124 1.00 45.72 O ANISOU 2855 O HOH A 627 5750 5769 5854 -139 -9 72 O HETATM 2856 O HOH A 628 18.253 57.133 15.622 1.00 37.96 O ANISOU 2856 O HOH A 628 4867 4765 4793 -21 -55 6 O HETATM 2857 O HOH A 629 16.354 15.417 31.718 1.00 43.69 O ANISOU 2857 O HOH A 629 5681 5314 5606 173 233 328 O HETATM 2858 O HOH A 630 -4.712 55.781 14.443 1.00 43.75 O ANISOU 2858 O HOH A 630 5563 5588 5471 108 -46 -56 O HETATM 2859 O HOH A 631 26.138 50.909 2.632 1.00 42.86 O ANISOU 2859 O HOH A 631 5416 5529 5340 -103 105 101 O HETATM 2860 O HOH A 632 -19.174 55.384 9.196 1.00 40.47 O ANISOU 2860 O HOH A 632 4994 5246 5136 162 -111 -175 O HETATM 2861 O HOH A 633 6.710 46.522 8.750 1.00 48.00 O ANISOU 2861 O HOH A 633 6121 6090 6026 -10 35 -8 O HETATM 2862 O HOH A 634 15.467 27.598 23.470 1.00 40.52 O ANISOU 2862 O HOH A 634 5191 5068 5139 86 163 112 O HETATM 2863 O HOH A 635 18.952 47.727 37.702 1.00 32.72 O ANISOU 2863 O HOH A 635 4245 4287 3902 386 -21 -57 O HETATM 2864 O HOH A 636 8.402 37.266 5.246 1.00 53.78 O ANISOU 2864 O HOH A 636 6828 6804 6802 -14 48 -49 O HETATM 2865 O HOH A 637 20.912 57.090 16.904 1.00 40.41 O ANISOU 2865 O HOH A 637 5161 5074 5121 -22 -64 -3 O HETATM 2866 O HOH A 638 -15.922 46.494 4.106 1.00 37.00 O ANISOU 2866 O HOH A 638 4535 4726 4796 47 -87 -169 O HETATM 2867 O HOH A 639 4.424 54.398 28.365 1.00 43.20 O ANISOU 2867 O HOH A 639 5522 5583 5310 242 -5 -36 O HETATM 2868 O HOH A 640 -6.605 45.173 23.855 1.00 48.47 O ANISOU 2868 O HOH A 640 6035 6276 6107 117 161 70 O HETATM 2869 O HOH A 641 15.592 53.072 35.888 1.00 39.14 O ANISOU 2869 O HOH A 641 5050 5078 4744 362 -75 -96 O HETATM 2870 O HOH A 642 37.879 28.638 10.015 1.00 51.13 O ANISOU 2870 O HOH A 642 6405 6657 6365 145 92 -139 O HETATM 2871 O HOH A 643 24.303 42.504 16.752 1.00 31.10 O ANISOU 2871 O HOH A 643 3952 3985 3878 23 67 -11 O HETATM 2872 O HOH A 644 34.074 23.329 20.631 1.00 38.09 O ANISOU 2872 O HOH A 644 4880 4841 4751 223 56 -82 O HETATM 2873 O HOH A 645 -2.113 48.890 14.173 1.00 26.79 O ANISOU 2873 O HOH A 645 3384 3433 3362 47 31 -17 O HETATM 2874 O HOH A 646 28.962 60.072 5.130 1.00 54.72 O ANISOU 2874 O HOH A 646 6893 6916 6983 -200 37 174 O HETATM 2875 O HOH A 647 27.236 45.417 7.684 1.00 30.04 O ANISOU 2875 O HOH A 647 3780 3903 3730 -52 97 24 O HETATM 2876 O HOH A 648 19.988 44.213 22.820 1.00 34.68 O ANISOU 2876 O HOH A 648 4437 4430 4310 88 51 -4 O HETATM 2877 O HOH A 649 31.424 26.089 35.003 1.00 44.95 O ANISOU 2877 O HOH A 649 5849 5728 5503 384 71 36 O HETATM 2878 O HOH A 650 24.831 29.623 34.235 0.50 36.49 O ANISOU 2878 O HOH A 650 4756 4663 4446 310 124 91 O HETATM 2879 O HOH A 651 28.694 41.662 12.956 1.00 36.92 O ANISOU 2879 O HOH A 651 4652 4762 4614 0 83 -18 O HETATM 2880 O HOH A 652 0.322 51.967 24.709 1.00 38.86 O ANISOU 2880 O HOH A 652 4933 5031 4801 177 45 -4 O HETATM 2881 O HOH A 653 36.094 16.145 17.523 1.00 43.61 O ANISOU 2881 O HOH A 653 5602 5489 5478 289 9 -145 O HETATM 2882 O HOH A 654 12.381 58.141 8.029 1.00 54.08 O ANISOU 2882 O HOH A 654 6951 6808 6791 -43 -41 48 O HETATM 2883 O HOH A 655 -18.284 39.279 21.401 1.00 49.23 O ANISOU 2883 O HOH A 655 5883 6379 6444 9 237 114 O HETATM 2884 O HOH A 656 28.523 60.556 8.587 1.00 45.21 O ANISOU 2884 O HOH A 656 5694 5675 5810 -181 -12 125 O HETATM 2885 O HOH A 657 10.128 24.363 13.470 1.00 32.96 O ANISOU 2885 O HOH A 657 4178 4021 4325 -12 94 21 O HETATM 2886 O HOH A 658 39.003 22.600 11.557 1.00 38.02 O ANISOU 2886 O HOH A 658 4783 4953 4711 230 52 -189 O HETATM 2887 O HOH A 659 16.266 36.090 16.068 1.00 35.73 O ANISOU 2887 O HOH A 659 4559 4526 4492 26 106 16 O HETATM 2888 O HOH A 660 12.334 26.161 30.834 1.00 46.96 O ANISOU 2888 O HOH A 660 6019 5903 5919 151 247 247 O HETATM 2889 O HOH A 661 25.537 33.950 20.978 1.00 47.36 O ANISOU 2889 O HOH A 661 6039 6028 5926 105 92 -9 O HETATM 2890 O HOH A 662 33.269 24.328 3.424 1.00 42.40 O ANISOU 2890 O HOH A 662 5343 5531 5238 179 68 -187 O HETATM 2891 O HOH A 663 1.295 41.248 3.118 1.00 36.92 O ANISOU 2891 O HOH A 663 4679 4671 4676 -8 2 -75 O HETATM 2892 O HOH A 664 -5.935 52.221 8.734 1.00 41.00 O ANISOU 2892 O HOH A 664 5197 5224 5156 57 -42 -67 O HETATM 2893 O HOH A 665 27.844 13.237 14.854 1.00 42.73 O ANISOU 2893 O HOH A 665 5519 5232 5485 205 0 -99 O HETATM 2894 O HOH A 666 12.684 16.428 25.550 1.00 39.76 O ANISOU 2894 O HOH A 666 5110 4781 5216 61 196 247 O HETATM 2895 O HOH A 667 29.751 37.326 11.453 1.00 31.28 O ANISOU 2895 O HOH A 667 3935 4066 3883 28 99 -40 O HETATM 2896 O HOH A 668 14.793 50.754 37.193 1.00 42.84 O ANISOU 2896 O HOH A 668 5521 5579 5178 389 -28 -63 O HETATM 2897 O HOH A 669 0.267 31.351 13.002 1.00 46.87 O ANISOU 2897 O HOH A 669 5859 5844 6104 -54 108 30 O HETATM 2898 O HOH A 670 17.988 54.562 35.174 1.00 40.92 O ANISOU 2898 O HOH A 670 5272 5269 5006 340 -122 -128 O HETATM 2899 O HOH A 671 17.122 33.215 27.116 1.00 40.50 O ANISOU 2899 O HOH A 671 5199 5143 5046 144 151 94 O HETATM 2900 O HOH A 672 25.313 65.987 12.577 1.00 47.95 O ANISOU 2900 O HOH A 672 6093 5904 6221 -153 -140 79 O HETATM 2901 O HOH A 673 -3.234 35.559 12.105 1.00 36.33 O ANISOU 2901 O HOH A 673 4504 4555 4746 -45 91 7 O HETATM 2902 O HOH A 674 -1.126 41.757 17.631 1.00 38.58 O ANISOU 2902 O HOH A 674 4836 4918 4905 24 117 42 O HETATM 2903 O HOH A 675 21.741 54.168 36.465 1.00 53.94 O ANISOU 2903 O HOH A 675 6917 6912 6667 359 -157 -161 O HETATM 2904 O HOH A 676 23.515 63.155 13.471 1.00 46.00 O ANISOU 2904 O HOH A 676 5860 5704 5916 -109 -113 50 O HETATM 2905 O HOH A 677 23.948 19.522 34.311 0.50 41.52 O ANISOU 2905 O HOH A 677 5449 5169 5159 310 172 211 O HETATM 2906 O HOH A 678 13.509 48.065 37.819 1.00 44.81 O ANISOU 2906 O HOH A 678 5768 5851 5406 395 32 -13 O HETATM 2907 O HOH A 679 22.181 21.385 3.876 1.00 42.11 O ANISOU 2907 O HOH A 679 5366 5295 5339 119 8 -173 O HETATM 2908 O HOH A 680 -0.733 46.909 1.185 1.00 37.03 O ANISOU 2908 O HOH A 680 4727 4706 4637 16 -37 -75 O HETATM 2909 O HOH A 681 -12.733 59.470 16.359 1.00 41.46 O ANISOU 2909 O HOH A 681 5217 5370 5165 214 -90 -121 O HETATM 2910 O HOH A 682 -11.327 61.124 23.333 1.00 44.68 O ANISOU 2910 O HOH A 682 5630 5840 5508 313 -75 -123 O HETATM 2911 O HOH A 683 34.294 20.262 5.250 1.00 52.29 O ANISOU 2911 O HOH A 683 6616 6734 6520 227 32 -223 O HETATM 2912 O HOH A 684 -2.831 28.743 18.948 1.00 42.60 O ANISOU 2912 O HOH A 684 5266 5295 5626 -67 197 148 O HETATM 2913 O HOH A 685 30.497 23.420 35.530 1.00 39.74 O ANISOU 2913 O HOH A 685 5214 5037 4848 395 92 80 O HETATM 2914 O HOH A 686 9.185 58.911 30.437 1.00 46.32 O ANISOU 2914 O HOH A 686 5956 5934 5711 287 -119 -109 O HETATM 2915 O HOH A 687 -5.576 44.505 27.507 1.00 45.18 O ANISOU 2915 O HOH A 687 5624 5894 5648 162 200 108 O HETATM 2916 O HOH A 688 17.019 60.912 29.026 1.00 55.00 O ANISOU 2916 O HOH A 688 7051 6941 6906 210 -200 -139 O HETATM 2917 O HOH A 689 -8.209 52.749 -1.970 1.00 38.98 O ANISOU 2917 O HOH A 689 4991 4962 4857 86 -138 -130 O HETATM 2918 O HOH A 690 -4.938 36.002 24.458 1.00 51.92 O ANISOU 2918 O HOH A 690 6443 6632 6652 33 248 176 O HETATM 2919 O HOH A 691 13.402 37.222 32.862 1.00 38.71 O ANISOU 2919 O HOH A 691 4976 4993 4739 235 171 126 O HETATM 2920 O HOH A 692 27.590 36.975 19.390 1.00 41.64 O ANISOU 2920 O HOH A 692 5290 5329 5203 81 77 -29 O HETATM 2921 O HOH A 693 38.388 22.437 18.915 1.00 47.78 O ANISOU 2921 O HOH A 693 6072 6118 5964 257 36 -142 O HETATM 2922 O HOH A 694 0.173 50.805 3.113 1.00 53.06 O ANISOU 2922 O HOH A 694 6783 6732 6645 18 -39 -44 O HETATM 2923 O HOH A 695 21.791 19.553 6.162 1.00 48.40 O ANISOU 2923 O HOH A 695 6172 6039 6177 115 4 -155 O HETATM 2924 O HOH A 696 28.584 44.859 5.287 1.00 29.01 O ANISOU 2924 O HOH A 696 3635 3806 3582 -54 117 31 O HETATM 2925 O HOH A 697 22.329 43.035 21.403 1.00 40.60 O ANISOU 2925 O HOH A 697 5176 5181 5068 71 55 -9 O HETATM 2926 O HOH A 698 26.624 47.839 6.398 1.00 28.30 O ANISOU 2926 O HOH A 698 3564 3676 3512 -74 94 49 O HETATM 2927 O HOH A 699 20.896 37.425 22.796 1.00 42.58 O ANISOU 2927 O HOH A 699 5442 5422 5314 99 97 19 O HETATM 2928 O HOH A 700 16.497 48.831 38.256 1.00 37.94 O ANISOU 2928 O HOH A 700 4907 4966 4543 407 -14 -52 O HETATM 2929 O HOH A 701 26.812 54.160 13.784 1.00 25.72 O ANISOU 2929 O HOH A 701 3243 3256 3275 -77 -5 25 O HETATM 2930 O HOH A 702 -21.638 45.006 21.435 1.00 33.63 O ANISOU 2930 O HOH A 702 3889 4498 4391 98 190 37 O HETATM 2931 O HOH A 703 -23.453 50.020 29.569 1.00 31.33 O ANISOU 2931 O HOH A 703 3580 4416 3909 300 260 63 O HETATM 2932 O HOH A 704 -4.964 34.105 10.471 1.00 35.84 O ANISOU 2932 O HOH A 704 4416 4470 4733 -61 72 -14 O HETATM 2933 O HOH A 705 -10.556 36.513 6.325 1.00 44.01 O ANISOU 2933 O HOH A 705 5400 5521 5801 -52 -1 -98 O HETATM 2934 O HOH A 706 -19.812 55.764 13.453 1.00 39.56 O ANISOU 2934 O HOH A 706 4844 5178 5008 191 -66 -153 O HETATM 2935 O HOH A 707 -17.026 54.334 10.778 1.00 36.02 O ANISOU 2935 O HOH A 707 4442 4677 4569 142 -74 -141 O HETATM 2936 O HOH A 708 -10.498 55.256 7.099 1.00 53.41 O ANISOU 2936 O HOH A 708 6763 6809 6722 101 -100 -111 O HETATM 2937 O HOH A 709 -12.215 51.339 3.936 1.00 36.81 O ANISOU 2937 O HOH A 709 4618 4704 4664 78 -102 -140 O HETATM 2938 O HOH A 710 19.528 9.657 16.310 1.00 49.75 O ANISOU 2938 O HOH A 710 6412 5935 6556 110 5 10 O HETATM 2939 O HOH A 711 20.312 8.528 19.212 1.00 38.42 O ANISOU 2939 O HOH A 711 5003 4477 5118 129 25 65 O HETATM 2940 O HOH A 712 12.967 41.794 0.591 1.00 40.64 O ANISOU 2940 O HOH A 712 5195 5207 5038 -5 51 -32 O HETATM 2941 O HOH A 713 13.853 44.041 2.599 1.00 38.82 O ANISOU 2941 O HOH A 713 4966 4971 4813 -21 58 -6 O HETATM 2942 O HOH A 714 16.626 44.054 2.880 1.00 25.31 O ANISOU 2942 O HOH A 714 3247 3273 3095 -27 72 4 O HETATM 2943 O HOH A 715 27.095 64.778 9.528 1.00 53.02 O ANISOU 2943 O HOH A 715 6711 6583 6852 -194 -79 132 O HETATM 2944 O HOH A 716 31.553 26.578 3.048 1.00 36.21 O ANISOU 2944 O HOH A 716 4561 4745 4454 144 81 -158 O HETATM 2945 O HOH A 717 13.227 32.360 14.739 1.00 23.41 O ANISOU 2945 O HOH A 717 2988 2925 2981 12 111 20 O HETATM 2946 O HOH A 718 13.866 25.583 6.489 1.00 40.33 O ANISOU 2946 O HOH A 718 5125 5017 5181 23 37 -89 O HETATM 2947 O HOH A 719 23.277 47.330 31.578 1.00 34.01 O ANISOU 2947 O HOH A 719 4372 4379 4173 237 -33 -69 O HETATM 2948 O HOH A 720 23.520 35.091 -5.194 1.00 36.02 O ANISOU 2948 O HOH A 720 4570 4768 4348 85 96 -89 O HETATM 2949 O HOH A 721 -7.909 55.919 19.519 1.00 37.87 O ANISOU 2949 O HOH A 721 4770 4912 4706 179 -16 -62 O HETATM 2950 O HOH A 722 7.129 28.787 11.474 1.00 40.99 O ANISOU 2950 O HOH A 722 5174 5085 5315 -29 87 0 O HETATM 2951 O HOH A 723 35.182 31.213 6.194 1.00 44.14 O ANISOU 2951 O HOH A 723 5521 5789 5463 100 115 -110 O HETATM 2952 O HOH A 724 37.047 24.604 9.286 1.00 47.16 O ANISOU 2952 O HOH A 724 5933 6123 5863 188 70 -171 O HETATM 2953 O HOH A 725 23.532 41.020 0.876 1.00 35.50 O ANISOU 2953 O HOH A 725 4501 4637 4352 -9 112 -4 O HETATM 2954 O HOH A 726 6.104 58.918 29.636 1.00 55.94 O ANISOU 2954 O HOH A 726 7165 7170 6919 289 -98 -97 O HETATM 2955 O HOH A 727 11.615 64.118 18.013 1.00 38.80 O ANISOU 2955 O HOH A 727 5029 4815 4899 58 -172 -42 O HETATM 2956 O HOH A 728 -6.002 39.246 19.579 1.00 40.97 O ANISOU 2956 O HOH A 728 5062 5235 5271 14 168 83 O HETATM 2957 O HOH A 729 -0.856 41.717 14.854 1.00 41.53 O ANISOU 2957 O HOH A 729 5216 5275 5289 6 93 18 O HETATM 2958 O HOH A 730 16.791 29.839 11.384 1.00 24.38 O ANISOU 2958 O HOH A 730 3116 3050 3097 23 89 -26 O HETATM 2959 O HOH A 731 4.406 22.488 20.979 1.00 40.27 O ANISOU 2959 O HOH A 731 5059 4911 5331 -39 198 190 O HETATM 2960 O HOH A 732 -3.820 50.498 1.011 1.00 37.93 O ANISOU 2960 O HOH A 732 4852 4822 4739 40 -73 -84 O HETATM 2961 O HOH A 733 -10.603 51.391 -2.164 1.00 43.04 O ANISOU 2961 O HOH A 733 5470 5481 5403 93 -152 -164 O HETATM 2962 O HOH A 734 -7.030 50.466 -0.375 1.00 41.36 O ANISOU 2962 O HOH A 734 5269 5261 5186 60 -105 -120 O HETATM 2963 O HOH A 735 -12.376 53.242 6.043 1.00 40.57 O ANISOU 2963 O HOH A 735 5099 5189 5125 94 -97 -129 O HETATM 2964 O HOH A 736 19.916 35.462 24.889 1.00 57.56 O ANISOU 2964 O HOH A 736 7351 7313 7205 126 115 44 O HETATM 2965 O HOH A 737 24.926 36.724 21.977 1.00 58.46 O ANISOU 2965 O HOH A 737 7444 7444 7326 103 83 -8 O HETATM 2966 O HOH A 738 35.710 27.066 8.726 1.00 49.07 O ANISOU 2966 O HOH A 738 6171 6370 6104 150 86 -144 O HETATM 2967 O HOH A 739 33.157 30.689 7.998 1.00 31.74 O ANISOU 2967 O HOH A 739 3978 4170 3911 96 102 -103 O HETATM 2968 O HOH A 740 21.568 43.695 11.036 1.00 21.67 O ANISOU 2968 O HOH A 740 2763 2794 2676 -20 77 6 O HETATM 2969 O HOH A 741 15.060 35.213 2.771 1.00 40.64 O ANISOU 2969 O HOH A 741 5175 5182 5085 12 59 -68 O HETATM 2970 O HOH A 742 12.742 38.107 5.680 1.00 32.60 O ANISOU 2970 O HOH A 742 4158 4147 4083 -10 65 -35 O HETATM 2971 O HOH A 743 13.420 40.705 6.498 1.00 30.93 O ANISOU 2971 O HOH A 743 3952 3945 3856 -16 68 -17 O HETATM 2972 O HOH A 744 19.207 60.946 15.020 1.00 50.34 O ANISOU 2972 O HOH A 744 6441 6287 6400 -44 -101 15 O HETATM 2973 O HOH A 745 16.820 59.381 10.741 1.00 36.51 O ANISOU 2973 O HOH A 745 4703 4562 4607 -62 -54 50 O HETATM 2974 O HOH A 746 31.761 27.573 29.695 1.00 52.70 O ANISOU 2974 O HOH A 746 6775 6705 6542 286 65 -10 O HETATM 2975 O HOH A 747 -11.963 37.732 8.233 1.00 40.61 O ANISOU 2975 O HOH A 747 4948 5114 5368 -48 23 -76 O HETATM 2976 O HOH A 748 -7.081 41.810 20.600 1.00 43.46 O ANISOU 2976 O HOH A 748 5376 5586 5550 47 163 73 O HETATM 2977 O HOH A 749 3.175 49.504 7.813 1.00 44.71 O ANISOU 2977 O HOH A 749 5711 5672 5604 4 2 -19 O HETATM 2978 O HOH A 750 9.809 56.107 30.901 1.00 43.41 O ANISOU 2978 O HOH A 750 5577 5585 5329 280 -71 -80 O HETATM 2979 O HOH A 751 12.590 63.123 25.103 1.00 37.11 O ANISOU 2979 O HOH A 751 4803 4647 4650 167 -197 -109 O HETATM 2980 O HOH A 752 6.958 62.761 31.001 1.00 47.13 O ANISOU 2980 O HOH A 752 6071 6028 5807 338 -186 -155 O HETATM 2981 O HOH A 753 12.720 40.142 34.326 1.00 47.73 O ANISOU 2981 O HOH A 753 6120 6170 5847 275 151 102 O HETATM 2982 O HOH A 754 21.401 48.487 28.858 1.00 44.64 O ANISOU 2982 O HOH A 754 5712 5707 5543 182 -23 -53 O HETATM 2983 O HOH A 755 7.783 50.436 9.205 1.00 38.96 O ANISOU 2983 O HOH A 755 4997 4940 4866 -8 13 3 O HETATM 2984 O HOH A 756 29.557 37.466 -0.495 1.00 43.98 O ANISOU 2984 O HOH A 756 5526 5793 5392 33 143 -34 O HETATM 2985 O HOH A 757 22.650 31.324 -2.685 1.00 47.75 O ANISOU 2985 O HOH A 757 6060 6191 5894 94 66 -130 O HETATM 2986 O HOH A 758 23.366 28.555 -2.898 1.00 47.31 O ANISOU 2986 O HOH A 758 6003 6126 5847 123 49 -167 O HETATM 2987 O HOH A 759 28.241 47.201 3.515 1.00 36.02 O ANISOU 2987 O HOH A 759 4525 4696 4465 -77 122 63 O HETATM 2988 O HOH A 760 26.994 43.191 0.854 1.00 48.97 O ANISOU 2988 O HOH A 760 6179 6373 6057 -31 134 29 O CONECT 1755 2727 CONECT 1769 2727 CONECT 2271 2728 CONECT 2302 2728 CONECT 2687 2688 2693 CONECT 2688 2687 2689 2691 CONECT 2689 2688 2694 2699 CONECT 2690 2691 2695 CONECT 2691 2688 2690 2696 CONECT 2692 2694 2697 2698 CONECT 2693 2687 2699 2700 CONECT 2694 2689 2692 2695 CONECT 2695 2690 2694 CONECT 2696 2691 CONECT 2697 2692 CONECT 2698 2692 CONECT 2699 2689 2693 CONECT 2700 2693 CONECT 2701 2702 CONECT 2702 2701 2703 2704 2705 CONECT 2703 2702 CONECT 2704 2702 CONECT 2705 2702 2706 CONECT 2706 2705 2707 CONECT 2707 2706 2708 2709 CONECT 2708 2707 2713 CONECT 2709 2707 2710 2711 CONECT 2710 2709 CONECT 2711 2709 2712 2713 CONECT 2712 2711 CONECT 2713 2708 2711 2714 CONECT 2714 2713 2715 2722 CONECT 2715 2714 2716 CONECT 2716 2715 2717 2720 CONECT 2717 2716 2718 2719 CONECT 2718 2717 CONECT 2719 2717 CONECT 2720 2716 2721 CONECT 2721 2720 2722 CONECT 2722 2714 2721 CONECT 2723 2724 2725 2726 CONECT 2724 2723 CONECT 2725 2723 CONECT 2726 2723 CONECT 2727 1755 1769 2747 2784 CONECT 2727 2811 2983 CONECT 2728 2271 2302 2731 2743 CONECT 2728 2818 2821 CONECT 2731 2728 CONECT 2743 2728 CONECT 2747 2727 CONECT 2784 2727 CONECT 2811 2727 CONECT 2818 2728 CONECT 2821 2728 CONECT 2983 2727 END