USER MOD reduce.3.24.130724 H: found=0, std=0, add=3977, rem=0, adj=124 USER MOD reduce.3.24.130724 removed 24 hydrogens (24 hets) HEADER HYDROLASE 10-JUL-16 5LHB TITLE POLYADPRIBOSYL GLYCOSIDASE IN COMPLEX WITH PDD00017262 COMPND MOL_ID: 1; COMPND 2 MOLECULE: POLY(ADP-RIBOSE) GLYCOHYDROLASE; COMPND 3 CHAIN: A; COMPND 4 EC: 3.2.1.143; COMPND 5 ENGINEERED: YES; COMPND 6 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: PARG; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 5116; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21; SOURCE 9 EXPRESSION_SYSTEM_VARIANT: GOLD KEYWDS HYDROLASE, COMPETITIVE INHIBITOR EXPDTA X-RAY DIFFRACTION AUTHOR J.TUCKER,E.BARKAUSKAITE REVDAT 1 12-OCT-16 5LHB 0 JRNL AUTH D.I.JAMES,K.M.SMITH,A.M.JORDAN,E.E.FAIRWEATHER, JRNL AUTH 2 L.A.GRIFFITHS,N.S.HAMILTON,J.R.HITCHIN,C.P.HUTTON,S.JONES, JRNL AUTH 3 P.KELLY,A.E.MCGONAGLE,H.SMALL,A.I.STOWELL,J.TUCKER, JRNL AUTH 4 I.D.WADDELL,B.WASZKOWYCZ,D.J.OGILVIE JRNL TITL FIRST-IN-CLASS CHEMICAL PROBES AGAINST POLY(ADP-RIBOSE) JRNL TITL 2 GLYCOHYDROLASE (PARG) INHIBIT DNA REPAIR WITH DIFFERENTIAL JRNL TITL 3 PHARMACOLOGY TO OLAPARIB. JRNL REF ACS CHEM.BIOL. 2016 JRNL REFN ESSN 1554-8937 JRNL PMID 27689388 JRNL DOI 10.1021/ACSCHEMBIO.6B00609 REMARK 2 REMARK 2 RESOLUTION. 2.23 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : BUSTER 2.11.5 REMARK 3 AUTHORS : BRICOGNE,BLANC,BRANDL,FLENSBURG,KELLER, REMARK 3 : PACIOREK,ROVERSI,SHARFF,SMART,VONRHEIN, REMARK 3 : WOMACK,MATTHEWS,TEN EYCK,TRONRUD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.23 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 27.61 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : 99.4 REMARK 3 NUMBER OF REFLECTIONS : 28527 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) : 0.165 REMARK 3 R VALUE (WORKING SET) : 0.162 REMARK 3 FREE R VALUE : 0.212 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.060 REMARK 3 FREE R VALUE TEST SET COUNT : 1444 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : NULL REMARK 3 BIN RESOLUTION RANGE HIGH (ANGSTROMS) : 2.23 REMARK 3 BIN RESOLUTION RANGE LOW (ANGSTROMS) : 2.31 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 99.41 REMARK 3 REFLECTIONS IN BIN (WORKING + TEST SET) : NULL REMARK 3 BIN R VALUE (WORKING + TEST SET) : NULL REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 2771 REMARK 3 BIN R VALUE (WORKING SET) : 0.1820 REMARK 3 BIN FREE R VALUE : 0.2487 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 4.97 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 145 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 4029 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 58 REMARK 3 SOLVENT ATOMS : 300 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 44.63 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 4.07430 REMARK 3 B22 (A**2) : -0.12870 REMARK 3 B33 (A**2) : -3.94560 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 COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.232 REMARK 3 DPI (BLOW EQ-10) BASED ON R VALUE (A) : NULL REMARK 3 DPI (BLOW EQ-9) BASED ON FREE R VALUE (A) : NULL REMARK 3 DPI (CRUICKSHANK) BASED ON R VALUE (A) : NULL REMARK 3 DPI (CRUICKSHANK) BASED ON FREE R VALUE (A) : NULL REMARK 3 REMARK 3 REFERENCES: BLOW, D. (2002) ACTA CRYST D58, 792-797 REMARK 3 CRUICKSHANK, D.W.J. (1999) ACTA CRYST D55, 583-601 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : NULL REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : NULL REMARK 3 REMARK 3 NUMBER OF GEOMETRIC FUNCTION TERMS DEFINED : 15 REMARK 3 TERM COUNT WEIGHT FUNCTION. REMARK 3 BOND LENGTHS : NULL ; NULL ; NULL REMARK 3 BOND ANGLES : NULL ; NULL ; NULL REMARK 3 TORSION ANGLES : NULL ; NULL ; NULL REMARK 3 TRIGONAL CARBON PLANES : NULL ; NULL ; NULL REMARK 3 GENERAL PLANES : NULL ; NULL ; NULL REMARK 3 ISOTROPIC THERMAL FACTORS : NULL ; NULL ; NULL REMARK 3 BAD NON-BONDED CONTACTS : NULL ; NULL ; NULL REMARK 3 IMPROPER TORSIONS : NULL ; NULL ; NULL REMARK 3 PSEUDOROTATION ANGLES : NULL ; NULL ; NULL REMARK 3 CHIRAL IMPROPER TORSION : NULL ; NULL ; NULL REMARK 3 SUM OF OCCUPANCIES : NULL ; NULL ; NULL REMARK 3 UTILITY DISTANCES : NULL ; NULL ; NULL REMARK 3 UTILITY ANGLES : NULL ; NULL ; NULL REMARK 3 UTILITY TORSION : NULL ; NULL ; NULL REMARK 3 IDEAL-DIST CONTACT TERM : NULL ; NULL ; NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : NULL REMARK 3 BOND ANGLES (DEGREES) : NULL REMARK 3 PEPTIDE OMEGA TORSION ANGLES (DEGREES) : NULL REMARK 3 OTHER TORSION ANGLES (DEGREES) : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 5LHB COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBE ON 11-JUL-16. REMARK 100 THE DEPOSITION ID IS D_1200000708. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 11-JUL-13 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : DIAMOND REMARK 200 BEAMLINE : I02 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.979 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : PIXEL REMARK 200 DETECTOR MANUFACTURER : DECTRIS PILATUS3 6M REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS REMARK 200 DATA SCALING SOFTWARE : AIMLESS REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 28669 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.230 REMARK 200 RESOLUTION RANGE LOW (A) : 33.510 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.8 REMARK 200 DATA REDUNDANCY : 5.700 REMARK 200 R MERGE (I) : 0.10900 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 8.6000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.23 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.37 REMARK 200 COMPLETENESS FOR SHELL (%) : 99.7 REMARK 200 DATA REDUNDANCY IN SHELL : 5.50 REMARK 200 R MERGE FOR SHELL (I) : 0.61400 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 3.000 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: 4A0D REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 49.62 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.44 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 25% PEG 3350, 36.4MM PCTP PH 4, 63.6MM REMARK 280 PCTP PH 10, 0.2M AMMONIUM SULPHATE, PH 7.5, VAPOR DIFFUSION, REMARK 280 SITTING DROP, TEMPERATURE 293K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X+1/2,-Y,Z+1/2 REMARK 290 3555 -X,Y+1/2,-Z+1/2 REMARK 290 4555 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 33.50500 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 47.72000 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 44.86500 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 47.72000 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 33.50500 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 44.86500 REMARK 290 SMTRY3 4 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 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 1250 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 20860 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -33.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY A 446 REMARK 465 SER A 447 REMARK 465 SER A 448 REMARK 465 PRO A 449 REMARK 465 ASP A 525 REMARK 465 GLU A 526 REMARK 465 ASN A 527 REMARK 465 GLY A 528 REMARK 465 PRO A 946 REMARK 465 GLY A 947 REMARK 465 ALA A 964 REMARK 465 GLU A 965 REMARK 465 THR A 966 REMARK 465 ALA A 967 REMARK 465 ASP A 968 REMARK 465 HIS A 969 REMARK 465 SER A 970 REMARK 465 GLY A 971 REMARK 465 GLN A 972 REMARK 465 ARG A 973 REMARK 465 THR A 974 REMARK 465 GLY A 975 REMARK 465 THR A 976 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 ASP A 450 CG OD1 OD2 REMARK 470 LYS A 452 CE NZ REMARK 470 MET A 464 CG SD CE REMARK 470 ILE A 469 CG1 CG2 CD1 REMARK 470 ARG A 470 CG CD NE CZ NH1 NH2 REMARK 470 LEU A 473 CG CD1 CD2 REMARK 470 ARG A 490 CD NE CZ NH1 NH2 REMARK 470 LYS A 509 CD CE NZ REMARK 470 GLU A 524 CG CD OE1 OE2 REMARK 470 GLU A 529 CG CD OE1 OE2 REMARK 470 ARG A 530 CG CD NE CZ NH1 NH2 REMARK 470 THR A 531 OG1 CG2 REMARK 470 LYS A 566 CG CD CE NZ REMARK 470 LYS A 567 CE NZ REMARK 470 GLU A 583 CD OE1 OE2 REMARK 470 LYS A 648 CG CD CE NZ REMARK 470 LYS A 677 CD CE NZ REMARK 470 GLU A 728 CG CD OE1 OE2 REMARK 470 ARG A 800 NE CZ NH1 NH2 REMARK 470 ARG A 830 CG CD NE CZ NH1 NH2 REMARK 470 ARG A 831 CD NE CZ NH1 NH2 REMARK 470 GLU A 839 CD OE1 OE2 REMARK 470 LYS A 840 CD CE NZ REMARK 470 SER A 858 OG REMARK 470 LYS A 922 CG CD CE NZ REMARK 470 GLU A 939 CG CD OE1 OE2 REMARK 470 ASN A 942 CG OD1 ND2 REMARK 470 ASP A 949 CG OD1 OD2 REMARK 470 LYS A 951 CD CE NZ REMARK 470 GLU A 961 CG CD OE1 OE2 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 CYS A 467 55.88 -106.78 REMARK 500 ILE A 469 149.84 -38.80 REMARK 500 ARG A 530 -18.95 60.65 REMARK 500 ASN A 561 43.05 -144.61 REMARK 500 SER A 592 -56.31 -123.74 REMARK 500 CYS A 608 79.80 -106.21 REMARK 500 ALA A 618 -3.06 74.68 REMARK 500 TYR A 653 2.60 82.19 REMARK 500 SER A 749 -112.41 -133.02 REMARK 500 LEU A 752 37.24 -144.58 REMARK 500 VAL A 753 -162.64 -101.89 REMARK 500 ASN A 762 72.98 -118.21 REMARK 500 ALA A 796 -119.30 50.78 REMARK 500 ASN A 869 79.62 -60.37 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A1398 DISTANCE = 6.54 ANGSTROMS REMARK 525 HOH A1399 DISTANCE = 7.93 ANGSTROMS REMARK 525 HOH A1400 DISTANCE = 10.09 ANGSTROMS REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue 6WJ A 1001 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue SO4 A 1002 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue SO4 A 1003 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue SO4 A 1004 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue DMS A 1005 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue DMS A 1006 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue DMS A 1007 DBREF 5LHB A 448 976 UNP Q86W56 PARG_HUMAN 340 868 SEQADV 5LHB GLY A 446 UNP Q86W56 EXPRESSION TAG SEQADV 5LHB SER A 447 UNP Q86W56 EXPRESSION TAG SEQADV 5LHB ALA A 616 UNP Q86W56 LYS 508 ENGINEERED MUTATION SEQADV 5LHB ALA A 617 UNP Q86W56 GLN 509 ENGINEERED MUTATION SEQADV 5LHB ALA A 618 UNP Q86W56 LYS 510 ENGINEERED MUTATION SEQADV 5LHB 6WK A 681 UNP Q86W56 CYS 573 MODIFIED RESIDUE SEQADV 5LHB ALA A 688 UNP Q86W56 GLU 580 ENGINEERED MUTATION SEQADV 5LHB ALA A 689 UNP Q86W56 LYS 581 ENGINEERED MUTATION SEQADV 5LHB ALA A 690 UNP Q86W56 LYS 582 ENGINEERED MUTATION SEQRES 1 A 531 GLY SER SER PRO ASP LYS LYS TRP LEU GLY THR PRO ILE SEQRES 2 A 531 GLU GLU MET ARG ARG MET PRO ARG CYS GLY ILE ARG LEU SEQRES 3 A 531 PRO LEU LEU ARG PRO SER ALA ASN HIS THR VAL THR ILE SEQRES 4 A 531 ARG VAL ASP LEU LEU ARG ALA GLY GLU VAL PRO LYS PRO SEQRES 5 A 531 PHE PRO THR HIS TYR LYS ASP LEU TRP ASP ASN LYS HIS SEQRES 6 A 531 VAL LYS MET PRO CYS SER GLU GLN ASN LEU TYR PRO VAL SEQRES 7 A 531 GLU ASP GLU ASN GLY GLU ARG THR ALA GLY SER ARG TRP SEQRES 8 A 531 GLU LEU ILE GLN THR ALA LEU LEU ASN LYS PHE THR ARG SEQRES 9 A 531 PRO GLN ASN LEU LYS ASP ALA ILE LEU LYS TYR ASN VAL SEQRES 10 A 531 ALA TYR SER LYS LYS TRP ASP PHE THR ALA LEU ILE ASP SEQRES 11 A 531 PHE TRP ASP LYS VAL LEU GLU GLU ALA GLU ALA GLN HIS SEQRES 12 A 531 LEU TYR GLN SER ILE LEU PRO ASP MET VAL LYS ILE ALA SEQRES 13 A 531 LEU CYS LEU PRO ASN ILE CYS THR GLN PRO ILE PRO LEU SEQRES 14 A 531 LEU ALA ALA ALA MET ASN HIS SER ILE THR MET SER GLN SEQRES 15 A 531 GLU GLN ILE ALA SER LEU LEU ALA ASN ALA PHE PHE CYS SEQRES 16 A 531 THR PHE PRO ARG ARG ASN ALA LYS MET LYS SER GLU TYR SEQRES 17 A 531 SER SER TYR PRO ASP ILE ASN PHE ASN ARG LEU PHE GLU SEQRES 18 A 531 GLY ARG SER SER ARG LYS PRO GLU LYS LEU LYS THR LEU SEQRES 19 A 531 PHE 6WK TYR PHE ARG ARG VAL THR ALA ALA ALA PRO THR SEQRES 20 A 531 GLY LEU VAL THR PHE THR ARG GLN SER LEU GLU ASP PHE SEQRES 21 A 531 PRO GLU TRP GLU ARG CYS GLU LYS PRO LEU THR ARG LEU SEQRES 22 A 531 HIS VAL THR TYR GLU GLY THR ILE GLU GLU ASN GLY GLN SEQRES 23 A 531 GLY MET LEU GLN VAL ASP PHE ALA ASN ARG PHE VAL GLY SEQRES 24 A 531 GLY GLY VAL THR SER ALA GLY LEU VAL GLN GLU GLU ILE SEQRES 25 A 531 ARG PHE LEU ILE ASN PRO GLU LEU ILE ILE SER ARG LEU SEQRES 26 A 531 PHE THR GLU VAL LEU ASP HIS ASN GLU CYS LEU ILE ILE SEQRES 27 A 531 THR GLY THR GLU GLN TYR SER GLU TYR THR GLY TYR ALA SEQRES 28 A 531 GLU THR TYR ARG TRP SER ARG SER HIS GLU ASP GLY SER SEQRES 29 A 531 GLU ARG ASP ASP TRP GLN ARG ARG CYS THR GLU ILE VAL SEQRES 30 A 531 ALA ILE ASP ALA LEU HIS PHE ARG ARG TYR LEU ASP GLN SEQRES 31 A 531 PHE VAL PRO GLU LYS MET ARG ARG GLU LEU ASN LYS ALA SEQRES 32 A 531 TYR CYS GLY PHE LEU ARG PRO GLY VAL SER SER GLU ASN SEQRES 33 A 531 LEU SER ALA VAL ALA THR GLY ASN TRP GLY CYS GLY ALA SEQRES 34 A 531 PHE GLY GLY ASP ALA ARG LEU LYS ALA LEU ILE GLN ILE SEQRES 35 A 531 LEU ALA ALA ALA ALA ALA GLU ARG ASP VAL VAL TYR PHE SEQRES 36 A 531 THR PHE GLY ASP SER GLU LEU MET ARG ASP ILE TYR SER SEQRES 37 A 531 MET HIS ILE PHE LEU THR GLU ARG LYS LEU THR VAL GLY SEQRES 38 A 531 ASP VAL TYR LYS LEU LEU LEU ARG TYR TYR ASN GLU GLU SEQRES 39 A 531 CYS ARG ASN CYS SER THR PRO GLY PRO ASP ILE LYS LEU SEQRES 40 A 531 TYR PRO PHE ILE TYR HIS ALA VAL GLU SER CYS ALA GLU SEQRES 41 A 531 THR ALA ASP HIS SER GLY GLN ARG THR GLY THR HET 6WK A 681 14 HET 6WJ A1001 55 HET SO4 A1002 5 HET SO4 A1003 5 HET SO4 A1004 5 HET DMS A1005 4 HET DMS A1006 4 HET DMS A1007 4 HETNAM 6WK (2~{R})-2-AZANYL-3-[[(2~{S},3~{S})-2,3-BIS(OXIDANYL)-4- HETNAM 2 6WK SULFANYL-BUTYL]DISULFANYL]PROPANOIC ACID HETNAM 6WJ 1-(CYCLOPROPYLMETHYL)-6-[[(1-METHYLCYCLOPROPYL)AMINO]- HETNAM 2 6WJ BIS(OXIDANYL)-$L^{4}-SULFANYL]-3-[(2-METHYL-1,3- HETNAM 3 6WJ THIAZOL-5-YL)METHYL]QUINAZOLINE-2,4-DIONE HETNAM SO4 SULFATE ION HETNAM DMS DIMETHYL SULFOXIDE FORMUL 1 6WK C7 H15 N O4 S3 FORMUL 2 6WJ C21 H26 N4 O4 S2 FORMUL 3 SO4 3(O4 S 2-) FORMUL 6 DMS 3(C2 H6 O S) FORMUL 9 HOH *300(H2 O) HELIX 1 AA1 PRO A 457 MET A 461 5 5 HELIX 2 AA2 ARG A 485 LEU A 489 5 5 HELIX 3 AA3 ARG A 535 LEU A 544 1 10 HELIX 4 AA4 ARG A 549 TYR A 560 1 12 HELIX 5 AA5 ASN A 561 SER A 565 5 5 HELIX 6 AA6 PHE A 570 VAL A 580 1 11 HELIX 7 AA7 GLU A 582 SER A 592 1 11 HELIX 8 AA8 SER A 592 CYS A 603 1 12 HELIX 9 AA9 CYS A 603 CYS A 608 1 6 HELIX 10 AB1 GLN A 627 PHE A 639 1 13 HELIX 11 AB2 PHE A 661 GLU A 666 5 6 HELIX 12 AB3 ARG A 671 ALA A 689 1 19 HELIX 13 AB4 GLU A 707 CYS A 711 5 5 HELIX 14 AB5 THR A 725 GLY A 730 1 6 HELIX 15 AB6 VAL A 753 ASN A 762 1 10 HELIX 16 AB7 PRO A 763 ILE A 766 5 4 HELIX 17 AB8 ILE A 767 THR A 772 1 6 HELIX 18 AB9 TYR A 795 TYR A 799 5 5 HELIX 19 AC1 ARG A 831 PHE A 836 5 6 HELIX 20 AC2 VAL A 837 LEU A 853 1 17 HELIX 21 AC3 SER A 858 LEU A 862 5 5 HELIX 22 AC4 CYS A 872 GLY A 876 5 5 HELIX 23 AC5 ASP A 878 ALA A 893 1 16 HELIX 24 AC6 ASP A 904 ARG A 921 1 18 HELIX 25 AC7 THR A 924 CYS A 940 1 17 HELIX 26 AC8 LYS A 951 CYS A 963 1 13 SHEET 1 AA110 TRP A 453 GLY A 455 0 SHEET 2 AA110 LEU A 718 THR A 721 -1 O VAL A 720 N LEU A 454 SHEET 3 AA110 VAL A 897 PHE A 900 1 O TYR A 899 N HIS A 719 SHEET 4 AA110 VAL A 865 GLY A 868 1 N THR A 867 O VAL A 898 SHEET 5 AA110 LEU A 734 ALA A 739 1 N LEU A 734 O ALA A 866 SHEET 6 AA110 GLU A 820 ASP A 825 1 O GLU A 820 N GLN A 735 SHEET 7 AA110 GLU A 779 THR A 784 -1 N ILE A 783 O ILE A 821 SHEET 8 AA110 LEU A 694 SER A 701 -1 N THR A 698 O ILE A 782 SHEET 9 AA110 HIS A 621 SER A 626 -1 N HIS A 621 O ARG A 699 SHEET 10 AA110 HIS A 480 VAL A 482 1 N THR A 481 O THR A 624 SHEET 1 AA2 2 LEU A 520 PRO A 522 0 SHEET 2 AA2 2 ALA A 532 SER A 534 -1 O GLY A 533 N TYR A 521 SHEET 1 AA3 2 SER A 790 THR A 793 0 SHEET 2 AA3 2 ARG A 800 SER A 804 -1 O ARG A 800 N THR A 793 LINK C PHE A 680 N 6WK A 681 1555 1555 1.34 LINK C 6WK A 681 N TYR A 682 1555 1555 1.34 CISPEP 1 MET A 464 PRO A 465 0 -0.71 CISPEP 2 PHE A 498 PRO A 499 0 3.15 SITE *** AC1 10 THR A 725 ILE A 726 GLU A 727 GLN A 754 SITE *** AC1 10 ARG A 758 TYR A 792 TYR A 795 ASN A 869 SITE *** AC1 10 THR A 901 PHE A 902 SITE *** AC2 6 CYS A 711 GLU A 712 THR A 924 GLY A 926 SITE *** AC2 6 ASP A 927 LYS A 930 SITE *** AC3 5 ARG A 535 TYR A 564 ARG A 644 ASN A 646 SITE *** AC3 5 ARG A 941 SITE *** AC4 3 PRO A 838 ARG A 842 HOH A1258 SITE *** AC5 4 ILE A 484 ARG A 485 VAL A 486 PHE A 498 SITE *** AC6 6 TYR A 521 LYS A 559 TYR A 560 ASN A 561 SITE *** AC6 6 VAL A 562 HOH A1265 SITE *** AC7 4 PRO A 657 ASP A 658 GLY A 745 ARG A 769 CRYST1 67.010 89.730 95.440 90.00 90.00 90.00 P 21 21 21 4 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 0.014923 0.000000 0.000000 0.00000 SCALE2 0.000000 0.011145 0.000000 0.00000 SCALE3 0.000000 0.000000 0.010478 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 943 CYS SG : rot 180:sc= 0.0626 USER MOD Set 1.2: A 945 THR OG1 : rot -4:sc= 0.0403 USER MOD Set 2.1: A 867 THR OG1 : rot -155:sc= 1.37 USER MOD Set 2.2: A 886 GLN : amide:sc= 1.4 K(o=2.8,f=1.5) USER MOD Set 3.1: A 780 CYS SG : rot -90:sc= -0.874 USER MOD Set 3.2: A 850 CYS SG : rot 160:sc= 0.13 USER MOD Set 4.1: A 678 THR OG1 : rot 74:sc= 1.99 USER MOD Set 4.2: A 799 TYR OH : rot -173:sc= 0.952 USER MOD Set 5.1: A 762 ASN : amide:sc= -0.0735 K(o=0.78,f=-2.4) USER MOD Set 5.2: A 786 THR OG1 : rot -66:sc= 0.853 USER MOD Set 6.1: A 701 SER OG : rot -160:sc= 0 USER MOD Set 6.2: A 778 ASN : amide:sc= 0.995 K(o=0.99,f=-3.4!) USER MOD Set 7.1: A 646 ASN : amide:sc= 2.69 K(o=3.8,f=-0.87) USER MOD Set 7.2: A 660 ASN : amide:sc= 1.1 K(o=3.8,f=-0.87!) USER MOD Set 8.1: A 636 ASN : amide:sc= 0.96 X(o=0.96,f=1.4) USER MOD Set 8.2: A 641 THR OG1 : rot -59:sc=-0.00447 USER MOD Set 9.1: A 622 SER OG : rot -90:sc= 0.981 USER MOD Set 9.2: A 698 THR OG1 : rot 180:sc= 0.844 USER MOD Set10.1: A 548 THR OG1 : rot 180:sc= 0 USER MOD Set10.2: A 552 ASN : amide:sc= 0.0401 K(o=0.04,f=-3.3!) USER MOD Set11.1: A 502 TYR OH : rot -137:sc= 1.21 USER MOD Set11.2: A 515 CYS SG : rot 85:sc= 0.602 USER MOD Set12.1: A 483 THR OG1 : rot 106:sc= 0.804 USER MOD Set12.2: A 629 GLN : amide:sc= 2.11 K(o=2.9,f=-2.4!) USER MOD Set13.1: A 481 THR OG1 : rot 77:sc= 0.885 USER MOD Set13.2: A 621 HIS : no HE2:sc= 0.948 K(o=1.8,f=-6.4!) USER MOD Set14.1: A 480 HIS : no HE2:sc= 1.02 K(o=4.8,f=-2.9!) USER MOD Set14.2: A 624 THR OG1 : rot 104:sc= 2.3 USER MOD Set14.3: A 696 THR OG1 : rot -70:sc= 1.5 USER MOD Set15.1: A 477 SER OG : rot 107:sc= 0.449 USER MOD Set15.2: A 479 ASN : amide:sc= 0.41 K(o=0.86,f=-1.6) USER MOD Single : A 451 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 456 THR OG1 : rot 72:sc= 0.416 USER MOD Single : A 461 MET CE :methyl 162:sc= -0.0659 (180deg=-0.301) USER MOD Single : A 467 CYS SG : rot 180:sc= 0 USER MOD Single : A 496 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.0073) USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 501 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 503 LYS NZ :NH3+ 141:sc= 0.892 (180deg=0.0765) USER MOD Single : A 508 ASN : amide:sc= 0.323 K(o=0.32,f=-3.6!) USER MOD Single : A 510 HIS : no HE2:sc= 0.872 K(o=0.87,f=-4.3!) USER MOD Single : A 512 LYS NZ :NH3+ 178:sc= 1.25 (180deg=1.21) USER MOD Single : A 513 MET CE :methyl 179:sc= -0.573 (180deg=-0.583) USER MOD Single : A 516 SER OG : rot 80:sc= 1.36 USER MOD Single : A 518 GLN : amide:sc=-0.00372 X(o=-0.0037,f=-0.032) USER MOD Single : A 519 ASN : amide:sc= 1.1 K(o=1.1,f=-1.3) USER MOD Single : A 521 TYR OH : rot 180:sc= 0 USER MOD Single : A 534 SER OG : rot 43:sc= 0.514 USER MOD Single : A 540 GLN : amide:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 541 THR OG1 : rot 88:sc= 0.348 USER MOD Single : A 545 ASN : amide:sc= -0.0182 X(o=-0.018,f=-0.2) USER MOD Single : A 546 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 551 GLN : amide:sc= 0.96 K(o=0.96,f=-0.21) USER MOD Single : A 554 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 559 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 560 TYR OH : rot -13:sc= 1.15 USER MOD Single : A 561 ASN : amide:sc= 0.663 K(o=0.66,f=0) USER MOD Single : A 564 TYR OH : rot 180:sc= 0 USER MOD Single : A 565 SER OG : rot 180:sc= 0 USER MOD Single : A 571 THR OG1 : rot 84:sc= 0.703 USER MOD Single : A 579 LYS NZ :NH3+ 142:sc= 1.03 (180deg=0.355) USER MOD Single : A 587 GLN : amide:sc= 0 X(o=0,f=-0.05) USER MOD Single : A 588 HIS : no HE2:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 590 TYR OH : rot 180:sc= 0 USER MOD Single : A 591 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 592 SER OG : rot 180:sc= 0.0887 USER MOD Single : A 597 MET CE :methyl 162:sc= -0.204 (180deg=-1.12) USER MOD Single : A 599 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 603 CYS SG : rot 82:sc= 0.0359 USER MOD Single : A 606 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 608 CYS SG : rot -110:sc= 0 USER MOD Single : A 609 THR OG1 : rot 175:sc= 2.29 USER MOD Single : A 610 GLN : amide:sc= 1.8 K(o=1.8,f=1.3) USER MOD Single : A 619 MET CE :methyl 162:sc= -0.1 (180deg=-0.557) USER MOD Single : A 620 ASN : amide:sc= 0.0808 K(o=0.081,f=-2.4!) USER MOD Single : A 625 MET CE :methyl -98:sc= -3.16! (180deg=-3.6!) USER MOD Single : A 626 SER OG : rot -174:sc= 1.2 USER MOD Single : A 627 GLN : amide:sc= 0.761 K(o=0.76,f=-3.5!) USER MOD Single : A 632 SER OG : rot 71:sc= 1.31 USER MOD Single : A 640 CYS SG : rot 160:sc= 0 USER MOD Single : A 649 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 650 LYS NZ :NH3+ 137:sc= 0.214 (180deg=-0.0636) USER MOD Single : A 651 SER OG A: rot 180:sc= 0 USER MOD Single : A 651 SER OG B: rot 180:sc= 0 USER MOD Single : A 653 TYR OH A: rot 180:sc= 0.799 USER MOD Single : A 653 TYR OH B: rot 180:sc= 0.958 USER MOD Single : A 654 SER OG : rot -84:sc= 1.02 USER MOD Single : A 655 SER OG : rot 139:sc= 1.04 USER MOD Single : A 656 TYR OH : rot 60:sc= -0.131 USER MOD Single : A 662 ASN : amide:sc= 1.09 K(o=1.1,f=-0.19) USER MOD Single : A 669 SER OG : rot 180:sc= 0.157 USER MOD Single : A 670 SER OG : rot -160:sc= 0.603 USER MOD Single : A 672 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0892) USER MOD Single : A 675 LYS NZ :NH3+ -143:sc= 1.18 (180deg=0.1) USER MOD Single : A 682 TYR OH : rot 13:sc= 1.43 USER MOD Single : A 687 THR OG1 : rot -81:sc= 1.23 USER MOD Single : A 692 THR OG1 : rot 180:sc= 0 USER MOD Single : A 700 GLN : amide:sc= 0.833 K(o=0.83,f=-0.12) USER MOD Single : A 711 CYS SG : rot 180:sc= -0.298 USER MOD Single : A 713 LYS NZ :NH3+ 164:sc= 0.0274 (180deg=0.00704) USER MOD Single : A 716 THR OG1 : rot 165:sc= 2.3 USER MOD Single : A 719 HIS : no HE2:sc= 0.655 K(o=0.65,f=-2.2!) USER MOD Single : A 721 THR OG1 : rot 55:sc= 1.39 USER MOD Single : A 722 TYR OH : rot 180:sc= 0 USER MOD Single : A 725 THR OG1 : rot 180:sc= 0 USER MOD Single : A 729 ASN : amide:sc= 0.245 K(o=0.25,f=-3.6!) USER MOD Single : A 731 GLN : amide:sc= 0.714 K(o=0.71,f=0) USER MOD Single : A 733 MET CE :methyl 172:sc= -0.103 (180deg=-0.237) USER MOD Single : A 735 GLN : amide:sc= 2.06 K(o=2.1,f=-8.2!) USER MOD Single : A 740 ASN : amide:sc= -0.0717 K(o=-0.072,f=-0.93!) USER MOD Single : A 748 THR OG1 : rot 167:sc= 0.0151 USER MOD Single : A 749 SER OG : rot 180:sc= 0.00925 USER MOD Single : A 754 GLN : amide:sc= 0.332 K(o=0.33,f=-4.7!) USER MOD Single : A 768 SER OG : rot -78:sc= 1.22 USER MOD Single : A 772 THR OG1 : rot 84:sc= 0.962 USER MOD Single : A 777 HIS : no HD1:sc= 0.912 K(o=0.91,f=-4.9!) USER MOD Single : A 784 THR OG1 : rot 85:sc= 1.31 USER MOD Single : A 788 GLN : amide:sc= 0.861 K(o=0.86,f=-0.35) USER MOD Single : A 789 TYR OH : rot 16:sc= 0.67 USER MOD Single : A 790 SER OG : rot 103:sc= 1.24 USER MOD Single : A 792 TYR OH : rot 7:sc= 1.08 USER MOD Single : A 793 THR OG1 : rot 180:sc= 0 USER MOD Single : A 795 TYR OH : rot 175:sc= -0.106 USER MOD Single : A 798 THR OG1 : rot 180:sc= 0.0328 USER MOD Single : A 802 SER OG : rot -90:sc= -0.235 USER MOD Single : A 804 SER OG : rot 85:sc= 0.528 USER MOD Single : A 805 HIS : no HE2:sc= 0.953 K(o=0.95,f=-3!) USER MOD Single : A 809 SER OG : rot 84:sc= 0.909 USER MOD Single : A 815 GLN : amide:sc= -0.209 X(o=-0.21,f=-0.23) USER MOD Single : A 818 CYS SG : rot 71:sc= 0.401 USER MOD Single : A 819 THR OG1 : rot 180:sc= 0 USER MOD Single : A 828 HIS : no HD1:sc= -0.185 K(o=-0.18,f=-0.81) USER MOD Single : A 832 TYR OH : rot 6:sc= 0.912 USER MOD Single : A 835 GLN : amide:sc= 1.61 K(o=1.6,f=-6.2!) USER MOD Single : A 841 MET CE :methyl -165:sc= -0.0588 (180deg=-0.254) USER MOD Single : A 846 ASN : amide:sc= 0.639 K(o=0.64,f=-4.6!) USER MOD Single : A 847 LYS NZ :NH3+ 146:sc= 3.16 (180deg=1.77) USER MOD Single : A 849 TYR OH : rot 180:sc= 0 USER MOD Single : A 859 SER OG : rot 180:sc= 0 USER MOD Single : A 861 ASN : amide:sc= 0 X(o=0,f=-0.04) USER MOD Single : A 863 SER OG : rot 180:sc= 0.0327 USER MOD Single : A 869 ASN : amide:sc= -1.02 K(o=-1,f=-1.7) USER MOD Single : A 872 CYS SG : rot -1:sc= 0.101 USER MOD Single : A 882 LYS NZ :NH3+ -133:sc= 0.638 (180deg=-0.177) USER MOD Single : A 899 TYR OH : rot 105:sc= 0.00137 USER MOD Single : A 901 THR OG1 : rot 142:sc= 0.532 USER MOD Single : A 905 SER OG : rot 180:sc= 0 USER MOD Single : A 908 MET CE :methyl -128:sc=-0.00602 (180deg=-0.358) USER MOD Single : A 912 TYR OH : rot 180:sc=-0.00735 USER MOD Single : A 913 SER OG : rot 74:sc= 1.06 USER MOD Single : A 914 MET CE :methyl -176:sc= -0.0105 (180deg=-0.0318) USER MOD Single : A 915 HIS : no HD1:sc= 0.0238 K(o=0.024,f=-0.64) USER MOD Single : A 919 THR OG1 : rot 180:sc= 0 USER MOD Single : A 924 THR OG1 : rot 157:sc= 1.1 USER MOD Single : A 929 TYR OH : rot 180:sc= 0 USER MOD Single : A 930 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 935 TYR OH : rot -11:sc= 1.19 USER MOD Single : A 936 TYR OH : rot 180:sc= 0 USER MOD Single : A 937 ASN : amide:sc=-0.00188 X(o=-0.0019,f=0) USER MOD Single : A 940 CYS SG : rot 102:sc= -0.125 USER MOD Single : A 944 SER OG : rot 180:sc= 0 USER MOD Single : A 953 TYR OH : rot 33:sc= 1.11 USER MOD Single : A 957 TYR OH : rot 180:sc= 0 USER MOD Single : A 958 HIS A: no HD1:sc= -0.0549 X(o=-0.055,f=-0.4) USER MOD Single : A 958 HIS B: no HD1:sc= 0 X(o=0,f=-0.0082) USER MOD Single : A 962 SER OG : rot -77:sc= 1.08 USER MOD Single : A 963 CYS SG : rot 180:sc= 0 USER MOD Single : A1005 DMS C1 :methyl 145:sc= 0 (180deg=-1.24) USER MOD Single : A1005 DMS C2 :methyl -124:sc= -0.0733 (180deg=-1.22) USER MOD Single : A1006 DMS C1 :methyl -120:sc=-0.00603 (180deg=-2!) USER MOD Single : A1006 DMS C2 :methyl 152:sc= -0.169 (180deg=-0.618) USER MOD Single : A1007 DMS C1 :methyl -173:sc= -0.0792 (180deg=-0.108) USER MOD Single : A1007 DMS C2 :methyl -158:sc= 0 (180deg=-0.193) USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 450 30.479 -19.999 -15.324 1.00 70.02 N ANISOU 1 N ASP A 450 9982 8334 8290 1150 378 -1717 N ATOM 2 CA ASP A 450 30.677 -19.112 -14.181 1.00 68.08 C ANISOU 2 CA ASP A 450 9613 8139 8115 1092 390 -1559 C ATOM 3 C ASP A 450 29.339 -18.629 -13.589 1.00 68.97 C ANISOU 3 C ASP A 450 9709 8255 8241 994 254 -1502 C ATOM 4 O ASP A 450 28.859 -17.530 -13.912 1.00 69.45 O ANISOU 4 O ASP A 450 9800 8404 8184 958 235 -1461 O ATOM 5 CB ASP A 450 31.606 -17.942 -14.551 1.00 69.98 C ANISOU 5 CB ASP A 450 9838 8499 8253 1120 521 -1489 C ATOM 0 HA ASP A 450 31.115 -19.622 -13.482 1.00 68.08 H new ATOM 6 N LYS A 451 28.745 -19.476 -12.720 1.00 61.55 N ANISOU 6 N LYS A 451 8720 7213 7454 955 165 -1495 N ATOM 7 CA LYS A 451 27.461 -19.266 -12.041 1.00 58.89 C ANISOU 7 CA LYS A 451 8353 6853 7168 866 42 -1442 C ATOM 8 C LYS A 451 27.412 -17.948 -11.261 1.00 57.40 C ANISOU 8 C LYS A 451 8092 6761 6955 813 55 -1303 C ATOM 9 O LYS A 451 28.389 -17.601 -10.593 1.00 56.57 O ANISOU 9 O LYS A 451 7911 6694 6890 831 135 -1222 O ATOM 10 CB LYS A 451 27.142 -20.465 -11.136 1.00 62.01 C ANISOU 10 CB LYS A 451 8690 7117 7752 848 -15 -1437 C ATOM 11 CG LYS A 451 26.721 -21.709 -11.912 1.00 72.39 C ANISOU 11 CG LYS A 451 10081 8318 9106 875 -74 -1584 C ATOM 12 CD LYS A 451 26.067 -22.751 -11.026 1.00 82.80 C ANISOU 12 CD LYS A 451 11342 9501 10619 835 -151 -1565 C ATOM 13 CE LYS A 451 26.956 -23.953 -10.803 1.00 96.41 C ANISOU 13 CE LYS A 451 13041 11121 12470 900 -95 -1599 C ATOM 14 NZ LYS A 451 26.286 -24.994 -9.976 1.00104.07 N ANISOU 14 NZ LYS A 451 13957 11949 13636 862 -167 -1574 N ATOM 0 H LYS A 451 29.107 -20.226 -12.505 1.00 61.55 H new ATOM 0 HA LYS A 451 26.777 -19.197 -12.725 1.00 58.89 H new ATOM 0 HB2 LYS A 451 27.923 -20.674 -10.600 1.00 62.01 H new ATOM 0 HB3 LYS A 451 26.433 -20.219 -10.521 1.00 62.01 H new ATOM 0 HG2 LYS A 451 26.104 -21.454 -12.616 1.00 72.39 H new ATOM 0 HG3 LYS A 451 27.499 -22.097 -12.343 1.00 72.39 H new ATOM 0 HD2 LYS A 451 25.845 -22.352 -10.170 1.00 82.80 H new ATOM 0 HD3 LYS A 451 25.233 -23.038 -11.429 1.00 82.80 H new ATOM 0 HE2 LYS A 451 27.206 -24.333 -11.660 1.00 96.41 H new ATOM 0 HE3 LYS A 451 27.776 -23.672 -10.367 1.00 96.41 H new ATOM 0 HZ1 LYS A 451 26.836 -25.685 -9.865 1.00104.07 H new ATOM 0 HZ2 LYS A 451 26.076 -24.652 -9.182 1.00104.07 H new ATOM 0 HZ3 LYS A 451 25.545 -25.268 -10.386 1.00104.07 H new ATOM 15 N LYS A 452 26.296 -17.184 -11.392 1.00 50.18 N ANISOU 15 N LYS A 452 7201 5888 5976 751 -27 -1282 N ATOM 16 CA LYS A 452 26.149 -15.866 -10.743 1.00 45.87 C ANISOU 16 CA LYS A 452 6596 5431 5400 701 -19 -1162 C ATOM 17 C LYS A 452 25.558 -16.000 -9.353 1.00 45.11 C ANISOU 17 C LYS A 452 6411 5291 5438 642 -75 -1074 C ATOM 18 O LYS A 452 25.615 -15.074 -8.545 1.00 43.44 O ANISOU 18 O LYS A 452 6136 5140 5231 609 -59 -973 O ATOM 19 CB LYS A 452 25.341 -14.887 -11.610 1.00 47.39 C ANISOU 19 CB LYS A 452 6858 5694 5452 673 -65 -1176 C ATOM 20 CG LYS A 452 25.683 -14.912 -13.103 1.00 60.17 C ANISOU 20 CG LYS A 452 8593 7350 6919 735 -27 -1274 C ATOM 21 CD LYS A 452 26.648 -13.812 -13.539 1.00 66.10 C ANISOU 21 CD LYS A 452 9349 8208 7557 769 93 -1218 C ATOM 0 H LYS A 452 25.613 -17.421 -11.858 1.00 50.18 H new ATOM 0 HA LYS A 452 27.038 -15.491 -10.648 1.00 45.87 H new ATOM 0 HB2 LYS A 452 24.397 -15.085 -11.505 1.00 47.39 H new ATOM 0 HB3 LYS A 452 25.481 -13.988 -11.275 1.00 47.39 H new ATOM 0 HG2 LYS A 452 26.070 -15.774 -13.322 1.00 60.17 H new ATOM 0 HG3 LYS A 452 24.863 -14.831 -13.614 1.00 60.17 H new ATOM 22 N TRP A 453 24.997 -17.164 -9.065 1.00 40.52 N ANISOU 22 N TRP A 453 5825 4600 4970 632 -137 -1112 N ATOM 23 CA TRP A 453 24.429 -17.438 -7.750 1.00 38.15 C ANISOU 23 CA TRP A 453 5446 4249 4802 584 -178 -1023 C ATOM 24 C TRP A 453 24.632 -18.900 -7.437 1.00 39.70 C ANISOU 24 C TRP A 453 5628 4323 5135 612 -184 -1057 C ATOM 25 O TRP A 453 24.827 -19.707 -8.345 1.00 39.12 O ANISOU 25 O TRP A 453 5615 4192 5058 653 -187 -1170 O ATOM 26 CB TRP A 453 22.938 -17.020 -7.669 1.00 36.22 C ANISOU 26 CB TRP A 453 5202 3999 4562 511 -274 -1005 C ATOM 27 CG TRP A 453 22.071 -17.782 -8.615 1.00 38.27 C ANISOU 27 CG TRP A 453 5526 4180 4835 502 -360 -1119 C ATOM 28 CD1 TRP A 453 21.803 -17.461 -9.912 1.00 41.43 C ANISOU 28 CD1 TRP A 453 6015 4618 5110 515 -397 -1214 C ATOM 29 CD2 TRP A 453 21.474 -19.069 -8.382 1.00 38.96 C ANISOU 29 CD2 TRP A 453 5598 4132 5072 487 -420 -1159 C ATOM 30 NE1 TRP A 453 21.064 -18.456 -10.499 1.00 42.71 N ANISOU 30 NE1 TRP A 453 6219 4679 5329 508 -487 -1321 N ATOM 31 CE2 TRP A 453 20.845 -19.459 -9.584 1.00 44.23 C ANISOU 31 CE2 TRP A 453 6344 4758 5701 488 -502 -1291 C ATOM 32 CE3 TRP A 453 21.352 -19.901 -7.251 1.00 39.73 C ANISOU 32 CE3 TRP A 453 5622 4137 5335 471 -416 -1090 C ATOM 33 CZ2 TRP A 453 20.100 -20.644 -9.691 1.00 43.88 C ANISOU 33 CZ2 TRP A 453 6300 4577 5795 468 -585 -1364 C ATOM 34 CZ3 TRP A 453 20.703 -21.119 -7.387 1.00 42.33 C ANISOU 34 CZ3 TRP A 453 5954 4328 5801 457 -481 -1153 C ATOM 35 CH2 TRP A 453 20.062 -21.469 -8.587 1.00 44.00 C ANISOU 35 CH2 TRP A 453 6236 4494 5987 451 -568 -1292 C ATOM 0 H TRP A 453 24.934 -17.816 -9.622 1.00 40.52 H new ATOM 0 HA TRP A 453 24.885 -16.905 -7.081 1.00 38.15 H new ATOM 0 HB2 TRP A 453 22.618 -17.155 -6.763 1.00 36.22 H new ATOM 0 HB3 TRP A 453 22.862 -16.072 -7.859 1.00 36.22 H new ATOM 0 HD1 TRP A 453 22.081 -16.682 -10.337 1.00 41.43 H new ATOM 0 HE1 TRP A 453 20.782 -18.453 -11.311 1.00 42.71 H new ATOM 0 HE3 TRP A 453 21.700 -19.638 -6.430 1.00 39.73 H new ATOM 0 HZ2 TRP A 453 19.650 -20.864 -10.475 1.00 43.88 H new ATOM 0 HZ3 TRP A 453 20.692 -21.714 -6.672 1.00 42.33 H new ATOM 0 HH2 TRP A 453 19.602 -22.275 -8.638 1.00 44.00 H new ATOM 36 N LEU A 454 24.590 -19.247 -6.156 1.00 35.66 N ANISOU 36 N LEU A 454 5040 3769 4740 595 -184 -959 N ATOM 37 CA LEU A 454 24.782 -20.622 -5.706 1.00 35.03 C ANISOU 37 CA LEU A 454 4936 3566 4807 622 -186 -965 C ATOM 38 C LEU A 454 23.863 -20.892 -4.555 1.00 37.05 C ANISOU 38 C LEU A 454 5133 3766 5176 569 -230 -866 C ATOM 39 O LEU A 454 23.531 -19.974 -3.809 1.00 34.80 O ANISOU 39 O LEU A 454 4811 3556 4854 532 -229 -771 O ATOM 40 CB LEU A 454 26.239 -20.817 -5.230 1.00 35.37 C ANISOU 40 CB LEU A 454 4938 3628 4872 689 -102 -925 C ATOM 41 CG LEU A 454 27.337 -20.764 -6.299 1.00 41.63 C ANISOU 41 CG LEU A 454 5775 4459 5584 756 -33 -1017 C ATOM 42 CD1 LEU A 454 28.708 -20.614 -5.654 1.00 41.69 C ANISOU 42 CD1 LEU A 454 5716 4507 5616 809 46 -948 C ATOM 43 CD2 LEU A 454 27.281 -22.001 -7.228 1.00 42.27 C ANISOU 43 CD2 LEU A 454 5918 4427 5714 795 -46 -1149 C ATOM 0 H LEU A 454 24.448 -18.688 -5.518 1.00 35.66 H new ATOM 0 HA LEU A 454 24.593 -21.228 -6.439 1.00 35.03 H new ATOM 0 HB2 LEU A 454 26.432 -20.137 -4.566 1.00 35.37 H new ATOM 0 HB3 LEU A 454 26.297 -21.675 -4.782 1.00 35.37 H new ATOM 0 HG LEU A 454 27.180 -19.983 -6.852 1.00 41.63 H new ATOM 0 HD11 LEU A 454 29.389 -20.582 -6.344 1.00 41.69 H new ATOM 0 HD12 LEU A 454 28.734 -19.794 -5.136 1.00 41.69 H new ATOM 0 HD13 LEU A 454 28.875 -21.370 -5.070 1.00 41.69 H new ATOM 0 HD21 LEU A 454 27.985 -21.939 -7.892 1.00 42.27 H new ATOM 0 HD22 LEU A 454 27.403 -22.807 -6.702 1.00 42.27 H new ATOM 0 HD23 LEU A 454 26.420 -22.033 -7.673 1.00 42.27 H new ATOM 44 N GLY A 455 23.513 -22.157 -4.373 1.00 35.42 N ANISOU 44 N GLY A 455 4919 3426 5115 570 -259 -884 N ATOM 45 CA GLY A 455 22.702 -22.596 -3.246 1.00 35.24 C ANISOU 45 CA GLY A 455 4837 3332 5222 528 -284 -778 C ATOM 46 C GLY A 455 21.266 -22.842 -3.599 1.00 40.68 C ANISOU 46 C GLY A 455 5532 3946 5977 462 -364 -818 C ATOM 47 O GLY A 455 20.972 -23.308 -4.700 1.00 41.82 O ANISOU 47 O GLY A 455 5729 4034 6127 461 -416 -949 O ATOM 0 H GLY A 455 23.742 -22.792 -4.906 1.00 35.42 H new ATOM 0 HA2 GLY A 455 23.082 -23.411 -2.882 1.00 35.24 H new ATOM 0 HA3 GLY A 455 22.745 -21.926 -2.546 1.00 35.24 H new ATOM 48 N THR A 456 20.370 -22.562 -2.646 1.00 37.90 N ANISOU 48 N THR A 456 5126 3592 5682 409 -376 -706 N ATOM 49 CA THR A 456 18.920 -22.711 -2.805 1.00 38.46 C ANISOU 49 CA THR A 456 5179 3592 5840 339 -448 -720 C ATOM 50 C THR A 456 18.436 -21.661 -3.808 1.00 42.45 C ANISOU 50 C THR A 456 5729 4189 6211 311 -500 -800 C ATOM 51 O THR A 456 18.781 -20.483 -3.659 1.00 40.24 O ANISOU 51 O THR A 456 5454 4040 5794 316 -465 -756 O ATOM 52 CB THR A 456 18.204 -22.546 -1.437 1.00 40.22 C ANISOU 52 CB THR A 456 5329 3809 6143 299 -421 -562 C ATOM 53 OG1 THR A 456 18.671 -23.558 -0.543 1.00 45.46 O ANISOU 53 OG1 THR A 456 5961 4388 6924 333 -373 -481 O ATOM 54 CG2 THR A 456 16.680 -22.636 -1.542 1.00 36.66 C ANISOU 54 CG2 THR A 456 4843 3286 5801 225 -485 -563 C ATOM 0 H THR A 456 20.597 -22.272 -1.869 1.00 37.90 H new ATOM 0 HA THR A 456 18.710 -23.598 -3.137 1.00 38.46 H new ATOM 0 HB THR A 456 18.415 -21.658 -1.108 1.00 40.22 H new ATOM 0 HG1 THR A 456 19.461 -23.387 -0.315 1.00 45.46 H new ATOM 0 HG21 THR A 456 16.288 -22.526 -0.662 1.00 36.66 H new ATOM 0 HG22 THR A 456 16.354 -21.937 -2.130 1.00 36.66 H new ATOM 0 HG23 THR A 456 16.431 -23.502 -1.901 1.00 36.66 H new ATOM 55 N PRO A 457 17.613 -22.045 -4.811 1.00 43.07 N ANISOU 55 N PRO A 457 5838 4197 6329 281 -591 -915 N ATOM 56 CA PRO A 457 17.077 -21.030 -5.743 1.00 43.23 C ANISOU 56 CA PRO A 457 5902 4305 6218 257 -651 -980 C ATOM 57 C PRO A 457 16.317 -19.968 -4.955 1.00 46.43 C ANISOU 57 C PRO A 457 6249 4783 6608 206 -642 -862 C ATOM 58 O PRO A 457 15.705 -20.294 -3.941 1.00 45.60 O ANISOU 58 O PRO A 457 6071 4618 6635 172 -627 -764 O ATOM 59 CB PRO A 457 16.131 -21.838 -6.646 1.00 45.88 C ANISOU 59 CB PRO A 457 6259 4523 6650 226 -765 -1103 C ATOM 60 CG PRO A 457 16.618 -23.239 -6.548 1.00 51.37 C ANISOU 60 CG PRO A 457 6953 5086 7478 258 -750 -1145 C ATOM 61 CD PRO A 457 17.111 -23.398 -5.144 1.00 46.33 C ANISOU 61 CD PRO A 457 6246 4444 6912 268 -651 -992 C ATOM 0 HA PRO A 457 17.758 -20.562 -6.251 1.00 43.23 H new ATOM 0 HB2 PRO A 457 15.211 -21.763 -6.348 1.00 45.88 H new ATOM 0 HB3 PRO A 457 16.160 -21.518 -7.561 1.00 45.88 H new ATOM 0 HG2 PRO A 457 15.907 -23.870 -6.741 1.00 51.37 H new ATOM 0 HG3 PRO A 457 17.328 -23.407 -7.188 1.00 51.37 H new ATOM 0 HD2 PRO A 457 16.401 -23.675 -4.544 1.00 46.33 H new ATOM 0 HD3 PRO A 457 17.812 -24.066 -5.083 1.00 46.33 H new ATOM 62 N ILE A 458 16.382 -18.712 -5.392 1.00 44.41 N ANISOU 62 N ILE A 458 6025 4653 6196 206 -643 -866 N ATOM 63 CA ILE A 458 15.768 -17.577 -4.696 1.00 44.09 C ANISOU 63 CA ILE A 458 5934 4690 6128 166 -628 -762 C ATOM 64 C ILE A 458 14.219 -17.686 -4.639 1.00 48.36 C ANISOU 64 C ILE A 458 6421 5158 6794 99 -709 -751 C ATOM 65 O ILE A 458 13.614 -17.243 -3.660 1.00 47.52 O ANISOU 65 O ILE A 458 6248 5065 6743 66 -677 -643 O ATOM 66 CB ILE A 458 16.278 -16.208 -5.251 1.00 46.66 C ANISOU 66 CB ILE A 458 6306 5157 6265 186 -607 -772 C ATOM 67 CG1 ILE A 458 16.149 -15.085 -4.176 1.00 46.19 C ANISOU 67 CG1 ILE A 458 6191 5182 6178 165 -552 -648 C ATOM 68 CG2 ILE A 458 15.630 -15.826 -6.586 1.00 46.52 C ANISOU 68 CG2 ILE A 458 6346 5157 6173 172 -700 -870 C ATOM 69 CD1 ILE A 458 17.093 -13.884 -4.363 1.00 48.43 C ANISOU 69 CD1 ILE A 458 6505 5593 6303 196 -497 -634 C ATOM 0 H ILE A 458 16.791 -18.489 -6.115 1.00 44.41 H new ATOM 0 HA ILE A 458 16.061 -17.614 -3.772 1.00 44.09 H new ATOM 0 HB ILE A 458 17.222 -16.314 -5.447 1.00 46.66 H new ATOM 0 HG12 ILE A 458 15.234 -14.762 -4.176 1.00 46.19 H new ATOM 0 HG13 ILE A 458 16.313 -15.474 -3.302 1.00 46.19 H new ATOM 0 HG21 ILE A 458 15.981 -14.972 -6.884 1.00 46.52 H new ATOM 0 HG22 ILE A 458 15.829 -16.506 -7.249 1.00 46.52 H new ATOM 0 HG23 ILE A 458 14.669 -15.758 -6.472 1.00 46.52 H new ATOM 0 HD11 ILE A 458 16.943 -13.241 -3.653 1.00 48.43 H new ATOM 0 HD12 ILE A 458 18.014 -14.188 -4.334 1.00 48.43 H new ATOM 0 HD13 ILE A 458 16.918 -13.465 -5.220 1.00 48.43 H new ATOM 70 N GLU A 459 13.609 -18.338 -5.629 1.00 46.33 N ANISOU 70 N GLU A 459 6190 4819 6592 83 -810 -864 N ATOM 71 CA GLU A 459 12.163 -18.589 -5.711 1.00 47.50 C ANISOU 71 CA GLU A 459 6281 4880 6886 19 -903 -873 C ATOM 72 C GLU A 459 11.705 -19.519 -4.569 1.00 50.16 C ANISOU 72 C GLU A 459 6528 5099 7432 -11 -863 -780 C ATOM 73 O GLU A 459 10.561 -19.437 -4.135 1.00 48.40 O ANISOU 73 O GLU A 459 6227 4829 7335 -66 -888 -721 O ATOM 74 CB GLU A 459 11.790 -19.210 -7.076 1.00 50.51 C ANISOU 74 CB GLU A 459 6720 5193 7278 17 -1030 -1034 C ATOM 75 CG GLU A 459 12.212 -18.375 -8.276 1.00 63.76 C ANISOU 75 CG GLU A 459 8500 6985 8741 55 -1069 -1123 C ATOM 76 CD GLU A 459 13.582 -18.641 -8.878 1.00 81.15 C ANISOU 76 CD GLU A 459 10799 9230 10806 128 -1013 -1198 C ATOM 77 OE1 GLU A 459 14.504 -19.052 -8.137 1.00 66.94 O ANISOU 77 OE1 GLU A 459 8982 7420 9031 159 -910 -1143 O ATOM 78 OE2 GLU A 459 13.738 -18.408 -10.099 1.00 72.99 O ANISOU 78 OE2 GLU A 459 9858 8241 9633 159 -1070 -1308 O ATOM 0 H GLU A 459 14.041 -18.660 -6.299 1.00 46.33 H new ATOM 0 HA GLU A 459 11.708 -17.737 -5.622 1.00 47.50 H new ATOM 0 HB2 GLU A 459 12.200 -20.087 -7.144 1.00 50.51 H new ATOM 0 HB3 GLU A 459 10.830 -19.343 -7.108 1.00 50.51 H new ATOM 0 HG2 GLU A 459 11.550 -18.501 -8.974 1.00 63.76 H new ATOM 0 HG3 GLU A 459 12.177 -17.441 -8.016 1.00 63.76 H new ATOM 79 N GLU A 460 12.600 -20.380 -4.084 1.00 48.17 N ANISOU 79 N GLU A 460 6285 4799 7219 27 -795 -760 N ATOM 80 CA GLU A 460 12.310 -21.296 -2.978 1.00 49.97 C ANISOU 80 CA GLU A 460 6438 4917 7633 10 -743 -658 C ATOM 81 C GLU A 460 12.390 -20.603 -1.584 1.00 56.19 C ANISOU 81 C GLU A 460 7176 5783 8389 13 -635 -491 C ATOM 82 O GLU A 460 11.997 -21.214 -0.588 1.00 57.52 O ANISOU 82 O GLU A 460 7282 5874 8699 -2 -584 -385 O ATOM 83 CB GLU A 460 13.259 -22.502 -3.017 1.00 51.86 C ANISOU 83 CB GLU A 460 6708 5069 7927 57 -716 -698 C ATOM 84 CG GLU A 460 13.089 -23.408 -4.223 1.00 65.01 C ANISOU 84 CG GLU A 460 8414 6626 9660 55 -818 -862 C ATOM 85 CD GLU A 460 11.949 -24.408 -4.168 1.00 94.69 C ANISOU 85 CD GLU A 460 12103 10213 13663 -4 -887 -875 C ATOM 86 OE1 GLU A 460 11.343 -24.582 -3.085 1.00102.92 O ANISOU 86 OE1 GLU A 460 13058 11202 14846 -40 -835 -737 O ATOM 87 OE2 GLU A 460 11.683 -25.044 -5.212 1.00 88.89 O ANISOU 87 OE2 GLU A 460 11402 9391 12981 -12 -992 -1024 O ATOM 0 H GLU A 460 13.401 -20.450 -4.390 1.00 48.17 H new ATOM 0 HA GLU A 460 11.395 -21.596 -3.098 1.00 49.97 H new ATOM 0 HB2 GLU A 460 14.173 -22.179 -2.998 1.00 51.86 H new ATOM 0 HB3 GLU A 460 13.127 -23.028 -2.212 1.00 51.86 H new ATOM 0 HG2 GLU A 460 12.965 -22.850 -5.006 1.00 65.01 H new ATOM 0 HG3 GLU A 460 13.916 -23.898 -4.353 1.00 65.01 H new ATOM 88 N MET A 461 12.909 -19.359 -1.513 1.00 51.73 N ANISOU 88 N MET A 461 6644 5368 7642 35 -598 -469 N ATOM 89 CA MET A 461 13.070 -18.607 -0.252 1.00 51.99 C ANISOU 89 CA MET A 461 6645 5488 7622 45 -505 -332 C ATOM 90 C MET A 461 11.783 -17.843 0.143 1.00 62.30 C ANISOU 90 C MET A 461 7888 6810 8974 -8 -512 -267 C ATOM 91 O MET A 461 11.057 -17.351 -0.735 1.00 63.16 O ANISOU 91 O MET A 461 7996 6924 9077 -43 -593 -338 O ATOM 92 CB MET A 461 14.280 -17.631 -0.328 1.00 52.61 C ANISOU 92 CB MET A 461 6780 5709 7503 94 -464 -343 C ATOM 93 CG MET A 461 15.625 -18.289 -0.667 1.00 55.65 C ANISOU 93 CG MET A 461 7215 6085 7842 153 -444 -398 C ATOM 94 SD MET A 461 16.244 -19.393 0.634 1.00 60.20 S ANISOU 94 SD MET A 461 7759 6591 8523 192 -369 -290 S ATOM 95 CE MET A 461 17.800 -18.839 0.807 1.00 55.89 C ANISOU 95 CE MET A 461 7250 6158 7827 257 -318 -287 C ATOM 0 H MET A 461 13.179 -18.926 -2.205 1.00 51.73 H new ATOM 0 HA MET A 461 13.245 -19.262 0.442 1.00 51.99 H new ATOM 0 HB2 MET A 461 14.090 -16.953 -0.995 1.00 52.61 H new ATOM 0 HB3 MET A 461 14.364 -17.175 0.524 1.00 52.61 H new ATOM 0 HG2 MET A 461 15.531 -18.793 -1.490 1.00 55.65 H new ATOM 0 HG3 MET A 461 16.283 -17.596 -0.832 1.00 55.65 H new ATOM 0 HE1 MET A 461 18.160 -19.143 1.655 1.00 55.89 H new ATOM 0 HE2 MET A 461 18.348 -19.180 0.083 1.00 55.89 H new ATOM 0 HE3 MET A 461 17.803 -17.869 0.784 1.00 55.89 H new ATOM 96 N ARG A 462 11.494 -17.743 1.461 1.00 61.92 N ANISOU 96 N ARG A 462 7789 6769 8970 -10 -427 -132 N ATOM 97 CA ARG A 462 10.270 -17.065 1.928 1.00 62.78 C ANISOU 97 CA ARG A 462 7833 6888 9134 -54 -415 -64 C ATOM 98 C ARG A 462 10.338 -15.547 1.775 1.00 66.74 C ANISOU 98 C ARG A 462 8357 7527 9476 -50 -416 -76 C ATOM 99 O ARG A 462 11.331 -14.922 2.161 1.00 61.26 O ANISOU 99 O ARG A 462 7706 6932 8636 -7 -367 -58 O ATOM 100 CB ARG A 462 9.861 -17.465 3.364 1.00 63.41 C ANISOU 100 CB ARG A 462 7855 6928 9311 -53 -314 85 C ATOM 101 CG ARG A 462 9.305 -18.885 3.482 1.00 74.09 C ANISOU 101 CG ARG A 462 9155 8118 10878 -78 -317 114 C ATOM 102 CD ARG A 462 8.699 -19.170 4.849 1.00 84.17 C ANISOU 102 CD ARG A 462 10369 9355 12255 -81 -208 276 C ATOM 103 NE ARG A 462 9.715 -19.237 5.901 1.00101.18 N ANISOU 103 NE ARG A 462 12569 11574 14300 -16 -117 367 N ATOM 104 CZ ARG A 462 10.318 -20.352 6.306 1.00120.69 C ANISOU 104 CZ ARG A 462 15052 13970 16833 17 -85 414 C ATOM 105 NH1 ARG A 462 10.004 -21.521 5.761 1.00109.41 N ANISOU 105 NH1 ARG A 462 13593 12392 15585 -12 -130 376 N ATOM 106 NH2 ARG A 462 11.236 -20.307 7.263 1.00108.41 N ANISOU 106 NH2 ARG A 462 13540 12485 15165 80 -15 497 N ATOM 0 H ARG A 462 11.990 -18.058 2.089 1.00 61.92 H new ATOM 0 HA ARG A 462 9.568 -17.382 1.338 1.00 62.78 H new ATOM 0 HB2 ARG A 462 10.633 -17.381 3.945 1.00 63.41 H new ATOM 0 HB3 ARG A 462 9.194 -16.839 3.686 1.00 63.41 H new ATOM 0 HG2 ARG A 462 8.630 -19.021 2.799 1.00 74.09 H new ATOM 0 HG3 ARG A 462 10.016 -19.522 3.309 1.00 74.09 H new ATOM 0 HD2 ARG A 462 8.056 -18.477 5.067 1.00 84.17 H new ATOM 0 HD3 ARG A 462 8.213 -20.009 4.817 1.00 84.17 H new ATOM 0 HE ARG A 462 9.939 -18.501 6.286 1.00101.18 H new ATOM 0 HH11 ARG A 462 9.408 -21.561 5.142 1.00109.41 H new ATOM 0 HH12 ARG A 462 10.397 -22.239 6.026 1.00109.41 H new ATOM 0 HH21 ARG A 462 11.444 -19.555 7.625 1.00108.41 H new ATOM 0 HH22 ARG A 462 11.623 -21.030 7.522 1.00108.41 H new ATOM 107 N ARG A 463 9.265 -14.987 1.160 1.00 68.55 N ANISOU 107 N ARG A 463 8551 7749 9747 -95 -481 -110 N ATOM 108 CA ARG A 463 9.026 -13.566 0.879 1.00 69.57 C ANISOU 108 CA ARG A 463 8688 7983 9763 -101 -497 -122 C ATOM 109 C ARG A 463 7.754 -13.083 1.634 1.00 80.74 C ANISOU 109 C ARG A 463 10016 9384 11279 -136 -460 -33 C ATOM 110 O ARG A 463 7.223 -13.824 2.463 1.00 81.67 O ANISOU 110 O ARG A 463 10075 9424 11531 -149 -404 48 O ATOM 111 CB ARG A 463 8.949 -13.289 -0.646 1.00 67.96 C ANISOU 111 CB ARG A 463 8528 7790 9504 -113 -613 -246 C ATOM 112 CG ARG A 463 10.289 -13.386 -1.402 1.00 70.38 C ANISOU 112 CG ARG A 463 8929 8146 9666 -67 -626 -329 C ATOM 113 CD ARG A 463 10.219 -12.781 -2.810 1.00 72.38 C ANISOU 113 CD ARG A 463 9237 8443 9820 -69 -719 -430 C ATOM 114 NE ARG A 463 11.370 -13.113 -3.672 1.00 76.35 N ANISOU 114 NE ARG A 463 9828 8971 10209 -25 -730 -519 N ATOM 115 CZ ARG A 463 12.351 -12.268 -4.001 1.00 85.47 C ANISOU 115 CZ ARG A 463 11042 10231 11202 13 -692 -531 C ATOM 116 NH1 ARG A 463 12.365 -11.034 -3.518 1.00 75.71 N ANISOU 116 NH1 ARG A 463 9787 9082 9899 11 -647 -464 N ATOM 117 NH2 ARG A 463 13.323 -12.652 -4.818 1.00 61.44 N ANISOU 117 NH2 ARG A 463 8073 7200 8071 54 -695 -610 N ATOM 0 H ARG A 463 8.615 -15.476 0.880 1.00 68.55 H new ATOM 0 HA ARG A 463 9.781 -13.053 1.207 1.00 69.57 H new ATOM 0 HB2 ARG A 463 8.325 -13.917 -1.043 1.00 67.96 H new ATOM 0 HB3 ARG A 463 8.582 -12.401 -0.780 1.00 67.96 H new ATOM 0 HG2 ARG A 463 10.977 -12.931 -0.892 1.00 70.38 H new ATOM 0 HG3 ARG A 463 10.553 -14.317 -1.467 1.00 70.38 H new ATOM 0 HD2 ARG A 463 9.406 -13.087 -3.242 1.00 72.38 H new ATOM 0 HD3 ARG A 463 10.154 -11.816 -2.733 1.00 72.38 H new ATOM 0 HE ARG A 463 11.412 -13.912 -3.987 1.00 76.35 H new ATOM 0 HH11 ARG A 463 11.740 -10.772 -2.989 1.00 75.71 H new ATOM 0 HH12 ARG A 463 12.999 -10.495 -3.734 1.00 75.71 H new ATOM 0 HH21 ARG A 463 13.324 -13.450 -5.140 1.00 61.44 H new ATOM 0 HH22 ARG A 463 13.952 -12.103 -5.026 1.00 61.44 H new ATOM 118 N MET A 464 7.300 -11.837 1.383 1.00 81.92 N ANISOU 118 N MET A 464 10155 9606 11364 -147 -481 -40 N ATOM 119 CA MET A 464 6.144 -11.212 2.049 1.00 83.87 C ANISOU 119 CA MET A 464 10321 9851 11695 -172 -440 38 C ATOM 120 C MET A 464 5.285 -10.339 1.088 1.00 92.02 C ANISOU 120 C MET A 464 11327 10898 12738 -203 -535 -15 C ATOM 121 O MET A 464 5.793 -9.923 0.039 1.00 91.19 O ANISOU 121 O MET A 464 11287 10841 12519 -193 -613 -100 O ATOM 122 CB MET A 464 6.616 -10.379 3.259 1.00 85.32 C ANISOU 122 CB MET A 464 10519 10129 11770 -134 -323 121 C ATOM 0 H MET A 464 7.670 -11.321 0.803 1.00 81.92 H new ATOM 0 HA MET A 464 5.570 -11.933 2.353 1.00 83.87 H new ATOM 123 N PRO A 465 3.993 -10.039 1.405 1.00 92.09 N ANISOU 123 N PRO A 465 11241 10866 12883 -237 -530 36 N ATOM 124 CA PRO A 465 3.209 -10.446 2.592 1.00 93.24 C ANISOU 124 CA PRO A 465 11299 10952 13177 -251 -430 145 C ATOM 125 C PRO A 465 2.641 -11.869 2.492 1.00 99.75 C ANISOU 125 C PRO A 465 12063 11635 14201 -288 -460 149 C ATOM 126 O PRO A 465 1.960 -12.319 3.418 1.00100.20 O ANISOU 126 O PRO A 465 12042 11629 14400 -302 -371 247 O ATOM 127 CB PRO A 465 2.120 -9.369 2.653 1.00 95.05 C ANISOU 127 CB PRO A 465 11454 11202 13457 -269 -430 175 C ATOM 128 CG PRO A 465 1.833 -9.084 1.201 1.00 99.67 C ANISOU 128 CG PRO A 465 12051 11782 14038 -293 -587 71 C ATOM 129 CD PRO A 465 3.172 -9.215 0.490 1.00 94.40 C ANISOU 129 CD PRO A 465 11504 11170 13193 -262 -631 -11 C ATOM 0 HA PRO A 465 3.746 -10.496 3.399 1.00 93.24 H new ATOM 0 HB2 PRO A 465 1.330 -9.685 3.119 1.00 95.05 H new ATOM 0 HB3 PRO A 465 2.427 -8.576 3.120 1.00 95.05 H new ATOM 0 HG2 PRO A 465 1.185 -9.711 0.843 1.00 99.67 H new ATOM 0 HG3 PRO A 465 1.462 -8.195 1.086 1.00 99.67 H new ATOM 0 HD2 PRO A 465 3.073 -9.640 -0.376 1.00 94.40 H new ATOM 0 HD3 PRO A 465 3.577 -8.347 0.335 1.00 94.40 H new ATOM 130 N ARG A 466 2.921 -12.564 1.360 1.00 97.05 N ANISOU 130 N ARG A 466 11760 11243 13872 -303 -582 42 N ATOM 131 CA ARG A 466 2.492 -13.926 1.021 1.00 97.94 C ANISOU 131 CA ARG A 466 11827 11214 14171 -340 -641 13 C ATOM 132 C ARG A 466 2.805 -14.907 2.164 1.00102.01 C ANISOU 132 C ARG A 466 12325 11669 14763 -326 -517 112 C ATOM 133 O ARG A 466 1.892 -15.573 2.660 1.00102.24 O ANISOU 133 O ARG A 466 12257 11590 15001 -362 -482 183 O ATOM 134 CB ARG A 466 3.136 -14.343 -0.317 1.00 97.94 C ANISOU 134 CB ARG A 466 11912 11204 14096 -334 -774 -131 C ATOM 135 CG ARG A 466 3.003 -15.815 -0.689 1.00106.28 C ANISOU 135 CG ARG A 466 12949 12117 15316 -360 -835 -184 C ATOM 136 CD ARG A 466 3.782 -16.134 -1.949 1.00107.87 C ANISOU 136 CD ARG A 466 13254 12329 15401 -338 -949 -331 C ATOM 137 NE ARG A 466 5.234 -16.006 -1.793 1.00108.72 N ANISOU 137 NE ARG A 466 13468 12530 15312 -278 -875 -337 N ATOM 138 CZ ARG A 466 6.051 -17.002 -1.460 1.00116.38 C ANISOU 138 CZ ARG A 466 14470 13449 16299 -252 -824 -333 C ATOM 139 NH1 ARG A 466 5.568 -18.215 -1.222 1.00106.14 N ANISOU 139 NH1 ARG A 466 13113 12008 15208 -282 -832 -319 N ATOM 140 NH2 ARG A 466 7.356 -16.788 -1.350 1.00 94.63 N ANISOU 140 NH2 ARG A 466 11802 10784 13370 -197 -764 -338 N ATOM 0 H ARG A 466 3.400 -12.218 0.735 1.00 97.05 H new ATOM 0 HA ARG A 466 1.529 -13.947 0.909 1.00 97.94 H new ATOM 0 HB2 ARG A 466 2.741 -13.811 -1.026 1.00 97.94 H new ATOM 0 HB3 ARG A 466 4.079 -14.119 -0.286 1.00 97.94 H new ATOM 0 HG2 ARG A 466 3.325 -16.366 0.041 1.00106.28 H new ATOM 0 HG3 ARG A 466 2.067 -16.035 -0.820 1.00106.28 H new ATOM 0 HD2 ARG A 466 3.573 -17.039 -2.228 1.00107.87 H new ATOM 0 HD3 ARG A 466 3.488 -15.543 -2.660 1.00107.87 H new ATOM 0 HE ARG A 466 5.583 -15.231 -1.926 1.00108.72 H new ATOM 0 HH11 ARG A 466 4.723 -18.361 -1.283 1.00106.14 H new ATOM 0 HH12 ARG A 466 6.100 -18.855 -1.007 1.00106.14 H new ATOM 0 HH21 ARG A 466 7.677 -16.003 -1.494 1.00 94.63 H new ATOM 0 HH22 ARG A 466 7.881 -17.434 -1.135 1.00 94.63 H new ATOM 141 N CYS A 467 4.084 -14.959 2.599 1.00 97.93 N ANISOU 141 N CYS A 467 11900 11223 14084 -272 -450 126 N ATOM 142 CA CYS A 467 4.528 -15.777 3.731 1.00 97.77 C ANISOU 142 CA CYS A 467 11880 11167 14101 -245 -333 230 C ATOM 143 C CYS A 467 4.823 -14.853 4.935 1.00 99.18 C ANISOU 143 C CYS A 467 12078 11463 14145 -202 -205 333 C ATOM 144 O CYS A 467 5.934 -14.816 5.484 1.00 97.50 O ANISOU 144 O CYS A 467 11937 11320 13787 -149 -148 358 O ATOM 145 CB CYS A 467 5.716 -16.659 3.354 1.00 98.15 C ANISOU 145 CB CYS A 467 12007 11192 14091 -214 -362 168 C ATOM 146 SG CYS A 467 5.248 -18.302 2.749 1.00103.52 S ANISOU 146 SG CYS A 467 12640 11680 15012 -257 -439 118 S ATOM 0 H CYS A 467 4.719 -14.510 2.233 1.00 97.93 H new ATOM 0 HA CYS A 467 3.821 -16.391 3.986 1.00 97.77 H new ATOM 0 HB2 CYS A 467 6.238 -16.209 2.671 1.00 98.15 H new ATOM 0 HB3 CYS A 467 6.291 -16.761 4.129 1.00 98.15 H new ATOM 0 HG CYS A 467 6.237 -18.925 2.475 1.00103.52 H new ATOM 147 N GLY A 468 3.789 -14.084 5.280 1.00 94.91 N ANISOU 147 N GLY A 468 11466 10938 13656 -224 -170 384 N ATOM 148 CA GLY A 468 3.752 -13.109 6.362 1.00 93.42 C ANISOU 148 CA GLY A 468 11282 10849 13365 -188 -55 471 C ATOM 149 C GLY A 468 2.343 -13.007 6.902 1.00 95.53 C ANISOU 149 C GLY A 468 11437 11057 13803 -220 10 558 C ATOM 150 O GLY A 468 1.468 -12.426 6.252 1.00 95.37 O ANISOU 150 O GLY A 468 11356 11024 13856 -258 -56 515 O ATOM 0 H GLY A 468 3.041 -14.124 4.857 1.00 94.91 H new ATOM 0 HA2 GLY A 468 4.361 -13.373 7.069 1.00 93.42 H new ATOM 0 HA3 GLY A 468 4.049 -12.243 6.040 1.00 93.42 H new ATOM 151 N ILE A 469 2.123 -13.612 8.089 1.00 90.19 N ANISOU 151 N ILE A 469 10731 10342 13195 -202 143 687 N ATOM 152 CA ILE A 469 0.864 -13.743 8.836 1.00 89.60 C ANISOU 152 CA ILE A 469 10549 10201 13295 -223 247 801 C ATOM 153 C ILE A 469 -0.067 -12.512 8.814 1.00 88.91 C ANISOU 153 C ILE A 469 10399 10162 13219 -235 260 798 C ATOM 154 O ILE A 469 0.402 -11.367 8.736 1.00 87.17 O ANISOU 154 O ILE A 469 10242 10060 12819 -204 243 746 O ATOM 155 CB ILE A 469 1.185 -14.150 10.293 1.00 93.21 C ANISOU 155 CB ILE A 469 11036 10678 13701 -167 412 944 C ATOM 0 H ILE A 469 2.772 -13.989 8.510 1.00 90.19 H new ATOM 0 HA ILE A 469 0.357 -14.429 8.374 1.00 89.60 H new ATOM 156 N ARG A 470 -1.397 -12.772 8.907 1.00 82.69 N ANISOU 156 N ARG A 470 9481 9275 12662 -279 294 859 N ATOM 157 CA ARG A 470 -2.449 -11.749 8.959 1.00 80.51 C ANISOU 157 CA ARG A 470 9122 9021 12447 -291 320 873 C ATOM 158 C ARG A 470 -2.189 -10.892 10.182 1.00 77.11 C ANISOU 158 C ARG A 470 8744 8705 11847 -223 475 950 C ATOM 159 O ARG A 470 -1.864 -11.435 11.246 1.00 77.86 O ANISOU 159 O ARG A 470 8875 8806 11902 -183 604 1051 O ATOM 160 CB ARG A 470 -3.845 -12.390 9.049 1.00 83.60 C ANISOU 160 CB ARG A 470 9355 9273 13138 -345 356 948 C ATOM 0 H ARG A 470 -1.707 -13.573 8.942 1.00 82.69 H new ATOM 0 HA ARG A 470 -2.430 -11.215 8.150 1.00 80.51 H new ATOM 161 N LEU A 471 -2.245 -9.558 10.014 1.00 65.88 N ANISOU 161 N LEU A 471 7341 7378 10313 -205 454 896 N ATOM 162 CA LEU A 471 -1.937 -8.631 11.098 1.00 61.83 C ANISOU 162 CA LEU A 471 6889 6978 9626 -138 582 942 C ATOM 163 C LEU A 471 -3.070 -8.494 12.113 1.00 62.36 C ANISOU 163 C LEU A 471 6865 7017 9812 -123 748 1061 C ATOM 164 O LEU A 471 -4.240 -8.411 11.709 1.00 62.94 O ANISOU 164 O LEU A 471 6812 7014 10090 -168 732 1071 O ATOM 165 CB LEU A 471 -1.561 -7.229 10.559 1.00 59.73 C ANISOU 165 CB LEU A 471 6674 6813 9206 -124 503 839 C ATOM 166 CG LEU A 471 -0.249 -7.058 9.759 1.00 61.08 C ANISOU 166 CG LEU A 471 6956 7048 9202 -118 375 730 C ATOM 167 CD1 LEU A 471 -0.226 -5.716 9.062 1.00 58.75 C ANISOU 167 CD1 LEU A 471 6675 6819 8827 -119 297 645 C ATOM 168 CD2 LEU A 471 0.981 -7.163 10.648 1.00 62.26 C ANISOU 168 CD2 LEU A 471 7220 7279 9156 -57 443 752 C ATOM 0 H LEU A 471 -2.461 -9.177 9.274 1.00 65.88 H new ATOM 0 HA LEU A 471 -1.174 -9.018 11.556 1.00 61.83 H new ATOM 0 HB2 LEU A 471 -2.290 -6.928 9.994 1.00 59.73 H new ATOM 0 HB3 LEU A 471 -1.522 -6.625 11.317 1.00 59.73 H new ATOM 0 HG LEU A 471 -0.224 -7.777 9.108 1.00 61.08 H new ATOM 0 HD11 LEU A 471 0.602 -5.623 8.565 1.00 58.75 H new ATOM 0 HD12 LEU A 471 -0.978 -5.655 8.452 1.00 58.75 H new ATOM 0 HD13 LEU A 471 -0.288 -5.007 9.722 1.00 58.75 H new ATOM 0 HD21 LEU A 471 1.780 -7.051 10.110 1.00 62.26 H new ATOM 0 HD22 LEU A 471 0.949 -6.471 11.327 1.00 62.26 H new ATOM 0 HD23 LEU A 471 0.999 -8.034 11.074 1.00 62.26 H new ATOM 169 N PRO A 472 -2.748 -8.374 13.427 1.00 55.01 N ANISOU 169 N PRO A 472 5998 6155 8750 -55 906 1147 N ATOM 170 CA PRO A 472 -3.806 -8.085 14.404 1.00 55.33 C ANISOU 170 CA PRO A 472 5963 6184 8876 -28 1079 1255 C ATOM 171 C PRO A 472 -4.281 -6.633 14.235 1.00 57.79 C ANISOU 171 C PRO A 472 6249 6557 9152 -16 1070 1192 C ATOM 172 O PRO A 472 -3.606 -5.837 13.559 1.00 57.98 O ANISOU 172 O PRO A 472 6338 6649 9042 -16 948 1078 O ATOM 173 CB PRO A 472 -3.106 -8.289 15.747 1.00 57.55 C ANISOU 173 CB PRO A 472 6353 6542 8971 52 1224 1341 C ATOM 174 CG PRO A 472 -1.682 -8.005 15.479 1.00 60.43 C ANISOU 174 CG PRO A 472 6853 6998 9107 78 1113 1243 C ATOM 175 CD PRO A 472 -1.414 -8.411 14.068 1.00 55.27 C ANISOU 175 CD PRO A 472 6175 6283 8542 8 930 1144 C ATOM 0 HA PRO A 472 -4.594 -8.642 14.310 1.00 55.33 H new ATOM 0 HB2 PRO A 472 -3.462 -7.692 16.424 1.00 57.55 H new ATOM 0 HB3 PRO A 472 -3.229 -9.194 16.074 1.00 57.55 H new ATOM 0 HG2 PRO A 472 -1.490 -7.063 15.607 1.00 60.43 H new ATOM 0 HG3 PRO A 472 -1.113 -8.497 16.092 1.00 60.43 H new ATOM 0 HD2 PRO A 472 -0.794 -7.803 13.635 1.00 55.27 H new ATOM 0 HD3 PRO A 472 -1.022 -9.297 14.021 1.00 55.27 H new ATOM 176 N LEU A 473 -5.431 -6.283 14.823 1.00 51.77 N ANISOU 176 N LEU A 473 5387 5766 8516 -5 1203 1269 N ATOM 177 CA LEU A 473 -5.956 -4.929 14.719 1.00 51.06 C ANISOU 177 CA LEU A 473 5264 5724 8414 11 1207 1217 C ATOM 178 C LEU A 473 -4.940 -3.894 15.218 1.00 52.63 C ANISOU 178 C LEU A 473 5607 6059 8331 80 1220 1152 C ATOM 179 O LEU A 473 -4.331 -4.086 16.272 1.00 54.23 O ANISOU 179 O LEU A 473 5906 6326 8373 143 1329 1201 O ATOM 180 CB LEU A 473 -7.291 -4.793 15.462 1.00 52.90 C ANISOU 180 CB LEU A 473 5373 5907 8820 27 1381 1323 C ATOM 0 H LEU A 473 -5.918 -6.820 15.286 1.00 51.77 H new ATOM 0 HA LEU A 473 -6.119 -4.751 13.779 1.00 51.06 H new ATOM 181 N LEU A 474 -4.686 -2.853 14.409 1.00 45.31 N ANISOU 181 N LEU A 474 4699 5174 7344 68 1093 1038 N ATOM 182 CA LEU A 474 -3.763 -1.791 14.787 1.00 42.50 C ANISOU 182 CA LEU A 474 4463 4934 6751 125 1090 966 C ATOM 183 C LEU A 474 -4.446 -0.964 15.862 1.00 45.90 C ANISOU 183 C LEU A 474 4877 5402 7162 188 1258 1009 C ATOM 184 O LEU A 474 -5.607 -0.583 15.716 1.00 46.01 O ANISOU 184 O LEU A 474 4772 5361 7349 173 1300 1034 O ATOM 185 CB LEU A 474 -3.404 -0.918 13.572 1.00 41.04 C ANISOU 185 CB LEU A 474 4287 4768 6539 90 919 847 C ATOM 186 CG LEU A 474 -2.507 0.304 13.799 1.00 43.00 C ANISOU 186 CG LEU A 474 4641 5119 6579 138 901 764 C ATOM 187 CD1 LEU A 474 -1.120 -0.097 14.288 1.00 40.74 C ANISOU 187 CD1 LEU A 474 4487 4904 6090 171 893 746 C ATOM 188 CD2 LEU A 474 -2.418 1.144 12.532 1.00 44.62 C ANISOU 188 CD2 LEU A 474 4827 5320 6805 99 748 671 C ATOM 0 H LEU A 474 -5.045 -2.751 13.634 1.00 45.31 H new ATOM 0 HA LEU A 474 -2.933 -2.165 15.120 1.00 42.50 H new ATOM 0 HB2 LEU A 474 -2.970 -1.486 12.916 1.00 41.04 H new ATOM 0 HB3 LEU A 474 -4.233 -0.608 13.175 1.00 41.04 H new ATOM 0 HG LEU A 474 -2.912 0.842 14.497 1.00 43.00 H new ATOM 0 HD11 LEU A 474 -0.581 0.698 14.421 1.00 40.74 H new ATOM 0 HD12 LEU A 474 -1.199 -0.577 15.127 1.00 40.74 H new ATOM 0 HD13 LEU A 474 -0.696 -0.668 13.628 1.00 40.74 H new ATOM 0 HD21 LEU A 474 -1.848 1.912 12.692 1.00 44.62 H new ATOM 0 HD22 LEU A 474 -2.045 0.609 11.814 1.00 44.62 H new ATOM 0 HD23 LEU A 474 -3.305 1.447 12.281 1.00 44.62 H new ATOM 189 N ARG A 475 -3.755 -0.741 16.965 1.00 42.86 N ANISOU 189 N ARG A 475 4606 5104 6573 262 1355 1019 N ATOM 190 CA ARG A 475 -4.303 0.031 18.074 1.00 44.40 C ANISOU 190 CA ARG A 475 4809 5345 6716 334 1521 1050 C ATOM 191 C ARG A 475 -3.176 0.529 18.950 1.00 46.83 C ANISOU 191 C ARG A 475 5274 5768 6751 410 1545 1000 C ATOM 192 O ARG A 475 -2.179 -0.170 19.102 1.00 44.69 O ANISOU 192 O ARG A 475 5093 5530 6358 417 1498 1005 O ATOM 193 CB ARG A 475 -5.316 -0.799 18.926 1.00 47.96 C ANISOU 193 CB ARG A 475 5186 5741 7296 354 1710 1196 C ATOM 194 CG ARG A 475 -4.807 -2.162 19.393 1.00 60.66 C ANISOU 194 CG ARG A 475 6846 7337 8866 358 1750 1289 C ATOM 195 CD ARG A 475 -5.772 -2.870 20.352 1.00 79.33 C ANISOU 195 CD ARG A 475 9147 9654 11342 389 1960 1445 C ATOM 196 NE ARG A 475 -5.730 -2.323 21.716 1.00 87.56 N ANISOU 196 NE ARG A 475 10283 10791 12196 494 2135 1481 N ATOM 197 CZ ARG A 475 -4.807 -2.625 22.630 1.00 97.42 C ANISOU 197 CZ ARG A 475 11679 12125 13212 564 2181 1507 C ATOM 198 NH1 ARG A 475 -3.818 -3.467 22.338 1.00 80.03 N ANISOU 198 NH1 ARG A 475 9541 9923 10943 540 2070 1506 N ATOM 199 NH2 ARG A 475 -4.854 -2.071 23.836 1.00 80.48 N ANISOU 199 NH2 ARG A 475 9620 10066 10893 664 2335 1531 N ATOM 0 H ARG A 475 -2.956 -1.031 17.096 1.00 42.86 H new ATOM 0 HA ARG A 475 -4.789 0.782 17.700 1.00 44.40 H new ATOM 0 HB2 ARG A 475 -5.565 -0.278 19.705 1.00 47.96 H new ATOM 0 HB3 ARG A 475 -6.123 -0.932 18.404 1.00 47.96 H new ATOM 0 HG2 ARG A 475 -4.656 -2.727 18.619 1.00 60.66 H new ATOM 0 HG3 ARG A 475 -3.950 -2.048 19.832 1.00 60.66 H new ATOM 0 HD2 ARG A 475 -6.675 -2.796 20.007 1.00 79.33 H new ATOM 0 HD3 ARG A 475 -5.556 -3.815 20.381 1.00 79.33 H new ATOM 0 HE ARG A 475 -6.346 -1.767 21.941 1.00 87.56 H new ATOM 0 HH11 ARG A 475 -3.771 -3.820 21.555 1.00 80.03 H new ATOM 0 HH12 ARG A 475 -3.226 -3.658 22.932 1.00 80.03 H new ATOM 0 HH21 ARG A 475 -5.481 -1.515 24.030 1.00 80.48 H new ATOM 0 HH22 ARG A 475 -4.257 -2.268 24.423 1.00 80.48 H new ATOM 200 N PRO A 476 -3.315 1.717 19.567 1.00 44.47 N ANISOU 200 N PRO A 476 5010 5528 6359 471 1615 950 N ATOM 201 CA PRO A 476 -2.284 2.143 20.509 1.00 44.27 C ANISOU 201 CA PRO A 476 5135 5610 6076 548 1639 901 C ATOM 202 C PRO A 476 -2.353 1.288 21.778 1.00 50.59 C ANISOU 202 C PRO A 476 5994 6441 6787 615 1801 1017 C ATOM 203 O PRO A 476 -3.391 0.713 22.113 1.00 52.48 O ANISOU 203 O PRO A 476 6152 6624 7165 617 1940 1132 O ATOM 204 CB PRO A 476 -2.626 3.610 20.771 1.00 45.77 C ANISOU 204 CB PRO A 476 5327 5834 6231 590 1675 817 C ATOM 205 CG PRO A 476 -4.097 3.697 20.566 1.00 50.62 C ANISOU 205 CG PRO A 476 5797 6367 7071 569 1770 881 C ATOM 206 CD PRO A 476 -4.443 2.678 19.521 1.00 45.99 C ANISOU 206 CD PRO A 476 5105 5688 6680 479 1684 939 C ATOM 0 HA PRO A 476 -1.377 2.041 20.179 1.00 44.27 H new ATOM 0 HB2 PRO A 476 -2.379 3.874 21.671 1.00 45.77 H new ATOM 0 HB3 PRO A 476 -2.150 4.197 20.163 1.00 45.77 H new ATOM 0 HG2 PRO A 476 -4.572 3.518 21.393 1.00 50.62 H new ATOM 0 HG3 PRO A 476 -4.353 4.587 20.278 1.00 50.62 H new ATOM 0 HD2 PRO A 476 -5.288 2.243 19.715 1.00 45.99 H new ATOM 0 HD3 PRO A 476 -4.528 3.084 18.644 1.00 45.99 H new ATOM 207 N SER A 477 -1.218 1.142 22.426 1.00 46.79 N ANISOU 207 N SER A 477 5649 6043 6084 667 1776 993 N ATOM 208 CA SER A 477 -1.044 0.393 23.656 1.00 47.34 C ANISOU 208 CA SER A 477 5805 6161 6019 743 1907 1095 C ATOM 209 C SER A 477 0.178 0.968 24.312 1.00 51.42 C ANISOU 209 C SER A 477 6476 6791 6271 811 1845 1003 C ATOM 210 O SER A 477 0.833 1.843 23.729 1.00 49.90 O ANISOU 210 O SER A 477 6302 6622 6037 786 1705 870 O ATOM 211 CB SER A 477 -0.882 -1.104 23.382 1.00 50.22 C ANISOU 211 CB SER A 477 6144 6466 6472 699 1889 1205 C ATOM 212 OG SER A 477 0.251 -1.425 22.594 1.00 51.72 O ANISOU 212 OG SER A 477 6371 6659 6623 652 1707 1137 O ATOM 0 H SER A 477 -0.485 1.496 22.147 1.00 46.79 H new ATOM 0 HA SER A 477 -1.822 0.470 24.230 1.00 47.34 H new ATOM 0 HB2 SER A 477 -0.820 -1.574 24.228 1.00 50.22 H new ATOM 0 HB3 SER A 477 -1.679 -1.430 22.935 1.00 50.22 H new ATOM 0 HG SER A 477 0.839 -1.779 23.079 1.00 51.72 H new ATOM 213 N ALA A 478 0.488 0.496 25.519 1.00 49.74 N ANISOU 213 N ALA A 478 6370 6645 5882 899 1947 1074 N ATOM 214 CA ALA A 478 1.636 0.957 26.297 1.00 49.47 C ANISOU 214 CA ALA A 478 6488 6723 5585 975 1889 992 C ATOM 215 C ALA A 478 2.943 0.899 25.495 1.00 49.44 C ANISOU 215 C ALA A 478 6512 6730 5545 923 1678 900 C ATOM 216 O ALA A 478 3.744 1.826 25.608 1.00 48.06 O ANISOU 216 O ALA A 478 6406 6618 5236 948 1583 772 O ATOM 217 CB ALA A 478 1.761 0.147 27.580 1.00 51.56 C ANISOU 217 CB ALA A 478 6857 7047 5686 1069 2016 1113 C ATOM 0 H ALA A 478 0.028 -0.113 25.915 1.00 49.74 H new ATOM 0 HA ALA A 478 1.480 1.888 26.520 1.00 49.47 H new ATOM 0 HB1 ALA A 478 2.525 0.461 28.088 1.00 51.56 H new ATOM 0 HB2 ALA A 478 0.955 0.253 28.110 1.00 51.56 H new ATOM 0 HB3 ALA A 478 1.882 -0.790 27.361 1.00 51.56 H new ATOM 218 N ASN A 479 3.129 -0.158 24.659 1.00 43.60 N ANISOU 218 N ASN A 479 5710 5919 4936 850 1608 959 N ATOM 219 CA ASN A 479 4.340 -0.348 23.855 1.00 42.12 C ANISOU 219 CA ASN A 479 5542 5735 4727 803 1424 884 C ATOM 220 C ASN A 479 4.159 0.086 22.401 1.00 43.06 C ANISOU 220 C ASN A 479 5557 5784 5020 704 1312 804 C ATOM 221 O ASN A 479 5.019 -0.205 21.565 1.00 40.94 O ANISOU 221 O ASN A 479 5286 5501 4767 655 1175 756 O ATOM 222 CB ASN A 479 4.820 -1.805 23.919 1.00 41.18 C ANISOU 222 CB ASN A 479 5442 5591 4613 799 1413 990 C ATOM 223 CG ASN A 479 3.946 -2.808 23.197 1.00 71.83 C ANISOU 223 CG ASN A 479 9209 9357 8726 727 1453 1090 C ATOM 224 OD1 ASN A 479 2.763 -2.573 22.909 1.00 68.14 O ANISOU 224 OD1 ASN A 479 8645 8830 8414 692 1531 1116 O ATOM 225 ND2 ASN A 479 4.502 -3.978 22.919 1.00 66.49 N ANISOU 225 ND2 ASN A 479 8537 8642 8086 704 1401 1148 N ATOM 0 H ASN A 479 2.545 -0.780 24.552 1.00 43.60 H new ATOM 0 HA ASN A 479 5.018 0.227 24.243 1.00 42.12 H new ATOM 0 HB2 ASN A 479 5.715 -1.852 23.547 1.00 41.18 H new ATOM 0 HB3 ASN A 479 4.886 -2.067 24.851 1.00 41.18 H new ATOM 0 HD21 ASN A 479 4.041 -4.592 22.532 1.00 66.49 H new ATOM 0 HD22 ASN A 479 5.324 -4.124 23.126 1.00 66.49 H new ATOM 226 N HIS A 480 3.013 0.705 22.080 1.00 39.04 N ANISOU 226 N HIS A 480 4959 5228 4645 677 1375 800 N ATOM 227 CA HIS A 480 2.775 1.080 20.696 1.00 36.97 C ANISOU 227 CA HIS A 480 4602 4899 4544 589 1266 736 C ATOM 228 C HIS A 480 2.084 2.431 20.547 1.00 39.52 C ANISOU 228 C HIS A 480 4880 5221 4914 590 1288 665 C ATOM 229 O HIS A 480 0.901 2.549 20.841 1.00 38.39 O ANISOU 229 O HIS A 480 4671 5042 4873 601 1410 722 O ATOM 230 CB HIS A 480 2.015 -0.049 19.956 1.00 36.61 C ANISOU 230 CB HIS A 480 4452 4752 4705 521 1275 830 C ATOM 231 CG HIS A 480 2.020 0.063 18.458 1.00 37.80 C ANISOU 231 CG HIS A 480 4528 4841 4992 433 1133 766 C ATOM 232 ND1 HIS A 480 1.362 -0.858 17.676 1.00 38.89 N ANISOU 232 ND1 HIS A 480 4572 4885 5318 368 1113 824 N ATOM 233 CD2 HIS A 480 2.565 1.005 17.650 1.00 37.71 C ANISOU 233 CD2 HIS A 480 4525 4851 4954 405 1010 653 C ATOM 234 CE1 HIS A 480 1.566 -0.488 16.423 1.00 36.81 C ANISOU 234 CE1 HIS A 480 4274 4595 5116 308 974 741 C ATOM 235 NE2 HIS A 480 2.279 0.627 16.353 1.00 36.47 N ANISOU 235 NE2 HIS A 480 4289 4619 4948 327 915 644 N ATOM 0 H HIS A 480 2.386 0.907 22.633 1.00 39.04 H new ATOM 0 HA HIS A 480 3.643 1.192 20.277 1.00 36.97 H new ATOM 0 HB2 HIS A 480 2.406 -0.901 20.205 1.00 36.61 H new ATOM 0 HB3 HIS A 480 1.095 -0.058 20.264 1.00 36.61 H new ATOM 0 HD1 HIS A 480 0.909 -1.537 17.947 1.00 38.89 H new ATOM 0 HD2 HIS A 480 3.039 1.759 17.917 1.00 37.71 H new ATOM 0 HE1 HIS A 480 1.248 -0.953 15.683 1.00 36.81 H new ATOM 236 N THR A 481 2.819 3.438 20.053 1.00 36.13 N ANISOU 236 N THR A 481 4479 4821 4427 577 1172 543 N ATOM 237 CA THR A 481 2.257 4.778 19.754 1.00 36.05 C ANISOU 237 CA THR A 481 4423 4798 4475 572 1171 467 C ATOM 238 C THR A 481 1.683 4.777 18.313 1.00 36.98 C ANISOU 238 C THR A 481 4428 4833 4792 484 1086 467 C ATOM 239 O THR A 481 2.395 4.394 17.392 1.00 34.21 O ANISOU 239 O THR A 481 4079 4468 4451 432 961 442 O ATOM 240 CB THR A 481 3.342 5.848 19.868 1.00 41.74 C ANISOU 240 CB THR A 481 5224 5581 5055 597 1082 342 C ATOM 241 OG1 THR A 481 3.942 5.747 21.158 1.00 36.49 O ANISOU 241 OG1 THR A 481 4669 4995 4200 679 1136 336 O ATOM 242 CG2 THR A 481 2.792 7.258 19.644 1.00 40.90 C ANISOU 242 CG2 THR A 481 5076 5455 5010 598 1087 264 C ATOM 0 H THR A 481 3.659 3.368 19.880 1.00 36.13 H new ATOM 0 HA THR A 481 1.554 4.977 20.392 1.00 36.05 H new ATOM 0 HB THR A 481 4.001 5.695 19.173 1.00 41.74 H new ATOM 0 HG1 THR A 481 4.475 5.098 21.169 1.00 36.49 H new ATOM 0 HG21 THR A 481 3.512 7.903 19.725 1.00 40.90 H new ATOM 0 HG22 THR A 481 2.404 7.317 18.757 1.00 40.90 H new ATOM 0 HG23 THR A 481 2.111 7.449 20.308 1.00 40.90 H new ATOM 243 N VAL A 482 0.398 5.160 18.139 1.00 33.57 N ANISOU 243 N VAL A 482 3898 4345 4513 473 1155 498 N ATOM 244 CA VAL A 482 -0.304 5.232 16.842 1.00 32.58 C ANISOU 244 CA VAL A 482 3660 4141 4580 399 1075 502 C ATOM 245 C VAL A 482 -0.830 6.671 16.697 1.00 34.32 C ANISOU 245 C VAL A 482 3841 4352 4848 413 1081 438 C ATOM 246 O VAL A 482 -1.628 7.127 17.519 1.00 32.94 O ANISOU 246 O VAL A 482 3643 4178 4694 464 1211 458 O ATOM 247 CB VAL A 482 -1.407 4.146 16.699 1.00 37.50 C ANISOU 247 CB VAL A 482 4181 4687 5378 366 1138 612 C ATOM 248 CG1 VAL A 482 -2.066 4.216 15.330 1.00 36.25 C ANISOU 248 CG1 VAL A 482 3913 4451 5408 292 1030 603 C ATOM 249 CG2 VAL A 482 -0.822 2.743 16.934 1.00 37.59 C ANISOU 249 CG2 VAL A 482 4240 4703 5340 359 1140 675 C ATOM 0 H VAL A 482 -0.102 5.392 18.799 1.00 33.57 H new ATOM 0 HA VAL A 482 0.303 5.034 16.112 1.00 32.58 H new ATOM 0 HB VAL A 482 -2.083 4.318 17.373 1.00 37.50 H new ATOM 0 HG11 VAL A 482 -2.749 3.531 15.264 1.00 36.25 H new ATOM 0 HG12 VAL A 482 -2.472 5.089 15.210 1.00 36.25 H new ATOM 0 HG13 VAL A 482 -1.398 4.073 14.641 1.00 36.25 H new ATOM 0 HG21 VAL A 482 -1.524 2.080 16.841 1.00 37.59 H new ATOM 0 HG22 VAL A 482 -0.125 2.569 16.282 1.00 37.59 H new ATOM 0 HG23 VAL A 482 -0.448 2.694 17.828 1.00 37.59 H new ATOM 250 N THR A 483 -0.325 7.407 15.688 1.00 28.94 N ANISOU 250 N THR A 483 3158 3664 4174 374 947 363 N ATOM 251 CA THR A 483 -0.597 8.847 15.588 1.00 28.86 C ANISOU 251 CA THR A 483 3128 3648 4191 393 942 296 C ATOM 252 C THR A 483 -1.748 9.237 14.608 1.00 32.93 C ANISOU 252 C THR A 483 3518 4085 4911 351 907 321 C ATOM 253 O THR A 483 -1.925 10.417 14.281 1.00 33.59 O ANISOU 253 O THR A 483 3577 4151 5033 357 877 270 O ATOM 254 CB THR A 483 0.716 9.561 15.279 1.00 33.67 C ANISOU 254 CB THR A 483 3820 4300 4674 389 835 201 C ATOM 255 OG1 THR A 483 1.193 9.092 14.028 1.00 32.73 O ANISOU 255 OG1 THR A 483 3687 4159 4589 323 704 204 O ATOM 256 CG2 THR A 483 1.783 9.292 16.329 1.00 34.00 C ANISOU 256 CG2 THR A 483 3976 4418 4525 438 864 170 C ATOM 0 H THR A 483 0.171 7.091 15.061 1.00 28.94 H new ATOM 0 HA THR A 483 -0.943 9.142 16.445 1.00 28.86 H new ATOM 0 HB THR A 483 0.542 10.515 15.268 1.00 33.67 H new ATOM 0 HG1 THR A 483 1.074 9.683 13.443 1.00 32.73 H new ATOM 0 HG21 THR A 483 2.597 9.764 16.092 1.00 34.00 H new ATOM 0 HG22 THR A 483 1.471 9.600 17.194 1.00 34.00 H new ATOM 0 HG23 THR A 483 1.963 8.340 16.371 1.00 34.00 H new ATOM 257 N ILE A 484 -2.525 8.240 14.165 1.00 29.45 N ANISOU 257 N ILE A 484 2995 3591 4605 310 906 400 N ATOM 258 CA ILE A 484 -3.586 8.392 13.187 1.00 29.62 C ANISOU 258 CA ILE A 484 2894 3537 4824 266 850 428 C ATOM 259 C ILE A 484 -4.852 7.668 13.661 1.00 36.77 C ANISOU 259 C ILE A 484 3696 4389 5887 269 965 520 C ATOM 260 O ILE A 484 -4.788 6.828 14.564 1.00 35.87 O ANISOU 260 O ILE A 484 3612 4294 5721 293 1072 573 O ATOM 261 CB ILE A 484 -3.105 7.944 11.753 1.00 32.46 C ANISOU 261 CB ILE A 484 3254 3876 5204 196 674 411 C ATOM 262 CG1 ILE A 484 -2.677 6.448 11.679 1.00 31.91 C ANISOU 262 CG1 ILE A 484 3213 3805 5107 165 652 450 C ATOM 263 CG2 ILE A 484 -1.966 8.840 11.250 1.00 35.01 C ANISOU 263 CG2 ILE A 484 3663 4244 5396 196 578 329 C ATOM 264 CD1 ILE A 484 -3.860 5.342 11.494 1.00 31.95 C ANISOU 264 CD1 ILE A 484 3100 3729 5309 127 674 534 C ATOM 0 H ILE A 484 -2.438 7.430 14.442 1.00 29.45 H new ATOM 0 HA ILE A 484 -3.816 9.331 13.106 1.00 29.62 H new ATOM 0 HB ILE A 484 -3.877 8.044 11.175 1.00 32.46 H new ATOM 0 HG12 ILE A 484 -2.055 6.349 10.941 1.00 31.91 H new ATOM 0 HG13 ILE A 484 -2.190 6.234 12.490 1.00 31.91 H new ATOM 0 HG21 ILE A 484 -1.688 8.546 10.369 1.00 35.01 H new ATOM 0 HG22 ILE A 484 -2.274 9.759 11.202 1.00 35.01 H new ATOM 0 HG23 ILE A 484 -1.215 8.783 11.861 1.00 35.01 H new ATOM 0 HD11 ILE A 484 -3.471 4.454 11.462 1.00 31.95 H new ATOM 0 HD12 ILE A 484 -4.475 5.398 12.242 1.00 31.95 H new ATOM 0 HD13 ILE A 484 -4.339 5.515 10.668 1.00 31.95 H new ATOM 265 N ARG A 485 -5.984 8.005 13.046 1.00 33.36 N ANISOU 265 N ARG A 485 3137 3887 5650 245 942 546 N ATOM 266 CA ARG A 485 -7.294 7.437 13.322 1.00 34.40 C ANISOU 266 CA ARG A 485 3141 3953 5979 240 1037 633 C ATOM 267 C ARG A 485 -7.406 6.049 12.672 1.00 38.58 C ANISOU 267 C ARG A 485 3626 4433 6600 173 958 683 C ATOM 268 O ARG A 485 -7.568 5.930 11.460 1.00 34.87 O ANISOU 268 O ARG A 485 3107 3920 6223 117 802 663 O ATOM 269 CB ARG A 485 -8.387 8.405 12.831 1.00 33.07 C ANISOU 269 CB ARG A 485 2848 3725 5991 240 1018 631 C ATOM 270 CG ARG A 485 -8.488 9.637 13.721 1.00 41.90 C ANISOU 270 CG ARG A 485 3994 4877 7049 316 1140 593 C ATOM 271 CD ARG A 485 -9.267 9.327 15.005 1.00 45.32 C ANISOU 271 CD ARG A 485 4385 5304 7529 371 1356 661 C ATOM 272 NE ARG A 485 -10.634 8.885 14.703 1.00 40.91 N ANISOU 272 NE ARG A 485 3654 4656 7234 341 1387 745 N ATOM 273 CZ ARG A 485 -11.630 9.720 14.436 1.00 51.87 C ANISOU 273 CZ ARG A 485 4922 5989 8798 353 1398 748 C ATOM 274 NH1 ARG A 485 -11.423 11.030 14.433 1.00 40.33 N ANISOU 274 NH1 ARG A 485 3499 4550 7277 395 1385 674 N ATOM 275 NH2 ARG A 485 -12.835 9.253 14.147 1.00 44.64 N ANISOU 275 NH2 ARG A 485 3841 4988 8130 323 1415 824 N ATOM 0 H ARG A 485 -6.006 8.601 12.426 1.00 33.36 H new ATOM 0 HA ARG A 485 -7.415 7.318 14.277 1.00 34.40 H new ATOM 0 HB2 ARG A 485 -8.193 8.678 11.921 1.00 33.07 H new ATOM 0 HB3 ARG A 485 -9.242 7.947 12.814 1.00 33.07 H new ATOM 0 HG2 ARG A 485 -7.598 9.951 13.947 1.00 41.90 H new ATOM 0 HG3 ARG A 485 -8.927 10.354 13.238 1.00 41.90 H new ATOM 0 HD2 ARG A 485 -8.805 8.638 15.508 1.00 45.32 H new ATOM 0 HD3 ARG A 485 -9.297 10.117 15.567 1.00 45.32 H new ATOM 0 HE ARG A 485 -10.798 8.041 14.699 1.00 40.91 H new ATOM 0 HH11 ARG A 485 -10.640 11.342 14.605 1.00 40.33 H new ATOM 0 HH12 ARG A 485 -12.072 11.567 14.259 1.00 40.33 H new ATOM 0 HH21 ARG A 485 -12.975 8.405 14.132 1.00 44.64 H new ATOM 0 HH22 ARG A 485 -13.477 9.798 13.975 1.00 44.64 H new ATOM 276 N VAL A 486 -7.227 4.997 13.475 1.00 39.17 N ANISOU 276 N VAL A 486 3732 4516 6632 184 1059 742 N ATOM 277 CA VAL A 486 -7.240 3.607 12.982 1.00 39.87 C ANISOU 277 CA VAL A 486 3790 4553 6806 124 995 787 C ATOM 278 C VAL A 486 -8.637 3.249 12.420 1.00 46.39 C ANISOU 278 C VAL A 486 4441 5273 7914 77 975 843 C ATOM 279 O VAL A 486 -8.717 2.590 11.387 1.00 47.67 O ANISOU 279 O VAL A 486 4559 5380 8171 13 829 830 O ATOM 280 CB VAL A 486 -6.783 2.622 14.089 1.00 44.33 C ANISOU 280 CB VAL A 486 4424 5147 7273 155 1128 853 C ATOM 281 CG1 VAL A 486 -7.036 1.164 13.693 1.00 45.17 C ANISOU 281 CG1 VAL A 486 4471 5175 7516 96 1090 915 C ATOM 282 CG2 VAL A 486 -5.322 2.840 14.446 1.00 42.30 C ANISOU 282 CG2 VAL A 486 4333 4988 6751 192 1104 791 C ATOM 0 H VAL A 486 -7.094 5.065 14.322 1.00 39.17 H new ATOM 0 HA VAL A 486 -6.604 3.526 12.254 1.00 39.87 H new ATOM 0 HB VAL A 486 -7.318 2.807 14.876 1.00 44.33 H new ATOM 0 HG11 VAL A 486 -6.739 0.578 14.407 1.00 45.17 H new ATOM 0 HG12 VAL A 486 -7.984 1.030 13.539 1.00 45.17 H new ATOM 0 HG13 VAL A 486 -6.545 0.959 12.882 1.00 45.17 H new ATOM 0 HG21 VAL A 486 -5.061 2.213 15.139 1.00 42.30 H new ATOM 0 HG22 VAL A 486 -4.772 2.699 13.659 1.00 42.30 H new ATOM 0 HG23 VAL A 486 -5.199 3.747 14.768 1.00 42.30 H new ATOM 283 N ASP A 487 -9.711 3.727 13.066 1.00 43.72 N ANISOU 283 N ASP A 487 4001 4905 7705 111 1112 895 N ATOM 284 CA ASP A 487 -11.103 3.487 12.660 1.00 45.86 C ANISOU 284 CA ASP A 487 4088 5072 8264 72 1110 953 C ATOM 285 C ASP A 487 -11.385 4.070 11.270 1.00 49.45 C ANISOU 285 C ASP A 487 4482 5491 8814 27 904 888 C ATOM 286 O ASP A 487 -12.278 3.581 10.579 1.00 50.42 O ANISOU 286 O ASP A 487 4471 5526 9161 -25 823 916 O ATOM 287 CB ASP A 487 -12.103 4.075 13.700 1.00 49.04 C ANISOU 287 CB ASP A 487 4404 5462 8765 133 1317 1016 C ATOM 288 CG ASP A 487 -11.972 5.583 13.976 1.00 63.19 C ANISOU 288 CG ASP A 487 6246 7314 10449 196 1353 951 C ATOM 289 OD1 ASP A 487 -10.817 6.086 14.052 1.00 65.22 O ANISOU 289 OD1 ASP A 487 6656 7656 10470 222 1307 874 O ATOM 290 OD2 ASP A 487 -13.013 6.239 14.207 1.00 67.90 O ANISOU 290 OD2 ASP A 487 6727 7870 11202 224 1439 978 O ATOM 0 H ASP A 487 -9.646 4.213 13.772 1.00 43.72 H new ATOM 0 HA ASP A 487 -11.230 2.526 12.621 1.00 45.86 H new ATOM 0 HB2 ASP A 487 -13.005 3.897 13.392 1.00 49.04 H new ATOM 0 HB3 ASP A 487 -11.990 3.599 14.538 1.00 49.04 H new ATOM 291 N LEU A 488 -10.612 5.097 10.859 1.00 42.88 N ANISOU 291 N LEU A 488 3751 4726 7815 48 817 804 N ATOM 292 CA LEU A 488 -10.788 5.771 9.563 1.00 41.13 C ANISOU 292 CA LEU A 488 3493 4483 7651 17 629 749 C ATOM 293 C LEU A 488 -9.723 5.369 8.508 1.00 42.09 C ANISOU 293 C LEU A 488 3724 4637 7632 -25 447 683 C ATOM 294 O LEU A 488 -9.746 5.880 7.382 1.00 41.41 O ANISOU 294 O LEU A 488 3631 4543 7561 -47 286 639 O ATOM 295 CB LEU A 488 -10.813 7.303 9.745 1.00 39.74 C ANISOU 295 CB LEU A 488 3334 4344 7422 71 663 710 C ATOM 296 CG LEU A 488 -11.798 7.917 10.744 1.00 43.89 C ANISOU 296 CG LEU A 488 3765 4845 8065 126 846 758 C ATOM 297 CD1 LEU A 488 -11.585 9.416 10.826 1.00 42.87 C ANISOU 297 CD1 LEU A 488 3679 4753 7858 179 856 700 C ATOM 298 CD2 LEU A 488 -13.260 7.621 10.374 1.00 47.06 C ANISOU 298 CD2 LEU A 488 3971 5145 8765 96 835 823 C ATOM 0 H LEU A 488 -9.969 5.419 11.331 1.00 42.88 H new ATOM 0 HA LEU A 488 -11.644 5.472 9.217 1.00 41.13 H new ATOM 0 HB2 LEU A 488 -9.921 7.581 10.005 1.00 39.74 H new ATOM 0 HB3 LEU A 488 -10.992 7.698 8.877 1.00 39.74 H new ATOM 0 HG LEU A 488 -11.625 7.510 11.608 1.00 43.89 H new ATOM 0 HD11 LEU A 488 -12.212 9.798 11.460 1.00 42.87 H new ATOM 0 HD12 LEU A 488 -10.678 9.599 11.118 1.00 42.87 H new ATOM 0 HD13 LEU A 488 -11.728 9.812 9.952 1.00 42.87 H new ATOM 0 HD21 LEU A 488 -13.848 8.026 11.030 1.00 47.06 H new ATOM 0 HD22 LEU A 488 -13.453 7.988 9.497 1.00 47.06 H new ATOM 0 HD23 LEU A 488 -13.403 6.662 10.361 1.00 47.06 H new ATOM 299 N LEU A 489 -8.803 4.468 8.870 1.00 36.31 N ANISOU 299 N LEU A 489 3093 3940 6764 -32 475 681 N ATOM 300 CA LEU A 489 -7.743 4.037 7.963 1.00 36.04 C ANISOU 300 CA LEU A 489 3164 3937 6595 -64 325 620 C ATOM 301 C LEU A 489 -8.316 3.304 6.753 1.00 42.54 C ANISOU 301 C LEU A 489 3907 4684 7571 -128 159 611 C ATOM 302 O LEU A 489 -8.977 2.290 6.906 1.00 42.85 O ANISOU 302 O LEU A 489 3860 4652 7770 -159 181 659 O ATOM 303 CB LEU A 489 -6.709 3.166 8.693 1.00 35.13 C ANISOU 303 CB LEU A 489 3158 3866 6326 -53 400 627 C ATOM 304 CG LEU A 489 -5.410 2.933 7.938 1.00 37.57 C ANISOU 304 CG LEU A 489 3592 4223 6460 -69 276 558 C ATOM 305 CD1 LEU A 489 -4.607 4.266 7.763 1.00 36.02 C ANISOU 305 CD1 LEU A 489 3484 4104 6099 -35 248 495 C ATOM 306 CD2 LEU A 489 -4.573 1.834 8.618 1.00 35.99 C ANISOU 306 CD2 LEU A 489 3470 4044 6159 -63 342 579 C ATOM 0 H LEU A 489 -8.779 4.094 9.644 1.00 36.31 H new ATOM 0 HA LEU A 489 -7.290 4.832 7.642 1.00 36.04 H new ATOM 0 HB2 LEU A 489 -6.501 3.581 9.545 1.00 35.13 H new ATOM 0 HB3 LEU A 489 -7.112 2.305 8.888 1.00 35.13 H new ATOM 0 HG LEU A 489 -5.628 2.619 7.046 1.00 37.57 H new ATOM 0 HD11 LEU A 489 -3.785 4.088 7.279 1.00 36.02 H new ATOM 0 HD12 LEU A 489 -5.143 4.904 7.266 1.00 36.02 H new ATOM 0 HD13 LEU A 489 -4.395 4.633 8.635 1.00 36.02 H new ATOM 0 HD21 LEU A 489 -3.750 1.700 8.122 1.00 35.99 H new ATOM 0 HD22 LEU A 489 -4.363 2.102 9.526 1.00 35.99 H new ATOM 0 HD23 LEU A 489 -5.078 1.006 8.634 1.00 35.99 H new ATOM 307 N ARG A 490 -8.102 3.863 5.562 1.00 41.04 N ANISOU 307 N ARG A 490 3747 4508 7340 -143 -6 552 N ATOM 308 CA ARG A 490 -8.629 3.315 4.314 1.00 41.96 C ANISOU 308 CA ARG A 490 3802 4563 7579 -194 -187 529 C ATOM 309 C ARG A 490 -7.558 3.417 3.248 1.00 43.69 C ANISOU 309 C ARG A 490 4151 4836 7613 -201 -331 455 C ATOM 310 O ARG A 490 -6.777 4.388 3.231 1.00 41.69 O ANISOU 310 O ARG A 490 3989 4654 7195 -167 -317 428 O ATOM 311 CB ARG A 490 -9.889 4.099 3.865 1.00 43.79 C ANISOU 311 CB ARG A 490 3898 4742 7999 -195 -246 550 C ATOM 312 CG ARG A 490 -11.205 3.516 4.360 1.00 52.61 C ANISOU 312 CG ARG A 490 4844 5764 9380 -217 -179 617 C ATOM 0 H ARG A 490 -7.640 4.581 5.456 1.00 41.04 H new ATOM 0 HA ARG A 490 -8.879 2.388 4.450 1.00 41.96 H new ATOM 0 HB2 ARG A 490 -9.815 5.014 4.179 1.00 43.79 H new ATOM 0 HB3 ARG A 490 -9.907 4.132 2.896 1.00 43.79 H new ATOM 313 N ALA A 491 -7.547 2.421 2.347 1.00 38.26 N ANISOU 313 N ALA A 491 3468 4109 6962 -245 -467 421 N ATOM 314 CA ALA A 491 -6.608 2.302 1.244 1.00 37.25 C ANISOU 314 CA ALA A 491 3459 4024 6671 -252 -605 349 C ATOM 315 C ALA A 491 -6.789 3.470 0.275 1.00 42.97 C ANISOU 315 C ALA A 491 4193 4776 7359 -236 -721 327 C ATOM 316 O ALA A 491 -7.913 3.763 -0.114 1.00 44.61 O ANISOU 316 O ALA A 491 4289 4931 7730 -247 -794 346 O ATOM 317 CB ALA A 491 -6.836 0.981 0.524 1.00 38.44 C ANISOU 317 CB ALA A 491 3589 4109 6908 -299 -726 315 C ATOM 0 H ALA A 491 -8.114 1.775 2.372 1.00 38.26 H new ATOM 0 HA ALA A 491 -5.702 2.324 1.589 1.00 37.25 H new ATOM 0 HB1 ALA A 491 -6.210 0.901 -0.212 1.00 38.44 H new ATOM 0 HB2 ALA A 491 -6.701 0.247 1.144 1.00 38.44 H new ATOM 0 HB3 ALA A 491 -7.743 0.952 0.181 1.00 38.44 H new ATOM 318 N GLY A 492 -5.701 4.163 -0.054 1.00 37.71 N ANISOU 318 N GLY A 492 3651 4189 6489 -209 -729 295 N ATOM 319 CA GLY A 492 -5.767 5.273 -0.988 1.00 37.76 C ANISOU 319 CA GLY A 492 3678 4222 6447 -191 -831 284 C ATOM 320 C GLY A 492 -6.274 6.574 -0.398 1.00 44.33 C ANISOU 320 C GLY A 492 4447 5055 7340 -159 -749 329 C ATOM 321 O GLY A 492 -6.365 7.572 -1.116 1.00 46.92 O ANISOU 321 O GLY A 492 4786 5398 7644 -140 -827 332 O ATOM 0 H GLY A 492 -4.915 4.003 0.256 1.00 37.71 H new ATOM 0 HA2 GLY A 492 -4.882 5.423 -1.355 1.00 37.76 H new ATOM 0 HA3 GLY A 492 -6.342 5.023 -1.728 1.00 37.76 H new ATOM 322 N GLU A 493 -6.608 6.585 0.907 1.00 38.33 N ANISOU 322 N GLU A 493 3627 4280 6658 -147 -589 367 N ATOM 323 CA GLU A 493 -7.051 7.786 1.602 1.00 36.70 C ANISOU 323 CA GLU A 493 3366 4074 6503 -109 -490 400 C ATOM 324 C GLU A 493 -5.960 8.218 2.546 1.00 37.83 C ANISOU 324 C GLU A 493 3609 4282 6483 -77 -354 384 C ATOM 325 O GLU A 493 -5.319 7.385 3.200 1.00 36.80 O ANISOU 325 O GLU A 493 3533 4176 6275 -81 -280 376 O ATOM 326 CB GLU A 493 -8.330 7.561 2.408 1.00 38.78 C ANISOU 326 CB GLU A 493 3483 4271 6983 -110 -401 452 C ATOM 327 CG GLU A 493 -9.531 7.122 1.616 1.00 50.58 C ANISOU 327 CG GLU A 493 4850 5688 8680 -144 -531 470 C ATOM 328 CD GLU A 493 -10.868 7.267 2.319 1.00 69.95 C ANISOU 328 CD GLU A 493 7137 8072 11369 -137 -442 529 C ATOM 329 OE1 GLU A 493 -10.958 8.021 3.318 1.00 56.29 O ANISOU 329 OE1 GLU A 493 5391 6356 9638 -95 -283 555 O ATOM 330 OE2 GLU A 493 -11.847 6.669 1.820 1.00 63.78 O ANISOU 330 OE2 GLU A 493 6237 7217 10779 -172 -538 545 O ATOM 0 H GLU A 493 -6.580 5.886 1.407 1.00 38.33 H new ATOM 0 HA GLU A 493 -7.240 8.463 0.933 1.00 36.70 H new ATOM 0 HB2 GLU A 493 -8.151 6.894 3.089 1.00 38.78 H new ATOM 0 HB3 GLU A 493 -8.551 8.385 2.870 1.00 38.78 H new ATOM 0 HG2 GLU A 493 -9.560 7.633 0.792 1.00 50.58 H new ATOM 0 HG3 GLU A 493 -9.413 6.192 1.369 1.00 50.58 H new ATOM 331 N VAL A 494 -5.755 9.525 2.625 1.00 34.52 N ANISOU 331 N VAL A 494 3211 3888 6019 -42 -326 380 N ATOM 332 CA VAL A 494 -4.776 10.149 3.520 1.00 33.11 C ANISOU 332 CA VAL A 494 3117 3764 5700 -8 -208 355 C ATOM 333 C VAL A 494 -5.252 9.930 4.985 1.00 35.27 C ANISOU 333 C VAL A 494 3340 4027 6033 17 -40 380 C ATOM 334 O VAL A 494 -6.398 10.294 5.314 1.00 36.01 O ANISOU 334 O VAL A 494 3324 4072 6285 31 8 416 O ATOM 335 CB VAL A 494 -4.609 11.652 3.181 1.00 37.34 C ANISOU 335 CB VAL A 494 3669 4309 6211 20 -229 345 C ATOM 336 CG1 VAL A 494 -3.727 12.364 4.216 1.00 36.56 C ANISOU 336 CG1 VAL A 494 3641 4253 5998 56 -108 312 C ATOM 337 CG2 VAL A 494 -4.058 11.841 1.764 1.00 36.68 C ANISOU 337 CG2 VAL A 494 3648 4242 6047 2 -379 333 C ATOM 0 H VAL A 494 -6.191 10.093 2.149 1.00 34.52 H new ATOM 0 HA VAL A 494 -3.903 9.742 3.407 1.00 33.11 H new ATOM 0 HB VAL A 494 -5.489 12.059 3.215 1.00 37.34 H new ATOM 0 HG11 VAL A 494 -3.641 13.300 3.978 1.00 36.56 H new ATOM 0 HG12 VAL A 494 -4.133 12.290 5.094 1.00 36.56 H new ATOM 0 HG13 VAL A 494 -2.849 11.952 4.231 1.00 36.56 H new ATOM 0 HG21 VAL A 494 -3.963 12.788 1.577 1.00 36.68 H new ATOM 0 HG22 VAL A 494 -3.192 11.410 1.693 1.00 36.68 H new ATOM 0 HG23 VAL A 494 -4.669 11.445 1.123 1.00 36.68 H new ATOM 338 N PRO A 495 -4.414 9.296 5.844 1.00 30.61 N ANISOU 338 N PRO A 495 2827 3481 5321 25 49 366 N ATOM 339 CA PRO A 495 -4.816 9.067 7.247 1.00 30.24 C ANISOU 339 CA PRO A 495 2750 3434 5306 57 213 395 C ATOM 340 C PRO A 495 -5.071 10.370 8.017 1.00 31.31 C ANISOU 340 C PRO A 495 2871 3577 5448 110 314 383 C ATOM 341 O PRO A 495 -4.429 11.388 7.765 1.00 28.74 O ANISOU 341 O PRO A 495 2602 3277 5039 126 278 337 O ATOM 342 CB PRO A 495 -3.609 8.309 7.832 1.00 31.23 C ANISOU 342 CB PRO A 495 2987 3617 5260 62 256 374 C ATOM 343 CG PRO A 495 -2.914 7.707 6.646 1.00 34.91 C ANISOU 343 CG PRO A 495 3505 4090 5669 18 112 349 C ATOM 344 CD PRO A 495 -3.048 8.772 5.606 1.00 31.30 C ANISOU 344 CD PRO A 495 3035 3624 5234 13 8 327 C ATOM 0 HA PRO A 495 -5.655 8.584 7.311 1.00 30.24 H new ATOM 0 HB2 PRO A 495 -3.020 8.908 8.317 1.00 31.23 H new ATOM 0 HB3 PRO A 495 -3.894 7.624 8.457 1.00 31.23 H new ATOM 0 HG2 PRO A 495 -1.985 7.506 6.837 1.00 34.91 H new ATOM 0 HG3 PRO A 495 -3.332 6.877 6.367 1.00 34.91 H new ATOM 0 HD2 PRO A 495 -2.375 9.463 5.710 1.00 31.30 H new ATOM 0 HD3 PRO A 495 -2.951 8.414 4.710 1.00 31.30 H new ATOM 345 N LYS A 496 -6.029 10.326 8.924 1.00 28.78 N ANISOU 345 N LYS A 496 2472 3227 5235 138 442 424 N ATOM 346 CA LYS A 496 -6.456 11.464 9.731 1.00 29.38 C ANISOU 346 CA LYS A 496 2523 3301 5338 195 554 411 C ATOM 347 C LYS A 496 -5.643 11.454 11.014 1.00 34.00 C ANISOU 347 C LYS A 496 3213 3952 5753 242 682 381 C ATOM 348 O LYS A 496 -5.598 10.420 11.675 1.00 32.26 O ANISOU 348 O LYS A 496 3010 3748 5499 244 757 418 O ATOM 349 CB LYS A 496 -7.962 11.368 10.057 1.00 31.83 C ANISOU 349 CB LYS A 496 2688 3545 5862 206 639 475 C ATOM 350 CG LYS A 496 -8.520 12.634 10.681 1.00 35.90 C ANISOU 350 CG LYS A 496 3163 4046 6433 266 740 459 C ATOM 351 CD LYS A 496 -9.970 12.513 11.014 1.00 38.22 C ANISOU 351 CD LYS A 496 3306 4274 6941 281 836 525 C ATOM 352 CE LYS A 496 -10.700 13.810 11.277 1.00 48.07 C ANISOU 352 CE LYS A 496 4485 5485 8293 334 902 512 C ATOM 353 NZ LYS A 496 -10.063 14.638 12.334 1.00 56.13 N ANISOU 353 NZ LYS A 496 5610 6559 9157 401 1023 447 N ATOM 0 H LYS A 496 -6.468 9.607 9.097 1.00 28.78 H new ATOM 0 HA LYS A 496 -6.313 12.289 9.242 1.00 29.38 H new ATOM 0 HB2 LYS A 496 -8.452 11.173 9.243 1.00 31.83 H new ATOM 0 HB3 LYS A 496 -8.109 10.624 10.662 1.00 31.83 H new ATOM 0 HG2 LYS A 496 -8.022 12.841 11.487 1.00 35.90 H new ATOM 0 HG3 LYS A 496 -8.392 13.376 10.070 1.00 35.90 H new ATOM 0 HD2 LYS A 496 -10.414 12.055 10.283 1.00 38.22 H new ATOM 0 HD3 LYS A 496 -10.058 11.948 11.798 1.00 38.22 H new ATOM 0 HE2 LYS A 496 -10.742 14.323 10.455 1.00 48.07 H new ATOM 0 HE3 LYS A 496 -11.614 13.613 11.536 1.00 48.07 H new ATOM 0 HZ1 LYS A 496 -10.539 15.379 12.458 1.00 56.13 H new ATOM 0 HZ2 LYS A 496 -10.031 14.176 13.094 1.00 56.13 H new ATOM 0 HZ3 LYS A 496 -9.237 14.855 12.084 1.00 56.13 H new ATOM 354 N PRO A 497 -5.020 12.586 11.395 1.00 32.67 N ANISOU 354 N PRO A 497 3113 3817 5482 283 704 314 N ATOM 355 CA PRO A 497 -4.264 12.611 12.657 1.00 33.20 C ANISOU 355 CA PRO A 497 3283 3949 5383 333 812 275 C ATOM 356 C PRO A 497 -5.131 12.373 13.898 1.00 37.15 C ANISOU 356 C PRO A 497 3746 4447 5922 388 991 316 C ATOM 357 O PRO A 497 -6.302 12.737 13.920 1.00 37.14 O ANISOU 357 O PRO A 497 3637 4391 6082 402 1051 351 O ATOM 358 CB PRO A 497 -3.637 14.018 12.670 1.00 34.33 C ANISOU 358 CB PRO A 497 3480 4105 5459 361 783 190 C ATOM 359 CG PRO A 497 -3.692 14.479 11.225 1.00 37.65 C ANISOU 359 CG PRO A 497 3854 4482 5969 311 636 195 C ATOM 360 CD PRO A 497 -4.943 13.890 10.695 1.00 33.63 C ANISOU 360 CD PRO A 497 3225 3916 5637 285 624 271 C ATOM 0 HA PRO A 497 -3.613 11.893 12.695 1.00 33.20 H new ATOM 0 HB2 PRO A 497 -4.131 14.618 13.250 1.00 34.33 H new ATOM 0 HB3 PRO A 497 -2.724 13.994 12.998 1.00 34.33 H new ATOM 0 HG2 PRO A 497 -3.704 15.447 11.163 1.00 37.65 H new ATOM 0 HG3 PRO A 497 -2.918 14.172 10.727 1.00 37.65 H new ATOM 0 HD2 PRO A 497 -5.713 14.448 10.889 1.00 33.63 H new ATOM 0 HD3 PRO A 497 -4.908 13.779 9.732 1.00 33.63 H new ATOM 361 N PHE A 498 -4.577 11.634 14.873 1.00 34.12 N ANISOU 361 N PHE A 498 3447 4120 5397 416 1075 325 N ATOM 362 CA PHE A 498 -5.197 11.415 16.173 1.00 34.71 C ANISOU 362 CA PHE A 498 3518 4210 5460 480 1259 364 C ATOM 363 C PHE A 498 -4.199 11.926 17.191 1.00 37.76 C ANISOU 363 C PHE A 498 4043 4675 5629 543 1306 285 C ATOM 364 O PHE A 498 -3.054 11.446 17.172 1.00 37.25 O ANISOU 364 O PHE A 498 4074 4662 5418 528 1232 260 O ATOM 365 CB PHE A 498 -5.576 9.953 16.490 1.00 36.58 C ANISOU 365 CB PHE A 498 3726 4439 5733 464 1328 466 C ATOM 366 CG PHE A 498 -6.172 9.879 17.882 1.00 40.48 C ANISOU 366 CG PHE A 498 4228 4955 6198 541 1536 510 C ATOM 367 CD1 PHE A 498 -7.464 10.346 18.132 1.00 45.30 C ANISOU 367 CD1 PHE A 498 4725 5512 6974 570 1653 548 C ATOM 368 CD2 PHE A 498 -5.404 9.456 18.966 1.00 43.97 C ANISOU 368 CD2 PHE A 498 4797 5475 6434 595 1615 508 C ATOM 369 CE1 PHE A 498 -8.000 10.325 19.430 1.00 48.39 C ANISOU 369 CE1 PHE A 498 5131 5929 7327 650 1861 587 C ATOM 370 CE2 PHE A 498 -5.940 9.430 20.263 1.00 48.54 C ANISOU 370 CE2 PHE A 498 5398 6082 6963 676 1813 549 C ATOM 371 CZ PHE A 498 -7.239 9.859 20.485 1.00 48.18 C ANISOU 371 CZ PHE A 498 5239 5983 7082 704 1941 589 C ATOM 0 H PHE A 498 -3.816 11.243 14.787 1.00 34.12 H new ATOM 0 HA PHE A 498 -6.048 11.881 16.188 1.00 34.71 H new ATOM 0 HB2 PHE A 498 -6.213 9.624 15.836 1.00 36.58 H new ATOM 0 HB3 PHE A 498 -4.792 9.385 16.432 1.00 36.58 H new ATOM 0 HD1 PHE A 498 -7.977 10.675 17.429 1.00 45.30 H new ATOM 0 HD2 PHE A 498 -4.524 9.187 18.828 1.00 43.97 H new ATOM 0 HE1 PHE A 498 -8.868 10.625 19.580 1.00 48.39 H new ATOM 0 HE2 PHE A 498 -5.423 9.125 20.974 1.00 48.54 H new ATOM 0 HZ PHE A 498 -7.598 9.833 21.343 1.00 48.18 H new ATOM 372 N PRO A 499 -4.567 12.906 18.060 1.00 34.14 N ANISOU 372 N PRO A 499 3599 4227 5146 616 1418 238 N ATOM 373 CA PRO A 499 -5.891 13.550 18.215 1.00 35.50 C ANISOU 373 CA PRO A 499 3662 4340 5487 648 1525 261 C ATOM 374 C PRO A 499 -6.201 14.581 17.121 1.00 39.59 C ANISOU 374 C PRO A 499 4098 4793 6153 612 1412 223 C ATOM 375 O PRO A 499 -5.370 14.825 16.266 1.00 36.46 O ANISOU 375 O PRO A 499 3737 4399 5716 565 1259 180 O ATOM 376 CB PRO A 499 -5.806 14.168 19.628 1.00 37.51 C ANISOU 376 CB PRO A 499 4005 4647 5599 748 1675 202 C ATOM 377 CG PRO A 499 -4.345 14.543 19.754 1.00 39.89 C ANISOU 377 CG PRO A 499 4445 5012 5699 753 1570 98 C ATOM 378 CD PRO A 499 -3.608 13.407 19.072 1.00 34.57 C ANISOU 378 CD PRO A 499 3792 4357 4988 681 1451 148 C ATOM 0 HA PRO A 499 -6.626 12.924 18.119 1.00 35.50 H new ATOM 0 HB2 PRO A 499 -6.384 14.942 19.716 1.00 37.51 H new ATOM 0 HB3 PRO A 499 -6.074 13.535 20.313 1.00 37.51 H new ATOM 0 HG2 PRO A 499 -4.159 15.393 19.326 1.00 39.89 H new ATOM 0 HG3 PRO A 499 -4.080 14.630 20.683 1.00 39.89 H new ATOM 0 HD2 PRO A 499 -2.786 13.715 18.659 1.00 34.57 H new ATOM 0 HD3 PRO A 499 -3.365 12.712 19.704 1.00 34.57 H new ATOM 379 N THR A 500 -7.414 15.163 17.128 1.00 39.73 N ANISOU 379 N THR A 500 4001 4747 6346 638 1490 248 N ATOM 380 CA THR A 500 -7.799 16.163 16.126 1.00 40.28 C ANISOU 380 CA THR A 500 3988 4750 6567 612 1388 224 C ATOM 381 C THR A 500 -7.002 17.464 16.284 1.00 44.64 C ANISOU 381 C THR A 500 4625 5316 7019 646 1350 109 C ATOM 382 O THR A 500 -6.586 18.032 15.278 1.00 44.67 O ANISOU 382 O THR A 500 4622 5292 7059 603 1207 83 O ATOM 383 CB THR A 500 -9.328 16.370 16.136 1.00 48.48 C ANISOU 383 CB THR A 500 4871 5714 7836 633 1482 288 C ATOM 384 OG1 THR A 500 -9.960 15.096 16.009 1.00 44.82 O ANISOU 384 OG1 THR A 500 4330 5234 7468 595 1511 392 O ATOM 385 CG2 THR A 500 -9.815 17.269 15.008 1.00 48.07 C ANISOU 385 CG2 THR A 500 4721 5587 7957 604 1360 283 C ATOM 0 H THR A 500 -8.025 14.989 17.707 1.00 39.73 H new ATOM 0 HA THR A 500 -7.567 15.829 15.245 1.00 40.28 H new ATOM 0 HB THR A 500 -9.556 16.806 16.972 1.00 48.48 H new ATOM 0 HG1 THR A 500 -10.794 15.195 16.015 1.00 44.82 H new ATOM 0 HG21 THR A 500 -10.779 17.364 15.063 1.00 48.07 H new ATOM 0 HG22 THR A 500 -9.400 18.142 15.087 1.00 48.07 H new ATOM 0 HG23 THR A 500 -9.577 16.875 14.154 1.00 48.07 H new ATOM 386 N HIS A 501 -6.780 17.915 17.530 1.00 43.45 N ANISOU 386 N HIS A 501 4558 5207 6744 724 1476 42 N ATOM 387 CA HIS A 501 -6.088 19.172 17.854 1.00 44.94 C ANISOU 387 CA HIS A 501 4826 5402 6848 765 1454 -81 C ATOM 388 C HIS A 501 -4.754 18.924 18.482 1.00 43.43 C ANISOU 388 C HIS A 501 4785 5294 6424 777 1425 -151 C ATOM 389 O HIS A 501 -4.607 18.012 19.279 1.00 40.86 O ANISOU 389 O HIS A 501 4518 5031 5975 802 1504 -121 O ATOM 390 CB HIS A 501 -6.944 20.039 18.798 1.00 50.00 C ANISOU 390 CB HIS A 501 5441 6016 7542 855 1615 -124 C ATOM 391 CG HIS A 501 -8.311 20.324 18.256 1.00 56.79 C ANISOU 391 CG HIS A 501 6140 6788 8648 852 1654 -53 C ATOM 392 ND1 HIS A 501 -9.421 19.584 18.654 1.00 60.66 N ANISOU 392 ND1 HIS A 501 6543 7268 9239 872 1790 42 N ATOM 393 CD2 HIS A 501 -8.697 21.219 17.314 1.00 60.05 C ANISOU 393 CD2 HIS A 501 6464 7121 9231 829 1564 -57 C ATOM 394 CE1 HIS A 501 -10.446 20.083 17.976 1.00 61.01 C ANISOU 394 CE1 HIS A 501 6442 7226 9514 862 1777 84 C ATOM 395 NE2 HIS A 501 -10.057 21.062 17.150 1.00 60.82 N ANISOU 395 NE2 HIS A 501 6416 7160 9534 837 1639 28 N ATOM 0 H HIS A 501 -7.036 17.484 18.228 1.00 43.45 H new ATOM 0 HA HIS A 501 -5.950 19.644 17.018 1.00 44.94 H new ATOM 0 HB2 HIS A 501 -7.028 19.590 19.653 1.00 50.00 H new ATOM 0 HB3 HIS A 501 -6.486 20.878 18.962 1.00 50.00 H new ATOM 0 HD2 HIS A 501 -8.150 21.822 16.865 1.00 60.05 H new ATOM 0 HE1 HIS A 501 -11.324 19.790 18.063 1.00 61.01 H new ATOM 0 HE2 HIS A 501 -10.561 21.510 16.616 1.00 60.82 H new ATOM 396 N TYR A 502 -3.782 19.760 18.144 1.00 41.12 N ANISOU 396 N TYR A 502 4549 4998 6077 761 1311 -243 N ATOM 397 CA TYR A 502 -2.405 19.668 18.630 1.00 40.04 C ANISOU 397 CA TYR A 502 4545 4932 5739 766 1254 -322 C ATOM 398 C TYR A 502 -2.319 19.533 20.152 1.00 45.73 C ANISOU 398 C TYR A 502 5363 5720 6294 855 1386 -375 C ATOM 399 O TYR A 502 -2.888 20.350 20.882 1.00 45.78 O ANISOU 399 O TYR A 502 5370 5706 6318 926 1491 -433 O ATOM 400 CB TYR A 502 -1.590 20.885 18.153 1.00 39.67 C ANISOU 400 CB TYR A 502 4520 4847 5704 748 1140 -422 C ATOM 401 CG TYR A 502 -0.131 20.820 18.537 1.00 41.28 C ANISOU 401 CG TYR A 502 4842 5114 5730 744 1063 -505 C ATOM 402 CD1 TYR A 502 0.758 20.002 17.842 1.00 42.25 C ANISOU 402 CD1 TYR A 502 4986 5270 5798 678 952 -463 C ATOM 403 CD2 TYR A 502 0.370 21.587 19.587 1.00 43.16 C ANISOU 403 CD2 TYR A 502 5166 5373 5860 810 1094 -631 C ATOM 404 CE1 TYR A 502 2.104 19.939 18.188 1.00 43.09 C ANISOU 404 CE1 TYR A 502 5188 5430 5757 676 879 -536 C ATOM 405 CE2 TYR A 502 1.725 21.571 19.910 1.00 43.55 C ANISOU 405 CE2 TYR A 502 5311 5473 5762 804 1005 -712 C ATOM 406 CZ TYR A 502 2.587 20.739 19.213 1.00 50.14 C ANISOU 406 CZ TYR A 502 6156 6340 6554 737 900 -660 C ATOM 407 OH TYR A 502 3.913 20.688 19.554 1.00 47.76 O ANISOU 407 OH TYR A 502 5939 6088 6120 734 815 -735 O ATOM 0 H TYR A 502 -3.906 20.420 17.607 1.00 41.12 H new ATOM 0 HA TYR A 502 -2.027 18.857 18.256 1.00 40.04 H new ATOM 0 HB2 TYR A 502 -1.660 20.954 17.188 1.00 39.67 H new ATOM 0 HB3 TYR A 502 -1.979 21.692 18.525 1.00 39.67 H new ATOM 0 HD1 TYR A 502 0.445 19.488 17.133 1.00 42.25 H new ATOM 0 HD2 TYR A 502 -0.211 22.119 20.081 1.00 43.16 H new ATOM 0 HE1 TYR A 502 2.677 19.364 17.735 1.00 43.09 H new ATOM 0 HE2 TYR A 502 2.050 22.116 20.590 1.00 43.55 H new ATOM 0 HH TYR A 502 3.988 20.691 20.391 1.00 47.76 H new ATOM 408 N LYS A 503 -1.645 18.476 20.611 1.00 43.58 N ANISOU 408 N LYS A 503 5172 5526 5861 855 1382 -348 N ATOM 409 CA LYS A 503 -1.360 18.211 22.023 1.00 45.50 C ANISOU 409 CA LYS A 503 5531 5849 5908 939 1484 -390 C ATOM 410 C LYS A 503 0.165 18.218 22.125 1.00 48.96 C ANISOU 410 C LYS A 503 6076 6342 6184 923 1350 -474 C ATOM 411 O LYS A 503 0.847 17.539 21.355 1.00 46.80 O ANISOU 411 O LYS A 503 5795 6077 5911 853 1238 -428 O ATOM 412 CB LYS A 503 -1.973 16.876 22.502 1.00 50.05 C ANISOU 412 CB LYS A 503 6100 6465 6452 955 1603 -262 C ATOM 413 CG LYS A 503 -1.289 16.229 23.721 1.00 66.75 C ANISOU 413 CG LYS A 503 8355 8680 8327 1021 1657 -277 C ATOM 414 CD LYS A 503 -1.550 16.982 25.032 1.00 80.77 C ANISOU 414 CD LYS A 503 10213 10493 9981 1135 1787 -365 C ATOM 415 CE LYS A 503 -0.490 16.710 26.069 1.00 84.18 C ANISOU 415 CE LYS A 503 10806 11026 10154 1196 1766 -429 C ATOM 416 NZ LYS A 503 -0.204 17.926 26.873 1.00 86.05 N ANISOU 416 NZ LYS A 503 11130 11281 10286 1275 1773 -591 N ATOM 0 H LYS A 503 -1.329 17.871 20.088 1.00 43.58 H new ATOM 0 HA LYS A 503 -1.760 18.879 22.601 1.00 45.50 H new ATOM 0 HB2 LYS A 503 -2.907 17.026 22.717 1.00 50.05 H new ATOM 0 HB3 LYS A 503 -1.950 16.245 21.766 1.00 50.05 H new ATOM 0 HG2 LYS A 503 -1.601 15.315 23.812 1.00 66.75 H new ATOM 0 HG3 LYS A 503 -0.333 16.188 23.564 1.00 66.75 H new ATOM 0 HD2 LYS A 503 -1.588 17.935 24.853 1.00 80.77 H new ATOM 0 HD3 LYS A 503 -2.417 16.725 25.383 1.00 80.77 H new ATOM 0 HE2 LYS A 503 -0.782 15.993 26.654 1.00 84.18 H new ATOM 0 HE3 LYS A 503 0.323 16.408 25.634 1.00 84.18 H new ATOM 0 HZ1 LYS A 503 -0.078 17.697 27.724 1.00 86.05 H new ATOM 0 HZ2 LYS A 503 0.529 18.323 26.561 1.00 86.05 H new ATOM 0 HZ3 LYS A 503 -0.892 18.488 26.817 1.00 86.05 H new ATOM 417 N ASP A 504 0.688 19.019 23.048 1.00 46.60 N ANISOU 417 N ASP A 504 5873 6076 5759 991 1358 -602 N ATOM 418 CA ASP A 504 2.117 19.219 23.217 1.00 45.44 C ANISOU 418 CA ASP A 504 5818 5970 5477 983 1226 -701 C ATOM 419 C ASP A 504 2.700 18.584 24.467 1.00 47.92 C ANISOU 419 C ASP A 504 6262 6386 5557 1054 1261 -728 C ATOM 420 O ASP A 504 2.142 18.712 25.558 1.00 48.65 O ANISOU 420 O ASP A 504 6415 6516 5555 1146 1392 -752 O ATOM 421 CB ASP A 504 2.387 20.734 23.284 1.00 47.98 C ANISOU 421 CB ASP A 504 6148 6240 5843 1002 1178 -849 C ATOM 422 CG ASP A 504 3.853 21.113 23.163 1.00 55.99 C ANISOU 422 CG ASP A 504 7220 7267 6787 971 1018 -951 C ATOM 423 OD1 ASP A 504 4.498 20.681 22.184 1.00 51.86 O ANISOU 423 OD1 ASP A 504 6657 6733 6315 889 909 -897 O ATOM 424 OD2 ASP A 504 4.346 21.864 24.035 1.00 63.86 O ANISOU 424 OD2 ASP A 504 8297 8281 7685 1030 1002 -1089 O ATOM 0 H ASP A 504 0.210 19.469 23.603 1.00 46.60 H new ATOM 0 HA ASP A 504 2.545 18.788 22.461 1.00 45.44 H new ATOM 0 HB2 ASP A 504 1.891 21.172 22.575 1.00 47.98 H new ATOM 0 HB3 ASP A 504 2.043 21.076 24.124 1.00 47.98 H new ATOM 425 N LEU A 505 3.878 17.983 24.321 1.00 41.37 N ANISOU 425 N LEU A 505 5484 5604 4631 1019 1140 -730 N ATOM 426 CA LEU A 505 4.649 17.492 25.454 1.00 41.94 C ANISOU 426 CA LEU A 505 5687 5773 4476 1087 1135 -770 C ATOM 427 C LEU A 505 6.070 17.976 25.259 1.00 45.43 C ANISOU 427 C LEU A 505 6168 6223 4873 1056 959 -883 C ATOM 428 O LEU A 505 6.695 17.641 24.249 1.00 45.04 O ANISOU 428 O LEU A 505 6063 6147 4904 971 851 -843 O ATOM 429 CB LEU A 505 4.573 15.962 25.680 1.00 41.75 C ANISOU 429 CB LEU A 505 5686 5808 4368 1091 1189 -628 C ATOM 430 CG LEU A 505 3.297 15.392 26.342 1.00 46.64 C ANISOU 430 CG LEU A 505 6302 6444 4976 1151 1386 -522 C ATOM 431 CD1 LEU A 505 3.437 13.928 26.582 1.00 46.65 C ANISOU 431 CD1 LEU A 505 6334 6498 4894 1152 1419 -390 C ATOM 432 CD2 LEU A 505 2.941 16.092 27.660 1.00 47.90 C ANISOU 432 CD2 LEU A 505 6557 6649 4994 1269 1500 -611 C ATOM 0 H LEU A 505 4.252 17.849 23.558 1.00 41.37 H new ATOM 0 HA LEU A 505 4.263 17.847 26.270 1.00 41.94 H new ATOM 0 HB2 LEU A 505 4.681 15.528 24.819 1.00 41.75 H new ATOM 0 HB3 LEU A 505 5.332 15.703 26.225 1.00 41.75 H new ATOM 0 HG LEU A 505 2.573 15.558 25.718 1.00 46.64 H new ATOM 0 HD11 LEU A 505 2.628 13.589 26.997 1.00 46.65 H new ATOM 0 HD12 LEU A 505 3.581 13.474 25.737 1.00 46.65 H new ATOM 0 HD13 LEU A 505 4.193 13.767 27.168 1.00 46.65 H new ATOM 0 HD21 LEU A 505 2.136 15.696 28.030 1.00 47.90 H new ATOM 0 HD22 LEU A 505 3.671 15.987 28.290 1.00 47.90 H new ATOM 0 HD23 LEU A 505 2.790 17.036 27.495 1.00 47.90 H new ATOM 433 N TRP A 506 6.539 18.842 26.165 1.00 41.65 N ANISOU 433 N TRP A 506 5775 5768 4283 1123 931 -1032 N ATOM 434 CA TRP A 506 7.892 19.397 26.146 1.00 41.24 C ANISOU 434 CA TRP A 506 5759 5719 4193 1101 764 -1158 C ATOM 435 C TRP A 506 8.584 18.859 27.406 1.00 46.40 C ANISOU 435 C TRP A 506 6549 6481 4602 1185 742 -1204 C ATOM 436 O TRP A 506 8.561 19.495 28.460 1.00 46.93 O ANISOU 436 O TRP A 506 6707 6581 4545 1272 765 -1323 O ATOM 437 CB TRP A 506 7.817 20.928 26.122 1.00 40.64 C ANISOU 437 CB TRP A 506 5660 5566 4216 1108 736 -1302 C ATOM 438 CG TRP A 506 9.128 21.641 26.048 1.00 41.43 C ANISOU 438 CG TRP A 506 5776 5646 4319 1079 568 -1437 C ATOM 439 CD1 TRP A 506 9.861 22.113 27.098 1.00 45.35 C ANISOU 439 CD1 TRP A 506 6374 6185 4673 1145 499 -1589 C ATOM 440 CD2 TRP A 506 9.780 22.112 24.859 1.00 39.88 C ANISOU 440 CD2 TRP A 506 5485 5371 4298 980 453 -1440 C ATOM 441 NE1 TRP A 506 10.968 22.787 26.638 1.00 44.06 N ANISOU 441 NE1 TRP A 506 6174 5970 4595 1087 342 -1684 N ATOM 442 CE2 TRP A 506 10.940 22.811 25.267 1.00 44.27 C ANISOU 442 CE2 TRP A 506 6082 5922 4818 986 320 -1591 C ATOM 443 CE3 TRP A 506 9.503 22.003 23.486 1.00 39.71 C ANISOU 443 CE3 TRP A 506 5350 5282 4455 889 448 -1329 C ATOM 444 CZ2 TRP A 506 11.846 23.363 24.350 1.00 42.87 C ANISOU 444 CZ2 TRP A 506 5829 5673 4789 901 195 -1621 C ATOM 445 CZ3 TRP A 506 10.388 22.573 22.576 1.00 40.63 C ANISOU 445 CZ3 TRP A 506 5405 5335 4698 812 328 -1360 C ATOM 446 CH2 TRP A 506 11.553 23.227 23.009 1.00 41.86 C ANISOU 446 CH2 TRP A 506 5595 5484 4824 816 209 -1499 C ATOM 0 H TRP A 506 6.064 19.128 26.823 1.00 41.65 H new ATOM 0 HA TRP A 506 8.396 19.138 25.358 1.00 41.24 H new ATOM 0 HB2 TRP A 506 7.278 21.197 25.362 1.00 40.64 H new ATOM 0 HB3 TRP A 506 7.351 21.225 26.919 1.00 40.64 H new ATOM 0 HD1 TRP A 506 9.643 21.996 27.995 1.00 45.35 H new ATOM 0 HE1 TRP A 506 11.580 23.137 27.131 1.00 44.06 H new ATOM 0 HE3 TRP A 506 8.742 21.558 23.191 1.00 39.71 H new ATOM 0 HZ2 TRP A 506 12.614 23.803 24.635 1.00 42.87 H new ATOM 0 HZ3 TRP A 506 10.205 22.520 21.666 1.00 40.63 H new ATOM 0 HH2 TRP A 506 12.140 23.576 22.378 1.00 41.86 H new ATOM 447 N ASP A 507 9.132 17.636 27.304 1.00 42.20 N ANISOU 447 N ASP A 507 6033 6004 3996 1164 703 -1102 N ATOM 448 CA ASP A 507 9.770 16.939 28.417 1.00 43.28 C ANISOU 448 CA ASP A 507 6294 6246 3904 1242 681 -1113 C ATOM 449 C ASP A 507 10.942 16.042 27.955 1.00 48.44 C ANISOU 449 C ASP A 507 6938 6927 4541 1187 546 -1061 C ATOM 450 O ASP A 507 11.347 16.105 26.786 1.00 47.11 O ANISOU 450 O ASP A 507 6671 6695 4535 1091 466 -1040 O ATOM 451 CB ASP A 507 8.712 16.162 29.258 1.00 45.30 C ANISOU 451 CB ASP A 507 6611 6561 4041 1324 865 -1003 C ATOM 452 CG ASP A 507 7.998 15.004 28.546 1.00 52.97 C ANISOU 452 CG ASP A 507 7500 7510 5116 1270 958 -811 C ATOM 453 OD1 ASP A 507 8.610 14.381 27.644 1.00 52.14 O ANISOU 453 OD1 ASP A 507 7335 7383 5095 1187 860 -750 O ATOM 454 OD2 ASP A 507 6.861 14.679 28.936 1.00 56.25 O ANISOU 454 OD2 ASP A 507 7914 7931 5527 1313 1127 -723 O ATOM 0 H ASP A 507 9.139 17.187 26.570 1.00 42.20 H new ATOM 0 HA ASP A 507 10.168 17.607 28.997 1.00 43.28 H new ATOM 0 HB2 ASP A 507 9.150 15.810 30.049 1.00 45.30 H new ATOM 0 HB3 ASP A 507 8.041 16.793 29.562 1.00 45.30 H new ATOM 455 N ASN A 508 11.469 15.204 28.875 1.00 44.60 N ANISOU 455 N ASN A 508 6555 6534 3856 1255 528 -1036 N ATOM 456 CA ASN A 508 12.600 14.312 28.640 1.00 43.50 C ANISOU 456 CA ASN A 508 6418 6429 3681 1224 406 -990 C ATOM 457 C ASN A 508 12.254 13.011 27.893 1.00 46.69 C ANISOU 457 C ASN A 508 6759 6819 4162 1170 467 -808 C ATOM 458 O ASN A 508 13.170 12.290 27.477 1.00 45.92 O ANISOU 458 O ASN A 508 6643 6731 4073 1131 367 -768 O ATOM 459 CB ASN A 508 13.292 13.988 29.984 1.00 47.89 C ANISOU 459 CB ASN A 508 7115 7091 3990 1329 353 -1039 C ATOM 460 CG ASN A 508 12.406 13.374 31.071 1.00 88.96 C ANISOU 460 CG ASN A 508 12421 12368 9013 1433 513 -955 C ATOM 461 OD1 ASN A 508 11.206 13.678 31.206 1.00 92.32 O ANISOU 461 OD1 ASN A 508 12838 12771 9468 1458 671 -928 O ATOM 462 ND2 ASN A 508 13.001 12.548 31.931 1.00 80.18 N ANISOU 462 ND2 ASN A 508 11413 11347 7706 1506 476 -916 N ATOM 0 H ASN A 508 11.159 15.147 29.675 1.00 44.60 H new ATOM 0 HA ASN A 508 13.199 14.793 28.048 1.00 43.50 H new ATOM 0 HB2 ASN A 508 14.026 13.379 29.809 1.00 47.89 H new ATOM 0 HB3 ASN A 508 13.679 14.806 30.333 1.00 47.89 H new ATOM 0 HD21 ASN A 508 12.556 12.218 32.589 1.00 80.18 H new ATOM 0 HD22 ASN A 508 13.830 12.345 31.828 1.00 80.18 H new ATOM 463 N LYS A 509 10.957 12.678 27.755 1.00 43.06 N ANISOU 463 N LYS A 509 6266 6334 3762 1170 628 -701 N ATOM 464 CA LYS A 509 10.576 11.408 27.125 1.00 41.70 C ANISOU 464 CA LYS A 509 6037 6143 3666 1122 685 -534 C ATOM 465 C LYS A 509 9.946 11.569 25.744 1.00 43.40 C ANISOU 465 C LYS A 509 6119 6262 4110 1022 701 -489 C ATOM 466 O LYS A 509 9.439 10.590 25.168 1.00 43.25 O ANISOU 466 O LYS A 509 6044 6214 4174 980 755 -359 O ATOM 467 CB LYS A 509 9.663 10.595 28.072 1.00 44.63 C ANISOU 467 CB LYS A 509 6471 6562 3924 1202 850 -419 C ATOM 468 CG LYS A 509 10.386 10.071 29.329 1.00 45.40 C ANISOU 468 CG LYS A 509 6707 6763 3781 1300 824 -421 C ATOM 0 H LYS A 509 10.298 13.166 28.015 1.00 43.06 H new ATOM 0 HA LYS A 509 11.398 10.916 26.974 1.00 41.70 H new ATOM 0 HB2 LYS A 509 8.917 11.151 28.346 1.00 44.63 H new ATOM 0 HB3 LYS A 509 9.292 9.843 27.584 1.00 44.63 H new ATOM 469 N HIS A 510 9.947 12.801 25.217 1.00 36.81 N ANISOU 469 N HIS A 510 5234 5373 3379 985 652 -594 N ATOM 470 CA HIS A 510 9.301 13.068 23.930 1.00 34.87 C ANISOU 470 CA HIS A 510 4870 5039 3341 899 664 -553 C ATOM 471 C HIS A 510 10.104 14.007 23.052 1.00 36.20 C ANISOU 471 C HIS A 510 4988 5157 3611 835 533 -648 C ATOM 472 O HIS A 510 10.910 14.800 23.541 1.00 34.66 O ANISOU 472 O HIS A 510 4838 4980 3353 861 454 -771 O ATOM 473 CB HIS A 510 7.868 13.632 24.151 1.00 36.16 C ANISOU 473 CB HIS A 510 5001 5166 3570 929 807 -539 C ATOM 474 CG HIS A 510 6.964 12.702 24.915 1.00 40.98 C ANISOU 474 CG HIS A 510 5643 5814 4113 986 958 -427 C ATOM 475 ND1 HIS A 510 7.021 12.615 26.296 1.00 44.94 N ANISOU 475 ND1 HIS A 510 6259 6395 4420 1088 1025 -450 N ATOM 476 CD2 HIS A 510 6.060 11.800 24.463 1.00 42.68 C ANISOU 476 CD2 HIS A 510 5789 5996 4432 953 1047 -289 C ATOM 477 CE1 HIS A 510 6.139 11.688 26.642 1.00 44.70 C ANISOU 477 CE1 HIS A 510 6225 6376 4383 1115 1165 -317 C ATOM 478 NE2 HIS A 510 5.533 11.173 25.572 1.00 44.10 N ANISOU 478 NE2 HIS A 510 6034 6228 4493 1033 1181 -219 N ATOM 0 H HIS A 510 10.312 13.486 25.586 1.00 36.81 H new ATOM 0 HA HIS A 510 9.248 12.220 23.462 1.00 34.87 H new ATOM 0 HB2 HIS A 510 7.930 14.474 24.628 1.00 36.16 H new ATOM 0 HB3 HIS A 510 7.468 13.824 23.288 1.00 36.16 H new ATOM 0 HD1 HIS A 510 7.526 13.070 26.822 1.00 44.94 H new ATOM 0 HD2 HIS A 510 5.838 11.635 23.575 1.00 42.68 H new ATOM 0 HE1 HIS A 510 5.965 11.430 27.518 1.00 44.70 H new ATOM 479 N VAL A 511 9.859 13.924 21.744 1.00 31.80 N ANISOU 479 N VAL A 511 4334 4535 3215 751 512 -589 N ATOM 480 CA VAL A 511 10.436 14.830 20.767 1.00 30.70 C ANISOU 480 CA VAL A 511 4135 4337 3192 687 413 -654 C ATOM 481 C VAL A 511 10.003 16.234 21.162 1.00 35.38 C ANISOU 481 C VAL A 511 4728 4894 3821 718 439 -757 C ATOM 482 O VAL A 511 8.843 16.451 21.528 1.00 35.87 O ANISOU 482 O VAL A 511 4783 4943 3904 754 551 -736 O ATOM 483 CB VAL A 511 9.984 14.478 19.321 1.00 32.99 C ANISOU 483 CB VAL A 511 4332 4566 3637 605 408 -559 C ATOM 484 CG1 VAL A 511 10.416 15.553 18.315 1.00 32.74 C ANISOU 484 CG1 VAL A 511 4242 4471 3728 547 328 -614 C ATOM 485 CG2 VAL A 511 10.494 13.106 18.905 1.00 31.19 C ANISOU 485 CG2 VAL A 511 4108 4367 3378 576 375 -473 C ATOM 0 H VAL A 511 9.344 13.328 21.399 1.00 31.80 H new ATOM 0 HA VAL A 511 11.403 14.758 20.764 1.00 30.70 H new ATOM 0 HB VAL A 511 9.014 14.451 19.320 1.00 32.99 H new ATOM 0 HG11 VAL A 511 10.119 15.303 17.426 1.00 32.74 H new ATOM 0 HG12 VAL A 511 10.020 16.404 18.560 1.00 32.74 H new ATOM 0 HG13 VAL A 511 11.383 15.633 18.322 1.00 32.74 H new ATOM 0 HG21 VAL A 511 10.199 12.911 18.002 1.00 31.19 H new ATOM 0 HG22 VAL A 511 11.463 13.098 18.937 1.00 31.19 H new ATOM 0 HG23 VAL A 511 10.145 12.434 19.511 1.00 31.19 H new ATOM 486 N LYS A 512 10.956 17.160 21.181 1.00 34.51 N ANISOU 486 N LYS A 512 4626 4767 3719 709 340 -872 N ATOM 487 CA LYS A 512 10.675 18.560 21.443 1.00 35.36 C ANISOU 487 CA LYS A 512 4726 4824 3884 730 347 -981 C ATOM 488 C LYS A 512 10.297 19.153 20.087 1.00 37.24 C ANISOU 488 C LYS A 512 4861 4971 4317 654 335 -939 C ATOM 489 O LYS A 512 11.134 19.261 19.199 1.00 35.33 O ANISOU 489 O LYS A 512 4578 4701 4145 591 245 -935 O ATOM 490 CB LYS A 512 11.864 19.262 22.090 1.00 36.76 C ANISOU 490 CB LYS A 512 4955 5016 3995 753 240 -1126 C ATOM 491 CG LYS A 512 11.878 19.089 23.590 1.00 44.11 C ANISOU 491 CG LYS A 512 5999 6027 4735 851 270 -1195 C ATOM 492 CD LYS A 512 13.040 19.834 24.197 1.00 48.99 C ANISOU 492 CD LYS A 512 6663 6654 5298 873 144 -1350 C ATOM 493 CE LYS A 512 12.919 20.023 25.688 1.00 55.49 C ANISOU 493 CE LYS A 512 7604 7544 5936 980 171 -1451 C ATOM 494 NZ LYS A 512 12.875 18.742 26.420 1.00 54.10 N ANISOU 494 NZ LYS A 512 7510 7471 5574 1038 215 -1366 N ATOM 0 H LYS A 512 11.787 16.990 21.041 1.00 34.51 H new ATOM 0 HA LYS A 512 9.954 18.675 22.082 1.00 35.36 H new ATOM 0 HB2 LYS A 512 12.688 18.910 21.717 1.00 36.76 H new ATOM 0 HB3 LYS A 512 11.836 20.207 21.875 1.00 36.76 H new ATOM 0 HG2 LYS A 512 11.046 19.415 23.966 1.00 44.11 H new ATOM 0 HG3 LYS A 512 11.940 18.147 23.812 1.00 44.11 H new ATOM 0 HD2 LYS A 512 13.860 19.353 24.005 1.00 48.99 H new ATOM 0 HD3 LYS A 512 13.115 20.703 23.773 1.00 48.99 H new ATOM 0 HE2 LYS A 512 13.670 20.548 26.006 1.00 55.49 H new ATOM 0 HE3 LYS A 512 12.116 20.531 25.882 1.00 55.49 H new ATOM 0 HZ1 LYS A 512 12.833 18.901 27.295 1.00 54.10 H new ATOM 0 HZ2 LYS A 512 12.157 18.280 26.168 1.00 54.10 H new ATOM 0 HZ3 LYS A 512 13.608 18.271 26.239 1.00 54.10 H new ATOM 495 N MET A 513 9.018 19.438 19.903 1.00 34.18 N ANISOU 495 N MET A 513 4431 4543 4014 664 431 -894 N ATOM 496 CA MET A 513 8.509 19.926 18.623 1.00 33.66 C ANISOU 496 CA MET A 513 4270 4395 4126 600 422 -839 C ATOM 497 C MET A 513 8.821 21.394 18.366 1.00 35.71 C ANISOU 497 C MET A 513 4499 4578 4492 587 372 -934 C ATOM 498 O MET A 513 8.719 22.197 19.286 1.00 34.62 O ANISOU 498 O MET A 513 4398 4430 4324 643 397 -1041 O ATOM 499 CB MET A 513 6.989 19.672 18.519 1.00 36.36 C ANISOU 499 CB MET A 513 4565 4715 4534 617 536 -751 C ATOM 500 CG MET A 513 6.626 18.210 18.592 1.00 39.98 C ANISOU 500 CG MET A 513 5034 5229 4928 616 585 -641 C ATOM 501 SD MET A 513 7.168 17.278 17.132 1.00 43.70 S ANISOU 501 SD MET A 513 5457 5692 5456 525 491 -543 S ATOM 502 CE MET A 513 5.905 17.748 16.037 1.00 41.41 C ANISOU 502 CE MET A 513 5064 5319 5351 488 517 -474 C ATOM 0 H MET A 513 8.418 19.356 20.513 1.00 34.18 H new ATOM 0 HA MET A 513 8.973 19.425 17.934 1.00 33.66 H new ATOM 0 HB2 MET A 513 6.538 20.148 19.234 1.00 36.36 H new ATOM 0 HB3 MET A 513 6.662 20.039 17.683 1.00 36.36 H new ATOM 0 HG2 MET A 513 7.025 17.821 19.386 1.00 39.98 H new ATOM 0 HG3 MET A 513 5.665 18.124 18.687 1.00 39.98 H new ATOM 0 HE1 MET A 513 6.056 17.335 15.172 1.00 41.41 H new ATOM 0 HE2 MET A 513 5.048 17.459 16.388 1.00 41.41 H new ATOM 0 HE3 MET A 513 5.904 18.713 15.939 1.00 41.41 H new ATOM 503 N PRO A 514 9.138 21.802 17.115 1.00 30.98 N ANISOU 503 N PRO A 514 3832 3916 4022 517 307 -896 N ATOM 504 CA PRO A 514 9.404 23.238 16.879 1.00 30.48 C ANISOU 504 CA PRO A 514 3736 3769 4078 504 267 -978 C ATOM 505 C PRO A 514 8.180 24.114 17.080 1.00 35.66 C ANISOU 505 C PRO A 514 4358 4361 4828 543 347 -995 C ATOM 506 O PRO A 514 8.334 25.287 17.387 1.00 35.32 O ANISOU 506 O PRO A 514 4313 4258 4850 560 333 -1095 O ATOM 507 CB PRO A 514 9.849 23.304 15.409 1.00 31.07 C ANISOU 507 CB PRO A 514 3746 3797 4261 425 201 -898 C ATOM 508 CG PRO A 514 9.447 21.997 14.806 1.00 34.11 C ANISOU 508 CG PRO A 514 4124 4233 4605 401 221 -774 C ATOM 509 CD PRO A 514 9.347 20.989 15.894 1.00 29.88 C ANISOU 509 CD PRO A 514 3652 3781 3919 450 266 -783 C ATOM 0 HA PRO A 514 10.063 23.570 17.508 1.00 30.48 H new ATOM 0 HB2 PRO A 514 9.424 24.045 14.949 1.00 31.07 H new ATOM 0 HB3 PRO A 514 10.807 23.439 15.341 1.00 31.07 H new ATOM 0 HG2 PRO A 514 8.597 22.084 14.348 1.00 34.11 H new ATOM 0 HG3 PRO A 514 10.098 21.716 14.144 1.00 34.11 H new ATOM 0 HD2 PRO A 514 8.610 20.376 15.744 1.00 29.88 H new ATOM 0 HD3 PRO A 514 10.153 20.453 15.957 1.00 29.88 H new ATOM 510 N CYS A 515 6.966 23.549 16.905 1.00 34.05 N ANISOU 510 N CYS A 515 4124 4167 4646 556 431 -900 N ATOM 511 CA CYS A 515 5.713 24.293 17.019 1.00 35.67 C ANISOU 511 CA CYS A 515 4284 4311 4958 593 515 -900 C ATOM 512 C CYS A 515 5.209 24.460 18.457 1.00 41.28 C ANISOU 512 C CYS A 515 5053 5054 5578 682 613 -987 C ATOM 513 O CYS A 515 4.193 25.112 18.672 1.00 41.49 O ANISOU 513 O CYS A 515 5044 5030 5691 723 694 -999 O ATOM 514 CB CYS A 515 4.641 23.696 16.112 1.00 35.85 C ANISOU 514 CB CYS A 515 4232 4319 5072 564 550 -761 C ATOM 515 SG CYS A 515 4.434 21.911 16.289 1.00 39.32 S ANISOU 515 SG CYS A 515 4698 4854 5390 559 587 -661 S ATOM 0 H CYS A 515 6.857 22.717 16.716 1.00 34.05 H new ATOM 0 HA CYS A 515 5.911 25.193 16.717 1.00 35.67 H new ATOM 0 HB2 CYS A 515 3.794 24.130 16.300 1.00 35.85 H new ATOM 0 HB3 CYS A 515 4.864 23.896 15.189 1.00 35.85 H new ATOM 0 HG CYS A 515 3.685 21.683 17.198 1.00 39.32 H new ATOM 516 N SER A 516 5.916 23.894 19.429 1.00 38.44 N ANISOU 516 N SER A 516 4785 4777 5042 717 606 -1045 N ATOM 517 CA SER A 516 5.561 23.961 20.847 1.00 38.70 C ANISOU 517 CA SER A 516 4896 4858 4950 811 696 -1128 C ATOM 518 C SER A 516 5.578 25.382 21.376 1.00 43.48 C ANISOU 518 C SER A 516 5516 5398 5604 855 695 -1275 C ATOM 519 O SER A 516 6.444 26.176 20.995 1.00 43.13 O ANISOU 519 O SER A 516 5460 5300 5628 816 590 -1350 O ATOM 520 CB SER A 516 6.525 23.102 21.660 1.00 41.60 C ANISOU 520 CB SER A 516 5364 5328 5115 835 656 -1160 C ATOM 521 OG SER A 516 6.382 23.300 23.054 1.00 49.83 O ANISOU 521 OG SER A 516 6501 6420 6012 931 722 -1259 O ATOM 0 H SER A 516 6.636 23.448 19.280 1.00 38.44 H new ATOM 0 HA SER A 516 4.655 23.625 20.936 1.00 38.70 H new ATOM 0 HB2 SER A 516 6.375 22.167 21.452 1.00 41.60 H new ATOM 0 HB3 SER A 516 7.436 23.308 21.399 1.00 41.60 H new ATOM 0 HG SER A 516 5.721 22.863 23.333 1.00 49.83 H new ATOM 522 N GLU A 517 4.627 25.693 22.282 1.00 41.29 N ANISOU 522 N GLU A 517 5265 5124 5298 940 820 -1319 N ATOM 523 CA GLU A 517 4.529 26.990 22.953 1.00 42.65 C ANISOU 523 CA GLU A 517 5465 5239 5502 999 839 -1472 C ATOM 524 C GLU A 517 5.725 27.179 23.895 1.00 45.71 C ANISOU 524 C GLU A 517 5963 5677 5727 1034 752 -1624 C ATOM 525 O GLU A 517 6.068 28.304 24.216 1.00 45.00 O ANISOU 525 O GLU A 517 5891 5525 5683 1056 708 -1769 O ATOM 526 CB GLU A 517 3.198 27.111 23.711 1.00 45.33 C ANISOU 526 CB GLU A 517 5809 5580 5832 1089 1009 -1472 C ATOM 527 CG GLU A 517 2.047 27.505 22.802 1.00 57.44 C ANISOU 527 CG GLU A 517 7215 7021 7587 1062 1070 -1376 C ATOM 528 CD GLU A 517 0.821 28.039 23.514 1.00 86.73 C ANISOU 528 CD GLU A 517 10912 10700 11340 1152 1228 -1410 C ATOM 529 OE1 GLU A 517 0.869 29.196 23.995 1.00 82.92 O ANISOU 529 OE1 GLU A 517 10456 10158 10893 1202 1233 -1553 O ATOM 530 OE2 GLU A 517 -0.201 27.315 23.557 1.00 84.39 O ANISOU 530 OE2 GLU A 517 10574 10432 11059 1173 1348 -1295 O ATOM 0 H GLU A 517 4.014 25.139 22.521 1.00 41.29 H new ATOM 0 HA GLU A 517 4.549 27.694 22.286 1.00 42.65 H new ATOM 0 HB2 GLU A 517 2.994 26.264 24.138 1.00 45.33 H new ATOM 0 HB3 GLU A 517 3.290 27.770 24.417 1.00 45.33 H new ATOM 0 HG2 GLU A 517 2.361 28.179 22.179 1.00 57.44 H new ATOM 0 HG3 GLU A 517 1.788 26.731 22.277 1.00 57.44 H new ATOM 531 N GLN A 518 6.374 26.073 24.303 1.00 43.13 N ANISOU 531 N GLN A 518 5707 5457 5222 1037 719 -1590 N ATOM 532 CA GLN A 518 7.568 26.105 25.144 1.00 44.39 C ANISOU 532 CA GLN A 518 5969 5674 5223 1067 618 -1720 C ATOM 533 C GLN A 518 8.859 26.312 24.336 1.00 46.79 C ANISOU 533 C GLN A 518 6228 5939 5609 976 451 -1741 C ATOM 534 O GLN A 518 9.914 26.542 24.924 1.00 47.59 O ANISOU 534 O GLN A 518 6391 6064 5625 990 344 -1863 O ATOM 535 CB GLN A 518 7.636 24.872 26.045 1.00 46.89 C ANISOU 535 CB GLN A 518 6386 6123 5308 1126 665 -1674 C ATOM 536 CG GLN A 518 6.794 25.055 27.327 1.00 71.10 C ANISOU 536 CG GLN A 518 9542 9233 8237 1247 805 -1740 C ATOM 537 CD GLN A 518 6.210 23.742 27.793 1.00 98.07 C ANISOU 537 CD GLN A 518 13003 12749 11511 1289 925 -1603 C ATOM 538 OE1 GLN A 518 5.359 23.134 27.123 1.00 94.97 O ANISOU 538 OE1 GLN A 518 12526 12337 11222 1251 1014 -1449 O ATOM 539 NE2 GLN A 518 6.663 23.266 28.948 1.00 88.88 N ANISOU 539 NE2 GLN A 518 11970 11689 10111 1370 926 -1653 N ATOM 0 H GLN A 518 6.123 25.278 24.092 1.00 43.13 H new ATOM 0 HA GLN A 518 7.493 26.883 25.718 1.00 44.39 H new ATOM 0 HB2 GLN A 518 7.319 24.096 25.557 1.00 46.89 H new ATOM 0 HB3 GLN A 518 8.559 24.697 26.286 1.00 46.89 H new ATOM 0 HG2 GLN A 518 7.347 25.432 28.029 1.00 71.10 H new ATOM 0 HG3 GLN A 518 6.078 25.688 27.159 1.00 71.10 H new ATOM 0 HE21 GLN A 518 7.253 23.706 29.393 1.00 88.88 H new ATOM 0 HE22 GLN A 518 6.367 22.517 29.250 1.00 88.88 H new ATOM 540 N ASN A 519 8.767 26.290 22.988 1.00 40.88 N ANISOU 540 N ASN A 519 5372 5127 5034 886 428 -1626 N ATOM 541 CA ASN A 519 9.913 26.546 22.114 1.00 39.19 C ANISOU 541 CA ASN A 519 5106 4866 4918 800 292 -1630 C ATOM 542 C ASN A 519 10.094 28.065 22.041 1.00 42.67 C ANISOU 542 C ASN A 519 5511 5191 5512 793 248 -1755 C ATOM 543 O ASN A 519 9.514 28.730 21.188 1.00 40.75 O ANISOU 543 O ASN A 519 5184 4854 5446 758 278 -1704 O ATOM 544 CB ASN A 519 9.714 25.918 20.723 1.00 36.41 C ANISOU 544 CB ASN A 519 4666 4497 4672 717 294 -1458 C ATOM 545 CG ASN A 519 10.940 26.036 19.861 1.00 50.17 C ANISOU 545 CG ASN A 519 6364 6207 6490 636 172 -1451 C ATOM 546 OD1 ASN A 519 12.052 26.292 20.343 1.00 41.15 O ANISOU 546 OD1 ASN A 519 5256 5074 5305 637 78 -1558 O ATOM 547 ND2 ASN A 519 10.756 25.918 18.559 1.00 38.80 N ANISOU 547 ND2 ASN A 519 4845 4724 5173 567 169 -1328 N ATOM 0 H ASN A 519 8.036 26.126 22.566 1.00 40.88 H new ATOM 0 HA ASN A 519 10.715 26.133 22.472 1.00 39.19 H new ATOM 0 HB2 ASN A 519 9.481 24.982 20.824 1.00 36.41 H new ATOM 0 HB3 ASN A 519 8.967 26.350 20.280 1.00 36.41 H new ATOM 0 HD21 ASN A 519 11.419 26.019 18.020 1.00 38.80 H new ATOM 0 HD22 ASN A 519 9.974 25.740 18.250 1.00 38.80 H new ATOM 548 N LEU A 520 10.866 28.609 22.974 1.00 42.82 N ANISOU 548 N LEU A 520 5594 5214 5460 832 174 -1922 N ATOM 549 CA LEU A 520 11.049 30.054 23.107 1.00 46.15 C ANISOU 549 CA LEU A 520 5994 5522 6019 837 130 -2067 C ATOM 550 C LEU A 520 12.470 30.506 22.898 1.00 53.70 C ANISOU 550 C LEU A 520 6926 6434 7045 779 -24 -2151 C ATOM 551 O LEU A 520 13.402 29.725 23.069 1.00 54.34 O ANISOU 551 O LEU A 520 7039 6593 7014 763 -103 -2145 O ATOM 552 CB LEU A 520 10.595 30.512 24.513 1.00 48.24 C ANISOU 552 CB LEU A 520 6359 5812 6159 947 181 -2225 C ATOM 553 CG LEU A 520 9.168 30.170 24.919 1.00 53.91 C ANISOU 553 CG LEU A 520 7105 6571 6808 1021 351 -2162 C ATOM 554 CD1 LEU A 520 9.063 30.004 26.425 1.00 56.11 C ANISOU 554 CD1 LEU A 520 7519 6940 6859 1135 393 -2286 C ATOM 555 CD2 LEU A 520 8.187 31.197 24.403 1.00 55.07 C ANISOU 555 CD2 LEU A 520 7169 6595 7159 1019 428 -2155 C ATOM 0 H LEU A 520 11.303 28.148 23.554 1.00 42.82 H new ATOM 0 HA LEU A 520 10.509 30.457 22.409 1.00 46.15 H new ATOM 0 HB2 LEU A 520 11.197 30.123 25.167 1.00 48.24 H new ATOM 0 HB3 LEU A 520 10.702 31.475 24.567 1.00 48.24 H new ATOM 0 HG LEU A 520 8.934 29.322 24.510 1.00 53.91 H new ATOM 0 HD11 LEU A 520 8.148 29.787 26.664 1.00 56.11 H new ATOM 0 HD12 LEU A 520 9.651 29.288 26.714 1.00 56.11 H new ATOM 0 HD13 LEU A 520 9.323 30.831 26.861 1.00 56.11 H new ATOM 0 HD21 LEU A 520 7.289 30.953 24.677 1.00 55.07 H new ATOM 0 HD22 LEU A 520 8.410 32.068 24.766 1.00 55.07 H new ATOM 0 HD23 LEU A 520 8.232 31.230 23.435 1.00 55.07 H new ATOM 556 N TYR A 521 12.636 31.784 22.575 1.00 52.11 N ANISOU 556 N TYR A 521 6664 6101 7036 750 -64 -2231 N ATOM 557 CA TYR A 521 13.954 32.389 22.427 1.00 52.85 C ANISOU 557 CA TYR A 521 6721 6128 7232 695 -205 -2325 C ATOM 558 C TYR A 521 14.062 33.719 23.234 1.00 62.43 C ANISOU 558 C TYR A 521 7956 7244 8521 738 -250 -2535 C ATOM 559 O TYR A 521 13.069 34.445 23.349 1.00 60.01 O ANISOU 559 O TYR A 521 7644 6869 8286 779 -163 -2565 O ATOM 560 CB TYR A 521 14.327 32.544 20.944 1.00 51.62 C ANISOU 560 CB TYR A 521 6446 5892 7273 590 -227 -2185 C ATOM 561 CG TYR A 521 13.575 33.619 20.192 1.00 52.25 C ANISOU 561 CG TYR A 521 6448 5837 7569 569 -169 -2147 C ATOM 562 CD1 TYR A 521 12.362 33.345 19.572 1.00 53.31 C ANISOU 562 CD1 TYR A 521 6557 5977 7724 576 -56 -2005 C ATOM 563 CD2 TYR A 521 14.108 34.896 20.045 1.00 53.75 C ANISOU 563 CD2 TYR A 521 6581 5887 7956 536 -234 -2245 C ATOM 564 CE1 TYR A 521 11.675 34.329 18.857 1.00 54.09 C ANISOU 564 CE1 TYR A 521 6580 5950 8023 560 -11 -1962 C ATOM 565 CE2 TYR A 521 13.436 35.885 19.328 1.00 54.36 C ANISOU 565 CE2 TYR A 521 6584 5833 8238 518 -182 -2198 C ATOM 566 CZ TYR A 521 12.216 35.601 18.743 1.00 60.83 C ANISOU 566 CZ TYR A 521 7384 6666 9064 533 -71 -2056 C ATOM 567 OH TYR A 521 11.557 36.588 18.045 1.00 64.62 O ANISOU 567 OH TYR A 521 7790 7016 9748 520 -28 -2007 O ATOM 0 H TYR A 521 11.984 32.327 22.435 1.00 52.11 H new ATOM 0 HA TYR A 521 14.613 31.790 22.812 1.00 52.85 H new ATOM 0 HB2 TYR A 521 15.276 32.733 20.884 1.00 51.62 H new ATOM 0 HB3 TYR A 521 14.178 31.695 20.499 1.00 51.62 H new ATOM 0 HD1 TYR A 521 12.001 32.490 19.634 1.00 53.31 H new ATOM 0 HD2 TYR A 521 14.930 35.094 20.433 1.00 53.75 H new ATOM 0 HE1 TYR A 521 10.858 34.132 18.459 1.00 54.09 H new ATOM 0 HE2 TYR A 521 13.807 36.733 19.243 1.00 54.36 H new ATOM 0 HH TYR A 521 12.008 37.296 18.067 1.00 64.62 H new ATOM 568 N PRO A 522 15.245 34.063 23.803 1.00 65.50 N ANISOU 568 N PRO A 522 8364 7618 8904 731 -390 -2687 N ATOM 569 CA PRO A 522 15.353 35.331 24.549 1.00 67.88 C ANISOU 569 CA PRO A 522 8687 7818 9287 770 -444 -2899 C ATOM 570 C PRO A 522 15.430 36.549 23.625 1.00 74.18 C ANISOU 570 C PRO A 522 9364 8435 10387 699 -458 -2893 C ATOM 571 O PRO A 522 16.185 36.536 22.643 1.00 72.25 O ANISOU 571 O PRO A 522 9025 8141 10287 605 -512 -2796 O ATOM 572 CB PRO A 522 16.634 35.153 25.381 1.00 70.50 C ANISOU 572 CB PRO A 522 9071 8201 9514 780 -604 -3049 C ATOM 573 CG PRO A 522 17.092 33.722 25.146 1.00 73.28 C ANISOU 573 CG PRO A 522 9439 8693 9710 757 -616 -2905 C ATOM 574 CD PRO A 522 16.530 33.337 23.818 1.00 66.83 C ANISOU 574 CD PRO A 522 8535 7857 9002 690 -512 -2683 C ATOM 0 HA PRO A 522 14.572 35.504 25.097 1.00 67.88 H new ATOM 0 HB2 PRO A 522 17.317 35.785 25.107 1.00 70.50 H new ATOM 0 HB3 PRO A 522 16.461 35.312 26.322 1.00 70.50 H new ATOM 0 HG2 PRO A 522 18.060 33.660 25.147 1.00 73.28 H new ATOM 0 HG3 PRO A 522 16.770 33.133 25.846 1.00 73.28 H new ATOM 0 HD2 PRO A 522 17.108 33.608 23.087 1.00 66.83 H new ATOM 0 HD3 PRO A 522 16.406 32.378 23.741 1.00 66.83 H new ATOM 575 N VAL A 523 14.607 37.583 23.925 1.00 74.61 N ANISOU 575 N VAL A 523 9423 8389 10538 747 -397 -2987 N ATOM 576 CA VAL A 523 14.528 38.860 23.194 1.00 76.31 C ANISOU 576 CA VAL A 523 9533 8418 11044 696 -399 -2995 C ATOM 577 C VAL A 523 14.825 40.038 24.157 1.00 84.13 C ANISOU 577 C VAL A 523 10556 9303 12108 742 -476 -3249 C ATOM 578 O VAL A 523 14.451 39.985 25.337 1.00 84.74 O ANISOU 578 O VAL A 523 10747 9447 12005 840 -460 -3398 O ATOM 579 CB VAL A 523 13.186 39.092 22.428 1.00 80.20 C ANISOU 579 CB VAL A 523 9975 8860 11639 704 -251 -2846 C ATOM 580 CG1 VAL A 523 13.415 39.888 21.144 1.00 79.89 C ANISOU 580 CG1 VAL A 523 9805 8668 11884 613 -266 -2738 C ATOM 581 CG2 VAL A 523 12.453 37.788 22.123 1.00 78.32 C ANISOU 581 CG2 VAL A 523 9764 8768 11226 718 -151 -2663 C ATOM 0 H VAL A 523 14.061 37.550 24.588 1.00 74.61 H new ATOM 0 HA VAL A 523 15.206 38.814 22.502 1.00 76.31 H new ATOM 0 HB VAL A 523 12.618 39.610 23.019 1.00 80.20 H new ATOM 0 HG11 VAL A 523 12.569 40.018 20.688 1.00 79.89 H new ATOM 0 HG12 VAL A 523 13.800 40.751 21.362 1.00 79.89 H new ATOM 0 HG13 VAL A 523 14.022 39.401 20.565 1.00 79.89 H new ATOM 0 HG21 VAL A 523 11.630 37.983 21.649 1.00 78.32 H new ATOM 0 HG22 VAL A 523 13.016 37.221 21.573 1.00 78.32 H new ATOM 0 HG23 VAL A 523 12.247 37.330 22.953 1.00 78.32 H new ATOM 582 N GLU A 524 15.503 41.094 23.645 1.00 82.08 N ANISOU 582 N GLU A 524 10198 8876 12113 671 -558 -3299 N ATOM 583 CA GLU A 524 15.866 42.296 24.404 1.00120.81 C ANISOU 583 CA GLU A 524 15112 13650 17139 697 -647 -3539 C ATOM 584 C GLU A 524 16.008 43.518 23.498 1.00156.03 C ANISOU 584 C GLU A 524 19440 17898 21945 622 -657 -3511 C ATOM 585 O GLU A 524 16.637 43.440 22.444 1.00119.33 O ANISOU 585 O GLU A 524 14690 13207 17445 525 -682 -3361 O ATOM 586 CB GLU A 524 17.150 42.073 25.222 1.00123.15 C ANISOU 586 CB GLU A 524 15454 13997 17339 692 -818 -3706 C ATOM 0 H GLU A 524 15.766 41.121 22.827 1.00 82.08 H new ATOM 0 HA GLU A 524 15.139 42.472 25.022 1.00120.81 H new ATOM 587 N GLU A 529 14.286 43.001 27.360 1.00102.08 N ANISOU 587 N GLU A 529 13029 11348 14411 983 -561 -3995 N ATOM 588 CA GLU A 529 14.647 42.431 28.655 1.00102.74 C ANISOU 588 CA GLU A 529 13260 11576 14202 1068 -628 -4155 C ATOM 589 C GLU A 529 13.587 41.435 29.148 1.00105.27 C ANISOU 589 C GLU A 529 13688 12071 14241 1163 -471 -4063 C ATOM 590 O GLU A 529 12.400 41.774 29.190 1.00105.46 O ANISOU 590 O GLU A 529 13721 12063 14286 1225 -319 -4042 O ATOM 591 CB GLU A 529 14.866 43.549 29.691 1.00106.74 C ANISOU 591 CB GLU A 529 13832 11984 14741 1136 -717 -4455 C ATOM 0 HA GLU A 529 15.477 41.942 28.543 1.00102.74 H new ATOM 592 N ARG A 530 14.026 40.194 29.490 1.00 99.47 N ANISOU 592 N ARG A 530 13023 11512 13259 1173 -504 -3996 N ATOM 593 CA ARG A 530 13.246 39.055 30.022 1.00 97.72 C ANISOU 593 CA ARG A 530 12907 11471 12750 1256 -376 -3898 C ATOM 594 C ARG A 530 12.115 38.534 29.101 1.00 97.45 C ANISOU 594 C ARG A 530 12803 11453 12769 1233 -194 -3653 C ATOM 595 O ARG A 530 11.678 37.391 29.290 1.00 96.60 O ANISOU 595 O ARG A 530 12754 11493 12458 1270 -106 -3528 O ATOM 596 CB ARG A 530 12.698 39.344 31.430 1.00100.41 C ANISOU 596 CB ARG A 530 13405 11868 12879 1401 -327 -4097 C ATOM 0 H ARG A 530 14.857 39.988 29.407 1.00 99.47 H new ATOM 0 HA ARG A 530 13.894 38.335 30.067 1.00 97.72 H new ATOM 597 N THR A 531 11.658 39.341 28.112 1.00 90.54 N ANISOU 597 N THR A 531 11803 10426 12170 1175 -145 -3581 N ATOM 598 CA THR A 531 10.602 38.973 27.164 1.00 87.04 C ANISOU 598 CA THR A 531 11282 9980 11809 1150 4 -3358 C ATOM 599 C THR A 531 11.018 37.793 26.264 1.00 85.32 C ANISOU 599 C THR A 531 11014 9854 11552 1063 -18 -3141 C ATOM 600 O THR A 531 11.816 37.960 25.337 1.00 84.47 O ANISOU 600 O THR A 531 10813 9678 11605 962 -112 -3077 O ATOM 601 CB THR A 531 10.135 40.198 26.370 1.00 92.31 C ANISOU 601 CB THR A 531 11834 10458 12781 1113 35 -3348 C ATOM 0 H THR A 531 11.968 40.132 27.981 1.00 90.54 H new ATOM 0 HA THR A 531 9.838 38.656 27.671 1.00 87.04 H new ATOM 602 N ALA A 532 10.503 36.591 26.579 1.00 77.04 N ANISOU 602 N ALA A 532 10030 8958 10285 1107 72 -3035 N ATOM 603 CA ALA A 532 10.760 35.376 25.814 1.00 72.40 C ANISOU 603 CA ALA A 532 9406 8463 9640 1039 66 -2835 C ATOM 604 C ALA A 532 9.818 35.398 24.618 1.00 69.99 C ANISOU 604 C ALA A 532 8990 8095 9508 990 168 -2646 C ATOM 605 O ALA A 532 8.621 35.653 24.780 1.00 70.59 O ANISOU 605 O ALA A 532 9063 8148 9610 1049 298 -2628 O ATOM 606 CB ALA A 532 10.498 34.144 26.672 1.00 72.98 C ANISOU 606 CB ALA A 532 9592 8708 9427 1112 129 -2802 C ATOM 0 H ALA A 532 9.987 36.467 27.256 1.00 77.04 H new ATOM 0 HA ALA A 532 11.685 35.339 25.525 1.00 72.40 H new ATOM 0 HB1 ALA A 532 10.672 33.344 26.152 1.00 72.98 H new ATOM 0 HB2 ALA A 532 11.081 34.159 27.447 1.00 72.98 H new ATOM 0 HB3 ALA A 532 9.573 34.144 26.964 1.00 72.98 H new ATOM 607 N GLY A 533 10.377 35.205 23.432 1.00 60.54 N ANISOU 607 N GLY A 533 7702 6864 8438 886 104 -2514 N ATOM 608 CA GLY A 533 9.619 35.195 22.189 1.00 57.11 C ANISOU 608 CA GLY A 533 7164 6374 8162 834 174 -2329 C ATOM 609 C GLY A 533 9.316 33.788 21.716 1.00 53.82 C ANISOU 609 C GLY A 533 6748 6078 7622 811 222 -2147 C ATOM 610 O GLY A 533 10.011 32.845 22.090 1.00 52.09 O ANISOU 610 O GLY A 533 6589 5970 7234 808 174 -2145 O ATOM 0 H GLY A 533 11.220 35.074 23.324 1.00 60.54 H new ATOM 0 HA2 GLY A 533 8.788 35.678 22.315 1.00 57.11 H new ATOM 0 HA3 GLY A 533 10.119 35.665 21.503 1.00 57.11 H new ATOM 611 N SER A 534 8.285 33.643 20.883 1.00 47.32 N ANISOU 611 N SER A 534 5856 5230 6894 795 308 -1995 N ATOM 612 CA SER A 534 7.886 32.356 20.321 1.00 44.09 C ANISOU 612 CA SER A 534 5434 4917 6401 769 352 -1820 C ATOM 613 C SER A 534 8.783 32.004 19.138 1.00 44.32 C ANISOU 613 C SER A 534 5408 4939 6493 670 258 -1711 C ATOM 614 O SER A 534 8.700 32.655 18.101 1.00 43.80 O ANISOU 614 O SER A 534 5260 4776 6607 618 240 -1642 O ATOM 615 CB SER A 534 6.428 32.393 19.876 1.00 45.00 C ANISOU 615 CB SER A 534 5489 4999 6611 791 468 -1710 C ATOM 616 OG SER A 534 6.150 31.277 19.039 1.00 48.82 O ANISOU 616 OG SER A 534 5938 5547 7065 744 480 -1535 O ATOM 0 H SER A 534 7.792 34.299 20.626 1.00 47.32 H new ATOM 0 HA SER A 534 7.982 31.677 21.007 1.00 44.09 H new ATOM 0 HB2 SER A 534 5.844 32.380 20.651 1.00 45.00 H new ATOM 0 HB3 SER A 534 6.248 33.218 19.399 1.00 45.00 H new ATOM 0 HG SER A 534 6.503 30.588 19.364 1.00 48.82 H new ATOM 617 N ARG A 535 9.610 30.961 19.265 1.00 39.13 N ANISOU 617 N ARG A 535 4797 4385 5687 647 206 -1688 N ATOM 618 CA ARG A 535 10.463 30.536 18.148 1.00 37.65 C ANISOU 618 CA ARG A 535 4559 4198 5548 559 130 -1583 C ATOM 619 C ARG A 535 9.639 30.108 16.919 1.00 40.24 C ANISOU 619 C ARG A 535 4822 4517 5952 520 180 -1401 C ATOM 620 O ARG A 535 10.040 30.405 15.796 1.00 39.57 O ANISOU 620 O ARG A 535 4674 4373 5987 454 134 -1323 O ATOM 621 CB ARG A 535 11.437 29.444 18.597 1.00 38.98 C ANISOU 621 CB ARG A 535 4790 4481 5541 554 71 -1595 C ATOM 622 CG ARG A 535 12.777 29.485 17.890 1.00 46.22 C ANISOU 622 CG ARG A 535 5666 5373 6521 478 -35 -1582 C ATOM 623 CD ARG A 535 13.782 28.677 18.677 1.00 56.32 C ANISOU 623 CD ARG A 535 7011 6751 7636 494 -103 -1646 C ATOM 624 NE ARG A 535 15.132 28.767 18.122 1.00 73.61 N ANISOU 624 NE ARG A 535 9155 8912 9900 427 -206 -1652 N ATOM 625 CZ ARG A 535 16.221 28.276 18.709 1.00 90.77 C ANISOU 625 CZ ARG A 535 11363 11145 11978 431 -292 -1721 C ATOM 626 NH1 ARG A 535 17.405 28.381 18.117 1.00 78.02 N ANISOU 626 NH1 ARG A 535 9690 9497 10458 367 -374 -1714 N ATOM 627 NH2 ARG A 535 16.133 27.669 19.888 1.00 76.24 N ANISOU 627 NH2 ARG A 535 9616 9402 9949 501 -293 -1789 N ATOM 0 H ARG A 535 9.692 30.491 19.980 1.00 39.13 H new ATOM 0 HA ARG A 535 10.987 31.303 17.868 1.00 37.65 H new ATOM 0 HB2 ARG A 535 11.583 29.527 19.552 1.00 38.98 H new ATOM 0 HB3 ARG A 535 11.029 28.577 18.446 1.00 38.98 H new ATOM 0 HG2 ARG A 535 12.692 29.128 16.992 1.00 46.22 H new ATOM 0 HG3 ARG A 535 13.081 30.402 17.803 1.00 46.22 H new ATOM 0 HD2 ARG A 535 13.792 28.986 19.596 1.00 56.32 H new ATOM 0 HD3 ARG A 535 13.504 27.748 18.693 1.00 56.32 H new ATOM 0 HE ARG A 535 15.229 29.164 17.365 1.00 73.61 H new ATOM 0 HH11 ARG A 535 17.470 28.767 17.351 1.00 78.02 H new ATOM 0 HH12 ARG A 535 18.107 28.063 18.499 1.00 78.02 H new ATOM 0 HH21 ARG A 535 15.369 27.592 20.276 1.00 76.24 H new ATOM 0 HH22 ARG A 535 16.840 27.353 20.263 1.00 76.24 H new ATOM 628 N TRP A 536 8.460 29.468 17.134 1.00 37.66 N ANISOU 628 N TRP A 536 4504 4240 5563 563 274 -1336 N ATOM 629 CA TRP A 536 7.568 29.034 16.048 1.00 36.43 C ANISOU 629 CA TRP A 536 4285 4076 5481 531 313 -1175 C ATOM 630 C TRP A 536 7.075 30.194 15.205 1.00 37.33 C ANISOU 630 C TRP A 536 4319 4066 5798 512 313 -1141 C ATOM 631 O TRP A 536 7.098 30.110 13.985 1.00 34.34 O ANISOU 631 O TRP A 536 3888 3661 5499 457 278 -1023 O ATOM 632 CB TRP A 536 6.406 28.187 16.568 1.00 35.59 C ANISOU 632 CB TRP A 536 4196 4037 5289 583 414 -1124 C ATOM 633 CG TRP A 536 5.568 27.571 15.477 1.00 35.90 C ANISOU 633 CG TRP A 536 4170 4076 5396 546 433 -965 C ATOM 634 CD1 TRP A 536 4.237 27.773 15.259 1.00 39.15 C ANISOU 634 CD1 TRP A 536 4521 4446 5908 572 506 -904 C ATOM 635 CD2 TRP A 536 6.005 26.636 14.469 1.00 34.26 C ANISOU 635 CD2 TRP A 536 3949 3910 5159 481 375 -854 C ATOM 636 NE1 TRP A 536 3.810 27.016 14.189 1.00 38.05 N ANISOU 636 NE1 TRP A 536 4333 4321 5804 525 485 -765 N ATOM 637 CE2 TRP A 536 4.878 26.320 13.675 1.00 37.87 C ANISOU 637 CE2 TRP A 536 4342 4349 5698 470 406 -734 C ATOM 638 CE3 TRP A 536 7.247 26.054 14.143 1.00 34.75 C ANISOU 638 CE3 TRP A 536 4044 4020 5141 434 297 -847 C ATOM 639 CZ2 TRP A 536 4.940 25.412 12.604 1.00 35.24 C ANISOU 639 CZ2 TRP A 536 3988 4047 5354 416 358 -618 C ATOM 640 CZ3 TRP A 536 7.312 25.175 13.064 1.00 34.58 C ANISOU 640 CZ3 TRP A 536 4000 4027 5112 382 262 -727 C ATOM 641 CH2 TRP A 536 6.156 24.836 12.332 1.00 34.55 C ANISOU 641 CH2 TRP A 536 3945 4010 5175 375 292 -619 C ATOM 0 H TRP A 536 8.165 29.278 17.919 1.00 37.66 H new ATOM 0 HA TRP A 536 8.101 28.470 15.466 1.00 36.43 H new ATOM 0 HB2 TRP A 536 6.758 27.481 17.132 1.00 35.59 H new ATOM 0 HB3 TRP A 536 5.838 28.740 17.127 1.00 35.59 H new ATOM 0 HD1 TRP A 536 3.696 28.340 15.760 1.00 39.15 H new ATOM 0 HE1 TRP A 536 3.004 26.984 13.891 1.00 38.05 H new ATOM 0 HE3 TRP A 536 8.008 26.253 14.639 1.00 34.75 H new ATOM 0 HZ2 TRP A 536 4.186 25.209 12.099 1.00 35.24 H new ATOM 0 HZ3 TRP A 536 8.131 24.806 12.823 1.00 34.58 H new ATOM 0 HH2 TRP A 536 6.219 24.208 11.649 1.00 34.55 H new ATOM 642 N GLU A 537 6.695 31.302 15.849 1.00 36.48 N ANISOU 642 N GLU A 537 4206 3880 5773 561 346 -1248 N ATOM 643 CA GLU A 537 6.274 32.521 15.151 1.00 37.38 C ANISOU 643 CA GLU A 537 4245 3863 6094 550 344 -1227 C ATOM 644 C GLU A 537 7.452 33.102 14.358 1.00 40.82 C ANISOU 644 C GLU A 537 4652 4233 6623 480 249 -1218 C ATOM 645 O GLU A 537 7.255 33.619 13.262 1.00 40.66 O ANISOU 645 O GLU A 537 4567 4136 6745 443 233 -1116 O ATOM 646 CB GLU A 537 5.724 33.561 16.141 1.00 39.92 C ANISOU 646 CB GLU A 537 4576 4113 6478 623 401 -1365 C ATOM 647 CG GLU A 537 4.402 33.136 16.761 1.00 53.69 C ANISOU 647 CG GLU A 537 6326 5901 8173 694 517 -1348 C ATOM 648 CD GLU A 537 3.790 34.114 17.754 1.00 80.28 C ANISOU 648 CD GLU A 537 9706 9203 11592 777 592 -1485 C ATOM 649 OE1 GLU A 537 4.065 35.332 17.645 1.00 78.00 O ANISOU 649 OE1 GLU A 537 9390 8796 11450 774 556 -1561 O ATOM 650 OE2 GLU A 537 3.026 33.662 18.638 1.00 69.05 O ANISOU 650 OE2 GLU A 537 8322 7844 10069 847 692 -1513 O ATOM 0 H GLU A 537 6.674 31.367 16.706 1.00 36.48 H new ATOM 0 HA GLU A 537 5.561 32.292 14.534 1.00 37.38 H new ATOM 0 HB2 GLU A 537 6.375 33.708 16.845 1.00 39.92 H new ATOM 0 HB3 GLU A 537 5.605 34.408 15.683 1.00 39.92 H new ATOM 0 HG2 GLU A 537 3.763 32.985 16.047 1.00 53.69 H new ATOM 0 HG3 GLU A 537 4.533 32.286 17.209 1.00 53.69 H new ATOM 651 N LEU A 538 8.668 33.008 14.904 1.00 38.32 N ANISOU 651 N LEU A 538 4384 3948 6229 464 187 -1318 N ATOM 652 CA LEU A 538 9.865 33.482 14.206 1.00 39.10 C ANISOU 652 CA LEU A 538 4449 3988 6420 396 104 -1309 C ATOM 653 C LEU A 538 10.157 32.590 12.968 1.00 42.26 C ANISOU 653 C LEU A 538 4827 4443 6788 334 82 -1142 C ATOM 654 O LEU A 538 10.480 33.113 11.897 1.00 43.36 O ANISOU 654 O LEU A 538 4912 4510 7055 285 56 -1056 O ATOM 655 CB LEU A 538 11.066 33.558 15.162 1.00 39.86 C ANISOU 655 CB LEU A 538 4594 4106 6446 397 37 -1464 C ATOM 656 CG LEU A 538 12.400 34.086 14.572 1.00 44.10 C ANISOU 656 CG LEU A 538 5085 4574 7099 326 -49 -1470 C ATOM 657 CD1 LEU A 538 12.287 35.551 14.159 1.00 45.05 C ANISOU 657 CD1 LEU A 538 5137 4532 7449 312 -50 -1489 C ATOM 658 CD2 LEU A 538 13.526 33.888 15.551 1.00 43.90 C ANISOU 658 CD2 LEU A 538 5107 4593 6982 331 -124 -1616 C ATOM 0 H LEU A 538 8.820 32.671 15.681 1.00 38.32 H new ATOM 0 HA LEU A 538 9.704 34.383 13.885 1.00 39.10 H new ATOM 0 HB2 LEU A 538 10.821 34.125 15.910 1.00 39.86 H new ATOM 0 HB3 LEU A 538 11.224 32.670 15.519 1.00 39.86 H new ATOM 0 HG LEU A 538 12.596 33.573 13.772 1.00 44.10 H new ATOM 0 HD11 LEU A 538 13.135 35.851 13.795 1.00 45.05 H new ATOM 0 HD12 LEU A 538 11.595 35.645 13.486 1.00 45.05 H new ATOM 0 HD13 LEU A 538 12.060 36.089 14.933 1.00 45.05 H new ATOM 0 HD21 LEU A 538 14.351 34.223 15.167 1.00 43.90 H new ATOM 0 HD22 LEU A 538 13.332 34.370 16.370 1.00 43.90 H new ATOM 0 HD23 LEU A 538 13.622 32.943 15.748 1.00 43.90 H new ATOM 659 N ILE A 539 9.988 31.261 13.108 1.00 36.00 N ANISOU 659 N ILE A 539 4077 3772 5827 341 98 -1093 N ATOM 660 CA ILE A 539 10.156 30.299 12.006 1.00 34.05 C ANISOU 660 CA ILE A 539 3819 3584 5534 293 81 -947 C ATOM 661 C ILE A 539 9.189 30.627 10.845 1.00 36.62 C ANISOU 661 C ILE A 539 4086 3852 5976 279 105 -813 C ATOM 662 O ILE A 539 9.617 30.687 9.689 1.00 34.32 O ANISOU 662 O ILE A 539 3766 3537 5738 231 71 -714 O ATOM 663 CB ILE A 539 10.008 28.821 12.485 1.00 35.36 C ANISOU 663 CB ILE A 539 4041 3881 5512 311 101 -928 C ATOM 664 CG1 ILE A 539 11.216 28.410 13.361 1.00 34.41 C ANISOU 664 CG1 ILE A 539 3976 3822 5276 313 53 -1032 C ATOM 665 CG2 ILE A 539 9.854 27.871 11.276 1.00 33.40 C ANISOU 665 CG2 ILE A 539 3777 3678 5237 269 92 -777 C ATOM 666 CD1 ILE A 539 10.959 27.167 14.381 1.00 29.80 C ANISOU 666 CD1 ILE A 539 3464 3358 4499 361 86 -1056 C ATOM 0 H ILE A 539 9.771 30.893 13.854 1.00 36.00 H new ATOM 0 HA ILE A 539 11.063 30.388 11.675 1.00 34.05 H new ATOM 0 HB ILE A 539 9.206 28.752 13.026 1.00 35.36 H new ATOM 0 HG12 ILE A 539 11.955 28.179 12.776 1.00 34.41 H new ATOM 0 HG13 ILE A 539 11.495 29.180 13.880 1.00 34.41 H new ATOM 0 HG21 ILE A 539 9.763 26.958 11.591 1.00 33.40 H new ATOM 0 HG22 ILE A 539 9.065 28.118 10.769 1.00 33.40 H new ATOM 0 HG23 ILE A 539 10.637 27.940 10.708 1.00 33.40 H new ATOM 0 HD11 ILE A 539 11.770 26.987 14.882 1.00 29.80 H new ATOM 0 HD12 ILE A 539 10.243 27.395 14.995 1.00 29.80 H new ATOM 0 HD13 ILE A 539 10.711 26.378 13.874 1.00 29.80 H new ATOM 667 N GLN A 540 7.901 30.862 11.176 1.00 33.88 N ANISOU 667 N GLN A 540 3722 3482 5668 328 164 -812 N ATOM 668 CA GLN A 540 6.854 31.198 10.204 1.00 34.51 C ANISOU 668 CA GLN A 540 3742 3506 5864 327 180 -693 C ATOM 669 C GLN A 540 7.205 32.460 9.424 1.00 40.38 C ANISOU 669 C GLN A 540 4436 4130 6776 300 148 -664 C ATOM 670 O GLN A 540 7.173 32.452 8.199 1.00 40.28 O ANISOU 670 O GLN A 540 4394 4099 6810 266 120 -535 O ATOM 671 CB GLN A 540 5.512 31.376 10.911 1.00 36.20 C ANISOU 671 CB GLN A 540 3938 3705 6112 391 254 -724 C ATOM 672 CG GLN A 540 4.894 30.059 11.357 1.00 43.89 C ANISOU 672 CG GLN A 540 4940 4788 6949 413 297 -697 C ATOM 673 CD GLN A 540 3.694 30.307 12.234 1.00 60.68 C ANISOU 673 CD GLN A 540 7049 6896 9112 481 387 -742 C ATOM 674 OE1 GLN A 540 3.797 30.447 13.451 1.00 60.75 O ANISOU 674 OE1 GLN A 540 7104 6923 9055 530 436 -863 O ATOM 675 NE2 GLN A 540 2.537 30.387 11.635 1.00 51.92 N ANISOU 675 NE2 GLN A 540 5871 5748 8108 491 411 -649 N ATOM 0 H GLN A 540 7.615 30.828 11.986 1.00 33.88 H new ATOM 0 HA GLN A 540 6.787 30.463 9.574 1.00 34.51 H new ATOM 0 HB2 GLN A 540 5.633 31.949 11.684 1.00 36.20 H new ATOM 0 HB3 GLN A 540 4.896 31.831 10.315 1.00 36.20 H new ATOM 0 HG2 GLN A 540 4.632 29.540 10.581 1.00 43.89 H new ATOM 0 HG3 GLN A 540 5.551 29.535 11.840 1.00 43.89 H new ATOM 0 HE21 GLN A 540 2.486 30.286 10.782 1.00 51.92 H new ATOM 0 HE22 GLN A 540 1.825 30.541 12.093 1.00 51.92 H new ATOM 676 N THR A 541 7.566 33.527 10.143 1.00 38.21 N ANISOU 676 N THR A 541 4156 3772 6591 318 152 -784 N ATOM 677 CA THR A 541 7.953 34.824 9.603 1.00 38.79 C ANISOU 677 CA THR A 541 4180 3713 6844 296 128 -776 C ATOM 678 C THR A 541 9.162 34.653 8.687 1.00 41.07 C ANISOU 678 C THR A 541 4467 4010 7128 228 76 -702 C ATOM 679 O THR A 541 9.142 35.141 7.562 1.00 41.41 O ANISOU 679 O THR A 541 4469 3990 7274 201 65 -581 O ATOM 680 CB THR A 541 8.210 35.785 10.784 1.00 45.41 C ANISOU 680 CB THR A 541 5027 4477 7752 330 137 -952 C ATOM 681 OG1 THR A 541 6.975 35.947 11.476 1.00 46.62 O ANISOU 681 OG1 THR A 541 5179 4620 7916 399 202 -1000 O ATOM 682 CG2 THR A 541 8.752 37.140 10.356 1.00 44.10 C ANISOU 682 CG2 THR A 541 4807 4161 7786 302 109 -963 C ATOM 0 H THR A 541 7.591 33.508 11.002 1.00 38.21 H new ATOM 0 HA THR A 541 7.249 35.210 9.059 1.00 38.79 H new ATOM 0 HB THR A 541 8.895 35.398 11.351 1.00 45.41 H new ATOM 0 HG1 THR A 541 6.898 35.345 12.057 1.00 46.62 H new ATOM 0 HG21 THR A 541 8.892 37.695 11.139 1.00 44.10 H new ATOM 0 HG22 THR A 541 9.595 37.019 9.891 1.00 44.10 H new ATOM 0 HG23 THR A 541 8.116 37.571 9.764 1.00 44.10 H new ATOM 683 N ALA A 542 10.191 33.949 9.161 1.00 36.05 N ANISOU 683 N ALA A 542 3874 3453 6371 207 47 -767 N ATOM 684 CA ALA A 542 11.412 33.708 8.394 1.00 35.77 C ANISOU 684 CA ALA A 542 3834 3431 6328 146 6 -708 C ATOM 685 C ALA A 542 11.161 32.893 7.101 1.00 38.10 C ANISOU 685 C ALA A 542 4131 3787 6557 121 8 -537 C ATOM 686 O ALA A 542 11.679 33.264 6.056 1.00 36.08 O ANISOU 686 O ALA A 542 3848 3486 6374 84 -3 -439 O ATOM 687 CB ALA A 542 12.453 33.008 9.270 1.00 36.27 C ANISOU 687 CB ALA A 542 3940 3574 6267 138 -27 -818 C ATOM 0 H ALA A 542 10.199 33.595 9.945 1.00 36.05 H new ATOM 0 HA ALA A 542 11.747 34.575 8.116 1.00 35.77 H new ATOM 0 HB1 ALA A 542 13.259 32.852 8.753 1.00 36.27 H new ATOM 0 HB2 ALA A 542 12.662 33.568 10.034 1.00 36.27 H new ATOM 0 HB3 ALA A 542 12.099 32.160 9.579 1.00 36.27 H new ATOM 688 N LEU A 543 10.352 31.812 7.165 1.00 35.83 N ANISOU 688 N LEU A 543 3876 3598 6139 145 23 -502 N ATOM 689 CA LEU A 543 10.146 30.941 5.999 1.00 35.62 C ANISOU 689 CA LEU A 543 3860 3635 6039 123 12 -362 C ATOM 690 C LEU A 543 9.118 31.435 5.008 1.00 40.26 C ANISOU 690 C LEU A 543 4411 4167 6718 133 14 -242 C ATOM 691 O LEU A 543 9.192 31.021 3.852 1.00 37.97 O ANISOU 691 O LEU A 543 4129 3906 6391 110 -7 -123 O ATOM 692 CB LEU A 543 9.847 29.480 6.402 1.00 34.55 C ANISOU 692 CB LEU A 543 3771 3623 5734 135 16 -371 C ATOM 693 CG LEU A 543 10.958 28.771 7.200 1.00 38.57 C ANISOU 693 CG LEU A 543 4323 4203 6128 125 2 -462 C ATOM 694 CD1 LEU A 543 10.568 27.348 7.526 1.00 37.58 C ANISOU 694 CD1 LEU A 543 4240 4187 5850 139 12 -453 C ATOM 695 CD2 LEU A 543 12.319 28.842 6.498 1.00 40.52 C ANISOU 695 CD2 LEU A 543 4564 4441 6389 76 -28 -431 C ATOM 0 H LEU A 543 9.921 31.574 7.870 1.00 35.83 H new ATOM 0 HA LEU A 543 10.998 30.971 5.537 1.00 35.62 H new ATOM 0 HB2 LEU A 543 9.033 29.467 6.929 1.00 34.55 H new ATOM 0 HB3 LEU A 543 9.672 28.968 5.597 1.00 34.55 H new ATOM 0 HG LEU A 543 11.059 29.250 8.037 1.00 38.57 H new ATOM 0 HD11 LEU A 543 11.282 26.923 8.027 1.00 37.58 H new ATOM 0 HD12 LEU A 543 9.756 27.348 8.057 1.00 37.58 H new ATOM 0 HD13 LEU A 543 10.415 26.857 6.703 1.00 37.58 H new ATOM 0 HD21 LEU A 543 12.985 28.384 7.035 1.00 40.52 H new ATOM 0 HD22 LEU A 543 12.257 28.417 5.628 1.00 40.52 H new ATOM 0 HD23 LEU A 543 12.577 29.770 6.386 1.00 40.52 H new ATOM 696 N LEU A 544 8.193 32.337 5.419 1.00 41.56 N ANISOU 696 N LEU A 544 4537 4250 7002 171 38 -272 N ATOM 697 CA LEU A 544 7.162 32.857 4.512 1.00 43.75 C ANISOU 697 CA LEU A 544 4773 4469 7382 187 33 -156 C ATOM 698 C LEU A 544 7.622 34.084 3.708 1.00 53.34 C ANISOU 698 C LEU A 544 5951 5569 8745 168 23 -88 C ATOM 699 O LEU A 544 6.955 35.116 3.653 1.00 56.81 O ANISOU 699 O LEU A 544 6345 5906 9335 194 34 -73 O ATOM 700 CB LEU A 544 5.818 33.116 5.219 1.00 43.90 C ANISOU 700 CB LEU A 544 4758 4458 7464 241 68 -198 C ATOM 701 CG LEU A 544 5.011 31.871 5.577 1.00 47.16 C ANISOU 701 CG LEU A 544 5188 4974 7757 261 83 -198 C ATOM 702 CD1 LEU A 544 3.899 32.210 6.568 1.00 47.24 C ANISOU 702 CD1 LEU A 544 5164 4950 7835 318 141 -268 C ATOM 703 CD2 LEU A 544 4.484 31.138 4.331 1.00 46.78 C ANISOU 703 CD2 LEU A 544 5135 4973 7667 244 35 -57 C ATOM 0 H LEU A 544 8.154 32.653 6.218 1.00 41.56 H new ATOM 0 HA LEU A 544 7.012 32.146 3.869 1.00 43.75 H new ATOM 0 HB2 LEU A 544 5.990 33.616 6.033 1.00 43.90 H new ATOM 0 HB3 LEU A 544 5.274 33.681 4.648 1.00 43.90 H new ATOM 0 HG LEU A 544 5.612 31.249 6.016 1.00 47.16 H new ATOM 0 HD11 LEU A 544 3.400 31.406 6.782 1.00 47.24 H new ATOM 0 HD12 LEU A 544 4.288 32.574 7.379 1.00 47.24 H new ATOM 0 HD13 LEU A 544 3.303 32.866 6.174 1.00 47.24 H new ATOM 0 HD21 LEU A 544 3.979 30.356 4.605 1.00 46.78 H new ATOM 0 HD22 LEU A 544 3.909 31.733 3.824 1.00 46.78 H new ATOM 0 HD23 LEU A 544 5.231 30.862 3.777 1.00 46.78 H new ATOM 704 N ASN A 545 8.751 33.930 3.060 1.00 51.16 N ANISOU 704 N ASN A 545 5696 5312 8430 124 6 -40 N ATOM 705 CA ASN A 545 9.368 34.905 2.177 1.00 52.20 C ANISOU 705 CA ASN A 545 5801 5351 8683 98 5 47 C ATOM 706 C ASN A 545 9.672 34.221 0.856 1.00 55.14 C ANISOU 706 C ASN A 545 6207 5791 8951 76 -13 191 C ATOM 707 O ASN A 545 9.854 33.002 0.816 1.00 52.96 O ANISOU 707 O ASN A 545 5977 5631 8514 66 -26 184 O ATOM 708 CB ASN A 545 10.643 35.456 2.804 1.00 53.60 C ANISOU 708 CB ASN A 545 5964 5473 8927 66 15 -53 C ATOM 709 CG ASN A 545 10.374 36.525 3.826 1.00 83.66 C ANISOU 709 CG ASN A 545 9733 9171 12883 91 28 -176 C ATOM 710 OD1 ASN A 545 9.627 37.482 3.587 1.00 75.28 O ANISOU 710 OD1 ASN A 545 8631 8007 11965 116 39 -134 O ATOM 711 ND2 ASN A 545 10.989 36.394 4.988 1.00 81.19 N ANISOU 711 ND2 ASN A 545 9435 8877 12538 88 22 -335 N ATOM 0 H ASN A 545 9.214 33.208 3.124 1.00 51.16 H new ATOM 0 HA ASN A 545 8.766 35.652 2.030 1.00 52.20 H new ATOM 0 HB2 ASN A 545 11.133 34.730 3.222 1.00 53.60 H new ATOM 0 HB3 ASN A 545 11.212 35.817 2.106 1.00 53.60 H new ATOM 0 HD21 ASN A 545 10.875 36.984 5.604 1.00 81.19 H new ATOM 0 HD22 ASN A 545 11.503 35.719 5.129 1.00 81.19 H new ATOM 712 N LYS A 546 9.681 34.984 -0.238 1.00 53.84 N ANISOU 712 N LYS A 546 6026 5558 8874 72 -13 325 N ATOM 713 CA LYS A 546 10.014 34.362 -1.507 1.00 53.37 C ANISOU 713 CA LYS A 546 6010 5568 8700 58 -26 459 C ATOM 714 C LYS A 546 11.521 34.259 -1.606 1.00 53.89 C ANISOU 714 C LYS A 546 6087 5645 8743 14 4 446 C ATOM 715 O LYS A 546 12.230 35.190 -1.237 1.00 53.88 O ANISOU 715 O LYS A 546 6042 5547 8882 -7 31 406 O ATOM 716 CB LYS A 546 9.327 35.026 -2.721 1.00 57.73 C ANISOU 716 CB LYS A 546 6555 6066 9314 82 -43 623 C ATOM 717 CG LYS A 546 10.021 36.216 -3.363 1.00 69.73 C ANISOU 717 CG LYS A 546 8048 7474 10973 67 -7 718 C ATOM 718 CD LYS A 546 9.455 36.420 -4.762 1.00 79.66 C ANISOU 718 CD LYS A 546 9330 8730 12208 95 -31 903 C ATOM 719 CE LYS A 546 9.936 37.683 -5.421 1.00 85.99 C ANISOU 719 CE LYS A 546 10102 9408 13162 90 9 1021 C ATOM 720 NZ LYS A 546 9.672 37.651 -6.881 1.00 95.32 N ANISOU 720 NZ LYS A 546 11334 10622 14263 117 -9 1211 N ATOM 0 H LYS A 546 9.505 35.825 -0.265 1.00 53.84 H new ATOM 0 HA LYS A 546 9.649 33.464 -1.533 1.00 53.37 H new ATOM 0 HB2 LYS A 546 9.206 34.347 -3.403 1.00 57.73 H new ATOM 0 HB3 LYS A 546 8.442 35.311 -2.444 1.00 57.73 H new ATOM 0 HG2 LYS A 546 9.886 37.013 -2.827 1.00 69.73 H new ATOM 0 HG3 LYS A 546 10.978 36.063 -3.407 1.00 69.73 H new ATOM 0 HD2 LYS A 546 9.697 35.661 -5.316 1.00 79.66 H new ATOM 0 HD3 LYS A 546 8.486 36.437 -4.713 1.00 79.66 H new ATOM 0 HE2 LYS A 546 9.492 38.449 -5.025 1.00 85.99 H new ATOM 0 HE3 LYS A 546 10.887 37.793 -5.263 1.00 85.99 H new ATOM 0 HZ1 LYS A 546 9.963 38.406 -7.252 1.00 95.32 H new ATOM 0 HZ2 LYS A 546 10.097 36.959 -7.245 1.00 95.32 H new ATOM 0 HZ3 LYS A 546 8.797 37.569 -7.023 1.00 95.32 H new ATOM 721 N PHE A 547 12.001 33.075 -1.937 1.00 48.41 N ANISOU 721 N PHE A 547 5446 5066 7881 0 -2 458 N ATOM 722 CA PHE A 547 13.429 32.846 -2.090 1.00 47.25 C ANISOU 722 CA PHE A 547 5305 4939 7708 -38 30 453 C ATOM 723 C PHE A 547 13.673 32.947 -3.586 1.00 50.18 C ANISOU 723 C PHE A 547 5705 5315 8045 -39 51 623 C ATOM 724 O PHE A 547 12.981 32.277 -4.363 1.00 51.13 O ANISOU 724 O PHE A 547 5878 5510 8039 -14 22 699 O ATOM 725 CB PHE A 547 13.839 31.450 -1.560 1.00 47.55 C ANISOU 725 CB PHE A 547 5385 5100 7583 -47 16 364 C ATOM 726 CG PHE A 547 13.363 31.050 -0.179 1.00 47.92 C ANISOU 726 CG PHE A 547 5428 5175 7605 -33 -7 216 C ATOM 727 CD1 PHE A 547 13.644 31.839 0.929 1.00 51.10 C ANISOU 727 CD1 PHE A 547 5788 5503 8126 -37 -2 99 C ATOM 728 CD2 PHE A 547 12.690 29.853 0.021 1.00 49.45 C ANISOU 728 CD2 PHE A 547 5664 5469 7654 -14 -32 193 C ATOM 729 CE1 PHE A 547 13.186 31.474 2.202 1.00 51.41 C ANISOU 729 CE1 PHE A 547 5835 5575 8124 -15 -16 -33 C ATOM 730 CE2 PHE A 547 12.269 29.471 1.304 1.00 51.54 C ANISOU 730 CE2 PHE A 547 5929 5763 7892 3 -39 69 C ATOM 731 CZ PHE A 547 12.521 30.284 2.385 1.00 49.05 C ANISOU 731 CZ PHE A 547 5580 5380 7678 6 -29 -41 C ATOM 0 H PHE A 547 11.513 32.382 -2.080 1.00 48.41 H new ATOM 0 HA PHE A 547 13.954 33.485 -1.583 1.00 47.25 H new ATOM 0 HB2 PHE A 547 13.517 30.786 -2.190 1.00 47.55 H new ATOM 0 HB3 PHE A 547 14.808 31.402 -1.567 1.00 47.55 H new ATOM 0 HD1 PHE A 547 14.141 32.618 0.825 1.00 51.10 H new ATOM 0 HD2 PHE A 547 12.516 29.297 -0.704 1.00 49.45 H new ATOM 0 HE1 PHE A 547 13.332 32.039 2.926 1.00 51.41 H new ATOM 0 HE2 PHE A 547 11.819 28.666 1.424 1.00 51.54 H new ATOM 0 HZ PHE A 547 12.243 30.030 3.235 1.00 49.05 H new ATOM 732 N THR A 548 14.581 33.827 -4.005 1.00 43.74 N ANISOU 732 N THR A 548 4856 4417 7348 -63 101 686 N ATOM 733 CA THR A 548 14.921 33.945 -5.428 1.00 43.44 C ANISOU 733 CA THR A 548 4851 4386 7270 -59 138 858 C ATOM 734 C THR A 548 16.376 33.539 -5.663 1.00 44.68 C ANISOU 734 C THR A 548 5009 4576 7392 -93 196 864 C ATOM 735 O THR A 548 16.748 33.168 -6.783 1.00 45.12 O ANISOU 735 O THR A 548 5115 4685 7344 -85 233 983 O ATOM 736 CB THR A 548 14.569 35.335 -5.982 1.00 56.34 C ANISOU 736 CB THR A 548 6447 5891 9070 -47 159 975 C ATOM 737 OG1 THR A 548 15.261 36.338 -5.231 1.00 59.82 O ANISOU 737 OG1 THR A 548 6807 6208 9716 -80 192 908 O ATOM 738 CG2 THR A 548 13.054 35.611 -5.946 1.00 56.74 C ANISOU 738 CG2 THR A 548 6499 5921 9137 -3 99 991 C ATOM 0 H THR A 548 15.011 34.363 -3.487 1.00 43.74 H new ATOM 0 HA THR A 548 14.375 33.324 -5.935 1.00 43.44 H new ATOM 0 HB THR A 548 14.846 35.360 -6.911 1.00 56.34 H new ATOM 0 HG1 THR A 548 15.070 37.097 -5.535 1.00 59.82 H new ATOM 0 HG21 THR A 548 12.877 36.495 -6.303 1.00 56.74 H new ATOM 0 HG22 THR A 548 12.591 34.948 -6.482 1.00 56.74 H new ATOM 0 HG23 THR A 548 12.738 35.564 -5.030 1.00 56.74 H new ATOM 739 N ARG A 549 17.192 33.600 -4.583 1.00 37.59 N ANISOU 739 N ARG A 549 4057 3649 6579 -129 202 730 N ATOM 740 CA ARG A 549 18.628 33.317 -4.560 1.00 35.96 C ANISOU 740 CA ARG A 549 3825 3455 6384 -165 250 711 C ATOM 741 C ARG A 549 18.980 32.444 -3.350 1.00 36.57 C ANISOU 741 C ARG A 549 3898 3600 6398 -178 206 539 C ATOM 742 O ARG A 549 18.284 32.540 -2.349 1.00 35.21 O ANISOU 742 O ARG A 549 3718 3415 6247 -166 154 427 O ATOM 743 CB ARG A 549 19.393 34.650 -4.500 1.00 35.66 C ANISOU 743 CB ARG A 549 3699 3271 6581 -200 297 737 C ATOM 744 CG ARG A 549 19.060 35.664 -5.628 1.00 39.37 C ANISOU 744 CG ARG A 549 4166 3653 7140 -186 346 918 C ATOM 745 CD ARG A 549 19.632 35.279 -6.991 1.00 47.38 C ANISOU 745 CD ARG A 549 5229 4726 8048 -178 421 1083 C ATOM 746 NE ARG A 549 21.088 35.109 -6.925 1.00 56.06 N ANISOU 746 NE ARG A 549 6278 5819 9202 -219 485 1065 N ATOM 747 CZ ARG A 549 21.724 33.968 -7.150 1.00 58.31 C ANISOU 747 CZ ARG A 549 6603 6220 9333 -219 506 1050 C ATOM 748 NH1 ARG A 549 23.039 33.903 -7.022 1.00 46.02 N ANISOU 748 NH1 ARG A 549 4985 4644 7857 -256 563 1031 N ATOM 749 NH2 ARG A 549 21.052 32.886 -7.516 1.00 49.77 N ANISOU 749 NH2 ARG A 549 5618 5267 8027 -180 470 1054 N ATOM 0 H ARG A 549 16.894 33.821 -3.807 1.00 37.59 H new ATOM 0 HA ARG A 549 18.879 32.833 -5.362 1.00 35.96 H new ATOM 0 HB2 ARG A 549 19.212 35.071 -3.645 1.00 35.66 H new ATOM 0 HB3 ARG A 549 20.344 34.461 -4.527 1.00 35.66 H new ATOM 0 HG2 ARG A 549 18.096 35.747 -5.703 1.00 39.37 H new ATOM 0 HG3 ARG A 549 19.401 36.537 -5.378 1.00 39.37 H new ATOM 0 HD2 ARG A 549 19.221 34.455 -7.296 1.00 47.38 H new ATOM 0 HD3 ARG A 549 19.413 35.964 -7.642 1.00 47.38 H new ATOM 0 HE ARG A 549 21.562 35.798 -6.726 1.00 56.06 H new ATOM 0 HH11 ARG A 549 23.484 34.602 -6.792 1.00 46.02 H new ATOM 0 HH12 ARG A 549 23.449 33.161 -7.169 1.00 46.02 H new ATOM 0 HH21 ARG A 549 20.198 32.921 -7.609 1.00 49.77 H new ATOM 0 HH22 ARG A 549 21.470 32.149 -7.661 1.00 49.77 H new ATOM 750 N PRO A 550 20.047 31.604 -3.384 1.00 32.67 N ANISOU 750 N PRO A 550 3409 3175 5830 -196 229 516 N ATOM 751 CA PRO A 550 20.330 30.740 -2.224 1.00 31.23 C ANISOU 751 CA PRO A 550 3227 3058 5579 -201 179 361 C ATOM 752 C PRO A 550 20.596 31.481 -0.899 1.00 35.90 C ANISOU 752 C PRO A 550 3752 3568 6320 -220 139 217 C ATOM 753 O PRO A 550 20.258 30.966 0.172 1.00 36.30 O ANISOU 753 O PRO A 550 3823 3668 6303 -205 85 89 O ATOM 754 CB PRO A 550 21.519 29.893 -2.682 1.00 32.53 C ANISOU 754 CB PRO A 550 3396 3290 5672 -216 221 387 C ATOM 755 CG PRO A 550 22.127 30.643 -3.816 1.00 37.89 C ANISOU 755 CG PRO A 550 4048 3905 6444 -231 302 532 C ATOM 756 CD PRO A 550 20.984 31.324 -4.497 1.00 34.10 C ANISOU 756 CD PRO A 550 3601 3385 5971 -205 303 635 C ATOM 0 HA PRO A 550 19.551 30.212 -1.991 1.00 31.23 H new ATOM 0 HB2 PRO A 550 22.158 29.769 -1.962 1.00 32.53 H new ATOM 0 HB3 PRO A 550 21.232 29.010 -2.961 1.00 32.53 H new ATOM 0 HG2 PRO A 550 22.780 31.287 -3.500 1.00 37.89 H new ATOM 0 HG3 PRO A 550 22.590 30.045 -4.423 1.00 37.89 H new ATOM 0 HD2 PRO A 550 21.266 32.139 -4.942 1.00 34.10 H new ATOM 0 HD3 PRO A 550 20.580 30.757 -5.172 1.00 34.10 H new ATOM 757 N GLN A 551 21.152 32.689 -0.969 1.00 33.12 N ANISOU 757 N GLN A 551 3325 3090 6167 -249 165 236 N ATOM 758 CA GLN A 551 21.387 33.539 0.196 1.00 33.28 C ANISOU 758 CA GLN A 551 3281 3015 6349 -267 122 97 C ATOM 759 C GLN A 551 20.105 33.780 0.971 1.00 38.12 C ANISOU 759 C GLN A 551 3925 3620 6940 -231 75 15 C ATOM 760 O GLN A 551 20.167 33.864 2.193 1.00 39.50 O ANISOU 760 O GLN A 551 4087 3784 7138 -227 23 -141 O ATOM 761 CB GLN A 551 21.963 34.895 -0.217 1.00 35.42 C ANISOU 761 CB GLN A 551 3468 3133 6857 -302 163 159 C ATOM 762 CG GLN A 551 22.525 35.722 0.959 1.00 36.46 C ANISOU 762 CG GLN A 551 3521 3158 7174 -330 112 1 C ATOM 763 CD GLN A 551 23.710 35.038 1.626 1.00 53.03 C ANISOU 763 CD GLN A 551 5590 5310 9250 -354 75 -106 C ATOM 764 OE1 GLN A 551 24.479 34.288 1.009 1.00 45.48 O ANISOU 764 OE1 GLN A 551 4633 4421 8226 -368 115 -34 O ATOM 765 NE2 GLN A 551 23.884 35.287 2.906 1.00 46.87 N ANISOU 765 NE2 GLN A 551 4786 4499 8522 -356 -5 -284 N ATOM 0 H GLN A 551 21.408 33.044 -1.709 1.00 33.12 H new ATOM 0 HA GLN A 551 22.023 33.071 0.759 1.00 33.28 H new ATOM 0 HB2 GLN A 551 22.669 34.752 -0.866 1.00 35.42 H new ATOM 0 HB3 GLN A 551 21.270 35.409 -0.660 1.00 35.42 H new ATOM 0 HG2 GLN A 551 22.797 36.596 0.637 1.00 36.46 H new ATOM 0 HG3 GLN A 551 21.825 35.866 1.615 1.00 36.46 H new ATOM 0 HE21 GLN A 551 23.341 35.810 3.320 1.00 46.87 H new ATOM 0 HE22 GLN A 551 24.541 34.927 3.329 1.00 46.87 H new ATOM 766 N ASN A 552 18.955 33.907 0.269 1.00 34.13 N ANISOU 766 N ASN A 552 3459 3118 6392 -200 92 118 N ATOM 767 CA ASN A 552 17.649 34.152 0.895 1.00 33.26 C ANISOU 767 CA ASN A 552 3370 2995 6274 -162 59 58 C ATOM 768 C ASN A 552 17.236 32.964 1.755 1.00 37.71 C ANISOU 768 C ASN A 552 3988 3681 6660 -136 21 -46 C ATOM 769 O ASN A 552 16.659 33.165 2.820 1.00 39.32 O ANISOU 769 O ASN A 552 4193 3870 6877 -112 -7 -165 O ATOM 770 CB ASN A 552 16.587 34.433 -0.150 1.00 28.42 C ANISOU 770 CB ASN A 552 2780 2367 5653 -135 79 205 C ATOM 771 CG ASN A 552 16.849 35.573 -1.099 1.00 45.73 C ANISOU 771 CG ASN A 552 4929 4442 8003 -151 122 338 C ATOM 772 OD1 ASN A 552 16.359 35.568 -2.228 1.00 46.08 O ANISOU 772 OD1 ASN A 552 5005 4503 8000 -134 143 490 O ATOM 773 ND2 ASN A 552 17.594 36.584 -0.688 1.00 37.56 N ANISOU 773 ND2 ASN A 552 3823 3286 7163 -182 135 290 N ATOM 0 H ASN A 552 18.920 33.852 -0.589 1.00 34.13 H new ATOM 0 HA ASN A 552 17.734 34.935 1.462 1.00 33.26 H new ATOM 0 HB2 ASN A 552 16.459 33.627 -0.674 1.00 28.42 H new ATOM 0 HB3 ASN A 552 15.751 34.609 0.309 1.00 28.42 H new ATOM 0 HD21 ASN A 552 17.742 37.250 -1.212 1.00 37.56 H new ATOM 0 HD22 ASN A 552 17.931 36.576 0.103 1.00 37.56 H new ATOM 774 N LEU A 553 17.566 31.736 1.313 1.00 31.83 N ANISOU 774 N LEU A 553 3289 3052 5753 -139 25 -4 N ATOM 775 CA LEU A 553 17.264 30.531 2.067 1.00 31.10 C ANISOU 775 CA LEU A 553 3247 3072 5496 -117 -6 -87 C ATOM 776 C LEU A 553 18.186 30.419 3.284 1.00 34.08 C ANISOU 776 C LEU A 553 3606 3456 5887 -128 -38 -235 C ATOM 777 O LEU A 553 17.715 30.081 4.376 1.00 30.29 O ANISOU 777 O LEU A 553 3152 3015 5342 -100 -67 -345 O ATOM 778 CB LEU A 553 17.323 29.260 1.179 1.00 30.69 C ANISOU 778 CB LEU A 553 3250 3132 5280 -115 5 3 C ATOM 779 CG LEU A 553 17.201 27.894 1.894 1.00 35.03 C ANISOU 779 CG LEU A 553 3848 3794 5668 -98 -22 -73 C ATOM 780 CD1 LEU A 553 15.863 27.794 2.698 1.00 35.52 C ANISOU 780 CD1 LEU A 553 3930 3869 5696 -61 -42 -130 C ATOM 781 CD2 LEU A 553 17.280 26.761 0.895 1.00 37.05 C ANISOU 781 CD2 LEU A 553 4153 4138 5787 -97 -11 18 C ATOM 0 H LEU A 553 17.970 31.591 0.568 1.00 31.83 H new ATOM 0 HA LEU A 553 16.351 30.599 2.386 1.00 31.10 H new ATOM 0 HB2 LEU A 553 16.613 29.320 0.521 1.00 30.69 H new ATOM 0 HB3 LEU A 553 18.162 29.271 0.693 1.00 30.69 H new ATOM 0 HG LEU A 553 17.942 27.822 2.516 1.00 35.03 H new ATOM 0 HD11 LEU A 553 15.812 26.930 3.136 1.00 35.52 H new ATOM 0 HD12 LEU A 553 15.834 28.497 3.366 1.00 35.52 H new ATOM 0 HD13 LEU A 553 15.113 27.894 2.091 1.00 35.52 H new ATOM 0 HD21 LEU A 553 17.202 25.913 1.360 1.00 37.05 H new ATOM 0 HD22 LEU A 553 16.558 26.845 0.253 1.00 37.05 H new ATOM 0 HD23 LEU A 553 18.131 26.797 0.431 1.00 37.05 H new ATOM 782 N LYS A 554 19.510 30.670 3.083 1.00 32.27 N ANISOU 782 N LYS A 554 3329 3192 5740 -166 -32 -234 N ATOM 783 CA LYS A 554 20.494 30.665 4.153 1.00 32.47 C ANISOU 783 CA LYS A 554 3325 3213 5801 -180 -76 -371 C ATOM 784 C LYS A 554 20.039 31.677 5.251 1.00 37.22 C ANISOU 784 C LYS A 554 3906 3730 6507 -164 -113 -500 C ATOM 785 O LYS A 554 19.968 31.327 6.434 1.00 36.46 O ANISOU 785 O LYS A 554 3838 3678 6335 -138 -159 -633 O ATOM 786 CB LYS A 554 21.910 31.023 3.591 1.00 34.33 C ANISOU 786 CB LYS A 554 3489 3393 6161 -228 -56 -330 C ATOM 787 CG LYS A 554 22.880 31.512 4.657 1.00 35.03 C ANISOU 787 CG LYS A 554 3519 3428 6365 -248 -116 -475 C ATOM 788 CD LYS A 554 24.320 31.710 4.171 1.00 42.08 C ANISOU 788 CD LYS A 554 4328 4272 7387 -297 -98 -438 C ATOM 789 CE LYS A 554 25.180 32.247 5.300 1.00 42.02 C ANISOU 789 CE LYS A 554 4256 4200 7509 -317 -177 -597 C ATOM 790 NZ LYS A 554 26.626 31.957 5.093 1.00 54.09 N ANISOU 790 NZ LYS A 554 5712 5728 9113 -354 -181 -588 N ATOM 0 H LYS A 554 19.842 30.847 2.310 1.00 32.27 H new ATOM 0 HA LYS A 554 20.558 29.781 4.546 1.00 32.47 H new ATOM 0 HB2 LYS A 554 22.285 30.241 3.157 1.00 34.33 H new ATOM 0 HB3 LYS A 554 21.816 31.708 2.910 1.00 34.33 H new ATOM 0 HG2 LYS A 554 22.553 32.353 5.013 1.00 35.03 H new ATOM 0 HG3 LYS A 554 22.883 30.876 5.390 1.00 35.03 H new ATOM 0 HD2 LYS A 554 24.680 30.868 3.852 1.00 42.08 H new ATOM 0 HD3 LYS A 554 24.335 32.326 3.422 1.00 42.08 H new ATOM 0 HE2 LYS A 554 25.052 33.206 5.374 1.00 42.02 H new ATOM 0 HE3 LYS A 554 24.890 31.856 6.139 1.00 42.02 H new ATOM 0 HZ1 LYS A 554 27.095 32.287 5.774 1.00 54.09 H new ATOM 0 HZ2 LYS A 554 26.749 31.077 5.047 1.00 54.09 H new ATOM 0 HZ3 LYS A 554 26.899 32.334 4.335 1.00 54.09 H new ATOM 791 N ASP A 555 19.753 32.921 4.845 1.00 34.92 N ANISOU 791 N ASP A 555 3569 3316 6384 -176 -90 -460 N ATOM 792 CA ASP A 555 19.319 33.999 5.746 1.00 35.65 C ANISOU 792 CA ASP A 555 3637 3308 6599 -160 -117 -578 C ATOM 793 C ASP A 555 18.051 33.615 6.533 1.00 39.11 C ANISOU 793 C ASP A 555 4140 3808 6912 -103 -124 -645 C ATOM 794 O ASP A 555 17.982 33.882 7.728 1.00 39.35 O ANISOU 794 O ASP A 555 4182 3825 6946 -78 -160 -796 O ATOM 795 CB ASP A 555 19.095 35.298 4.955 1.00 38.16 C ANISOU 795 CB ASP A 555 3898 3484 7117 -179 -79 -488 C ATOM 796 CG ASP A 555 20.363 36.023 4.495 1.00 51.38 C ANISOU 796 CG ASP A 555 5491 5057 8976 -235 -70 -455 C ATOM 797 OD1 ASP A 555 21.486 35.499 4.746 1.00 50.53 O ANISOU 797 OD1 ASP A 555 5362 4991 8845 -262 -95 -501 O ATOM 798 OD2 ASP A 555 20.238 37.136 3.928 1.00 59.65 O ANISOU 798 OD2 ASP A 555 6488 5976 10203 -250 -38 -383 O ATOM 0 H ASP A 555 19.807 33.166 4.022 1.00 34.92 H new ATOM 0 HA ASP A 555 20.026 34.143 6.394 1.00 35.65 H new ATOM 0 HB2 ASP A 555 18.558 35.093 4.174 1.00 38.16 H new ATOM 0 HB3 ASP A 555 18.576 35.906 5.504 1.00 38.16 H new ATOM 799 N ALA A 556 17.067 32.968 5.868 1.00 34.44 N ANISOU 799 N ALA A 556 3591 3285 6210 -80 -88 -534 N ATOM 800 CA ALA A 556 15.805 32.545 6.494 1.00 33.07 C ANISOU 800 CA ALA A 556 3466 3167 5932 -29 -82 -574 C ATOM 801 C ALA A 556 16.072 31.526 7.608 1.00 36.23 C ANISOU 801 C ALA A 556 3918 3676 6173 -7 -111 -687 C ATOM 802 O ALA A 556 15.599 31.721 8.720 1.00 36.10 O ANISOU 802 O ALA A 556 3923 3657 6135 33 -119 -805 O ATOM 803 CB ALA A 556 14.881 31.959 5.453 1.00 32.72 C ANISOU 803 CB ALA A 556 3445 3174 5815 -19 -52 -427 C ATOM 0 H ALA A 556 17.121 32.764 5.034 1.00 34.44 H new ATOM 0 HA ALA A 556 15.378 33.322 6.888 1.00 33.07 H new ATOM 0 HB1 ALA A 556 14.052 31.683 5.874 1.00 32.72 H new ATOM 0 HB2 ALA A 556 14.692 32.627 4.775 1.00 32.72 H new ATOM 0 HB3 ALA A 556 15.305 31.190 5.040 1.00 32.72 H new ATOM 804 N ILE A 557 16.909 30.506 7.337 1.00 32.55 N ANISOU 804 N ILE A 557 3470 3296 5602 -29 -125 -655 N ATOM 805 CA ILE A 557 17.277 29.449 8.291 1.00 30.95 C ANISOU 805 CA ILE A 557 3316 3198 5247 -9 -155 -742 C ATOM 806 C ILE A 557 18.003 30.002 9.517 1.00 35.17 C ANISOU 806 C ILE A 557 3841 3699 5825 -1 -208 -905 C ATOM 807 O ILE A 557 17.758 29.546 10.642 1.00 35.50 O ANISOU 807 O ILE A 557 3934 3802 5751 43 -228 -1005 O ATOM 808 CB ILE A 557 18.065 28.315 7.589 1.00 32.62 C ANISOU 808 CB ILE A 557 3539 3493 5364 -35 -157 -662 C ATOM 809 CG1 ILE A 557 17.121 27.500 6.650 1.00 32.56 C ANISOU 809 CG1 ILE A 557 3565 3543 5265 -27 -117 -533 C ATOM 810 CG2 ILE A 557 18.754 27.389 8.610 1.00 32.26 C ANISOU 810 CG2 ILE A 557 3527 3534 5195 -19 -200 -758 C ATOM 811 CD1 ILE A 557 17.861 26.523 5.619 1.00 29.81 C ANISOU 811 CD1 ILE A 557 3226 3258 4844 -55 -109 -435 C ATOM 0 H ILE A 557 17.286 30.412 6.570 1.00 32.55 H new ATOM 0 HA ILE A 557 16.455 29.058 8.627 1.00 30.95 H new ATOM 0 HB ILE A 557 18.761 28.724 7.051 1.00 32.62 H new ATOM 0 HG12 ILE A 557 16.520 26.972 7.199 1.00 32.56 H new ATOM 0 HG13 ILE A 557 16.573 28.122 6.147 1.00 32.56 H new ATOM 0 HG21 ILE A 557 19.237 26.692 8.140 1.00 32.26 H new ATOM 0 HG22 ILE A 557 19.374 27.905 9.148 1.00 32.26 H new ATOM 0 HG23 ILE A 557 18.085 26.986 9.185 1.00 32.26 H new ATOM 0 HD11 ILE A 557 17.200 26.061 5.080 1.00 29.81 H new ATOM 0 HD12 ILE A 557 18.443 27.042 5.042 1.00 29.81 H new ATOM 0 HD13 ILE A 557 18.389 25.874 6.110 1.00 29.81 H new ATOM 812 N LEU A 558 18.896 30.964 9.292 1.00 31.29 N ANISOU 812 N LEU A 558 3285 3108 5497 -40 -234 -930 N ATOM 813 CA LEU A 558 19.704 31.566 10.338 1.00 32.55 C ANISOU 813 CA LEU A 558 3423 3220 5724 -40 -301 -1088 C ATOM 814 C LEU A 558 18.962 32.518 11.258 1.00 39.31 C ANISOU 814 C LEU A 558 4293 4007 6635 0 -309 -1212 C ATOM 815 O LEU A 558 19.451 32.751 12.355 1.00 41.13 O ANISOU 815 O LEU A 558 4537 4232 6857 19 -373 -1366 O ATOM 816 CB LEU A 558 20.942 32.241 9.756 1.00 33.02 C ANISOU 816 CB LEU A 558 3396 3188 5963 -101 -325 -1070 C ATOM 817 CG LEU A 558 21.953 31.279 9.167 1.00 35.62 C ANISOU 817 CG LEU A 558 3710 3589 6236 -133 -327 -994 C ATOM 818 CD1 LEU A 558 23.120 32.054 8.566 1.00 36.14 C ANISOU 818 CD1 LEU A 558 3676 3550 6505 -193 -334 -967 C ATOM 819 CD2 LEU A 558 22.389 30.230 10.190 1.00 33.91 C ANISOU 819 CD2 LEU A 558 3543 3486 5854 -103 -388 -1091 C ATOM 0 H LEU A 558 19.049 31.288 8.510 1.00 31.29 H new ATOM 0 HA LEU A 558 19.969 30.822 10.901 1.00 32.55 H new ATOM 0 HB2 LEU A 558 20.664 32.865 9.067 1.00 33.02 H new ATOM 0 HB3 LEU A 558 21.373 32.761 10.453 1.00 33.02 H new ATOM 0 HG LEU A 558 21.536 30.782 8.446 1.00 35.62 H new ATOM 0 HD11 LEU A 558 23.763 31.432 8.191 1.00 36.14 H new ATOM 0 HD12 LEU A 558 22.793 32.641 7.867 1.00 36.14 H new ATOM 0 HD13 LEU A 558 23.548 32.583 9.257 1.00 36.14 H new ATOM 0 HD21 LEU A 558 23.035 29.631 9.784 1.00 33.91 H new ATOM 0 HD22 LEU A 558 22.793 30.671 10.954 1.00 33.91 H new ATOM 0 HD23 LEU A 558 21.616 29.722 10.482 1.00 33.91 H new ATOM 820 N LYS A 559 17.786 33.043 10.845 1.00 36.63 N ANISOU 820 N LYS A 559 3954 3619 6346 19 -249 -1150 N ATOM 821 CA LYS A 559 16.953 33.923 11.667 1.00 37.62 C ANISOU 821 CA LYS A 559 4092 3677 6524 65 -241 -1259 C ATOM 822 C LYS A 559 16.542 33.237 12.974 1.00 41.89 C ANISOU 822 C LYS A 559 4716 4321 6879 129 -250 -1377 C ATOM 823 O LYS A 559 16.503 33.891 14.008 1.00 44.13 O ANISOU 823 O LYS A 559 5020 4564 7184 166 -278 -1531 O ATOM 824 CB LYS A 559 15.712 34.404 10.894 1.00 39.72 C ANISOU 824 CB LYS A 559 4339 3887 6865 78 -171 -1146 C ATOM 825 CG LYS A 559 16.050 35.512 9.920 1.00 50.36 C ANISOU 825 CG LYS A 559 5607 5096 8430 31 -165 -1070 C ATOM 826 CD LYS A 559 14.868 35.921 9.083 1.00 54.72 C ANISOU 826 CD LYS A 559 6143 5600 9049 46 -106 -943 C ATOM 827 CE LYS A 559 15.303 36.918 8.036 1.00 59.77 C ANISOU 827 CE LYS A 559 6710 6111 9888 -1 -97 -842 C ATOM 828 NZ LYS A 559 14.157 37.380 7.215 1.00 67.45 N ANISOU 828 NZ LYS A 559 7665 7031 10929 19 -51 -714 N ATOM 0 H LYS A 559 17.455 32.889 10.066 1.00 36.63 H new ATOM 0 HA LYS A 559 17.487 34.701 11.890 1.00 37.62 H new ATOM 0 HB2 LYS A 559 15.322 33.658 10.412 1.00 39.72 H new ATOM 0 HB3 LYS A 559 15.042 34.718 11.521 1.00 39.72 H new ATOM 0 HG2 LYS A 559 16.377 36.282 10.411 1.00 50.36 H new ATOM 0 HG3 LYS A 559 16.769 35.220 9.338 1.00 50.36 H new ATOM 0 HD2 LYS A 559 14.478 35.142 8.657 1.00 54.72 H new ATOM 0 HD3 LYS A 559 14.181 36.310 9.647 1.00 54.72 H new ATOM 0 HE2 LYS A 559 15.721 37.680 8.467 1.00 59.77 H new ATOM 0 HE3 LYS A 559 15.972 36.514 7.461 1.00 59.77 H new ATOM 0 HZ1 LYS A 559 14.443 37.965 6.608 1.00 67.45 H new ATOM 0 HZ2 LYS A 559 13.787 36.683 6.803 1.00 67.45 H new ATOM 0 HZ3 LYS A 559 13.553 37.769 7.740 1.00 67.45 H new ATOM 829 N TYR A 560 16.299 31.917 12.945 1.00 34.79 N ANISOU 829 N TYR A 560 3867 3552 5798 144 -229 -1308 N ATOM 830 CA TYR A 560 15.918 31.197 14.161 1.00 33.26 C ANISOU 830 CA TYR A 560 3755 3459 5422 208 -226 -1400 C ATOM 831 C TYR A 560 17.018 30.257 14.630 1.00 35.84 C ANISOU 831 C TYR A 560 4115 3881 5622 201 -291 -1440 C ATOM 832 O TYR A 560 16.775 29.390 15.454 1.00 35.05 O ANISOU 832 O TYR A 560 4087 3884 5348 249 -285 -1474 O ATOM 833 CB TYR A 560 14.553 30.495 14.005 1.00 31.99 C ANISOU 833 CB TYR A 560 3629 3363 5164 245 -142 -1305 C ATOM 834 CG TYR A 560 14.429 29.726 12.710 1.00 29.34 C ANISOU 834 CG TYR A 560 3267 3062 4818 201 -117 -1132 C ATOM 835 CD1 TYR A 560 14.828 28.402 12.626 1.00 27.35 C ANISOU 835 CD1 TYR A 560 3050 2919 4422 193 -128 -1080 C ATOM 836 CD2 TYR A 560 13.936 30.339 11.556 1.00 29.09 C ANISOU 836 CD2 TYR A 560 3179 2951 4922 171 -89 -1022 C ATOM 837 CE1 TYR A 560 14.743 27.699 11.428 1.00 27.51 C ANISOU 837 CE1 TYR A 560 3052 2969 4431 156 -111 -934 C ATOM 838 CE2 TYR A 560 13.843 29.645 10.359 1.00 27.74 C ANISOU 838 CE2 TYR A 560 2995 2817 4729 137 -75 -872 C ATOM 839 CZ TYR A 560 14.247 28.323 10.300 1.00 29.78 C ANISOU 839 CZ TYR A 560 3291 3184 4841 129 -86 -834 C ATOM 840 OH TYR A 560 14.136 27.627 9.123 1.00 25.33 O ANISOU 840 OH TYR A 560 2721 2654 4249 99 -74 -699 O ATOM 0 H TYR A 560 16.350 31.430 12.238 1.00 34.79 H new ATOM 0 HA TYR A 560 15.806 31.854 14.866 1.00 33.26 H new ATOM 0 HB2 TYR A 560 14.420 29.888 14.750 1.00 31.99 H new ATOM 0 HB3 TYR A 560 13.847 31.158 14.050 1.00 31.99 H new ATOM 0 HD1 TYR A 560 15.158 27.976 13.384 1.00 27.35 H new ATOM 0 HD2 TYR A 560 13.665 31.228 11.591 1.00 29.09 H new ATOM 0 HE1 TYR A 560 15.019 26.812 11.387 1.00 27.51 H new ATOM 0 HE2 TYR A 560 13.511 30.066 9.599 1.00 27.74 H new ATOM 0 HH TYR A 560 14.567 26.908 9.180 1.00 25.33 H new ATOM 841 N ASN A 561 18.249 30.486 14.151 1.00 34.19 N ANISOU 841 N ASN A 561 3849 3630 5510 144 -352 -1438 N ATOM 842 CA ASN A 561 19.472 29.721 14.487 1.00 33.14 C ANISOU 842 CA ASN A 561 3724 3567 5299 131 -426 -1474 C ATOM 843 C ASN A 561 20.631 30.695 14.513 1.00 38.45 C ANISOU 843 C ASN A 561 4324 4139 6146 87 -504 -1561 C ATOM 844 O ASN A 561 21.708 30.387 13.991 1.00 38.27 O ANISOU 844 O ASN A 561 4249 4118 6175 39 -539 -1516 O ATOM 845 CB ASN A 561 19.735 28.610 13.435 1.00 25.32 C ANISOU 845 CB ASN A 561 2721 2646 4254 95 -394 -1316 C ATOM 846 CG ASN A 561 18.746 27.478 13.466 1.00 41.58 C ANISOU 846 CG ASN A 561 4847 4808 6142 133 -333 -1239 C ATOM 847 OD1 ASN A 561 18.682 26.700 14.421 1.00 33.95 O ANISOU 847 OD1 ASN A 561 3948 3932 5020 180 -349 -1293 O ATOM 848 ND2 ASN A 561 17.991 27.323 12.389 1.00 28.18 N ANISOU 848 ND2 ASN A 561 3134 3101 4473 114 -267 -1105 N ATOM 0 H ASN A 561 18.405 31.122 13.594 1.00 34.19 H new ATOM 0 HA ASN A 561 19.366 29.289 15.349 1.00 33.14 H new ATOM 0 HB2 ASN A 561 19.726 29.009 12.551 1.00 25.32 H new ATOM 0 HB3 ASN A 561 20.625 28.251 13.575 1.00 25.32 H new ATOM 0 HD21 ASN A 561 17.438 26.666 12.343 1.00 28.18 H new ATOM 0 HD22 ASN A 561 18.054 27.879 11.736 1.00 28.18 H new ATOM 849 N VAL A 562 20.403 31.885 15.124 1.00 38.02 N ANISOU 849 N VAL A 562 4262 3988 6197 105 -529 -1687 N ATOM 850 CA VAL A 562 21.332 33.027 15.216 1.00 38.74 C ANISOU 850 CA VAL A 562 4277 3953 6490 65 -603 -1788 C ATOM 851 C VAL A 562 22.684 32.620 15.818 1.00 44.63 C ANISOU 851 C VAL A 562 5010 4739 7208 52 -716 -1882 C ATOM 852 O VAL A 562 23.715 33.129 15.373 1.00 44.38 O ANISOU 852 O VAL A 562 4884 4622 7355 -8 -763 -1884 O ATOM 853 CB VAL A 562 20.712 34.276 15.931 1.00 44.12 C ANISOU 853 CB VAL A 562 4968 4529 7265 100 -611 -1928 C ATOM 854 CG1 VAL A 562 21.744 35.398 16.114 1.00 45.32 C ANISOU 854 CG1 VAL A 562 5040 4546 7632 56 -704 -2049 C ATOM 855 CG2 VAL A 562 19.509 34.822 15.161 1.00 43.77 C ANISOU 855 CG2 VAL A 562 4908 4419 7305 102 -506 -1819 C ATOM 0 H VAL A 562 19.655 32.048 15.516 1.00 38.02 H new ATOM 0 HA VAL A 562 21.500 33.308 14.303 1.00 38.74 H new ATOM 0 HB VAL A 562 20.420 33.974 16.805 1.00 44.12 H new ATOM 0 HG11 VAL A 562 21.327 36.153 16.558 1.00 45.32 H new ATOM 0 HG12 VAL A 562 22.482 35.074 16.653 1.00 45.32 H new ATOM 0 HG13 VAL A 562 22.076 35.677 15.246 1.00 45.32 H new ATOM 0 HG21 VAL A 562 19.149 35.592 15.627 1.00 43.77 H new ATOM 0 HG22 VAL A 562 19.787 35.085 14.270 1.00 43.77 H new ATOM 0 HG23 VAL A 562 18.827 34.135 15.097 1.00 43.77 H new ATOM 856 N ALA A 563 22.682 31.689 16.802 1.00 43.05 N ANISOU 856 N ALA A 563 4897 4666 6792 110 -756 -1949 N ATOM 857 CA ALA A 563 23.905 31.224 17.482 1.00 44.45 C ANISOU 857 CA ALA A 563 5073 4896 6921 111 -875 -2041 C ATOM 858 C ALA A 563 24.875 30.429 16.570 1.00 48.51 C ANISOU 858 C ALA A 563 5518 5442 7471 54 -877 -1913 C ATOM 859 O ALA A 563 26.044 30.223 16.932 1.00 50.45 O ANISOU 859 O ALA A 563 5726 5700 7742 40 -979 -1979 O ATOM 860 CB ALA A 563 23.531 30.384 18.700 1.00 45.23 C ANISOU 860 CB ALA A 563 5294 5128 6762 196 -901 -2117 C ATOM 0 H ALA A 563 21.964 31.312 17.090 1.00 43.05 H new ATOM 0 HA ALA A 563 24.385 32.023 17.750 1.00 44.45 H new ATOM 0 HB1 ALA A 563 24.338 30.080 19.144 1.00 45.23 H new ATOM 0 HB2 ALA A 563 23.007 30.921 19.315 1.00 45.23 H new ATOM 0 HB3 ALA A 563 23.010 29.616 18.416 1.00 45.23 H new ATOM 861 N TYR A 564 24.376 29.976 15.408 1.00 42.20 N ANISOU 861 N TYR A 564 4705 4659 6669 27 -768 -1736 N ATOM 862 CA TYR A 564 25.103 29.154 14.438 1.00 39.88 C ANISOU 862 CA TYR A 564 4362 4404 6387 -17 -743 -1601 C ATOM 863 C TYR A 564 25.395 29.903 13.162 1.00 43.39 C ANISOU 863 C TYR A 564 4707 4737 7041 -86 -687 -1497 C ATOM 864 O TYR A 564 25.856 29.298 12.210 1.00 42.88 O ANISOU 864 O TYR A 564 4607 4699 6987 -120 -642 -1371 O ATOM 865 CB TYR A 564 24.295 27.864 14.155 1.00 39.06 C ANISOU 865 CB TYR A 564 4338 4422 6080 16 -665 -1484 C ATOM 866 CG TYR A 564 24.077 27.064 15.419 1.00 37.93 C ANISOU 866 CG TYR A 564 4291 4389 5731 86 -713 -1571 C ATOM 867 CD1 TYR A 564 25.119 26.340 15.996 1.00 38.74 C ANISOU 867 CD1 TYR A 564 4397 4557 5765 98 -801 -1621 C ATOM 868 CD2 TYR A 564 22.856 27.097 16.085 1.00 37.66 C ANISOU 868 CD2 TYR A 564 4342 4387 5579 144 -670 -1607 C ATOM 869 CE1 TYR A 564 24.954 25.677 17.208 1.00 39.26 C ANISOU 869 CE1 TYR A 564 4557 4721 5639 169 -849 -1699 C ATOM 870 CE2 TYR A 564 22.684 26.453 17.307 1.00 38.89 C ANISOU 870 CE2 TYR A 564 4592 4640 5547 214 -706 -1688 C ATOM 871 CZ TYR A 564 23.738 25.746 17.865 1.00 48.43 C ANISOU 871 CZ TYR A 564 5808 5914 6677 227 -798 -1731 C ATOM 872 OH TYR A 564 23.564 25.061 19.038 1.00 54.05 O ANISOU 872 OH TYR A 564 6619 6727 7190 301 -832 -1794 O ATOM 0 H TYR A 564 23.571 30.149 15.158 1.00 42.20 H new ATOM 0 HA TYR A 564 25.963 28.920 14.820 1.00 39.88 H new ATOM 0 HB2 TYR A 564 23.438 28.096 13.765 1.00 39.06 H new ATOM 0 HB3 TYR A 564 24.766 27.321 13.503 1.00 39.06 H new ATOM 0 HD1 TYR A 564 25.941 26.299 15.562 1.00 38.74 H new ATOM 0 HD2 TYR A 564 22.142 27.558 15.707 1.00 37.66 H new ATOM 0 HE1 TYR A 564 25.657 25.190 17.574 1.00 39.26 H new ATOM 0 HE2 TYR A 564 21.866 26.497 17.747 1.00 38.89 H new ATOM 0 HH TYR A 564 22.786 25.191 19.326 1.00 54.05 H new ATOM 873 N SER A 565 25.147 31.219 13.137 1.00 43.69 N ANISOU 873 N SER A 565 4703 4648 7249 -105 -685 -1547 N ATOM 874 CA SER A 565 25.386 32.060 11.963 1.00 45.51 C ANISOU 874 CA SER A 565 4840 4759 7692 -167 -627 -1442 C ATOM 875 C SER A 565 26.855 32.066 11.503 1.00 51.46 C ANISOU 875 C SER A 565 5489 5472 8591 -226 -661 -1417 C ATOM 876 O SER A 565 27.116 32.217 10.311 1.00 52.43 O ANISOU 876 O SER A 565 5551 5549 8821 -271 -583 -1274 O ATOM 877 CB SER A 565 24.869 33.476 12.191 1.00 51.44 C ANISOU 877 CB SER A 565 5566 5375 8606 -170 -630 -1516 C ATOM 878 OG SER A 565 25.754 34.199 13.031 1.00 66.26 O ANISOU 878 OG SER A 565 7389 7172 10616 -185 -739 -1681 O ATOM 0 H SER A 565 24.832 31.650 13.811 1.00 43.69 H new ATOM 0 HA SER A 565 24.883 31.661 11.236 1.00 45.51 H new ATOM 0 HB2 SER A 565 24.776 33.933 11.340 1.00 51.44 H new ATOM 0 HB3 SER A 565 23.987 33.443 12.593 1.00 51.44 H new ATOM 0 HG SER A 565 25.458 34.977 13.147 1.00 66.26 H new ATOM 879 N LYS A 566 27.806 31.845 12.418 1.00 48.65 N ANISOU 879 N LYS A 566 5113 5139 8232 -221 -773 -1547 N ATOM 880 CA LYS A 566 29.221 31.794 12.033 1.00 48.78 C ANISOU 880 CA LYS A 566 5018 5118 8397 -274 -808 -1526 C ATOM 881 C LYS A 566 29.746 30.361 12.067 1.00 52.30 C ANISOU 881 C LYS A 566 5493 5701 8676 -253 -821 -1484 C ATOM 882 O LYS A 566 30.922 30.127 11.771 1.00 55.50 O ANISOU 882 O LYS A 566 5809 6094 9184 -289 -846 -1461 O ATOM 883 CB LYS A 566 30.076 32.756 12.901 1.00 52.72 C ANISOU 883 CB LYS A 566 5438 5510 9083 -297 -936 -1701 C ATOM 0 H LYS A 566 27.655 31.724 13.256 1.00 48.65 H new ATOM 0 HA LYS A 566 29.297 32.103 11.117 1.00 48.78 H new ATOM 884 N LYS A 567 28.883 29.398 12.415 1.00 43.90 N ANISOU 884 N LYS A 567 4548 4763 7370 -195 -800 -1468 N ATOM 885 CA LYS A 567 29.298 28.006 12.523 1.00 42.22 C ANISOU 885 CA LYS A 567 4371 4677 6994 -169 -814 -1431 C ATOM 886 C LYS A 567 28.777 27.138 11.390 1.00 42.40 C ANISOU 886 C LYS A 567 4430 4764 6918 -171 -693 -1258 C ATOM 887 O LYS A 567 29.411 26.129 11.061 1.00 39.93 O ANISOU 887 O LYS A 567 4106 4518 6547 -171 -684 -1197 O ATOM 888 CB LYS A 567 28.896 27.418 13.888 1.00 44.38 C ANISOU 888 CB LYS A 567 4749 5049 7065 -99 -897 -1551 C ATOM 889 CG LYS A 567 29.622 28.050 15.061 1.00 52.53 C ANISOU 889 CG LYS A 567 5754 6041 8166 -89 -1042 -1734 C ATOM 890 CD LYS A 567 28.916 27.769 16.382 1.00 62.48 C ANISOU 890 CD LYS A 567 7138 7384 9218 -10 -1100 -1852 C ATOM 0 H LYS A 567 28.053 29.537 12.592 1.00 43.90 H new ATOM 0 HA LYS A 567 30.265 28.003 12.450 1.00 42.22 H new ATOM 0 HB2 LYS A 567 27.940 27.530 14.011 1.00 44.38 H new ATOM 0 HB3 LYS A 567 29.072 26.464 13.885 1.00 44.38 H new ATOM 0 HG2 LYS A 567 30.530 27.710 15.101 1.00 52.53 H new ATOM 0 HG3 LYS A 567 29.684 29.008 14.925 1.00 52.53 H new ATOM 891 N TRP A 568 27.604 27.497 10.820 1.00 36.98 N ANISOU 891 N TRP A 568 3788 4056 6207 -168 -606 -1184 N ATOM 892 CA TRP A 568 27.001 26.705 9.756 1.00 35.19 C ANISOU 892 CA TRP A 568 3603 3888 5879 -165 -504 -1030 C ATOM 893 C TRP A 568 27.394 27.211 8.378 1.00 42.48 C ANISOU 893 C TRP A 568 4452 4737 6953 -218 -423 -903 C ATOM 894 O TRP A 568 27.103 28.345 8.008 1.00 44.56 O ANISOU 894 O TRP A 568 4678 4898 7354 -243 -394 -884 O ATOM 895 CB TRP A 568 25.484 26.662 9.881 1.00 31.76 C ANISOU 895 CB TRP A 568 3258 3483 5325 -128 -461 -1011 C ATOM 896 CG TRP A 568 24.942 25.858 11.024 1.00 31.38 C ANISOU 896 CG TRP A 568 3300 3533 5091 -69 -502 -1090 C ATOM 897 CD1 TRP A 568 25.643 25.105 11.933 1.00 34.60 C ANISOU 897 CD1 TRP A 568 3728 4012 5407 -42 -578 -1168 C ATOM 898 CD2 TRP A 568 23.554 25.699 11.351 1.00 29.34 C ANISOU 898 CD2 TRP A 568 3122 3312 4714 -27 -463 -1085 C ATOM 899 NE1 TRP A 568 24.769 24.503 12.821 1.00 32.79 N ANISOU 899 NE1 TRP A 568 3595 3863 5002 17 -583 -1208 N ATOM 900 CE2 TRP A 568 23.483 24.868 12.497 1.00 33.07 C ANISOU 900 CE2 TRP A 568 3664 3876 5024 26 -509 -1160 C ATOM 901 CE3 TRP A 568 22.365 26.249 10.835 1.00 29.30 C ANISOU 901 CE3 TRP A 568 3131 3264 4737 -25 -395 -1025 C ATOM 902 CZ2 TRP A 568 22.260 24.513 13.088 1.00 30.94 C ANISOU 902 CZ2 TRP A 568 3476 3660 4619 77 -473 -1169 C ATOM 903 CZ3 TRP A 568 21.151 25.868 11.399 1.00 30.00 C ANISOU 903 CZ3 TRP A 568 3294 3406 4698 24 -367 -1037 C ATOM 904 CH2 TRP A 568 21.107 25.003 12.505 1.00 30.52 C ANISOU 904 CH2 TRP A 568 3426 3564 4605 73 -399 -1105 C ATOM 0 H TRP A 568 27.154 28.195 11.044 1.00 36.98 H new ATOM 0 HA TRP A 568 27.345 25.804 9.856 1.00 35.19 H new ATOM 0 HB2 TRP A 568 25.158 27.572 9.965 1.00 31.76 H new ATOM 0 HB3 TRP A 568 25.119 26.305 9.056 1.00 31.76 H new ATOM 0 HD1 TRP A 568 26.568 25.013 11.950 1.00 34.60 H new ATOM 0 HE1 TRP A 568 24.993 23.985 13.470 1.00 32.79 H new ATOM 0 HE3 TRP A 568 22.390 26.856 10.130 1.00 29.30 H new ATOM 0 HZ2 TRP A 568 22.227 23.970 13.842 1.00 30.94 H new ATOM 0 HZ3 TRP A 568 20.357 26.191 11.038 1.00 30.00 H new ATOM 0 HH2 TRP A 568 20.281 24.754 12.853 1.00 30.52 H new ATOM 905 N ASP A 569 28.020 26.345 7.610 1.00 39.08 N ANISOU 905 N ASP A 569 4006 4357 6486 -228 -380 -810 N ATOM 906 CA ASP A 569 28.437 26.650 6.255 1.00 39.33 C ANISOU 906 CA ASP A 569 3980 4337 6626 -268 -288 -676 C ATOM 907 C ASP A 569 27.346 26.200 5.269 1.00 39.27 C ANISOU 907 C ASP A 569 4053 4378 6490 -250 -202 -550 C ATOM 908 O ASP A 569 26.849 25.091 5.396 1.00 36.84 O ANISOU 908 O ASP A 569 3822 4169 6005 -215 -205 -543 O ATOM 909 CB ASP A 569 29.781 25.952 5.955 1.00 41.65 C ANISOU 909 CB ASP A 569 4212 4660 6954 -283 -283 -650 C ATOM 910 CG ASP A 569 30.206 26.143 4.523 1.00 51.52 C ANISOU 910 CG ASP A 569 5415 5872 8290 -314 -170 -503 C ATOM 911 OD1 ASP A 569 30.177 27.297 4.053 1.00 54.30 O ANISOU 911 OD1 ASP A 569 5714 6120 8798 -347 -130 -460 O ATOM 912 OD2 ASP A 569 30.479 25.133 3.853 1.00 53.74 O ANISOU 912 OD2 ASP A 569 5721 6227 8472 -300 -115 -426 O ATOM 0 H ASP A 569 28.220 25.548 7.863 1.00 39.08 H new ATOM 0 HA ASP A 569 28.564 27.607 6.156 1.00 39.33 H new ATOM 0 HB2 ASP A 569 30.466 26.303 6.545 1.00 41.65 H new ATOM 0 HB3 ASP A 569 29.702 25.004 6.145 1.00 41.65 H new ATOM 913 N PHE A 570 27.032 27.042 4.259 1.00 36.08 N ANISOU 913 N PHE A 570 3627 3899 6181 -273 -130 -447 N ATOM 914 CA PHE A 570 25.975 26.806 3.263 1.00 34.10 C ANISOU 914 CA PHE A 570 3448 3682 5827 -256 -61 -327 C ATOM 915 C PHE A 570 26.476 26.626 1.819 1.00 36.12 C ANISOU 915 C PHE A 570 3689 3939 6094 -272 32 -179 C ATOM 916 O PHE A 570 25.665 26.588 0.884 1.00 33.96 O ANISOU 916 O PHE A 570 3472 3683 5750 -258 84 -74 O ATOM 917 CB PHE A 570 24.932 27.945 3.342 1.00 35.72 C ANISOU 917 CB PHE A 570 3659 3807 6107 -254 -62 -328 C ATOM 918 CG PHE A 570 24.023 27.809 4.541 1.00 36.95 C ANISOU 918 CG PHE A 570 3867 3994 6177 -219 -126 -444 C ATOM 919 CD1 PHE A 570 24.382 28.354 5.776 1.00 40.12 C ANISOU 919 CD1 PHE A 570 4236 4354 6654 -219 -199 -590 C ATOM 920 CD2 PHE A 570 22.781 27.189 4.427 1.00 35.24 C ANISOU 920 CD2 PHE A 570 3730 3845 5813 -184 -113 -409 C ATOM 921 CE1 PHE A 570 23.531 28.233 6.884 1.00 39.96 C ANISOU 921 CE1 PHE A 570 4274 4369 6541 -178 -245 -695 C ATOM 922 CE2 PHE A 570 21.928 27.086 5.529 1.00 37.34 C ANISOU 922 CE2 PHE A 570 4040 4138 6008 -148 -155 -507 C ATOM 923 CZ PHE A 570 22.313 27.591 6.752 1.00 36.78 C ANISOU 923 CZ PHE A 570 3947 4034 5993 -143 -215 -647 C ATOM 0 H PHE A 570 27.445 27.787 4.137 1.00 36.08 H new ATOM 0 HA PHE A 570 25.572 25.954 3.493 1.00 34.10 H new ATOM 0 HB2 PHE A 570 25.391 28.799 3.382 1.00 35.72 H new ATOM 0 HB3 PHE A 570 24.398 27.948 2.532 1.00 35.72 H new ATOM 0 HD1 PHE A 570 25.193 28.801 5.864 1.00 40.12 H new ATOM 0 HD2 PHE A 570 22.516 26.839 3.607 1.00 35.24 H new ATOM 0 HE1 PHE A 570 23.785 28.584 7.707 1.00 39.96 H new ATOM 0 HE2 PHE A 570 21.099 26.676 5.437 1.00 37.34 H new ATOM 0 HZ PHE A 570 21.753 27.500 7.489 1.00 36.78 H new ATOM 924 N THR A 571 27.799 26.453 1.661 1.00 34.02 N ANISOU 924 N THR A 571 3354 3665 5907 -294 52 -174 N ATOM 925 CA THR A 571 28.529 26.272 0.391 1.00 32.88 C ANISOU 925 CA THR A 571 3185 3521 5786 -307 152 -44 C ATOM 926 C THR A 571 27.912 25.237 -0.521 1.00 33.52 C ANISOU 926 C THR A 571 3367 3700 5669 -271 202 44 C ATOM 927 O THR A 571 27.709 25.543 -1.696 1.00 34.36 O ANISOU 927 O THR A 571 3495 3792 5769 -270 282 169 O ATOM 928 CB THR A 571 30.005 25.976 0.659 1.00 37.04 C ANISOU 928 CB THR A 571 3621 4042 6410 -327 149 -83 C ATOM 929 OG1 THR A 571 30.507 27.055 1.414 1.00 38.16 O ANISOU 929 OG1 THR A 571 3667 4079 6753 -363 96 -164 O ATOM 930 CG2 THR A 571 30.836 25.867 -0.618 1.00 34.98 C ANISOU 930 CG2 THR A 571 3324 3774 6194 -337 270 50 C ATOM 0 H THR A 571 28.329 26.437 2.338 1.00 34.02 H new ATOM 0 HA THR A 571 28.460 27.112 -0.089 1.00 32.88 H new ATOM 0 HB THR A 571 30.068 25.123 1.116 1.00 37.04 H new ATOM 0 HG1 THR A 571 30.336 26.932 2.227 1.00 38.16 H new ATOM 0 HG21 THR A 571 31.760 25.679 -0.388 1.00 34.98 H new ATOM 0 HG22 THR A 571 30.488 25.149 -1.170 1.00 34.98 H new ATOM 0 HG23 THR A 571 30.789 26.703 -1.108 1.00 34.98 H new ATOM 931 N ALA A 572 27.601 24.038 -0.012 1.00 27.64 N ANISOU 931 N ALA A 572 2685 3052 4764 -241 152 -18 N ATOM 932 CA ALA A 572 27.014 22.988 -0.865 1.00 26.85 C ANISOU 932 CA ALA A 572 2679 3039 4483 -209 189 53 C ATOM 933 C ALA A 572 25.635 23.389 -1.369 1.00 33.52 C ANISOU 933 C ALA A 572 3591 3877 5268 -195 192 112 C ATOM 934 O ALA A 572 25.275 23.073 -2.502 1.00 33.37 O ANISOU 934 O ALA A 572 3630 3891 5159 -179 242 210 O ATOM 935 CB ALA A 572 26.934 21.671 -0.120 1.00 25.78 C ANISOU 935 CB ALA A 572 2590 2993 4214 -182 132 -28 C ATOM 0 H ALA A 572 27.719 23.813 0.810 1.00 27.64 H new ATOM 0 HA ALA A 572 27.597 22.878 -1.633 1.00 26.85 H new ATOM 0 HB1 ALA A 572 26.546 20.995 -0.698 1.00 25.78 H new ATOM 0 HB2 ALA A 572 27.825 21.395 0.146 1.00 25.78 H new ATOM 0 HB3 ALA A 572 26.380 21.778 0.669 1.00 25.78 H new ATOM 936 N LEU A 573 24.864 24.082 -0.535 1.00 32.54 N ANISOU 936 N LEU A 573 3459 3709 5195 -199 135 49 N ATOM 937 CA LEU A 573 23.506 24.506 -0.901 1.00 33.16 C ANISOU 937 CA LEU A 573 3588 3774 5237 -184 130 98 C ATOM 938 C LEU A 573 23.563 25.623 -1.955 1.00 36.58 C ANISOU 938 C LEU A 573 3995 4129 5774 -199 193 216 C ATOM 939 O LEU A 573 22.838 25.576 -2.957 1.00 34.82 O ANISOU 939 O LEU A 573 3830 3926 5475 -180 219 316 O ATOM 940 CB LEU A 573 22.720 24.946 0.346 1.00 33.40 C ANISOU 940 CB LEU A 573 3611 3776 5302 -178 62 -7 C ATOM 941 CG LEU A 573 21.247 25.402 0.108 1.00 39.66 C ANISOU 941 CG LEU A 573 4444 4550 6076 -159 53 33 C ATOM 942 CD1 LEU A 573 20.398 24.293 -0.574 1.00 38.10 C ANISOU 942 CD1 LEU A 573 4325 4438 5711 -132 51 91 C ATOM 943 CD2 LEU A 573 20.619 25.861 1.399 1.00 42.73 C ANISOU 943 CD2 LEU A 573 4820 4909 6507 -149 2 -79 C ATOM 0 H LEU A 573 25.108 24.320 0.255 1.00 32.54 H new ATOM 0 HA LEU A 573 23.037 23.752 -1.290 1.00 33.16 H new ATOM 0 HB2 LEU A 573 22.713 24.209 0.977 1.00 33.40 H new ATOM 0 HB3 LEU A 573 23.201 25.676 0.767 1.00 33.40 H new ATOM 0 HG LEU A 573 21.267 26.154 -0.504 1.00 39.66 H new ATOM 0 HD11 LEU A 573 19.492 24.613 -0.705 1.00 38.10 H new ATOM 0 HD12 LEU A 573 20.788 24.069 -1.433 1.00 38.10 H new ATOM 0 HD13 LEU A 573 20.383 23.504 -0.010 1.00 38.10 H new ATOM 0 HD21 LEU A 573 19.705 26.140 1.233 1.00 42.73 H new ATOM 0 HD22 LEU A 573 20.623 25.131 2.038 1.00 42.73 H new ATOM 0 HD23 LEU A 573 21.125 26.607 1.758 1.00 42.73 H new ATOM 944 N ILE A 574 24.457 26.597 -1.743 1.00 34.39 N ANISOU 944 N ILE A 574 3631 3763 5675 -232 215 207 N ATOM 945 CA ILE A 574 24.688 27.710 -2.675 1.00 34.71 C ANISOU 945 CA ILE A 574 3631 3714 5843 -250 285 325 C ATOM 946 C ILE A 574 25.213 27.164 -4.022 1.00 37.35 C ANISOU 946 C ILE A 574 4001 4099 6091 -238 375 454 C ATOM 947 O ILE A 574 24.694 27.557 -5.059 1.00 38.11 O ANISOU 947 O ILE A 574 4139 4183 6157 -223 421 577 O ATOM 948 CB ILE A 574 25.635 28.781 -2.043 1.00 38.29 C ANISOU 948 CB ILE A 574 3971 4053 6524 -293 284 271 C ATOM 949 CG1 ILE A 574 24.895 29.589 -0.940 1.00 38.85 C ANISOU 949 CG1 ILE A 574 4022 4056 6682 -296 206 162 C ATOM 950 CG2 ILE A 574 26.246 29.707 -3.101 1.00 40.16 C ANISOU 950 CG2 ILE A 574 4154 4203 6903 -317 381 410 C ATOM 951 CD1 ILE A 574 25.817 30.318 0.049 1.00 40.51 C ANISOU 951 CD1 ILE A 574 4132 4176 7083 -333 165 49 C ATOM 0 H ILE A 574 24.954 26.630 -1.042 1.00 34.39 H new ATOM 0 HA ILE A 574 23.849 28.163 -2.852 1.00 34.71 H new ATOM 0 HB ILE A 574 26.373 28.308 -1.627 1.00 38.29 H new ATOM 0 HG12 ILE A 574 24.318 30.242 -1.367 1.00 38.85 H new ATOM 0 HG13 ILE A 574 24.321 28.985 -0.443 1.00 38.85 H new ATOM 0 HG21 ILE A 574 26.825 30.354 -2.669 1.00 40.16 H new ATOM 0 HG22 ILE A 574 26.763 29.182 -3.732 1.00 40.16 H new ATOM 0 HG23 ILE A 574 25.537 30.172 -3.573 1.00 40.16 H new ATOM 0 HD11 ILE A 574 25.280 30.795 0.701 1.00 40.51 H new ATOM 0 HD12 ILE A 574 26.379 29.672 0.505 1.00 40.51 H new ATOM 0 HD13 ILE A 574 26.375 30.948 -0.433 1.00 40.51 H new ATOM 952 N ASP A 575 26.215 26.269 -4.000 1.00 31.47 N ANISOU 952 N ASP A 575 3243 3412 5303 -240 398 426 N ATOM 953 CA ASP A 575 26.765 25.668 -5.214 1.00 32.52 C ANISOU 953 CA ASP A 575 3413 3598 5345 -222 490 534 C ATOM 954 C ASP A 575 25.743 24.769 -5.928 1.00 37.90 C ANISOU 954 C ASP A 575 4218 4374 5807 -177 476 574 C ATOM 955 O ASP A 575 25.765 24.711 -7.141 1.00 39.40 O ANISOU 955 O ASP A 575 4460 4588 5923 -155 548 690 O ATOM 956 CB ASP A 575 28.036 24.854 -4.921 1.00 33.91 C ANISOU 956 CB ASP A 575 3542 3812 5532 -229 513 480 C ATOM 957 CG ASP A 575 29.273 25.650 -4.540 1.00 49.52 C ANISOU 957 CG ASP A 575 5387 5696 7731 -272 544 466 C ATOM 958 OD1 ASP A 575 29.186 26.914 -4.471 1.00 51.74 O ANISOU 958 OD1 ASP A 575 5611 5874 8175 -301 551 495 O ATOM 959 OD2 ASP A 575 30.336 25.022 -4.327 1.00 51.66 O ANISOU 959 OD2 ASP A 575 5607 5994 8029 -277 561 428 O ATOM 0 H ASP A 575 26.591 25.997 -3.276 1.00 31.47 H new ATOM 0 HA ASP A 575 26.991 26.408 -5.799 1.00 32.52 H new ATOM 0 HB2 ASP A 575 27.841 24.233 -4.202 1.00 33.91 H new ATOM 0 HB3 ASP A 575 28.245 24.323 -5.706 1.00 33.91 H new ATOM 960 N PHE A 576 24.887 24.040 -5.203 1.00 33.57 N ANISOU 960 N PHE A 576 3717 3880 5158 -163 386 481 N ATOM 961 CA PHE A 576 23.878 23.203 -5.858 1.00 32.78 C ANISOU 961 CA PHE A 576 3723 3859 4874 -126 362 514 C ATOM 962 C PHE A 576 22.933 24.074 -6.679 1.00 35.16 C ANISOU 962 C PHE A 576 4060 4123 5177 -114 368 618 C ATOM 963 O PHE A 576 22.703 23.803 -7.856 1.00 34.23 O ANISOU 963 O PHE A 576 4014 4046 4945 -84 402 713 O ATOM 964 CB PHE A 576 23.056 22.406 -4.819 1.00 33.57 C ANISOU 964 CB PHE A 576 3850 4005 4901 -118 267 400 C ATOM 965 CG PHE A 576 21.909 21.605 -5.395 1.00 33.60 C ANISOU 965 CG PHE A 576 3946 4072 4746 -86 228 424 C ATOM 966 CD1 PHE A 576 22.148 20.491 -6.200 1.00 34.51 C ANISOU 966 CD1 PHE A 576 4128 4262 4721 -62 250 448 C ATOM 967 CD2 PHE A 576 20.589 21.971 -5.144 1.00 34.56 C ANISOU 967 CD2 PHE A 576 4085 4176 4871 -79 168 420 C ATOM 968 CE1 PHE A 576 21.086 19.744 -6.719 1.00 35.33 C ANISOU 968 CE1 PHE A 576 4315 4418 4691 -35 201 459 C ATOM 969 CE2 PHE A 576 19.526 21.221 -5.670 1.00 36.21 C ANISOU 969 CE2 PHE A 576 4368 4439 4953 -53 122 439 C ATOM 970 CZ PHE A 576 19.781 20.131 -6.476 1.00 33.49 C ANISOU 970 CZ PHE A 576 4089 4164 4471 -33 134 458 C ATOM 0 H PHE A 576 24.874 24.017 -4.343 1.00 33.57 H new ATOM 0 HA PHE A 576 24.340 22.577 -6.438 1.00 32.78 H new ATOM 0 HB2 PHE A 576 23.652 21.802 -4.349 1.00 33.57 H new ATOM 0 HB3 PHE A 576 22.703 23.025 -4.161 1.00 33.57 H new ATOM 0 HD1 PHE A 576 23.023 20.243 -6.394 1.00 34.51 H new ATOM 0 HD2 PHE A 576 20.410 22.720 -4.623 1.00 34.56 H new ATOM 0 HE1 PHE A 576 21.258 18.985 -7.229 1.00 35.33 H new ATOM 0 HE2 PHE A 576 18.648 21.459 -5.475 1.00 36.21 H new ATOM 0 HZ PHE A 576 19.076 19.657 -6.855 1.00 33.49 H new ATOM 971 N TRP A 577 22.408 25.123 -6.053 1.00 32.86 N ANISOU 971 N TRP A 577 3719 3752 5014 -131 333 598 N ATOM 972 CA TRP A 577 21.416 26.049 -6.614 1.00 33.89 C ANISOU 972 CA TRP A 577 3869 3833 5176 -119 323 686 C ATOM 973 C TRP A 577 22.013 26.909 -7.738 1.00 39.09 C ANISOU 973 C TRP A 577 4517 4440 5897 -120 416 831 C ATOM 974 O TRP A 577 21.436 26.984 -8.820 1.00 39.75 O ANISOU 974 O TRP A 577 4669 4545 5890 -88 430 942 O ATOM 975 CB TRP A 577 20.870 26.895 -5.452 1.00 32.82 C ANISOU 975 CB TRP A 577 3670 3619 5179 -138 268 603 C ATOM 976 CG TRP A 577 19.763 27.883 -5.719 1.00 34.02 C ANISOU 976 CG TRP A 577 3825 3706 5394 -125 245 666 C ATOM 977 CD1 TRP A 577 19.639 28.733 -6.784 1.00 37.37 C ANISOU 977 CD1 TRP A 577 4258 4080 5861 -115 290 807 C ATOM 978 CD2 TRP A 577 18.795 28.313 -4.753 1.00 33.17 C ANISOU 978 CD2 TRP A 577 3692 3558 5354 -122 182 585 C ATOM 979 NE1 TRP A 577 18.576 29.587 -6.584 1.00 36.54 N ANISOU 979 NE1 TRP A 577 4137 3908 5839 -104 247 820 N ATOM 980 CE2 TRP A 577 18.055 29.363 -5.337 1.00 37.16 C ANISOU 980 CE2 TRP A 577 4191 3989 5939 -109 185 682 C ATOM 981 CE3 TRP A 577 18.442 27.867 -3.467 1.00 33.20 C ANISOU 981 CE3 TRP A 577 3684 3584 5347 -123 127 445 C ATOM 982 CZ2 TRP A 577 16.985 29.971 -4.680 1.00 36.81 C ANISOU 982 CZ2 TRP A 577 4122 3889 5974 -98 136 637 C ATOM 983 CZ3 TRP A 577 17.396 28.487 -2.812 1.00 34.12 C ANISOU 983 CZ3 TRP A 577 3780 3649 5534 -111 87 402 C ATOM 984 CH2 TRP A 577 16.673 29.517 -3.419 1.00 35.58 C ANISOU 984 CH2 TRP A 577 3953 3758 5806 -98 92 494 C ATOM 0 H TRP A 577 22.630 25.328 -5.248 1.00 32.86 H new ATOM 0 HA TRP A 577 20.690 25.558 -7.030 1.00 33.89 H new ATOM 0 HB2 TRP A 577 20.557 26.283 -4.767 1.00 32.82 H new ATOM 0 HB3 TRP A 577 21.615 27.387 -5.073 1.00 32.82 H new ATOM 0 HD1 TRP A 577 20.191 28.734 -7.533 1.00 37.37 H new ATOM 0 HE1 TRP A 577 18.287 30.166 -7.150 1.00 36.54 H new ATOM 0 HE3 TRP A 577 18.904 27.167 -3.065 1.00 33.20 H new ATOM 0 HZ2 TRP A 577 16.501 30.657 -5.079 1.00 36.81 H new ATOM 0 HZ3 TRP A 577 17.169 28.214 -1.952 1.00 34.12 H new ATOM 0 HH2 TRP A 577 15.964 29.905 -2.960 1.00 35.58 H new ATOM 985 N ASP A 578 23.174 27.525 -7.493 1.00 35.17 N ANISOU 985 N ASP A 578 3935 3876 5553 -154 479 833 N ATOM 986 CA ASP A 578 23.847 28.393 -8.452 1.00 36.21 C ANISOU 986 CA ASP A 578 4039 3943 5774 -159 583 975 C ATOM 987 C ASP A 578 24.750 27.717 -9.478 1.00 39.88 C ANISOU 987 C ASP A 578 4544 4475 6134 -140 682 1058 C ATOM 988 O ASP A 578 24.847 28.215 -10.603 1.00 40.85 O ANISOU 988 O ASP A 578 4698 4582 6240 -120 765 1206 O ATOM 989 CB ASP A 578 24.689 29.445 -7.712 1.00 39.05 C ANISOU 989 CB ASP A 578 4273 4183 6382 -210 608 940 C ATOM 990 CG ASP A 578 23.950 30.678 -7.273 1.00 53.44 C ANISOU 990 CG ASP A 578 6053 5895 8357 -223 566 937 C ATOM 991 OD1 ASP A 578 22.728 30.745 -7.498 1.00 55.90 O ANISOU 991 OD1 ASP A 578 6428 6225 8588 -192 515 965 O ATOM 992 OD2 ASP A 578 24.605 31.599 -6.729 1.00 59.07 O ANISOU 992 OD2 ASP A 578 6665 6498 9283 -264 582 908 O ATOM 0 H ASP A 578 23.597 27.445 -6.748 1.00 35.17 H new ATOM 0 HA ASP A 578 23.113 28.777 -8.957 1.00 36.21 H new ATOM 0 HB2 ASP A 578 25.083 29.028 -6.930 1.00 39.05 H new ATOM 0 HB3 ASP A 578 25.421 29.714 -8.289 1.00 39.05 H new ATOM 993 N LYS A 579 25.468 26.647 -9.094 1.00 35.59 N ANISOU 993 N LYS A 579 3996 4000 5529 -143 683 969 N ATOM 994 CA LYS A 579 26.497 26.059 -9.963 1.00 35.73 C ANISOU 994 CA LYS A 579 4032 4067 5479 -126 791 1036 C ATOM 995 C LYS A 579 26.222 24.659 -10.521 1.00 40.27 C ANISOU 995 C LYS A 579 4720 4767 5816 -79 779 1018 C ATOM 996 O LYS A 579 26.975 24.208 -11.382 1.00 40.20 O ANISOU 996 O LYS A 579 4741 4800 5732 -54 877 1083 O ATOM 997 CB LYS A 579 27.846 26.059 -9.223 1.00 37.88 C ANISOU 997 CB LYS A 579 4185 4298 5910 -166 828 969 C ATOM 998 CG LYS A 579 28.316 27.457 -8.808 1.00 37.94 C ANISOU 998 CG LYS A 579 4071 4170 6173 -215 853 992 C ATOM 999 CD LYS A 579 29.676 27.402 -8.121 1.00 46.57 C ANISOU 999 CD LYS A 579 5041 5224 7428 -254 877 921 C ATOM 1000 CE LYS A 579 30.097 28.782 -7.668 1.00 47.50 C ANISOU 1000 CE LYS A 579 5036 5200 7814 -306 884 929 C ATOM 1001 NZ LYS A 579 29.536 29.107 -6.319 1.00 53.47 N ANISOU 1001 NZ LYS A 579 5759 5914 8642 -330 746 777 N ATOM 0 H LYS A 579 25.373 26.251 -8.337 1.00 35.59 H new ATOM 0 HA LYS A 579 26.500 26.629 -10.748 1.00 35.73 H new ATOM 0 HB2 LYS A 579 27.773 25.502 -8.432 1.00 37.88 H new ATOM 0 HB3 LYS A 579 28.519 25.655 -9.793 1.00 37.88 H new ATOM 0 HG2 LYS A 579 28.369 28.028 -9.590 1.00 37.94 H new ATOM 0 HG3 LYS A 579 27.665 27.855 -8.210 1.00 37.94 H new ATOM 0 HD2 LYS A 579 29.635 26.804 -7.358 1.00 46.57 H new ATOM 0 HD3 LYS A 579 30.338 27.040 -8.731 1.00 46.57 H new ATOM 0 HE2 LYS A 579 31.065 28.834 -7.639 1.00 47.50 H new ATOM 0 HE3 LYS A 579 29.797 29.442 -8.313 1.00 47.50 H new ATOM 0 HZ1 LYS A 579 30.139 29.562 -5.848 1.00 53.47 H new ATOM 0 HZ2 LYS A 579 28.801 29.600 -6.414 1.00 53.47 H new ATOM 0 HZ3 LYS A 579 29.334 28.353 -5.892 1.00 53.47 H new ATOM 1002 N VAL A 580 25.221 23.945 -10.005 1.00 36.98 N ANISOU 1002 N VAL A 580 4358 4403 5290 -67 665 925 N ATOM 1003 CA VAL A 580 24.925 22.585 -10.482 1.00 36.66 C ANISOU 1003 CA VAL A 580 4420 4469 5041 -27 642 895 C ATOM 1004 C VAL A 580 23.651 22.619 -11.321 1.00 41.77 C ANISOU 1004 C VAL A 580 5171 5149 5552 10 592 960 C ATOM 1005 O VAL A 580 23.674 22.248 -12.494 1.00 42.95 O ANISOU 1005 O VAL A 580 5410 5353 5557 52 638 1037 O ATOM 1006 CB VAL A 580 24.870 21.576 -9.305 1.00 39.12 C ANISOU 1006 CB VAL A 580 4711 4817 5335 -40 558 743 C ATOM 1007 CG1 VAL A 580 24.199 20.260 -9.706 1.00 38.38 C ANISOU 1007 CG1 VAL A 580 4724 4816 5044 -2 506 706 C ATOM 1008 CG2 VAL A 580 26.277 21.330 -8.741 1.00 38.29 C ANISOU 1008 CG2 VAL A 580 4520 4700 5329 -62 612 693 C ATOM 0 H VAL A 580 24.701 24.225 -9.380 1.00 36.98 H new ATOM 0 HA VAL A 580 25.642 22.268 -11.053 1.00 36.66 H new ATOM 0 HB VAL A 580 24.322 21.970 -8.608 1.00 39.12 H new ATOM 0 HG11 VAL A 580 24.185 19.659 -8.945 1.00 38.38 H new ATOM 0 HG12 VAL A 580 23.290 20.435 -9.996 1.00 38.38 H new ATOM 0 HG13 VAL A 580 24.696 19.851 -10.431 1.00 38.38 H new ATOM 0 HG21 VAL A 580 26.226 20.698 -8.007 1.00 38.29 H new ATOM 0 HG22 VAL A 580 26.847 20.970 -9.438 1.00 38.29 H new ATOM 0 HG23 VAL A 580 26.648 22.167 -8.421 1.00 38.29 H new ATOM 1009 N LEU A 581 22.570 23.149 -10.751 1.00 38.61 N ANISOU 1009 N LEU A 581 4755 4709 5206 -3 500 933 N ATOM 1010 CA LEU A 581 21.281 23.246 -11.425 1.00 37.74 C ANISOU 1010 CA LEU A 581 4725 4620 4994 29 434 989 C ATOM 1011 C LEU A 581 21.276 24.165 -12.627 1.00 44.33 C ANISOU 1011 C LEU A 581 5597 5429 5816 55 499 1148 C ATOM 1012 O LEU A 581 21.877 25.229 -12.595 1.00 45.73 O ANISOU 1012 O LEU A 581 5706 5527 6142 33 574 1216 O ATOM 1013 CB LEU A 581 20.182 23.669 -10.448 1.00 36.03 C ANISOU 1013 CB LEU A 581 4465 4358 4866 9 333 924 C ATOM 1014 CG LEU A 581 19.797 22.668 -9.334 1.00 37.64 C ANISOU 1014 CG LEU A 581 4657 4600 5043 -3 254 780 C ATOM 1015 CD1 LEU A 581 18.620 23.217 -8.521 1.00 35.41 C ANISOU 1015 CD1 LEU A 581 4339 4271 4845 -13 173 739 C ATOM 1016 CD2 LEU A 581 19.490 21.261 -9.897 1.00 34.64 C ANISOU 1016 CD2 LEU A 581 4370 4315 4477 27 217 753 C ATOM 0 H LEU A 581 22.567 23.466 -9.952 1.00 38.61 H new ATOM 0 HA LEU A 581 21.103 22.353 -11.760 1.00 37.74 H new ATOM 0 HB2 LEU A 581 20.459 24.497 -10.025 1.00 36.03 H new ATOM 0 HB3 LEU A 581 19.384 23.867 -10.962 1.00 36.03 H new ATOM 0 HG LEU A 581 20.561 22.566 -8.745 1.00 37.64 H new ATOM 0 HD11 LEU A 581 18.384 22.584 -7.825 1.00 35.41 H new ATOM 0 HD12 LEU A 581 18.872 24.062 -8.117 1.00 35.41 H new ATOM 0 HD13 LEU A 581 17.858 23.352 -9.106 1.00 35.41 H new ATOM 0 HD21 LEU A 581 19.254 20.665 -9.169 1.00 34.64 H new ATOM 0 HD22 LEU A 581 18.750 21.317 -10.522 1.00 34.64 H new ATOM 0 HD23 LEU A 581 20.273 20.917 -10.354 1.00 34.64 H new ATOM 1017 N GLU A 582 20.537 23.777 -13.666 1.00 42.55 N ANISOU 1017 N GLU A 582 5481 5265 5420 104 462 1207 N ATOM 1018 CA GLU A 582 20.314 24.608 -14.848 1.00 44.86 C ANISOU 1018 CA GLU A 582 5830 5544 5671 141 503 1366 C ATOM 1019 C GLU A 582 19.319 25.694 -14.405 1.00 48.81 C ANISOU 1019 C GLU A 582 6277 5961 6309 125 431 1394 C ATOM 1020 O GLU A 582 18.654 25.530 -13.372 1.00 48.24 O ANISOU 1020 O GLU A 582 6154 5869 6306 99 342 1283 O ATOM 1021 CB GLU A 582 19.707 23.766 -15.981 1.00 47.28 C ANISOU 1021 CB GLU A 582 6275 5949 5739 201 454 1396 C ATOM 1022 CG GLU A 582 20.533 22.543 -16.374 1.00 61.54 C ANISOU 1022 CG GLU A 582 8144 7841 7399 223 510 1344 C ATOM 1023 CD GLU A 582 19.891 21.558 -17.337 1.00 95.84 C ANISOU 1023 CD GLU A 582 12625 12280 11509 280 439 1332 C ATOM 1024 OE1 GLU A 582 20.595 20.615 -17.768 1.00 95.56 O ANISOU 1024 OE1 GLU A 582 12649 12310 11349 306 495 1296 O ATOM 1025 OE2 GLU A 582 18.691 21.720 -17.659 1.00 94.49 O ANISOU 1025 OE2 GLU A 582 12501 12117 11286 301 323 1353 O ATOM 0 H GLU A 582 20.146 23.012 -13.704 1.00 42.55 H new ATOM 0 HA GLU A 582 21.141 24.989 -15.182 1.00 44.86 H new ATOM 0 HB2 GLU A 582 18.823 23.472 -15.712 1.00 47.28 H new ATOM 0 HB3 GLU A 582 19.593 24.330 -16.762 1.00 47.28 H new ATOM 0 HG2 GLU A 582 21.363 22.854 -16.769 1.00 61.54 H new ATOM 0 HG3 GLU A 582 20.767 22.064 -15.564 1.00 61.54 H new ATOM 1026 N GLU A 583 19.205 26.779 -15.169 1.00 46.10 N ANISOU 1026 N GLU A 583 5944 5566 6005 146 474 1542 N ATOM 1027 CA GLU A 583 18.316 27.906 -14.855 1.00 46.44 C ANISOU 1027 CA GLU A 583 5935 5518 6191 138 418 1585 C ATOM 1028 C GLU A 583 16.870 27.472 -14.531 1.00 48.70 C ANISOU 1028 C GLU A 583 6245 5834 6425 152 268 1511 C ATOM 1029 O GLU A 583 16.317 27.887 -13.511 1.00 48.01 O ANISOU 1029 O GLU A 583 6077 5684 6482 122 215 1437 O ATOM 1030 CB GLU A 583 18.348 28.936 -15.993 1.00 49.68 C ANISOU 1030 CB GLU A 583 6383 5888 6603 174 482 1778 C ATOM 1031 CG GLU A 583 17.680 30.255 -15.653 1.00 66.42 C ANISOU 1031 CG GLU A 583 8432 7892 8913 162 450 1834 C ATOM 0 H GLU A 583 19.649 26.886 -15.898 1.00 46.10 H new ATOM 0 HA GLU A 583 18.654 28.317 -14.044 1.00 46.44 H new ATOM 0 HB2 GLU A 583 19.271 29.106 -16.237 1.00 49.68 H new ATOM 0 HB3 GLU A 583 17.914 28.556 -16.773 1.00 49.68 H new ATOM 1032 N ALA A 584 16.276 26.640 -15.397 1.00 44.64 N ANISOU 1032 N ALA A 584 5838 5412 5710 198 202 1528 N ATOM 1033 CA ALA A 584 14.910 26.149 -15.264 1.00 43.73 C ANISOU 1033 CA ALA A 584 5747 5328 5541 215 58 1470 C ATOM 1034 C ALA A 584 14.753 25.232 -14.037 1.00 44.60 C ANISOU 1034 C ALA A 584 5805 5457 5685 175 9 1298 C ATOM 1035 O ALA A 584 13.742 25.322 -13.346 1.00 43.70 O ANISOU 1035 O ALA A 584 5643 5313 5650 165 -76 1242 O ATOM 1036 CB ALA A 584 14.487 25.437 -16.548 1.00 45.22 C ANISOU 1036 CB ALA A 584 6065 5611 5504 273 0 1524 C ATOM 0 H ALA A 584 16.675 26.340 -16.097 1.00 44.64 H new ATOM 0 HA ALA A 584 14.324 26.909 -15.123 1.00 43.73 H new ATOM 0 HB1 ALA A 584 13.578 25.113 -16.454 1.00 45.22 H new ATOM 0 HB2 ALA A 584 14.533 26.057 -17.292 1.00 45.22 H new ATOM 0 HB3 ALA A 584 15.081 24.689 -16.714 1.00 45.22 H new ATOM 1037 N GLU A 585 15.765 24.393 -13.740 1.00 40.30 N ANISOU 1037 N GLU A 585 5265 4957 5090 156 71 1222 N ATOM 1038 CA GLU A 585 15.753 23.525 -12.559 1.00 38.56 C ANISOU 1038 CA GLU A 585 4998 4753 4900 122 36 1071 C ATOM 1039 C GLU A 585 15.795 24.362 -11.274 1.00 40.02 C ANISOU 1039 C GLU A 585 5070 4850 5284 80 52 1019 C ATOM 1040 O GLU A 585 15.113 24.032 -10.313 1.00 39.98 O ANISOU 1040 O GLU A 585 5026 4840 5324 65 -11 922 O ATOM 1041 CB GLU A 585 16.944 22.564 -12.570 1.00 39.82 C ANISOU 1041 CB GLU A 585 5182 4970 4976 115 106 1017 C ATOM 1042 CG GLU A 585 16.831 21.364 -13.498 1.00 52.04 C ANISOU 1042 CG GLU A 585 6840 6612 6322 153 74 1008 C ATOM 1043 CD GLU A 585 18.105 20.535 -13.609 1.00 69.46 C ANISOU 1043 CD GLU A 585 9068 8865 8458 154 163 969 C ATOM 1044 OE1 GLU A 585 18.000 19.289 -13.556 1.00 77.32 O ANISOU 1044 OE1 GLU A 585 10107 9919 9351 163 119 882 O ATOM 1045 OE2 GLU A 585 19.209 21.122 -13.722 1.00 50.41 O ANISOU 1045 OE2 GLU A 585 6621 6425 6109 145 276 1023 O ATOM 0 H GLU A 585 16.473 24.317 -14.221 1.00 40.30 H new ATOM 0 HA GLU A 585 14.931 23.010 -12.584 1.00 38.56 H new ATOM 0 HB2 GLU A 585 17.738 23.065 -12.815 1.00 39.82 H new ATOM 0 HB3 GLU A 585 17.082 22.239 -11.667 1.00 39.82 H new ATOM 0 HG2 GLU A 585 16.112 20.793 -13.185 1.00 52.04 H new ATOM 0 HG3 GLU A 585 16.582 21.675 -14.382 1.00 52.04 H new ATOM 1046 N ALA A 586 16.615 25.422 -11.244 1.00 35.65 N ANISOU 1046 N ALA A 586 4465 4227 4853 62 139 1079 N ATOM 1047 CA ALA A 586 16.737 26.297 -10.074 1.00 34.94 C ANISOU 1047 CA ALA A 586 4272 4046 4958 25 151 1022 C ATOM 1048 C ALA A 586 15.436 27.081 -9.889 1.00 39.76 C ANISOU 1048 C ALA A 586 4856 4597 5652 37 81 1044 C ATOM 1049 O ALA A 586 14.958 27.205 -8.769 1.00 38.90 O ANISOU 1049 O ALA A 586 4690 4455 5635 20 43 947 O ATOM 1050 CB ALA A 586 17.939 27.238 -10.222 1.00 35.36 C ANISOU 1050 CB ALA A 586 4274 4030 5133 2 257 1086 C ATOM 0 H ALA A 586 17.116 25.652 -11.904 1.00 35.65 H new ATOM 0 HA ALA A 586 16.890 25.756 -9.283 1.00 34.94 H new ATOM 0 HB1 ALA A 586 18.003 27.808 -9.439 1.00 35.36 H new ATOM 0 HB2 ALA A 586 18.751 26.715 -10.307 1.00 35.36 H new ATOM 0 HB3 ALA A 586 17.824 27.788 -11.013 1.00 35.36 H new ATOM 1051 N GLN A 587 14.840 27.564 -10.994 1.00 37.67 N ANISOU 1051 N GLN A 587 4639 4326 5347 73 62 1173 N ATOM 1052 CA GLN A 587 13.559 28.276 -10.979 1.00 37.45 C ANISOU 1052 CA GLN A 587 4589 4245 5396 93 -11 1210 C ATOM 1053 C GLN A 587 12.473 27.368 -10.412 1.00 40.01 C ANISOU 1053 C GLN A 587 4916 4619 5668 99 -109 1109 C ATOM 1054 O GLN A 587 11.698 27.796 -9.566 1.00 39.23 O ANISOU 1054 O GLN A 587 4752 4464 5688 93 -144 1057 O ATOM 1055 CB GLN A 587 13.164 28.640 -12.401 1.00 40.38 C ANISOU 1055 CB GLN A 587 5031 4628 5682 140 -28 1367 C ATOM 1056 CG GLN A 587 13.492 30.056 -12.798 1.00 63.50 C ANISOU 1056 CG GLN A 587 7927 7458 8744 144 39 1496 C ATOM 1057 CD GLN A 587 12.836 30.318 -14.120 1.00 76.22 C ANISOU 1057 CD GLN A 587 9616 9092 10254 200 -4 1646 C ATOM 1058 OE1 GLN A 587 11.610 30.455 -14.217 1.00 67.47 O ANISOU 1058 OE1 GLN A 587 8507 7974 9154 228 -106 1661 O ATOM 1059 NE2 GLN A 587 13.628 30.263 -15.174 1.00 70.39 N ANISOU 1059 NE2 GLN A 587 8953 8395 9399 222 67 1755 N ATOM 0 H GLN A 587 15.178 27.483 -11.781 1.00 37.67 H new ATOM 0 HA GLN A 587 13.652 29.074 -10.435 1.00 37.45 H new ATOM 0 HB2 GLN A 587 13.609 28.033 -13.013 1.00 40.38 H new ATOM 0 HB3 GLN A 587 12.210 28.500 -12.505 1.00 40.38 H new ATOM 0 HG2 GLN A 587 13.172 30.681 -12.129 1.00 63.50 H new ATOM 0 HG3 GLN A 587 14.452 30.178 -12.864 1.00 63.50 H new ATOM 0 HE21 GLN A 587 14.476 30.167 -15.070 1.00 70.39 H new ATOM 0 HE22 GLN A 587 13.296 30.323 -15.965 1.00 70.39 H new ATOM 1060 N HIS A 588 12.406 26.118 -10.884 1.00 36.66 N ANISOU 1060 N HIS A 588 4564 4293 5073 112 -148 1082 N ATOM 1061 CA HIS A 588 11.417 25.176 -10.370 1.00 37.17 C ANISOU 1061 CA HIS A 588 4625 4398 5098 113 -237 990 C ATOM 1062 C HIS A 588 11.594 24.950 -8.840 1.00 40.87 C ANISOU 1062 C HIS A 588 5023 4846 5661 77 -212 857 C ATOM 1063 O HIS A 588 10.602 24.881 -8.104 1.00 40.03 O ANISOU 1063 O HIS A 588 4872 4721 5616 78 -262 801 O ATOM 1064 CB HIS A 588 11.461 23.843 -11.123 1.00 37.45 C ANISOU 1064 CB HIS A 588 4751 4534 4945 130 -278 974 C ATOM 1065 CG HIS A 588 10.372 22.917 -10.673 1.00 41.19 C ANISOU 1065 CG HIS A 588 5214 5037 5400 129 -373 892 C ATOM 1066 ND1 HIS A 588 9.031 23.247 -10.823 1.00 43.74 N ANISOU 1066 ND1 HIS A 588 5509 5330 5778 148 -463 923 N ATOM 1067 CD2 HIS A 588 10.458 21.718 -10.051 1.00 42.64 C ANISOU 1067 CD2 HIS A 588 5400 5267 5533 111 -385 787 C ATOM 1068 CE1 HIS A 588 8.353 22.234 -10.311 1.00 42.69 C ANISOU 1068 CE1 HIS A 588 5362 5227 5630 138 -523 837 C ATOM 1069 NE2 HIS A 588 9.167 21.292 -9.832 1.00 42.35 N ANISOU 1069 NE2 HIS A 588 5340 5230 5523 116 -477 756 N ATOM 0 H HIS A 588 12.921 25.802 -11.496 1.00 36.66 H new ATOM 0 HA HIS A 588 10.543 25.570 -10.518 1.00 37.17 H new ATOM 0 HB2 HIS A 588 11.375 24.006 -12.075 1.00 37.45 H new ATOM 0 HB3 HIS A 588 12.323 23.421 -10.984 1.00 37.45 H new ATOM 0 HD1 HIS A 588 8.709 23.962 -11.176 1.00 43.74 H new ATOM 0 HD2 HIS A 588 11.238 21.269 -9.817 1.00 42.64 H new ATOM 0 HE1 HIS A 588 7.425 22.184 -10.288 1.00 42.69 H new ATOM 1070 N LEU A 589 12.856 24.883 -8.384 1.00 35.56 N ANISOU 1070 N LEU A 589 4337 4175 4998 51 -134 813 N ATOM 1071 CA LEU A 589 13.210 24.714 -6.974 1.00 34.30 C ANISOU 1071 CA LEU A 589 4121 4001 4912 22 -111 692 C ATOM 1072 C LEU A 589 12.712 25.883 -6.110 1.00 35.95 C ANISOU 1072 C LEU A 589 4253 4117 5289 16 -108 668 C ATOM 1073 O LEU A 589 12.097 25.667 -5.073 1.00 35.30 O ANISOU 1073 O LEU A 589 4137 4031 5246 15 -132 579 O ATOM 1074 CB LEU A 589 14.757 24.563 -6.815 1.00 33.98 C ANISOU 1074 CB LEU A 589 4076 3973 4862 -2 -35 666 C ATOM 1075 CG LEU A 589 15.300 24.401 -5.389 1.00 36.95 C ANISOU 1075 CG LEU A 589 4399 4338 5303 -28 -18 541 C ATOM 1076 CD1 LEU A 589 14.961 23.021 -4.822 1.00 33.95 C ANISOU 1076 CD1 LEU A 589 4047 4034 4819 -24 -59 456 C ATOM 1077 CD2 LEU A 589 16.818 24.669 -5.342 1.00 40.87 C ANISOU 1077 CD2 LEU A 589 4868 4816 5844 -53 52 538 C ATOM 0 H LEU A 589 13.541 24.936 -8.902 1.00 35.56 H new ATOM 0 HA LEU A 589 12.771 23.907 -6.664 1.00 34.30 H new ATOM 0 HB2 LEU A 589 15.039 23.794 -7.334 1.00 33.98 H new ATOM 0 HB3 LEU A 589 15.178 25.342 -7.211 1.00 33.98 H new ATOM 0 HG LEU A 589 14.866 25.062 -4.828 1.00 36.95 H new ATOM 0 HD11 LEU A 589 15.315 22.945 -3.922 1.00 33.95 H new ATOM 0 HD12 LEU A 589 13.998 22.907 -4.801 1.00 33.95 H new ATOM 0 HD13 LEU A 589 15.355 22.335 -5.383 1.00 33.95 H new ATOM 0 HD21 LEU A 589 17.138 24.561 -4.433 1.00 40.87 H new ATOM 0 HD22 LEU A 589 17.276 24.041 -5.922 1.00 40.87 H new ATOM 0 HD23 LEU A 589 16.996 25.574 -5.642 1.00 40.87 H new ATOM 1078 N TYR A 590 12.995 27.097 -6.511 1.00 33.07 N ANISOU 1078 N TYR A 590 3861 3676 5027 16 -72 745 N ATOM 1079 CA TYR A 590 12.642 28.227 -5.669 1.00 33.91 C ANISOU 1079 CA TYR A 590 3895 3685 5305 11 -64 711 C ATOM 1080 C TYR A 590 11.215 28.728 -5.896 1.00 37.90 C ANISOU 1080 C TYR A 590 4385 4152 5864 42 -120 760 C ATOM 1081 O TYR A 590 10.668 29.394 -5.019 1.00 38.08 O ANISOU 1081 O TYR A 590 4349 4107 6012 45 -122 704 O ATOM 1082 CB TYR A 590 13.697 29.351 -5.777 1.00 35.88 C ANISOU 1082 CB TYR A 590 4105 3850 5679 -11 4 751 C ATOM 1083 CG TYR A 590 13.775 30.173 -7.054 1.00 39.24 C ANISOU 1083 CG TYR A 590 4547 4230 6132 3 30 911 C ATOM 1084 CD1 TYR A 590 12.802 31.119 -7.355 1.00 41.86 C ANISOU 1084 CD1 TYR A 590 4857 4488 6560 29 2 985 C ATOM 1085 CD2 TYR A 590 14.922 30.161 -7.842 1.00 41.25 C ANISOU 1085 CD2 TYR A 590 4827 4499 6347 -8 97 987 C ATOM 1086 CE1 TYR A 590 12.921 31.965 -8.459 1.00 44.42 C ANISOU 1086 CE1 TYR A 590 5194 4761 6921 45 31 1140 C ATOM 1087 CE2 TYR A 590 15.051 30.999 -8.956 1.00 43.42 C ANISOU 1087 CE2 TYR A 590 5116 4726 6655 8 137 1144 C ATOM 1088 CZ TYR A 590 14.038 31.888 -9.269 1.00 54.17 C ANISOU 1088 CZ TYR A 590 6466 6020 8097 35 100 1222 C ATOM 1089 OH TYR A 590 14.152 32.739 -10.346 1.00 60.70 O ANISOU 1089 OH TYR A 590 7310 6797 8957 55 140 1387 O ATOM 0 H TYR A 590 13.384 27.295 -7.252 1.00 33.07 H new ATOM 0 HA TYR A 590 12.650 27.909 -4.753 1.00 33.91 H new ATOM 0 HB2 TYR A 590 13.545 29.966 -5.042 1.00 35.88 H new ATOM 0 HB3 TYR A 590 14.568 28.949 -5.635 1.00 35.88 H new ATOM 0 HD1 TYR A 590 12.054 31.190 -6.808 1.00 41.86 H new ATOM 0 HD2 TYR A 590 15.618 29.584 -7.624 1.00 41.25 H new ATOM 0 HE1 TYR A 590 12.249 32.580 -8.649 1.00 44.42 H new ATOM 0 HE2 TYR A 590 15.815 30.958 -9.484 1.00 43.42 H new ATOM 0 HH TYR A 590 14.873 32.587 -10.749 1.00 60.70 H new ATOM 1090 N GLN A 591 10.614 28.432 -7.055 1.00 34.56 N ANISOU 1090 N GLN A 591 4012 3768 5350 69 -167 861 N ATOM 1091 CA GLN A 591 9.238 28.874 -7.297 1.00 35.58 C ANISOU 1091 CA GLN A 591 4120 3861 5539 101 -232 911 C ATOM 1092 C GLN A 591 8.231 27.853 -6.870 1.00 42.10 C ANISOU 1092 C GLN A 591 4944 4745 6308 109 -297 841 C ATOM 1093 O GLN A 591 7.109 28.225 -6.534 1.00 44.56 O ANISOU 1093 O GLN A 591 5205 5012 6713 129 -335 837 O ATOM 1094 CB GLN A 591 8.997 29.246 -8.772 1.00 37.76 C ANISOU 1094 CB GLN A 591 4446 4139 5763 132 -265 1065 C ATOM 1095 CG GLN A 591 9.755 30.497 -9.203 1.00 44.32 C ANISOU 1095 CG GLN A 591 5262 4886 6691 130 -196 1162 C ATOM 1096 CD GLN A 591 9.477 30.939 -10.614 1.00 63.53 C ANISOU 1096 CD GLN A 591 7749 7318 9073 169 -222 1327 C ATOM 1097 OE1 GLN A 591 9.002 30.175 -11.465 1.00 60.49 O ANISOU 1097 OE1 GLN A 591 7433 7014 8536 197 -291 1370 O ATOM 1098 NE2 GLN A 591 9.819 32.185 -10.902 1.00 50.78 N ANISOU 1098 NE2 GLN A 591 6105 5608 7582 172 -167 1424 N ATOM 0 H GLN A 591 10.975 27.988 -7.697 1.00 34.56 H new ATOM 0 HA GLN A 591 9.121 29.669 -6.754 1.00 35.58 H new ATOM 0 HB2 GLN A 591 9.263 28.503 -9.335 1.00 37.76 H new ATOM 0 HB3 GLN A 591 8.048 29.384 -8.914 1.00 37.76 H new ATOM 0 HG2 GLN A 591 9.530 31.222 -8.599 1.00 44.32 H new ATOM 0 HG3 GLN A 591 10.706 30.334 -9.109 1.00 44.32 H new ATOM 0 HE21 GLN A 591 10.147 32.693 -10.291 1.00 50.78 H new ATOM 0 HE22 GLN A 591 9.713 32.486 -11.701 1.00 50.78 H new ATOM 1099 N SER A 592 8.593 26.563 -6.904 1.00 37.84 N ANISOU 1099 N SER A 592 4454 4296 5627 96 -308 790 N ATOM 1100 CA SER A 592 7.620 25.527 -6.580 1.00 37.16 C ANISOU 1100 CA SER A 592 4365 4258 5496 102 -370 733 C ATOM 1101 C SER A 592 8.035 24.576 -5.438 1.00 38.07 C ANISOU 1101 C SER A 592 4473 4417 5573 78 -335 611 C ATOM 1102 O SER A 592 7.285 24.480 -4.478 1.00 38.21 O ANISOU 1102 O SER A 592 4442 4418 5659 81 -337 548 O ATOM 1103 CB SER A 592 7.242 24.741 -7.834 1.00 40.55 C ANISOU 1103 CB SER A 592 4862 4753 5793 120 -449 797 C ATOM 1104 OG SER A 592 6.271 23.754 -7.525 1.00 51.29 O ANISOU 1104 OG SER A 592 6207 6147 7135 121 -513 741 O ATOM 0 H SER A 592 9.378 26.278 -7.108 1.00 37.84 H new ATOM 0 HA SER A 592 6.845 26.000 -6.239 1.00 37.16 H new ATOM 0 HB2 SER A 592 6.894 25.345 -8.509 1.00 40.55 H new ATOM 0 HB3 SER A 592 8.031 24.320 -8.209 1.00 40.55 H new ATOM 0 HG SER A 592 6.071 23.330 -8.222 1.00 51.29 H new ATOM 1105 N ILE A 593 9.194 23.891 -5.527 1.00 32.34 N ANISOU 1105 N ILE A 593 3796 3746 4745 59 -300 583 N ATOM 1106 CA ILE A 593 9.621 22.927 -4.498 1.00 30.72 C ANISOU 1106 CA ILE A 593 3590 3585 4496 41 -274 477 C ATOM 1107 C ILE A 593 9.776 23.564 -3.091 1.00 32.69 C ANISOU 1107 C ILE A 593 3782 3786 4852 33 -224 395 C ATOM 1108 O ILE A 593 9.084 23.124 -2.178 1.00 32.05 O ANISOU 1108 O ILE A 593 3675 3714 4787 39 -228 331 O ATOM 1109 CB ILE A 593 10.878 22.105 -4.907 1.00 33.31 C ANISOU 1109 CB ILE A 593 3977 3975 4703 27 -247 467 C ATOM 1110 CG1 ILE A 593 10.634 21.385 -6.264 1.00 34.51 C ANISOU 1110 CG1 ILE A 593 4198 4180 4734 42 -300 532 C ATOM 1111 CG2 ILE A 593 11.266 21.061 -3.785 1.00 31.64 C ANISOU 1111 CG2 ILE A 593 3762 3807 4451 13 -228 362 C ATOM 1112 CD1 ILE A 593 11.964 20.688 -6.899 1.00 35.00 C ANISOU 1112 CD1 ILE A 593 4325 4299 4673 37 -257 537 C ATOM 0 H ILE A 593 9.747 23.974 -6.181 1.00 32.34 H new ATOM 0 HA ILE A 593 8.890 22.292 -4.433 1.00 30.72 H new ATOM 0 HB ILE A 593 11.621 22.720 -5.010 1.00 33.31 H new ATOM 0 HG12 ILE A 593 9.953 20.706 -6.140 1.00 34.51 H new ATOM 0 HG13 ILE A 593 10.282 22.027 -6.901 1.00 34.51 H new ATOM 0 HG21 ILE A 593 12.050 20.563 -4.064 1.00 31.64 H new ATOM 0 HG22 ILE A 593 11.458 21.531 -2.958 1.00 31.64 H new ATOM 0 HG23 ILE A 593 10.528 20.448 -3.644 1.00 31.64 H new ATOM 0 HD11 ILE A 593 11.736 20.261 -7.740 1.00 35.00 H new ATOM 0 HD12 ILE A 593 12.642 21.365 -7.054 1.00 35.00 H new ATOM 0 HD13 ILE A 593 12.307 20.023 -6.282 1.00 35.00 H new ATOM 1113 N LEU A 594 10.651 24.586 -2.919 1.00 28.59 N ANISOU 1113 N LEU A 594 3241 3215 4407 22 -176 395 N ATOM 1114 CA LEU A 594 10.888 25.230 -1.610 1.00 28.05 C ANISOU 1114 CA LEU A 594 3125 3098 4435 17 -139 303 C ATOM 1115 C LEU A 594 9.616 25.827 -0.988 1.00 32.09 C ANISOU 1115 C LEU A 594 3588 3556 5047 41 -148 282 C ATOM 1116 O LEU A 594 9.340 25.478 0.164 1.00 31.47 O ANISOU 1116 O LEU A 594 3496 3492 4967 49 -132 191 O ATOM 1117 CB LEU A 594 12.044 26.246 -1.659 1.00 28.18 C ANISOU 1117 CB LEU A 594 3120 3055 4531 -2 -97 309 C ATOM 1118 CG LEU A 594 13.414 25.577 -1.844 1.00 32.03 C ANISOU 1118 CG LEU A 594 3638 3596 4937 -25 -72 295 C ATOM 1119 CD1 LEU A 594 14.484 26.624 -2.095 1.00 34.24 C ANISOU 1119 CD1 LEU A 594 3884 3806 5318 -46 -30 324 C ATOM 1120 CD2 LEU A 594 13.775 24.670 -0.633 1.00 27.17 C ANISOU 1120 CD2 LEU A 594 3027 3035 4262 -29 -74 177 C ATOM 0 H LEU A 594 11.119 24.919 -3.559 1.00 28.59 H new ATOM 0 HA LEU A 594 11.164 24.517 -1.013 1.00 28.05 H new ATOM 0 HB2 LEU A 594 11.892 26.869 -2.387 1.00 28.18 H new ATOM 0 HB3 LEU A 594 12.049 26.764 -0.839 1.00 28.18 H new ATOM 0 HG LEU A 594 13.366 25.001 -2.623 1.00 32.03 H new ATOM 0 HD11 LEU A 594 15.343 26.188 -2.210 1.00 34.24 H new ATOM 0 HD12 LEU A 594 14.266 27.124 -2.897 1.00 34.24 H new ATOM 0 HD13 LEU A 594 14.528 27.230 -1.339 1.00 34.24 H new ATOM 0 HD21 LEU A 594 14.643 24.263 -0.780 1.00 27.17 H new ATOM 0 HD22 LEU A 594 13.802 25.205 0.176 1.00 27.17 H new ATOM 0 HD23 LEU A 594 13.105 23.975 -0.538 1.00 27.17 H new ATOM 1121 N PRO A 595 8.783 26.639 -1.707 1.00 28.00 N ANISOU 1121 N PRO A 595 3047 2981 4611 59 -172 366 N ATOM 1122 CA PRO A 595 7.516 27.098 -1.113 1.00 27.63 C ANISOU 1122 CA PRO A 595 2947 2886 4665 86 -178 344 C ATOM 1123 C PRO A 595 6.598 25.941 -0.711 1.00 30.82 C ANISOU 1123 C PRO A 595 3351 3351 5007 97 -200 312 C ATOM 1124 O PRO A 595 5.955 26.042 0.322 1.00 30.91 O ANISOU 1124 O PRO A 595 3326 3344 5076 115 -171 247 O ATOM 1125 CB PRO A 595 6.883 27.911 -2.260 1.00 30.12 C ANISOU 1125 CB PRO A 595 3246 3145 5052 103 -216 464 C ATOM 1126 CG PRO A 595 8.068 28.425 -3.014 1.00 33.73 C ANISOU 1126 CG PRO A 595 3734 3586 5495 84 -195 524 C ATOM 1127 CD PRO A 595 8.947 27.211 -3.059 1.00 29.17 C ANISOU 1127 CD PRO A 595 3213 3104 4768 61 -190 488 C ATOM 0 HA PRO A 595 7.655 27.598 -0.294 1.00 27.63 H new ATOM 0 HB2 PRO A 595 6.315 27.358 -2.819 1.00 30.12 H new ATOM 0 HB3 PRO A 595 6.332 28.635 -1.924 1.00 30.12 H new ATOM 0 HG2 PRO A 595 7.829 28.735 -3.901 1.00 33.73 H new ATOM 0 HG3 PRO A 595 8.495 29.168 -2.559 1.00 33.73 H new ATOM 0 HD2 PRO A 595 8.667 26.589 -3.749 1.00 29.17 H new ATOM 0 HD3 PRO A 595 9.871 27.442 -3.243 1.00 29.17 H new ATOM 1128 N ASP A 596 6.545 24.832 -1.497 1.00 27.66 N ANISOU 1128 N ASP A 596 2994 3022 4494 87 -247 355 N ATOM 1129 CA ASP A 596 5.720 23.675 -1.124 1.00 28.25 C ANISOU 1129 CA ASP A 596 3063 3145 4524 91 -268 325 C ATOM 1130 C ASP A 596 6.303 22.949 0.110 1.00 32.51 C ANISOU 1130 C ASP A 596 3618 3729 5006 83 -214 225 C ATOM 1131 O ASP A 596 5.537 22.409 0.902 1.00 32.24 O ANISOU 1131 O ASP A 596 3559 3707 4985 94 -197 187 O ATOM 1132 CB ASP A 596 5.535 22.717 -2.314 1.00 31.02 C ANISOU 1132 CB ASP A 596 3457 3550 4779 84 -340 386 C ATOM 1133 CG ASP A 596 4.638 23.248 -3.441 1.00 47.27 C ANISOU 1133 CG ASP A 596 5499 5575 6886 102 -413 482 C ATOM 1134 OD1 ASP A 596 4.089 24.387 -3.298 1.00 47.68 O ANISOU 1134 OD1 ASP A 596 5497 5556 7063 122 -404 509 O ATOM 1135 OD2 ASP A 596 4.541 22.571 -4.488 1.00 51.97 O ANISOU 1135 OD2 ASP A 596 6139 6214 7392 101 -482 528 O ATOM 0 H ASP A 596 6.976 24.742 -2.236 1.00 27.66 H new ATOM 0 HA ASP A 596 4.841 24.002 -0.878 1.00 28.25 H new ATOM 0 HB2 ASP A 596 6.408 22.510 -2.684 1.00 31.02 H new ATOM 0 HB3 ASP A 596 5.161 21.884 -1.986 1.00 31.02 H new ATOM 1136 N MET A 597 7.649 23.012 0.315 1.00 27.59 N ANISOU 1136 N MET A 597 3031 3124 4329 65 -184 188 N ATOM 1137 CA MET A 597 8.298 22.392 1.489 1.00 25.28 C ANISOU 1137 CA MET A 597 2755 2872 3977 62 -144 96 C ATOM 1138 C MET A 597 8.009 23.233 2.741 1.00 28.69 C ANISOU 1138 C MET A 597 3150 3258 4492 84 -97 21 C ATOM 1139 O MET A 597 7.706 22.688 3.810 1.00 27.49 O ANISOU 1139 O MET A 597 3001 3136 4309 101 -66 -40 O ATOM 1140 CB MET A 597 9.801 22.245 1.265 1.00 25.93 C ANISOU 1140 CB MET A 597 2877 2983 3993 39 -136 81 C ATOM 1141 CG MET A 597 10.139 21.178 0.266 1.00 28.81 C ANISOU 1141 CG MET A 597 3288 3406 4253 25 -168 130 C ATOM 1142 SD MET A 597 11.898 21.147 -0.110 1.00 31.93 S ANISOU 1142 SD MET A 597 3715 3824 4594 2 -145 125 S ATOM 1143 CE MET A 597 12.542 20.813 1.517 1.00 29.23 C ANISOU 1143 CE MET A 597 3365 3504 4237 5 -116 9 C ATOM 0 H MET A 597 8.194 23.410 -0.218 1.00 27.59 H new ATOM 0 HA MET A 597 7.933 21.502 1.618 1.00 25.28 H new ATOM 0 HB2 MET A 597 10.163 23.092 0.962 1.00 25.93 H new ATOM 0 HB3 MET A 597 10.231 22.039 2.110 1.00 25.93 H new ATOM 0 HG2 MET A 597 9.867 20.313 0.612 1.00 28.81 H new ATOM 0 HG3 MET A 597 9.636 21.328 -0.550 1.00 28.81 H new ATOM 0 HE1 MET A 597 13.453 20.487 1.444 1.00 29.23 H new ATOM 0 HE2 MET A 597 12.532 21.628 2.043 1.00 29.23 H new ATOM 0 HE3 MET A 597 11.993 20.142 1.951 1.00 29.23 H new ATOM 1144 N VAL A 598 8.046 24.555 2.589 1.00 24.95 N ANISOU 1144 N VAL A 598 2646 2710 4126 89 -90 30 N ATOM 1145 CA VAL A 598 7.704 25.496 3.694 1.00 25.98 C ANISOU 1145 CA VAL A 598 2741 2781 4348 115 -48 -46 C ATOM 1146 C VAL A 598 6.250 25.258 4.159 1.00 31.23 C ANISOU 1146 C VAL A 598 3372 3443 5051 148 -29 -45 C ATOM 1147 O VAL A 598 5.998 25.151 5.349 1.00 32.33 O ANISOU 1147 O VAL A 598 3511 3594 5179 174 19 -124 O ATOM 1148 CB VAL A 598 7.942 26.969 3.257 1.00 29.10 C ANISOU 1148 CB VAL A 598 3103 3080 4872 113 -50 -23 C ATOM 1149 CG1 VAL A 598 7.279 27.977 4.211 1.00 30.30 C ANISOU 1149 CG1 VAL A 598 3214 3160 5141 147 -12 -92 C ATOM 1150 CG2 VAL A 598 9.436 27.255 3.096 1.00 27.53 C ANISOU 1150 CG2 VAL A 598 2925 2876 4659 81 -51 -43 C ATOM 0 H VAL A 598 8.267 24.943 1.854 1.00 24.95 H new ATOM 0 HA VAL A 598 8.289 25.326 4.449 1.00 25.98 H new ATOM 0 HB VAL A 598 7.516 27.083 2.393 1.00 29.10 H new ATOM 0 HG11 VAL A 598 7.453 28.879 3.901 1.00 30.30 H new ATOM 0 HG12 VAL A 598 6.322 27.822 4.232 1.00 30.30 H new ATOM 0 HG13 VAL A 598 7.644 27.867 5.103 1.00 30.30 H new ATOM 0 HG21 VAL A 598 9.562 28.177 2.824 1.00 27.53 H new ATOM 0 HG22 VAL A 598 9.888 27.104 3.941 1.00 27.53 H new ATOM 0 HG23 VAL A 598 9.808 26.666 2.421 1.00 27.53 H new ATOM 1151 N LYS A 599 5.313 25.137 3.237 1.00 28.66 N ANISOU 1151 N LYS A 599 3018 3105 4766 150 -65 44 N ATOM 1152 CA LYS A 599 3.894 24.957 3.617 1.00 28.77 C ANISOU 1152 CA LYS A 599 2982 3105 4843 179 -48 53 C ATOM 1153 C LYS A 599 3.639 23.666 4.399 1.00 30.94 C ANISOU 1153 C LYS A 599 3273 3451 5031 183 -17 17 C ATOM 1154 O LYS A 599 2.973 23.679 5.424 1.00 32.31 O ANISOU 1154 O LYS A 599 3422 3618 5238 214 45 -29 O ATOM 1155 CB LYS A 599 2.983 25.065 2.404 1.00 29.23 C ANISOU 1155 CB LYS A 599 3002 3136 4968 179 -112 158 C ATOM 1156 CG LYS A 599 3.031 26.444 1.766 1.00 37.83 C ANISOU 1156 CG LYS A 599 4067 4144 6164 187 -131 205 C ATOM 1157 CD LYS A 599 2.085 26.495 0.559 1.00 45.75 C ANISOU 1157 CD LYS A 599 5038 5127 7220 194 -208 315 C ATOM 1158 CE LYS A 599 2.358 27.629 -0.391 1.00 58.00 C ANISOU 1158 CE LYS A 599 6588 6615 8835 197 -240 392 C ATOM 1159 NZ LYS A 599 2.641 27.124 -1.765 1.00 69.76 N ANISOU 1159 NZ LYS A 599 8128 8151 10229 180 -318 484 N ATOM 0 H LYS A 599 5.460 25.154 2.390 1.00 28.66 H new ATOM 0 HA LYS A 599 3.678 25.683 4.223 1.00 28.77 H new ATOM 0 HB2 LYS A 599 3.241 24.399 1.748 1.00 29.23 H new ATOM 0 HB3 LYS A 599 2.071 24.865 2.668 1.00 29.23 H new ATOM 0 HG2 LYS A 599 2.776 27.118 2.415 1.00 37.83 H new ATOM 0 HG3 LYS A 599 3.937 26.648 1.486 1.00 37.83 H new ATOM 0 HD2 LYS A 599 2.150 25.657 0.074 1.00 45.75 H new ATOM 0 HD3 LYS A 599 1.172 26.567 0.879 1.00 45.75 H new ATOM 0 HE2 LYS A 599 1.594 28.226 -0.414 1.00 58.00 H new ATOM 0 HE3 LYS A 599 3.113 28.147 -0.072 1.00 58.00 H new ATOM 0 HZ1 LYS A 599 2.799 27.812 -2.308 1.00 69.76 H new ATOM 0 HZ2 LYS A 599 3.354 26.592 -1.745 1.00 69.76 H new ATOM 0 HZ3 LYS A 599 1.939 26.666 -2.064 1.00 69.76 H new ATOM 1160 N ILE A 600 4.244 22.585 3.979 1.00 26.24 N ANISOU 1160 N ILE A 600 2724 2921 4324 154 -51 34 N ATOM 1161 CA ILE A 600 4.082 21.336 4.701 1.00 26.39 C ANISOU 1161 CA ILE A 600 2761 3000 4266 156 -21 7 C ATOM 1162 C ILE A 600 4.850 21.371 6.028 1.00 29.22 C ANISOU 1162 C ILE A 600 3158 3386 4559 174 42 -86 C ATOM 1163 O ILE A 600 4.378 20.782 6.997 1.00 28.19 O ANISOU 1163 O ILE A 600 3027 3283 4401 197 97 -114 O ATOM 1164 CB ILE A 600 4.405 20.125 3.812 1.00 28.81 C ANISOU 1164 CB ILE A 600 3103 3359 4484 123 -80 53 C ATOM 1165 CG1 ILE A 600 3.701 18.844 4.371 1.00 30.52 C ANISOU 1165 CG1 ILE A 600 3308 3610 4677 127 -57 53 C ATOM 1166 CG2 ILE A 600 5.930 19.961 3.555 1.00 25.00 C ANISOU 1166 CG2 ILE A 600 2685 2915 3899 101 -96 29 C ATOM 1167 CD1 ILE A 600 3.850 17.542 3.424 1.00 30.07 C ANISOU 1167 CD1 ILE A 600 3280 3594 4552 94 -125 95 C ATOM 0 H ILE A 600 4.750 22.544 3.285 1.00 26.24 H new ATOM 0 HA ILE A 600 3.148 21.228 4.940 1.00 26.39 H new ATOM 0 HB ILE A 600 4.037 20.281 2.928 1.00 28.81 H new ATOM 0 HG12 ILE A 600 4.069 18.640 5.245 1.00 30.52 H new ATOM 0 HG13 ILE A 600 2.758 19.034 4.497 1.00 30.52 H new ATOM 0 HG21 ILE A 600 6.082 19.186 2.991 1.00 25.00 H new ATOM 0 HG22 ILE A 600 6.271 20.754 3.113 1.00 25.00 H new ATOM 0 HG23 ILE A 600 6.390 19.840 4.401 1.00 25.00 H new ATOM 0 HD11 ILE A 600 3.392 16.791 3.832 1.00 30.07 H new ATOM 0 HD12 ILE A 600 3.459 17.727 2.556 1.00 30.07 H new ATOM 0 HD13 ILE A 600 4.789 17.326 3.315 1.00 30.07 H new ATOM 1168 N ALA A 601 6.003 22.087 6.088 1.00 25.50 N ANISOU 1168 N ALA A 601 2717 2904 4068 165 33 -132 N ATOM 1169 CA ALA A 601 6.760 22.232 7.343 1.00 24.44 C ANISOU 1169 CA ALA A 601 2617 2791 3876 185 74 -231 C ATOM 1170 C ALA A 601 5.902 23.030 8.325 1.00 28.70 C ANISOU 1170 C ALA A 601 3128 3289 4488 231 136 -284 C ATOM 1171 O ALA A 601 5.758 22.628 9.484 1.00 27.53 O ANISOU 1171 O ALA A 601 3005 3178 4276 265 191 -341 O ATOM 1172 CB ALA A 601 8.071 22.972 7.102 1.00 24.01 C ANISOU 1172 CB ALA A 601 2581 2716 3824 162 42 -266 C ATOM 0 H ALA A 601 6.353 22.490 5.414 1.00 25.50 H new ATOM 0 HA ALA A 601 6.968 21.354 7.698 1.00 24.44 H new ATOM 0 HB1 ALA A 601 8.554 23.057 7.939 1.00 24.01 H new ATOM 0 HB2 ALA A 601 8.611 22.476 6.467 1.00 24.01 H new ATOM 0 HB3 ALA A 601 7.884 23.855 6.746 1.00 24.01 H new ATOM 1173 N LEU A 602 5.286 24.128 7.845 1.00 26.73 N ANISOU 1173 N LEU A 602 2827 2961 4368 238 133 -260 N ATOM 1174 CA LEU A 602 4.457 24.985 8.701 1.00 28.10 C ANISOU 1174 CA LEU A 602 2967 3082 4627 286 195 -312 C ATOM 1175 C LEU A 602 3.121 24.355 9.061 1.00 33.85 C ANISOU 1175 C LEU A 602 3659 3826 5377 315 250 -277 C ATOM 1176 O LEU A 602 2.550 24.752 10.068 1.00 33.60 O ANISOU 1176 O LEU A 602 3617 3777 5372 364 326 -334 O ATOM 1177 CB LEU A 602 4.291 26.407 8.144 1.00 28.85 C ANISOU 1177 CB LEU A 602 3016 3078 4867 288 177 -302 C ATOM 1178 CG LEU A 602 5.603 27.203 7.907 1.00 33.69 C ANISOU 1178 CG LEU A 602 3653 3656 5492 260 137 -342 C ATOM 1179 CD1 LEU A 602 5.307 28.587 7.395 1.00 33.54 C ANISOU 1179 CD1 LEU A 602 3582 3528 5633 266 129 -320 C ATOM 1180 CD2 LEU A 602 6.482 27.251 9.166 1.00 35.72 C ANISOU 1180 CD2 LEU A 602 3961 3941 5671 276 159 -471 C ATOM 0 H LEU A 602 5.339 24.389 7.027 1.00 26.73 H new ATOM 0 HA LEU A 602 4.951 25.070 9.531 1.00 28.10 H new ATOM 0 HB2 LEU A 602 3.811 26.352 7.303 1.00 28.85 H new ATOM 0 HB3 LEU A 602 3.733 26.912 8.756 1.00 28.85 H new ATOM 0 HG LEU A 602 6.108 26.731 7.227 1.00 33.69 H new ATOM 0 HD11 LEU A 602 6.139 29.065 7.254 1.00 33.54 H new ATOM 0 HD12 LEU A 602 4.824 28.525 6.556 1.00 33.54 H new ATOM 0 HD13 LEU A 602 4.767 29.064 8.044 1.00 33.54 H new ATOM 0 HD21 LEU A 602 7.289 27.755 8.978 1.00 35.72 H new ATOM 0 HD22 LEU A 602 5.993 27.680 9.886 1.00 35.72 H new ATOM 0 HD23 LEU A 602 6.719 26.348 9.430 1.00 35.72 H new ATOM 1181 N CYS A 603 2.673 23.307 8.332 1.00 32.97 N ANISOU 1181 N CYS A 603 3531 3749 5247 288 218 -190 N ATOM 1182 CA CYS A 603 1.441 22.566 8.676 1.00 35.32 C ANISOU 1182 CA CYS A 603 3784 4058 5576 309 270 -151 C ATOM 1183 C CYS A 603 1.644 21.591 9.854 1.00 34.98 C ANISOU 1183 C CYS A 603 3791 4086 5414 330 340 -194 C ATOM 1184 O CYS A 603 0.685 20.924 10.245 1.00 32.75 O ANISOU 1184 O CYS A 603 3473 3814 5156 348 398 -158 O ATOM 1185 CB CYS A 603 0.917 21.814 7.456 1.00 38.38 C ANISOU 1185 CB CYS A 603 4134 4449 5999 271 196 -52 C ATOM 1186 SG CYS A 603 -0.078 22.822 6.346 1.00 45.27 S ANISOU 1186 SG CYS A 603 4922 5236 7042 273 138 20 S ATOM 0 H CYS A 603 3.074 23.011 7.631 1.00 32.97 H new ATOM 0 HA CYS A 603 0.786 23.223 8.959 1.00 35.32 H new ATOM 0 HB2 CYS A 603 1.670 21.453 6.962 1.00 38.38 H new ATOM 0 HB3 CYS A 603 0.386 21.060 7.756 1.00 38.38 H new ATOM 0 HG CYS A 603 0.643 23.458 5.627 1.00 45.27 H new ATOM 1187 N LEU A 604 2.894 21.445 10.353 1.00 30.28 N ANISOU 1187 N LEU A 604 3274 3539 4693 327 330 -259 N ATOM 1188 CA LEU A 604 3.248 20.501 11.403 1.00 30.76 C ANISOU 1188 CA LEU A 604 3393 3671 4623 348 381 -292 C ATOM 1189 C LEU A 604 2.230 20.393 12.558 1.00 35.53 C ANISOU 1189 C LEU A 604 3983 4282 5236 407 497 -305 C ATOM 1190 O LEU A 604 1.812 19.260 12.791 1.00 35.44 O ANISOU 1190 O LEU A 604 3970 4309 5189 407 535 -252 O ATOM 1191 CB LEU A 604 4.660 20.758 11.938 1.00 30.06 C ANISOU 1191 CB LEU A 604 3379 3617 4424 351 353 -379 C ATOM 1192 CG LEU A 604 5.238 19.730 12.921 1.00 32.33 C ANISOU 1192 CG LEU A 604 3738 3986 4561 372 382 -407 C ATOM 1193 CD1 LEU A 604 5.383 18.404 12.277 1.00 29.68 C ANISOU 1193 CD1 LEU A 604 3406 3690 4183 333 347 -328 C ATOM 1194 CD2 LEU A 604 6.579 20.199 13.454 1.00 32.28 C ANISOU 1194 CD2 LEU A 604 3793 4003 4471 380 340 -504 C ATOM 0 H LEU A 604 3.562 21.909 10.074 1.00 30.28 H new ATOM 0 HA LEU A 604 3.226 19.635 10.966 1.00 30.76 H new ATOM 0 HB2 LEU A 604 5.262 20.820 11.180 1.00 30.06 H new ATOM 0 HB3 LEU A 604 4.663 21.625 12.374 1.00 30.06 H new ATOM 0 HG LEU A 604 4.618 19.645 13.662 1.00 32.33 H new ATOM 0 HD11 LEU A 604 5.749 17.772 12.916 1.00 29.68 H new ATOM 0 HD12 LEU A 604 4.515 18.093 11.977 1.00 29.68 H new ATOM 0 HD13 LEU A 604 5.980 18.477 11.516 1.00 29.68 H new ATOM 0 HD21 LEU A 604 6.930 19.540 14.073 1.00 32.28 H new ATOM 0 HD22 LEU A 604 7.199 20.312 12.717 1.00 32.28 H new ATOM 0 HD23 LEU A 604 6.466 21.046 13.914 1.00 32.28 H new ATOM 1195 N PRO A 605 1.806 21.489 13.268 1.00 32.80 N ANISOU 1195 N PRO A 605 3626 3896 4941 457 560 -371 N ATOM 1196 CA PRO A 605 0.836 21.329 14.369 1.00 33.39 C ANISOU 1196 CA PRO A 605 3691 3981 5013 520 687 -380 C ATOM 1197 C PRO A 605 -0.504 20.684 14.005 1.00 36.56 C ANISOU 1197 C PRO A 605 4004 4361 5526 514 735 -276 C ATOM 1198 O PRO A 605 -1.164 20.110 14.872 1.00 37.08 O ANISOU 1198 O PRO A 605 4067 4453 5567 555 844 -257 O ATOM 1199 CB PRO A 605 0.609 22.772 14.866 1.00 35.72 C ANISOU 1199 CB PRO A 605 3978 4219 5377 569 728 -468 C ATOM 1200 CG PRO A 605 1.071 23.644 13.766 1.00 39.00 C ANISOU 1200 CG PRO A 605 4361 4570 5886 522 622 -466 C ATOM 1201 CD PRO A 605 2.197 22.915 13.125 1.00 33.91 C ANISOU 1201 CD PRO A 605 3763 3975 5146 464 527 -442 C ATOM 0 HA PRO A 605 1.198 20.712 15.025 1.00 33.39 H new ATOM 0 HB2 PRO A 605 -0.327 22.929 15.067 1.00 35.72 H new ATOM 0 HB3 PRO A 605 1.107 22.943 15.681 1.00 35.72 H new ATOM 0 HG2 PRO A 605 0.357 23.812 13.131 1.00 39.00 H new ATOM 0 HG3 PRO A 605 1.360 24.507 14.102 1.00 39.00 H new ATOM 0 HD2 PRO A 605 2.302 23.166 12.194 1.00 33.91 H new ATOM 0 HD3 PRO A 605 3.041 23.101 13.566 1.00 33.91 H new ATOM 1202 N ASN A 606 -0.890 20.752 12.737 1.00 31.06 N ANISOU 1202 N ASN A 606 3236 3617 4950 465 653 -206 N ATOM 1203 CA ASN A 606 -2.144 20.182 12.241 1.00 31.32 C ANISOU 1203 CA ASN A 606 3172 3619 5110 453 669 -111 C ATOM 1204 C ASN A 606 -2.003 18.752 11.770 1.00 33.83 C ANISOU 1204 C ASN A 606 3496 3979 5379 404 622 -43 C ATOM 1205 O ASN A 606 -2.996 18.044 11.670 1.00 33.02 O ANISOU 1205 O ASN A 606 3321 3859 5366 397 653 26 O ATOM 1206 CB ASN A 606 -2.657 21.033 11.076 1.00 34.17 C ANISOU 1206 CB ASN A 606 3453 3905 5626 430 588 -74 C ATOM 1207 CG ASN A 606 -2.985 22.440 11.477 1.00 55.62 C ANISOU 1207 CG ASN A 606 6145 6562 8428 479 637 -130 C ATOM 1208 OD1 ASN A 606 -2.339 23.394 11.040 1.00 54.35 O ANISOU 1208 OD1 ASN A 606 6005 6367 8278 470 574 -167 O ATOM 1209 ND2 ASN A 606 -3.946 22.587 12.364 1.00 45.27 N ANISOU 1209 ND2 ASN A 606 4788 5233 7179 535 760 -139 N ATOM 0 H ASN A 606 -0.423 21.138 12.126 1.00 31.06 H new ATOM 0 HA ASN A 606 -2.767 20.183 12.984 1.00 31.32 H new ATOM 0 HB2 ASN A 606 -1.987 21.050 10.375 1.00 34.17 H new ATOM 0 HB3 ASN A 606 -3.449 20.616 10.702 1.00 34.17 H new ATOM 0 HD21 ASN A 606 -4.142 23.370 12.659 1.00 45.27 H new ATOM 0 HD22 ASN A 606 -4.378 21.900 12.648 1.00 45.27 H new ATOM 1210 N ILE A 607 -0.782 18.345 11.454 1.00 31.67 N ANISOU 1210 N ILE A 607 3301 3751 4980 370 547 -65 N ATOM 1211 CA ILE A 607 -0.435 17.033 10.922 1.00 31.92 C ANISOU 1211 CA ILE A 607 3353 3820 4956 324 490 -14 C ATOM 1212 C ILE A 607 0.050 16.096 12.027 1.00 37.23 C ANISOU 1212 C ILE A 607 4094 4557 5495 347 563 -29 C ATOM 1213 O ILE A 607 -0.395 14.944 12.086 1.00 36.83 O ANISOU 1213 O ILE A 607 4021 4516 5456 334 589 32 O ATOM 1214 CB ILE A 607 0.594 17.203 9.746 1.00 33.77 C ANISOU 1214 CB ILE A 607 3625 4058 5148 276 361 -21 C ATOM 1215 CG1 ILE A 607 -0.004 18.065 8.591 1.00 33.75 C ANISOU 1215 CG1 ILE A 607 3555 3991 5277 257 288 14 C ATOM 1216 CG2 ILE A 607 1.135 15.863 9.244 1.00 32.68 C ANISOU 1216 CG2 ILE A 607 3522 3961 4933 234 304 13 C ATOM 1217 CD1 ILE A 607 0.882 18.230 7.358 1.00 39.87 C ANISOU 1217 CD1 ILE A 607 4366 4770 6014 215 173 26 C ATOM 0 H ILE A 607 -0.095 18.854 11.549 1.00 31.67 H new ATOM 0 HA ILE A 607 -1.226 16.607 10.556 1.00 31.92 H new ATOM 0 HB ILE A 607 1.357 17.684 10.103 1.00 33.77 H new ATOM 0 HG12 ILE A 607 -0.844 17.666 8.314 1.00 33.75 H new ATOM 0 HG13 ILE A 607 -0.210 18.946 8.941 1.00 33.75 H new ATOM 0 HG21 ILE A 607 1.763 16.018 8.522 1.00 32.68 H new ATOM 0 HG22 ILE A 607 1.584 15.403 9.970 1.00 32.68 H new ATOM 0 HG23 ILE A 607 0.400 15.318 8.922 1.00 32.68 H new ATOM 0 HD11 ILE A 607 0.424 18.778 6.702 1.00 39.87 H new ATOM 0 HD12 ILE A 607 1.714 18.658 7.612 1.00 39.87 H new ATOM 0 HD13 ILE A 607 1.071 17.359 6.976 1.00 39.87 H new ATOM 1218 N CYS A 608 0.977 16.567 12.867 1.00 34.97 N ANISOU 1218 N CYS A 608 3889 4310 5087 381 588 -108 N ATOM 1219 CA CYS A 608 1.548 15.778 13.971 1.00 36.28 C ANISOU 1219 CA CYS A 608 4133 4545 5107 413 648 -126 C ATOM 1220 C CYS A 608 0.961 16.302 15.261 1.00 38.66 C ANISOU 1220 C CYS A 608 4447 4854 5389 487 775 -164 C ATOM 1221 O CYS A 608 1.577 17.110 15.944 1.00 37.54 O ANISOU 1221 O CYS A 608 4366 4731 5165 526 784 -255 O ATOM 1222 CB CYS A 608 3.075 15.853 13.978 1.00 37.25 C ANISOU 1222 CB CYS A 608 4342 4713 5100 402 570 -190 C ATOM 1223 SG CYS A 608 3.861 15.043 12.571 1.00 41.24 S ANISOU 1223 SG CYS A 608 4845 5220 5603 326 443 -145 S ATOM 0 H CYS A 608 1.297 17.363 12.813 1.00 34.97 H new ATOM 0 HA CYS A 608 1.324 14.840 13.862 1.00 36.28 H new ATOM 0 HB2 CYS A 608 3.343 16.785 13.993 1.00 37.25 H new ATOM 0 HB3 CYS A 608 3.405 15.450 14.796 1.00 37.25 H new ATOM 0 HG CYS A 608 4.427 14.053 12.944 1.00 41.24 H new ATOM 1224 N THR A 609 -0.267 15.878 15.561 1.00 34.98 N ANISOU 1224 N THR A 609 3917 4367 5008 506 874 -97 N ATOM 1225 CA THR A 609 -1.013 16.373 16.717 1.00 34.89 C ANISOU 1225 CA THR A 609 3906 4357 4995 582 1016 -121 C ATOM 1226 C THR A 609 -0.685 15.613 18.009 1.00 37.98 C ANISOU 1226 C THR A 609 4387 4823 5220 636 1112 -122 C ATOM 1227 O THR A 609 -0.991 16.108 19.092 1.00 37.18 O ANISOU 1227 O THR A 609 4324 4742 5062 711 1224 -166 O ATOM 1228 CB THR A 609 -2.482 16.312 16.404 1.00 34.03 C ANISOU 1228 CB THR A 609 3675 4185 5070 579 1083 -43 C ATOM 1229 OG1 THR A 609 -2.790 14.940 16.161 1.00 31.15 O ANISOU 1229 OG1 THR A 609 3277 3827 4730 542 1088 54 O ATOM 1230 CG2 THR A 609 -2.856 17.153 15.184 1.00 30.15 C ANISOU 1230 CG2 THR A 609 3099 3621 4737 537 985 -41 C ATOM 0 H THR A 609 -0.692 15.292 15.097 1.00 34.98 H new ATOM 0 HA THR A 609 -0.747 17.291 16.882 1.00 34.89 H new ATOM 0 HB THR A 609 -2.988 16.675 17.148 1.00 34.03 H new ATOM 0 HG1 THR A 609 -3.618 14.854 16.047 1.00 31.15 H new ATOM 0 HG21 THR A 609 -3.810 17.082 15.022 1.00 30.15 H new ATOM 0 HG22 THR A 609 -2.624 18.081 15.347 1.00 30.15 H new ATOM 0 HG23 THR A 609 -2.372 16.831 14.408 1.00 30.15 H new ATOM 1231 N GLN A 610 -0.051 14.427 17.883 1.00 32.29 N ANISOU 1231 N GLN A 610 3707 4144 4419 604 1068 -73 N ATOM 1232 CA GLN A 610 0.263 13.565 19.022 1.00 33.37 C ANISOU 1232 CA GLN A 610 3928 4351 4402 654 1150 -51 C ATOM 1233 C GLN A 610 1.719 13.631 19.392 1.00 38.91 C ANISOU 1233 C GLN A 610 4742 5116 4925 667 1067 -132 C ATOM 1234 O GLN A 610 2.573 13.441 18.516 1.00 38.92 O ANISOU 1234 O GLN A 610 4745 5113 4928 607 939 -142 O ATOM 1235 CB GLN A 610 -0.109 12.086 18.719 1.00 34.35 C ANISOU 1235 CB GLN A 610 4010 4467 4574 615 1168 70 C ATOM 1236 CG GLN A 610 -0.321 11.265 19.972 1.00 40.29 C ANISOU 1236 CG GLN A 610 4816 5269 5222 678 1307 128 C ATOM 1237 CD GLN A 610 -0.701 9.840 19.716 1.00 52.05 C ANISOU 1237 CD GLN A 610 6261 6739 6778 640 1331 249 C ATOM 1238 OE1 GLN A 610 -0.134 8.932 20.328 1.00 43.99 O ANISOU 1238 OE1 GLN A 610 5315 5767 5634 662 1354 288 O ATOM 1239 NE2 GLN A 610 -1.735 9.617 18.894 1.00 35.85 N ANISOU 1239 NE2 GLN A 610 4084 4610 4929 588 1332 314 N ATOM 0 H GLN A 610 0.206 14.108 17.127 1.00 32.29 H new ATOM 0 HA GLN A 610 -0.264 13.891 19.768 1.00 33.37 H new ATOM 0 HB2 GLN A 610 -0.917 12.064 18.182 1.00 34.35 H new ATOM 0 HB3 GLN A 610 0.595 11.682 18.188 1.00 34.35 H new ATOM 0 HG2 GLN A 610 0.493 11.282 20.499 1.00 40.29 H new ATOM 0 HG3 GLN A 610 -1.014 11.683 20.507 1.00 40.29 H new ATOM 0 HE21 GLN A 610 -2.107 10.274 18.483 1.00 35.85 H new ATOM 0 HE22 GLN A 610 -2.027 8.816 18.777 1.00 35.85 H new ATOM 1240 N PRO A 611 2.037 13.818 20.696 1.00 36.95 N ANISOU 1240 N PRO A 611 4590 4930 4518 747 1138 -185 N ATOM 1241 CA PRO A 611 3.455 13.808 21.113 1.00 36.02 C ANISOU 1241 CA PRO A 611 4579 4877 4232 762 1047 -262 C ATOM 1242 C PRO A 611 4.167 12.544 20.648 1.00 38.03 C ANISOU 1242 C PRO A 611 4845 5155 4450 715 974 -191 C ATOM 1243 O PRO A 611 3.580 11.458 20.659 1.00 36.05 O ANISOU 1243 O PRO A 611 4567 4900 4230 707 1040 -82 O ATOM 1244 CB PRO A 611 3.370 13.899 22.643 1.00 39.00 C ANISOU 1244 CB PRO A 611 5054 5321 4444 865 1157 -299 C ATOM 1245 CG PRO A 611 2.056 14.637 22.891 1.00 44.22 C ANISOU 1245 CG PRO A 611 5657 5936 5208 902 1287 -299 C ATOM 1246 CD PRO A 611 1.140 14.050 21.854 1.00 39.39 C ANISOU 1246 CD PRO A 611 4920 5257 4788 832 1303 -181 C ATOM 0 HA PRO A 611 3.973 14.531 20.726 1.00 36.02 H new ATOM 0 HB2 PRO A 611 3.367 13.020 23.052 1.00 39.00 H new ATOM 0 HB3 PRO A 611 4.125 14.382 23.014 1.00 39.00 H new ATOM 0 HG2 PRO A 611 1.724 14.487 23.790 1.00 44.22 H new ATOM 0 HG3 PRO A 611 2.156 15.596 22.781 1.00 44.22 H new ATOM 0 HD2 PRO A 611 0.733 13.225 22.162 1.00 39.39 H new ATOM 0 HD3 PRO A 611 0.417 14.657 21.631 1.00 39.39 H new ATOM 1247 N ILE A 612 5.401 12.702 20.170 1.00 35.57 N ANISOU 1247 N ILE A 612 4563 4856 4095 679 839 -252 N ATOM 1248 CA ILE A 612 6.186 11.576 19.652 1.00 35.60 C ANISOU 1248 CA ILE A 612 4576 4878 4071 635 762 -198 C ATOM 1249 C ILE A 612 7.151 11.079 20.727 1.00 38.98 C ANISOU 1249 C ILE A 612 5111 5387 4313 693 751 -222 C ATOM 1250 O ILE A 612 8.070 11.801 21.083 1.00 39.41 O ANISOU 1250 O ILE A 612 5218 5471 4285 715 679 -325 O ATOM 1251 CB ILE A 612 6.891 11.885 18.291 1.00 37.57 C ANISOU 1251 CB ILE A 612 4780 5088 4408 557 630 -227 C ATOM 1252 CG1 ILE A 612 5.896 12.456 17.250 1.00 37.45 C ANISOU 1252 CG1 ILE A 612 4667 4997 4567 509 634 -202 C ATOM 1253 CG2 ILE A 612 7.620 10.631 17.747 1.00 36.96 C ANISOU 1253 CG2 ILE A 612 4710 5024 4308 517 566 -168 C ATOM 1254 CD1 ILE A 612 6.533 13.094 16.027 1.00 43.33 C ANISOU 1254 CD1 ILE A 612 5377 5704 5384 447 518 -238 C ATOM 0 H ILE A 612 5.806 13.460 20.136 1.00 35.57 H new ATOM 0 HA ILE A 612 5.570 10.856 19.442 1.00 35.60 H new ATOM 0 HB ILE A 612 7.558 12.570 18.455 1.00 37.57 H new ATOM 0 HG12 ILE A 612 5.312 11.740 16.956 1.00 37.45 H new ATOM 0 HG13 ILE A 612 5.337 13.117 17.687 1.00 37.45 H new ATOM 0 HG21 ILE A 612 8.049 10.846 16.904 1.00 36.96 H new ATOM 0 HG22 ILE A 612 8.290 10.343 18.386 1.00 36.96 H new ATOM 0 HG23 ILE A 612 6.978 9.917 17.610 1.00 36.96 H new ATOM 0 HD11 ILE A 612 5.839 13.422 15.434 1.00 43.33 H new ATOM 0 HD12 ILE A 612 7.096 13.833 16.304 1.00 43.33 H new ATOM 0 HD13 ILE A 612 7.071 12.435 15.561 1.00 43.33 H new ATOM 1255 N PRO A 613 6.979 9.859 21.261 1.00 36.23 N ANISOU 1255 N PRO A 613 4793 5070 3901 719 815 -127 N ATOM 1256 CA PRO A 613 7.921 9.393 22.285 1.00 36.17 C ANISOU 1256 CA PRO A 613 4891 5142 3710 781 794 -143 C ATOM 1257 C PRO A 613 9.256 9.029 21.681 1.00 38.48 C ANISOU 1257 C PRO A 613 5192 5445 3986 737 652 -170 C ATOM 1258 O PRO A 613 9.347 8.561 20.542 1.00 37.03 O ANISOU 1258 O PRO A 613 4942 5213 3915 665 601 -128 O ATOM 1259 CB PRO A 613 7.236 8.165 22.889 1.00 38.75 C ANISOU 1259 CB PRO A 613 5235 5485 4004 816 914 -12 C ATOM 1260 CG PRO A 613 6.351 7.656 21.811 1.00 43.64 C ANISOU 1260 CG PRO A 613 5743 6024 4814 741 941 74 C ATOM 1261 CD PRO A 613 5.933 8.850 20.982 1.00 39.04 C ANISOU 1261 CD PRO A 613 5089 5388 4358 697 904 2 C ATOM 0 HA PRO A 613 8.114 10.076 22.946 1.00 36.17 H new ATOM 0 HB2 PRO A 613 7.885 7.496 23.157 1.00 38.75 H new ATOM 0 HB3 PRO A 613 6.727 8.400 23.681 1.00 38.75 H new ATOM 0 HG2 PRO A 613 6.817 7.004 21.264 1.00 43.64 H new ATOM 0 HG3 PRO A 613 5.575 7.210 22.186 1.00 43.64 H new ATOM 0 HD2 PRO A 613 5.893 8.631 20.038 1.00 39.04 H new ATOM 0 HD3 PRO A 613 5.053 9.170 21.237 1.00 39.04 H new ATOM 1262 N LEU A 614 10.292 9.269 22.455 1.00 34.18 N ANISOU 1262 N LEU A 614 4727 4961 3298 786 587 -245 N ATOM 1263 CA LEU A 614 11.638 8.914 22.100 1.00 32.87 C ANISOU 1263 CA LEU A 614 4574 4813 3103 761 458 -273 C ATOM 1264 C LEU A 614 11.779 7.405 22.292 1.00 35.99 C ANISOU 1264 C LEU A 614 4993 5230 3452 773 482 -158 C ATOM 1265 O LEU A 614 11.290 6.854 23.282 1.00 33.75 O ANISOU 1265 O LEU A 614 4767 4986 3072 838 575 -93 O ATOM 1266 CB LEU A 614 12.606 9.646 23.037 1.00 33.67 C ANISOU 1266 CB LEU A 614 4752 4973 3067 819 382 -391 C ATOM 1267 CG LEU A 614 12.598 11.189 22.950 1.00 38.13 C ANISOU 1267 CG LEU A 614 5298 5508 3680 810 349 -520 C ATOM 1268 CD1 LEU A 614 13.538 11.771 23.990 1.00 38.97 C ANISOU 1268 CD1 LEU A 614 5487 5673 3645 874 269 -640 C ATOM 1269 CD2 LEU A 614 13.026 11.686 21.534 1.00 35.47 C ANISOU 1269 CD2 LEU A 614 4868 5103 3508 716 266 -546 C ATOM 0 H LEU A 614 10.227 9.653 23.222 1.00 34.18 H new ATOM 0 HA LEU A 614 11.837 9.159 21.183 1.00 32.87 H new ATOM 0 HB2 LEU A 614 12.400 9.390 23.950 1.00 33.67 H new ATOM 0 HB3 LEU A 614 13.506 9.334 22.851 1.00 33.67 H new ATOM 0 HG LEU A 614 11.691 11.488 23.118 1.00 38.13 H new ATOM 0 HD11 LEU A 614 13.528 12.739 23.930 1.00 38.97 H new ATOM 0 HD12 LEU A 614 13.249 11.500 24.875 1.00 38.97 H new ATOM 0 HD13 LEU A 614 14.438 11.447 23.830 1.00 38.97 H new ATOM 0 HD21 LEU A 614 13.011 12.656 21.513 1.00 35.47 H new ATOM 0 HD22 LEU A 614 13.923 11.373 21.338 1.00 35.47 H new ATOM 0 HD23 LEU A 614 12.411 11.339 20.869 1.00 35.47 H new ATOM 1270 N LEU A 615 12.404 6.735 21.319 1.00 32.77 N ANISOU 1270 N LEU A 615 4540 4792 3119 714 407 -126 N ATOM 1271 CA LEU A 615 12.691 5.308 21.384 1.00 32.12 C ANISOU 1271 CA LEU A 615 4473 4718 3011 720 412 -27 C ATOM 1272 C LEU A 615 14.052 5.252 22.069 1.00 35.76 C ANISOU 1272 C LEU A 615 5003 5245 3341 768 314 -81 C ATOM 1273 O LEU A 615 15.094 5.143 21.422 1.00 34.34 O ANISOU 1273 O LEU A 615 4795 5055 3196 732 210 -116 O ATOM 1274 CB LEU A 615 12.718 4.666 19.978 1.00 30.99 C ANISOU 1274 CB LEU A 615 4252 4509 3016 637 374 16 C ATOM 1275 CG LEU A 615 11.418 4.695 19.163 1.00 35.69 C ANISOU 1275 CG LEU A 615 4771 5034 3755 584 443 64 C ATOM 1276 CD1 LEU A 615 11.619 4.045 17.815 1.00 34.80 C ANISOU 1276 CD1 LEU A 615 4598 4865 3758 511 385 91 C ATOM 1277 CD2 LEU A 615 10.274 4.015 19.900 1.00 39.06 C ANISOU 1277 CD2 LEU A 615 5206 5456 4180 619 573 166 C ATOM 0 H LEU A 615 12.675 7.108 20.593 1.00 32.77 H new ATOM 0 HA LEU A 615 12.013 4.807 21.864 1.00 32.12 H new ATOM 0 HB2 LEU A 615 13.407 5.110 19.459 1.00 30.99 H new ATOM 0 HB3 LEU A 615 12.989 3.740 20.077 1.00 30.99 H new ATOM 0 HG LEU A 615 11.181 5.627 19.035 1.00 35.69 H new ATOM 0 HD11 LEU A 615 10.788 4.073 17.315 1.00 34.80 H new ATOM 0 HD12 LEU A 615 12.307 4.522 17.325 1.00 34.80 H new ATOM 0 HD13 LEU A 615 11.891 3.122 17.938 1.00 34.80 H new ATOM 0 HD21 LEU A 615 9.471 4.052 19.357 1.00 39.06 H new ATOM 0 HD22 LEU A 615 10.505 3.089 20.072 1.00 39.06 H new ATOM 0 HD23 LEU A 615 10.115 4.470 20.742 1.00 39.06 H new ATOM 1278 N ALA A 616 14.013 5.396 23.391 1.00 33.73 N ANISOU 1278 N ALA A 616 4832 5053 2929 854 350 -92 N ATOM 1279 CA ALA A 616 15.167 5.434 24.286 1.00 34.77 C ANISOU 1279 CA ALA A 616 5042 5258 2911 918 257 -149 C ATOM 1280 C ALA A 616 15.758 4.058 24.498 1.00 41.45 C ANISOU 1280 C ALA A 616 5916 6124 3709 943 235 -50 C ATOM 1281 O ALA A 616 15.091 3.041 24.286 1.00 39.05 O ANISOU 1281 O ALA A 616 5594 5788 3457 930 322 72 O ATOM 1282 CB ALA A 616 14.762 6.039 25.623 1.00 36.06 C ANISOU 1282 CB ALA A 616 5300 5486 2915 1009 311 -191 C ATOM 0 H ALA A 616 13.269 5.479 23.814 1.00 33.73 H new ATOM 0 HA ALA A 616 15.848 5.985 23.870 1.00 34.77 H new ATOM 0 HB1 ALA A 616 15.531 6.062 26.214 1.00 36.06 H new ATOM 0 HB2 ALA A 616 14.434 6.941 25.484 1.00 36.06 H new ATOM 0 HB3 ALA A 616 14.063 5.499 26.024 1.00 36.06 H new ATOM 1283 N ALA A 617 17.008 4.035 24.958 1.00 41.58 N ANISOU 1283 N ALA A 617 5973 6190 3633 980 115 -103 N ATOM 1284 CA ALA A 617 17.752 2.822 25.266 1.00 42.88 C ANISOU 1284 CA ALA A 617 6170 6381 3741 1016 73 -22 C ATOM 1285 C ALA A 617 16.957 1.889 26.197 1.00 46.30 C ANISOU 1285 C ALA A 617 6676 6844 4074 1086 195 112 C ATOM 1286 O ALA A 617 16.352 2.349 27.161 1.00 46.73 O ANISOU 1286 O ALA A 617 6803 6947 4005 1151 267 104 O ATOM 1287 CB ALA A 617 19.074 3.196 25.907 1.00 44.56 C ANISOU 1287 CB ALA A 617 6429 6657 3846 1067 -72 -115 C ATOM 0 H ALA A 617 17.459 4.752 25.103 1.00 41.58 H new ATOM 0 HA ALA A 617 17.910 2.342 24.438 1.00 42.88 H new ATOM 0 HB1 ALA A 617 19.573 2.390 26.114 1.00 44.56 H new ATOM 0 HB2 ALA A 617 19.587 3.745 25.294 1.00 44.56 H new ATOM 0 HB3 ALA A 617 18.909 3.692 26.724 1.00 44.56 H new ATOM 1288 N ALA A 618 16.939 0.587 25.870 1.00 43.37 N ANISOU 1288 N ALA A 618 6281 6435 3762 1072 226 236 N ATOM 1289 CA ALA A 618 16.272 -0.510 26.608 1.00 44.73 C ANISOU 1289 CA ALA A 618 6507 6615 3873 1129 343 389 C ATOM 1290 C ALA A 618 14.747 -0.529 26.446 1.00 48.85 C ANISOU 1290 C ALA A 618 6994 7088 4477 1101 507 460 C ATOM 1291 O ALA A 618 14.100 -1.461 26.914 1.00 49.79 O ANISOU 1291 O ALA A 618 7138 7196 4585 1134 619 597 O ATOM 1292 CB ALA A 618 16.668 -0.517 28.088 1.00 46.92 C ANISOU 1292 CB ALA A 618 6911 6994 3924 1247 330 402 C ATOM 0 H ALA A 618 17.341 0.300 25.166 1.00 43.37 H new ATOM 0 HA ALA A 618 16.595 -1.328 26.199 1.00 44.73 H new ATOM 0 HB1 ALA A 618 16.215 -1.245 28.541 1.00 46.92 H new ATOM 0 HB2 ALA A 618 17.628 -0.635 28.166 1.00 46.92 H new ATOM 0 HB3 ALA A 618 16.412 0.325 28.496 1.00 46.92 H new ATOM 1293 N MET A 619 14.182 0.452 25.731 1.00 43.89 N ANISOU 1293 N MET A 619 6302 6423 3952 1038 519 376 N ATOM 1294 CA MET A 619 12.754 0.459 25.466 1.00 43.44 C ANISOU 1294 CA MET A 619 6194 6311 4000 1006 660 438 C ATOM 1295 C MET A 619 12.436 -0.524 24.331 1.00 45.38 C ANISOU 1295 C MET A 619 6345 6461 4435 923 670 518 C ATOM 1296 O MET A 619 13.179 -0.613 23.350 1.00 44.54 O ANISOU 1296 O MET A 619 6191 6322 4411 864 561 467 O ATOM 1297 CB MET A 619 12.300 1.862 25.047 1.00 45.25 C ANISOU 1297 CB MET A 619 6383 6529 4282 969 656 320 C ATOM 1298 CG MET A 619 11.989 2.792 26.195 1.00 49.38 C ANISOU 1298 CG MET A 619 6987 7122 4653 1051 712 262 C ATOM 1299 SD MET A 619 11.498 4.444 25.593 1.00 52.36 S ANISOU 1299 SD MET A 619 7304 7467 5123 1002 699 120 S ATOM 1300 CE MET A 619 9.949 4.072 24.767 1.00 48.33 C ANISOU 1300 CE MET A 619 6684 6863 4814 937 833 224 C ATOM 0 H MET A 619 14.613 1.116 25.395 1.00 43.89 H new ATOM 0 HA MET A 619 12.287 0.196 26.274 1.00 43.44 H new ATOM 0 HB2 MET A 619 12.993 2.263 24.500 1.00 45.25 H new ATOM 0 HB3 MET A 619 11.510 1.780 24.489 1.00 45.25 H new ATOM 0 HG2 MET A 619 11.276 2.417 26.734 1.00 49.38 H new ATOM 0 HG3 MET A 619 12.767 2.872 26.769 1.00 49.38 H new ATOM 0 HE1 MET A 619 9.442 4.890 24.647 1.00 48.33 H new ATOM 0 HE2 MET A 619 10.131 3.675 23.901 1.00 48.33 H new ATOM 0 HE3 MET A 619 9.436 3.450 25.306 1.00 48.33 H new ATOM 1301 N ASN A 620 11.332 -1.253 24.474 1.00 42.16 N ANISOU 1301 N ASN A 620 5912 6007 4098 921 802 640 N ATOM 1302 CA ASN A 620 10.784 -2.163 23.468 1.00 41.06 C ANISOU 1302 CA ASN A 620 5680 5767 4152 844 825 715 C ATOM 1303 C ASN A 620 9.496 -1.470 23.129 1.00 43.81 C ANISOU 1303 C ASN A 620 5961 6075 4608 805 911 704 C ATOM 1304 O ASN A 620 8.502 -1.628 23.831 1.00 44.55 O ANISOU 1304 O ASN A 620 6060 6167 4702 841 1050 789 O ATOM 1305 CB ASN A 620 10.560 -3.582 24.019 1.00 39.75 C ANISOU 1305 CB ASN A 620 5534 5575 3994 877 907 871 C ATOM 1306 CG ASN A 620 11.817 -4.414 23.936 1.00 53.08 C ANISOU 1306 CG ASN A 620 7256 7271 5641 891 802 883 C ATOM 1307 OD1 ASN A 620 12.167 -4.971 22.887 1.00 40.91 O ANISOU 1307 OD1 ASN A 620 5655 5663 4228 826 729 868 O ATOM 1308 ND2 ASN A 620 12.574 -4.426 25.011 1.00 43.25 N ANISOU 1308 ND2 ASN A 620 6110 6111 4211 980 781 894 N ATOM 0 H ASN A 620 10.860 -1.230 25.192 1.00 42.16 H new ATOM 0 HA ASN A 620 11.367 -2.313 22.708 1.00 41.06 H new ATOM 0 HB2 ASN A 620 10.266 -3.529 24.942 1.00 39.75 H new ATOM 0 HB3 ASN A 620 9.850 -4.016 23.520 1.00 39.75 H new ATOM 0 HD21 ASN A 620 13.334 -4.828 24.997 1.00 43.25 H new ATOM 0 HD22 ASN A 620 12.309 -4.032 25.728 1.00 43.25 H new ATOM 1309 N HIS A 621 9.554 -0.585 22.127 1.00 38.20 N ANISOU 1309 N HIS A 621 5194 5342 3980 741 831 595 N ATOM 1310 CA HIS A 621 8.419 0.259 21.808 1.00 37.28 C ANISOU 1310 CA HIS A 621 5014 5191 3958 711 894 570 C ATOM 1311 C HIS A 621 8.319 0.505 20.315 1.00 37.31 C ANISOU 1311 C HIS A 621 4927 5127 4121 617 807 514 C ATOM 1312 O HIS A 621 9.336 0.542 19.638 1.00 35.34 O ANISOU 1312 O HIS A 621 4684 4882 3861 588 688 450 O ATOM 1313 CB HIS A 621 8.574 1.593 22.581 1.00 37.93 C ANISOU 1313 CB HIS A 621 5158 5350 3905 769 901 473 C ATOM 1314 CG HIS A 621 7.355 2.458 22.574 1.00 41.25 C ANISOU 1314 CG HIS A 621 5528 5745 4402 763 994 458 C ATOM 1315 ND1 HIS A 621 6.435 2.415 23.604 1.00 44.54 N ANISOU 1315 ND1 HIS A 621 5970 6181 4774 827 1148 527 N ATOM 1316 CD2 HIS A 621 6.963 3.386 21.670 1.00 41.67 C ANISOU 1316 CD2 HIS A 621 5508 5755 4571 706 952 384 C ATOM 1317 CE1 HIS A 621 5.501 3.297 23.283 1.00 44.13 C ANISOU 1317 CE1 HIS A 621 5852 6094 4823 805 1196 490 C ATOM 1318 NE2 HIS A 621 5.783 3.906 22.125 1.00 42.90 N ANISOU 1318 NE2 HIS A 621 5637 5899 4766 732 1076 405 N ATOM 0 H HIS A 621 10.243 -0.465 21.627 1.00 38.20 H new ATOM 0 HA HIS A 621 7.598 -0.184 22.075 1.00 37.28 H new ATOM 0 HB2 HIS A 621 8.811 1.395 23.501 1.00 37.93 H new ATOM 0 HB3 HIS A 621 9.313 2.092 22.198 1.00 37.93 H new ATOM 0 HD1 HIS A 621 6.463 1.919 24.306 1.00 44.54 H new ATOM 0 HD2 HIS A 621 7.410 3.624 20.890 1.00 41.67 H new ATOM 0 HE1 HIS A 621 4.745 3.471 23.797 1.00 44.13 H new ATOM 1319 N SER A 622 7.082 0.685 19.814 1.00 32.22 N ANISOU 1319 N SER A 622 4199 4420 3624 575 867 542 N ATOM 1320 CA SER A 622 6.815 0.945 18.412 1.00 30.96 C ANISOU 1320 CA SER A 622 3956 4197 3612 493 787 496 C ATOM 1321 C SER A 622 6.076 2.243 18.212 1.00 33.80 C ANISOU 1321 C SER A 622 4272 4550 4019 483 806 437 C ATOM 1322 O SER A 622 5.267 2.611 19.038 1.00 33.35 O ANISOU 1322 O SER A 622 4214 4504 3952 526 918 467 O ATOM 1323 CB SER A 622 6.001 -0.191 17.794 1.00 34.20 C ANISOU 1323 CB SER A 622 4289 4518 4187 441 813 585 C ATOM 1324 OG SER A 622 6.702 -1.416 17.892 1.00 41.15 O ANISOU 1324 OG SER A 622 5204 5390 5040 447 789 637 O ATOM 0 H SER A 622 6.372 0.656 20.299 1.00 32.22 H new ATOM 0 HA SER A 622 7.677 1.008 17.971 1.00 30.96 H new ATOM 0 HB2 SER A 622 5.145 -0.265 18.245 1.00 34.20 H new ATOM 0 HB3 SER A 622 5.815 0.007 16.863 1.00 34.20 H new ATOM 0 HG SER A 622 7.182 -1.520 17.210 1.00 41.15 H new ATOM 1325 N ILE A 623 6.361 2.931 17.108 1.00 31.06 N ANISOU 1325 N ILE A 623 3892 4184 3725 431 702 358 N ATOM 1326 CA ILE A 623 5.664 4.153 16.692 1.00 30.64 C ANISOU 1326 CA ILE A 623 3787 4110 3743 413 703 306 C ATOM 1327 C ILE A 623 5.100 3.911 15.279 1.00 32.46 C ANISOU 1327 C ILE A 623 3931 4266 4136 337 637 319 C ATOM 1328 O ILE A 623 5.863 3.591 14.399 1.00 28.73 O ANISOU 1328 O ILE A 623 3468 3786 3662 299 537 291 O ATOM 1329 CB ILE A 623 6.553 5.430 16.698 1.00 32.55 C ANISOU 1329 CB ILE A 623 4075 4399 3895 428 634 195 C ATOM 1330 CG1 ILE A 623 7.124 5.733 18.112 1.00 33.36 C ANISOU 1330 CG1 ILE A 623 4267 4577 3830 508 682 165 C ATOM 1331 CG2 ILE A 623 5.732 6.634 16.149 1.00 32.76 C ANISOU 1331 CG2 ILE A 623 4037 4387 4024 406 636 155 C ATOM 1332 CD1 ILE A 623 8.293 6.806 18.129 1.00 33.09 C ANISOU 1332 CD1 ILE A 623 4280 4584 3707 518 588 47 C ATOM 0 H ILE A 623 6.983 2.695 16.563 1.00 31.06 H new ATOM 0 HA ILE A 623 4.964 4.327 17.340 1.00 30.64 H new ATOM 0 HB ILE A 623 7.317 5.276 16.120 1.00 32.55 H new ATOM 0 HG12 ILE A 623 6.403 6.047 18.680 1.00 33.36 H new ATOM 0 HG13 ILE A 623 7.452 4.907 18.501 1.00 33.36 H new ATOM 0 HG21 ILE A 623 6.285 7.431 16.152 1.00 32.76 H new ATOM 0 HG22 ILE A 623 5.445 6.444 15.242 1.00 32.76 H new ATOM 0 HG23 ILE A 623 4.954 6.778 16.710 1.00 32.76 H new ATOM 0 HD11 ILE A 623 8.595 6.941 19.041 1.00 33.09 H new ATOM 0 HD12 ILE A 623 9.032 6.488 17.587 1.00 33.09 H new ATOM 0 HD13 ILE A 623 7.967 7.646 17.769 1.00 33.09 H new ATOM 1333 N THR A 624 3.786 4.058 15.083 1.00 31.53 N ANISOU 1333 N THR A 624 3731 4094 4155 319 691 360 N ATOM 1334 CA THR A 624 3.168 3.999 13.769 1.00 32.65 C ANISOU 1334 CA THR A 624 3790 4168 4447 253 616 363 C ATOM 1335 C THR A 624 2.606 5.383 13.468 1.00 36.99 C ANISOU 1335 C THR A 624 4298 4709 5049 252 609 316 C ATOM 1336 O THR A 624 1.831 5.944 14.250 1.00 36.61 O ANISOU 1336 O THR A 624 4225 4661 5023 291 709 330 O ATOM 1337 CB THR A 624 2.145 2.849 13.603 1.00 39.72 C ANISOU 1337 CB THR A 624 4609 4993 5490 223 656 452 C ATOM 1338 OG1 THR A 624 2.838 1.616 13.803 1.00 39.73 O ANISOU 1338 OG1 THR A 624 4657 4998 5440 223 649 487 O ATOM 1339 CG2 THR A 624 1.549 2.822 12.193 1.00 32.95 C ANISOU 1339 CG2 THR A 624 3672 4068 4780 156 553 439 C ATOM 0 H THR A 624 3.227 4.196 15.722 1.00 31.53 H new ATOM 0 HA THR A 624 3.837 3.771 13.105 1.00 32.65 H new ATOM 0 HB THR A 624 1.427 2.980 14.242 1.00 39.72 H new ATOM 0 HG1 THR A 624 2.658 1.314 14.566 1.00 39.73 H new ATOM 0 HG21 THR A 624 0.914 2.092 12.124 1.00 32.95 H new ATOM 0 HG22 THR A 624 1.096 3.661 12.017 1.00 32.95 H new ATOM 0 HG23 THR A 624 2.259 2.696 11.544 1.00 32.95 H new ATOM 1340 N MET A 625 3.057 5.928 12.350 1.00 33.39 N ANISOU 1340 N MET A 625 3838 4244 4603 214 495 261 N ATOM 1341 CA MET A 625 2.725 7.251 11.853 1.00 33.75 C ANISOU 1341 CA MET A 625 3851 4276 4695 209 464 216 C ATOM 1342 C MET A 625 2.501 7.237 10.351 1.00 30.06 C ANISOU 1342 C MET A 625 3337 3765 4321 152 350 214 C ATOM 1343 O MET A 625 2.952 6.320 9.676 1.00 28.58 O ANISOU 1343 O MET A 625 3167 3571 4122 119 283 221 O ATOM 1344 CB MET A 625 3.806 8.274 12.275 1.00 36.77 C ANISOU 1344 CB MET A 625 4307 4714 4950 241 450 138 C ATOM 1345 CG MET A 625 5.220 7.925 11.875 1.00 42.33 C ANISOU 1345 CG MET A 625 5078 5456 5551 226 369 101 C ATOM 1346 SD MET A 625 6.522 9.110 12.460 1.00 48.39 S ANISOU 1346 SD MET A 625 5916 6278 6191 261 348 7 S ATOM 1347 CE MET A 625 5.771 10.612 12.136 1.00 45.12 C ANISOU 1347 CE MET A 625 5450 5824 5868 259 352 -25 C ATOM 0 H MET A 625 3.598 5.509 11.829 1.00 33.39 H new ATOM 0 HA MET A 625 1.887 7.529 12.255 1.00 33.75 H new ATOM 0 HB2 MET A 625 3.581 9.136 11.891 1.00 36.77 H new ATOM 0 HB3 MET A 625 3.775 8.376 13.239 1.00 36.77 H new ATOM 0 HG2 MET A 625 5.429 7.042 12.218 1.00 42.33 H new ATOM 0 HG3 MET A 625 5.263 7.871 10.907 1.00 42.33 H new ATOM 0 HE1 MET A 625 6.098 10.962 11.293 1.00 45.12 H new ATOM 0 HE2 MET A 625 4.810 10.489 12.084 1.00 45.12 H new ATOM 0 HE3 MET A 625 5.978 11.238 12.848 1.00 45.12 H new ATOM 1348 N SER A 626 1.825 8.245 9.828 1.00 24.85 N ANISOU 1348 N SER A 626 2623 3074 3746 144 326 203 N ATOM 1349 CA SER A 626 1.580 8.309 8.393 1.00 25.11 C ANISOU 1349 CA SER A 626 2619 3069 3852 98 210 204 C ATOM 1350 C SER A 626 2.779 8.873 7.638 1.00 30.85 C ANISOU 1350 C SER A 626 3412 3829 4480 87 127 152 C ATOM 1351 O SER A 626 3.581 9.666 8.193 1.00 29.83 O ANISOU 1351 O SER A 626 3332 3737 4265 114 156 108 O ATOM 1352 CB SER A 626 0.315 9.110 8.092 1.00 27.85 C ANISOU 1352 CB SER A 626 2875 3366 4343 97 211 226 C ATOM 1353 OG SER A 626 0.467 10.487 8.379 1.00 29.46 O ANISOU 1353 OG SER A 626 3089 3581 4524 127 237 188 O ATOM 0 H SER A 626 1.500 8.900 10.280 1.00 24.85 H new ATOM 0 HA SER A 626 1.445 7.401 8.080 1.00 25.11 H new ATOM 0 HB2 SER A 626 0.081 9.001 7.157 1.00 27.85 H new ATOM 0 HB3 SER A 626 -0.422 8.753 8.612 1.00 27.85 H new ATOM 0 HG SER A 626 -0.270 10.877 8.279 1.00 29.46 H new ATOM 1354 N GLN A 627 2.887 8.488 6.348 1.00 25.84 N ANISOU 1354 N GLN A 627 2778 3178 3863 49 24 155 N ATOM 1355 CA GLN A 627 3.949 9.003 5.495 1.00 24.02 C ANISOU 1355 CA GLN A 627 2604 2973 3548 39 -47 118 C ATOM 1356 C GLN A 627 3.777 10.514 5.387 1.00 27.50 C ANISOU 1356 C GLN A 627 3025 3404 4018 53 -45 106 C ATOM 1357 O GLN A 627 4.779 11.220 5.280 1.00 29.30 O ANISOU 1357 O GLN A 627 3300 3659 4175 59 -55 72 O ATOM 1358 CB GLN A 627 3.911 8.347 4.103 1.00 25.08 C ANISOU 1358 CB GLN A 627 2744 3091 3695 4 -152 127 C ATOM 1359 CG GLN A 627 4.366 6.887 4.078 1.00 27.01 C ANISOU 1359 CG GLN A 627 3022 3342 3899 -9 -163 125 C ATOM 1360 CD GLN A 627 4.105 6.343 2.695 1.00 41.26 C ANISOU 1360 CD GLN A 627 4827 5121 5728 -40 -271 122 C ATOM 1361 OE1 GLN A 627 2.957 6.134 2.295 1.00 34.17 O ANISOU 1361 OE1 GLN A 627 3867 4176 4940 -57 -315 145 O ATOM 1362 NE2 GLN A 627 5.162 6.106 1.932 1.00 32.17 N ANISOU 1362 NE2 GLN A 627 3745 3999 4477 -43 -317 92 N ATOM 0 H GLN A 627 2.354 7.934 5.962 1.00 25.84 H new ATOM 0 HA GLN A 627 4.813 8.792 5.883 1.00 24.02 H new ATOM 0 HB2 GLN A 627 3.006 8.398 3.758 1.00 25.08 H new ATOM 0 HB3 GLN A 627 4.473 8.860 3.501 1.00 25.08 H new ATOM 0 HG2 GLN A 627 5.309 6.822 4.296 1.00 27.01 H new ATOM 0 HG3 GLN A 627 3.884 6.370 4.743 1.00 27.01 H new ATOM 0 HE21 GLN A 627 5.953 6.260 2.233 1.00 32.17 H new ATOM 0 HE22 GLN A 627 5.057 5.799 1.136 1.00 32.17 H new ATOM 1363 N GLU A 628 2.528 11.024 5.448 1.00 22.85 N ANISOU 1363 N GLU A 628 2362 2773 3548 59 -30 133 N ATOM 1364 CA GLU A 628 2.289 12.475 5.414 1.00 24.14 C ANISOU 1364 CA GLU A 628 2500 2916 3756 77 -22 123 C ATOM 1365 C GLU A 628 2.899 13.178 6.657 1.00 27.91 C ANISOU 1365 C GLU A 628 3012 3420 4173 115 67 75 C ATOM 1366 O GLU A 628 3.544 14.218 6.518 1.00 24.87 O ANISOU 1366 O GLU A 628 2651 3036 3762 121 54 42 O ATOM 1367 CB GLU A 628 0.802 12.774 5.340 1.00 26.51 C ANISOU 1367 CB GLU A 628 2706 3162 4205 82 -16 163 C ATOM 1368 CG GLU A 628 0.537 14.263 5.209 1.00 38.59 C ANISOU 1368 CG GLU A 628 4207 4663 5793 103 -14 156 C ATOM 1369 CD GLU A 628 -0.918 14.658 5.295 1.00 60.23 C ANISOU 1369 CD GLU A 628 6846 7348 8692 117 6 193 C ATOM 1370 OE1 GLU A 628 -1.658 14.048 6.100 1.00 51.92 O ANISOU 1370 OE1 GLU A 628 5745 6285 7696 128 81 210 O ATOM 1371 OE2 GLU A 628 -1.315 15.586 4.558 1.00 58.16 O ANISOU 1371 OE2 GLU A 628 6547 7048 8502 120 -50 211 O ATOM 0 H GLU A 628 1.815 10.546 5.509 1.00 22.85 H new ATOM 0 HA GLU A 628 2.724 12.821 4.619 1.00 24.14 H new ATOM 0 HB2 GLU A 628 0.415 12.308 4.583 1.00 26.51 H new ATOM 0 HB3 GLU A 628 0.363 12.435 6.136 1.00 26.51 H new ATOM 0 HG2 GLU A 628 1.027 14.728 5.905 1.00 38.59 H new ATOM 0 HG3 GLU A 628 0.892 14.568 4.360 1.00 38.59 H new ATOM 1372 N GLN A 629 2.707 12.588 7.867 1.00 25.43 N ANISOU 1372 N GLN A 629 2702 3125 3834 140 156 73 N ATOM 1373 CA GLN A 629 3.319 13.107 9.104 1.00 24.99 C ANISOU 1373 CA GLN A 629 2694 3104 3697 182 232 19 C ATOM 1374 C GLN A 629 4.855 13.149 8.958 1.00 27.96 C ANISOU 1374 C GLN A 629 3146 3523 3956 173 183 -28 C ATOM 1375 O GLN A 629 5.485 14.155 9.306 1.00 26.94 O ANISOU 1375 O GLN A 629 3042 3400 3796 190 188 -83 O ATOM 1376 CB GLN A 629 2.878 12.252 10.297 1.00 26.61 C ANISOU 1376 CB GLN A 629 2902 3330 3878 213 330 40 C ATOM 1377 CG GLN A 629 1.440 12.594 10.732 1.00 26.99 C ANISOU 1377 CG GLN A 629 2872 3336 4045 237 410 73 C ATOM 1378 CD GLN A 629 0.793 11.626 11.674 1.00 32.62 C ANISOU 1378 CD GLN A 629 3570 4058 4766 260 512 121 C ATOM 1379 OE1 GLN A 629 1.110 10.432 11.689 1.00 24.57 O ANISOU 1379 OE1 GLN A 629 2575 3056 3703 243 504 154 O ATOM 1380 NE2 GLN A 629 -0.182 12.115 12.453 1.00 25.69 N ANISOU 1380 NE2 GLN A 629 2646 3160 3955 302 618 132 N ATOM 0 H GLN A 629 2.224 11.886 7.983 1.00 25.43 H new ATOM 0 HA GLN A 629 3.018 14.015 9.264 1.00 24.99 H new ATOM 0 HB2 GLN A 629 2.932 11.313 10.061 1.00 26.61 H new ATOM 0 HB3 GLN A 629 3.485 12.393 11.040 1.00 26.61 H new ATOM 0 HG2 GLN A 629 1.447 13.469 11.150 1.00 26.99 H new ATOM 0 HG3 GLN A 629 0.888 12.663 9.937 1.00 26.99 H new ATOM 0 HE21 GLN A 629 -0.380 12.951 12.420 1.00 25.69 H new ATOM 0 HE22 GLN A 629 -0.610 11.592 12.986 1.00 25.69 H new ATOM 1381 N ILE A 630 5.436 12.100 8.322 1.00 23.68 N ANISOU 1381 N ILE A 630 2631 3000 3365 143 130 -7 N ATOM 1382 CA ILE A 630 6.880 12.014 8.094 1.00 23.44 C ANISOU 1382 CA ILE A 630 2662 3008 3239 133 86 -44 C ATOM 1383 C ILE A 630 7.365 13.138 7.178 1.00 25.67 C ANISOU 1383 C ILE A 630 2940 3269 3543 115 32 -62 C ATOM 1384 O ILE A 630 8.363 13.777 7.501 1.00 22.63 O ANISOU 1384 O ILE A 630 2584 2901 3113 124 31 -110 O ATOM 1385 CB ILE A 630 7.314 10.608 7.620 1.00 25.71 C ANISOU 1385 CB ILE A 630 2976 3314 3480 111 51 -18 C ATOM 1386 CG1 ILE A 630 7.026 9.596 8.759 1.00 26.03 C ANISOU 1386 CG1 ILE A 630 3026 3373 3491 136 118 2 C ATOM 1387 CG2 ILE A 630 8.826 10.610 7.285 1.00 26.19 C ANISOU 1387 CG2 ILE A 630 3088 3408 3455 103 9 -54 C ATOM 1388 CD1 ILE A 630 7.051 8.139 8.359 1.00 24.83 C ANISOU 1388 CD1 ILE A 630 2882 3218 3335 115 95 40 C ATOM 0 H ILE A 630 4.995 11.428 8.017 1.00 23.68 H new ATOM 0 HA ILE A 630 7.322 12.146 8.948 1.00 23.44 H new ATOM 0 HB ILE A 630 6.821 10.358 6.823 1.00 25.71 H new ATOM 0 HG12 ILE A 630 7.678 9.733 9.464 1.00 26.03 H new ATOM 0 HG13 ILE A 630 6.155 9.797 9.136 1.00 26.03 H new ATOM 0 HG21 ILE A 630 9.093 9.726 6.988 1.00 26.19 H new ATOM 0 HG22 ILE A 630 9.001 11.254 6.581 1.00 26.19 H new ATOM 0 HG23 ILE A 630 9.333 10.852 8.076 1.00 26.19 H new ATOM 0 HD11 ILE A 630 6.861 7.587 9.134 1.00 24.83 H new ATOM 0 HD12 ILE A 630 6.381 7.979 7.676 1.00 24.83 H new ATOM 0 HD13 ILE A 630 7.928 7.914 8.010 1.00 24.83 H new ATOM 1389 N ALA A 631 6.627 13.413 6.084 1.00 23.07 N ANISOU 1389 N ALA A 631 2572 2902 3292 93 -12 -20 N ATOM 1390 CA ALA A 631 6.990 14.477 5.135 1.00 22.38 C ANISOU 1390 CA ALA A 631 2482 2791 3230 79 -59 -18 C ATOM 1391 C ALA A 631 7.025 15.833 5.837 1.00 26.50 C ANISOU 1391 C ALA A 631 2988 3289 3794 103 -19 -58 C ATOM 1392 O ALA A 631 7.944 16.608 5.594 1.00 26.13 O ANISOU 1392 O ALA A 631 2957 3236 3733 96 -35 -83 O ATOM 1393 CB ALA A 631 6.016 14.500 3.954 1.00 22.31 C ANISOU 1393 CB ALA A 631 2436 2748 3294 62 -117 39 C ATOM 0 H ALA A 631 5.908 12.989 5.877 1.00 23.07 H new ATOM 0 HA ALA A 631 7.878 14.292 4.791 1.00 22.38 H new ATOM 0 HB1 ALA A 631 6.269 15.206 3.339 1.00 22.31 H new ATOM 0 HB2 ALA A 631 6.044 13.646 3.495 1.00 22.31 H new ATOM 0 HB3 ALA A 631 5.117 14.662 4.279 1.00 22.31 H new ATOM 1394 N SER A 632 6.043 16.112 6.720 1.00 22.99 N ANISOU 1394 N SER A 632 2507 2825 3404 131 38 -67 N ATOM 1395 CA SER A 632 5.988 17.392 7.438 1.00 23.46 C ANISOU 1395 CA SER A 632 2552 2854 3506 160 80 -116 C ATOM 1396 C SER A 632 7.167 17.516 8.394 1.00 28.86 C ANISOU 1396 C SER A 632 3291 3575 4100 177 101 -192 C ATOM 1397 O SER A 632 7.841 18.537 8.418 1.00 27.91 O ANISOU 1397 O SER A 632 3175 3431 3997 177 86 -238 O ATOM 1398 CB SER A 632 4.671 17.542 8.186 1.00 24.50 C ANISOU 1398 CB SER A 632 2637 2961 3710 194 148 -109 C ATOM 1399 OG SER A 632 4.646 18.824 8.786 1.00 30.95 O ANISOU 1399 OG SER A 632 3444 3744 4572 224 184 -164 O ATOM 0 H SER A 632 5.404 15.570 6.912 1.00 22.99 H new ATOM 0 HA SER A 632 6.044 18.108 6.786 1.00 23.46 H new ATOM 0 HB2 SER A 632 3.923 17.439 7.577 1.00 24.50 H new ATOM 0 HB3 SER A 632 4.585 16.851 8.861 1.00 24.50 H new ATOM 0 HG SER A 632 4.562 19.411 8.191 1.00 30.95 H new ATOM 1400 N LEU A 633 7.454 16.436 9.133 1.00 25.85 N ANISOU 1400 N LEU A 633 2947 3247 3626 189 126 -202 N ATOM 1401 CA LEU A 633 8.613 16.368 9.999 1.00 24.45 C ANISOU 1401 CA LEU A 633 2824 3113 3352 207 128 -269 C ATOM 1402 C LEU A 633 9.955 16.500 9.231 1.00 26.10 C ANISOU 1402 C LEU A 633 3051 3329 3538 172 61 -281 C ATOM 1403 O LEU A 633 10.869 17.187 9.691 1.00 26.10 O ANISOU 1403 O LEU A 633 3066 3329 3522 180 47 -347 O ATOM 1404 CB LEU A 633 8.579 15.064 10.801 1.00 23.84 C ANISOU 1404 CB LEU A 633 2783 3091 3184 228 163 -254 C ATOM 1405 CG LEU A 633 7.525 14.993 11.909 1.00 27.41 C ANISOU 1405 CG LEU A 633 3230 3548 3635 275 252 -253 C ATOM 1406 CD1 LEU A 633 7.414 13.582 12.425 1.00 26.80 C ANISOU 1406 CD1 LEU A 633 3181 3515 3489 287 286 -207 C ATOM 1407 CD2 LEU A 633 7.873 15.905 13.089 1.00 24.58 C ANISOU 1407 CD2 LEU A 633 2908 3202 3227 324 285 -343 C ATOM 0 H LEU A 633 6.972 15.724 9.138 1.00 25.85 H new ATOM 0 HA LEU A 633 8.568 17.128 10.600 1.00 24.45 H new ATOM 0 HB2 LEU A 633 8.428 14.329 10.186 1.00 23.84 H new ATOM 0 HB3 LEU A 633 9.453 14.926 11.199 1.00 23.84 H new ATOM 0 HG LEU A 633 6.686 15.287 11.521 1.00 27.41 H new ATOM 0 HD11 LEU A 633 6.745 13.545 13.126 1.00 26.80 H new ATOM 0 HD12 LEU A 633 7.155 12.992 11.700 1.00 26.80 H new ATOM 0 HD13 LEU A 633 8.271 13.299 12.781 1.00 26.80 H new ATOM 0 HD21 LEU A 633 7.184 15.833 13.768 1.00 24.58 H new ATOM 0 HD22 LEU A 633 8.726 15.637 13.465 1.00 24.58 H new ATOM 0 HD23 LEU A 633 7.929 16.824 12.783 1.00 24.58 H new ATOM 1408 N LEU A 634 10.089 15.850 8.094 1.00 21.78 N ANISOU 1408 N LEU A 634 2499 2784 2991 138 22 -223 N ATOM 1409 CA LEU A 634 11.338 15.923 7.337 1.00 21.02 C ANISOU 1409 CA LEU A 634 2419 2696 2874 110 -24 -227 C ATOM 1410 C LEU A 634 11.545 17.312 6.683 1.00 25.60 C ANISOU 1410 C LEU A 634 2969 3222 3537 94 -41 -229 C ATOM 1411 O LEU A 634 12.700 17.736 6.534 1.00 25.29 O ANISOU 1411 O LEU A 634 2933 3179 3495 81 -60 -257 O ATOM 1412 CB LEU A 634 11.397 14.831 6.276 1.00 20.86 C ANISOU 1412 CB LEU A 634 2410 2693 2822 85 -55 -168 C ATOM 1413 CG LEU A 634 11.712 13.432 6.771 1.00 25.73 C ANISOU 1413 CG LEU A 634 3060 3357 3358 94 -48 -169 C ATOM 1414 CD1 LEU A 634 11.578 12.422 5.632 1.00 23.64 C ANISOU 1414 CD1 LEU A 634 2804 3096 3081 70 -81 -117 C ATOM 1415 CD2 LEU A 634 13.113 13.365 7.412 1.00 28.54 C ANISOU 1415 CD2 LEU A 634 3444 3748 3653 105 -56 -222 C ATOM 0 H LEU A 634 9.478 15.361 7.738 1.00 21.78 H new ATOM 0 HA LEU A 634 12.058 15.786 7.972 1.00 21.02 H new ATOM 0 HB2 LEU A 634 10.543 14.807 5.816 1.00 20.86 H new ATOM 0 HB3 LEU A 634 12.066 15.080 5.619 1.00 20.86 H new ATOM 0 HG LEU A 634 11.068 13.203 7.460 1.00 25.73 H new ATOM 0 HD11 LEU A 634 11.782 11.533 5.962 1.00 23.64 H new ATOM 0 HD12 LEU A 634 10.671 12.439 5.289 1.00 23.64 H new ATOM 0 HD13 LEU A 634 12.196 12.652 4.921 1.00 23.64 H new ATOM 0 HD21 LEU A 634 13.286 12.461 7.718 1.00 28.54 H new ATOM 0 HD22 LEU A 634 13.782 13.617 6.756 1.00 28.54 H new ATOM 0 HD23 LEU A 634 13.154 13.975 8.165 1.00 28.54 H new ATOM 1416 N ALA A 635 10.434 18.017 6.284 1.00 21.91 N ANISOU 1416 N ALA A 635 2465 2706 3154 96 -34 -195 N ATOM 1417 CA ALA A 635 10.550 19.377 5.725 1.00 22.89 C ANISOU 1417 CA ALA A 635 2560 2771 3368 86 -45 -189 C ATOM 1418 C ALA A 635 11.051 20.317 6.879 1.00 27.78 C ANISOU 1418 C ALA A 635 3175 3367 4013 106 -23 -281 C ATOM 1419 O ALA A 635 11.903 21.175 6.666 1.00 26.66 O ANISOU 1419 O ALA A 635 3022 3190 3918 91 -39 -304 O ATOM 1420 CB ALA A 635 9.211 19.856 5.170 1.00 23.42 C ANISOU 1420 CB ALA A 635 2587 2791 3522 91 -46 -133 C ATOM 0 H ALA A 635 9.629 17.718 6.334 1.00 21.91 H new ATOM 0 HA ALA A 635 11.178 19.387 4.985 1.00 22.89 H new ATOM 0 HB1 ALA A 635 9.312 20.751 4.809 1.00 23.42 H new ATOM 0 HB2 ALA A 635 8.918 19.255 4.467 1.00 23.42 H new ATOM 0 HB3 ALA A 635 8.551 19.867 5.881 1.00 23.42 H new ATOM 1421 N ASN A 636 10.642 20.025 8.115 1.00 24.91 N ANISOU 1421 N ASN A 636 2828 3030 3607 141 12 -336 N ATOM 1422 CA ASN A 636 11.153 20.744 9.287 1.00 25.91 C ANISOU 1422 CA ASN A 636 2967 3148 3729 168 24 -437 C ATOM 1423 C ASN A 636 12.650 20.497 9.483 1.00 28.82 C ANISOU 1423 C ASN A 636 3361 3549 4039 153 -17 -484 C ATOM 1424 O ASN A 636 13.403 21.453 9.719 1.00 28.22 O ANISOU 1424 O ASN A 636 3272 3435 4015 148 -39 -548 O ATOM 1425 CB ASN A 636 10.344 20.356 10.541 1.00 22.51 C ANISOU 1425 CB ASN A 636 2561 2751 3242 218 79 -476 C ATOM 1426 CG ASN A 636 9.111 21.206 10.646 1.00 38.70 C ANISOU 1426 CG ASN A 636 4572 4744 5388 241 124 -473 C ATOM 1427 OD1 ASN A 636 9.171 22.352 11.100 1.00 28.69 O ANISOU 1427 OD1 ASN A 636 3294 3427 4179 260 131 -543 O ATOM 1428 ND2 ASN A 636 7.978 20.695 10.157 1.00 29.13 N ANISOU 1428 ND2 ASN A 636 3330 3529 4210 240 148 -393 N ATOM 0 H ASN A 636 10.067 19.412 8.298 1.00 24.91 H new ATOM 0 HA ASN A 636 11.042 21.696 9.137 1.00 25.91 H new ATOM 0 HB2 ASN A 636 10.096 19.419 10.497 1.00 22.51 H new ATOM 0 HB3 ASN A 636 10.891 20.468 11.334 1.00 22.51 H new ATOM 0 HD21 ASN A 636 7.260 21.168 10.152 1.00 29.13 H new ATOM 0 HD22 ASN A 636 7.967 19.893 9.847 1.00 29.13 H new ATOM 1429 N ALA A 637 13.100 19.216 9.319 1.00 24.00 N ANISOU 1429 N ALA A 637 2780 3003 3338 145 -30 -450 N ATOM 1430 CA ALA A 637 14.533 18.863 9.467 1.00 22.63 C ANISOU 1430 CA ALA A 637 2623 2862 3115 133 -69 -487 C ATOM 1431 C ALA A 637 15.338 19.545 8.363 1.00 27.69 C ANISOU 1431 C ALA A 637 3226 3456 3838 91 -96 -460 C ATOM 1432 O ALA A 637 16.430 20.041 8.623 1.00 28.68 O ANISOU 1432 O ALA A 637 3338 3568 3992 82 -124 -516 O ATOM 1433 CB ALA A 637 14.727 17.339 9.463 1.00 21.21 C ANISOU 1433 CB ALA A 637 2477 2749 2833 137 -71 -447 C ATOM 0 H ALA A 637 12.590 18.551 9.124 1.00 24.00 H new ATOM 0 HA ALA A 637 14.858 19.182 10.324 1.00 22.63 H new ATOM 0 HB1 ALA A 637 15.670 17.132 9.561 1.00 21.21 H new ATOM 0 HB2 ALA A 637 14.232 16.948 10.200 1.00 21.21 H new ATOM 0 HB3 ALA A 637 14.401 16.973 8.626 1.00 21.21 H new ATOM 1434 N PHE A 638 14.756 19.681 7.154 1.00 24.33 N ANISOU 1434 N PHE A 638 2782 3001 3460 68 -85 -375 N ATOM 1435 CA PHE A 638 15.428 20.434 6.085 1.00 22.98 C ANISOU 1435 CA PHE A 638 2581 2784 3367 34 -96 -336 C ATOM 1436 C PHE A 638 15.619 21.898 6.483 1.00 27.98 C ANISOU 1436 C PHE A 638 3176 3342 4112 32 -98 -390 C ATOM 1437 O PHE A 638 16.687 22.453 6.252 1.00 26.92 O ANISOU 1437 O PHE A 638 3015 3177 4039 8 -111 -405 O ATOM 1438 CB PHE A 638 14.658 20.347 4.758 1.00 23.63 C ANISOU 1438 CB PHE A 638 2661 2852 3465 20 -90 -233 C ATOM 1439 CG PHE A 638 15.312 21.099 3.622 1.00 25.63 C ANISOU 1439 CG PHE A 638 2893 3062 3783 -8 -89 -176 C ATOM 1440 CD1 PHE A 638 15.005 22.442 3.381 1.00 28.08 C ANISOU 1440 CD1 PHE A 638 3166 3294 4208 -12 -82 -160 C ATOM 1441 CD2 PHE A 638 16.273 20.483 2.815 1.00 26.95 C ANISOU 1441 CD2 PHE A 638 3076 3262 3903 -25 -89 -137 C ATOM 1442 CE1 PHE A 638 15.634 23.153 2.351 1.00 28.37 C ANISOU 1442 CE1 PHE A 638 3183 3287 4309 -36 -71 -95 C ATOM 1443 CE2 PHE A 638 16.868 21.185 1.753 1.00 28.97 C ANISOU 1443 CE2 PHE A 638 3313 3479 4215 -46 -72 -73 C ATOM 1444 CZ PHE A 638 16.559 22.518 1.544 1.00 27.50 C ANISOU 1444 CZ PHE A 638 3091 3215 4142 -52 -63 -49 C ATOM 0 H PHE A 638 13.991 19.352 6.941 1.00 24.33 H new ATOM 0 HA PHE A 638 16.299 20.028 5.955 1.00 22.98 H new ATOM 0 HB2 PHE A 638 14.567 19.414 4.507 1.00 23.63 H new ATOM 0 HB3 PHE A 638 13.762 20.694 4.891 1.00 23.63 H new ATOM 0 HD1 PHE A 638 14.373 22.870 3.913 1.00 28.08 H new ATOM 0 HD2 PHE A 638 16.520 19.602 2.982 1.00 26.95 H new ATOM 0 HE1 PHE A 638 15.430 24.049 2.211 1.00 28.37 H new ATOM 0 HE2 PHE A 638 17.470 20.754 1.190 1.00 28.97 H new ATOM 0 HZ PHE A 638 16.975 22.988 0.858 1.00 27.50 H new ATOM 1445 N PHE A 639 14.570 22.532 7.064 1.00 25.82 N ANISOU 1445 N PHE A 639 2896 3035 3880 57 -80 -420 N ATOM 1446 CA PHE A 639 14.621 23.944 7.454 1.00 24.42 C ANISOU 1446 CA PHE A 639 2683 2776 3818 60 -80 -479 C ATOM 1447 C PHE A 639 15.325 24.170 8.796 1.00 29.88 C ANISOU 1447 C PHE A 639 3387 3475 4490 80 -103 -608 C ATOM 1448 O PHE A 639 15.436 25.316 9.236 1.00 30.33 O ANISOU 1448 O PHE A 639 3419 3463 4644 84 -111 -678 O ATOM 1449 CB PHE A 639 13.214 24.581 7.396 1.00 24.43 C ANISOU 1449 CB PHE A 639 2667 2729 3885 82 -51 -453 C ATOM 1450 CG PHE A 639 12.752 24.701 5.944 1.00 25.00 C ANISOU 1450 CG PHE A 639 2719 2774 4006 59 -50 -329 C ATOM 1451 CD1 PHE A 639 13.435 25.518 5.040 1.00 28.01 C ANISOU 1451 CD1 PHE A 639 3072 3096 4477 29 -59 -281 C ATOM 1452 CD2 PHE A 639 11.642 23.981 5.481 1.00 23.62 C ANISOU 1452 CD2 PHE A 639 2554 2632 3788 70 -44 -258 C ATOM 1453 CE1 PHE A 639 13.011 25.621 3.704 1.00 29.05 C ANISOU 1453 CE1 PHE A 639 3196 3208 4633 16 -60 -162 C ATOM 1454 CE2 PHE A 639 11.221 24.081 4.148 1.00 25.37 C ANISOU 1454 CE2 PHE A 639 2763 2833 4042 55 -59 -151 C ATOM 1455 CZ PHE A 639 11.921 24.876 3.262 1.00 24.96 C ANISOU 1455 CZ PHE A 639 2696 2732 4056 31 -67 -101 C ATOM 0 H PHE A 639 13.820 22.148 7.237 1.00 25.82 H new ATOM 0 HA PHE A 639 15.174 24.403 6.803 1.00 24.42 H new ATOM 0 HB2 PHE A 639 12.585 24.040 7.899 1.00 24.43 H new ATOM 0 HB3 PHE A 639 13.230 25.457 7.811 1.00 24.43 H new ATOM 0 HD1 PHE A 639 14.178 25.999 5.325 1.00 28.01 H new ATOM 0 HD2 PHE A 639 11.178 23.428 6.067 1.00 23.62 H new ATOM 0 HE1 PHE A 639 13.458 26.186 3.116 1.00 29.05 H new ATOM 0 HE2 PHE A 639 10.471 23.612 3.860 1.00 25.37 H new ATOM 0 HZ PHE A 639 11.664 24.914 2.369 1.00 24.96 H new ATOM 1456 N CYS A 640 15.874 23.079 9.405 1.00 27.78 N ANISOU 1456 N CYS A 640 3160 3291 4102 92 -120 -639 N ATOM 1457 CA CYS A 640 16.655 23.067 10.657 1.00 26.94 C ANISOU 1457 CA CYS A 640 3076 3213 3947 116 -158 -756 C ATOM 1458 C CYS A 640 15.865 23.696 11.819 1.00 29.85 C ANISOU 1458 C CYS A 640 3469 3565 4307 165 -140 -848 C ATOM 1459 O CYS A 640 16.395 24.541 12.562 1.00 28.27 O ANISOU 1459 O CYS A 640 3264 3328 4150 176 -177 -958 O ATOM 1460 CB CYS A 640 18.009 23.757 10.442 1.00 27.46 C ANISOU 1460 CB CYS A 640 3095 3229 4107 80 -207 -797 C ATOM 1461 SG CYS A 640 18.950 23.099 9.042 1.00 30.38 S ANISOU 1461 SG CYS A 640 3435 3615 4493 30 -206 -686 S ATOM 0 H CYS A 640 15.789 22.291 9.071 1.00 27.78 H new ATOM 0 HA CYS A 640 16.826 22.145 10.906 1.00 26.94 H new ATOM 0 HB2 CYS A 640 17.861 24.706 10.304 1.00 27.46 H new ATOM 0 HB3 CYS A 640 18.540 23.667 11.249 1.00 27.46 H new ATOM 0 HG CYS A 640 19.770 23.904 8.696 1.00 30.38 H new ATOM 1462 N THR A 641 14.577 23.272 11.974 1.00 26.19 N ANISOU 1462 N THR A 641 3029 3127 3795 196 -83 -806 N ATOM 1463 CA THR A 641 13.682 23.851 12.981 1.00 26.18 C ANISOU 1463 CA THR A 641 3049 3110 3790 248 -44 -879 C ATOM 1464 C THR A 641 13.611 23.091 14.296 1.00 31.18 C ANISOU 1464 C THR A 641 3751 3826 4270 305 -30 -940 C ATOM 1465 O THR A 641 13.064 23.634 15.268 1.00 31.04 O ANISOU 1465 O THR A 641 3761 3800 4234 356 2 -1021 O ATOM 1466 CB THR A 641 12.290 24.044 12.424 1.00 28.47 C ANISOU 1466 CB THR A 641 3309 3364 4142 254 17 -800 C ATOM 1467 OG1 THR A 641 11.695 22.758 12.272 1.00 24.05 O ANISOU 1467 OG1 THR A 641 2771 2874 3492 260 49 -717 O ATOM 1468 CG2 THR A 641 12.268 24.859 11.128 1.00 24.18 C ANISOU 1468 CG2 THR A 641 2706 2739 3744 208 3 -730 C ATOM 0 H THR A 641 14.219 22.651 11.499 1.00 26.19 H new ATOM 0 HA THR A 641 14.082 24.709 13.194 1.00 26.18 H new ATOM 0 HB THR A 641 11.769 24.574 13.047 1.00 28.47 H new ATOM 0 HG1 THR A 641 12.164 22.292 11.754 1.00 24.05 H new ATOM 0 HG21 THR A 641 11.353 24.950 10.818 1.00 24.18 H new ATOM 0 HG22 THR A 641 12.643 25.739 11.292 1.00 24.18 H new ATOM 0 HG23 THR A 641 12.794 24.405 10.451 1.00 24.18 H new ATOM 1469 N PHE A 642 14.133 21.849 14.353 1.00 26.62 N ANISOU 1469 N PHE A 642 3206 3328 3581 301 -48 -901 N ATOM 1470 CA PHE A 642 14.021 21.104 15.618 1.00 26.81 C ANISOU 1470 CA PHE A 642 3301 3432 3455 361 -29 -944 C ATOM 1471 C PHE A 642 14.884 21.701 16.707 1.00 32.57 C ANISOU 1471 C PHE A 642 4068 4170 4139 395 -88 -1082 C ATOM 1472 O PHE A 642 16.107 21.788 16.540 1.00 31.76 O ANISOU 1472 O PHE A 642 3948 4063 4057 366 -170 -1119 O ATOM 1473 CB PHE A 642 14.283 19.593 15.435 1.00 27.01 C ANISOU 1473 CB PHE A 642 3351 3532 3380 354 -30 -859 C ATOM 1474 CG PHE A 642 13.185 18.936 14.630 1.00 26.68 C ANISOU 1474 CG PHE A 642 3285 3485 3368 336 33 -741 C ATOM 1475 CD1 PHE A 642 11.959 18.618 15.219 1.00 28.48 C ANISOU 1475 CD1 PHE A 642 3531 3731 3559 378 114 -714 C ATOM 1476 CD2 PHE A 642 13.396 18.577 13.305 1.00 25.74 C ANISOU 1476 CD2 PHE A 642 3124 3347 3309 279 9 -657 C ATOM 1477 CE1 PHE A 642 10.956 17.989 14.481 1.00 28.23 C ANISOU 1477 CE1 PHE A 642 3466 3689 3571 358 161 -609 C ATOM 1478 CE2 PHE A 642 12.390 17.952 12.567 1.00 27.97 C ANISOU 1478 CE2 PHE A 642 3385 3624 3617 263 50 -559 C ATOM 1479 CZ PHE A 642 11.170 17.676 13.154 1.00 25.74 C ANISOU 1479 CZ PHE A 642 3110 3351 3317 300 120 -537 C ATOM 0 H PHE A 642 14.533 21.442 13.709 1.00 26.62 H new ATOM 0 HA PHE A 642 13.100 21.192 15.909 1.00 26.81 H new ATOM 0 HB2 PHE A 642 15.135 19.462 14.990 1.00 27.01 H new ATOM 0 HB3 PHE A 642 14.349 19.167 16.304 1.00 27.01 H new ATOM 0 HD1 PHE A 642 11.810 18.828 16.113 1.00 28.48 H new ATOM 0 HD2 PHE A 642 14.217 18.755 12.905 1.00 25.74 H new ATOM 0 HE1 PHE A 642 10.144 17.781 14.883 1.00 28.23 H new ATOM 0 HE2 PHE A 642 12.541 17.721 11.679 1.00 27.97 H new ATOM 0 HZ PHE A 642 10.493 17.279 12.655 1.00 25.74 H new ATOM 1480 N PRO A 643 14.268 22.108 17.836 1.00 31.30 N ANISOU 1480 N PRO A 643 3958 4021 3915 461 -50 -1164 N ATOM 1481 CA PRO A 643 15.063 22.738 18.905 1.00 31.06 C ANISOU 1481 CA PRO A 643 3971 3997 3834 499 -119 -1313 C ATOM 1482 C PRO A 643 15.836 21.739 19.752 1.00 37.57 C ANISOU 1482 C PRO A 643 4864 4920 4491 536 -168 -1335 C ATOM 1483 O PRO A 643 15.418 20.579 19.895 1.00 37.75 O ANISOU 1483 O PRO A 643 4924 5013 4407 558 -115 -1244 O ATOM 1484 CB PRO A 643 14.013 23.500 19.724 1.00 32.39 C ANISOU 1484 CB PRO A 643 4174 4143 3988 562 -46 -1386 C ATOM 1485 CG PRO A 643 12.761 22.710 19.537 1.00 36.24 C ANISOU 1485 CG PRO A 643 4665 4663 4441 579 68 -1265 C ATOM 1486 CD PRO A 643 12.822 22.070 18.182 1.00 31.70 C ANISOU 1486 CD PRO A 643 4024 4074 3946 505 59 -1130 C ATOM 0 HA PRO A 643 15.760 23.311 18.549 1.00 31.06 H new ATOM 0 HB2 PRO A 643 14.263 23.552 20.660 1.00 32.39 H new ATOM 0 HB3 PRO A 643 13.908 24.411 19.407 1.00 32.39 H new ATOM 0 HG2 PRO A 643 12.678 22.035 20.229 1.00 36.24 H new ATOM 0 HG3 PRO A 643 11.983 23.285 19.607 1.00 36.24 H new ATOM 0 HD2 PRO A 643 12.485 21.161 18.202 1.00 31.70 H new ATOM 0 HD3 PRO A 643 12.288 22.556 17.534 1.00 31.70 H new ATOM 1487 N ARG A 644 16.983 22.199 20.298 1.00 34.47 N ANISOU 1487 N ARG A 644 4484 4526 4088 543 -277 -1454 N ATOM 1488 CA ARG A 644 17.882 21.448 21.197 1.00 35.27 C ANISOU 1488 CA ARG A 644 4649 4714 4037 584 -353 -1498 C ATOM 1489 C ARG A 644 18.638 20.324 20.523 1.00 35.19 C ANISOU 1489 C ARG A 644 4609 4742 4020 542 -387 -1394 C ATOM 1490 O ARG A 644 19.191 19.476 21.216 1.00 36.32 O ANISOU 1490 O ARG A 644 4807 4964 4030 582 -431 -1397 O ATOM 1491 CB ARG A 644 17.145 20.904 22.461 1.00 36.09 C ANISOU 1491 CB ARG A 644 4865 4907 3943 680 -290 -1514 C ATOM 1492 CG ARG A 644 16.272 21.916 23.201 1.00 41.72 C ANISOU 1492 CG ARG A 644 5620 5591 4642 736 -233 -1614 C ATOM 1493 CD ARG A 644 17.060 23.004 23.906 1.00 35.21 C ANISOU 1493 CD ARG A 644 4816 4734 3829 759 -344 -1798 C ATOM 1494 NE ARG A 644 16.144 23.919 24.595 1.00 47.90 N ANISOU 1494 NE ARG A 644 6468 6312 5421 819 -276 -1894 N ATOM 1495 CZ ARG A 644 15.647 25.039 24.072 1.00 62.41 C ANISOU 1495 CZ ARG A 644 8241 8042 7428 788 -243 -1929 C ATOM 1496 NH1 ARG A 644 14.825 25.797 24.777 1.00 57.91 N ANISOU 1496 NH1 ARG A 644 7719 7450 6836 853 -177 -2020 N ATOM 1497 NH2 ARG A 644 15.976 25.411 22.841 1.00 44.41 N ANISOU 1497 NH2 ARG A 644 5854 5677 5344 696 -272 -1870 N ATOM 0 H ARG A 644 17.268 22.996 20.144 1.00 34.47 H new ATOM 0 HA ARG A 644 18.539 22.106 21.473 1.00 35.27 H new ATOM 0 HB2 ARG A 644 16.589 20.155 22.195 1.00 36.09 H new ATOM 0 HB3 ARG A 644 17.808 20.559 23.079 1.00 36.09 H new ATOM 0 HG2 ARG A 644 15.662 22.328 22.569 1.00 41.72 H new ATOM 0 HG3 ARG A 644 15.730 21.446 23.854 1.00 41.72 H new ATOM 0 HD2 ARG A 644 17.674 22.608 24.544 1.00 35.21 H new ATOM 0 HD3 ARG A 644 17.596 23.494 23.263 1.00 35.21 H new ATOM 0 HE ARG A 644 15.910 23.717 25.398 1.00 47.90 H new ATOM 0 HH11 ARG A 644 14.609 25.568 25.577 1.00 57.91 H new ATOM 0 HH12 ARG A 644 14.507 26.519 24.435 1.00 57.91 H new ATOM 0 HH21 ARG A 644 16.514 24.928 22.375 1.00 44.41 H new ATOM 0 HH22 ARG A 644 15.652 26.135 22.509 1.00 44.41 H new ATOM 1498 N ARG A 645 18.675 20.312 19.200 1.00 29.84 N ANISOU 1498 N ARG A 645 3849 4009 3478 468 -367 -1304 N ATOM 1499 CA ARG A 645 19.332 19.260 18.422 1.00 29.84 C ANISOU 1499 CA ARG A 645 3817 4038 3482 428 -385 -1204 C ATOM 1500 C ARG A 645 20.596 19.753 17.702 1.00 37.18 C ANISOU 1500 C ARG A 645 4667 4914 4546 367 -469 -1231 C ATOM 1501 O ARG A 645 21.119 19.046 16.839 1.00 37.74 O ANISOU 1501 O ARG A 645 4699 4993 4649 328 -471 -1146 O ATOM 1502 CB ARG A 645 18.318 18.686 17.386 1.00 26.29 C ANISOU 1502 CB ARG A 645 3345 3577 3068 396 -286 -1065 C ATOM 1503 CG ARG A 645 17.037 18.063 18.004 1.00 31.07 C ANISOU 1503 CG ARG A 645 4012 4230 3564 449 -193 -1017 C ATOM 1504 CD ARG A 645 17.360 16.911 18.964 1.00 24.51 C ANISOU 1504 CD ARG A 645 3253 3490 2568 505 -205 -1005 C ATOM 1505 NE ARG A 645 17.852 15.720 18.255 1.00 28.24 N ANISOU 1505 NE ARG A 645 3706 3987 3038 472 -218 -907 N ATOM 1506 CZ ARG A 645 17.080 14.700 17.893 1.00 34.73 C ANISOU 1506 CZ ARG A 645 4535 4826 3834 469 -145 -796 C ATOM 1507 NH1 ARG A 645 15.786 14.702 18.185 1.00 29.85 N ANISOU 1507 NH1 ARG A 645 3937 4207 3198 495 -53 -762 N ATOM 1508 NH2 ARG A 645 17.594 13.675 17.231 1.00 27.13 N ANISOU 1508 NH2 ARG A 645 3554 3877 2877 440 -164 -723 N ATOM 0 H ARG A 645 18.314 20.924 18.715 1.00 29.84 H new ATOM 0 HA ARG A 645 19.616 18.569 19.041 1.00 29.84 H new ATOM 0 HB2 ARG A 645 18.057 19.397 16.780 1.00 26.29 H new ATOM 0 HB3 ARG A 645 18.766 18.010 16.854 1.00 26.29 H new ATOM 0 HG2 ARG A 645 16.542 18.749 18.479 1.00 31.07 H new ATOM 0 HG3 ARG A 645 16.462 17.739 17.294 1.00 31.07 H new ATOM 0 HD2 ARG A 645 18.027 17.203 19.605 1.00 24.51 H new ATOM 0 HD3 ARG A 645 16.565 16.680 19.469 1.00 24.51 H new ATOM 0 HE ARG A 645 18.689 15.681 18.063 1.00 28.24 H new ATOM 0 HH11 ARG A 645 15.442 15.366 18.611 1.00 29.85 H new ATOM 0 HH12 ARG A 645 15.291 14.040 17.949 1.00 29.85 H new ATOM 0 HH21 ARG A 645 18.431 13.667 17.033 1.00 27.13 H new ATOM 0 HH22 ARG A 645 17.091 13.017 16.999 1.00 27.13 H new ATOM 1509 N ASN A 646 21.080 20.953 18.037 1.00 35.95 N ANISOU 1509 N ASN A 646 4484 4700 4476 361 -533 -1349 N ATOM 1510 CA ASN A 646 22.182 21.593 17.320 1.00 36.17 C ANISOU 1510 CA ASN A 646 4420 4656 4665 298 -597 -1370 C ATOM 1511 C ASN A 646 23.521 21.713 18.018 1.00 44.63 C ANISOU 1511 C ASN A 646 5475 5738 5743 306 -723 -1477 C ATOM 1512 O ASN A 646 24.540 21.686 17.329 1.00 45.68 O ANISOU 1512 O ASN A 646 5530 5840 5988 256 -764 -1451 O ATOM 1513 CB ASN A 646 21.746 22.984 16.868 1.00 31.62 C ANISOU 1513 CB ASN A 646 3794 3974 4246 264 -571 -1404 C ATOM 1514 CG ASN A 646 20.512 22.963 16.005 1.00 48.23 C ANISOU 1514 CG ASN A 646 5895 6056 6375 249 -461 -1292 C ATOM 1515 OD1 ASN A 646 20.421 22.207 15.046 1.00 42.87 O ANISOU 1515 OD1 ASN A 646 5198 5397 5695 219 -417 -1170 O ATOM 1516 ND2 ASN A 646 19.510 23.764 16.340 1.00 43.31 N ANISOU 1516 ND2 ASN A 646 5291 5392 5772 275 -416 -1334 N ATOM 0 H ASN A 646 20.774 21.420 18.692 1.00 35.95 H new ATOM 0 HA ASN A 646 22.355 20.977 16.591 1.00 36.17 H new ATOM 0 HB2 ASN A 646 21.579 23.535 17.649 1.00 31.62 H new ATOM 0 HB3 ASN A 646 22.471 23.401 16.377 1.00 31.62 H new ATOM 0 HD21 ASN A 646 18.783 23.758 15.881 1.00 43.31 H new ATOM 0 HD22 ASN A 646 19.587 24.290 17.016 1.00 43.31 H new ATOM 1517 N ALA A 647 23.551 21.905 19.335 1.00 45.78 N ANISOU 1517 N ALA A 647 5691 5923 5782 369 -787 -1598 N ATOM 1518 CA ALA A 647 24.802 22.154 20.052 1.00 48.32 C ANISOU 1518 CA ALA A 647 5994 6246 6119 380 -928 -1719 C ATOM 1519 C ALA A 647 25.738 20.949 20.128 1.00 56.32 C ANISOU 1519 C ALA A 647 7005 7335 7060 390 -987 -1669 C ATOM 1520 O ALA A 647 25.290 19.836 20.361 1.00 54.66 O ANISOU 1520 O ALA A 647 6864 7210 6696 431 -939 -1589 O ATOM 1521 CB ALA A 647 24.521 22.717 21.433 1.00 49.98 C ANISOU 1521 CB ALA A 647 6291 6480 6221 452 -985 -1870 C ATOM 0 H ALA A 647 22.852 21.895 19.836 1.00 45.78 H new ATOM 0 HA ALA A 647 25.281 22.813 19.526 1.00 48.32 H new ATOM 0 HB1 ALA A 647 25.359 22.876 21.894 1.00 49.98 H new ATOM 0 HB2 ALA A 647 24.035 23.552 21.349 1.00 49.98 H new ATOM 0 HB3 ALA A 647 23.989 22.083 21.939 1.00 49.98 H new ATOM 1522 N LYS A 648 27.042 21.176 19.898 1.00 57.64 N ANISOU 1522 N LYS A 648 7082 7463 7355 350 -1087 -1710 N ATOM 1523 CA LYS A 648 28.057 20.111 19.948 1.00 59.24 C ANISOU 1523 CA LYS A 648 7264 7725 7518 358 -1152 -1670 C ATOM 1524 C LYS A 648 28.240 19.603 21.384 1.00 66.66 C ANISOU 1524 C LYS A 648 8302 8759 8267 446 -1250 -1752 C ATOM 1525 O LYS A 648 28.564 18.430 21.578 1.00 66.39 O ANISOU 1525 O LYS A 648 8298 8802 8126 479 -1265 -1684 O ATOM 1526 CB LYS A 648 29.397 20.618 19.398 1.00 62.74 C ANISOU 1526 CB LYS A 648 7576 8094 8169 295 -1234 -1702 C ATOM 0 H LYS A 648 27.361 21.952 19.709 1.00 57.64 H new ATOM 0 HA LYS A 648 27.749 19.376 19.395 1.00 59.24 H new ATOM 1527 N MET A 649 28.010 20.495 22.380 1.00 65.59 N ANISOU 1527 N MET A 649 8221 8615 8085 487 -1314 -1896 N ATOM 1528 CA MET A 649 28.133 20.230 23.820 1.00 67.76 C ANISOU 1528 CA MET A 649 8605 8977 8165 580 -1413 -1995 C ATOM 1529 C MET A 649 26.768 19.996 24.520 1.00 72.92 C ANISOU 1529 C MET A 649 9395 9697 8614 654 -1307 -1977 C ATOM 1530 O MET A 649 26.671 20.104 25.748 1.00 73.04 O ANISOU 1530 O MET A 649 9514 9772 8467 736 -1370 -2080 O ATOM 1531 CB MET A 649 28.938 21.355 24.511 1.00 72.06 C ANISOU 1531 CB MET A 649 9118 9469 8792 582 -1573 -2185 C ATOM 1532 CG MET A 649 30.315 21.592 23.909 1.00 76.64 C ANISOU 1532 CG MET A 649 9551 9978 9589 511 -1678 -2204 C ATOM 1533 SD MET A 649 31.441 20.190 24.110 1.00 82.01 S ANISOU 1533 SD MET A 649 10215 10750 10197 540 -1774 -2137 S ATOM 1534 CE MET A 649 32.833 20.754 23.132 1.00 79.17 C ANISOU 1534 CE MET A 649 9654 10273 10153 438 -1845 -2147 C ATOM 0 H MET A 649 27.768 21.304 22.216 1.00 65.59 H new ATOM 0 HA MET A 649 28.621 19.396 23.910 1.00 67.76 H new ATOM 0 HB2 MET A 649 28.429 22.179 24.465 1.00 72.06 H new ATOM 0 HB3 MET A 649 29.039 21.137 25.451 1.00 72.06 H new ATOM 0 HG2 MET A 649 30.218 21.787 22.964 1.00 76.64 H new ATOM 0 HG3 MET A 649 30.710 22.376 24.321 1.00 76.64 H new ATOM 0 HE1 MET A 649 33.534 20.083 23.149 1.00 79.17 H new ATOM 0 HE2 MET A 649 32.548 20.899 22.216 1.00 79.17 H new ATOM 0 HE3 MET A 649 33.172 21.585 23.500 1.00 79.17 H new ATOM 1535 N LYS A 650 25.715 19.660 23.740 1.00 69.75 N ANISOU 1535 N LYS A 650 8995 9285 8220 628 -1147 -1846 N ATOM 1536 CA LYS A 650 24.389 19.376 24.309 1.00 69.30 C ANISOU 1536 CA LYS A 650 9050 9285 7997 692 -1030 -1810 C ATOM 1537 C LYS A 650 24.438 18.043 25.084 1.00 71.37 C ANISOU 1537 C LYS A 650 9405 9663 8048 767 -1035 -1743 C ATOM 1538 O LYS A 650 25.096 17.098 24.622 1.00 72.17 O ANISOU 1538 O LYS A 650 9466 9788 8168 745 -1060 -1652 O ATOM 1539 CB LYS A 650 23.296 19.363 23.218 1.00 70.60 C ANISOU 1539 CB LYS A 650 9174 9400 8249 640 -873 -1687 C ATOM 1540 CG LYS A 650 23.314 18.172 22.249 1.00 80.43 C ANISOU 1540 CG LYS A 650 10379 10666 9515 600 -810 -1521 C ATOM 1541 CD LYS A 650 22.340 18.359 21.086 1.00 84.88 C ANISOU 1541 CD LYS A 650 10892 11167 10189 542 -684 -1422 C ATOM 1542 CE LYS A 650 22.823 17.714 19.803 1.00 95.52 C ANISOU 1542 CE LYS A 650 12160 12492 11641 473 -668 -1308 C ATOM 1543 NZ LYS A 650 22.817 16.226 19.862 1.00104.20 N ANISOU 1543 NZ LYS A 650 13300 13667 12626 500 -642 -1204 N ATOM 0 H LYS A 650 25.755 19.593 22.884 1.00 69.75 H new ATOM 0 HA LYS A 650 24.153 20.086 24.927 1.00 69.30 H new ATOM 0 HB2 LYS A 650 22.430 19.387 23.655 1.00 70.60 H new ATOM 0 HB3 LYS A 650 23.375 20.179 22.699 1.00 70.60 H new ATOM 0 HG2 LYS A 650 24.212 18.054 21.901 1.00 80.43 H new ATOM 0 HG3 LYS A 650 23.088 17.361 22.731 1.00 80.43 H new ATOM 0 HD2 LYS A 650 21.479 17.983 21.327 1.00 84.88 H new ATOM 0 HD3 LYS A 650 22.203 19.307 20.934 1.00 84.88 H new ATOM 0 HE2 LYS A 650 22.261 18.006 19.068 1.00 95.52 H new ATOM 0 HE3 LYS A 650 23.723 18.022 19.611 1.00 95.52 H new ATOM 0 HZ1 LYS A 650 22.493 15.900 19.100 1.00104.20 H new ATOM 0 HZ2 LYS A 650 23.648 15.930 19.981 1.00104.20 H new ATOM 0 HZ3 LYS A 650 22.307 15.958 20.540 1.00104.20 H new ATOM 1544 N ASER A 651 23.784 17.962 26.250 0.50 65.49 N ANISOU 1544 N ASER A 651 8786 8990 7106 860 -1010 -1786 N ATOM 1545 N BSER A 651 23.805 18.005 26.277 0.50 66.93 N ANISOU 1545 N BSER A 651 8969 9171 7289 861 -1013 -1792 N ATOM 1546 CA ASER A 651 23.778 16.713 27.013 0.50 63.66 C ANISOU 1546 CA ASER A 651 8650 8867 6670 937 -1003 -1708 C ATOM 1547 CA BSER A 651 23.725 16.811 27.120 0.50 65.91 C ANISOU 1547 CA BSER A 651 8944 9154 6945 944 -1003 -1722 C ATOM 1548 C ASER A 651 22.474 15.940 26.813 0.50 60.97 C ANISOU 1548 C ASER A 651 8353 8553 6260 952 -822 -1560 C ATOM 1549 C BSER A 651 22.496 16.010 26.716 0.50 64.96 C ANISOU 1549 C BSER A 651 8847 9049 6784 944 -822 -1562 C ATOM 1550 O ASER A 651 22.503 14.711 26.740 0.50 59.30 O ANISOU 1550 O ASER A 651 8159 8391 5981 966 -788 -1433 O ATOM 1551 O BSER A 651 22.634 14.828 26.405 0.50 63.11 O ANISOU 1551 O BSER A 651 8605 8849 6523 938 -795 -1433 O ATOM 1552 CB ASER A 651 24.021 16.970 28.495 0.50 69.13 C ANISOU 1552 CB ASER A 651 9464 9635 7169 1040 -1098 -1838 C ATOM 1553 CB BSER A 651 23.655 17.179 28.594 0.50 71.23 C ANISOU 1553 CB BSER A 651 9747 9897 7420 1049 -1062 -1849 C ATOM 1554 OG ASER A 651 24.091 15.748 29.212 0.50 77.60 O ANISOU 1554 OG ASER A 651 10628 10811 8043 1118 -1095 -1750 O ATOM 1555 OG BSER A 651 23.515 16.026 29.408 0.50 80.02 O ANISOU 1555 OG BSER A 651 10969 11119 8318 1135 -1039 -1765 O ATOM 0 H ASER A 651 23.346 18.609 26.609 0.50 66.93 H new ATOM 0 H BSER A 651 23.407 18.688 26.615 0.50 66.93 H new ATOM 0 HA ASER A 651 24.505 16.168 26.675 0.50 65.91 H new ATOM 0 HA BSER A 651 24.526 16.279 26.992 0.50 65.91 H new ATOM 0 HB2ASER A 651 24.847 17.466 28.611 0.50 71.23 H new ATOM 0 HB2BSER A 651 24.458 17.661 28.848 0.50 71.23 H new ATOM 0 HB3ASER A 651 23.307 17.520 28.854 0.50 71.23 H new ATOM 0 HB3BSER A 651 22.906 17.777 28.745 0.50 71.23 H new ATOM 0 HG ASER A 651 24.226 15.908 30.026 0.50 80.02 H new ATOM 0 HG BSER A 651 23.480 16.255 30.215 0.50 80.02 H new ATOM 1556 N AGLU A 652 21.342 16.668 26.733 0.50 53.69 N ANISOU 1556 N AGLU A 652 7440 7591 5367 950 -708 -1578 N ATOM 1557 N BGLU A 652 21.294 16.639 26.723 0.50 59.20 N ANISOU 1557 N BGLU A 652 8140 8290 6063 950 -701 -1572 N ATOM 1558 CA AGLU A 652 19.987 16.137 26.576 0.50 51.19 C ANISOU 1558 CA AGLU A 652 7153 7287 5010 964 -534 -1454 C ATOM 1559 CA BGLU A 652 20.107 15.934 26.252 0.50 57.02 C ANISOU 1559 CA BGLU A 652 7864 8016 5784 941 -536 -1422 C ATOM 1560 C AGLU A 652 19.838 15.121 25.433 0.50 52.03 C ANISOU 1560 C AGLU A 652 7185 7373 5212 895 -470 -1290 C ATOM 1561 C BGLU A 652 20.287 15.887 24.755 0.50 57.18 C ANISOU 1561 C BGLU A 652 7760 7958 6010 834 -526 -1346 C ATOM 1562 O AGLU A 652 19.250 14.052 25.632 0.50 51.01 O ANISOU 1562 O AGLU A 652 7100 7291 4990 928 -382 -1170 O ATOM 1563 O BGLU A 652 20.681 16.892 24.145 0.50 56.53 O ANISOU 1563 O BGLU A 652 7600 7799 6079 775 -579 -1421 O ATOM 1564 CB AGLU A 652 18.982 17.297 26.427 0.50 52.10 C ANISOU 1564 CB AGLU A 652 7252 7336 5206 953 -447 -1515 C ATOM 1565 CB BGLU A 652 18.786 16.639 26.610 0.50 58.88 C ANISOU 1565 CB BGLU A 652 8142 8236 5995 976 -409 -1449 C ATOM 1566 CG AGLU A 652 17.539 16.847 26.280 0.50 55.84 C ANISOU 1566 CG AGLU A 652 7742 7816 5660 967 -269 -1395 C ATOM 1567 CG BGLU A 652 17.696 15.714 27.164 0.50 69.81 C ANISOU 1567 CG BGLU A 652 9605 9685 7235 1041 -263 -1332 C ATOM 1568 CD AGLU A 652 16.461 17.911 26.297 0.50 64.85 C ANISOU 1568 CD AGLU A 652 8876 8902 6864 976 -173 -1450 C ATOM 1569 CD BGLU A 652 17.352 14.387 26.495 0.50 84.91 C ANISOU 1569 CD BGLU A 652 11483 11607 9173 1006 -185 -1151 C ATOM 1570 OE1AGLU A 652 16.780 19.118 26.181 0.50 48.36 O ANISOU 1570 OE1AGLU A 652 6753 6748 4875 953 -240 -1577 O ATOM 1571 OE1BGLU A 652 17.522 14.259 25.261 0.50 67.16 O ANISOU 1571 OE1BGLU A 652 9132 9295 7088 917 -197 -1094 O ATOM 1572 OE2AGLU A 652 15.281 17.521 26.439 0.50 52.01 O ANISOU 1572 OE2AGLU A 652 7273 7291 5197 1007 -28 -1362 O ATOM 1573 OE2BGLU A 652 16.864 13.482 27.210 0.50 81.99 O ANISOU 1573 OE2BGLU A 652 11191 11304 8658 1073 -105 -1066 O ATOM 0 H AGLU A 652 21.354 17.527 26.772 0.50 59.20 H new ATOM 0 H BGLU A 652 21.162 17.446 26.990 0.50 59.20 H new ATOM 0 HA AGLU A 652 19.792 15.637 27.384 0.50 57.02 H new ATOM 0 HA BGLU A 652 20.035 15.062 26.671 0.50 57.02 H new ATOM 0 HB2AGLU A 652 19.053 17.876 27.202 0.50 58.88 H new ATOM 0 HB2BGLU A 652 18.970 17.331 27.265 0.50 58.88 H new ATOM 0 HB3AGLU A 652 19.226 17.827 25.653 0.50 58.88 H new ATOM 0 HB3BGLU A 652 18.445 17.082 25.817 0.50 58.88 H new ATOM 0 HG2AGLU A 652 17.463 16.359 25.445 0.50 69.81 H new ATOM 0 HG2BGLU A 652 17.939 15.511 28.081 0.50 69.81 H new ATOM 0 HG3AGLU A 652 17.349 16.219 26.994 0.50 69.81 H new ATOM 0 HG3BGLU A 652 16.877 16.233 27.196 0.50 69.81 H new ATOM 1574 N ATYR A 653 20.378 15.465 24.249 0.50 47.27 N ANISOU 1574 N ATYR A 653 6471 6694 4795 804 -515 -1285 N ATOM 1575 N BTYR A 653 20.099 14.691 24.184 0.50 50.79 N ANISOU 1575 N BTYR A 653 6932 7166 5200 812 -466 -1200 N ATOM 1576 CA ATYR A 653 20.301 14.671 23.024 0.50 44.94 C ANISOU 1576 CA ATYR A 653 6102 6368 4606 735 -465 -1152 C ATOM 1577 CA BTYR A 653 20.270 14.386 22.769 0.50 47.90 C ANISOU 1577 CA BTYR A 653 6464 6741 4995 722 -452 -1114 C ATOM 1578 C ATYR A 653 21.663 14.249 22.480 0.50 49.18 C ANISOU 1578 C ATYR A 653 6577 6899 5210 693 -574 -1145 C ATOM 1579 C BTYR A 653 21.715 14.124 22.387 0.50 50.65 C ANISOU 1579 C BTYR A 653 6758 7085 5402 689 -574 -1132 C ATOM 1580 O ATYR A 653 21.792 13.978 21.285 0.50 48.77 O ANISOU 1580 O ATYR A 653 6447 6801 5282 624 -550 -1071 O ATOM 1581 O BTYR A 653 21.969 13.843 21.213 0.50 50.25 O ANISOU 1581 O BTYR A 653 6627 6990 5475 620 -562 -1065 O ATOM 1582 CB ATYR A 653 19.555 15.483 21.965 0.50 44.71 C ANISOU 1582 CB ATYR A 653 5998 6253 4739 666 -396 -1138 C ATOM 1583 CB BTYR A 653 19.633 15.440 21.859 0.50 47.94 C ANISOU 1583 CB BTYR A 653 6398 6658 5158 659 -400 -1132 C ATOM 1584 CG ATYR A 653 18.054 15.427 22.101 0.50 45.78 C ANISOU 1584 CG ATYR A 653 6165 6387 4843 691 -259 -1080 C ATOM 1585 CG BTYR A 653 18.143 15.569 22.056 0.50 49.16 C ANISOU 1585 CG BTYR A 653 6586 6808 5284 686 -269 -1092 C ATOM 1586 CD1ATYR A 653 17.331 14.350 21.599 0.50 46.98 C ANISOU 1586 CD1ATYR A 653 6308 6549 4993 676 -168 -941 C ATOM 1587 CD1BTYR A 653 17.276 14.566 21.634 0.50 50.24 C ANISOU 1587 CD1BTYR A 653 6720 6956 5413 677 -168 -956 C ATOM 1588 CD2ATYR A 653 17.345 16.487 22.653 0.50 47.04 C ANISOU 1588 CD2ATYR A 653 6351 6525 4998 724 -219 -1166 C ATOM 1589 CD2BTYR A 653 17.591 16.724 22.600 0.50 50.59 C ANISOU 1589 CD2BTYR A 653 6791 6965 5468 716 -246 -1192 C ATOM 1590 CE1ATYR A 653 15.945 14.307 21.685 0.50 48.13 C ANISOU 1590 CE1ATYR A 653 6466 6686 5136 694 -43 -884 C ATOM 1591 CE1BTYR A 653 15.900 14.696 21.772 0.50 51.14 C ANISOU 1591 CE1BTYR A 653 6847 7058 5526 698 -46 -916 C ATOM 1592 CE2ATYR A 653 15.955 16.457 22.744 0.50 47.87 C ANISOU 1592 CE2ATYR A 653 6471 6623 5093 747 -86 -1109 C ATOM 1593 CE2BTYR A 653 16.213 16.870 22.735 0.50 51.59 C ANISOU 1593 CE2BTYR A 653 6935 7081 5587 741 -118 -1152 C ATOM 1594 CZ ATYR A 653 15.260 15.360 22.262 0.50 54.99 C ANISOU 1594 CZ ATYR A 653 7358 7538 5999 731 1 -965 C ATOM 1595 CZ BTYR A 653 15.373 15.847 22.328 0.50 59.17 C ANISOU 1595 CZ BTYR A 653 7884 8054 6542 731 -18 -1011 C ATOM 1596 OH ATYR A 653 13.890 15.317 22.298 0.50 56.52 O ANISOU 1596 OH ATYR A 653 7550 7718 6209 747 130 -905 O ATOM 1597 OH BTYR A 653 14.013 15.983 22.412 0.50 62.02 O ANISOU 1597 OH BTYR A 653 8245 8397 6920 751 107 -967 O ATOM 0 H ATYR A 653 20.815 16.198 24.142 0.50 50.79 H new ATOM 0 H BTYR A 653 19.856 14.004 24.641 0.50 50.79 H new ATOM 0 HA ATYR A 653 19.831 13.851 23.241 0.50 47.90 H new ATOM 0 HA BTYR A 653 19.790 13.555 22.626 0.50 47.90 H new ATOM 0 HB2ATYR A 653 19.842 16.408 22.017 0.50 47.94 H new ATOM 0 HB2BTYR A 653 20.051 16.299 22.026 0.50 47.94 H new ATOM 0 HB3ATYR A 653 19.804 15.158 21.086 0.50 47.94 H new ATOM 0 HB3BTYR A 653 19.813 15.212 20.934 0.50 47.94 H new ATOM 0 HD1ATYR A 653 17.785 13.644 21.198 0.50 50.24 H new ATOM 0 HD1BTYR A 653 17.625 13.793 21.252 0.50 50.24 H new ATOM 0 HD2ATYR A 653 17.807 17.230 22.968 0.50 50.59 H new ATOM 0 HD2BTYR A 653 18.152 17.411 22.879 0.50 50.59 H new ATOM 0 HE1ATYR A 653 15.480 13.572 21.356 0.50 51.14 H new ATOM 0 HE1BTYR A 653 15.336 14.012 21.492 0.50 51.14 H new ATOM 0 HE2ATYR A 653 15.496 17.170 23.126 0.50 51.59 H new ATOM 0 HE2BTYR A 653 15.859 17.650 23.096 0.50 51.59 H new ATOM 0 HH ATYR A 653 13.597 16.010 22.672 0.50 62.02 H new ATOM 0 HH BTYR A 653 13.826 16.721 22.767 0.50 62.02 H new ATOM 1598 N SER A 654 22.661 14.142 23.362 1.00 47.19 N ANISOU 1598 N SER A 654 6362 6697 4872 741 -691 -1218 N ATOM 1599 CA SER A 654 24.062 13.806 23.047 1.00 46.38 C ANISOU 1599 CA SER A 654 6198 6592 4833 714 -809 -1228 C ATOM 1600 C SER A 654 24.184 12.366 22.526 1.00 46.75 C ANISOU 1600 C SER A 654 6235 6665 4865 707 -767 -1087 C ATOM 1601 O SER A 654 25.093 12.066 21.770 1.00 46.92 O ANISOU 1601 O SER A 654 6178 6659 4991 661 -815 -1062 O ATOM 1602 CB SER A 654 24.958 13.995 24.267 1.00 50.65 C ANISOU 1602 CB SER A 654 6790 7186 5267 781 -949 -1341 C ATOM 1603 OG SER A 654 24.547 13.191 25.360 1.00 60.21 O ANISOU 1603 OG SER A 654 8120 8489 6270 873 -928 -1304 O ATOM 0 H ASER A 654 22.536 14.269 24.203 0.50 47.19 H new ATOM 0 H BSER A 654 22.511 14.341 24.185 0.50 47.19 H new ATOM 0 HA SER A 654 24.355 14.412 22.349 1.00 46.38 H new ATOM 0 HB2 SER A 654 25.873 13.776 24.032 1.00 50.65 H new ATOM 0 HB3 SER A 654 24.949 14.928 24.532 1.00 50.65 H new ATOM 0 HG SER A 654 23.940 13.586 25.786 1.00 60.21 H new ATOM 1604 N SER A 655 23.246 11.503 22.920 1.00 41.23 N ANISOU 1604 N SER A 655 5609 6010 4045 751 -671 -994 N ATOM 1605 CA SER A 655 23.200 10.107 22.541 1.00 40.62 C ANISOU 1605 CA SER A 655 5533 5951 3951 751 -623 -861 C ATOM 1606 C SER A 655 22.150 9.857 21.425 1.00 42.59 C ANISOU 1606 C SER A 655 5740 6147 4294 690 -497 -766 C ATOM 1607 O SER A 655 21.760 8.720 21.190 1.00 42.54 O ANISOU 1607 O SER A 655 5747 6149 4267 694 -434 -656 O ATOM 1608 CB SER A 655 22.948 9.259 23.789 1.00 44.83 C ANISOU 1608 CB SER A 655 6174 6565 4293 844 -610 -816 C ATOM 1609 OG SER A 655 21.685 9.568 24.345 1.00 52.72 O ANISOU 1609 OG SER A 655 7240 7580 5209 880 -504 -809 O ATOM 0 H SER A 655 22.597 11.732 23.436 1.00 41.23 H new ATOM 0 HA SER A 655 24.054 9.844 22.162 1.00 40.62 H new ATOM 0 HB2 SER A 655 22.986 8.317 23.561 1.00 44.83 H new ATOM 0 HB3 SER A 655 23.645 9.421 24.444 1.00 44.83 H new ATOM 0 HG SER A 655 21.308 8.860 24.594 1.00 52.72 H new ATOM 1610 N TYR A 656 21.733 10.931 20.718 1.00 36.57 N ANISOU 1610 N TYR A 656 4925 5323 3645 635 -469 -811 N ATOM 1611 CA TYR A 656 20.778 10.909 19.617 1.00 34.48 C ANISOU 1611 CA TYR A 656 4617 5005 3479 577 -372 -738 C ATOM 1612 C TYR A 656 21.471 11.399 18.377 1.00 37.09 C ANISOU 1612 C TYR A 656 4856 5275 3959 503 -411 -753 C ATOM 1613 O TYR A 656 22.365 12.239 18.478 1.00 35.76 O ANISOU 1613 O TYR A 656 4655 5091 3840 492 -492 -843 O ATOM 1614 CB TYR A 656 19.523 11.787 19.916 1.00 35.20 C ANISOU 1614 CB TYR A 656 4731 5078 3565 589 -293 -765 C ATOM 1615 CG TYR A 656 18.526 11.087 20.817 1.00 35.71 C ANISOU 1615 CG TYR A 656 4872 5191 3504 652 -204 -705 C ATOM 1616 CD1 TYR A 656 18.720 11.035 22.194 1.00 37.39 C ANISOU 1616 CD1 TYR A 656 5172 5471 3562 735 -226 -750 C ATOM 1617 CD2 TYR A 656 17.430 10.409 20.286 1.00 35.42 C ANISOU 1617 CD2 TYR A 656 4821 5132 3505 631 -99 -596 C ATOM 1618 CE1 TYR A 656 17.853 10.333 23.022 1.00 34.82 C ANISOU 1618 CE1 TYR A 656 4921 5193 3117 797 -132 -679 C ATOM 1619 CE2 TYR A 656 16.533 9.727 21.113 1.00 36.29 C ANISOU 1619 CE2 TYR A 656 4991 5280 3517 687 -7 -529 C ATOM 1620 CZ TYR A 656 16.759 9.685 22.482 1.00 38.65 C ANISOU 1620 CZ TYR A 656 5380 5649 3658 771 -17 -565 C ATOM 1621 OH TYR A 656 15.935 8.976 23.325 1.00 38.24 O ANISOU 1621 OH TYR A 656 5392 5637 3501 833 84 -486 O ATOM 0 H TYR A 656 22.021 11.724 20.886 1.00 36.57 H new ATOM 0 HA TYR A 656 20.464 9.999 19.495 1.00 34.48 H new ATOM 0 HB2 TYR A 656 19.804 12.616 20.333 1.00 35.20 H new ATOM 0 HB3 TYR A 656 19.090 12.022 19.080 1.00 35.20 H new ATOM 0 HD1 TYR A 656 19.446 11.480 22.568 1.00 37.39 H new ATOM 0 HD2 TYR A 656 17.293 10.410 19.366 1.00 35.42 H new ATOM 0 HE1 TYR A 656 18.009 10.299 23.938 1.00 34.82 H new ATOM 0 HE2 TYR A 656 15.789 9.304 20.748 1.00 36.29 H new ATOM 0 HH TYR A 656 15.614 9.493 23.904 1.00 38.24 H new ATOM 1622 N PRO A 657 21.084 10.885 17.189 1.00 33.30 N ANISOU 1622 N PRO A 657 4336 4760 3556 452 -354 -667 N ATOM 1623 CA PRO A 657 21.720 11.348 15.960 1.00 33.30 C ANISOU 1623 CA PRO A 657 4259 4707 3687 387 -377 -671 C ATOM 1624 C PRO A 657 21.251 12.764 15.597 1.00 37.98 C ANISOU 1624 C PRO A 657 4817 5245 4367 354 -362 -722 C ATOM 1625 O PRO A 657 20.270 13.260 16.156 1.00 36.23 O ANISOU 1625 O PRO A 657 4630 5023 4113 378 -320 -743 O ATOM 1626 CB PRO A 657 21.240 10.320 14.903 1.00 33.82 C ANISOU 1626 CB PRO A 657 4312 4758 3779 357 -316 -566 C ATOM 1627 CG PRO A 657 20.541 9.236 15.653 1.00 37.53 C ANISOU 1627 CG PRO A 657 4844 5269 4147 403 -274 -508 C ATOM 1628 CD PRO A 657 20.028 9.897 16.888 1.00 34.00 C ANISOU 1628 CD PRO A 657 4446 4851 3621 452 -266 -563 C ATOM 0 HA PRO A 657 22.686 11.401 16.030 1.00 33.30 H new ATOM 0 HB2 PRO A 657 20.643 10.737 14.262 1.00 33.82 H new ATOM 0 HB3 PRO A 657 21.990 9.964 14.402 1.00 33.82 H new ATOM 0 HG2 PRO A 657 19.817 8.856 15.130 1.00 37.53 H new ATOM 0 HG3 PRO A 657 21.147 8.510 15.868 1.00 37.53 H new ATOM 0 HD2 PRO A 657 19.169 10.322 16.739 1.00 34.00 H new ATOM 0 HD3 PRO A 657 19.910 9.264 17.613 1.00 34.00 H new ATOM 1629 N ASP A 658 21.968 13.421 14.676 1.00 35.95 N ANISOU 1629 N ASP A 658 4492 4939 4228 302 -390 -738 N ATOM 1630 CA ASP A 658 21.572 14.745 14.210 1.00 36.67 C ANISOU 1630 CA ASP A 658 4545 4967 4419 267 -373 -771 C ATOM 1631 C ASP A 658 20.314 14.583 13.386 1.00 36.25 C ANISOU 1631 C ASP A 658 4495 4892 4385 246 -291 -689 C ATOM 1632 O ASP A 658 20.171 13.594 12.685 1.00 35.89 O ANISOU 1632 O ASP A 658 4452 4859 4323 233 -263 -609 O ATOM 1633 CB ASP A 658 22.652 15.348 13.303 1.00 39.97 C ANISOU 1633 CB ASP A 658 4886 5335 4964 216 -408 -782 C ATOM 1634 CG ASP A 658 23.986 15.621 13.941 1.00 56.48 C ANISOU 1634 CG ASP A 658 6948 7433 7080 225 -499 -865 C ATOM 1635 OD1 ASP A 658 24.056 15.634 15.184 1.00 61.01 O ANISOU 1635 OD1 ASP A 658 7566 8044 7570 274 -550 -938 O ATOM 1636 OD2 ASP A 658 24.971 15.822 13.193 1.00 65.06 O ANISOU 1636 OD2 ASP A 658 7965 8485 8270 186 -520 -857 O ATOM 0 H ASP A 658 22.684 13.114 14.313 1.00 35.95 H new ATOM 0 HA ASP A 658 21.437 15.327 14.974 1.00 36.67 H new ATOM 0 HB2 ASP A 658 22.791 14.747 12.554 1.00 39.97 H new ATOM 0 HB3 ASP A 658 22.313 16.181 12.939 1.00 39.97 H new ATOM 1637 N ILE A 659 19.397 15.520 13.482 1.00 32.66 N ANISOU 1637 N ILE A 659 4039 4401 3968 246 -257 -710 N ATOM 1638 CA ILE A 659 18.177 15.461 12.684 1.00 29.75 C ANISOU 1638 CA ILE A 659 3664 4006 3634 226 -191 -634 C ATOM 1639 C ILE A 659 18.103 16.672 11.730 1.00 30.83 C ANISOU 1639 C ILE A 659 3746 4070 3898 182 -188 -632 C ATOM 1640 O ILE A 659 17.747 16.491 10.579 1.00 30.00 O ANISOU 1640 O ILE A 659 3620 3943 3836 149 -164 -556 O ATOM 1641 CB ILE A 659 16.907 15.234 13.541 1.00 32.09 C ANISOU 1641 CB ILE A 659 4004 4325 3864 270 -134 -626 C ATOM 1642 CG1 ILE A 659 15.621 15.065 12.659 1.00 31.49 C ANISOU 1642 CG1 ILE A 659 3906 4218 3840 247 -74 -541 C ATOM 1643 CG2 ILE A 659 16.744 16.327 14.619 1.00 32.61 C ANISOU 1643 CG2 ILE A 659 4088 4381 3920 308 -138 -725 C ATOM 1644 CD1 ILE A 659 15.683 13.931 11.476 1.00 29.04 C ANISOU 1644 CD1 ILE A 659 3584 3913 3535 211 -75 -450 C ATOM 0 H ILE A 659 19.454 16.203 14.002 1.00 32.66 H new ATOM 0 HA ILE A 659 18.214 14.671 12.123 1.00 29.75 H new ATOM 0 HB ILE A 659 17.026 14.394 14.011 1.00 32.09 H new ATOM 0 HG12 ILE A 659 14.878 14.851 13.245 1.00 31.49 H new ATOM 0 HG13 ILE A 659 15.421 15.921 12.248 1.00 31.49 H new ATOM 0 HG21 ILE A 659 15.941 16.155 15.136 1.00 32.61 H new ATOM 0 HG22 ILE A 659 17.515 16.319 15.208 1.00 32.61 H new ATOM 0 HG23 ILE A 659 16.673 17.195 14.192 1.00 32.61 H new ATOM 0 HD11 ILE A 659 14.839 13.915 10.999 1.00 29.04 H new ATOM 0 HD12 ILE A 659 16.399 14.146 10.858 1.00 29.04 H new ATOM 0 HD13 ILE A 659 15.848 13.060 11.870 1.00 29.04 H new ATOM 1645 N ASN A 660 18.470 17.876 12.179 1.00 28.21 N ANISOU 1645 N ASN A 660 3393 3698 3627 183 -217 -715 N ATOM 1646 CA ASN A 660 18.490 19.070 11.314 1.00 27.46 C ANISOU 1646 CA ASN A 660 3243 3524 3666 142 -214 -709 C ATOM 1647 C ASN A 660 19.490 18.849 10.195 1.00 31.49 C ANISOU 1647 C ASN A 660 3714 4024 4229 98 -229 -656 C ATOM 1648 O ASN A 660 20.492 18.146 10.396 1.00 31.86 O ANISOU 1648 O ASN A 660 3762 4111 4234 101 -264 -669 O ATOM 1649 CB ASN A 660 18.786 20.316 12.130 1.00 25.89 C ANISOU 1649 CB ASN A 660 3030 3281 3528 154 -248 -819 C ATOM 1650 CG ASN A 660 17.666 20.639 13.106 1.00 34.02 C ANISOU 1650 CG ASN A 660 4101 4316 4510 203 -214 -869 C ATOM 1651 OD1 ASN A 660 16.490 20.398 12.850 1.00 28.55 O ANISOU 1651 OD1 ASN A 660 3419 3625 3804 212 -154 -806 O ATOM 1652 ND2 ASN A 660 18.005 21.177 14.262 1.00 23.89 N ANISOU 1652 ND2 ASN A 660 2842 3035 3201 238 -253 -985 N ATOM 0 H ASN A 660 18.714 18.027 12.990 1.00 28.21 H new ATOM 0 HA ASN A 660 17.618 19.210 10.913 1.00 27.46 H new ATOM 0 HB2 ASN A 660 19.614 20.192 12.619 1.00 25.89 H new ATOM 0 HB3 ASN A 660 18.920 21.068 11.533 1.00 25.89 H new ATOM 0 HD21 ASN A 660 17.400 21.362 14.844 1.00 23.89 H new ATOM 0 HD22 ASN A 660 18.831 21.343 14.433 1.00 23.89 H new ATOM 1653 N PHE A 661 19.153 19.286 8.982 1.00 27.60 N ANISOU 1653 N PHE A 661 3191 3485 3813 64 -198 -582 N ATOM 1654 CA PHE A 661 19.962 19.000 7.772 1.00 26.11 C ANISOU 1654 CA PHE A 661 2974 3290 3656 28 -192 -514 C ATOM 1655 C PHE A 661 21.129 19.953 7.507 1.00 29.40 C ANISOU 1655 C PHE A 661 3330 3651 4190 -3 -211 -540 C ATOM 1656 O PHE A 661 21.690 19.916 6.410 1.00 28.83 O ANISOU 1656 O PHE A 661 3231 3564 4159 -31 -187 -472 O ATOM 1657 CB PHE A 661 19.044 19.007 6.537 1.00 26.83 C ANISOU 1657 CB PHE A 661 3071 3362 3761 12 -151 -415 C ATOM 1658 CG PHE A 661 18.137 17.827 6.296 1.00 27.27 C ANISOU 1658 CG PHE A 661 3172 3468 3721 27 -135 -363 C ATOM 1659 CD1 PHE A 661 17.851 16.923 7.311 1.00 28.42 C ANISOU 1659 CD1 PHE A 661 3354 3666 3780 58 -141 -398 C ATOM 1660 CD2 PHE A 661 17.554 17.620 5.047 1.00 28.96 C ANISOU 1660 CD2 PHE A 661 3394 3675 3936 12 -118 -278 C ATOM 1661 CE1 PHE A 661 17.019 15.823 7.073 1.00 28.03 C ANISOU 1661 CE1 PHE A 661 3336 3650 3665 67 -125 -346 C ATOM 1662 CE2 PHE A 661 16.679 16.536 4.831 1.00 28.82 C ANISOU 1662 CE2 PHE A 661 3410 3693 3847 22 -114 -239 C ATOM 1663 CZ PHE A 661 16.420 15.655 5.844 1.00 24.62 C ANISOU 1663 CZ PHE A 661 2903 3203 3249 47 -115 -273 C ATOM 0 H PHE A 661 18.451 19.757 8.827 1.00 27.60 H new ATOM 0 HA PHE A 661 20.363 18.133 7.941 1.00 26.11 H new ATOM 0 HB2 PHE A 661 18.487 19.799 6.591 1.00 26.83 H new ATOM 0 HB3 PHE A 661 19.607 19.109 5.754 1.00 26.83 H new ATOM 0 HD1 PHE A 661 18.216 17.050 8.157 1.00 28.42 H new ATOM 0 HD2 PHE A 661 17.744 18.204 4.348 1.00 28.96 H new ATOM 0 HE1 PHE A 661 16.870 15.202 7.749 1.00 28.03 H new ATOM 0 HE2 PHE A 661 16.278 16.420 4.000 1.00 28.82 H new ATOM 0 HZ PHE A 661 15.839 14.942 5.703 1.00 24.62 H new ATOM 1664 N ASN A 662 21.466 20.838 8.437 1.00 25.57 N ANISOU 1664 N ASN A 662 2821 3129 3766 2 -249 -635 N ATOM 1665 CA ASN A 662 22.485 21.876 8.142 1.00 26.58 C ANISOU 1665 CA ASN A 662 2876 3183 4040 -34 -267 -658 C ATOM 1666 C ASN A 662 23.822 21.325 7.595 1.00 30.60 C ANISOU 1666 C ASN A 662 3346 3710 4572 -57 -272 -627 C ATOM 1667 O ASN A 662 24.373 21.940 6.680 1.00 31.39 O ANISOU 1667 O ASN A 662 3390 3753 4785 -93 -241 -574 O ATOM 1668 CB ASN A 662 22.719 22.793 9.347 1.00 26.79 C ANISOU 1668 CB ASN A 662 2886 3169 4126 -22 -325 -787 C ATOM 1669 CG ASN A 662 23.091 22.002 10.571 1.00 43.82 C ANISOU 1669 CG ASN A 662 5083 5400 6167 18 -383 -872 C ATOM 1670 OD1 ASN A 662 22.239 21.371 11.198 1.00 32.78 O ANISOU 1670 OD1 ASN A 662 3753 4061 4642 59 -372 -880 O ATOM 1671 ND2 ASN A 662 24.378 21.883 10.830 1.00 33.91 N ANISOU 1671 ND2 ASN A 662 3786 4148 4951 7 -442 -918 N ATOM 0 H ASN A 662 21.134 20.867 9.230 1.00 25.57 H new ATOM 0 HA ASN A 662 22.106 22.400 7.419 1.00 26.58 H new ATOM 0 HB2 ASN A 662 23.424 23.427 9.142 1.00 26.79 H new ATOM 0 HB3 ASN A 662 21.917 23.309 9.524 1.00 26.79 H new ATOM 0 HD21 ASN A 662 24.644 21.353 11.452 1.00 33.91 H new ATOM 0 HD22 ASN A 662 24.952 22.336 10.376 1.00 33.91 H new ATOM 1672 N ARG A 663 24.286 20.143 8.049 1.00 27.48 N ANISOU 1672 N ARG A 663 2977 3389 4073 -33 -299 -644 N ATOM 1673 CA ARG A 663 25.560 19.572 7.527 1.00 28.72 C ANISOU 1673 CA ARG A 663 3091 3562 4261 -50 -299 -615 C ATOM 1674 C ARG A 663 25.488 19.143 6.060 1.00 33.77 C ANISOU 1674 C ARG A 663 3735 4206 4891 -67 -222 -497 C ATOM 1675 O ARG A 663 26.525 19.018 5.433 1.00 34.16 O ANISOU 1675 O ARG A 663 3735 4245 4999 -86 -200 -464 O ATOM 1676 CB ARG A 663 26.117 18.448 8.399 1.00 27.38 C ANISOU 1676 CB ARG A 663 2944 3464 3994 -15 -352 -662 C ATOM 1677 CG ARG A 663 26.482 18.965 9.815 1.00 33.19 C ANISOU 1677 CG ARG A 663 3670 4195 4744 5 -441 -786 C ATOM 1678 CD ARG A 663 27.414 18.024 10.541 1.00 40.47 C ANISOU 1678 CD ARG A 663 4593 5177 5608 34 -505 -826 C ATOM 1679 NE ARG A 663 28.700 17.932 9.842 1.00 56.39 N ANISOU 1679 NE ARG A 663 6524 7168 7732 4 -504 -797 N ATOM 1680 CZ ARG A 663 29.561 16.924 9.961 1.00 71.48 C ANISOU 1680 CZ ARG A 663 8422 9127 9613 23 -531 -789 C ATOM 1681 NH1 ARG A 663 29.299 15.908 10.779 1.00 59.36 N ANISOU 1681 NH1 ARG A 663 6955 7664 7937 72 -568 -806 N ATOM 1682 NH2 ARG A 663 30.689 16.922 9.262 1.00 49.72 N ANISOU 1682 NH2 ARG A 663 5580 6341 6971 -3 -515 -759 N ATOM 0 H ARG A 663 23.892 19.663 8.644 1.00 27.48 H new ATOM 0 HA ARG A 663 26.187 20.311 7.571 1.00 28.72 H new ATOM 0 HB2 ARG A 663 25.462 17.736 8.471 1.00 27.38 H new ATOM 0 HB3 ARG A 663 26.904 18.068 7.978 1.00 27.38 H new ATOM 0 HG2 ARG A 663 26.898 19.838 9.742 1.00 33.19 H new ATOM 0 HG3 ARG A 663 25.671 19.080 10.335 1.00 33.19 H new ATOM 0 HD2 ARG A 663 27.555 18.336 11.449 1.00 40.47 H new ATOM 0 HD3 ARG A 663 27.010 17.144 10.603 1.00 40.47 H new ATOM 0 HE ARG A 663 28.914 18.578 9.316 1.00 56.39 H new ATOM 0 HH11 ARG A 663 28.570 15.900 11.235 1.00 59.36 H new ATOM 0 HH12 ARG A 663 29.859 15.259 10.852 1.00 59.36 H new ATOM 0 HH21 ARG A 663 30.866 17.574 8.730 1.00 49.72 H new ATOM 0 HH22 ARG A 663 31.243 16.269 9.341 1.00 49.72 H new ATOM 1683 N ALEU A 664 24.277 18.988 5.513 0.50 29.19 N ANISOU 1683 N ALEU A 664 3210 3638 4245 -61 -183 -437 N ATOM 1684 N BLEU A 664 24.265 18.979 5.502 0.50 29.56 N ANISOU 1684 N BLEU A 664 3258 3685 4290 -61 -183 -436 N ATOM 1685 CA ALEU A 664 24.090 18.648 4.111 0.50 28.44 C ANISOU 1685 CA ALEU A 664 3131 3547 4125 -72 -122 -332 C ATOM 1686 CA BLEU A 664 24.070 18.651 4.086 0.50 28.99 C ANISOU 1686 CA BLEU A 664 3202 3617 4195 -72 -121 -330 C ATOM 1687 C ALEU A 664 24.384 19.857 3.216 0.50 31.32 C ANISOU 1687 C ALEU A 664 3446 3838 4616 -105 -80 -278 C ATOM 1688 C BLEU A 664 24.386 19.857 3.209 0.50 31.57 C ANISOU 1688 C BLEU A 664 3478 3870 4648 -105 -79 -278 C ATOM 1689 O ALEU A 664 24.642 19.690 2.026 0.50 31.28 O ANISOU 1689 O ALEU A 664 3444 3835 4605 -113 -24 -192 O ATOM 1690 O BLEU A 664 24.629 19.692 2.016 0.50 31.52 O ANISOU 1690 O BLEU A 664 3475 3865 4635 -113 -24 -191 O ATOM 1691 CB ALEU A 664 22.663 18.140 3.896 0.50 27.72 C ANISOU 1691 CB ALEU A 664 3110 3487 3935 -53 -112 -295 C ATOM 1692 CB BLEU A 664 22.627 18.199 3.811 0.50 28.48 C ANISOU 1692 CB BLEU A 664 3206 3581 4036 -55 -109 -289 C ATOM 1693 CG ALEU A 664 22.391 17.424 2.587 0.50 32.32 C ANISOU 1693 CG ALEU A 664 3731 4097 4453 -54 -71 -206 C ATOM 1694 CG BLEU A 664 22.252 16.780 4.198 0.50 33.18 C ANISOU 1694 CG BLEU A 664 3856 4246 4506 -27 -124 -299 C ATOM 1695 CD1ALEU A 664 23.221 16.173 2.462 0.50 32.62 C ANISOU 1695 CD1ALEU A 664 3783 4187 4424 -41 -67 -208 C ATOM 1696 CD1BLEU A 664 20.785 16.567 4.043 0.50 32.65 C ANISOU 1696 CD1BLEU A 664 3834 4187 4384 -16 -118 -267 C ATOM 1697 CD2ALEU A 664 20.948 17.098 2.488 0.50 33.75 C ANISOU 1697 CD2ALEU A 664 3964 4294 4567 -40 -78 -181 C ATOM 1698 CD2BLEU A 664 23.019 15.725 3.366 0.50 35.84 C ANISOU 1698 CD2BLEU A 664 4204 4619 4794 -25 -100 -255 C ATOM 0 H ALEU A 664 23.543 19.079 5.952 0.50 29.56 H new ATOM 0 H BLEU A 664 23.531 19.057 5.944 0.50 29.56 H new ATOM 0 HA ALEU A 664 24.713 17.946 3.868 0.50 28.99 H new ATOM 0 HA BLEU A 664 24.675 17.923 3.873 0.50 28.99 H new ATOM 0 HB2ALEU A 664 22.442 17.538 4.623 0.50 28.48 H new ATOM 0 HB2BLEU A 664 22.030 18.804 4.277 0.50 28.48 H new ATOM 0 HB3ALEU A 664 22.058 18.896 3.960 0.50 28.48 H new ATOM 0 HB3BLEU A 664 22.455 18.306 2.862 0.50 28.48 H new ATOM 0 HG ALEU A 664 22.639 18.014 1.858 0.50 33.18 H new ATOM 0 HG BLEU A 664 22.502 16.666 5.128 0.50 33.18 H new ATOM 0 HD11ALEU A 664 23.026 15.738 1.617 0.50 32.65 H new ATOM 0 HD11BLEU A 664 20.562 15.657 4.294 0.50 32.65 H new ATOM 0 HD12ALEU A 664 24.162 16.404 2.496 0.50 32.65 H new ATOM 0 HD12BLEU A 664 20.306 17.187 4.615 0.50 32.65 H new ATOM 0 HD13ALEU A 664 23.010 15.570 3.192 0.50 32.65 H new ATOM 0 HD13BLEU A 664 20.532 16.719 3.119 0.50 32.65 H new ATOM 0 HD21ALEU A 664 20.776 16.640 1.650 0.50 35.84 H new ATOM 0 HD21BLEU A 664 22.751 14.835 3.644 0.50 35.84 H new ATOM 0 HD22ALEU A 664 20.694 16.524 3.228 0.50 35.84 H new ATOM 0 HD22BLEU A 664 22.815 15.844 2.425 0.50 35.84 H new ATOM 0 HD23ALEU A 664 20.428 17.916 2.521 0.50 35.84 H new ATOM 0 HD23BLEU A 664 23.973 15.833 3.506 0.50 35.84 H new ATOM 1699 N PHE A 665 24.391 21.064 3.802 1.00 27.11 N ANISOU 1699 N PHE A 665 2867 3237 4196 -120 -104 -329 N ATOM 1700 CA PHE A 665 24.632 22.322 3.091 1.00 27.53 C ANISOU 1700 CA PHE A 665 2865 3203 4391 -152 -66 -279 C ATOM 1701 C PHE A 665 26.076 22.779 3.157 1.00 34.07 C ANISOU 1701 C PHE A 665 3605 3985 5355 -180 -66 -303 C ATOM 1702 O PHE A 665 26.416 23.743 2.508 1.00 35.10 O ANISOU 1702 O PHE A 665 3682 4038 5615 -209 -24 -249 O ATOM 1703 CB PHE A 665 23.664 23.428 3.628 1.00 29.18 C ANISOU 1703 CB PHE A 665 3072 3349 4664 -151 -89 -319 C ATOM 1704 CG PHE A 665 22.213 23.026 3.794 1.00 28.88 C ANISOU 1704 CG PHE A 665 3105 3352 4515 -120 -94 -311 C ATOM 1705 CD1 PHE A 665 21.608 22.128 2.907 1.00 31.13 C ANISOU 1705 CD1 PHE A 665 3446 3695 4688 -108 -65 -226 C ATOM 1706 CD2 PHE A 665 21.437 23.565 4.819 1.00 30.80 C ANISOU 1706 CD2 PHE A 665 3357 3571 4774 -102 -127 -391 C ATOM 1707 CE1 PHE A 665 20.264 21.746 3.075 1.00 31.09 C ANISOU 1707 CE1 PHE A 665 3492 3719 4602 -83 -75 -219 C ATOM 1708 CE2 PHE A 665 20.085 23.209 4.963 1.00 31.23 C ANISOU 1708 CE2 PHE A 665 3464 3658 4744 -74 -122 -377 C ATOM 1709 CZ PHE A 665 19.513 22.299 4.097 1.00 29.06 C ANISOU 1709 CZ PHE A 665 3233 3437 4373 -67 -99 -290 C ATOM 0 H APHE A 665 24.252 21.172 4.644 0.50 27.11 H new ATOM 0 H BPHE A 665 24.251 21.170 4.644 0.50 27.11 H new ATOM 0 HA PHE A 665 24.450 22.161 2.152 1.00 27.53 H new ATOM 0 HB2 PHE A 665 23.996 23.732 4.487 1.00 29.18 H new ATOM 0 HB3 PHE A 665 23.703 24.186 3.024 1.00 29.18 H new ATOM 0 HD1 PHE A 665 22.100 21.780 2.199 1.00 31.13 H new ATOM 0 HD2 PHE A 665 21.819 24.168 5.415 1.00 30.80 H new ATOM 0 HE1 PHE A 665 19.881 21.123 2.500 1.00 31.09 H new ATOM 0 HE2 PHE A 665 19.575 23.587 5.643 1.00 31.23 H new ATOM 0 HZ PHE A 665 18.621 22.057 4.201 1.00 29.06 H new ATOM 1710 N GLU A 666 26.945 22.076 3.877 1.00 33.26 N ANISOU 1710 N GLU A 666 3483 3924 5232 -172 -111 -373 N ATOM 1711 CA GLU A 666 28.333 22.519 4.011 1.00 34.48 C ANISOU 1711 CA GLU A 666 3538 4028 5534 -200 -123 -403 C ATOM 1712 C GLU A 666 29.313 21.889 3.025 1.00 35.65 C ANISOU 1712 C GLU A 666 3653 4197 5694 -208 -54 -320 C ATOM 1713 O GLU A 666 29.067 20.806 2.507 1.00 34.18 O ANISOU 1713 O GLU A 666 3531 4085 5371 -182 -19 -270 O ATOM 1714 CB GLU A 666 28.822 22.331 5.459 1.00 36.62 C ANISOU 1714 CB GLU A 666 3790 4317 5806 -186 -228 -538 C ATOM 1715 CG GLU A 666 29.061 20.894 5.893 1.00 43.78 C ANISOU 1715 CG GLU A 666 4743 5323 6569 -150 -258 -559 C ATOM 1716 CD GLU A 666 29.283 20.641 7.376 1.00 63.82 C ANISOU 1716 CD GLU A 666 7290 7894 9065 -122 -367 -684 C ATOM 1717 OE1 GLU A 666 29.005 21.537 8.210 1.00 59.06 O ANISOU 1717 OE1 GLU A 666 6681 7249 8510 -123 -424 -771 O ATOM 1718 OE2 GLU A 666 29.682 19.502 7.706 1.00 55.70 O ANISOU 1718 OE2 GLU A 666 6283 6937 7945 -93 -393 -692 O ATOM 0 H GLU A 666 26.756 21.347 4.292 1.00 33.26 H new ATOM 0 HA GLU A 666 28.321 23.462 3.783 1.00 34.48 H new ATOM 0 HB2 GLU A 666 29.648 22.827 5.571 1.00 36.62 H new ATOM 0 HB3 GLU A 666 28.170 22.728 6.057 1.00 36.62 H new ATOM 0 HG2 GLU A 666 28.300 20.364 5.609 1.00 43.78 H new ATOM 0 HG3 GLU A 666 29.835 20.560 5.412 1.00 43.78 H new ATOM 1719 N GLY A 667 30.414 22.599 2.767 1.00 34.06 N ANISOU 1719 N GLY A 667 3349 3925 5668 -242 -30 -307 N ATOM 1720 CA GLY A 667 31.528 22.097 1.963 1.00 33.92 C ANISOU 1720 CA GLY A 667 3278 3918 5691 -248 41 -239 C ATOM 1721 C GLY A 667 31.327 21.989 0.469 1.00 40.47 C ANISOU 1721 C GLY A 667 4146 4757 6473 -245 164 -99 C ATOM 1722 O GLY A 667 30.308 22.445 -0.074 1.00 40.65 O ANISOU 1722 O GLY A 667 4231 4769 6447 -243 194 -41 O ATOM 0 H GLY A 667 30.535 23.399 3.060 1.00 34.06 H new ATOM 0 HA2 GLY A 667 32.292 22.673 2.120 1.00 33.92 H new ATOM 0 HA3 GLY A 667 31.763 21.217 2.296 1.00 33.92 H new ATOM 1723 N AARG A 668 32.305 21.373 -0.209 0.50 37.75 N ANISOU 1723 N AARG A 668 3767 4436 6140 -239 236 -45 N ATOM 1724 N BARG A 668 32.309 21.380 -0.210 0.50 38.23 N ANISOU 1724 N BARG A 668 3827 4496 6203 -239 236 -45 N ATOM 1725 CA AARG A 668 32.344 21.263 -1.670 0.50 37.75 C ANISOU 1725 CA AARG A 668 3800 4447 6097 -230 364 87 C ATOM 1726 CA BARG A 668 32.329 21.260 -1.669 0.50 38.45 C ANISOU 1726 CA BARG A 668 3889 4536 6184 -230 363 87 C ATOM 1727 C AARG A 668 32.428 19.844 -2.230 0.50 41.81 C ANISOU 1727 C AARG A 668 4385 5055 6445 -187 405 112 C ATOM 1728 C BARG A 668 32.467 19.837 -2.214 0.50 42.24 C ANISOU 1728 C BARG A 668 4437 5110 6503 -187 404 110 C ATOM 1729 O AARG A 668 32.837 19.681 -3.389 0.50 42.38 O ANISOU 1729 O AARG A 668 4466 5137 6498 -175 517 207 O ATOM 1730 O BARG A 668 32.931 19.667 -3.351 0.50 42.97 O ANISOU 1730 O BARG A 668 4533 5210 6582 -175 517 204 O ATOM 1731 CB AARG A 668 33.510 22.108 -2.222 0.50 37.91 C ANISOU 1731 CB AARG A 668 3700 4384 6318 -264 452 154 C ATOM 1732 CB BARG A 668 33.424 22.166 -2.254 0.50 39.85 C ANISOU 1732 CB BARG A 668 3950 4628 6563 -264 453 157 C ATOM 1733 CG AARG A 668 33.423 23.567 -1.868 0.50 38.12 C ANISOU 1733 CG AARG A 668 3656 4302 6525 -308 428 146 C ATOM 1734 CG BARG A 668 32.948 23.583 -2.413 0.50 44.60 C ANISOU 1734 CG BARG A 668 4526 5136 7287 -298 464 198 C ATOM 1735 CD AARG A 668 34.069 24.409 -2.917 0.50 35.44 C ANISOU 1735 CD AARG A 668 3245 3886 6335 -333 556 272 C ATOM 1736 CD BARG A 668 33.851 24.392 -3.302 0.50 47.82 C ANISOU 1736 CD BARG A 668 4842 5463 7864 -326 586 310 C ATOM 1737 NE AARG A 668 34.191 25.783 -2.453 0.50 31.51 N ANISOU 1737 NE AARG A 668 2652 3265 6053 -382 524 249 N ATOM 1738 NE BARG A 668 33.555 25.818 -3.192 0.50 49.76 N ANISOU 1738 NE BARG A 668 5038 5597 8271 -364 579 331 N ATOM 1739 CZ AARG A 668 33.486 26.803 -2.921 0.50 38.55 C ANISOU 1739 CZ AARG A 668 3565 4090 6990 -395 558 322 C ATOM 1740 CZ BARG A 668 34.049 26.610 -2.248 0.50 62.66 C ANISOU 1740 CZ BARG A 668 6563 7140 10106 -407 505 242 C ATOM 1741 NH1AARG A 668 33.673 28.019 -2.436 0.50 29.45 N ANISOU 1741 NH1AARG A 668 2319 2818 6053 -440 524 289 N ATOM 1742 NH1BARG A 668 33.737 27.897 -2.225 0.50 48.97 N ANISOU 1742 NH1BARG A 668 4789 5297 8519 -439 505 264 N ATOM 1743 NH2AARG A 668 32.598 26.618 -3.891 0.50 25.99 N ANISOU 1743 NH2AARG A 668 2087 2549 5238 -363 622 426 N ATOM 1744 NH2BARG A 668 34.863 26.120 -1.317 0.50 52.01 N ANISOU 1744 NH2BARG A 668 5144 5804 8814 -414 424 127 N ATOM 0 H AARG A 668 32.977 21.001 0.178 0.50 38.23 H new ATOM 0 H BARG A 668 32.990 21.021 0.173 0.50 38.23 H new ATOM 0 HA AARG A 668 31.484 21.598 -1.969 0.50 38.45 H new ATOM 0 HA BARG A 668 31.449 21.548 -1.959 0.50 38.45 H new ATOM 0 HB2AARG A 668 34.346 21.751 -1.883 0.50 39.85 H new ATOM 0 HB2BARG A 668 34.202 22.149 -1.675 0.50 39.85 H new ATOM 0 HB3AARG A 668 33.534 22.019 -3.188 0.50 39.85 H new ATOM 0 HB3BARG A 668 33.704 21.820 -3.116 0.50 39.85 H new ATOM 0 HG2AARG A 668 32.493 23.825 -1.768 0.50 44.60 H new ATOM 0 HG2BARG A 668 32.051 23.581 -2.782 0.50 44.60 H new ATOM 0 HG3AARG A 668 33.853 23.722 -1.013 0.50 44.60 H new ATOM 0 HG3BARG A 668 32.895 24.004 -1.541 0.50 44.60 H new ATOM 0 HD2AARG A 668 34.946 24.054 -3.132 0.50 47.82 H new ATOM 0 HD2BARG A 668 34.777 24.231 -3.061 0.50 47.82 H new ATOM 0 HD3AARG A 668 33.544 24.381 -3.732 0.50 47.82 H new ATOM 0 HD3BARG A 668 33.744 24.106 -4.223 0.50 47.82 H new ATOM 0 HE AARG A 668 34.762 25.945 -1.830 0.50 49.76 H new ATOM 0 HE BARG A 668 33.028 26.166 -3.775 0.50 49.76 H new ATOM 0 HH11AARG A 668 34.253 28.150 -1.815 0.50 48.97 H new ATOM 0 HH11BARG A 668 33.212 28.223 -2.823 0.50 48.97 H new ATOM 0 HH12AARG A 668 33.214 28.679 -2.742 0.50 48.97 H new ATOM 0 HH12BARG A 668 34.059 28.407 -1.612 0.50 48.97 H new ATOM 0 HH21AARG A 668 32.477 25.832 -4.220 0.50 52.01 H new ATOM 0 HH21BARG A 668 35.072 25.286 -1.324 0.50 52.01 H new ATOM 0 HH22AARG A 668 32.143 27.284 -4.191 0.50 52.01 H new ATOM 0 HH22BARG A 668 35.180 26.637 -0.708 0.50 52.01 H new ATOM 1745 N SER A 669 32.023 18.822 -1.454 1.00 37.76 N ANISOU 1745 N SER A 669 3929 4610 5810 -160 320 30 N ATOM 1746 CA SER A 669 32.055 17.433 -1.958 1.00 37.94 C ANISOU 1746 CA SER A 669 4022 4712 5683 -119 353 46 C ATOM 1747 C SER A 669 31.162 17.343 -3.220 1.00 40.57 C ANISOU 1747 C SER A 669 4457 5072 5885 -101 423 137 C ATOM 1748 O SER A 669 30.067 17.915 -3.238 1.00 38.61 O ANISOU 1748 O SER A 669 4259 4811 5602 -109 392 151 O ATOM 1749 CB SER A 669 31.547 16.446 -0.910 1.00 42.75 C ANISOU 1749 CB SER A 669 4681 5377 6184 -95 250 -45 C ATOM 1750 OG SER A 669 31.254 15.192 -1.508 1.00 53.53 O ANISOU 1750 OG SER A 669 6132 6808 7398 -58 281 -21 O ATOM 0 H ASER A 669 31.732 18.908 -0.649 0.50 37.76 H new ATOM 0 H BSER A 669 31.705 18.912 -0.660 0.50 37.76 H new ATOM 0 HA SER A 669 32.973 17.201 -2.168 1.00 37.94 H new ATOM 0 HB2 SER A 669 32.215 16.331 -0.216 1.00 42.75 H new ATOM 0 HB3 SER A 669 30.752 16.800 -0.483 1.00 42.75 H new ATOM 0 HG SER A 669 30.977 14.659 -0.921 1.00 53.53 H new ATOM 1751 N SER A 670 31.647 16.657 -4.264 1.00 37.86 N ANISOU 1751 N SER A 670 4145 4765 5476 -72 515 196 N ATOM 1752 CA SER A 670 30.909 16.448 -5.513 1.00 38.69 C ANISOU 1752 CA SER A 670 4357 4905 5439 -46 575 275 C ATOM 1753 C SER A 670 29.667 15.581 -5.258 1.00 43.69 C ANISOU 1753 C SER A 670 5093 5591 5914 -25 489 226 C ATOM 1754 O SER A 670 28.781 15.516 -6.109 1.00 45.27 O ANISOU 1754 O SER A 670 5384 5816 6002 -7 500 275 O ATOM 1755 CB SER A 670 31.807 15.752 -6.534 1.00 43.62 C ANISOU 1755 CB SER A 670 4993 5561 6018 -12 688 326 C ATOM 1756 OG SER A 670 32.083 14.424 -6.101 1.00 51.38 O ANISOU 1756 OG SER A 670 5993 6593 6936 16 651 251 O ATOM 0 H SER A 670 32.427 16.295 -4.263 1.00 37.86 H new ATOM 0 HA SER A 670 30.631 17.311 -5.857 1.00 38.69 H new ATOM 0 HB2 SER A 670 31.373 15.736 -7.402 1.00 43.62 H new ATOM 0 HB3 SER A 670 32.635 16.246 -6.640 1.00 43.62 H new ATOM 0 HG SER A 670 32.769 14.138 -6.493 1.00 51.38 H new ATOM 1757 N ARG A 671 29.606 14.929 -4.077 1.00 39.00 N ANISOU 1757 N ARG A 671 4483 5015 5319 -25 401 133 N ATOM 1758 CA ARG A 671 28.513 14.056 -3.698 1.00 37.74 C ANISOU 1758 CA ARG A 671 4405 4898 5035 -8 325 88 C ATOM 1759 C ARG A 671 27.338 14.795 -3.078 1.00 38.91 C ANISOU 1759 C ARG A 671 4567 5023 5193 -28 255 71 C ATOM 1760 O ARG A 671 26.228 14.258 -3.105 1.00 37.83 O ANISOU 1760 O ARG A 671 4503 4915 4957 -15 211 62 O ATOM 1761 CB ARG A 671 29.016 12.904 -2.801 1.00 38.58 C ANISOU 1761 CB ARG A 671 4497 5036 5126 11 279 13 C ATOM 1762 CG ARG A 671 29.981 11.898 -3.530 1.00 41.99 C ANISOU 1762 CG ARG A 671 4932 5496 5524 43 350 27 C ATOM 1763 CD ARG A 671 29.531 11.438 -4.936 1.00 44.52 C ANISOU 1763 CD ARG A 671 5349 5846 5720 70 413 81 C ATOM 1764 NE ARG A 671 30.215 12.207 -5.984 1.00 52.41 N ANISOU 1764 NE ARG A 671 6326 6828 6761 70 521 159 N ATOM 1765 CZ ARG A 671 30.070 12.033 -7.296 1.00 67.55 C ANISOU 1765 CZ ARG A 671 8320 8770 8576 98 595 218 C ATOM 1766 NH1 ARG A 671 29.265 11.087 -7.765 1.00 51.19 N ANISOU 1766 NH1 ARG A 671 6352 6739 6358 128 562 197 N ATOM 1767 NH2 ARG A 671 30.747 12.789 -8.150 1.00 60.79 N ANISOU 1767 NH2 ARG A 671 7438 7895 7764 100 703 299 N ATOM 0 H ARG A 671 30.217 14.994 -3.475 1.00 39.00 H new ATOM 0 HA ARG A 671 28.167 13.670 -4.518 1.00 37.74 H new ATOM 0 HB2 ARG A 671 29.476 13.281 -2.035 1.00 38.58 H new ATOM 0 HB3 ARG A 671 28.251 12.414 -2.460 1.00 38.58 H new ATOM 0 HG2 ARG A 671 30.855 12.312 -3.607 1.00 41.99 H new ATOM 0 HG3 ARG A 671 30.087 11.113 -2.970 1.00 41.99 H new ATOM 0 HD2 ARG A 671 29.721 10.493 -5.047 1.00 44.52 H new ATOM 0 HD3 ARG A 671 28.571 11.547 -5.024 1.00 44.52 H new ATOM 0 HE ARG A 671 30.757 12.824 -5.728 1.00 52.41 H new ATOM 0 HH11 ARG A 671 28.833 10.581 -7.220 1.00 51.19 H new ATOM 0 HH12 ARG A 671 29.176 10.980 -8.614 1.00 51.19 H new ATOM 0 HH21 ARG A 671 31.283 13.395 -7.857 1.00 60.79 H new ATOM 0 HH22 ARG A 671 30.650 12.673 -8.997 1.00 60.79 H new ATOM 1768 N LYS A 672 27.550 16.011 -2.544 1.00 34.97 N ANISOU 1768 N LYS A 672 3997 4467 4821 -59 245 64 N ATOM 1769 CA LYS A 672 26.440 16.799 -1.971 1.00 35.56 C ANISOU 1769 CA LYS A 672 4082 4514 4916 -74 187 46 C ATOM 1770 C LYS A 672 25.347 17.106 -2.970 1.00 39.39 C ANISOU 1770 C LYS A 672 4634 4998 5333 -67 205 120 C ATOM 1771 O LYS A 672 24.209 16.870 -2.595 1.00 40.74 O ANISOU 1771 O LYS A 672 4849 5185 5446 -60 149 96 O ATOM 1772 CB LYS A 672 26.885 18.088 -1.256 1.00 39.93 C ANISOU 1772 CB LYS A 672 4548 4997 5627 -106 171 17 C ATOM 1773 CG LYS A 672 27.654 17.855 0.024 1.00 40.73 C ANISOU 1773 CG LYS A 672 4591 5100 5785 -109 112 -80 C ATOM 1774 CD LYS A 672 26.805 17.252 1.136 1.00 42.69 C ANISOU 1774 CD LYS A 672 4888 5388 5945 -89 33 -156 C ATOM 1775 CE LYS A 672 27.304 17.680 2.483 1.00 43.92 C ANISOU 1775 CE LYS A 672 4987 5522 6179 -95 -36 -251 C ATOM 1776 NZ LYS A 672 28.705 17.302 2.717 1.00 53.93 N ANISOU 1776 NZ LYS A 672 6188 6795 7507 -96 -44 -280 N ATOM 0 H LYS A 672 28.319 16.394 -2.504 1.00 34.97 H new ATOM 0 HA LYS A 672 26.071 16.211 -1.293 1.00 35.56 H new ATOM 0 HB2 LYS A 672 27.436 18.608 -1.862 1.00 39.93 H new ATOM 0 HB3 LYS A 672 26.100 18.622 -1.057 1.00 39.93 H new ATOM 0 HG2 LYS A 672 28.403 17.266 -0.159 1.00 40.73 H new ATOM 0 HG3 LYS A 672 28.024 18.698 0.329 1.00 40.73 H new ATOM 0 HD2 LYS A 672 25.881 17.526 1.027 1.00 42.69 H new ATOM 0 HD3 LYS A 672 26.823 16.284 1.073 1.00 42.69 H new ATOM 0 HE2 LYS A 672 27.215 18.642 2.566 1.00 43.92 H new ATOM 0 HE3 LYS A 672 26.747 17.283 3.171 1.00 43.92 H new ATOM 0 HZ1 LYS A 672 28.917 17.457 3.567 1.00 53.93 H new ATOM 0 HZ2 LYS A 672 28.813 16.437 2.538 1.00 53.93 H new ATOM 0 HZ3 LYS A 672 29.235 17.783 2.188 1.00 53.93 H new ATOM 1777 N PRO A 673 25.612 17.559 -4.232 1.00 37.70 N ANISOU 1777 N PRO A 673 4434 4772 5120 -65 280 214 N ATOM 1778 CA PRO A 673 24.495 17.783 -5.175 1.00 36.05 C ANISOU 1778 CA PRO A 673 4298 4570 4828 -51 279 284 C ATOM 1779 C PRO A 673 23.690 16.517 -5.450 1.00 36.69 C ANISOU 1779 C PRO A 673 4467 4715 4758 -23 235 261 C ATOM 1780 O PRO A 673 22.509 16.602 -5.775 1.00 36.40 O ANISOU 1780 O PRO A 673 4480 4683 4668 -16 192 284 O ATOM 1781 CB PRO A 673 25.176 18.236 -6.481 1.00 39.09 C ANISOU 1781 CB PRO A 673 4693 4947 5214 -43 378 388 C ATOM 1782 CG PRO A 673 26.592 18.452 -6.179 1.00 44.50 C ANISOU 1782 CG PRO A 673 5289 5602 6016 -60 437 378 C ATOM 1783 CD PRO A 673 26.926 17.889 -4.851 1.00 40.41 C ANISOU 1783 CD PRO A 673 4724 5093 5537 -71 372 266 C ATOM 0 HA PRO A 673 23.868 18.427 -4.810 1.00 36.05 H new ATOM 0 HB2 PRO A 673 25.072 17.564 -7.172 1.00 39.09 H new ATOM 0 HB3 PRO A 673 24.769 19.051 -6.815 1.00 39.09 H new ATOM 0 HG2 PRO A 673 27.142 18.036 -6.861 1.00 44.50 H new ATOM 0 HG3 PRO A 673 26.791 19.401 -6.194 1.00 44.50 H new ATOM 0 HD2 PRO A 673 27.483 17.100 -4.934 1.00 40.41 H new ATOM 0 HD3 PRO A 673 27.418 18.528 -4.312 1.00 40.41 H new ATOM 1784 N GLU A 674 24.330 15.354 -5.341 1.00 31.46 N ANISOU 1784 N GLU A 674 3817 4096 4039 -7 245 217 N ATOM 1785 CA GLU A 674 23.689 14.062 -5.578 1.00 31.16 C ANISOU 1785 CA GLU A 674 3856 4110 3875 18 204 188 C ATOM 1786 C GLU A 674 22.760 13.738 -4.418 1.00 33.34 C ANISOU 1786 C GLU A 674 4125 4384 4158 8 121 123 C ATOM 1787 O GLU A 674 21.658 13.265 -4.654 1.00 34.63 O ANISOU 1787 O GLU A 674 4341 4563 4253 17 74 123 O ATOM 1788 CB GLU A 674 24.748 12.942 -5.801 1.00 32.81 C ANISOU 1788 CB GLU A 674 4073 4354 4038 40 248 161 C ATOM 1789 CG GLU A 674 25.644 13.156 -7.013 1.00 37.16 C ANISOU 1789 CG GLU A 674 4637 4911 4568 58 347 228 C ATOM 1790 CD GLU A 674 24.962 13.477 -8.344 1.00 64.63 C ANISOU 1790 CD GLU A 674 8200 8405 7951 78 367 304 C ATOM 1791 OE1 GLU A 674 23.852 12.955 -8.614 1.00 42.99 O ANISOU 1791 OE1 GLU A 674 5532 5687 5116 90 298 289 O ATOM 1792 OE2 GLU A 674 25.544 14.276 -9.114 1.00 54.22 O ANISOU 1792 OE2 GLU A 674 6873 7072 6656 83 452 383 O ATOM 0 H GLU A 674 25.160 15.293 -5.124 1.00 31.46 H new ATOM 0 HA GLU A 674 23.161 14.112 -6.390 1.00 31.16 H new ATOM 0 HB2 GLU A 674 25.304 12.876 -5.009 1.00 32.81 H new ATOM 0 HB3 GLU A 674 24.289 12.093 -5.898 1.00 32.81 H new ATOM 0 HG2 GLU A 674 26.257 13.879 -6.808 1.00 37.16 H new ATOM 0 HG3 GLU A 674 26.179 12.356 -7.135 1.00 37.16 H new ATOM 1793 N LYS A 675 23.186 14.037 -3.175 1.00 27.50 N ANISOU 1793 N LYS A 675 3320 3625 3505 -8 104 70 N ATOM 1794 CA LYS A 675 22.376 13.841 -1.969 1.00 27.08 C ANISOU 1794 CA LYS A 675 3261 3571 3458 -11 39 12 C ATOM 1795 C LYS A 675 21.176 14.786 -2.012 1.00 30.14 C ANISOU 1795 C LYS A 675 3651 3926 3874 -22 14 38 C ATOM 1796 O LYS A 675 20.061 14.356 -1.757 1.00 27.83 O ANISOU 1796 O LYS A 675 3388 3644 3543 -16 -28 27 O ATOM 1797 CB LYS A 675 23.190 14.077 -0.689 1.00 27.76 C ANISOU 1797 CB LYS A 675 3283 3646 3618 -19 25 -51 C ATOM 1798 CG LYS A 675 24.208 12.979 -0.397 1.00 34.26 C ANISOU 1798 CG LYS A 675 4100 4503 4413 -2 30 -86 C ATOM 1799 CD LYS A 675 24.920 13.297 0.909 1.00 36.72 C ANISOU 1799 CD LYS A 675 4350 4805 4797 -7 -4 -150 C ATOM 1800 CE LYS A 675 25.059 12.112 1.790 1.00 36.38 C ANISOU 1800 CE LYS A 675 4325 4801 4698 18 -42 -196 C ATOM 1801 NZ LYS A 675 25.497 12.476 3.160 1.00 43.77 N ANISOU 1801 NZ LYS A 675 5217 5733 5681 21 -92 -262 N ATOM 0 H LYS A 675 23.965 14.363 -3.014 1.00 27.50 H new ATOM 0 HA LYS A 675 22.073 12.920 -1.952 1.00 27.08 H new ATOM 0 HB2 LYS A 675 23.654 14.926 -0.762 1.00 27.76 H new ATOM 0 HB3 LYS A 675 22.581 14.151 0.063 1.00 27.76 H new ATOM 0 HG2 LYS A 675 23.764 12.119 -0.336 1.00 34.26 H new ATOM 0 HG3 LYS A 675 24.850 12.916 -1.122 1.00 34.26 H new ATOM 0 HD2 LYS A 675 25.800 13.655 0.714 1.00 36.72 H new ATOM 0 HD3 LYS A 675 24.430 13.989 1.380 1.00 36.72 H new ATOM 0 HE2 LYS A 675 24.210 11.646 1.838 1.00 36.38 H new ATOM 0 HE3 LYS A 675 25.699 11.496 1.401 1.00 36.38 H new ATOM 0 HZ1 LYS A 675 26.054 11.854 3.469 1.00 43.77 H new ATOM 0 HZ2 LYS A 675 25.913 13.262 3.140 1.00 43.77 H new ATOM 0 HZ3 LYS A 675 24.787 12.530 3.694 1.00 43.77 H new ATOM 1802 N LEU A 676 21.411 16.038 -2.446 1.00 27.98 N ANISOU 1802 N LEU A 676 3345 3609 3676 -37 46 84 N ATOM 1803 CA LEU A 676 20.394 17.075 -2.565 1.00 28.81 C ANISOU 1803 CA LEU A 676 3445 3672 3828 -44 28 118 C ATOM 1804 C LEU A 676 19.389 16.768 -3.644 1.00 31.15 C ANISOU 1804 C LEU A 676 3805 3987 4043 -29 10 178 C ATOM 1805 O LEU A 676 18.209 17.000 -3.424 1.00 32.39 O ANISOU 1805 O LEU A 676 3966 4130 4212 -27 -33 179 O ATOM 1806 CB LEU A 676 21.026 18.472 -2.746 1.00 29.57 C ANISOU 1806 CB LEU A 676 3487 3707 4043 -64 69 154 C ATOM 1807 CG LEU A 676 21.788 19.003 -1.510 1.00 34.05 C ANISOU 1807 CG LEU A 676 3982 4240 4716 -82 61 78 C ATOM 1808 CD1 LEU A 676 22.620 20.233 -1.857 1.00 35.14 C ANISOU 1808 CD1 LEU A 676 4058 4310 4983 -105 107 117 C ATOM 1809 CD2 LEU A 676 20.844 19.323 -0.352 1.00 34.82 C ANISOU 1809 CD2 LEU A 676 4071 4320 4840 -79 8 11 C ATOM 0 H LEU A 676 22.193 16.305 -2.684 1.00 27.98 H new ATOM 0 HA LEU A 676 19.904 17.087 -1.728 1.00 28.81 H new ATOM 0 HB2 LEU A 676 21.637 18.442 -3.499 1.00 29.57 H new ATOM 0 HB3 LEU A 676 20.326 19.103 -2.974 1.00 29.57 H new ATOM 0 HG LEU A 676 22.385 18.293 -1.226 1.00 34.05 H new ATOM 0 HD11 LEU A 676 23.086 20.543 -1.065 1.00 35.14 H new ATOM 0 HD12 LEU A 676 23.267 20.004 -2.542 1.00 35.14 H new ATOM 0 HD13 LEU A 676 22.038 20.936 -2.185 1.00 35.14 H new ATOM 0 HD21 LEU A 676 21.357 19.652 0.402 1.00 34.82 H new ATOM 0 HD22 LEU A 676 20.208 20.001 -0.630 1.00 34.82 H new ATOM 0 HD23 LEU A 676 20.367 18.520 -0.092 1.00 34.82 H new ATOM 1810 N LYS A 677 19.834 16.221 -4.790 1.00 27.34 N ANISOU 1810 N LYS A 677 3372 3539 3477 -14 40 223 N ATOM 1811 CA LYS A 677 18.951 15.825 -5.897 1.00 27.46 C ANISOU 1811 CA LYS A 677 3458 3579 3395 6 10 271 C ATOM 1812 C LYS A 677 18.060 14.682 -5.411 1.00 28.82 C ANISOU 1812 C LYS A 677 3656 3779 3517 11 -56 212 C ATOM 1813 O LYS A 677 16.866 14.657 -5.699 1.00 26.97 O ANISOU 1813 O LYS A 677 3443 3540 3265 16 -112 229 O ATOM 1814 CB LYS A 677 19.759 15.353 -7.123 1.00 29.41 C ANISOU 1814 CB LYS A 677 3761 3863 3549 28 62 313 C ATOM 1815 CG LYS A 677 20.152 16.427 -8.114 1.00 39.64 C ANISOU 1815 CG LYS A 677 5064 5137 4859 34 122 410 C ATOM 0 H LYS A 677 20.666 16.070 -4.944 1.00 27.34 H new ATOM 0 HA LYS A 677 18.422 16.592 -6.167 1.00 27.46 H new ATOM 0 HB2 LYS A 677 20.567 14.918 -6.808 1.00 29.41 H new ATOM 0 HB3 LYS A 677 19.239 14.681 -7.591 1.00 29.41 H new ATOM 1816 N THR A 678 18.642 13.743 -4.663 1.00 25.52 N ANISOU 1816 N THR A 678 3228 3383 3085 10 -50 148 N ATOM 1817 CA THR A 678 17.872 12.622 -4.131 1.00 24.92 C ANISOU 1817 CA THR A 678 3170 3325 2974 14 -102 100 C ATOM 1818 C THR A 678 16.782 13.097 -3.154 1.00 27.60 C ANISOU 1818 C THR A 678 3468 3635 3382 3 -138 84 C ATOM 1819 O THR A 678 15.676 12.578 -3.202 1.00 28.61 O ANISOU 1819 O THR A 678 3611 3763 3495 5 -186 83 O ATOM 1820 CB THR A 678 18.806 11.554 -3.506 1.00 31.33 C ANISOU 1820 CB THR A 678 3978 4162 3763 21 -83 46 C ATOM 1821 OG1 THR A 678 19.871 11.247 -4.430 1.00 29.84 O ANISOU 1821 OG1 THR A 678 3818 3995 3524 35 -35 62 O ATOM 1822 CG2 THR A 678 18.050 10.288 -3.153 1.00 26.37 C ANISOU 1822 CG2 THR A 678 3375 3546 3097 27 -129 10 C ATOM 0 H THR A 678 19.476 13.738 -4.454 1.00 25.52 H new ATOM 0 HA THR A 678 17.410 12.197 -4.870 1.00 24.92 H new ATOM 0 HB THR A 678 19.174 11.917 -2.685 1.00 31.33 H new ATOM 0 HG1 THR A 678 20.424 11.879 -4.441 1.00 29.84 H new ATOM 0 HG21 THR A 678 18.662 9.643 -2.766 1.00 26.37 H new ATOM 0 HG22 THR A 678 17.352 10.496 -2.513 1.00 26.37 H new ATOM 0 HG23 THR A 678 17.652 9.914 -3.955 1.00 26.37 H new ATOM 1823 N LEU A 679 17.109 14.032 -2.251 1.00 23.22 N ANISOU 1823 N LEU A 679 2861 3054 2907 -7 -115 67 N ATOM 1824 CA LEU A 679 16.169 14.546 -1.269 1.00 24.07 C ANISOU 1824 CA LEU A 679 2933 3135 3078 -11 -135 44 C ATOM 1825 C LEU A 679 15.126 15.443 -1.880 1.00 26.64 C ANISOU 1825 C LEU A 679 3251 3424 3445 -12 -156 96 C ATOM 1826 O LEU A 679 13.959 15.234 -1.590 1.00 27.29 O ANISOU 1826 O LEU A 679 3326 3499 3543 -8 -189 94 O ATOM 1827 CB LEU A 679 16.864 15.209 -0.073 1.00 24.88 C ANISOU 1827 CB LEU A 679 2991 3221 3243 -15 -111 -7 C ATOM 1828 CG LEU A 679 17.647 14.212 0.803 1.00 31.38 C ANISOU 1828 CG LEU A 679 3818 4081 4025 -7 -109 -64 C ATOM 1829 CD1 LEU A 679 18.558 14.926 1.727 1.00 31.40 C ANISOU 1829 CD1 LEU A 679 3779 4070 4082 -10 -98 -113 C ATOM 1830 CD2 LEU A 679 16.702 13.232 1.575 1.00 32.63 C ANISOU 1830 CD2 LEU A 679 3993 4260 4146 6 -130 -87 C ATOM 0 H LEU A 679 17.892 14.383 -2.198 1.00 23.22 H new ATOM 0 HA LEU A 679 15.701 13.770 -0.922 1.00 24.07 H new ATOM 0 HB2 LEU A 679 17.472 15.892 -0.397 1.00 24.88 H new ATOM 0 HB3 LEU A 679 16.199 15.657 0.473 1.00 24.88 H new ATOM 0 HG LEU A 679 18.186 13.667 0.208 1.00 31.38 H new ATOM 0 HD11 LEU A 679 19.040 14.282 2.268 1.00 31.40 H new ATOM 0 HD12 LEU A 679 19.190 15.455 1.215 1.00 31.40 H new ATOM 0 HD13 LEU A 679 18.041 15.510 2.304 1.00 31.40 H new ATOM 0 HD21 LEU A 679 17.234 12.624 2.112 1.00 32.63 H new ATOM 0 HD22 LEU A 679 16.111 13.740 2.153 1.00 32.63 H new ATOM 0 HD23 LEU A 679 16.174 12.724 0.940 1.00 32.63 H new ATOM 1831 N PHE A 680 15.499 16.354 -2.791 1.00 22.73 N ANISOU 1831 N PHE A 680 2758 2908 2969 -14 -138 153 N ATOM 1832 CA PHE A 680 14.496 17.192 -3.506 1.00 22.70 C ANISOU 1832 CA PHE A 680 2754 2871 3001 -10 -166 217 C ATOM 1833 C PHE A 680 13.551 16.351 -4.383 1.00 27.94 C ANISOU 1833 C PHE A 680 3464 3562 3590 3 -225 245 C ATOM 1834 O PHE A 680 12.426 16.770 -4.628 1.00 27.76 O ANISOU 1834 O PHE A 680 3428 3513 3605 9 -269 278 O ATOM 1835 CB PHE A 680 15.163 18.305 -4.331 1.00 23.41 C ANISOU 1835 CB PHE A 680 2841 2931 3124 -12 -127 284 C ATOM 1836 CG PHE A 680 15.656 19.427 -3.446 1.00 25.38 C ANISOU 1836 CG PHE A 680 3027 3125 3491 -27 -91 258 C ATOM 1837 CD1 PHE A 680 14.788 20.087 -2.575 1.00 26.99 C ANISOU 1837 CD1 PHE A 680 3188 3286 3782 -26 -110 227 C ATOM 1838 CD2 PHE A 680 16.978 19.853 -3.507 1.00 27.10 C ANISOU 1838 CD2 PHE A 680 3224 3329 3742 -40 -37 262 C ATOM 1839 CE1 PHE A 680 15.241 21.111 -1.758 1.00 27.06 C ANISOU 1839 CE1 PHE A 680 3143 3240 3897 -37 -83 189 C ATOM 1840 CE2 PHE A 680 17.418 20.925 -2.727 1.00 29.14 C ANISOU 1840 CE2 PHE A 680 3420 3528 4124 -56 -16 231 C ATOM 1841 CZ PHE A 680 16.556 21.528 -1.846 1.00 27.02 C ANISOU 1841 CZ PHE A 680 3119 3218 3929 -54 -42 189 C ATOM 0 H PHE A 680 16.316 16.507 -3.013 1.00 22.73 H new ATOM 0 HA PHE A 680 13.956 17.614 -2.820 1.00 22.70 H new ATOM 0 HB2 PHE A 680 15.906 17.936 -4.833 1.00 23.41 H new ATOM 0 HB3 PHE A 680 14.530 18.655 -4.977 1.00 23.41 H new ATOM 0 HD1 PHE A 680 13.893 19.836 -2.542 1.00 26.99 H new ATOM 0 HD2 PHE A 680 17.575 19.420 -4.073 1.00 27.10 H new ATOM 0 HE1 PHE A 680 14.662 21.516 -1.153 1.00 27.06 H new ATOM 0 HE2 PHE A 680 18.293 21.229 -2.805 1.00 29.14 H new ATOM 0 HZ PHE A 680 16.858 22.221 -1.305 1.00 27.02 H new HETATM 1842 N 6WK A 681 13.994 15.167 -4.831 1.00 26.40 N ANISOU 1842 N 6WK A 681 3319 3413 3299 8 -231 226 N HETATM 1843 CA 6WK A 681 13.139 14.248 -5.601 1.00 28.69 C ANISOU 1843 CA 6WK A 681 3654 3725 3521 19 -298 233 C HETATM 1844 CB 6WK A 681 13.939 13.076 -6.201 1.00 32.97 C ANISOU 1844 CB 6WK A 681 4258 4313 3955 28 -290 208 C HETATM 1845 SG 6WK A 681 12.884 11.822 -7.006 1.00 37.57 S ANISOU 1845 SG 6WK A 681 4894 4914 4467 39 -386 190 S HETATM 1846 C 6WK A 681 12.019 13.772 -4.673 1.00 30.67 C ANISOU 1846 C 6WK A 681 3863 3959 3830 10 -338 194 C HETATM 1847 O 6WK A 681 10.863 13.838 -5.035 1.00 30.93 O ANISOU 1847 O 6WK A 681 3887 3975 3890 13 -398 218 O HETATM 1848 S3 6WK A 681 16.449 17.931 -8.207 1.00 85.17 S ANISOU 1848 S3 6WK A 681 10836 10832 10691 37 -69 484 S HETATM 1849 C1 6WK A 681 15.630 16.317 -8.343 1.00 80.06 C ANISOU 1849 C1 6WK A 681 10247 10243 9930 50 -152 419 C HETATM 1850 C2 6WK A 681 14.118 16.210 -8.242 1.00 78.32 C ANISOU 1850 C2 6WK A 681 10021 10009 9727 52 -245 413 C HETATM 1851 O4 6WK A 681 13.492 17.497 -8.359 1.00 76.99 O ANISOU 1851 O4 6WK A 681 9819 9793 9642 54 -258 478 O HETATM 1852 C3 6WK A 681 13.494 15.209 -9.224 1.00 76.79 C ANISOU 1852 C3 6WK A 681 9902 9858 9417 75 -320 410 C HETATM 1853 O3 6WK A 681 13.100 15.867 -10.429 1.00 81.42 O ANISOU 1853 O3 6WK A 681 10538 10448 9952 101 -351 494 O HETATM 1854 C4 6WK A 681 12.317 14.429 -8.661 1.00 70.49 C ANISOU 1854 C4 6WK A 681 9080 9053 8652 64 -403 355 C HETATM 1855 SD 6WK A 681 12.474 12.624 -8.848 1.00 66.06 S ANISOU 1855 SD 6WK A 681 8573 8534 7992 68 -438 276 S ATOM 1856 N TYR A 682 12.379 13.377 -3.447 1.00 27.33 N ANISOU 1856 N TYR A 682 3411 3540 3435 2 -300 140 N ATOM 1857 CA TYR A 682 11.429 12.965 -2.418 1.00 25.61 C ANISOU 1857 CA TYR A 682 3152 3307 3272 -2 -312 111 C ATOM 1858 C TYR A 682 10.503 14.115 -2.087 1.00 28.59 C ANISOU 1858 C TYR A 682 3477 3641 3744 0 -315 135 C ATOM 1859 O TYR A 682 9.305 13.922 -2.108 1.00 29.15 O ANISOU 1859 O TYR A 682 3521 3693 3860 1 -355 148 O ATOM 1860 CB TYR A 682 12.170 12.489 -1.157 1.00 25.03 C ANISOU 1860 CB TYR A 682 3066 3249 3193 -2 -262 57 C ATOM 1861 CG TYR A 682 11.277 12.414 0.067 1.00 25.21 C ANISOU 1861 CG TYR A 682 3047 3256 3276 1 -248 36 C ATOM 1862 CD1 TYR A 682 10.314 11.409 0.195 1.00 26.66 C ANISOU 1862 CD1 TYR A 682 3223 3436 3472 -1 -274 38 C ATOM 1863 CD2 TYR A 682 11.376 13.357 1.080 1.00 24.96 C ANISOU 1863 CD2 TYR A 682 2982 3209 3293 8 -208 13 C ATOM 1864 CE1 TYR A 682 9.504 11.324 1.327 1.00 22.69 C ANISOU 1864 CE1 TYR A 682 2678 2917 3024 6 -244 29 C ATOM 1865 CE2 TYR A 682 10.536 13.314 2.187 1.00 26.47 C ANISOU 1865 CE2 TYR A 682 3141 3389 3527 20 -184 -5 C ATOM 1866 CZ TYR A 682 9.621 12.279 2.320 1.00 27.37 C ANISOU 1866 CZ TYR A 682 3247 3504 3649 19 -195 8 C ATOM 1867 OH TYR A 682 8.799 12.243 3.410 1.00 28.29 O ANISOU 1867 OH TYR A 682 3330 3609 3810 33 -155 0 O ATOM 0 H TYR A 682 13.199 13.342 -3.190 1.00 27.33 H new ATOM 0 HA TYR A 682 10.902 12.224 -2.756 1.00 25.61 H new ATOM 0 HB2 TYR A 682 12.553 11.614 -1.325 1.00 25.03 H new ATOM 0 HB3 TYR A 682 12.908 13.092 -0.976 1.00 25.03 H new ATOM 0 HD1 TYR A 682 10.212 10.785 -0.487 1.00 26.66 H new ATOM 0 HD2 TYR A 682 12.015 14.029 1.017 1.00 24.96 H new ATOM 0 HE1 TYR A 682 8.890 10.631 1.413 1.00 22.69 H new ATOM 0 HE2 TYR A 682 10.587 13.977 2.837 1.00 26.47 H new ATOM 0 HH TYR A 682 8.401 11.504 3.436 1.00 28.29 H new ATOM 1868 N PHE A 683 11.044 15.295 -1.771 1.00 26.34 N ANISOU 1868 N PHE A 683 3171 3336 3503 1 -273 138 N ATOM 1869 CA PHE A 683 10.215 16.450 -1.395 1.00 26.55 C ANISOU 1869 CA PHE A 683 3146 3313 3629 6 -270 154 C ATOM 1870 C PHE A 683 9.286 16.901 -2.483 1.00 32.07 C ANISOU 1870 C PHE A 683 3841 3987 4355 13 -326 221 C ATOM 1871 O PHE A 683 8.143 17.244 -2.181 1.00 33.12 O ANISOU 1871 O PHE A 683 3927 4087 4570 20 -344 231 O ATOM 1872 CB PHE A 683 11.049 17.615 -0.881 1.00 27.23 C ANISOU 1872 CB PHE A 683 3211 3372 3764 5 -220 137 C ATOM 1873 CG PHE A 683 11.580 17.386 0.504 1.00 27.75 C ANISOU 1873 CG PHE A 683 3264 3451 3828 7 -180 61 C ATOM 1874 CD1 PHE A 683 10.711 17.270 1.590 1.00 30.21 C ANISOU 1874 CD1 PHE A 683 3549 3756 4176 20 -166 24 C ATOM 1875 CD2 PHE A 683 12.948 17.373 0.747 1.00 29.15 C ANISOU 1875 CD2 PHE A 683 3455 3647 3974 -1 -154 27 C ATOM 1876 CE1 PHE A 683 11.203 17.092 2.882 1.00 30.55 C ANISOU 1876 CE1 PHE A 683 3592 3817 4199 31 -130 -44 C ATOM 1877 CE2 PHE A 683 13.439 17.224 2.046 1.00 32.22 C ANISOU 1877 CE2 PHE A 683 3834 4049 4357 6 -131 -45 C ATOM 1878 CZ PHE A 683 12.564 17.085 3.103 1.00 29.85 C ANISOU 1878 CZ PHE A 683 3522 3749 4072 24 -121 -80 C ATOM 0 H PHE A 683 11.890 15.449 -1.768 1.00 26.34 H new ATOM 0 HA PHE A 683 9.658 16.132 -0.667 1.00 26.55 H new ATOM 0 HB2 PHE A 683 11.792 17.767 -1.486 1.00 27.23 H new ATOM 0 HB3 PHE A 683 10.509 18.421 -0.886 1.00 27.23 H new ATOM 0 HD1 PHE A 683 9.793 17.312 1.450 1.00 30.21 H new ATOM 0 HD2 PHE A 683 13.543 17.464 0.038 1.00 29.15 H new ATOM 0 HE1 PHE A 683 10.615 16.978 3.593 1.00 30.55 H new ATOM 0 HE2 PHE A 683 14.356 17.219 2.198 1.00 32.22 H new ATOM 0 HZ PHE A 683 12.893 16.986 3.967 1.00 29.85 H new ATOM 1879 N ARG A 684 9.739 16.871 -3.735 1.00 30.92 N ANISOU 1879 N ARG A 684 3746 3861 4141 14 -352 268 N ATOM 1880 CA ARG A 684 8.860 17.201 -4.871 1.00 33.31 C ANISOU 1880 CA ARG A 684 4058 4149 4447 27 -421 335 C ATOM 1881 C ARG A 684 7.690 16.207 -4.949 1.00 37.78 C ANISOU 1881 C ARG A 684 4615 4724 5018 27 -494 320 C ATOM 1882 O ARG A 684 6.558 16.619 -5.126 1.00 37.98 O ANISOU 1882 O ARG A 684 4598 4715 5117 35 -545 353 O ATOM 1883 CB ARG A 684 9.629 17.258 -6.218 1.00 32.63 C ANISOU 1883 CB ARG A 684 4045 4092 4259 37 -430 389 C ATOM 1884 CG ARG A 684 8.738 17.316 -7.473 1.00 42.35 C ANISOU 1884 CG ARG A 684 5309 5328 5455 58 -520 452 C ATOM 1885 CD ARG A 684 8.024 18.659 -7.693 1.00 62.50 C ANISOU 1885 CD ARG A 684 7819 7825 8102 72 -539 524 C ATOM 1886 NE ARG A 684 6.871 18.849 -6.803 1.00 71.84 N ANISOU 1886 NE ARG A 684 8920 8964 9412 67 -561 499 N ATOM 1887 CZ ARG A 684 6.449 20.024 -6.342 1.00 85.26 C ANISOU 1887 CZ ARG A 684 10557 10604 11233 74 -537 524 C ATOM 1888 NH1 ARG A 684 7.054 21.146 -6.711 1.00 72.76 N ANISOU 1888 NH1 ARG A 684 8984 8992 9672 81 -498 580 N ATOM 1889 NH2 ARG A 684 5.422 20.085 -5.508 1.00 74.53 N ANISOU 1889 NH2 ARG A 684 9125 9210 9983 75 -545 495 N ATOM 0 H ARG A 684 10.545 16.664 -3.953 1.00 30.92 H new ATOM 0 HA ARG A 684 8.507 18.091 -4.713 1.00 33.31 H new ATOM 0 HB2 ARG A 684 10.208 18.037 -6.212 1.00 32.63 H new ATOM 0 HB3 ARG A 684 10.203 16.479 -6.281 1.00 32.63 H new ATOM 0 HG2 ARG A 684 9.284 17.123 -8.251 1.00 42.35 H new ATOM 0 HG3 ARG A 684 8.070 16.615 -7.413 1.00 42.35 H new ATOM 0 HD2 ARG A 684 8.656 19.382 -7.554 1.00 62.50 H new ATOM 0 HD3 ARG A 684 7.727 18.715 -8.615 1.00 62.50 H new ATOM 0 HE ARG A 684 6.436 18.148 -6.561 1.00 71.84 H new ATOM 0 HH11 ARG A 684 7.723 21.116 -7.251 1.00 72.76 H new ATOM 0 HH12 ARG A 684 6.777 21.903 -6.410 1.00 72.76 H new ATOM 0 HH21 ARG A 684 5.025 19.363 -5.262 1.00 74.53 H new ATOM 0 HH22 ARG A 684 5.153 20.846 -5.213 1.00 74.53 H new ATOM 1890 N ARG A 685 7.962 14.913 -4.768 1.00 35.21 N ANISOU 1890 N ARG A 685 4316 4433 4628 17 -498 271 N ATOM 1891 CA ARG A 685 6.926 13.879 -4.822 1.00 34.19 C ANISOU 1891 CA ARG A 685 4171 4301 4517 12 -565 254 C ATOM 1892 C ARG A 685 5.877 14.035 -3.713 1.00 37.19 C ANISOU 1892 C ARG A 685 4466 4642 5023 7 -547 242 C ATOM 1893 O ARG A 685 4.690 13.992 -3.988 1.00 37.68 O ANISOU 1893 O ARG A 685 4484 4676 5157 9 -610 264 O ATOM 1894 CB ARG A 685 7.559 12.469 -4.730 1.00 32.99 C ANISOU 1894 CB ARG A 685 4064 4186 4285 2 -559 201 C ATOM 1895 CG ARG A 685 8.478 12.072 -5.912 1.00 38.61 C ANISOU 1895 CG ARG A 685 4864 4938 4867 12 -578 204 C ATOM 1896 CD ARG A 685 7.775 11.448 -7.096 1.00 40.93 C ANISOU 1896 CD ARG A 685 5198 5239 5113 20 -684 209 C ATOM 1897 NE ARG A 685 6.965 10.292 -6.713 1.00 45.21 N ANISOU 1897 NE ARG A 685 5708 5762 5706 4 -733 165 N ATOM 1898 CZ ARG A 685 7.441 9.061 -6.574 1.00 55.65 C ANISOU 1898 CZ ARG A 685 7062 7098 6985 -4 -724 113 C ATOM 1899 NH1 ARG A 685 6.641 8.078 -6.193 1.00 34.56 N ANISOU 1899 NH1 ARG A 685 4351 4397 4384 -21 -765 82 N ATOM 1900 NH2 ARG A 685 8.730 8.809 -6.783 1.00 40.40 N ANISOU 1900 NH2 ARG A 685 5193 5203 4953 7 -670 94 N ATOM 0 H ARG A 685 8.752 14.610 -4.611 1.00 35.21 H new ATOM 0 HA ARG A 685 6.476 13.986 -5.674 1.00 34.19 H new ATOM 0 HB2 ARG A 685 8.073 12.415 -3.909 1.00 32.99 H new ATOM 0 HB3 ARG A 685 6.846 11.815 -4.662 1.00 32.99 H new ATOM 0 HG2 ARG A 685 8.950 12.863 -6.215 1.00 38.61 H new ATOM 0 HG3 ARG A 685 9.147 11.449 -5.587 1.00 38.61 H new ATOM 0 HD2 ARG A 685 7.208 12.111 -7.520 1.00 40.93 H new ATOM 0 HD3 ARG A 685 8.434 11.175 -7.754 1.00 40.93 H new ATOM 0 HE ARG A 685 6.127 10.418 -6.569 1.00 45.21 H new ATOM 0 HH11 ARG A 685 5.811 8.236 -6.035 1.00 34.56 H new ATOM 0 HH12 ARG A 685 6.952 7.281 -6.104 1.00 34.56 H new ATOM 0 HH21 ARG A 685 9.261 9.446 -7.010 1.00 40.40 H new ATOM 0 HH22 ARG A 685 9.032 8.009 -6.691 1.00 40.40 H new ATOM 1901 N VAL A 686 6.308 14.171 -2.460 1.00 33.25 N ANISOU 1901 N VAL A 686 3944 4143 4549 6 -461 206 N ATOM 1902 CA VAL A 686 5.370 14.155 -1.334 1.00 32.12 C ANISOU 1902 CA VAL A 686 3729 3969 4505 8 -426 192 C ATOM 1903 C VAL A 686 4.609 15.476 -1.152 1.00 38.04 C ANISOU 1903 C VAL A 686 4420 4672 5361 23 -416 221 C ATOM 1904 O VAL A 686 3.561 15.456 -0.529 1.00 38.36 O ANISOU 1904 O VAL A 686 4395 4682 5496 30 -402 222 O ATOM 1905 CB VAL A 686 6.031 13.665 -0.019 1.00 33.44 C ANISOU 1905 CB VAL A 686 3904 4160 4643 9 -343 140 C ATOM 1906 CG1 VAL A 686 6.543 12.245 -0.186 1.00 32.95 C ANISOU 1906 CG1 VAL A 686 3887 4132 4502 -4 -359 119 C ATOM 1907 CG2 VAL A 686 7.135 14.603 0.465 1.00 32.11 C ANISOU 1907 CG2 VAL A 686 3755 3999 4445 17 -286 116 C ATOM 0 H VAL A 686 7.133 14.273 -2.240 1.00 33.25 H new ATOM 0 HA VAL A 686 4.696 13.498 -1.568 1.00 32.12 H new ATOM 0 HB VAL A 686 5.349 13.670 0.671 1.00 33.44 H new ATOM 0 HG11 VAL A 686 6.954 11.950 0.642 1.00 32.95 H new ATOM 0 HG12 VAL A 686 5.803 11.658 -0.407 1.00 32.95 H new ATOM 0 HG13 VAL A 686 7.200 12.219 -0.900 1.00 32.95 H new ATOM 0 HG21 VAL A 686 7.517 14.257 1.287 1.00 32.11 H new ATOM 0 HG22 VAL A 686 7.827 14.665 -0.212 1.00 32.11 H new ATOM 0 HG23 VAL A 686 6.763 15.484 0.628 1.00 32.11 H new ATOM 1908 N THR A 687 5.117 16.597 -1.678 1.00 36.82 N ANISOU 1908 N THR A 687 4283 4505 5201 31 -416 247 N ATOM 1909 CA THR A 687 4.397 17.877 -1.579 1.00 38.93 C ANISOU 1909 CA THR A 687 4494 4718 5580 48 -411 278 C ATOM 1910 C THR A 687 3.389 18.040 -2.702 1.00 48.37 C ANISOU 1910 C THR A 687 5668 5890 6821 55 -505 343 C ATOM 1911 O THR A 687 2.405 18.742 -2.518 1.00 52.60 O ANISOU 1911 O THR A 687 6136 6377 7474 71 -512 368 O ATOM 1912 CB THR A 687 5.334 19.059 -1.523 1.00 40.82 C ANISOU 1912 CB THR A 687 4751 4939 5821 53 -365 280 C ATOM 1913 OG1 THR A 687 6.193 19.029 -2.664 1.00 41.42 O ANISOU 1913 OG1 THR A 687 4890 5042 5807 45 -397 318 O ATOM 1914 CG2 THR A 687 6.116 19.112 -0.235 1.00 37.95 C ANISOU 1914 CG2 THR A 687 4389 4585 5445 52 -283 207 C ATOM 0 H THR A 687 5.869 16.639 -2.092 1.00 36.82 H new ATOM 0 HA THR A 687 3.911 17.854 -0.740 1.00 38.93 H new ATOM 0 HB THR A 687 4.806 19.872 -1.542 1.00 40.82 H new ATOM 0 HG1 THR A 687 6.820 18.487 -2.529 1.00 41.42 H new ATOM 0 HG21 THR A 687 6.702 19.885 -0.244 1.00 37.95 H new ATOM 0 HG22 THR A 687 5.503 19.180 0.513 1.00 37.95 H new ATOM 0 HG23 THR A 687 6.647 18.305 -0.145 1.00 37.95 H new ATOM 1915 N ALA A 688 3.635 17.407 -3.861 1.00 45.46 N ANISOU 1915 N ALA A 688 5358 5557 6359 49 -581 368 N ATOM 1916 CA ALA A 688 2.751 17.436 -5.025 1.00 46.55 C ANISOU 1916 CA ALA A 688 5491 5683 6512 59 -692 423 C ATOM 1917 C ALA A 688 1.518 16.560 -4.719 1.00 53.98 C ANISOU 1917 C ALA A 688 6366 6608 7538 51 -742 404 C ATOM 1918 O ALA A 688 0.391 17.038 -4.843 1.00 56.47 O ANISOU 1918 O ALA A 688 6610 6879 7968 63 -790 440 O ATOM 1919 CB ALA A 688 3.485 16.903 -6.251 1.00 47.01 C ANISOU 1919 CB ALA A 688 5646 5792 6424 60 -749 439 C ATOM 0 H ALA A 688 4.344 16.937 -3.989 1.00 45.46 H new ATOM 0 HA ALA A 688 2.472 18.346 -5.210 1.00 46.55 H new ATOM 0 HB1 ALA A 688 2.892 16.925 -7.018 1.00 47.01 H new ATOM 0 HB2 ALA A 688 4.263 17.455 -6.428 1.00 47.01 H new ATOM 0 HB3 ALA A 688 3.767 15.989 -6.088 1.00 47.01 H new ATOM 1920 N ALA A 689 1.738 15.303 -4.275 1.00 48.83 N ANISOU 1920 N ALA A 689 5729 5982 6842 30 -724 352 N ATOM 1921 CA ALA A 689 0.671 14.373 -3.906 1.00 48.73 C ANISOU 1921 CA ALA A 689 5649 5948 6920 16 -756 335 C ATOM 1922 C ALA A 689 0.986 13.729 -2.548 1.00 48.30 C ANISOU 1922 C ALA A 689 5579 5901 6872 5 -647 288 C ATOM 1923 O ALA A 689 2.018 13.065 -2.403 1.00 45.99 O ANISOU 1923 O ALA A 689 5354 5649 6471 -5 -613 253 O ATOM 1924 CB ALA A 689 0.498 13.304 -4.988 1.00 49.78 C ANISOU 1924 CB ALA A 689 5824 6099 6993 4 -875 326 C ATOM 0 H ALA A 689 2.526 14.972 -4.182 1.00 48.83 H new ATOM 0 HA ALA A 689 -0.163 14.862 -3.830 1.00 48.73 H new ATOM 0 HB1 ALA A 689 -0.212 12.695 -4.731 1.00 49.78 H new ATOM 0 HB2 ALA A 689 0.270 13.729 -5.829 1.00 49.78 H new ATOM 0 HB3 ALA A 689 1.326 12.810 -5.090 1.00 49.78 H new ATOM 1925 N ALA A 690 0.112 13.956 -1.552 1.00 44.27 N ANISOU 1925 N ALA A 690 4982 5353 6487 12 -587 291 N ATOM 1926 CA ALA A 690 0.280 13.415 -0.201 1.00 43.47 C ANISOU 1926 CA ALA A 690 4866 5260 6392 10 -477 258 C ATOM 1927 C ALA A 690 0.331 11.887 -0.211 1.00 43.42 C ANISOU 1927 C ALA A 690 4877 5268 6355 -14 -498 239 C ATOM 1928 O ALA A 690 -0.577 11.250 -0.744 1.00 44.28 O ANISOU 1928 O ALA A 690 4937 5346 6542 -30 -576 255 O ATOM 1929 CB ALA A 690 -0.840 13.889 0.707 1.00 44.87 C ANISOU 1929 CB ALA A 690 4944 5391 6713 28 -412 273 C ATOM 0 H ALA A 690 -0.598 14.432 -1.648 1.00 44.27 H new ATOM 0 HA ALA A 690 1.126 13.743 0.140 1.00 43.47 H new ATOM 0 HB1 ALA A 690 -0.713 13.522 1.596 1.00 44.87 H new ATOM 0 HB2 ALA A 690 -0.831 14.858 0.753 1.00 44.87 H new ATOM 0 HB3 ALA A 690 -1.692 13.590 0.353 1.00 44.87 H new ATOM 1930 N PRO A 691 1.401 11.274 0.328 1.00 35.82 N ANISOU 1930 N PRO A 691 3979 4346 5286 -18 -440 204 N ATOM 1931 CA PRO A 691 1.420 9.797 0.408 1.00 34.23 C ANISOU 1931 CA PRO A 691 3788 4147 5071 -38 -452 190 C ATOM 1932 C PRO A 691 0.332 9.326 1.382 1.00 35.83 C ANISOU 1932 C PRO A 691 3903 4310 5403 -40 -391 211 C ATOM 1933 O PRO A 691 -0.069 10.067 2.294 1.00 34.55 O ANISOU 1933 O PRO A 691 3695 4137 5295 -17 -305 223 O ATOM 1934 CB PRO A 691 2.851 9.459 0.847 1.00 35.11 C ANISOU 1934 CB PRO A 691 3984 4310 5048 -33 -395 155 C ATOM 1935 CG PRO A 691 3.405 10.701 1.393 1.00 39.93 C ANISOU 1935 CG PRO A 691 4605 4937 5628 -10 -331 148 C ATOM 1936 CD PRO A 691 2.538 11.879 1.045 1.00 36.20 C ANISOU 1936 CD PRO A 691 4080 4430 5246 -1 -357 177 C ATOM 0 HA PRO A 691 1.217 9.344 -0.425 1.00 34.23 H new ATOM 0 HB2 PRO A 691 2.853 8.754 1.514 1.00 35.11 H new ATOM 0 HB3 PRO A 691 3.379 9.142 0.098 1.00 35.11 H new ATOM 0 HG2 PRO A 691 3.484 10.627 2.357 1.00 39.93 H new ATOM 0 HG3 PRO A 691 4.300 10.840 1.045 1.00 39.93 H new ATOM 0 HD2 PRO A 691 2.247 12.354 1.839 1.00 36.20 H new ATOM 0 HD3 PRO A 691 3.011 12.518 0.489 1.00 36.20 H new ATOM 1937 N THR A 692 -0.228 8.152 1.117 1.00 31.37 N ANISOU 1937 N THR A 692 3306 3715 4899 -65 -438 217 N ATOM 1938 CA THR A 692 -1.360 7.640 1.873 1.00 30.87 C ANISOU 1938 CA THR A 692 3145 3602 4983 -72 -386 249 C ATOM 1939 C THR A 692 -1.048 6.508 2.876 1.00 34.09 C ANISOU 1939 C THR A 692 3566 4013 5373 -75 -295 253 C ATOM 1940 O THR A 692 -1.930 6.097 3.631 1.00 34.86 O ANISOU 1940 O THR A 692 3585 4071 5590 -76 -227 290 O ATOM 1941 CB THR A 692 -2.439 7.195 0.878 1.00 38.67 C ANISOU 1941 CB THR A 692 4062 4534 6098 -100 -511 262 C ATOM 1942 OG1 THR A 692 -1.890 6.146 0.076 1.00 40.48 O ANISOU 1942 OG1 THR A 692 4353 4769 6258 -125 -600 227 O ATOM 1943 CG2 THR A 692 -2.941 8.343 -0.008 1.00 35.57 C ANISOU 1943 CG2 THR A 692 3642 4131 5740 -90 -600 274 C ATOM 0 H THR A 692 0.040 7.628 0.490 1.00 31.37 H new ATOM 0 HA THR A 692 -1.661 8.369 2.437 1.00 30.87 H new ATOM 0 HB THR A 692 -3.212 6.885 1.376 1.00 38.67 H new ATOM 0 HG1 THR A 692 -2.466 5.885 -0.477 1.00 40.48 H new ATOM 0 HG21 THR A 692 -3.619 8.010 -0.616 1.00 35.57 H new ATOM 0 HG22 THR A 692 -3.322 9.040 0.549 1.00 35.57 H new ATOM 0 HG23 THR A 692 -2.200 8.706 -0.518 1.00 35.57 H new ATOM 1944 N GLY A 693 0.164 5.991 2.888 1.00 28.65 N ANISOU 1944 N GLY A 693 2970 3368 4547 -74 -290 222 N ATOM 1945 CA GLY A 693 0.428 4.872 3.788 1.00 27.50 C ANISOU 1945 CA GLY A 693 2836 3221 4392 -74 -213 234 C ATOM 1946 C GLY A 693 0.909 5.228 5.173 1.00 30.70 C ANISOU 1946 C GLY A 693 3270 3668 4728 -36 -80 244 C ATOM 1947 O GLY A 693 0.981 6.404 5.545 1.00 29.60 O ANISOU 1947 O GLY A 693 3135 3554 4559 -9 -39 233 O ATOM 0 H GLY A 693 0.827 6.254 2.408 1.00 28.65 H new ATOM 0 HA2 GLY A 693 -0.386 4.351 3.873 1.00 27.50 H new ATOM 0 HA3 GLY A 693 1.091 4.298 3.374 1.00 27.50 H new ATOM 1948 N LEU A 694 1.270 4.171 5.935 1.00 26.66 N ANISOU 1948 N LEU A 694 2782 3160 4188 -31 -18 261 N ATOM 1949 CA LEU A 694 1.804 4.211 7.288 1.00 24.57 C ANISOU 1949 CA LEU A 694 2558 2939 3838 10 99 273 C ATOM 1950 C LEU A 694 3.176 3.589 7.277 1.00 26.71 C ANISOU 1950 C LEU A 694 2919 3252 3976 15 78 243 C ATOM 1951 O LEU A 694 3.516 2.826 6.369 1.00 24.58 O ANISOU 1951 O LEU A 694 2669 2965 3707 -13 -4 226 O ATOM 1952 CB LEU A 694 0.895 3.427 8.256 1.00 25.29 C ANISOU 1952 CB LEU A 694 2591 2992 4027 18 202 341 C ATOM 1953 CG LEU A 694 -0.584 3.896 8.363 1.00 29.91 C ANISOU 1953 CG LEU A 694 3066 3525 4775 14 241 381 C ATOM 1954 CD1 LEU A 694 -1.280 3.222 9.555 1.00 28.91 C ANISOU 1954 CD1 LEU A 694 2894 3374 4717 34 380 455 C ATOM 1955 CD2 LEU A 694 -0.686 5.416 8.493 1.00 28.26 C ANISOU 1955 CD2 LEU A 694 2854 3344 4539 43 259 351 C ATOM 0 H LEU A 694 1.199 3.366 5.642 1.00 26.66 H new ATOM 0 HA LEU A 694 1.848 5.132 7.588 1.00 24.57 H new ATOM 0 HB2 LEU A 694 0.898 2.495 7.986 1.00 25.29 H new ATOM 0 HB3 LEU A 694 1.290 3.467 9.141 1.00 25.29 H new ATOM 0 HG LEU A 694 -1.030 3.633 7.543 1.00 29.91 H new ATOM 0 HD11 LEU A 694 -2.200 3.525 9.607 1.00 28.91 H new ATOM 0 HD12 LEU A 694 -1.264 2.259 9.437 1.00 28.91 H new ATOM 0 HD13 LEU A 694 -0.817 3.455 10.375 1.00 28.91 H new ATOM 0 HD21 LEU A 694 -1.619 5.674 8.557 1.00 28.26 H new ATOM 0 HD22 LEU A 694 -0.215 5.705 9.290 1.00 28.26 H new ATOM 0 HD23 LEU A 694 -0.288 5.835 7.714 1.00 28.26 H new ATOM 1956 N VAL A 695 3.948 3.918 8.293 1.00 25.95 N ANISOU 1956 N VAL A 695 2879 3211 3771 56 148 233 N ATOM 1957 CA VAL A 695 5.307 3.422 8.554 1.00 26.59 C ANISOU 1957 CA VAL A 695 3040 3339 3725 72 141 209 C ATOM 1958 C VAL A 695 5.374 3.139 10.052 1.00 31.00 C ANISOU 1958 C VAL A 695 3622 3926 4231 118 249 245 C ATOM 1959 O VAL A 695 4.956 3.991 10.852 1.00 33.03 O ANISOU 1959 O VAL A 695 3869 4202 4477 150 318 246 O ATOM 1960 CB VAL A 695 6.408 4.465 8.124 1.00 28.19 C ANISOU 1960 CB VAL A 695 3293 3590 3828 79 91 144 C ATOM 1961 CG1 VAL A 695 7.820 3.893 8.285 1.00 27.10 C ANISOU 1961 CG1 VAL A 695 3224 3493 3581 93 74 119 C ATOM 1962 CG2 VAL A 695 6.212 4.944 6.688 1.00 27.05 C ANISOU 1962 CG2 VAL A 695 3129 3421 3729 43 0 123 C ATOM 0 H VAL A 695 3.685 4.473 8.895 1.00 25.95 H new ATOM 0 HA VAL A 695 5.486 2.624 8.033 1.00 26.59 H new ATOM 0 HB VAL A 695 6.308 5.226 8.718 1.00 28.19 H new ATOM 0 HG11 VAL A 695 8.472 4.558 8.013 1.00 27.10 H new ATOM 0 HG12 VAL A 695 7.969 3.656 9.214 1.00 27.10 H new ATOM 0 HG13 VAL A 695 7.914 3.103 7.731 1.00 27.10 H new ATOM 0 HG21 VAL A 695 6.907 5.582 6.462 1.00 27.05 H new ATOM 0 HG22 VAL A 695 6.261 4.186 6.084 1.00 27.05 H new ATOM 0 HG23 VAL A 695 5.344 5.368 6.604 1.00 27.05 H new ATOM 1963 N THR A 696 5.939 1.993 10.430 1.00 25.31 N ANISOU 1963 N THR A 696 2937 3210 3468 128 263 271 N ATOM 1964 CA THR A 696 6.150 1.598 11.839 1.00 25.68 C ANISOU 1964 CA THR A 696 3023 3292 3443 179 358 313 C ATOM 1965 C THR A 696 7.659 1.575 12.137 1.00 29.47 C ANISOU 1965 C THR A 696 3584 3833 3779 208 322 271 C ATOM 1966 O THR A 696 8.430 1.026 11.359 1.00 27.12 O ANISOU 1966 O THR A 696 3303 3528 3473 185 249 247 O ATOM 1967 CB THR A 696 5.569 0.179 12.111 1.00 29.86 C ANISOU 1967 CB THR A 696 3524 3767 4055 171 405 397 C ATOM 1968 OG1 THR A 696 4.161 0.197 11.887 1.00 31.41 O ANISOU 1968 OG1 THR A 696 3632 3901 4402 143 439 438 O ATOM 1969 CG2 THR A 696 5.843 -0.326 13.551 1.00 28.77 C ANISOU 1969 CG2 THR A 696 3436 3667 3829 230 506 456 C ATOM 0 H THR A 696 6.219 1.406 9.868 1.00 25.31 H new ATOM 0 HA THR A 696 5.697 2.240 12.408 1.00 25.68 H new ATOM 0 HB THR A 696 6.015 -0.431 11.502 1.00 29.86 H new ATOM 0 HG1 THR A 696 3.786 0.640 12.494 1.00 31.41 H new ATOM 0 HG21 THR A 696 5.460 -1.210 13.662 1.00 28.77 H new ATOM 0 HG22 THR A 696 6.800 -0.367 13.703 1.00 28.77 H new ATOM 0 HG23 THR A 696 5.440 0.283 14.190 1.00 28.77 H new ATOM 1970 N PHE A 697 8.046 2.108 13.292 1.00 26.61 N ANISOU 1970 N PHE A 697 3269 3530 3311 262 374 260 N ATOM 1971 CA PHE A 697 9.415 2.130 13.781 1.00 26.99 C ANISOU 1971 CA PHE A 697 3388 3640 3228 297 341 221 C ATOM 1972 C PHE A 697 9.396 1.378 15.097 1.00 31.67 C ANISOU 1972 C PHE A 697 4023 4260 3751 353 420 286 C ATOM 1973 O PHE A 697 8.642 1.743 16.005 1.00 32.03 O ANISOU 1973 O PHE A 697 4072 4321 3777 390 509 314 O ATOM 1974 CB PHE A 697 9.878 3.578 14.006 1.00 28.50 C ANISOU 1974 CB PHE A 697 3599 3876 3353 315 319 141 C ATOM 1975 CG PHE A 697 9.965 4.411 12.751 1.00 28.13 C ANISOU 1975 CG PHE A 697 3515 3804 3369 266 248 87 C ATOM 1976 CD1 PHE A 697 8.860 5.104 12.284 1.00 28.68 C ANISOU 1976 CD1 PHE A 697 3531 3835 3532 241 265 91 C ATOM 1977 CD2 PHE A 697 11.184 4.600 12.106 1.00 28.47 C ANISOU 1977 CD2 PHE A 697 3578 3864 3375 250 169 35 C ATOM 1978 CE1 PHE A 697 8.954 5.898 11.134 1.00 29.49 C ANISOU 1978 CE1 PHE A 697 3606 3915 3684 202 198 52 C ATOM 1979 CE2 PHE A 697 11.271 5.380 10.946 1.00 29.93 C ANISOU 1979 CE2 PHE A 697 3734 4026 3610 209 115 -2 C ATOM 1980 CZ PHE A 697 10.154 6.008 10.464 1.00 28.81 C ANISOU 1980 CZ PHE A 697 3546 3847 3553 187 127 9 C ATOM 0 H PHE A 697 7.492 2.482 13.833 1.00 26.61 H new ATOM 0 HA PHE A 697 10.027 1.726 13.146 1.00 26.99 H new ATOM 0 HB2 PHE A 697 9.267 4.008 14.624 1.00 28.50 H new ATOM 0 HB3 PHE A 697 10.749 3.564 14.432 1.00 28.50 H new ATOM 0 HD1 PHE A 697 8.050 5.042 12.737 1.00 28.68 H new ATOM 0 HD2 PHE A 697 11.951 4.203 12.450 1.00 28.47 H new ATOM 0 HE1 PHE A 697 8.205 6.352 10.822 1.00 29.49 H new ATOM 0 HE2 PHE A 697 12.085 5.471 10.505 1.00 29.93 H new ATOM 0 HZ PHE A 697 10.205 6.510 9.683 1.00 28.81 H new ATOM 1981 N THR A 698 10.175 0.313 15.187 1.00 28.35 N ANISOU 1981 N THR A 698 3634 3842 3295 364 395 316 N ATOM 1982 CA THR A 698 10.213 -0.517 16.398 1.00 29.07 C ANISOU 1982 CA THR A 698 3771 3957 3317 421 466 394 C ATOM 1983 C THR A 698 11.608 -0.622 16.931 1.00 34.82 C ANISOU 1983 C THR A 698 4568 4747 3915 466 411 363 C ATOM 1984 O THR A 698 12.497 -1.119 16.234 1.00 34.42 O ANISOU 1984 O THR A 698 4516 4683 3880 444 333 340 O ATOM 1985 CB THR A 698 9.648 -1.940 16.123 1.00 30.40 C ANISOU 1985 CB THR A 698 3903 4051 3596 395 500 487 C ATOM 1986 OG1 THR A 698 8.305 -1.824 15.685 1.00 31.63 O ANISOU 1986 OG1 THR A 698 3985 4145 3886 354 546 515 O ATOM 1987 CG2 THR A 698 9.703 -2.864 17.363 1.00 31.39 C ANISOU 1987 CG2 THR A 698 4076 4193 3657 456 581 586 C ATOM 0 H THR A 698 10.696 0.046 14.557 1.00 28.35 H new ATOM 0 HA THR A 698 9.654 -0.085 17.063 1.00 29.07 H new ATOM 0 HB THR A 698 10.206 -2.347 15.442 1.00 30.40 H new ATOM 0 HG1 THR A 698 7.993 -2.589 15.533 1.00 31.63 H new ATOM 0 HG21 THR A 698 9.340 -3.734 17.135 1.00 31.39 H new ATOM 0 HG22 THR A 698 10.624 -2.964 17.652 1.00 31.39 H new ATOM 0 HG23 THR A 698 9.180 -2.474 18.081 1.00 31.39 H new ATOM 1988 N ARG A 699 11.785 -0.240 18.199 1.00 33.30 N ANISOU 1988 N ARG A 699 4438 4622 3594 534 452 366 N ATOM 1989 CA ARG A 699 13.060 -0.460 18.856 1.00 34.31 C ANISOU 1989 CA ARG A 699 4632 4810 3596 586 394 347 C ATOM 1990 C ARG A 699 12.934 -1.819 19.570 1.00 39.27 C ANISOU 1990 C ARG A 699 5291 5428 4201 628 455 466 C ATOM 1991 O ARG A 699 11.990 -2.034 20.333 1.00 36.97 O ANISOU 1991 O ARG A 699 5013 5137 3898 659 564 545 O ATOM 1992 CB ARG A 699 13.404 0.642 19.865 1.00 34.86 C ANISOU 1992 CB ARG A 699 4760 4958 3527 645 388 279 C ATOM 1993 CG ARG A 699 14.844 0.509 20.375 1.00 31.98 C ANISOU 1993 CG ARG A 699 4451 4653 3049 690 295 240 C ATOM 1994 CD ARG A 699 15.098 1.514 21.475 1.00 34.95 C ANISOU 1994 CD ARG A 699 4891 5104 3284 754 284 170 C ATOM 1995 NE ARG A 699 16.524 1.603 21.797 1.00 32.69 N ANISOU 1995 NE ARG A 699 4641 4868 2913 786 168 109 N ATOM 1996 CZ ARG A 699 17.370 2.446 21.220 1.00 38.68 C ANISOU 1996 CZ ARG A 699 5364 5625 3706 751 69 3 C ATOM 1997 NH1 ARG A 699 16.943 3.303 20.308 1.00 30.80 N ANISOU 1997 NH1 ARG A 699 4306 4583 2813 687 74 -50 N ATOM 1998 NH2 ARG A 699 18.643 2.466 21.580 1.00 30.00 N ANISOU 1998 NH2 ARG A 699 4287 4567 2543 782 -35 -47 N ATOM 0 H ARG A 699 11.186 0.142 18.684 1.00 33.30 H new ATOM 0 HA ARG A 699 13.778 -0.448 18.204 1.00 34.31 H new ATOM 0 HB2 ARG A 699 13.286 1.511 19.450 1.00 34.86 H new ATOM 0 HB3 ARG A 699 12.789 0.600 20.614 1.00 34.86 H new ATOM 0 HG2 ARG A 699 14.996 -0.390 20.707 1.00 31.98 H new ATOM 0 HG3 ARG A 699 15.468 0.652 19.646 1.00 31.98 H new ATOM 0 HD2 ARG A 699 14.771 2.385 21.201 1.00 34.95 H new ATOM 0 HD3 ARG A 699 14.601 1.261 22.268 1.00 34.95 H new ATOM 0 HE ARG A 699 16.833 1.074 22.400 1.00 32.69 H new ATOM 0 HH11 ARG A 699 16.112 3.316 20.086 1.00 30.80 H new ATOM 0 HH12 ARG A 699 17.496 3.847 19.937 1.00 30.80 H new ATOM 0 HH21 ARG A 699 18.926 1.931 22.191 1.00 30.00 H new ATOM 0 HH22 ARG A 699 19.188 3.014 21.203 1.00 30.00 H new ATOM 1999 N GLN A 700 13.869 -2.735 19.285 1.00 37.22 N ANISOU 1999 N GLN A 700 5038 5155 3948 628 391 485 N ATOM 2000 CA GLN A 700 13.871 -4.061 19.894 1.00 37.91 C ANISOU 2000 CA GLN A 700 5154 5225 4027 667 438 601 C ATOM 2001 C GLN A 700 15.164 -4.274 20.686 1.00 45.12 C ANISOU 2001 C GLN A 700 6136 6205 4801 737 371 595 C ATOM 2002 O GLN A 700 16.248 -4.091 20.147 1.00 43.74 O ANISOU 2002 O GLN A 700 5950 6042 4625 722 267 519 O ATOM 2003 CB GLN A 700 13.659 -5.148 18.829 1.00 38.05 C ANISOU 2003 CB GLN A 700 5110 5145 4203 606 428 641 C ATOM 2004 CG GLN A 700 13.822 -6.561 19.365 1.00 44.64 C ANISOU 2004 CG GLN A 700 5969 5947 5047 644 464 757 C ATOM 2005 CD GLN A 700 13.212 -7.571 18.446 1.00 59.73 C ANISOU 2005 CD GLN A 700 7813 7746 7135 582 482 802 C ATOM 2006 OE1 GLN A 700 11.978 -7.697 18.358 1.00 49.52 O ANISOU 2006 OE1 GLN A 700 6475 6398 5941 550 562 854 O ATOM 2007 NE2 GLN A 700 14.070 -8.324 17.758 1.00 41.46 N ANISOU 2007 NE2 GLN A 700 5489 5393 4871 567 406 780 N ATOM 0 H GLN A 700 14.516 -2.600 18.734 1.00 37.22 H new ATOM 0 HA GLN A 700 13.130 -4.126 20.517 1.00 37.91 H new ATOM 0 HB2 GLN A 700 12.770 -5.053 18.452 1.00 38.05 H new ATOM 0 HB3 GLN A 700 14.290 -5.009 18.105 1.00 38.05 H new ATOM 0 HG2 GLN A 700 14.765 -6.757 19.482 1.00 44.64 H new ATOM 0 HG3 GLN A 700 13.408 -6.626 20.240 1.00 44.64 H new ATOM 0 HE21 GLN A 700 14.917 -8.203 17.849 1.00 41.46 H new ATOM 0 HE22 GLN A 700 13.777 -8.930 17.223 1.00 41.46 H new ATOM 2008 N SER A 701 15.028 -4.684 21.954 1.00 45.99 N ANISOU 2008 N SER A 701 6315 6360 4799 814 434 682 N ATOM 2009 CA SER A 701 16.115 -4.907 22.908 1.00 48.40 C ANISOU 2009 CA SER A 701 6697 6738 4955 896 374 692 C ATOM 2010 C SER A 701 15.981 -6.293 23.513 1.00 55.67 C ANISOU 2010 C SER A 701 7650 7632 5871 942 437 843 C ATOM 2011 O SER A 701 14.962 -6.572 24.156 1.00 57.77 O ANISOU 2011 O SER A 701 7937 7890 6123 968 562 942 O ATOM 2012 CB SER A 701 16.027 -3.866 24.025 1.00 53.90 C ANISOU 2012 CB SER A 701 7469 7529 5481 962 389 646 C ATOM 2013 OG SER A 701 17.226 -3.806 24.773 1.00 68.32 O ANISOU 2013 OG SER A 701 9362 9432 7165 1032 289 612 O ATOM 0 H SER A 701 14.256 -4.847 22.295 1.00 45.99 H new ATOM 0 HA SER A 701 16.967 -4.830 22.451 1.00 48.40 H new ATOM 0 HB2 SER A 701 15.839 -2.995 23.643 1.00 53.90 H new ATOM 0 HB3 SER A 701 15.287 -4.083 24.614 1.00 53.90 H new ATOM 0 HG SER A 701 17.074 -3.450 25.519 1.00 68.32 H new ATOM 2014 N LEU A 702 16.971 -7.176 23.298 1.00 51.46 N ANISOU 2014 N LEU A 702 7114 7077 5362 954 361 867 N ATOM 2015 CA LEU A 702 16.894 -8.515 23.893 1.00 52.22 C ANISOU 2015 CA LEU A 702 7240 7140 5460 1002 418 1018 C ATOM 2016 C LEU A 702 17.620 -8.591 25.228 1.00 56.32 C ANISOU 2016 C LEU A 702 7860 7754 5785 1112 387 1064 C ATOM 2017 O LEU A 702 18.662 -7.957 25.418 1.00 53.23 O ANISOU 2017 O LEU A 702 7496 7435 5296 1142 269 967 O ATOM 2018 CB LEU A 702 17.404 -9.634 22.972 1.00 51.81 C ANISOU 2018 CB LEU A 702 7131 6995 5561 961 371 1043 C ATOM 2019 CG LEU A 702 16.715 -9.869 21.619 1.00 56.36 C ANISOU 2019 CG LEU A 702 7615 7465 6335 860 394 1012 C ATOM 2020 CD1 LEU A 702 17.185 -11.170 21.014 1.00 55.84 C ANISOU 2020 CD1 LEU A 702 7514 7308 6394 845 364 1058 C ATOM 2021 CD2 LEU A 702 15.171 -9.844 21.732 1.00 59.25 C ANISOU 2021 CD2 LEU A 702 7956 7788 6770 829 524 1080 C ATOM 0 H LEU A 702 17.673 -7.023 22.826 1.00 51.46 H new ATOM 0 HA LEU A 702 15.946 -8.663 24.033 1.00 52.22 H new ATOM 0 HB2 LEU A 702 18.342 -9.461 22.795 1.00 51.81 H new ATOM 0 HB3 LEU A 702 17.358 -10.465 23.470 1.00 51.81 H new ATOM 0 HG LEU A 702 16.966 -9.137 21.034 1.00 56.36 H new ATOM 0 HD11 LEU A 702 16.744 -11.308 20.161 1.00 55.84 H new ATOM 0 HD12 LEU A 702 18.145 -11.136 20.880 1.00 55.84 H new ATOM 0 HD13 LEU A 702 16.968 -11.902 21.612 1.00 55.84 H new ATOM 0 HD21 LEU A 702 14.780 -9.996 20.857 1.00 59.25 H new ATOM 0 HD22 LEU A 702 14.880 -10.540 22.342 1.00 59.25 H new ATOM 0 HD23 LEU A 702 14.885 -8.980 22.068 1.00 59.25 H new ATOM 2022 N GLU A 703 17.065 -9.401 26.136 1.00 56.66 N ANISOU 2022 N GLU A 703 7956 7794 5778 1173 493 1216 N ATOM 2023 CA GLU A 703 17.597 -9.676 27.473 1.00 58.92 C ANISOU 2023 CA GLU A 703 8351 8166 5870 1288 482 1295 C ATOM 2024 C GLU A 703 18.248 -11.066 27.429 1.00 64.10 C ANISOU 2024 C GLU A 703 8999 8762 6593 1313 450 1406 C ATOM 2025 O GLU A 703 19.423 -11.216 27.780 1.00 63.73 O ANISOU 2025 O GLU A 703 8989 8764 6460 1370 331 1387 O ATOM 2026 CB GLU A 703 16.443 -9.652 28.481 1.00 61.75 C ANISOU 2026 CB GLU A 703 8774 8555 6134 1342 645 1407 C ATOM 2027 CG GLU A 703 16.854 -9.743 29.942 1.00 79.44 C ANISOU 2027 CG GLU A 703 11146 10903 8133 1472 646 1481 C ATOM 2028 CD GLU A 703 16.977 -8.406 30.645 1.00 97.28 C ANISOU 2028 CD GLU A 703 13485 13285 10194 1524 608 1359 C ATOM 2029 OE1 GLU A 703 15.952 -7.695 30.762 1.00 79.47 O ANISOU 2029 OE1 GLU A 703 11230 11039 7925 1511 721 1337 O ATOM 2030 OE2 GLU A 703 18.097 -8.079 31.097 1.00 91.88 O ANISOU 2030 OE2 GLU A 703 12859 12681 9371 1582 464 1285 O ATOM 0 H GLU A 703 16.333 -9.824 25.980 1.00 56.66 H new ATOM 0 HA GLU A 703 18.252 -9.012 27.741 1.00 58.92 H new ATOM 0 HB2 GLU A 703 15.938 -8.834 28.353 1.00 61.75 H new ATOM 0 HB3 GLU A 703 15.844 -10.389 28.282 1.00 61.75 H new ATOM 0 HG2 GLU A 703 16.205 -10.286 30.416 1.00 79.44 H new ATOM 0 HG3 GLU A 703 17.705 -10.205 29.999 1.00 79.44 H new ATOM 2031 N ASP A 704 17.482 -12.066 26.946 1.00 61.52 N ANISOU 2031 N ASP A 704 8616 8321 6438 1266 550 1514 N ATOM 2032 CA ASP A 704 17.887 -13.469 26.856 1.00 62.11 C ANISOU 2032 CA ASP A 704 8676 8313 6611 1283 545 1631 C ATOM 2033 C ASP A 704 18.542 -13.812 25.518 1.00 62.17 C ANISOU 2033 C ASP A 704 8591 8236 6794 1205 446 1538 C ATOM 2034 O ASP A 704 17.864 -13.907 24.483 1.00 61.95 O ANISOU 2034 O ASP A 704 8482 8118 6938 1113 482 1500 O ATOM 2035 CB ASP A 704 16.697 -14.409 27.152 1.00 65.58 C ANISOU 2035 CB ASP A 704 9105 8666 7149 1279 712 1805 C ATOM 2036 CG ASP A 704 16.043 -14.179 28.505 1.00 86.54 C ANISOU 2036 CG ASP A 704 11854 11400 9625 1366 833 1918 C ATOM 2037 OD1 ASP A 704 16.650 -14.561 29.533 1.00 90.20 O ANISOU 2037 OD1 ASP A 704 12411 11929 9930 1470 815 2011 O ATOM 2038 OD2 ASP A 704 14.922 -13.617 28.536 1.00 94.61 O ANISOU 2038 OD2 ASP A 704 12859 12423 10666 1334 946 1917 O ATOM 0 H ASP A 704 16.685 -11.931 26.653 1.00 61.52 H new ATOM 0 HA ASP A 704 18.564 -13.607 27.537 1.00 62.11 H new ATOM 0 HB2 ASP A 704 16.029 -14.297 26.458 1.00 65.58 H new ATOM 0 HB3 ASP A 704 17.004 -15.328 27.104 1.00 65.58 H new ATOM 2039 N PHE A 705 19.870 -13.983 25.544 1.00 54.96 N ANISOU 2039 N PHE A 705 7691 7355 5835 1248 318 1498 N ATOM 2040 CA PHE A 705 20.638 -14.368 24.370 1.00 52.08 C ANISOU 2040 CA PHE A 705 7248 6917 5623 1192 230 1417 C ATOM 2041 C PHE A 705 21.013 -15.832 24.466 1.00 57.02 C ANISOU 2041 C PHE A 705 7868 7456 6340 1229 236 1543 C ATOM 2042 O PHE A 705 21.185 -16.362 25.583 1.00 56.74 O ANISOU 2042 O PHE A 705 7904 7454 6201 1320 256 1673 O ATOM 2043 CB PHE A 705 21.873 -13.487 24.191 1.00 52.60 C ANISOU 2043 CB PHE A 705 7310 7066 5609 1204 87 1274 C ATOM 2044 CG PHE A 705 21.536 -12.109 23.682 1.00 52.29 C ANISOU 2044 CG PHE A 705 7247 7074 5547 1141 75 1132 C ATOM 2045 CD1 PHE A 705 21.045 -11.925 22.393 1.00 53.58 C ANISOU 2045 CD1 PHE A 705 7333 7163 5861 1042 98 1056 C ATOM 2046 CD2 PHE A 705 21.695 -10.995 24.493 1.00 54.68 C ANISOU 2046 CD2 PHE A 705 7608 7491 5678 1184 38 1073 C ATOM 2047 CE1 PHE A 705 20.732 -10.647 21.921 1.00 53.69 C ANISOU 2047 CE1 PHE A 705 7326 7217 5857 988 87 935 C ATOM 2048 CE2 PHE A 705 21.375 -9.721 24.025 1.00 57.08 C ANISOU 2048 CE2 PHE A 705 7886 7826 5975 1127 30 945 C ATOM 2049 CZ PHE A 705 20.908 -9.552 22.737 1.00 53.55 C ANISOU 2049 CZ PHE A 705 7360 7305 5683 1029 55 882 C ATOM 0 H PHE A 705 20.347 -13.876 26.252 1.00 54.96 H new ATOM 0 HA PHE A 705 20.086 -14.237 23.583 1.00 52.08 H new ATOM 0 HB2 PHE A 705 22.336 -13.410 25.040 1.00 52.60 H new ATOM 0 HB3 PHE A 705 22.484 -13.916 23.572 1.00 52.60 H new ATOM 0 HD1 PHE A 705 20.924 -12.662 21.839 1.00 53.58 H new ATOM 0 HD2 PHE A 705 22.019 -11.099 25.359 1.00 54.68 H new ATOM 0 HE1 PHE A 705 20.405 -10.537 21.057 1.00 53.69 H new ATOM 0 HE2 PHE A 705 21.476 -8.983 24.582 1.00 57.08 H new ATOM 0 HZ PHE A 705 20.712 -8.700 22.421 1.00 53.55 H new ATOM 2050 N PRO A 706 21.119 -16.536 23.321 1.00 52.75 N ANISOU 2050 N PRO A 706 7250 6800 5993 1166 222 1510 N ATOM 2051 CA PRO A 706 21.461 -17.960 23.403 1.00 53.11 C ANISOU 2051 CA PRO A 706 7288 6750 6142 1202 231 1627 C ATOM 2052 C PRO A 706 22.867 -18.202 23.935 1.00 57.05 C ANISOU 2052 C PRO A 706 7818 7303 6554 1291 120 1639 C ATOM 2053 O PRO A 706 23.751 -17.341 23.832 1.00 55.94 O ANISOU 2053 O PRO A 706 7675 7250 6330 1300 15 1519 O ATOM 2054 CB PRO A 706 21.316 -18.455 21.953 1.00 54.08 C ANISOU 2054 CB PRO A 706 7323 6747 6480 1111 226 1548 C ATOM 2055 CG PRO A 706 20.629 -17.357 21.201 1.00 56.56 C ANISOU 2055 CG PRO A 706 7604 7088 6799 1027 237 1421 C ATOM 2056 CD PRO A 706 20.964 -16.096 21.918 1.00 51.98 C ANISOU 2056 CD PRO A 706 7075 6653 6021 1065 196 1367 C ATOM 0 HA PRO A 706 20.888 -18.432 24.027 1.00 53.11 H new ATOM 0 HB2 PRO A 706 22.184 -18.650 21.565 1.00 54.08 H new ATOM 0 HB3 PRO A 706 20.799 -19.275 21.917 1.00 54.08 H new ATOM 0 HG2 PRO A 706 20.933 -17.324 20.280 1.00 56.56 H new ATOM 0 HG3 PRO A 706 19.670 -17.499 21.178 1.00 56.56 H new ATOM 0 HD2 PRO A 706 21.778 -15.695 21.576 1.00 51.98 H new ATOM 0 HD3 PRO A 706 20.261 -15.434 21.826 1.00 51.98 H new ATOM 2057 N GLU A 707 23.050 -19.378 24.538 1.00 54.63 N ANISOU 2057 N GLU A 707 7537 6941 6278 1357 144 1791 N ATOM 2058 CA GLU A 707 24.340 -19.885 24.982 1.00 54.66 C ANISOU 2058 CA GLU A 707 7559 6968 6242 1444 41 1827 C ATOM 2059 C GLU A 707 24.767 -20.622 23.716 1.00 55.07 C ANISOU 2059 C GLU A 707 7521 6893 6511 1388 14 1762 C ATOM 2060 O GLU A 707 24.351 -21.759 23.499 1.00 55.36 O ANISOU 2060 O GLU A 707 7535 6802 6696 1379 80 1858 O ATOM 2061 CB GLU A 707 24.159 -20.846 26.168 1.00 58.16 C ANISOU 2061 CB GLU A 707 8072 7397 6629 1538 99 2037 C ATOM 2062 CG GLU A 707 23.883 -20.142 27.487 1.00 71.69 C ANISOU 2062 CG GLU A 707 9891 9249 8098 1613 119 2100 C ATOM 2063 CD GLU A 707 23.685 -21.076 28.666 1.00 98.97 C ANISOU 2063 CD GLU A 707 13426 12697 11481 1713 188 2319 C ATOM 2064 OE1 GLU A 707 24.666 -21.739 29.079 1.00 87.34 O ANISOU 2064 OE1 GLU A 707 11973 11223 9990 1796 103 2389 O ATOM 2065 OE2 GLU A 707 22.547 -21.134 29.187 1.00 95.08 O ANISOU 2065 OE2 GLU A 707 12975 12199 10952 1713 329 2427 O ATOM 0 H GLU A 707 22.401 -19.918 24.703 1.00 54.63 H new ATOM 0 HA GLU A 707 24.972 -19.221 25.299 1.00 54.66 H new ATOM 0 HB2 GLU A 707 23.427 -21.452 25.974 1.00 58.16 H new ATOM 0 HB3 GLU A 707 24.958 -21.387 26.260 1.00 58.16 H new ATOM 0 HG2 GLU A 707 24.621 -19.544 27.683 1.00 71.69 H new ATOM 0 HG3 GLU A 707 23.091 -19.592 27.388 1.00 71.69 H new ATOM 2066 N TRP A 708 25.456 -19.892 22.813 1.00 48.61 N ANISOU 2066 N TRP A 708 6650 6104 5714 1343 -70 1592 N ATOM 2067 CA TRP A 708 25.870 -20.307 21.467 1.00 46.41 C ANISOU 2067 CA TRP A 708 6291 5728 5615 1285 -95 1491 C ATOM 2068 C TRP A 708 26.553 -21.652 21.403 1.00 51.07 C ANISOU 2068 C TRP A 708 6857 6214 6332 1335 -114 1568 C ATOM 2069 O TRP A 708 26.186 -22.466 20.563 1.00 50.66 O ANISOU 2069 O TRP A 708 6762 6032 6453 1288 -67 1563 O ATOM 2070 CB TRP A 708 26.736 -19.225 20.783 1.00 42.95 C ANISOU 2070 CB TRP A 708 5814 5367 5140 1256 -187 1318 C ATOM 2071 CG TRP A 708 25.969 -17.960 20.565 1.00 42.02 C ANISOU 2071 CG TRP A 708 5704 5318 4943 1189 -160 1229 C ATOM 2072 CD1 TRP A 708 25.997 -16.846 21.343 1.00 44.65 C ANISOU 2072 CD1 TRP A 708 6081 5776 5106 1213 -191 1204 C ATOM 2073 CD2 TRP A 708 24.943 -17.746 19.595 1.00 40.93 C ANISOU 2073 CD2 TRP A 708 5535 5122 4894 1094 -91 1169 C ATOM 2074 NE1 TRP A 708 25.081 -15.931 20.894 1.00 42.47 N ANISOU 2074 NE1 TRP A 708 5801 5521 4816 1138 -142 1130 N ATOM 2075 CE2 TRP A 708 24.418 -16.456 19.819 1.00 43.72 C ANISOU 2075 CE2 TRP A 708 5911 5570 5130 1064 -82 1110 C ATOM 2076 CE3 TRP A 708 24.445 -18.504 18.517 1.00 42.14 C ANISOU 2076 CE3 TRP A 708 5643 5150 5218 1032 -46 1147 C ATOM 2077 CZ2 TRP A 708 23.434 -15.893 18.993 1.00 42.36 C ANISOU 2077 CZ2 TRP A 708 5713 5373 5008 977 -31 1040 C ATOM 2078 CZ3 TRP A 708 23.477 -17.942 17.693 1.00 42.67 C ANISOU 2078 CZ3 TRP A 708 5688 5197 5326 945 -4 1071 C ATOM 2079 CH2 TRP A 708 22.967 -16.662 17.946 1.00 42.53 C ANISOU 2079 CH2 TRP A 708 5690 5277 5193 919 5 1026 C ATOM 0 H TRP A 708 25.707 -19.089 22.990 1.00 48.61 H new ATOM 0 HA TRP A 708 25.040 -20.411 20.976 1.00 46.41 H new ATOM 0 HB2 TRP A 708 27.516 -19.041 21.330 1.00 42.95 H new ATOM 0 HB3 TRP A 708 27.059 -19.559 19.931 1.00 42.95 H new ATOM 0 HD1 TRP A 708 26.557 -16.722 22.075 1.00 44.65 H new ATOM 0 HE1 TRP A 708 24.945 -15.153 21.233 1.00 42.47 H new ATOM 0 HE3 TRP A 708 24.758 -19.365 18.359 1.00 42.14 H new ATOM 0 HZ2 TRP A 708 23.109 -15.035 19.145 1.00 42.36 H new ATOM 0 HZ3 TRP A 708 23.163 -18.423 16.962 1.00 42.67 H new ATOM 0 HH2 TRP A 708 22.298 -16.322 17.396 1.00 42.53 H new ATOM 2080 N GLU A 709 27.515 -21.896 22.293 1.00 50.13 N ANISOU 2080 N GLU A 709 6766 6148 6132 1433 -187 1640 N ATOM 2081 CA GLU A 709 28.274 -23.138 22.361 1.00 51.67 C ANISOU 2081 CA GLU A 709 6940 6253 6440 1498 -216 1724 C ATOM 2082 C GLU A 709 27.357 -24.367 22.564 1.00 56.26 C ANISOU 2082 C GLU A 709 7536 6701 7137 1498 -107 1878 C ATOM 2083 O GLU A 709 27.706 -25.462 22.132 1.00 56.35 O ANISOU 2083 O GLU A 709 7507 6587 7314 1512 -105 1912 O ATOM 2084 CB GLU A 709 29.413 -23.042 23.411 1.00 54.55 C ANISOU 2084 CB GLU A 709 7338 6715 6673 1609 -325 1779 C ATOM 2085 CG GLU A 709 28.987 -22.853 24.869 1.00 70.85 C ANISOU 2085 CG GLU A 709 9503 8875 8543 1682 -311 1918 C ATOM 2086 CD GLU A 709 28.439 -21.510 25.333 1.00 96.32 C ANISOU 2086 CD GLU A 709 12783 12237 11579 1659 -305 1855 C ATOM 2087 OE1 GLU A 709 28.761 -20.464 24.717 1.00 75.38 O ANISOU 2087 OE1 GLU A 709 10091 9643 8907 1605 -361 1689 O ATOM 2088 OE2 GLU A 709 27.708 -21.506 26.350 1.00 98.65 O ANISOU 2088 OE2 GLU A 709 13162 12578 11742 1702 -241 1976 O ATOM 0 H GLU A 709 27.749 -21.324 22.891 1.00 50.13 H new ATOM 0 HA GLU A 709 28.703 -23.273 21.502 1.00 51.67 H new ATOM 0 HB2 GLU A 709 29.947 -23.850 23.354 1.00 54.55 H new ATOM 0 HB3 GLU A 709 29.990 -22.302 23.165 1.00 54.55 H new ATOM 0 HG2 GLU A 709 28.312 -23.522 25.062 1.00 70.85 H new ATOM 0 HG3 GLU A 709 29.756 -23.058 25.423 1.00 70.85 H new ATOM 2089 N ARG A 710 26.158 -24.149 23.147 1.00 52.23 N ANISOU 2089 N ARG A 710 7076 6211 6557 1477 -12 1963 N ATOM 2090 CA ARG A 710 25.159 -25.181 23.421 1.00 53.49 C ANISOU 2090 CA ARG A 710 7246 6250 6827 1471 105 2119 C ATOM 2091 C ARG A 710 23.973 -25.201 22.438 1.00 55.98 C ANISOU 2091 C ARG A 710 7511 6467 7294 1355 191 2053 C ATOM 2092 O ARG A 710 23.039 -25.995 22.634 1.00 56.45 O ANISOU 2092 O ARG A 710 7567 6419 7465 1337 292 2176 O ATOM 2093 CB ARG A 710 24.637 -25.034 24.861 1.00 56.48 C ANISOU 2093 CB ARG A 710 7715 6714 7030 1541 165 2285 C ATOM 2094 CG ARG A 710 25.532 -25.692 25.907 1.00 71.11 C ANISOU 2094 CG ARG A 710 9621 8593 8803 1667 111 2430 C ATOM 2095 CD ARG A 710 24.858 -25.741 27.267 1.00 87.10 C ANISOU 2095 CD ARG A 710 11743 10681 10670 1738 197 2616 C ATOM 2096 NE ARG A 710 23.870 -26.821 27.365 1.00103.58 N ANISOU 2096 NE ARG A 710 13820 12624 12912 1720 339 2782 N ATOM 2097 CZ ARG A 710 22.551 -26.650 27.301 1.00122.47 C ANISOU 2097 CZ ARG A 710 16206 14983 15346 1652 471 2814 C ATOM 2098 NH1 ARG A 710 22.037 -25.436 27.139 1.00111.76 N ANISOU 2098 NH1 ARG A 710 14857 13728 13880 1598 481 2691 N ATOM 2099 NH2 ARG A 710 21.735 -27.692 27.405 1.00109.54 N ANISOU 2099 NH2 ARG A 710 14548 13202 13871 1637 594 2970 N ATOM 0 H ARG A 710 25.906 -23.366 23.398 1.00 52.23 H new ATOM 0 HA ARG A 710 25.617 -26.028 23.302 1.00 53.49 H new ATOM 0 HB2 ARG A 710 24.548 -24.091 25.070 1.00 56.48 H new ATOM 0 HB3 ARG A 710 23.749 -25.422 24.916 1.00 56.48 H new ATOM 0 HG2 ARG A 710 25.755 -26.592 25.623 1.00 71.11 H new ATOM 0 HG3 ARG A 710 26.366 -25.201 25.976 1.00 71.11 H new ATOM 0 HD2 ARG A 710 25.532 -25.860 27.955 1.00 87.10 H new ATOM 0 HD3 ARG A 710 24.423 -24.892 27.440 1.00 87.10 H new ATOM 0 HE ARG A 710 24.164 -27.622 27.471 1.00103.58 H new ATOM 0 HH11 ARG A 710 22.557 -24.754 27.075 1.00111.76 H new ATOM 0 HH12 ARG A 710 21.184 -25.332 27.098 1.00111.76 H new ATOM 0 HH21 ARG A 710 22.058 -28.482 27.514 1.00109.54 H new ATOM 0 HH22 ARG A 710 20.884 -27.577 27.363 1.00109.54 H new ATOM 2100 N CYS A 711 23.984 -24.323 21.405 1.00 49.79 N ANISOU 2100 N CYS A 711 6686 5716 6515 1277 151 1867 N ATOM 2101 CA CYS A 711 22.889 -24.256 20.437 1.00 48.77 C ANISOU 2101 CA CYS A 711 6511 5505 6515 1170 212 1794 C ATOM 2102 C CYS A 711 22.845 -25.493 19.552 1.00 50.77 C ANISOU 2102 C CYS A 711 6708 5581 7003 1138 223 1786 C ATOM 2103 O CYS A 711 23.774 -25.743 18.789 1.00 49.05 O ANISOU 2103 O CYS A 711 6459 5331 6847 1145 153 1686 O ATOM 2104 CB CYS A 711 22.951 -22.970 19.621 1.00 48.51 C ANISOU 2104 CB CYS A 711 6458 5562 6411 1106 162 1609 C ATOM 2105 SG CYS A 711 21.453 -22.634 18.669 1.00 52.27 S ANISOU 2105 SG CYS A 711 6892 5973 6996 985 231 1536 S ATOM 0 H CYS A 711 24.621 -23.764 21.258 1.00 49.79 H new ATOM 0 HA CYS A 711 22.057 -24.239 20.935 1.00 48.77 H new ATOM 0 HB2 CYS A 711 23.117 -22.225 20.220 1.00 48.51 H new ATOM 0 HB3 CYS A 711 23.706 -23.019 19.013 1.00 48.51 H new ATOM 0 HG CYS A 711 21.586 -21.608 18.061 1.00 52.27 H new ATOM 2106 N GLU A 712 21.780 -26.290 19.687 1.00 48.83 N ANISOU 2106 N GLU A 712 6447 5214 6892 1107 316 1895 N ATOM 2107 CA GLU A 712 21.615 -27.544 18.951 1.00 50.12 C ANISOU 2107 CA GLU A 712 6559 5191 7295 1076 331 1898 C ATOM 2108 C GLU A 712 20.921 -27.379 17.599 1.00 53.22 C ANISOU 2108 C GLU A 712 6896 5510 7816 969 324 1739 C ATOM 2109 O GLU A 712 20.694 -28.375 16.909 1.00 55.08 O ANISOU 2109 O GLU A 712 7088 5585 8253 936 329 1718 O ATOM 2110 CB GLU A 712 20.888 -28.588 19.816 1.00 53.24 C ANISOU 2110 CB GLU A 712 6958 5475 7795 1101 431 2107 C ATOM 2111 CG GLU A 712 21.814 -29.418 20.682 1.00 70.46 C ANISOU 2111 CG GLU A 712 9174 7639 9960 1210 417 2250 C ATOM 2112 CD GLU A 712 21.092 -30.413 21.570 1.00101.25 C ANISOU 2112 CD GLU A 712 13082 11432 13955 1240 526 2475 C ATOM 2113 OE1 GLU A 712 20.768 -30.049 22.723 1.00 97.51 O ANISOU 2113 OE1 GLU A 712 12669 11057 13323 1291 586 2616 O ATOM 2114 OE2 GLU A 712 20.841 -31.551 21.111 1.00101.74 O ANISOU 2114 OE2 GLU A 712 13094 11311 14253 1213 554 2509 O ATOM 0 H GLU A 712 21.126 -26.113 20.216 1.00 48.83 H new ATOM 0 HA GLU A 712 22.511 -27.859 18.752 1.00 50.12 H new ATOM 0 HB2 GLU A 712 20.247 -28.134 20.385 1.00 53.24 H new ATOM 0 HB3 GLU A 712 20.383 -29.180 19.237 1.00 53.24 H new ATOM 0 HG2 GLU A 712 22.434 -29.897 20.111 1.00 70.46 H new ATOM 0 HG3 GLU A 712 22.342 -28.824 21.238 1.00 70.46 H new ATOM 2115 N LYS A 713 20.592 -26.140 17.222 1.00 47.28 N ANISOU 2115 N LYS A 713 6147 4869 6948 918 306 1626 N ATOM 2116 CA LYS A 713 19.920 -25.819 15.963 1.00 45.82 C ANISOU 2116 CA LYS A 713 5919 4637 6852 821 288 1476 C ATOM 2117 C LYS A 713 20.776 -26.077 14.717 1.00 50.21 C ANISOU 2117 C LYS A 713 6454 5147 7475 810 209 1314 C ATOM 2118 O LYS A 713 21.960 -25.757 14.696 1.00 50.36 O ANISOU 2118 O LYS A 713 6492 5248 7396 863 153 1263 O ATOM 2119 CB LYS A 713 19.381 -24.389 15.981 1.00 46.14 C ANISOU 2119 CB LYS A 713 5973 4815 6743 780 292 1413 C ATOM 2120 CG LYS A 713 17.956 -24.372 16.505 1.00 51.42 C ANISOU 2120 CG LYS A 713 6625 5447 7463 738 385 1516 C ATOM 2121 CD LYS A 713 17.463 -23.020 16.891 1.00 59.39 C ANISOU 2121 CD LYS A 713 7658 6599 8310 725 408 1499 C ATOM 2122 CE LYS A 713 15.992 -23.069 17.195 1.00 70.55 C ANISOU 2122 CE LYS A 713 9038 7957 9812 675 504 1585 C ATOM 2123 NZ LYS A 713 15.546 -21.836 17.887 1.00 84.03 N ANISOU 2123 NZ LYS A 713 10776 9803 11349 685 547 1602 N ATOM 0 H LYS A 713 20.758 -25.448 17.704 1.00 47.28 H new ATOM 0 HA LYS A 713 19.173 -26.434 15.896 1.00 45.82 H new ATOM 0 HB2 LYS A 713 19.945 -23.831 16.539 1.00 46.14 H new ATOM 0 HB3 LYS A 713 19.408 -24.015 15.087 1.00 46.14 H new ATOM 0 HG2 LYS A 713 17.368 -24.738 15.826 1.00 51.42 H new ATOM 0 HG3 LYS A 713 17.898 -24.958 17.276 1.00 51.42 H new ATOM 0 HD2 LYS A 713 17.950 -22.701 17.667 1.00 59.39 H new ATOM 0 HD3 LYS A 713 17.630 -22.390 16.172 1.00 59.39 H new ATOM 0 HE2 LYS A 713 15.492 -23.179 16.371 1.00 70.55 H new ATOM 0 HE3 LYS A 713 15.799 -23.842 17.749 1.00 70.55 H new ATOM 0 HZ1 LYS A 713 14.659 -21.779 17.850 1.00 84.03 H new ATOM 0 HZ2 LYS A 713 15.806 -21.862 18.738 1.00 84.03 H new ATOM 0 HZ3 LYS A 713 15.905 -21.126 17.489 1.00 84.03 H new ATOM 2124 N PRO A 714 20.210 -26.677 13.664 1.00 47.22 N ANISOU 2124 N PRO A 714 6037 4636 7269 746 201 1230 N ATOM 2125 CA PRO A 714 21.003 -26.858 12.445 1.00 46.26 C ANISOU 2125 CA PRO A 714 5907 4481 7190 741 133 1067 C ATOM 2126 C PRO A 714 21.007 -25.567 11.612 1.00 48.26 C ANISOU 2126 C PRO A 714 6169 4853 7316 695 90 914 C ATOM 2127 O PRO A 714 20.182 -24.655 11.829 1.00 45.40 O ANISOU 2127 O PRO A 714 5808 4566 6876 651 110 923 O ATOM 2128 CB PRO A 714 20.254 -27.972 11.725 1.00 49.35 C ANISOU 2128 CB PRO A 714 6261 4685 7807 690 141 1038 C ATOM 2129 CG PRO A 714 18.810 -27.749 12.105 1.00 54.49 C ANISOU 2129 CG PRO A 714 6887 5313 8502 625 194 1115 C ATOM 2130 CD PRO A 714 18.805 -27.112 13.471 1.00 49.87 C ANISOU 2130 CD PRO A 714 6332 4853 7762 672 250 1265 C ATOM 0 HA PRO A 714 21.935 -27.068 12.611 1.00 46.26 H new ATOM 0 HB2 PRO A 714 20.380 -27.921 10.765 1.00 49.35 H new ATOM 0 HB3 PRO A 714 20.564 -28.847 12.006 1.00 49.35 H new ATOM 0 HG2 PRO A 714 18.370 -27.176 11.458 1.00 54.49 H new ATOM 0 HG3 PRO A 714 18.325 -28.589 12.117 1.00 54.49 H new ATOM 0 HD2 PRO A 714 18.191 -26.362 13.512 1.00 49.87 H new ATOM 0 HD3 PRO A 714 18.530 -27.741 14.156 1.00 49.87 H new ATOM 2131 N LEU A 715 21.917 -25.493 10.634 1.00 44.45 N ANISOU 2131 N LEU A 715 5688 4381 6819 707 38 776 N ATOM 2132 CA LEU A 715 21.949 -24.355 9.717 1.00 42.64 C ANISOU 2132 CA LEU A 715 5469 4249 6484 664 2 633 C ATOM 2133 C LEU A 715 20.702 -24.371 8.825 1.00 45.85 C ANISOU 2133 C LEU A 715 5860 4583 6978 579 -5 558 C ATOM 2134 O LEU A 715 20.107 -25.439 8.594 1.00 46.03 O ANISOU 2134 O LEU A 715 5862 4459 7169 556 1 571 O ATOM 2135 CB LEU A 715 23.230 -24.370 8.859 1.00 42.74 C ANISOU 2135 CB LEU A 715 5487 4281 6473 703 -37 514 C ATOM 2136 CG LEU A 715 24.578 -24.233 9.613 1.00 48.05 C ANISOU 2136 CG LEU A 715 6160 5033 7062 786 -46 568 C ATOM 2137 CD1 LEU A 715 25.712 -23.885 8.639 1.00 48.24 C ANISOU 2137 CD1 LEU A 715 6179 5101 7048 809 -75 434 C ATOM 2138 CD2 LEU A 715 24.507 -23.133 10.685 1.00 49.02 C ANISOU 2138 CD2 LEU A 715 6297 5299 7030 794 -43 646 C ATOM 0 H LEU A 715 22.520 -26.089 10.488 1.00 44.45 H new ATOM 0 HA LEU A 715 21.953 -23.538 10.240 1.00 42.64 H new ATOM 0 HB2 LEU A 715 23.248 -25.200 8.357 1.00 42.74 H new ATOM 0 HB3 LEU A 715 23.170 -23.649 8.213 1.00 42.74 H new ATOM 0 HG LEU A 715 24.755 -25.087 10.037 1.00 48.05 H new ATOM 0 HD11 LEU A 715 26.546 -23.804 9.128 1.00 48.24 H new ATOM 0 HD12 LEU A 715 25.795 -24.587 7.974 1.00 48.24 H new ATOM 0 HD13 LEU A 715 25.513 -23.044 8.198 1.00 48.24 H new ATOM 0 HD21 LEU A 715 25.361 -23.069 11.140 1.00 49.02 H new ATOM 0 HD22 LEU A 715 24.301 -22.284 10.264 1.00 49.02 H new ATOM 0 HD23 LEU A 715 23.814 -23.352 11.328 1.00 49.02 H new ATOM 2139 N THR A 716 20.294 -23.183 8.352 1.00 40.24 N ANISOU 2139 N THR A 716 5158 3971 6161 533 -23 483 N ATOM 2140 CA THR A 716 19.134 -23.022 7.466 1.00 39.05 C ANISOU 2140 CA THR A 716 4992 3771 6072 455 -46 405 C ATOM 2141 C THR A 716 19.595 -22.950 5.990 1.00 40.53 C ANISOU 2141 C THR A 716 5201 3952 6246 444 -102 233 C ATOM 2142 O THR A 716 20.766 -23.197 5.707 1.00 40.59 O ANISOU 2142 O THR A 716 5226 3972 6222 497 -109 187 O ATOM 2143 CB THR A 716 18.273 -21.848 7.939 1.00 42.77 C ANISOU 2143 CB THR A 716 5457 4342 6452 416 -26 447 C ATOM 2144 OG1 THR A 716 19.076 -20.667 7.948 1.00 40.51 O ANISOU 2144 OG1 THR A 716 5198 4203 5991 440 -39 405 O ATOM 2145 CG2 THR A 716 17.651 -22.096 9.314 1.00 40.37 C ANISOU 2145 CG2 THR A 716 5136 4023 6180 427 43 614 C ATOM 0 H THR A 716 20.689 -22.442 8.540 1.00 40.24 H new ATOM 0 HA THR A 716 18.554 -23.799 7.511 1.00 39.05 H new ATOM 0 HB THR A 716 17.531 -21.742 7.323 1.00 42.77 H new ATOM 0 HG1 THR A 716 18.580 -19.991 8.006 1.00 40.51 H new ATOM 0 HG21 THR A 716 17.117 -21.328 9.571 1.00 40.37 H new ATOM 0 HG22 THR A 716 17.087 -22.884 9.277 1.00 40.37 H new ATOM 0 HG23 THR A 716 18.354 -22.233 9.968 1.00 40.37 H new ATOM 2146 N ARG A 717 18.696 -22.634 5.055 1.00 34.85 N ANISOU 2146 N ARG A 717 4481 3213 5549 381 -141 142 N ATOM 2147 CA ARG A 717 19.056 -22.599 3.641 1.00 34.32 C ANISOU 2147 CA ARG A 717 4445 3138 5456 376 -194 -18 C ATOM 2148 C ARG A 717 19.838 -21.316 3.286 1.00 38.40 C ANISOU 2148 C ARG A 717 4993 3810 5788 394 -195 -72 C ATOM 2149 O ARG A 717 19.792 -20.321 4.037 1.00 37.09 O ANISOU 2149 O ARG A 717 4818 3750 5525 391 -171 -1 O ATOM 2150 CB ARG A 717 17.808 -22.789 2.754 1.00 33.97 C ANISOU 2150 CB ARG A 717 4392 3013 5504 306 -249 -97 C ATOM 2151 CG ARG A 717 17.101 -24.146 3.011 1.00 44.63 C ANISOU 2151 CG ARG A 717 5701 4188 7066 285 -252 -55 C ATOM 2152 CD ARG A 717 15.823 -24.345 2.213 1.00 49.09 C ANISOU 2152 CD ARG A 717 6244 4664 7742 213 -319 -133 C ATOM 2153 NE ARG A 717 14.846 -23.284 2.448 1.00 51.49 N ANISOU 2153 NE ARG A 717 6520 5045 7998 162 -321 -89 N ATOM 2154 CZ ARG A 717 13.877 -22.956 1.597 1.00 66.81 C ANISOU 2154 CZ ARG A 717 8450 6967 9969 104 -393 -174 C ATOM 2155 NH1 ARG A 717 13.736 -23.615 0.453 1.00 61.20 N ANISOU 2155 NH1 ARG A 717 7760 6166 9329 90 -476 -312 N ATOM 2156 NH2 ARG A 717 13.048 -21.962 1.879 1.00 51.57 N ANISOU 2156 NH2 ARG A 717 6488 5108 7997 65 -388 -125 N ATOM 0 H ARG A 717 17.875 -22.438 5.221 1.00 34.85 H new ATOM 0 HA ARG A 717 19.653 -23.343 3.463 1.00 34.32 H new ATOM 0 HB2 ARG A 717 17.184 -22.065 2.919 1.00 33.97 H new ATOM 0 HB3 ARG A 717 18.066 -22.733 1.821 1.00 33.97 H new ATOM 0 HG2 ARG A 717 17.717 -24.865 2.800 1.00 44.63 H new ATOM 0 HG3 ARG A 717 16.894 -24.217 3.956 1.00 44.63 H new ATOM 0 HD2 ARG A 717 16.038 -24.380 1.268 1.00 49.09 H new ATOM 0 HD3 ARG A 717 15.430 -25.200 2.446 1.00 49.09 H new ATOM 0 HE ARG A 717 14.901 -22.843 3.184 1.00 51.49 H new ATOM 0 HH11 ARG A 717 14.273 -24.258 0.258 1.00 61.20 H new ATOM 0 HH12 ARG A 717 13.108 -23.399 -0.093 1.00 61.20 H new ATOM 0 HH21 ARG A 717 13.135 -21.525 2.615 1.00 51.57 H new ATOM 0 HH22 ARG A 717 12.423 -21.753 1.326 1.00 51.57 H new ATOM 2157 N LEU A 718 20.555 -21.353 2.153 1.00 33.36 N ANISOU 2157 N LEU A 718 4390 3179 5106 416 -218 -196 N ATOM 2158 CA LEU A 718 21.340 -20.222 1.693 1.00 32.84 C ANISOU 2158 CA LEU A 718 4349 3244 4886 434 -211 -247 C ATOM 2159 C LEU A 718 21.243 -20.041 0.204 1.00 36.39 C ANISOU 2159 C LEU A 718 4843 3693 5290 419 -248 -387 C ATOM 2160 O LEU A 718 21.306 -21.016 -0.557 1.00 37.63 O ANISOU 2160 O LEU A 718 5024 3754 5520 433 -269 -472 O ATOM 2161 CB LEU A 718 22.833 -20.404 2.102 1.00 33.42 C ANISOU 2161 CB LEU A 718 4417 3351 4929 507 -172 -223 C ATOM 2162 CG LEU A 718 23.880 -19.398 1.536 1.00 36.20 C ANISOU 2162 CG LEU A 718 4783 3819 5150 534 -155 -283 C ATOM 2163 CD1 LEU A 718 23.806 -18.024 2.254 1.00 33.93 C ANISOU 2163 CD1 LEU A 718 4478 3655 4757 513 -148 -218 C ATOM 2164 CD2 LEU A 718 25.293 -19.974 1.637 1.00 34.90 C ANISOU 2164 CD2 LEU A 718 4606 3644 5011 607 -124 -286 C ATOM 0 H LEU A 718 20.593 -22.040 1.637 1.00 33.36 H new ATOM 0 HA LEU A 718 20.979 -19.427 2.115 1.00 32.84 H new ATOM 0 HB2 LEU A 718 22.881 -20.368 3.070 1.00 33.42 H new ATOM 0 HB3 LEU A 718 23.106 -21.296 1.837 1.00 33.42 H new ATOM 0 HG LEU A 718 23.666 -19.254 0.601 1.00 36.20 H new ATOM 0 HD11 LEU A 718 24.470 -17.425 1.877 1.00 33.93 H new ATOM 0 HD12 LEU A 718 22.922 -17.643 2.134 1.00 33.93 H new ATOM 0 HD13 LEU A 718 23.980 -18.144 3.201 1.00 33.93 H new ATOM 0 HD21 LEU A 718 25.930 -19.335 1.280 1.00 34.90 H new ATOM 0 HD22 LEU A 718 25.503 -20.155 2.566 1.00 34.90 H new ATOM 0 HD23 LEU A 718 25.344 -20.798 1.128 1.00 34.90 H new ATOM 2165 N HIS A 719 21.069 -18.785 -0.208 1.00 29.99 N ANISOU 2165 N HIS A 719 4049 2989 4358 394 -256 -412 N ATOM 2166 CA HIS A 719 21.170 -18.334 -1.585 1.00 29.51 C ANISOU 2166 CA HIS A 719 4040 2965 4209 392 -281 -529 C ATOM 2167 C HIS A 719 22.285 -17.273 -1.512 1.00 32.03 C ANISOU 2167 C HIS A 719 4360 3407 4403 426 -230 -512 C ATOM 2168 O HIS A 719 22.161 -16.306 -0.763 1.00 30.40 O ANISOU 2168 O HIS A 719 4124 3278 4148 407 -217 -437 O ATOM 2169 CB HIS A 719 19.875 -17.685 -2.082 1.00 29.94 C ANISOU 2169 CB HIS A 719 4104 3034 4240 330 -338 -553 C ATOM 2170 CG HIS A 719 19.996 -17.190 -3.490 1.00 32.55 C ANISOU 2170 CG HIS A 719 4497 3409 4461 336 -366 -664 C ATOM 2171 ND1 HIS A 719 19.689 -18.001 -4.563 1.00 34.57 N ANISOU 2171 ND1 HIS A 719 4801 3587 4746 339 -420 -778 N ATOM 2172 CD2 HIS A 719 20.385 -15.979 -3.953 1.00 32.81 C ANISOU 2172 CD2 HIS A 719 4555 3555 4357 342 -346 -673 C ATOM 2173 CE1 HIS A 719 19.895 -17.261 -5.640 1.00 33.66 C ANISOU 2173 CE1 HIS A 719 4746 3548 4496 351 -430 -849 C ATOM 2174 NE2 HIS A 719 20.331 -16.046 -5.325 1.00 33.15 N ANISOU 2174 NE2 HIS A 719 4667 3596 4333 353 -382 -784 N ATOM 0 H HIS A 719 20.880 -18.147 0.337 1.00 29.99 H new ATOM 0 HA HIS A 719 21.345 -19.066 -2.197 1.00 29.51 H new ATOM 0 HB2 HIS A 719 19.151 -18.328 -2.028 1.00 29.94 H new ATOM 0 HB3 HIS A 719 19.641 -16.945 -1.500 1.00 29.94 H new ATOM 0 HD1 HIS A 719 19.420 -18.817 -4.537 1.00 34.57 H new ATOM 0 HD2 HIS A 719 20.639 -15.245 -3.442 1.00 32.81 H new ATOM 0 HE1 HIS A 719 19.752 -17.555 -6.511 1.00 33.66 H new ATOM 2175 N VAL A 720 23.363 -17.449 -2.262 1.00 29.62 N ANISOU 2175 N VAL A 720 4083 3116 4055 476 -199 -582 N ATOM 2176 CA VAL A 720 24.478 -16.489 -2.240 1.00 28.27 C ANISOU 2176 CA VAL A 720 3901 3050 3790 506 -146 -565 C ATOM 2177 C VAL A 720 24.783 -16.061 -3.676 1.00 32.64 C ANISOU 2177 C VAL A 720 4512 3644 4245 521 -131 -664 C ATOM 2178 O VAL A 720 24.843 -16.899 -4.574 1.00 33.04 O ANISOU 2178 O VAL A 720 4610 3633 4309 546 -137 -754 O ATOM 2179 CB VAL A 720 25.706 -17.006 -1.414 1.00 31.90 C ANISOU 2179 CB VAL A 720 4315 3501 4304 563 -102 -515 C ATOM 2180 CG1 VAL A 720 26.292 -18.303 -1.980 1.00 33.71 C ANISOU 2180 CG1 VAL A 720 4562 3637 4608 615 -86 -582 C ATOM 2181 CG2 VAL A 720 26.779 -15.930 -1.209 1.00 30.64 C ANISOU 2181 CG2 VAL A 720 4123 3447 4069 586 -59 -487 C ATOM 0 H VAL A 720 23.476 -18.115 -2.794 1.00 29.62 H new ATOM 0 HA VAL A 720 24.222 -15.690 -1.754 1.00 28.27 H new ATOM 0 HB VAL A 720 25.361 -17.219 -0.533 1.00 31.90 H new ATOM 0 HG11 VAL A 720 27.046 -18.582 -1.437 1.00 33.71 H new ATOM 0 HG12 VAL A 720 25.614 -18.996 -1.970 1.00 33.71 H new ATOM 0 HG13 VAL A 720 26.588 -18.154 -2.892 1.00 33.71 H new ATOM 0 HG21 VAL A 720 27.514 -16.299 -0.694 1.00 30.64 H new ATOM 0 HG22 VAL A 720 27.107 -15.631 -2.072 1.00 30.64 H new ATOM 0 HG23 VAL A 720 26.396 -15.178 -0.731 1.00 30.64 H new ATOM 2182 N THR A 721 24.902 -14.753 -3.899 1.00 28.86 N ANISOU 2182 N THR A 721 4034 3266 3665 504 -113 -646 N ATOM 2183 CA THR A 721 25.136 -14.211 -5.232 1.00 29.27 C ANISOU 2183 CA THR A 721 4145 3366 3609 518 -92 -719 C ATOM 2184 C THR A 721 26.081 -13.031 -5.227 1.00 33.04 C ANISOU 2184 C THR A 721 4596 3942 4016 532 -27 -680 C ATOM 2185 O THR A 721 26.024 -12.219 -4.326 1.00 31.81 O ANISOU 2185 O THR A 721 4388 3832 3867 504 -31 -604 O ATOM 2186 CB THR A 721 23.787 -13.879 -5.929 1.00 37.61 C ANISOU 2186 CB THR A 721 5253 4421 4618 469 -164 -756 C ATOM 2187 OG1 THR A 721 24.036 -13.321 -7.223 1.00 43.48 O ANISOU 2187 OG1 THR A 721 6063 5219 5239 490 -143 -818 O ATOM 2188 CG2 THR A 721 22.874 -12.958 -5.100 1.00 32.00 C ANISOU 2188 CG2 THR A 721 4498 3747 3915 410 -200 -673 C ATOM 0 H THR A 721 24.849 -14.157 -3.281 1.00 28.86 H new ATOM 0 HA THR A 721 25.582 -14.899 -5.751 1.00 29.27 H new ATOM 0 HB THR A 721 23.303 -14.715 -6.018 1.00 37.61 H new ATOM 0 HG1 THR A 721 24.516 -13.848 -7.668 1.00 43.48 H new ATOM 0 HG21 THR A 721 22.053 -12.791 -5.589 1.00 32.00 H new ATOM 0 HG22 THR A 721 22.665 -13.385 -4.255 1.00 32.00 H new ATOM 0 HG23 THR A 721 23.328 -12.117 -4.933 1.00 32.00 H new ATOM 2189 N TYR A 722 26.890 -12.886 -6.267 1.00 32.21 N ANISOU 2189 N TYR A 722 4528 3868 3842 574 33 -734 N ATOM 2190 CA TYR A 722 27.741 -11.697 -6.369 1.00 32.78 C ANISOU 2190 CA TYR A 722 4570 4028 3858 582 101 -694 C ATOM 2191 C TYR A 722 27.032 -10.608 -7.203 1.00 35.59 C ANISOU 2191 C TYR A 722 4978 4442 4104 549 87 -698 C ATOM 2192 O TYR A 722 27.587 -9.530 -7.414 1.00 34.29 O ANISOU 2192 O TYR A 722 4795 4344 3890 550 142 -661 O ATOM 2193 CB TYR A 722 29.150 -12.014 -6.883 1.00 34.28 C ANISOU 2193 CB TYR A 722 4751 4223 4052 649 195 -725 C ATOM 2194 CG TYR A 722 29.222 -12.395 -8.347 1.00 38.55 C ANISOU 2194 CG TYR A 722 5384 4758 4506 690 234 -816 C ATOM 2195 CD1 TYR A 722 29.090 -13.719 -8.748 1.00 41.30 C ANISOU 2195 CD1 TYR A 722 5781 5027 4885 725 215 -899 C ATOM 2196 CD2 TYR A 722 29.543 -11.449 -9.319 1.00 40.42 C ANISOU 2196 CD2 TYR A 722 5658 5067 4633 703 299 -819 C ATOM 2197 CE1 TYR A 722 29.251 -14.092 -10.085 1.00 45.00 C ANISOU 2197 CE1 TYR A 722 6341 5492 5265 774 255 -995 C ATOM 2198 CE2 TYR A 722 29.707 -11.808 -10.656 1.00 42.72 C ANISOU 2198 CE2 TYR A 722 6043 5361 4827 753 346 -900 C ATOM 2199 CZ TYR A 722 29.556 -13.132 -11.035 1.00 51.66 C ANISOU 2199 CZ TYR A 722 7230 6418 5980 790 321 -994 C ATOM 2200 OH TYR A 722 29.693 -13.492 -12.349 1.00 54.22 O ANISOU 2200 OH TYR A 722 7657 6746 6197 846 363 -1087 O ATOM 0 H TYR A 722 26.965 -13.448 -6.914 1.00 32.21 H new ATOM 0 HA TYR A 722 27.875 -11.349 -5.473 1.00 32.78 H new ATOM 0 HB2 TYR A 722 29.716 -11.240 -6.735 1.00 34.28 H new ATOM 0 HB3 TYR A 722 29.518 -12.740 -6.355 1.00 34.28 H new ATOM 0 HD1 TYR A 722 28.891 -14.370 -8.114 1.00 41.30 H new ATOM 0 HD2 TYR A 722 29.650 -10.559 -9.070 1.00 40.42 H new ATOM 0 HE1 TYR A 722 29.154 -14.982 -10.336 1.00 45.00 H new ATOM 0 HE2 TYR A 722 29.917 -11.162 -11.291 1.00 42.72 H new ATOM 0 HH TYR A 722 29.876 -12.813 -12.808 1.00 54.22 H new ATOM 2201 N GLU A 723 25.801 -10.893 -7.656 1.00 32.61 N ANISOU 2201 N GLU A 723 4659 4033 3698 520 10 -737 N ATOM 2202 CA GLU A 723 25.021 -9.918 -8.425 1.00 33.96 C ANISOU 2202 CA GLU A 723 4880 4255 3769 492 -20 -737 C ATOM 2203 C GLU A 723 23.741 -9.578 -7.713 1.00 36.10 C ANISOU 2203 C GLU A 723 5121 4511 4083 429 -106 -694 C ATOM 2204 O GLU A 723 23.277 -10.361 -6.906 1.00 38.17 O ANISOU 2204 O GLU A 723 5351 4712 4440 411 -148 -686 O ATOM 2205 CB GLU A 723 24.721 -10.448 -9.832 1.00 37.07 C ANISOU 2205 CB GLU A 723 5378 4634 4072 523 -40 -833 C ATOM 2206 CG GLU A 723 25.951 -10.421 -10.714 1.00 50.36 C ANISOU 2206 CG GLU A 723 7100 6355 5678 589 66 -866 C ATOM 2207 CD GLU A 723 25.709 -10.639 -12.192 1.00 73.49 C ANISOU 2207 CD GLU A 723 10149 9297 8476 628 59 -954 C ATOM 2208 OE1 GLU A 723 26.609 -10.278 -12.986 1.00 72.95 O ANISOU 2208 OE1 GLU A 723 10119 9281 8316 680 159 -960 O ATOM 2209 OE2 GLU A 723 24.638 -11.181 -12.557 1.00 60.90 O ANISOU 2209 OE2 GLU A 723 8610 7659 6870 610 -46 -1017 O ATOM 0 H GLU A 723 25.403 -11.645 -7.527 1.00 32.61 H new ATOM 0 HA GLU A 723 25.551 -9.110 -8.508 1.00 33.96 H new ATOM 0 HB2 GLU A 723 24.386 -11.356 -9.771 1.00 37.07 H new ATOM 0 HB3 GLU A 723 24.020 -9.913 -10.237 1.00 37.07 H new ATOM 0 HG2 GLU A 723 26.392 -9.565 -10.599 1.00 50.36 H new ATOM 0 HG3 GLU A 723 26.567 -11.101 -10.401 1.00 50.36 H new ATOM 2210 N GLY A 724 23.167 -8.430 -8.015 1.00 31.37 N ANISOU 2210 N GLY A 724 4534 3966 3421 398 -126 -661 N ATOM 2211 CA GLY A 724 21.909 -8.013 -7.405 1.00 29.86 C ANISOU 2211 CA GLY A 724 4311 3762 3271 341 -201 -620 C ATOM 2212 C GLY A 724 22.081 -7.133 -6.190 1.00 34.31 C ANISOU 2212 C GLY A 724 4797 4360 3881 315 -173 -535 C ATOM 2213 O GLY A 724 23.203 -6.894 -5.729 1.00 33.46 O ANISOU 2213 O GLY A 724 4651 4281 3783 338 -107 -508 O ATOM 0 H GLY A 724 23.491 -7.867 -8.578 1.00 31.37 H new ATOM 0 HA2 GLY A 724 21.381 -7.538 -8.066 1.00 29.86 H new ATOM 0 HA3 GLY A 724 21.404 -8.802 -7.153 1.00 29.86 H new ATOM 2214 N THR A 725 20.963 -6.624 -5.664 1.00 30.83 N ANISOU 2214 N THR A 725 4328 3916 3471 269 -226 -496 N ATOM 2215 CA THR A 725 21.004 -5.751 -4.489 1.00 28.54 C ANISOU 2215 CA THR A 725 3970 3656 3216 247 -205 -425 C ATOM 2216 C THR A 725 19.961 -6.193 -3.492 1.00 31.54 C ANISOU 2216 C THR A 725 4314 3990 3679 215 -250 -395 C ATOM 2217 O THR A 725 18.990 -6.858 -3.860 1.00 29.31 O ANISOU 2217 O THR A 725 4051 3656 3430 198 -306 -422 O ATOM 2218 CB THR A 725 20.765 -4.268 -4.886 1.00 40.02 C ANISOU 2218 CB THR A 725 5426 5166 4614 226 -201 -394 C ATOM 2219 OG1 THR A 725 19.450 -4.126 -5.393 1.00 36.23 O ANISOU 2219 OG1 THR A 725 4970 4668 4127 198 -271 -402 O ATOM 2220 CG2 THR A 725 21.779 -3.739 -5.898 1.00 38.71 C ANISOU 2220 CG2 THR A 725 5294 5046 4368 257 -143 -406 C ATOM 0 H THR A 725 20.174 -6.772 -5.972 1.00 30.83 H new ATOM 0 HA THR A 725 21.885 -5.817 -4.088 1.00 28.54 H new ATOM 0 HB THR A 725 20.881 -3.735 -4.084 1.00 40.02 H new ATOM 0 HG1 THR A 725 19.317 -3.325 -5.607 1.00 36.23 H new ATOM 0 HG21 THR A 725 21.577 -2.813 -6.105 1.00 38.71 H new ATOM 0 HG22 THR A 725 22.672 -3.799 -5.524 1.00 38.71 H new ATOM 0 HG23 THR A 725 21.733 -4.268 -6.710 1.00 38.71 H new ATOM 2221 N ILE A 726 20.140 -5.799 -2.224 1.00 30.68 N ANISOU 2221 N ILE A 726 4151 3900 3606 210 -224 -339 N ATOM 2222 CA ILE A 726 19.177 -6.089 -1.163 1.00 31.18 C ANISOU 2222 CA ILE A 726 4179 3928 3738 186 -247 -296 C ATOM 2223 C ILE A 726 17.774 -5.468 -1.473 1.00 34.72 C ANISOU 2223 C ILE A 726 4623 4370 4198 144 -293 -287 C ATOM 2224 O ILE A 726 16.774 -6.164 -1.347 1.00 34.99 O ANISOU 2224 O ILE A 726 4646 4347 4300 123 -329 -284 O ATOM 2225 CB ILE A 726 19.780 -5.625 0.200 1.00 33.75 C ANISOU 2225 CB ILE A 726 4461 4291 4070 198 -208 -243 C ATOM 2226 CG1 ILE A 726 20.897 -6.619 0.670 1.00 34.00 C ANISOU 2226 CG1 ILE A 726 4488 4307 4122 241 -182 -244 C ATOM 2227 CG2 ILE A 726 18.723 -5.497 1.255 1.00 33.08 C ANISOU 2227 CG2 ILE A 726 4346 4194 4029 176 -215 -191 C ATOM 2228 CD1 ILE A 726 21.835 -6.109 1.777 1.00 30.24 C ANISOU 2228 CD1 ILE A 726 3976 3880 3633 265 -156 -208 C ATOM 0 H ILE A 726 20.827 -5.355 -1.959 1.00 30.68 H new ATOM 0 HA ILE A 726 19.018 -7.044 -1.109 1.00 31.18 H new ATOM 0 HB ILE A 726 20.173 -4.748 0.065 1.00 33.75 H new ATOM 0 HG12 ILE A 726 20.470 -7.432 0.982 1.00 34.00 H new ATOM 0 HG13 ILE A 726 21.436 -6.859 -0.100 1.00 34.00 H new ATOM 0 HG21 ILE A 726 19.129 -5.208 2.087 1.00 33.08 H new ATOM 0 HG22 ILE A 726 18.063 -4.844 0.974 1.00 33.08 H new ATOM 0 HG23 ILE A 726 18.292 -6.356 1.387 1.00 33.08 H new ATOM 0 HD11 ILE A 726 22.485 -6.796 1.993 1.00 30.24 H new ATOM 0 HD12 ILE A 726 22.297 -5.313 1.469 1.00 30.24 H new ATOM 0 HD13 ILE A 726 21.316 -5.896 2.568 1.00 30.24 H new ATOM 2229 N GLU A 727 17.703 -4.204 -1.922 1.00 31.64 N ANISOU 2229 N GLU A 727 4237 4030 3754 133 -292 -281 N ATOM 2230 CA GLU A 727 16.401 -3.535 -2.161 1.00 32.30 C ANISOU 2230 CA GLU A 727 4309 4107 3856 98 -337 -266 C ATOM 2231 C GLU A 727 15.629 -4.064 -3.371 1.00 37.50 C ANISOU 2231 C GLU A 727 5006 4729 4514 87 -408 -313 C ATOM 2232 O GLU A 727 14.408 -4.056 -3.329 1.00 38.46 O ANISOU 2232 O GLU A 727 5102 4817 4695 57 -458 -301 O ATOM 2233 CB GLU A 727 16.511 -1.984 -2.223 1.00 33.07 C ANISOU 2233 CB GLU A 727 4394 4261 3908 91 -318 -238 C ATOM 2234 CG GLU A 727 17.253 -1.393 -3.420 1.00 38.28 C ANISOU 2234 CG GLU A 727 5101 4961 4485 107 -308 -261 C ATOM 2235 CD GLU A 727 18.769 -1.445 -3.379 1.00 58.40 C ANISOU 2235 CD GLU A 727 7654 7538 6997 139 -245 -270 C ATOM 2236 OE1 GLU A 727 19.327 -2.083 -2.455 1.00 54.58 O ANISOU 2236 OE1 GLU A 727 7144 7044 6549 152 -220 -267 O ATOM 2237 OE2 GLU A 727 19.409 -0.811 -4.250 1.00 41.04 O ANISOU 2237 OE2 GLU A 727 5482 5373 4738 152 -217 -274 O ATOM 0 H GLU A 727 18.390 -3.716 -2.094 1.00 31.64 H new ATOM 0 HA GLU A 727 15.881 -3.769 -1.376 1.00 32.30 H new ATOM 0 HB2 GLU A 727 15.613 -1.617 -2.213 1.00 33.07 H new ATOM 0 HB3 GLU A 727 16.951 -1.680 -1.414 1.00 33.07 H new ATOM 0 HG2 GLU A 727 16.956 -1.857 -4.219 1.00 38.28 H new ATOM 0 HG3 GLU A 727 16.985 -0.466 -3.514 1.00 38.28 H new ATOM 2238 N GLU A 728 16.311 -4.538 -4.415 1.00 35.21 N ANISOU 2238 N GLU A 728 4775 4442 4160 113 -414 -368 N ATOM 2239 CA GLU A 728 15.621 -5.052 -5.611 1.00 36.41 C ANISOU 2239 CA GLU A 728 4977 4562 4296 109 -493 -427 C ATOM 2240 C GLU A 728 15.359 -6.547 -5.571 1.00 40.77 C ANISOU 2240 C GLU A 728 5533 5035 4922 108 -529 -474 C ATOM 2241 O GLU A 728 14.238 -6.991 -5.852 1.00 40.40 O ANISOU 2241 O GLU A 728 5477 4934 4939 81 -609 -498 O ATOM 2242 CB GLU A 728 16.394 -4.701 -6.890 1.00 37.98 C ANISOU 2242 CB GLU A 728 5252 4810 4370 144 -482 -467 C ATOM 0 H GLU A 728 17.169 -4.573 -4.455 1.00 35.21 H new ATOM 0 HA GLU A 728 14.757 -4.612 -5.616 1.00 36.41 H new ATOM 2243 N ASN A 729 16.402 -7.324 -5.232 1.00 35.05 N ANISOU 2243 N ASN A 729 4815 4299 4202 139 -473 -487 N ATOM 2244 CA ASN A 729 16.353 -8.775 -5.220 1.00 33.97 C ANISOU 2244 CA ASN A 729 4687 4082 4139 146 -496 -533 C ATOM 2245 C ASN A 729 15.940 -9.359 -3.885 1.00 37.89 C ANISOU 2245 C ASN A 729 5115 4524 4758 125 -479 -473 C ATOM 2246 O ASN A 729 15.693 -10.554 -3.813 1.00 39.37 O ANISOU 2246 O ASN A 729 5298 4630 5033 123 -502 -498 O ATOM 2247 CB ASN A 729 17.696 -9.348 -5.709 1.00 32.52 C ANISOU 2247 CB ASN A 729 4553 3909 3896 198 -446 -583 C ATOM 2248 CG ASN A 729 18.040 -8.824 -7.080 1.00 47.49 C ANISOU 2248 CG ASN A 729 6524 5857 5664 223 -454 -639 C ATOM 2249 OD1 ASN A 729 18.769 -7.852 -7.234 1.00 36.23 O ANISOU 2249 OD1 ASN A 729 5106 4504 4156 240 -395 -609 O ATOM 2250 ND2 ASN A 729 17.341 -9.304 -8.076 1.00 47.08 N ANISOU 2250 ND2 ASN A 729 6525 5769 5595 221 -535 -713 N ATOM 0 H ASN A 729 17.166 -7.005 -5.000 1.00 35.05 H new ATOM 0 HA ASN A 729 15.652 -9.042 -5.835 1.00 33.97 H new ATOM 0 HB2 ASN A 729 18.399 -9.113 -5.083 1.00 32.52 H new ATOM 0 HB3 ASN A 729 17.649 -10.317 -5.732 1.00 32.52 H new ATOM 0 HD21 ASN A 729 17.390 -8.936 -8.852 1.00 47.08 H new ATOM 0 HD22 ASN A 729 16.833 -9.987 -7.955 1.00 47.08 H new ATOM 2251 N GLY A 730 15.854 -8.525 -2.854 1.00 33.81 N ANISOU 2251 N GLY A 730 4550 4050 4248 113 -435 -394 N ATOM 2252 CA GLY A 730 15.425 -8.943 -1.527 1.00 33.44 C ANISOU 2252 CA GLY A 730 4444 3965 4296 100 -407 -324 C ATOM 2253 C GLY A 730 14.041 -8.442 -1.156 1.00 38.37 C ANISOU 2253 C GLY A 730 5020 4574 4985 57 -433 -281 C ATOM 2254 O GLY A 730 13.771 -8.205 0.015 1.00 37.34 O ANISOU 2254 O GLY A 730 4845 4452 4890 52 -386 -208 O ATOM 0 H GLY A 730 16.046 -7.689 -2.908 1.00 33.81 H new ATOM 0 HA2 GLY A 730 15.434 -9.912 -1.482 1.00 33.44 H new ATOM 0 HA3 GLY A 730 16.064 -8.622 -0.872 1.00 33.44 H new ATOM 2255 N GLN A 731 13.140 -8.291 -2.138 1.00 37.85 N ANISOU 2255 N GLN A 731 4961 4485 4933 29 -509 -324 N ATOM 2256 CA GLN A 731 11.753 -7.828 -1.912 1.00 38.31 C ANISOU 2256 CA GLN A 731 4964 4521 5071 -12 -543 -287 C ATOM 2257 C GLN A 731 10.951 -8.861 -1.116 1.00 44.62 C ANISOU 2257 C GLN A 731 5704 5230 6021 -35 -536 -247 C ATOM 2258 O GLN A 731 11.079 -10.057 -1.352 1.00 43.80 O ANISOU 2258 O GLN A 731 5611 5055 5977 -33 -558 -282 O ATOM 2259 CB GLN A 731 11.062 -7.524 -3.253 1.00 39.86 C ANISOU 2259 CB GLN A 731 5185 4712 5248 -30 -643 -350 C ATOM 2260 CG GLN A 731 11.516 -6.187 -3.853 1.00 49.38 C ANISOU 2260 CG GLN A 731 6432 6010 6321 -13 -638 -353 C ATOM 2261 CD GLN A 731 10.889 -5.893 -5.202 1.00 67.45 C ANISOU 2261 CD GLN A 731 8757 8300 8572 -20 -739 -407 C ATOM 2262 OE1 GLN A 731 9.674 -5.682 -5.319 1.00 64.11 O ANISOU 2262 OE1 GLN A 731 8288 7844 8227 -52 -806 -396 O ATOM 2263 NE2 GLN A 731 11.714 -5.815 -6.251 1.00 51.50 N ANISOU 2263 NE2 GLN A 731 6820 6322 6426 13 -750 -462 N ATOM 0 H GLN A 731 13.316 -8.456 -2.964 1.00 37.85 H new ATOM 0 HA GLN A 731 11.790 -7.011 -1.391 1.00 38.31 H new ATOM 0 HB2 GLN A 731 11.251 -8.239 -3.881 1.00 39.86 H new ATOM 0 HB3 GLN A 731 10.101 -7.508 -3.123 1.00 39.86 H new ATOM 0 HG2 GLN A 731 11.294 -5.471 -3.237 1.00 49.38 H new ATOM 0 HG3 GLN A 731 12.482 -6.192 -3.946 1.00 49.38 H new ATOM 0 HE21 GLN A 731 12.555 -5.965 -6.149 1.00 51.50 H new ATOM 0 HE22 GLN A 731 11.404 -5.615 -7.028 1.00 51.50 H new ATOM 2264 N GLY A 732 10.169 -8.401 -0.145 1.00 42.82 N ANISOU 2264 N GLY A 732 5412 5002 5855 -54 -494 -169 N ATOM 2265 CA GLY A 732 9.394 -9.304 0.705 1.00 42.54 C ANISOU 2265 CA GLY A 732 5315 4884 5966 -74 -465 -111 C ATOM 2266 C GLY A 732 10.250 -10.058 1.711 1.00 46.41 C ANISOU 2266 C GLY A 732 5817 5366 6451 -40 -385 -62 C ATOM 2267 O GLY A 732 9.762 -10.969 2.391 1.00 49.34 O ANISOU 2267 O GLY A 732 6146 5662 6941 -50 -353 -6 O ATOM 0 H GLY A 732 10.072 -7.567 0.040 1.00 42.82 H new ATOM 0 HA2 GLY A 732 8.720 -8.793 1.180 1.00 42.54 H new ATOM 0 HA3 GLY A 732 8.924 -9.942 0.146 1.00 42.54 H new ATOM 2268 N MET A 733 11.535 -9.665 1.850 1.00 36.62 N ANISOU 2268 N MET A 733 4630 4204 5081 1 -350 -73 N ATOM 2269 CA MET A 733 12.448 -10.310 2.789 1.00 33.87 C ANISOU 2269 CA MET A 733 4296 3857 4717 40 -286 -28 C ATOM 2270 C MET A 733 12.865 -9.281 3.795 1.00 36.08 C ANISOU 2270 C MET A 733 4577 4229 4905 66 -224 26 C ATOM 2271 O MET A 733 12.840 -8.108 3.476 1.00 35.01 O ANISOU 2271 O MET A 733 4446 4156 4698 59 -236 2 O ATOM 2272 CB MET A 733 13.692 -10.853 2.056 1.00 34.99 C ANISOU 2272 CB MET A 733 4493 4003 4800 71 -309 -97 C ATOM 2273 CG MET A 733 13.353 -11.876 1.018 1.00 39.55 C ANISOU 2273 CG MET A 733 5082 4490 5456 53 -375 -169 C ATOM 2274 SD MET A 733 14.803 -12.516 0.197 1.00 43.94 S ANISOU 2274 SD MET A 733 5704 5049 5943 99 -384 -252 S ATOM 2275 CE MET A 733 14.049 -13.766 -0.786 1.00 41.75 C ANISOU 2275 CE MET A 733 5432 4646 5786 72 -464 -331 C ATOM 0 H MET A 733 11.888 -9.022 1.402 1.00 36.62 H new ATOM 0 HA MET A 733 12.005 -11.058 3.220 1.00 33.87 H new ATOM 0 HB2 MET A 733 14.162 -10.116 1.636 1.00 34.99 H new ATOM 0 HB3 MET A 733 14.299 -11.244 2.704 1.00 34.99 H new ATOM 0 HG2 MET A 733 12.870 -12.607 1.434 1.00 39.55 H new ATOM 0 HG3 MET A 733 12.759 -11.482 0.360 1.00 39.55 H new ATOM 0 HE1 MET A 733 14.704 -14.135 -1.399 1.00 41.75 H new ATOM 0 HE2 MET A 733 13.712 -14.471 -0.211 1.00 41.75 H new ATOM 0 HE3 MET A 733 13.314 -13.382 -1.290 1.00 41.75 H new ATOM 2276 N LEU A 734 13.320 -9.711 4.984 1.00 32.57 N ANISOU 2276 N LEU A 734 4131 3791 4453 100 -163 95 N ATOM 2277 CA LEU A 734 13.856 -8.793 5.984 1.00 31.09 C ANISOU 2277 CA LEU A 734 3955 3693 4165 132 -114 132 C ATOM 2278 C LEU A 734 15.164 -8.230 5.396 1.00 32.95 C ANISOU 2278 C LEU A 734 4229 3994 4298 155 -142 65 C ATOM 2279 O LEU A 734 16.079 -8.978 5.105 1.00 31.77 O ANISOU 2279 O LEU A 734 4101 3827 4143 179 -153 40 O ATOM 2280 CB LEU A 734 14.132 -9.536 7.284 1.00 31.09 C ANISOU 2280 CB LEU A 734 3957 3683 4171 172 -56 217 C ATOM 2281 CG LEU A 734 14.800 -8.719 8.381 1.00 34.07 C ANISOU 2281 CG LEU A 734 4356 4154 4434 215 -19 248 C ATOM 2282 CD1 LEU A 734 13.990 -7.409 8.701 1.00 32.48 C ANISOU 2282 CD1 LEU A 734 4137 4003 4200 198 3 251 C ATOM 2283 CD2 LEU A 734 15.099 -9.590 9.604 1.00 31.09 C ANISOU 2283 CD2 LEU A 734 3992 3767 4054 262 30 336 C ATOM 0 H LEU A 734 13.324 -10.537 5.224 1.00 32.57 H new ATOM 0 HA LEU A 734 13.228 -8.081 6.186 1.00 31.09 H new ATOM 0 HB2 LEU A 734 13.292 -9.880 7.626 1.00 31.09 H new ATOM 0 HB3 LEU A 734 14.693 -10.302 7.087 1.00 31.09 H new ATOM 0 HG LEU A 734 15.662 -8.409 8.061 1.00 34.07 H new ATOM 0 HD11 LEU A 734 14.441 -6.913 9.402 1.00 32.48 H new ATOM 0 HD12 LEU A 734 13.933 -6.861 7.903 1.00 32.48 H new ATOM 0 HD13 LEU A 734 13.096 -7.645 8.996 1.00 32.48 H new ATOM 0 HD21 LEU A 734 15.524 -9.051 10.289 1.00 31.09 H new ATOM 0 HD22 LEU A 734 14.271 -9.958 9.950 1.00 31.09 H new ATOM 0 HD23 LEU A 734 15.692 -10.314 9.349 1.00 31.09 H new ATOM 2284 N GLN A 735 15.209 -6.937 5.151 1.00 28.30 N ANISOU 2284 N GLN A 735 3641 3470 3642 146 -150 37 N ATOM 2285 CA GLN A 735 16.375 -6.333 4.511 1.00 26.39 C ANISOU 2285 CA GLN A 735 3425 3282 3320 161 -168 -21 C ATOM 2286 C GLN A 735 17.288 -5.705 5.521 1.00 29.83 C ANISOU 2286 C GLN A 735 3863 3786 3686 196 -140 0 C ATOM 2287 O GLN A 735 16.849 -4.913 6.354 1.00 28.54 O ANISOU 2287 O GLN A 735 3687 3658 3499 197 -117 29 O ATOM 2288 CB GLN A 735 15.922 -5.338 3.459 1.00 26.73 C ANISOU 2288 CB GLN A 735 3470 3344 3343 129 -200 -64 C ATOM 2289 CG GLN A 735 15.228 -5.995 2.260 1.00 30.63 C ANISOU 2289 CG GLN A 735 3973 3777 3889 101 -251 -104 C ATOM 2290 CD GLN A 735 14.508 -4.962 1.453 1.00 42.22 C ANISOU 2290 CD GLN A 735 5436 5263 5341 71 -286 -125 C ATOM 2291 OE1 GLN A 735 14.617 -3.768 1.712 1.00 36.77 O ANISOU 2291 OE1 GLN A 735 4738 4627 4606 72 -267 -112 O ATOM 2292 NE2 GLN A 735 13.710 -5.395 0.500 1.00 29.77 N ANISOU 2292 NE2 GLN A 735 3864 3636 3809 46 -344 -157 N ATOM 0 H GLN A 735 14.579 -6.385 5.345 1.00 28.30 H new ATOM 0 HA GLN A 735 16.888 -7.029 4.071 1.00 26.39 H new ATOM 0 HB2 GLN A 735 15.315 -4.700 3.866 1.00 26.73 H new ATOM 0 HB3 GLN A 735 16.691 -4.837 3.145 1.00 26.73 H new ATOM 0 HG2 GLN A 735 15.883 -6.449 1.707 1.00 30.63 H new ATOM 0 HG3 GLN A 735 14.602 -6.669 2.569 1.00 30.63 H new ATOM 0 HE21 GLN A 735 13.651 -6.238 0.338 1.00 29.77 H new ATOM 0 HE22 GLN A 735 13.247 -4.835 0.039 1.00 29.77 H new ATOM 2293 N VAL A 736 18.567 -6.046 5.445 1.00 27.41 N ANISOU 2293 N VAL A 736 3570 3496 3349 228 -143 -22 N ATOM 2294 CA VAL A 736 19.527 -5.547 6.409 1.00 27.30 C ANISOU 2294 CA VAL A 736 3552 3541 3278 265 -132 -9 C ATOM 2295 C VAL A 736 20.120 -4.214 5.988 1.00 30.62 C ANISOU 2295 C VAL A 736 3964 4018 3652 255 -142 -55 C ATOM 2296 O VAL A 736 20.551 -4.047 4.852 1.00 28.21 O ANISOU 2296 O VAL A 736 3662 3710 3346 243 -151 -98 O ATOM 2297 CB VAL A 736 20.606 -6.608 6.741 1.00 31.26 C ANISOU 2297 CB VAL A 736 4059 4029 3789 309 -134 3 C ATOM 2298 CG1 VAL A 736 21.728 -6.034 7.604 1.00 30.51 C ANISOU 2298 CG1 VAL A 736 3956 3999 3639 348 -143 4 C ATOM 2299 CG2 VAL A 736 19.972 -7.808 7.428 1.00 31.86 C ANISOU 2299 CG2 VAL A 736 4142 4050 3915 322 -117 67 C ATOM 0 H VAL A 736 18.896 -6.564 4.843 1.00 27.41 H new ATOM 0 HA VAL A 736 19.046 -5.376 7.234 1.00 27.30 H new ATOM 0 HB VAL A 736 21.002 -6.892 5.902 1.00 31.26 H new ATOM 0 HG11 VAL A 736 22.381 -6.727 7.789 1.00 30.51 H new ATOM 0 HG12 VAL A 736 22.158 -5.303 7.132 1.00 30.51 H new ATOM 0 HG13 VAL A 736 21.359 -5.707 8.439 1.00 30.51 H new ATOM 0 HG21 VAL A 736 20.657 -8.464 7.630 1.00 31.86 H new ATOM 0 HG22 VAL A 736 19.545 -7.522 8.251 1.00 31.86 H new ATOM 0 HG23 VAL A 736 19.309 -8.204 6.841 1.00 31.86 H new ATOM 2300 N ASP A 737 20.166 -3.290 6.955 1.00 29.03 N ANISOU 2300 N ASP A 737 3754 3866 3411 265 -137 -43 N ATOM 2301 CA ASP A 737 20.802 -1.976 6.886 1.00 28.23 C ANISOU 2301 CA ASP A 737 3636 3812 3277 260 -148 -81 C ATOM 2302 C ASP A 737 22.087 -2.114 7.719 1.00 32.28 C ANISOU 2302 C ASP A 737 4140 4359 3765 303 -164 -85 C ATOM 2303 O ASP A 737 21.998 -2.429 8.897 1.00 31.37 O ANISOU 2303 O ASP A 737 4037 4260 3622 334 -166 -52 O ATOM 2304 CB ASP A 737 19.867 -0.897 7.480 1.00 29.20 C ANISOU 2304 CB ASP A 737 3754 3955 3384 243 -138 -74 C ATOM 2305 CG ASP A 737 20.569 0.408 7.779 1.00 47.34 C ANISOU 2305 CG ASP A 737 6034 6297 5656 246 -151 -111 C ATOM 2306 OD1 ASP A 737 21.412 0.817 6.968 1.00 53.15 O ANISOU 2306 OD1 ASP A 737 6753 7037 6404 235 -162 -144 O ATOM 2307 OD2 ASP A 737 20.277 1.018 8.840 1.00 46.92 O ANISOU 2307 OD2 ASP A 737 5984 6271 5573 261 -149 -110 O ATOM 0 H ASP A 737 19.799 -3.428 7.721 1.00 29.03 H new ATOM 0 HA ASP A 737 20.993 -1.703 5.975 1.00 28.23 H new ATOM 0 HB2 ASP A 737 19.141 -0.731 6.859 1.00 29.20 H new ATOM 0 HB3 ASP A 737 19.470 -1.237 8.297 1.00 29.20 H new ATOM 2308 N PHE A 738 23.282 -1.940 7.097 1.00 29.77 N ANISOU 2308 N PHE A 738 3800 4051 3459 309 -175 -121 N ATOM 2309 CA PHE A 738 24.577 -2.061 7.777 1.00 28.82 C ANISOU 2309 CA PHE A 738 3657 3958 3334 348 -200 -130 C ATOM 2310 C PHE A 738 24.803 -0.716 8.428 1.00 30.98 C ANISOU 2310 C PHE A 738 3911 4275 3586 343 -224 -157 C ATOM 2311 O PHE A 738 25.455 0.186 7.892 1.00 27.59 O ANISOU 2311 O PHE A 738 3445 3854 3182 325 -228 -194 O ATOM 2312 CB PHE A 738 25.714 -2.450 6.808 1.00 30.09 C ANISOU 2312 CB PHE A 738 3793 4105 3537 356 -193 -155 C ATOM 2313 CG PHE A 738 25.429 -3.552 5.799 1.00 31.73 C ANISOU 2313 CG PHE A 738 4025 4263 3767 354 -166 -152 C ATOM 2314 CD1 PHE A 738 24.782 -4.724 6.182 1.00 34.05 C ANISOU 2314 CD1 PHE A 738 4347 4519 4070 368 -166 -116 C ATOM 2315 CD2 PHE A 738 25.926 -3.475 4.505 1.00 33.69 C ANISOU 2315 CD2 PHE A 738 4268 4499 4033 343 -140 -186 C ATOM 2316 CE1 PHE A 738 24.563 -5.767 5.261 1.00 34.10 C ANISOU 2316 CE1 PHE A 738 4375 4471 4110 366 -151 -125 C ATOM 2317 CE2 PHE A 738 25.648 -4.487 3.569 1.00 36.74 C ANISOU 2317 CE2 PHE A 738 4687 4841 4432 346 -121 -196 C ATOM 2318 CZ PHE A 738 24.970 -5.627 3.958 1.00 33.95 C ANISOU 2318 CZ PHE A 738 4359 4445 4096 355 -132 -172 C ATOM 0 H PHE A 738 23.351 -1.747 6.262 1.00 29.77 H new ATOM 0 HA PHE A 738 24.573 -2.776 8.432 1.00 28.82 H new ATOM 0 HB2 PHE A 738 25.975 -1.655 6.317 1.00 30.09 H new ATOM 0 HB3 PHE A 738 26.480 -2.720 7.338 1.00 30.09 H new ATOM 0 HD1 PHE A 738 24.490 -4.820 7.060 1.00 34.05 H new ATOM 0 HD2 PHE A 738 26.448 -2.747 4.255 1.00 33.69 H new ATOM 0 HE1 PHE A 738 24.143 -6.550 5.536 1.00 34.10 H new ATOM 0 HE2 PHE A 738 25.921 -4.389 2.685 1.00 36.74 H new ATOM 0 HZ PHE A 738 24.790 -6.297 3.339 1.00 33.95 H new ATOM 2319 N ALA A 739 24.145 -0.565 9.541 1.00 29.58 N ANISOU 2319 N ALA A 739 3757 4118 3363 358 -231 -138 N ATOM 2320 CA ALA A 739 24.010 0.679 10.273 1.00 30.13 C ANISOU 2320 CA ALA A 739 3822 4222 3402 356 -250 -168 C ATOM 2321 C ALA A 739 25.195 1.090 11.132 1.00 35.20 C ANISOU 2321 C ALA A 739 4442 4902 4028 389 -308 -204 C ATOM 2322 O ALA A 739 26.099 0.301 11.398 1.00 34.28 O ANISOU 2322 O ALA A 739 4315 4792 3916 425 -337 -194 O ATOM 2323 CB ALA A 739 22.759 0.600 11.131 1.00 30.41 C ANISOU 2323 CB ALA A 739 3899 4265 3390 366 -225 -133 C ATOM 0 H ALA A 739 23.736 -1.219 9.922 1.00 29.58 H new ATOM 0 HA ALA A 739 23.957 1.372 9.596 1.00 30.13 H new ATOM 0 HB1 ALA A 739 22.655 1.426 11.628 1.00 30.41 H new ATOM 0 HB2 ALA A 739 21.985 0.465 10.563 1.00 30.41 H new ATOM 0 HB3 ALA A 739 22.838 -0.142 11.751 1.00 30.41 H new ATOM 2324 N ASN A 740 25.159 2.347 11.569 1.00 33.80 N ANISOU 2324 N ASN A 740 4255 4747 3841 379 -330 -251 N ATOM 2325 CA ASN A 740 26.044 2.906 12.580 1.00 34.40 C ANISOU 2325 CA ASN A 740 4316 4859 3894 411 -398 -298 C ATOM 2326 C ASN A 740 25.185 2.844 13.863 1.00 38.78 C ANISOU 2326 C ASN A 740 4936 5448 4350 451 -397 -282 C ATOM 2327 O ASN A 740 23.954 2.845 13.752 1.00 39.41 O ANISOU 2327 O ASN A 740 5046 5515 4412 435 -337 -250 O ATOM 2328 CB ASN A 740 26.387 4.383 12.286 1.00 34.48 C ANISOU 2328 CB ASN A 740 4280 4861 3958 375 -419 -365 C ATOM 2329 CG ASN A 740 27.465 4.900 13.242 1.00 66.45 C ANISOU 2329 CG ASN A 740 8303 8940 8006 405 -506 -425 C ATOM 2330 OD1 ASN A 740 27.172 5.589 14.244 1.00 55.99 O ANISOU 2330 OD1 ASN A 740 7007 7641 6626 425 -542 -469 O ATOM 2331 ND2 ASN A 740 28.728 4.457 13.041 1.00 55.11 N ANISOU 2331 ND2 ASN A 740 6814 7501 6623 417 -547 -430 N ATOM 0 H ASN A 740 24.592 2.920 11.269 1.00 33.80 H new ATOM 0 HA ASN A 740 26.888 2.430 12.629 1.00 34.40 H new ATOM 0 HB2 ASN A 740 26.694 4.471 11.370 1.00 34.48 H new ATOM 0 HB3 ASN A 740 25.588 4.927 12.371 1.00 34.48 H new ATOM 0 HD21 ASN A 740 29.346 4.648 13.608 1.00 55.11 H new ATOM 0 HD22 ASN A 740 28.912 3.984 12.347 1.00 55.11 H new ATOM 2332 N ARG A 741 25.799 2.826 15.056 1.00 34.12 N ANISOU 2332 N ARG A 741 4365 4902 3695 504 -461 -303 N ATOM 2333 CA ARG A 741 25.057 2.851 16.325 1.00 33.83 C ANISOU 2333 CA ARG A 741 4399 4907 3546 551 -456 -291 C ATOM 2334 C ARG A 741 24.043 4.064 16.368 1.00 34.84 C ANISOU 2334 C ARG A 741 4540 5030 3668 524 -416 -333 C ATOM 2335 O ARG A 741 22.933 3.936 16.904 1.00 34.14 O ANISOU 2335 O ARG A 741 4503 4953 3517 543 -357 -296 O ATOM 2336 CB ARG A 741 26.005 2.799 17.532 1.00 34.69 C ANISOU 2336 CB ARG A 741 4531 5070 3581 616 -548 -323 C ATOM 2337 CG ARG A 741 27.126 3.843 17.516 1.00 39.85 C ANISOU 2337 CG ARG A 741 5126 5728 4289 602 -640 -421 C ATOM 2338 CD ARG A 741 28.278 3.451 18.433 1.00 45.08 C ANISOU 2338 CD ARG A 741 5789 6432 4907 664 -748 -440 C ATOM 2339 NE ARG A 741 27.917 3.594 19.838 1.00 58.20 N ANISOU 2339 NE ARG A 741 7536 8154 6423 730 -784 -456 N ATOM 2340 CZ ARG A 741 28.278 4.614 20.610 1.00 69.73 C ANISOU 2340 CZ ARG A 741 9007 9645 7843 751 -868 -554 C ATOM 2341 NH1 ARG A 741 29.058 5.579 20.130 1.00 54.91 N ANISOU 2341 NH1 ARG A 741 7047 7736 6079 705 -931 -642 N ATOM 2342 NH2 ARG A 741 27.863 4.680 21.865 1.00 51.42 N ANISOU 2342 NH2 ARG A 741 6781 7385 5371 818 -889 -566 N ATOM 0 H ARG A 741 26.653 2.799 15.150 1.00 34.12 H new ATOM 0 HA ARG A 741 24.517 2.047 16.381 1.00 33.83 H new ATOM 0 HB2 ARG A 741 25.484 2.916 18.342 1.00 34.69 H new ATOM 0 HB3 ARG A 741 26.404 1.916 17.576 1.00 34.69 H new ATOM 0 HG2 ARG A 741 27.456 3.950 16.610 1.00 39.85 H new ATOM 0 HG3 ARG A 741 26.771 4.703 17.792 1.00 39.85 H new ATOM 0 HD2 ARG A 741 28.535 2.533 18.256 1.00 45.08 H new ATOM 0 HD3 ARG A 741 29.050 4.005 18.238 1.00 45.08 H new ATOM 0 HE ARG A 741 27.437 2.975 20.192 1.00 58.20 H new ATOM 0 HH11 ARG A 741 29.332 5.545 19.315 1.00 54.91 H new ATOM 0 HH12 ARG A 741 29.288 6.236 20.634 1.00 54.91 H new ATOM 0 HH21 ARG A 741 27.358 4.061 22.184 1.00 51.42 H new ATOM 0 HH22 ARG A 741 28.099 5.341 22.362 1.00 51.42 H new ATOM 2343 N PHE A 742 24.425 5.189 15.750 1.00 28.16 N ANISOU 2343 N PHE A 742 3640 4160 2898 479 -441 -401 N ATOM 2344 CA PHE A 742 23.560 6.351 15.513 1.00 28.49 C ANISOU 2344 CA PHE A 742 3678 4180 2968 445 -403 -437 C ATOM 2345 C PHE A 742 22.934 6.044 14.121 1.00 33.75 C ANISOU 2345 C PHE A 742 4315 4796 3711 390 -336 -380 C ATOM 2346 O PHE A 742 23.639 6.117 13.119 1.00 33.63 O ANISOU 2346 O PHE A 742 4251 4755 3773 354 -348 -386 O ATOM 2347 CB PHE A 742 24.382 7.646 15.445 1.00 29.60 C ANISOU 2347 CB PHE A 742 3768 4307 3170 423 -466 -529 C ATOM 2348 CG PHE A 742 24.938 8.078 16.784 1.00 31.30 C ANISOU 2348 CG PHE A 742 4013 4566 3313 475 -547 -603 C ATOM 2349 CD1 PHE A 742 24.188 8.876 17.644 1.00 33.57 C ANISOU 2349 CD1 PHE A 742 4349 4870 3535 501 -539 -654 C ATOM 2350 CD2 PHE A 742 26.219 7.707 17.175 1.00 32.35 C ANISOU 2350 CD2 PHE A 742 4124 4724 3445 502 -637 -629 C ATOM 2351 CE1 PHE A 742 24.706 9.288 18.863 1.00 35.73 C ANISOU 2351 CE1 PHE A 742 4659 5186 3730 554 -621 -734 C ATOM 2352 CE2 PHE A 742 26.734 8.116 18.402 1.00 36.44 C ANISOU 2352 CE2 PHE A 742 4671 5283 3891 553 -729 -705 C ATOM 2353 CZ PHE A 742 25.969 8.890 19.245 1.00 35.31 C ANISOU 2353 CZ PHE A 742 4588 5160 3668 580 -722 -760 C ATOM 0 H PHE A 742 25.223 5.299 15.447 1.00 28.16 H new ATOM 0 HA PHE A 742 22.906 6.483 16.217 1.00 28.49 H new ATOM 0 HB2 PHE A 742 25.116 7.523 14.823 1.00 29.60 H new ATOM 0 HB3 PHE A 742 23.825 8.356 15.090 1.00 29.60 H new ATOM 0 HD1 PHE A 742 23.330 9.136 17.398 1.00 33.57 H new ATOM 0 HD2 PHE A 742 26.738 7.180 16.611 1.00 32.35 H new ATOM 0 HE1 PHE A 742 24.201 9.833 19.423 1.00 35.73 H new ATOM 0 HE2 PHE A 742 27.594 7.866 18.652 1.00 36.44 H new ATOM 0 HZ PHE A 742 26.305 9.145 20.074 1.00 35.31 H new ATOM 2354 N VAL A 743 21.674 5.569 14.089 1.00 30.72 N ANISOU 2354 N VAL A 743 3964 4403 3304 389 -268 -323 N ATOM 2355 CA VAL A 743 20.962 5.137 12.871 1.00 30.19 C ANISOU 2355 CA VAL A 743 3879 4293 3301 344 -218 -271 C ATOM 2356 C VAL A 743 21.026 6.182 11.769 1.00 30.89 C ANISOU 2356 C VAL A 743 3921 4346 3468 292 -220 -303 C ATOM 2357 O VAL A 743 20.896 7.359 12.058 1.00 28.23 O ANISOU 2357 O VAL A 743 3574 4007 3144 286 -228 -351 O ATOM 2358 CB VAL A 743 19.494 4.664 13.123 1.00 33.81 C ANISOU 2358 CB VAL A 743 4366 4739 3740 349 -151 -212 C ATOM 2359 CG1 VAL A 743 19.473 3.414 13.997 1.00 34.64 C ANISOU 2359 CG1 VAL A 743 4512 4867 3781 396 -136 -156 C ATOM 2360 CG2 VAL A 743 18.623 5.779 13.712 1.00 32.64 C ANISOU 2360 CG2 VAL A 743 4227 4597 3578 355 -123 -243 C ATOM 0 H VAL A 743 21.197 5.488 14.800 1.00 30.72 H new ATOM 0 HA VAL A 743 21.443 4.351 12.567 1.00 30.19 H new ATOM 0 HB VAL A 743 19.108 4.436 12.263 1.00 33.81 H new ATOM 0 HG11 VAL A 743 18.555 3.136 14.142 1.00 34.64 H new ATOM 0 HG12 VAL A 743 19.960 2.701 13.555 1.00 34.64 H new ATOM 0 HG13 VAL A 743 19.890 3.609 14.851 1.00 34.64 H new ATOM 0 HG21 VAL A 743 17.723 5.446 13.853 1.00 32.64 H new ATOM 0 HG22 VAL A 743 18.997 6.069 14.559 1.00 32.64 H new ATOM 0 HG23 VAL A 743 18.597 6.529 13.097 1.00 32.64 H new ATOM 2361 N GLY A 744 21.337 5.743 10.552 1.00 28.05 N ANISOU 2361 N GLY A 744 3538 3961 3158 261 -214 -279 N ATOM 2362 CA GLY A 744 21.477 6.637 9.409 1.00 28.29 C ANISOU 2362 CA GLY A 744 3532 3962 3256 217 -210 -294 C ATOM 2363 C GLY A 744 22.885 7.109 9.151 1.00 34.60 C ANISOU 2363 C GLY A 744 4289 4762 4095 211 -243 -333 C ATOM 2364 O GLY A 744 23.136 7.694 8.099 1.00 34.07 O ANISOU 2364 O GLY A 744 4192 4669 4085 177 -228 -331 O ATOM 0 H GLY A 744 21.473 4.914 10.367 1.00 28.05 H new ATOM 0 HA2 GLY A 744 21.150 6.183 8.616 1.00 28.29 H new ATOM 0 HA3 GLY A 744 20.909 7.411 9.547 1.00 28.29 H new ATOM 2365 N GLY A 745 23.789 6.874 10.113 1.00 33.36 N ANISOU 2365 N GLY A 745 4129 4635 3914 245 -288 -363 N ATOM 2366 CA GLY A 745 25.201 7.248 10.005 1.00 34.70 C ANISOU 2366 CA GLY A 745 4244 4802 4137 242 -328 -402 C ATOM 2367 C GLY A 745 25.379 8.696 9.607 1.00 39.62 C ANISOU 2367 C GLY A 745 4822 5396 4837 205 -330 -440 C ATOM 2368 O GLY A 745 24.813 9.579 10.262 1.00 41.36 O ANISOU 2368 O GLY A 745 5053 5612 5049 206 -343 -477 O ATOM 0 H GLY A 745 23.592 6.487 10.856 1.00 33.36 H new ATOM 0 HA2 GLY A 745 25.641 7.091 10.855 1.00 34.70 H new ATOM 0 HA3 GLY A 745 25.636 6.679 9.351 1.00 34.70 H new ATOM 2369 N GLY A 746 26.080 8.933 8.498 1.00 33.54 N ANISOU 2369 N GLY A 746 4005 4598 4142 175 -306 -425 N ATOM 2370 CA GLY A 746 26.323 10.292 8.009 1.00 32.96 C ANISOU 2370 CA GLY A 746 3881 4485 4157 138 -298 -446 C ATOM 2371 C GLY A 746 25.386 10.761 6.914 1.00 35.68 C ANISOU 2371 C GLY A 746 4242 4801 4516 105 -240 -399 C ATOM 2372 O GLY A 746 25.779 11.583 6.088 1.00 35.34 O ANISOU 2372 O GLY A 746 4157 4723 4549 75 -214 -386 O ATOM 0 H GLY A 746 26.426 8.315 8.010 1.00 33.54 H new ATOM 0 HA2 GLY A 746 26.256 10.906 8.757 1.00 32.96 H new ATOM 0 HA3 GLY A 746 27.234 10.344 7.680 1.00 32.96 H new ATOM 2373 N VAL A 747 24.138 10.250 6.886 1.00 31.62 N ANISOU 2373 N VAL A 747 3784 4296 3932 113 -220 -368 N ATOM 2374 CA VAL A 747 23.163 10.614 5.864 1.00 31.65 C ANISOU 2374 CA VAL A 747 3805 4275 3945 87 -180 -323 C ATOM 2375 C VAL A 747 22.938 12.135 5.767 1.00 37.46 C ANISOU 2375 C VAL A 747 4508 4972 4754 62 -177 -337 C ATOM 2376 O VAL A 747 22.923 12.645 4.661 1.00 36.26 O ANISOU 2376 O VAL A 747 4344 4792 4642 37 -145 -297 O ATOM 2377 CB VAL A 747 21.821 9.840 5.950 1.00 33.76 C ANISOU 2377 CB VAL A 747 4125 4555 4149 98 -170 -292 C ATOM 2378 CG1 VAL A 747 21.034 10.171 7.229 1.00 33.56 C ANISOU 2378 CG1 VAL A 747 4113 4537 4100 117 -183 -322 C ATOM 2379 CG2 VAL A 747 20.975 10.076 4.692 1.00 32.37 C ANISOU 2379 CG2 VAL A 747 3960 4353 3985 73 -143 -244 C ATOM 0 H VAL A 747 23.844 9.684 7.463 1.00 31.62 H new ATOM 0 HA VAL A 747 23.574 10.328 5.033 1.00 31.65 H new ATOM 0 HB VAL A 747 22.037 8.895 5.997 1.00 33.76 H new ATOM 0 HG11 VAL A 747 20.206 9.666 7.239 1.00 33.56 H new ATOM 0 HG12 VAL A 747 21.565 9.936 8.006 1.00 33.56 H new ATOM 0 HG13 VAL A 747 20.834 11.120 7.250 1.00 33.56 H new ATOM 0 HG21 VAL A 747 20.142 9.585 4.765 1.00 32.37 H new ATOM 0 HG22 VAL A 747 20.785 11.023 4.603 1.00 32.37 H new ATOM 0 HG23 VAL A 747 21.463 9.770 3.912 1.00 32.37 H new ATOM 2380 N THR A 748 22.796 12.836 6.904 1.00 38.08 N ANISOU 2380 N THR A 748 4578 5045 4845 72 -208 -394 N ATOM 2381 CA THR A 748 22.529 14.295 6.962 1.00 39.44 C ANISOU 2381 CA THR A 748 4720 5170 5096 52 -209 -420 C ATOM 2382 C THR A 748 23.850 15.095 6.902 1.00 42.93 C ANISOU 2382 C THR A 748 5096 5580 5635 32 -229 -455 C ATOM 2383 O THR A 748 23.840 16.308 7.105 1.00 42.09 O ANISOU 2383 O THR A 748 4956 5426 5610 16 -239 -490 O ATOM 2384 CB THR A 748 21.697 14.672 8.222 1.00 47.12 C ANISOU 2384 CB THR A 748 5719 6149 6037 78 -228 -474 C ATOM 2385 OG1 THR A 748 22.389 14.238 9.398 1.00 50.42 O ANISOU 2385 OG1 THR A 748 6147 6606 6405 110 -274 -534 O ATOM 2386 CG2 THR A 748 20.285 14.108 8.213 1.00 46.21 C ANISOU 2386 CG2 THR A 748 5649 6049 5860 92 -195 -431 C ATOM 0 H THR A 748 22.853 12.472 7.681 1.00 38.08 H new ATOM 0 HA THR A 748 21.998 14.532 6.185 1.00 39.44 H new ATOM 0 HB THR A 748 21.603 15.637 8.216 1.00 47.12 H new ATOM 0 HG1 THR A 748 22.040 14.592 10.075 1.00 50.42 H new ATOM 0 HG21 THR A 748 19.823 14.379 9.022 1.00 46.21 H new ATOM 0 HG22 THR A 748 19.806 14.445 7.440 1.00 46.21 H new ATOM 0 HG23 THR A 748 20.323 13.140 8.172 1.00 46.21 H new ATOM 2387 N SER A 749 24.979 14.409 6.671 1.00 39.43 N ANISOU 2387 N SER A 749 4629 5157 5196 34 -235 -448 N ATOM 2388 CA SER A 749 26.292 15.042 6.584 1.00 39.80 C ANISOU 2388 CA SER A 749 4600 5171 5351 15 -251 -475 C ATOM 2389 C SER A 749 27.071 14.545 5.361 1.00 44.84 C ANISOU 2389 C SER A 749 5212 5808 6016 2 -196 -409 C ATOM 2390 O SER A 749 26.616 14.819 4.258 1.00 45.04 O ANISOU 2390 O SER A 749 5251 5815 6048 -16 -138 -344 O ATOM 2391 CB SER A 749 27.072 14.935 7.893 1.00 41.48 C ANISOU 2391 CB SER A 749 4791 5404 5564 38 -330 -561 C ATOM 2392 OG SER A 749 27.180 13.593 8.333 1.00 56.69 O ANISOU 2392 OG SER A 749 6758 7391 7391 75 -348 -554 O ATOM 0 H SER A 749 24.998 13.556 6.560 1.00 39.43 H new ATOM 0 HA SER A 749 26.155 15.993 6.448 1.00 39.80 H new ATOM 0 HB2 SER A 749 27.959 15.308 7.772 1.00 41.48 H new ATOM 0 HB3 SER A 749 26.632 15.465 8.576 1.00 41.48 H new ATOM 0 HG SER A 749 27.614 13.568 9.052 1.00 56.69 H new ATOM 2393 N ALA A 750 28.182 13.791 5.530 1.00 42.48 N ANISOU 2393 N ALA A 750 4881 5533 5725 16 -213 -423 N ATOM 2394 CA ALA A 750 29.045 13.368 4.423 1.00 43.62 C ANISOU 2394 CA ALA A 750 4993 5674 5906 10 -152 -368 C ATOM 2395 C ALA A 750 29.002 11.881 3.985 1.00 48.06 C ANISOU 2395 C ALA A 750 5608 6285 6369 40 -125 -334 C ATOM 2396 O ALA A 750 29.468 11.585 2.879 1.00 49.11 O ANISOU 2396 O ALA A 750 5734 6414 6513 38 -58 -284 O ATOM 2397 CB ALA A 750 30.489 13.741 4.739 1.00 45.67 C ANISOU 2397 CB ALA A 750 5154 5908 6290 0 -177 -404 C ATOM 0 H ALA A 750 28.449 13.514 6.299 1.00 42.48 H new ATOM 0 HA ALA A 750 28.675 13.844 3.663 1.00 43.62 H new ATOM 0 HB1 ALA A 750 31.063 13.462 4.008 1.00 45.67 H new ATOM 0 HB2 ALA A 750 30.557 14.702 4.855 1.00 45.67 H new ATOM 0 HB3 ALA A 750 30.767 13.297 5.555 1.00 45.67 H new ATOM 2398 N GLY A 751 28.495 10.975 4.820 1.00 42.72 N ANISOU 2398 N GLY A 751 4983 5647 5600 70 -171 -359 N ATOM 2399 CA GLY A 751 28.472 9.546 4.485 1.00 40.86 C ANISOU 2399 CA GLY A 751 4793 5445 5288 99 -151 -331 C ATOM 2400 C GLY A 751 27.683 9.197 3.235 1.00 38.73 C ANISOU 2400 C GLY A 751 4580 5174 4963 92 -90 -275 C ATOM 2401 O GLY A 751 26.610 9.756 3.008 1.00 33.86 O ANISOU 2401 O GLY A 751 3996 4545 4323 74 -85 -259 O ATOM 0 H GLY A 751 28.158 11.165 5.588 1.00 42.72 H new ATOM 0 HA2 GLY A 751 29.385 9.239 4.372 1.00 40.86 H new ATOM 0 HA3 GLY A 751 28.099 9.057 5.235 1.00 40.86 H new ATOM 2402 N LEU A 752 28.202 8.270 2.414 1.00 34.09 N ANISOU 2402 N LEU A 752 4003 4596 4355 108 -48 -251 N ATOM 2403 CA LEU A 752 27.495 7.827 1.211 1.00 32.79 C ANISOU 2403 CA LEU A 752 3902 4434 4124 108 -1 -210 C ATOM 2404 C LEU A 752 27.706 6.343 0.914 1.00 36.37 C ANISOU 2404 C LEU A 752 4392 4904 4524 141 10 -211 C ATOM 2405 O LEU A 752 27.822 5.928 -0.255 1.00 35.45 O ANISOU 2405 O LEU A 752 4308 4788 4375 150 62 -189 O ATOM 2406 CB LEU A 752 27.844 8.721 0.004 1.00 33.12 C ANISOU 2406 CB LEU A 752 3926 4456 4202 89 66 -168 C ATOM 2407 CG LEU A 752 26.761 8.888 -1.079 1.00 35.68 C ANISOU 2407 CG LEU A 752 4319 4779 4458 81 90 -125 C ATOM 2408 CD1 LEU A 752 25.348 8.989 -0.500 1.00 33.34 C ANISOU 2408 CD1 LEU A 752 4061 4482 4125 71 32 -135 C ATOM 2409 CD2 LEU A 752 27.039 10.082 -1.938 1.00 37.03 C ANISOU 2409 CD2 LEU A 752 4466 4927 4676 62 145 -77 C ATOM 0 H LEU A 752 28.962 7.888 2.540 1.00 34.09 H new ATOM 0 HA LEU A 752 26.546 7.926 1.385 1.00 32.79 H new ATOM 0 HB2 LEU A 752 28.075 9.602 0.338 1.00 33.12 H new ATOM 0 HB3 LEU A 752 28.639 8.361 -0.418 1.00 33.12 H new ATOM 0 HG LEU A 752 26.798 8.083 -1.620 1.00 35.68 H new ATOM 0 HD11 LEU A 752 24.709 9.092 -1.222 1.00 33.34 H new ATOM 0 HD12 LEU A 752 25.144 8.182 -0.001 1.00 33.34 H new ATOM 0 HD13 LEU A 752 25.294 9.756 0.091 1.00 33.34 H new ATOM 0 HD21 LEU A 752 26.345 10.166 -2.611 1.00 37.03 H new ATOM 0 HD22 LEU A 752 27.053 10.881 -1.388 1.00 37.03 H new ATOM 0 HD23 LEU A 752 27.899 9.975 -2.373 1.00 37.03 H new ATOM 2410 N VAL A 753 27.761 5.526 1.987 1.00 32.04 N ANISOU 2410 N VAL A 753 3844 4368 3963 163 -38 -238 N ATOM 2411 CA VAL A 753 27.928 4.087 1.795 1.00 30.81 C ANISOU 2411 CA VAL A 753 3720 4217 3770 196 -32 -238 C ATOM 2412 C VAL A 753 26.556 3.420 1.983 1.00 31.99 C ANISOU 2412 C VAL A 753 3937 4365 3855 195 -59 -231 C ATOM 2413 O VAL A 753 25.543 4.123 1.929 1.00 30.71 O ANISOU 2413 O VAL A 753 3794 4198 3676 169 -69 -221 O ATOM 2414 CB VAL A 753 29.110 3.454 2.584 1.00 35.68 C ANISOU 2414 CB VAL A 753 4286 4840 4429 228 -54 -258 C ATOM 2415 CG1 VAL A 753 30.431 4.029 2.097 1.00 36.26 C ANISOU 2415 CG1 VAL A 753 4285 4908 4585 227 -14 -260 C ATOM 2416 CG2 VAL A 753 28.978 3.662 4.084 1.00 36.00 C ANISOU 2416 CG2 VAL A 753 4312 4896 4472 235 -126 -278 C ATOM 0 H VAL A 753 27.705 5.784 2.806 1.00 32.04 H new ATOM 0 HA VAL A 753 28.223 3.915 0.887 1.00 30.81 H new ATOM 0 HB VAL A 753 29.087 2.498 2.419 1.00 35.68 H new ATOM 0 HG11 VAL A 753 31.161 3.629 2.594 1.00 36.26 H new ATOM 0 HG12 VAL A 753 30.540 3.836 1.153 1.00 36.26 H new ATOM 0 HG13 VAL A 753 30.436 4.989 2.233 1.00 36.26 H new ATOM 0 HG21 VAL A 753 29.733 3.253 4.535 1.00 36.00 H new ATOM 0 HG22 VAL A 753 28.961 4.612 4.279 1.00 36.00 H new ATOM 0 HG23 VAL A 753 28.155 3.254 4.396 1.00 36.00 H new ATOM 2417 N GLN A 754 26.513 2.095 2.205 1.00 28.88 N ANISOU 2417 N GLN A 754 3569 3966 3438 222 -70 -234 N ATOM 2418 CA GLN A 754 25.292 1.283 2.259 1.00 27.53 C ANISOU 2418 CA GLN A 754 3452 3780 3226 220 -89 -223 C ATOM 2419 C GLN A 754 24.112 1.927 3.007 1.00 30.01 C ANISOU 2419 C GLN A 754 3776 4097 3529 198 -116 -211 C ATOM 2420 O GLN A 754 23.081 2.135 2.401 1.00 28.53 O ANISOU 2420 O GLN A 754 3616 3897 3327 174 -115 -201 O ATOM 2421 CB GLN A 754 25.578 -0.114 2.782 1.00 28.34 C ANISOU 2421 CB GLN A 754 3566 3872 3331 254 -101 -223 C ATOM 2422 CG GLN A 754 24.509 -1.116 2.329 1.00 32.93 C ANISOU 2422 CG GLN A 754 4199 4420 3892 250 -106 -216 C ATOM 2423 CD GLN A 754 23.469 -1.386 3.392 1.00 38.86 C ANISOU 2423 CD GLN A 754 4961 5163 4640 245 -133 -190 C ATOM 2424 OE1 GLN A 754 23.412 -0.724 4.429 1.00 33.36 O ANISOU 2424 OE1 GLN A 754 4245 4492 3939 246 -146 -179 O ATOM 2425 NE2 GLN A 754 22.643 -2.390 3.175 1.00 28.27 N ANISOU 2425 NE2 GLN A 754 3651 3784 3307 242 -139 -180 N ATOM 0 H GLN A 754 27.225 1.631 2.333 1.00 28.88 H new ATOM 0 HA GLN A 754 24.998 1.222 1.337 1.00 27.53 H new ATOM 0 HB2 GLN A 754 26.449 -0.405 2.469 1.00 28.34 H new ATOM 0 HB3 GLN A 754 25.616 -0.096 3.751 1.00 28.34 H new ATOM 0 HG2 GLN A 754 24.071 -0.777 1.533 1.00 32.93 H new ATOM 0 HG3 GLN A 754 24.938 -1.951 2.083 1.00 32.93 H new ATOM 0 HE21 GLN A 754 22.697 -2.841 2.445 1.00 28.27 H new ATOM 0 HE22 GLN A 754 22.050 -2.594 3.763 1.00 28.27 H new ATOM 2426 N GLU A 755 24.262 2.258 4.280 1.00 28.23 N ANISOU 2426 N GLU A 755 3527 3889 3309 208 -142 -216 N ATOM 2427 CA GLU A 755 23.176 2.845 5.068 1.00 27.70 C ANISOU 2427 CA GLU A 755 3470 3827 3228 196 -157 -208 C ATOM 2428 C GLU A 755 22.664 4.186 4.525 1.00 31.26 C ANISOU 2428 C GLU A 755 3910 4271 3695 162 -147 -212 C ATOM 2429 O GLU A 755 21.458 4.383 4.397 1.00 31.61 O ANISOU 2429 O GLU A 755 3973 4302 3734 145 -146 -195 O ATOM 2430 CB GLU A 755 23.632 3.028 6.518 1.00 29.11 C ANISOU 2430 CB GLU A 755 3633 4032 3395 222 -186 -223 C ATOM 2431 CG GLU A 755 22.554 3.678 7.354 1.00 38.11 C ANISOU 2431 CG GLU A 755 4788 5179 4513 218 -189 -220 C ATOM 2432 CD GLU A 755 22.707 3.538 8.844 1.00 54.75 C ANISOU 2432 CD GLU A 755 6907 7318 6580 256 -213 -227 C ATOM 2433 OE1 GLU A 755 23.735 4.011 9.371 1.00 42.26 O ANISOU 2433 OE1 GLU A 755 5300 5757 5001 272 -249 -264 O ATOM 2434 OE2 GLU A 755 21.727 3.120 9.500 1.00 57.27 O ANISOU 2434 OE2 GLU A 755 7258 7638 6864 269 -196 -197 O ATOM 0 H GLU A 755 24.995 2.151 4.717 1.00 28.23 H new ATOM 0 HA GLU A 755 22.434 2.222 5.010 1.00 27.70 H new ATOM 0 HB2 GLU A 755 23.863 2.166 6.898 1.00 29.11 H new ATOM 0 HB3 GLU A 755 24.434 3.572 6.541 1.00 29.11 H new ATOM 0 HG2 GLU A 755 22.525 4.623 7.136 1.00 38.11 H new ATOM 0 HG3 GLU A 755 21.698 3.301 7.097 1.00 38.11 H new ATOM 2435 N GLU A 756 23.585 5.108 4.228 1.00 26.42 N ANISOU 2435 N GLU A 756 3260 3663 3117 153 -141 -229 N ATOM 2436 CA GLU A 756 23.239 6.447 3.780 1.00 24.21 C ANISOU 2436 CA GLU A 756 2963 3370 2865 123 -130 -227 C ATOM 2437 C GLU A 756 22.460 6.417 2.524 1.00 27.77 C ANISOU 2437 C GLU A 756 3447 3806 3301 105 -110 -196 C ATOM 2438 O GLU A 756 21.456 7.107 2.420 1.00 27.79 O ANISOU 2438 O GLU A 756 3456 3795 3310 87 -116 -183 O ATOM 2439 CB GLU A 756 24.488 7.344 3.673 1.00 24.44 C ANISOU 2439 CB GLU A 756 2937 3396 2951 116 -122 -245 C ATOM 2440 CG GLU A 756 25.076 7.612 5.049 1.00 22.28 C ANISOU 2440 CG GLU A 756 2631 3136 2697 132 -165 -288 C ATOM 2441 CD GLU A 756 26.175 6.648 5.476 1.00 43.97 C ANISOU 2441 CD GLU A 756 5361 5902 5442 163 -184 -301 C ATOM 2442 OE1 GLU A 756 26.347 5.594 4.825 1.00 39.45 O ANISOU 2442 OE1 GLU A 756 4809 5330 4849 176 -159 -278 O ATOM 2443 OE2 GLU A 756 26.896 6.967 6.445 1.00 38.80 O ANISOU 2443 OE2 GLU A 756 4672 5259 4812 177 -228 -338 O ATOM 0 H GLU A 756 24.432 4.967 4.283 1.00 26.42 H new ATOM 0 HA GLU A 756 22.664 6.843 4.453 1.00 24.21 H new ATOM 0 HB2 GLU A 756 25.152 6.916 3.110 1.00 24.44 H new ATOM 0 HB3 GLU A 756 24.254 8.183 3.247 1.00 24.44 H new ATOM 0 HG2 GLU A 756 25.432 8.514 5.064 1.00 22.28 H new ATOM 0 HG3 GLU A 756 24.361 7.578 5.704 1.00 22.28 H new ATOM 2444 N ILE A 757 22.890 5.585 1.574 1.00 24.81 N ANISOU 2444 N ILE A 757 3094 3431 2902 114 -91 -188 N ATOM 2445 CA ILE A 757 22.196 5.461 0.305 1.00 24.71 C ANISOU 2445 CA ILE A 757 3123 3408 2857 104 -82 -166 C ATOM 2446 C ILE A 757 20.772 4.978 0.545 1.00 26.07 C ANISOU 2446 C ILE A 757 3323 3567 3015 97 -117 -159 C ATOM 2447 O ILE A 757 19.848 5.560 -0.017 1.00 24.98 O ANISOU 2447 O ILE A 757 3197 3418 2877 79 -129 -140 O ATOM 2448 CB ILE A 757 22.967 4.556 -0.694 1.00 27.53 C ANISOU 2448 CB ILE A 757 3508 3770 3182 125 -53 -171 C ATOM 2449 CG1 ILE A 757 24.321 5.179 -1.066 1.00 27.33 C ANISOU 2449 CG1 ILE A 757 3444 3753 3185 130 -4 -167 C ATOM 2450 CG2 ILE A 757 22.111 4.273 -1.922 1.00 27.24 C ANISOU 2450 CG2 ILE A 757 3531 3726 3094 121 -62 -159 C ATOM 2451 CD1 ILE A 757 25.256 4.244 -1.902 1.00 26.78 C ANISOU 2451 CD1 ILE A 757 3393 3690 3090 160 39 -176 C ATOM 0 H ILE A 757 23.585 5.084 1.651 1.00 24.81 H new ATOM 0 HA ILE A 757 22.154 6.336 -0.112 1.00 24.71 H new ATOM 0 HB ILE A 757 23.154 3.706 -0.265 1.00 27.53 H new ATOM 0 HG12 ILE A 757 24.163 5.993 -1.569 1.00 27.33 H new ATOM 0 HG13 ILE A 757 24.782 5.434 -0.251 1.00 27.33 H new ATOM 0 HG21 ILE A 757 22.604 3.708 -2.537 1.00 27.24 H new ATOM 0 HG22 ILE A 757 21.296 3.822 -1.652 1.00 27.24 H new ATOM 0 HG23 ILE A 757 21.887 5.109 -2.361 1.00 27.24 H new ATOM 0 HD11 ILE A 757 26.086 4.706 -2.096 1.00 26.78 H new ATOM 0 HD12 ILE A 757 25.445 3.439 -1.395 1.00 26.78 H new ATOM 0 HD13 ILE A 757 24.817 4.006 -2.734 1.00 26.78 H new ATOM 2452 N ARG A 758 20.579 3.960 1.406 1.00 24.67 N ANISOU 2452 N ARG A 758 3150 3387 2836 111 -132 -168 N ATOM 2453 CA ARG A 758 19.203 3.468 1.660 1.00 25.19 C ANISOU 2453 CA ARG A 758 3231 3432 2907 101 -156 -154 C ATOM 2454 C ARG A 758 18.340 4.574 2.255 1.00 28.21 C ANISOU 2454 C ARG A 758 3590 3813 3317 86 -159 -141 C ATOM 2455 O ARG A 758 17.167 4.684 1.910 1.00 28.88 O ANISOU 2455 O ARG A 758 3678 3878 3419 70 -175 -124 O ATOM 2456 CB ARG A 758 19.177 2.225 2.573 1.00 25.82 C ANISOU 2456 CB ARG A 758 3315 3504 2989 121 -158 -152 C ATOM 2457 CG ARG A 758 17.863 1.417 2.475 1.00 30.49 C ANISOU 2457 CG ARG A 758 3921 4061 3604 109 -177 -135 C ATOM 2458 CD ARG A 758 17.854 0.649 1.152 1.00 34.27 C ANISOU 2458 CD ARG A 758 4432 4516 4072 104 -198 -152 C ATOM 2459 NE ARG A 758 16.521 0.202 0.741 1.00 27.72 N ANISOU 2459 NE ARG A 758 3609 3647 3276 83 -233 -145 N ATOM 2460 CZ ARG A 758 15.976 -0.950 1.102 1.00 36.51 C ANISOU 2460 CZ ARG A 758 4721 4721 4432 82 -244 -138 C ATOM 2461 NH1 ARG A 758 16.636 -1.786 1.899 1.00 29.14 N ANISOU 2461 NH1 ARG A 758 3786 3784 3502 106 -218 -131 N ATOM 2462 NH2 ARG A 758 14.762 -1.277 0.677 1.00 22.51 N ANISOU 2462 NH2 ARG A 758 2940 2906 2706 58 -282 -134 N ATOM 0 H ARG A 758 21.202 3.554 1.838 1.00 24.67 H new ATOM 0 HA ARG A 758 18.838 3.202 0.802 1.00 25.19 H new ATOM 0 HB2 ARG A 758 19.922 1.648 2.343 1.00 25.82 H new ATOM 0 HB3 ARG A 758 19.309 2.505 3.492 1.00 25.82 H new ATOM 0 HG2 ARG A 758 17.791 0.801 3.221 1.00 30.49 H new ATOM 0 HG3 ARG A 758 17.098 2.012 2.523 1.00 30.49 H new ATOM 0 HD2 ARG A 758 18.226 1.214 0.457 1.00 34.27 H new ATOM 0 HD3 ARG A 758 18.435 -0.123 1.231 1.00 34.27 H new ATOM 0 HE ARG A 758 16.062 0.722 0.232 1.00 27.72 H new ATOM 0 HH11 ARG A 758 17.421 -1.580 2.183 1.00 29.14 H new ATOM 0 HH12 ARG A 758 16.278 -2.533 2.130 1.00 29.14 H new ATOM 0 HH21 ARG A 758 14.326 -0.740 0.165 1.00 22.51 H new ATOM 0 HH22 ARG A 758 14.411 -2.026 0.913 1.00 22.51 H new ATOM 2463 N PHE A 759 18.922 5.381 3.162 1.00 25.20 N ANISOU 2463 N PHE A 759 3180 3449 2944 93 -147 -155 N ATOM 2464 CA PHE A 759 18.201 6.476 3.814 1.00 23.45 C ANISOU 2464 CA PHE A 759 2938 3223 2749 85 -146 -155 C ATOM 2465 C PHE A 759 17.865 7.619 2.849 1.00 28.78 C ANISOU 2465 C PHE A 759 3603 3881 3452 62 -147 -142 C ATOM 2466 O PHE A 759 16.929 8.389 3.106 1.00 28.55 O ANISOU 2466 O PHE A 759 3558 3835 3455 54 -148 -133 O ATOM 2467 CB PHE A 759 18.986 6.996 5.005 1.00 22.95 C ANISOU 2467 CB PHE A 759 2855 3181 2684 103 -143 -187 C ATOM 2468 CG PHE A 759 18.747 6.257 6.304 1.00 24.02 C ANISOU 2468 CG PHE A 759 3005 3334 2789 132 -142 -189 C ATOM 2469 CD1 PHE A 759 19.037 4.892 6.415 1.00 25.08 C ANISOU 2469 CD1 PHE A 759 3159 3474 2897 149 -143 -173 C ATOM 2470 CD2 PHE A 759 18.372 6.949 7.457 1.00 23.72 C ANISOU 2470 CD2 PHE A 759 2962 3307 2743 147 -136 -208 C ATOM 2471 CE1 PHE A 759 18.888 4.223 7.635 1.00 25.69 C ANISOU 2471 CE1 PHE A 759 3251 3567 2941 181 -137 -162 C ATOM 2472 CE2 PHE A 759 18.206 6.273 8.674 1.00 26.13 C ANISOU 2472 CE2 PHE A 759 3289 3635 3003 182 -128 -203 C ATOM 2473 CZ PHE A 759 18.458 4.917 8.754 1.00 24.32 C ANISOU 2473 CZ PHE A 759 3080 3411 2748 198 -128 -174 C ATOM 0 H PHE A 759 19.742 5.304 3.411 1.00 25.20 H new ATOM 0 HA PHE A 759 17.357 6.113 4.124 1.00 23.45 H new ATOM 0 HB2 PHE A 759 19.932 6.954 4.794 1.00 22.95 H new ATOM 0 HB3 PHE A 759 18.766 7.932 5.136 1.00 22.95 H new ATOM 0 HD1 PHE A 759 19.333 4.424 5.668 1.00 25.08 H new ATOM 0 HD2 PHE A 759 18.231 7.867 7.417 1.00 23.72 H new ATOM 0 HE1 PHE A 759 19.077 3.314 7.694 1.00 25.69 H new ATOM 0 HE2 PHE A 759 17.926 6.738 9.429 1.00 26.13 H new ATOM 0 HZ PHE A 759 18.339 4.469 9.560 1.00 24.32 H new ATOM 2474 N LEU A 760 18.627 7.741 1.759 1.00 25.40 N ANISOU 2474 N LEU A 760 3184 3455 3014 56 -140 -135 N ATOM 2475 CA LEU A 760 18.368 8.776 0.748 1.00 26.46 C ANISOU 2475 CA LEU A 760 3315 3573 3165 39 -137 -108 C ATOM 2476 C LEU A 760 17.283 8.340 -0.214 1.00 30.30 C ANISOU 2476 C LEU A 760 3835 4048 3630 33 -165 -81 C ATOM 2477 O LEU A 760 16.451 9.167 -0.590 1.00 29.95 O ANISOU 2477 O LEU A 760 3782 3985 3612 22 -179 -55 O ATOM 2478 CB LEU A 760 19.634 9.101 -0.048 1.00 26.75 C ANISOU 2478 CB LEU A 760 3349 3617 3195 40 -107 -101 C ATOM 2479 CG LEU A 760 20.719 9.896 0.699 1.00 31.24 C ANISOU 2479 CG LEU A 760 3869 4185 3815 38 -87 -125 C ATOM 2480 CD1 LEU A 760 21.952 10.038 -0.193 1.00 31.43 C ANISOU 2480 CD1 LEU A 760 3884 4213 3846 38 -47 -109 C ATOM 2481 CD2 LEU A 760 20.238 11.286 1.098 1.00 30.22 C ANISOU 2481 CD2 LEU A 760 3707 4027 3747 22 -92 -124 C ATOM 0 H LEU A 760 19.300 7.235 1.585 1.00 25.40 H new ATOM 0 HA LEU A 760 18.076 9.569 1.224 1.00 26.46 H new ATOM 0 HB2 LEU A 760 20.024 8.268 -0.355 1.00 26.75 H new ATOM 0 HB3 LEU A 760 19.378 9.602 -0.838 1.00 26.75 H new ATOM 0 HG LEU A 760 20.934 9.406 1.508 1.00 31.24 H new ATOM 0 HD11 LEU A 760 22.636 10.539 0.278 1.00 31.43 H new ATOM 0 HD12 LEU A 760 22.293 9.158 -0.417 1.00 31.43 H new ATOM 0 HD13 LEU A 760 21.711 10.507 -1.007 1.00 31.43 H new ATOM 0 HD21 LEU A 760 20.949 11.753 1.565 1.00 30.22 H new ATOM 0 HD22 LEU A 760 19.992 11.784 0.303 1.00 30.22 H new ATOM 0 HD23 LEU A 760 19.467 11.207 1.681 1.00 30.22 H new ATOM 2482 N ILE A 761 17.306 7.053 -0.641 1.00 25.62 N ANISOU 2482 N ILE A 761 3277 3463 2996 41 -179 -90 N ATOM 2483 CA ILE A 761 16.329 6.543 -1.608 1.00 25.54 C ANISOU 2483 CA ILE A 761 3300 3439 2965 36 -221 -78 C ATOM 2484 C ILE A 761 15.012 6.208 -0.927 1.00 28.73 C ANISOU 2484 C ILE A 761 3681 3819 3418 26 -251 -73 C ATOM 2485 O ILE A 761 13.979 6.270 -1.585 1.00 28.92 O ANISOU 2485 O ILE A 761 3708 3823 3456 16 -294 -57 O ATOM 2486 CB ILE A 761 16.874 5.400 -2.497 1.00 28.38 C ANISOU 2486 CB ILE A 761 3710 3808 3266 51 -227 -98 C ATOM 2487 CG1 ILE A 761 17.150 4.101 -1.660 1.00 29.32 C ANISOU 2487 CG1 ILE A 761 3825 3921 3394 61 -221 -126 C ATOM 2488 CG2 ILE A 761 18.105 5.920 -3.295 1.00 26.73 C ANISOU 2488 CG2 ILE A 761 3520 3624 3014 64 -181 -90 C ATOM 2489 CD1 ILE A 761 17.728 2.874 -2.412 1.00 27.89 C ANISOU 2489 CD1 ILE A 761 3689 3738 3168 79 -224 -156 C ATOM 0 H ILE A 761 17.881 6.471 -0.377 1.00 25.62 H new ATOM 0 HA ILE A 761 16.150 7.262 -2.235 1.00 25.54 H new ATOM 0 HB ILE A 761 16.204 5.133 -3.146 1.00 28.38 H new ATOM 0 HG12 ILE A 761 17.764 4.330 -0.945 1.00 29.32 H new ATOM 0 HG13 ILE A 761 16.317 3.831 -1.243 1.00 29.32 H new ATOM 0 HG21 ILE A 761 18.452 5.208 -3.855 1.00 26.73 H new ATOM 0 HG22 ILE A 761 17.837 6.668 -3.852 1.00 26.73 H new ATOM 0 HG23 ILE A 761 18.794 6.209 -2.676 1.00 26.73 H new ATOM 0 HD11 ILE A 761 17.853 2.141 -1.789 1.00 27.89 H new ATOM 0 HD12 ILE A 761 17.112 2.603 -3.110 1.00 27.89 H new ATOM 0 HD13 ILE A 761 18.582 3.110 -2.808 1.00 27.89 H new ATOM 2490 N ASN A 762 15.051 5.890 0.397 1.00 25.17 N ANISOU 2490 N ASN A 762 3203 3368 2992 32 -226 -84 N ATOM 2491 CA ASN A 762 13.881 5.664 1.269 1.00 26.06 C ANISOU 2491 CA ASN A 762 3287 3459 3156 27 -229 -71 C ATOM 2492 C ASN A 762 13.961 6.751 2.367 1.00 28.96 C ANISOU 2492 C ASN A 762 3623 3837 3544 35 -192 -74 C ATOM 2493 O ASN A 762 14.313 6.442 3.496 1.00 26.57 O ANISOU 2493 O ASN A 762 3317 3550 3230 52 -164 -86 O ATOM 2494 CB ASN A 762 13.880 4.236 1.856 1.00 24.15 C ANISOU 2494 CB ASN A 762 3053 3209 2913 36 -223 -76 C ATOM 2495 CG ASN A 762 13.581 3.183 0.819 1.00 36.32 C ANISOU 2495 CG ASN A 762 4620 4726 4454 26 -267 -83 C ATOM 2496 OD1 ASN A 762 14.039 3.253 -0.305 1.00 36.60 O ANISOU 2496 OD1 ASN A 762 4689 4770 4446 26 -290 -98 O ATOM 2497 ND2 ASN A 762 12.747 2.227 1.132 1.00 27.03 N ANISOU 2497 ND2 ASN A 762 3430 3514 3327 19 -279 -73 N ATOM 0 H ASN A 762 15.795 5.799 0.818 1.00 25.17 H new ATOM 0 HA ASN A 762 13.048 5.732 0.776 1.00 26.06 H new ATOM 0 HB2 ASN A 762 14.744 4.054 2.257 1.00 24.15 H new ATOM 0 HB3 ASN A 762 13.221 4.182 2.566 1.00 24.15 H new ATOM 0 HD21 ASN A 762 12.520 1.644 0.542 1.00 27.03 H new ATOM 0 HD22 ASN A 762 12.425 2.181 1.928 1.00 27.03 H new ATOM 2498 N PRO A 763 13.666 8.041 2.035 1.00 28.37 N ANISOU 2498 N PRO A 763 3529 3752 3497 26 -195 -65 N ATOM 2499 CA PRO A 763 13.858 9.139 3.020 1.00 27.29 C ANISOU 2499 CA PRO A 763 3366 3619 3383 35 -164 -82 C ATOM 2500 C PRO A 763 13.086 9.043 4.311 1.00 29.22 C ANISOU 2500 C PRO A 763 3592 3861 3650 50 -136 -87 C ATOM 2501 O PRO A 763 13.499 9.661 5.275 1.00 29.43 O ANISOU 2501 O PRO A 763 3613 3901 3669 67 -111 -117 O ATOM 2502 CB PRO A 763 13.443 10.389 2.234 1.00 29.32 C ANISOU 2502 CB PRO A 763 3606 3852 3683 22 -177 -61 C ATOM 2503 CG PRO A 763 13.674 10.010 0.808 1.00 32.65 C ANISOU 2503 CG PRO A 763 4059 4277 4071 12 -208 -38 C ATOM 2504 CD PRO A 763 13.235 8.592 0.726 1.00 28.27 C ANISOU 2504 CD PRO A 763 3523 3725 3494 12 -230 -40 C ATOM 0 HA PRO A 763 14.774 9.126 3.339 1.00 27.29 H new ATOM 0 HB2 PRO A 763 12.514 10.618 2.395 1.00 29.32 H new ATOM 0 HB3 PRO A 763 13.974 11.161 2.487 1.00 29.32 H new ATOM 0 HG2 PRO A 763 13.164 10.573 0.205 1.00 32.65 H new ATOM 0 HG3 PRO A 763 14.608 10.106 0.564 1.00 32.65 H new ATOM 0 HD2 PRO A 763 12.276 8.518 0.602 1.00 28.27 H new ATOM 0 HD3 PRO A 763 13.653 8.128 -0.016 1.00 28.27 H new ATOM 2505 N GLU A 764 11.981 8.294 4.338 1.00 24.86 N ANISOU 2505 N GLU A 764 3028 3290 3126 47 -138 -59 N ATOM 2506 CA GLU A 764 11.169 8.135 5.551 1.00 25.42 C ANISOU 2506 CA GLU A 764 3081 3358 3222 65 -93 -51 C ATOM 2507 C GLU A 764 11.972 7.491 6.694 1.00 28.52 C ANISOU 2507 C GLU A 764 3502 3786 3549 93 -62 -69 C ATOM 2508 O GLU A 764 11.691 7.768 7.859 1.00 27.97 O ANISOU 2508 O GLU A 764 3431 3729 3469 119 -18 -76 O ATOM 2509 CB GLU A 764 9.833 7.402 5.257 1.00 26.34 C ANISOU 2509 CB GLU A 764 3167 3438 3403 50 -100 -10 C ATOM 2510 CG GLU A 764 8.936 8.230 4.320 1.00 32.82 C ANISOU 2510 CG GLU A 764 3952 4225 4293 31 -138 7 C ATOM 2511 CD GLU A 764 7.998 7.502 3.363 1.00 43.25 C ANISOU 2511 CD GLU A 764 5252 5510 5671 7 -193 35 C ATOM 2512 OE1 GLU A 764 8.149 6.276 3.154 1.00 30.34 O ANISOU 2512 OE1 GLU A 764 3636 3872 4022 -1 -212 36 O ATOM 2513 OE2 GLU A 764 7.106 8.179 2.805 1.00 36.18 O ANISOU 2513 OE2 GLU A 764 4319 4587 4841 -2 -224 54 O ATOM 0 H GLU A 764 11.681 7.864 3.656 1.00 24.86 H new ATOM 0 HA GLU A 764 10.926 9.022 5.860 1.00 25.42 H new ATOM 0 HB2 GLU A 764 10.017 6.539 4.853 1.00 26.34 H new ATOM 0 HB3 GLU A 764 9.365 7.232 6.089 1.00 26.34 H new ATOM 0 HG2 GLU A 764 8.394 8.814 4.873 1.00 32.82 H new ATOM 0 HG3 GLU A 764 9.514 8.799 3.788 1.00 32.82 H new ATOM 2514 N LEU A 765 13.027 6.721 6.341 1.00 22.46 N ANISOU 2514 N LEU A 765 2763 3036 2734 92 -85 -78 N ATOM 2515 CA LEU A 765 13.979 6.093 7.267 1.00 21.54 C ANISOU 2515 CA LEU A 765 2675 2954 2557 120 -72 -92 C ATOM 2516 C LEU A 765 14.709 7.189 8.043 1.00 27.54 C ANISOU 2516 C LEU A 765 3435 3741 3286 140 -67 -138 C ATOM 2517 O LEU A 765 15.011 6.973 9.207 1.00 26.57 O ANISOU 2517 O LEU A 765 3332 3648 3115 174 -51 -151 O ATOM 2518 CB LEU A 765 15.051 5.282 6.471 1.00 20.38 C ANISOU 2518 CB LEU A 765 2548 2814 2384 114 -103 -99 C ATOM 2519 CG LEU A 765 14.604 3.960 5.851 1.00 24.39 C ANISOU 2519 CG LEU A 765 3064 3293 2910 102 -115 -70 C ATOM 2520 CD1 LEU A 765 15.708 3.380 4.966 1.00 22.43 C ANISOU 2520 CD1 LEU A 765 2839 3051 2635 101 -140 -90 C ATOM 2521 CD2 LEU A 765 14.301 2.928 6.957 1.00 27.64 C ANISOU 2521 CD2 LEU A 765 3483 3703 3316 126 -83 -39 C ATOM 0 H LEU A 765 13.207 6.549 5.518 1.00 22.46 H new ATOM 0 HA LEU A 765 13.492 5.503 7.864 1.00 21.54 H new ATOM 0 HB2 LEU A 765 15.390 5.848 5.760 1.00 20.38 H new ATOM 0 HB3 LEU A 765 15.794 5.099 7.067 1.00 20.38 H new ATOM 0 HG LEU A 765 13.810 4.137 5.323 1.00 24.39 H new ATOM 0 HD11 LEU A 765 15.408 2.542 4.581 1.00 22.43 H new ATOM 0 HD12 LEU A 765 15.915 4.006 4.255 1.00 22.43 H new ATOM 0 HD13 LEU A 765 16.502 3.224 5.500 1.00 22.43 H new ATOM 0 HD21 LEU A 765 14.018 2.093 6.552 1.00 27.64 H new ATOM 0 HD22 LEU A 765 15.100 2.776 7.486 1.00 27.64 H new ATOM 0 HD23 LEU A 765 13.594 3.265 7.529 1.00 27.64 H new ATOM 2522 N ILE A 766 15.021 8.355 7.385 1.00 24.48 N ANISOU 2522 N ILE A 766 3029 3342 2929 120 -86 -163 N ATOM 2523 CA ILE A 766 15.722 9.485 8.022 1.00 24.17 C ANISOU 2523 CA ILE A 766 2983 3315 2886 132 -91 -215 C ATOM 2524 C ILE A 766 15.040 9.955 9.289 1.00 29.71 C ANISOU 2524 C ILE A 766 3689 4024 3574 163 -60 -236 C ATOM 2525 O ILE A 766 15.731 10.408 10.192 1.00 29.76 O ANISOU 2525 O ILE A 766 3708 4054 3545 188 -69 -288 O ATOM 2526 CB ILE A 766 15.951 10.702 7.053 1.00 26.14 C ANISOU 2526 CB ILE A 766 3205 3534 3194 103 -106 -224 C ATOM 2527 CG1 ILE A 766 16.856 10.302 5.899 1.00 25.45 C ANISOU 2527 CG1 ILE A 766 3120 3448 3103 83 -125 -207 C ATOM 2528 CG2 ILE A 766 16.537 11.934 7.822 1.00 24.12 C ANISOU 2528 CG2 ILE A 766 2932 3274 2957 113 -112 -284 C ATOM 2529 CD1 ILE A 766 16.733 11.178 4.650 1.00 32.43 C ANISOU 2529 CD1 ILE A 766 3987 4301 4034 55 -129 -182 C ATOM 0 H ILE A 766 14.825 8.494 6.559 1.00 24.48 H new ATOM 0 HA ILE A 766 16.593 9.130 8.258 1.00 24.17 H new ATOM 0 HB ILE A 766 15.091 10.964 6.689 1.00 26.14 H new ATOM 0 HG12 ILE A 766 17.776 10.324 6.204 1.00 25.45 H new ATOM 0 HG13 ILE A 766 16.660 9.384 5.655 1.00 25.45 H new ATOM 0 HG21 ILE A 766 16.669 12.669 7.203 1.00 24.12 H new ATOM 0 HG22 ILE A 766 15.919 12.205 8.519 1.00 24.12 H new ATOM 0 HG23 ILE A 766 17.387 11.692 8.221 1.00 24.12 H new ATOM 0 HD11 ILE A 766 17.341 10.855 3.967 1.00 32.43 H new ATOM 0 HD12 ILE A 766 15.823 11.140 4.316 1.00 32.43 H new ATOM 0 HD13 ILE A 766 16.957 12.095 4.874 1.00 32.43 H new ATOM 2530 N ILE A 767 13.684 9.910 9.353 1.00 27.21 N ANISOU 2530 N ILE A 767 3362 3687 3291 163 -23 -201 N ATOM 2531 CA ILE A 767 12.985 10.421 10.541 1.00 25.69 C ANISOU 2531 CA ILE A 767 3174 3501 3087 199 23 -221 C ATOM 2532 C ILE A 767 13.258 9.546 11.780 1.00 30.46 C ANISOU 2532 C ILE A 767 3822 4151 3601 243 48 -221 C ATOM 2533 O ILE A 767 13.092 10.020 12.908 1.00 30.23 O ANISOU 2533 O ILE A 767 3815 4143 3526 284 79 -256 O ATOM 2534 CB ILE A 767 11.468 10.668 10.278 1.00 28.88 C ANISOU 2534 CB ILE A 767 3542 3866 3566 190 63 -181 C ATOM 2535 CG1 ILE A 767 10.942 11.836 11.175 1.00 28.99 C ANISOU 2535 CG1 ILE A 767 3549 3872 3595 222 105 -224 C ATOM 2536 CG2 ILE A 767 10.642 9.396 10.469 1.00 26.86 C ANISOU 2536 CG2 ILE A 767 3284 3609 3312 195 100 -118 C ATOM 2537 CD1 ILE A 767 11.802 13.219 10.974 1.00 29.25 C ANISOU 2537 CD1 ILE A 767 3575 3889 3650 213 62 -294 C ATOM 0 H ILE A 767 13.174 9.596 8.736 1.00 27.21 H new ATOM 0 HA ILE A 767 13.355 11.295 10.741 1.00 25.69 H new ATOM 0 HB ILE A 767 11.365 10.929 9.349 1.00 28.88 H new ATOM 0 HG12 ILE A 767 10.010 12.005 10.967 1.00 28.99 H new ATOM 0 HG13 ILE A 767 10.980 11.567 12.106 1.00 28.99 H new ATOM 0 HG21 ILE A 767 9.707 9.588 10.297 1.00 26.86 H new ATOM 0 HG22 ILE A 767 10.950 8.714 9.852 1.00 26.86 H new ATOM 0 HG23 ILE A 767 10.744 9.077 11.379 1.00 26.86 H new ATOM 0 HD11 ILE A 767 11.440 13.912 11.549 1.00 29.25 H new ATOM 0 HD12 ILE A 767 12.730 13.060 11.206 1.00 29.25 H new ATOM 0 HD13 ILE A 767 11.745 13.504 10.049 1.00 29.25 H new ATOM 2538 N SER A 768 13.804 8.322 11.592 1.00 25.65 N ANISOU 2538 N SER A 768 3231 3558 2957 240 31 -187 N ATOM 2539 CA SER A 768 14.167 7.535 12.774 1.00 25.72 C ANISOU 2539 CA SER A 768 3285 3611 2878 287 49 -180 C ATOM 2540 C SER A 768 15.203 8.318 13.626 1.00 28.71 C ANISOU 2540 C SER A 768 3689 4028 3189 320 12 -257 C ATOM 2541 O SER A 768 15.273 8.135 14.829 1.00 29.69 O ANISOU 2541 O SER A 768 3858 4194 3229 372 29 -267 O ATOM 2542 CB SER A 768 14.701 6.166 12.366 1.00 28.24 C ANISOU 2542 CB SER A 768 3613 3932 3185 279 28 -135 C ATOM 2543 OG SER A 768 15.910 6.247 11.631 1.00 26.53 O ANISOU 2543 OG SER A 768 3389 3719 2974 259 -32 -169 O ATOM 0 H SER A 768 13.962 7.954 10.831 1.00 25.65 H new ATOM 0 HA SER A 768 13.375 7.387 13.315 1.00 25.72 H new ATOM 0 HB2 SER A 768 14.846 5.629 13.161 1.00 28.24 H new ATOM 0 HB3 SER A 768 14.033 5.708 11.832 1.00 28.24 H new ATOM 0 HG SER A 768 15.742 6.471 10.839 1.00 26.53 H new ATOM 2544 N ARG A 769 15.924 9.260 13.013 1.00 24.19 N ANISOU 2544 N ARG A 769 3090 3440 2661 292 -38 -311 N ATOM 2545 CA ARG A 769 16.959 10.054 13.689 1.00 23.59 C ANISOU 2545 CA ARG A 769 3024 3387 2550 313 -87 -393 C ATOM 2546 C ARG A 769 16.403 11.043 14.677 1.00 27.56 C ANISOU 2546 C ARG A 769 3548 3896 3028 348 -63 -449 C ATOM 2547 O ARG A 769 17.090 11.437 15.628 1.00 27.12 O ANISOU 2547 O ARG A 769 3522 3872 2910 385 -102 -519 O ATOM 2548 CB ARG A 769 17.860 10.735 12.650 1.00 22.49 C ANISOU 2548 CB ARG A 769 2839 3217 2489 268 -137 -423 C ATOM 2549 CG ARG A 769 18.749 9.710 11.937 1.00 20.48 C ANISOU 2549 CG ARG A 769 2576 2971 2235 251 -164 -386 C ATOM 2550 CD ARG A 769 19.328 10.267 10.666 1.00 22.47 C ANISOU 2550 CD ARG A 769 2782 3187 2570 204 -181 -388 C ATOM 2551 NE ARG A 769 20.359 11.287 10.909 1.00 29.27 N ANISOU 2551 NE ARG A 769 3614 4041 3469 199 -225 -456 N ATOM 2552 CZ ARG A 769 21.658 11.035 11.020 1.00 41.65 C ANISOU 2552 CZ ARG A 769 5163 5625 5038 205 -270 -482 C ATOM 2553 NH1 ARG A 769 22.103 9.789 10.996 1.00 38.93 N ANISOU 2553 NH1 ARG A 769 4835 5309 4648 222 -276 -447 N ATOM 2554 NH2 ARG A 769 22.521 12.026 11.159 1.00 29.96 N ANISOU 2554 NH2 ARG A 769 3642 4124 3616 193 -312 -543 N ATOM 0 H ARG A 769 15.825 9.459 12.182 1.00 24.19 H new ATOM 0 HA ARG A 769 17.493 9.439 14.216 1.00 23.59 H new ATOM 0 HB2 ARG A 769 17.313 11.202 11.999 1.00 22.49 H new ATOM 0 HB3 ARG A 769 18.414 11.402 13.085 1.00 22.49 H new ATOM 0 HG2 ARG A 769 19.468 9.437 12.528 1.00 20.48 H new ATOM 0 HG3 ARG A 769 18.230 8.915 11.736 1.00 20.48 H new ATOM 0 HD2 ARG A 769 19.711 9.544 10.146 1.00 22.47 H new ATOM 0 HD3 ARG A 769 18.616 10.654 10.133 1.00 22.47 H new ATOM 0 HE ARG A 769 20.103 12.104 10.985 1.00 29.27 H new ATOM 0 HH11 ARG A 769 21.550 9.136 10.908 1.00 38.93 H new ATOM 0 HH12 ARG A 769 22.945 9.632 11.068 1.00 38.93 H new ATOM 0 HH21 ARG A 769 22.242 12.839 11.178 1.00 29.96 H new ATOM 0 HH22 ARG A 769 23.361 11.858 11.231 1.00 29.96 H new ATOM 2555 N LEU A 770 15.133 11.403 14.485 1.00 25.97 N ANISOU 2555 N LEU A 770 3330 3663 2873 341 -2 -421 N ATOM 2556 CA LEU A 770 14.442 12.328 15.387 1.00 26.91 C ANISOU 2556 CA LEU A 770 3467 3782 2976 379 38 -472 C ATOM 2557 C LEU A 770 14.224 11.678 16.768 1.00 30.78 C ANISOU 2557 C LEU A 770 4024 4331 3340 447 81 -467 C ATOM 2558 O LEU A 770 14.367 12.344 17.804 1.00 29.22 O ANISOU 2558 O LEU A 770 3868 4160 3074 496 78 -543 O ATOM 2559 CB LEU A 770 13.068 12.687 14.765 1.00 25.41 C ANISOU 2559 CB LEU A 770 3233 3542 2879 356 100 -425 C ATOM 2560 CG LEU A 770 12.188 13.701 15.495 1.00 29.11 C ANISOU 2560 CG LEU A 770 3705 3994 3362 392 156 -470 C ATOM 2561 CD1 LEU A 770 12.888 15.088 15.612 1.00 28.48 C ANISOU 2561 CD1 LEU A 770 3619 3890 3313 391 103 -575 C ATOM 2562 CD2 LEU A 770 10.836 13.829 14.779 1.00 27.60 C ANISOU 2562 CD2 LEU A 770 3458 3752 3277 367 211 -406 C ATOM 0 H LEU A 770 14.650 11.120 13.832 1.00 25.97 H new ATOM 0 HA LEU A 770 14.982 13.125 15.505 1.00 26.91 H new ATOM 0 HB2 LEU A 770 13.227 13.023 13.869 1.00 25.41 H new ATOM 0 HB3 LEU A 770 12.560 11.866 14.674 1.00 25.41 H new ATOM 0 HG LEU A 770 12.038 13.379 16.398 1.00 29.11 H new ATOM 0 HD11 LEU A 770 12.305 15.707 16.079 1.00 28.48 H new ATOM 0 HD12 LEU A 770 13.718 14.991 16.105 1.00 28.48 H new ATOM 0 HD13 LEU A 770 13.078 15.431 14.725 1.00 28.48 H new ATOM 0 HD21 LEU A 770 10.282 14.473 15.246 1.00 27.60 H new ATOM 0 HD22 LEU A 770 10.979 14.127 13.867 1.00 27.60 H new ATOM 0 HD23 LEU A 770 10.391 12.967 14.770 1.00 27.60 H new ATOM 2563 N PHE A 771 13.813 10.398 16.775 1.00 26.21 N ANISOU 2563 N PHE A 771 3457 3768 2733 453 124 -377 N ATOM 2564 CA PHE A 771 13.429 9.777 18.042 1.00 27.29 C ANISOU 2564 CA PHE A 771 3656 3955 2757 520 186 -349 C ATOM 2565 C PHE A 771 14.226 8.541 18.455 1.00 33.13 C ANISOU 2565 C PHE A 771 4439 4740 3408 545 157 -305 C ATOM 2566 O PHE A 771 13.926 8.008 19.503 1.00 34.54 O ANISOU 2566 O PHE A 771 4675 4962 3488 604 211 -270 O ATOM 2567 CB PHE A 771 11.922 9.448 18.004 1.00 28.91 C ANISOU 2567 CB PHE A 771 3837 4132 3015 520 295 -269 C ATOM 2568 CG PHE A 771 11.427 8.810 16.716 1.00 29.57 C ANISOU 2568 CG PHE A 771 3854 4161 3219 454 293 -193 C ATOM 2569 CD1 PHE A 771 11.812 7.517 16.362 1.00 32.26 C ANISOU 2569 CD1 PHE A 771 4198 4505 3554 437 273 -129 C ATOM 2570 CD2 PHE A 771 10.583 9.506 15.855 1.00 29.70 C ANISOU 2570 CD2 PHE A 771 3808 4123 3356 413 305 -191 C ATOM 2571 CE1 PHE A 771 11.342 6.928 15.179 1.00 31.73 C ANISOU 2571 CE1 PHE A 771 4076 4386 3593 380 264 -73 C ATOM 2572 CE2 PHE A 771 10.115 8.916 14.679 1.00 31.76 C ANISOU 2572 CE2 PHE A 771 4014 4337 3717 357 291 -129 C ATOM 2573 CZ PHE A 771 10.497 7.631 14.349 1.00 29.57 C ANISOU 2573 CZ PHE A 771 3746 4064 3427 341 269 -76 C ATOM 0 H PHE A 771 13.753 9.893 16.081 1.00 26.21 H new ATOM 0 HA PHE A 771 13.640 10.434 18.724 1.00 27.29 H new ATOM 0 HB2 PHE A 771 11.718 8.852 18.742 1.00 28.91 H new ATOM 0 HB3 PHE A 771 11.424 10.267 18.154 1.00 28.91 H new ATOM 0 HD1 PHE A 771 12.387 7.040 16.916 1.00 32.26 H new ATOM 0 HD2 PHE A 771 10.328 10.375 16.066 1.00 29.70 H new ATOM 0 HE1 PHE A 771 11.601 6.063 14.955 1.00 31.73 H new ATOM 0 HE2 PHE A 771 9.545 9.390 14.117 1.00 31.76 H new ATOM 0 HZ PHE A 771 10.184 7.240 13.566 1.00 29.57 H new ATOM 2574 N THR A 772 15.202 8.057 17.652 1.00 29.70 N ANISOU 2574 N THR A 772 3979 4296 3009 506 81 -299 N ATOM 2575 CA THR A 772 15.934 6.836 17.992 1.00 29.32 C ANISOU 2575 CA THR A 772 3965 4283 2894 531 55 -252 C ATOM 2576 C THR A 772 17.242 7.124 18.677 1.00 33.06 C ANISOU 2576 C THR A 772 4473 4805 3285 568 -35 -326 C ATOM 2577 O THR A 772 18.145 7.686 18.066 1.00 32.04 O ANISOU 2577 O THR A 772 4305 4659 3211 533 -111 -386 O ATOM 2578 CB THR A 772 16.127 5.935 16.749 1.00 29.56 C ANISOU 2578 CB THR A 772 3947 4270 3014 475 37 -193 C ATOM 2579 OG1 THR A 772 14.865 5.817 16.133 1.00 26.59 O ANISOU 2579 OG1 THR A 772 3535 3847 2720 441 104 -140 O ATOM 2580 CG2 THR A 772 16.652 4.536 17.107 1.00 26.92 C ANISOU 2580 CG2 THR A 772 3643 3957 2627 504 28 -129 C ATOM 0 H THR A 772 15.446 8.425 16.914 1.00 29.70 H new ATOM 0 HA THR A 772 15.390 6.348 18.630 1.00 29.32 H new ATOM 0 HB THR A 772 16.789 6.337 16.165 1.00 29.56 H new ATOM 0 HG1 THR A 772 14.736 6.477 15.629 1.00 26.59 H new ATOM 0 HG21 THR A 772 16.756 4.012 16.297 1.00 26.92 H new ATOM 0 HG22 THR A 772 17.510 4.616 17.552 1.00 26.92 H new ATOM 0 HG23 THR A 772 16.022 4.095 17.698 1.00 26.92 H new ATOM 2581 N GLU A 773 17.364 6.686 19.935 1.00 30.98 N ANISOU 2581 N GLU A 773 4282 4600 2890 641 -27 -314 N ATOM 2582 CA GLU A 773 18.596 6.860 20.690 1.00 30.97 C ANISOU 2582 CA GLU A 773 4318 4650 2799 685 -126 -383 C ATOM 2583 C GLU A 773 19.630 5.880 20.143 1.00 33.60 C ANISOU 2583 C GLU A 773 4623 4979 3166 667 -189 -343 C ATOM 2584 O GLU A 773 19.280 4.840 19.565 1.00 31.21 O ANISOU 2584 O GLU A 773 4303 4648 2909 645 -141 -250 O ATOM 2585 CB GLU A 773 18.333 6.576 22.176 1.00 33.52 C ANISOU 2585 CB GLU A 773 4738 5042 2956 778 -95 -369 C ATOM 2586 CG GLU A 773 19.525 6.874 23.072 1.00 41.34 C ANISOU 2586 CG GLU A 773 5776 6091 3839 833 -212 -455 C ATOM 2587 CD GLU A 773 19.235 6.989 24.553 1.00 52.61 C ANISOU 2587 CD GLU A 773 7311 7592 5085 930 -191 -474 C ATOM 2588 OE1 GLU A 773 20.050 7.612 25.269 1.00 46.34 O ANISOU 2588 OE1 GLU A 773 6557 6842 4209 972 -296 -579 O ATOM 2589 OE2 GLU A 773 18.200 6.455 25.002 1.00 48.97 O ANISOU 2589 OE2 GLU A 773 6896 7146 4564 966 -71 -384 O ATOM 0 H GLU A 773 16.738 6.284 20.366 1.00 30.98 H new ATOM 0 HA GLU A 773 18.923 7.769 20.603 1.00 30.97 H new ATOM 0 HB2 GLU A 773 17.576 7.107 22.470 1.00 33.52 H new ATOM 0 HB3 GLU A 773 18.084 5.644 22.281 1.00 33.52 H new ATOM 0 HG2 GLU A 773 20.185 6.175 22.944 1.00 41.34 H new ATOM 0 HG3 GLU A 773 19.930 7.704 22.775 1.00 41.34 H new ATOM 2590 N VAL A 774 20.896 6.200 20.354 1.00 32.20 N ANISOU 2590 N VAL A 774 4438 4824 2974 679 -298 -415 N ATOM 2591 CA VAL A 774 22.017 5.367 19.959 1.00 31.86 C ANISOU 2591 CA VAL A 774 4364 4779 2962 672 -366 -389 C ATOM 2592 C VAL A 774 21.773 3.908 20.359 1.00 36.75 C ANISOU 2592 C VAL A 774 5028 5417 3518 714 -322 -276 C ATOM 2593 O VAL A 774 21.343 3.656 21.483 1.00 36.33 O ANISOU 2593 O VAL A 774 5051 5412 3342 781 -292 -246 O ATOM 2594 CB VAL A 774 23.372 5.927 20.454 1.00 35.02 C ANISOU 2594 CB VAL A 774 4755 5210 3342 696 -494 -485 C ATOM 2595 CG1 VAL A 774 23.468 5.953 21.995 1.00 36.20 C ANISOU 2595 CG1 VAL A 774 4995 5433 3325 786 -537 -515 C ATOM 2596 CG2 VAL A 774 24.529 5.135 19.857 1.00 34.17 C ANISOU 2596 CG2 VAL A 774 4593 5089 3301 681 -555 -457 C ATOM 0 H VAL A 774 21.134 6.930 20.743 1.00 32.20 H new ATOM 0 HA VAL A 774 22.080 5.385 18.991 1.00 31.86 H new ATOM 0 HB VAL A 774 23.430 6.846 20.150 1.00 35.02 H new ATOM 0 HG11 VAL A 774 24.330 6.310 22.260 1.00 36.20 H new ATOM 0 HG12 VAL A 774 22.763 6.514 22.354 1.00 36.20 H new ATOM 0 HG13 VAL A 774 23.372 5.052 22.341 1.00 36.20 H new ATOM 0 HG21 VAL A 774 25.369 5.499 20.177 1.00 34.17 H new ATOM 0 HG22 VAL A 774 24.457 4.205 20.124 1.00 34.17 H new ATOM 0 HG23 VAL A 774 24.498 5.196 18.889 1.00 34.17 H new ATOM 2597 N LEU A 775 21.957 2.969 19.412 1.00 34.14 N ANISOU 2597 N LEU A 775 4654 5044 3275 677 -307 -212 N ATOM 2598 CA LEU A 775 21.750 1.546 19.701 1.00 34.64 C ANISOU 2598 CA LEU A 775 4750 5108 3304 711 -266 -103 C ATOM 2599 C LEU A 775 22.791 0.975 20.661 1.00 37.67 C ANISOU 2599 C LEU A 775 5174 5545 3594 784 -346 -92 C ATOM 2600 O LEU A 775 23.980 1.186 20.473 1.00 36.19 O ANISOU 2600 O LEU A 775 4949 5364 3438 781 -442 -151 O ATOM 2601 CB LEU A 775 21.777 0.713 18.407 1.00 34.03 C ANISOU 2601 CB LEU A 775 4614 4965 3350 655 -243 -54 C ATOM 2602 CG LEU A 775 20.726 1.021 17.328 1.00 37.08 C ANISOU 2602 CG LEU A 775 4962 5295 3833 585 -174 -48 C ATOM 2603 CD1 LEU A 775 20.979 0.131 16.081 1.00 35.94 C ANISOU 2603 CD1 LEU A 775 4771 5093 3792 540 -173 -17 C ATOM 2604 CD2 LEU A 775 19.264 0.887 17.873 1.00 34.70 C ANISOU 2604 CD2 LEU A 775 4695 4989 3501 598 -75 15 C ATOM 0 H LEU A 775 22.200 3.139 18.605 1.00 34.14 H new ATOM 0 HA LEU A 775 20.879 1.489 20.125 1.00 34.64 H new ATOM 0 HB2 LEU A 775 22.654 0.816 18.006 1.00 34.03 H new ATOM 0 HB3 LEU A 775 21.686 -0.221 18.653 1.00 34.03 H new ATOM 0 HG LEU A 775 20.820 1.949 17.061 1.00 37.08 H new ATOM 0 HD11 LEU A 775 20.314 0.328 15.402 1.00 35.94 H new ATOM 0 HD12 LEU A 775 21.864 0.312 15.728 1.00 35.94 H new ATOM 0 HD13 LEU A 775 20.917 -0.804 16.332 1.00 35.94 H new ATOM 0 HD21 LEU A 775 18.634 1.089 17.163 1.00 34.70 H new ATOM 0 HD22 LEU A 775 19.117 -0.019 18.187 1.00 34.70 H new ATOM 0 HD23 LEU A 775 19.134 1.508 18.607 1.00 34.70 H new ATOM 2605 N ASP A 776 22.345 0.213 21.662 1.00 35.17 N ANISOU 2605 N ASP A 776 4930 5262 3172 850 -302 -8 N ATOM 2606 CA ASP A 776 23.270 -0.502 22.542 1.00 34.69 C ANISOU 2606 CA ASP A 776 4913 5248 3019 925 -375 25 C ATOM 2607 C ASP A 776 23.550 -1.855 21.869 1.00 38.16 C ANISOU 2607 C ASP A 776 5315 5633 3550 909 -359 116 C ATOM 2608 O ASP A 776 22.882 -2.212 20.891 1.00 35.83 O ANISOU 2608 O ASP A 776 4978 5272 3364 848 -285 151 O ATOM 2609 CB ASP A 776 22.680 -0.707 23.947 1.00 37.17 C ANISOU 2609 CB ASP A 776 5332 5625 3165 1012 -330 83 C ATOM 2610 CG ASP A 776 23.722 -0.845 25.055 1.00 48.76 C ANISOU 2610 CG ASP A 776 6860 7168 4498 1100 -443 67 C ATOM 2611 OD1 ASP A 776 24.931 -1.041 24.730 1.00 47.30 O ANISOU 2611 OD1 ASP A 776 6624 6976 4370 1095 -555 33 O ATOM 2612 OD2 ASP A 776 23.330 -0.795 26.242 1.00 56.90 O ANISOU 2612 OD2 ASP A 776 7989 8264 5366 1178 -420 92 O ATOM 0 H ASP A 776 21.513 0.098 21.847 1.00 35.17 H new ATOM 0 HA ASP A 776 24.084 0.011 22.665 1.00 34.69 H new ATOM 0 HB2 ASP A 776 22.100 0.042 24.155 1.00 37.17 H new ATOM 0 HB3 ASP A 776 22.124 -1.502 23.940 1.00 37.17 H new ATOM 2613 N HIS A 777 24.523 -2.608 22.390 1.00 36.14 N ANISOU 2613 N HIS A 777 5076 5402 3254 968 -433 151 N ATOM 2614 CA HIS A 777 24.929 -3.898 21.839 1.00 36.91 C ANISOU 2614 CA HIS A 777 5139 5446 3440 964 -427 231 C ATOM 2615 C HIS A 777 23.768 -4.886 21.679 1.00 40.82 C ANISOU 2615 C HIS A 777 5654 5887 3970 952 -304 348 C ATOM 2616 O HIS A 777 23.797 -5.715 20.772 1.00 40.02 O ANISOU 2616 O HIS A 777 5504 5713 3988 914 -279 383 O ATOM 2617 CB HIS A 777 26.077 -4.520 22.681 1.00 38.94 C ANISOU 2617 CB HIS A 777 5421 5744 3628 1046 -528 261 C ATOM 2618 CG HIS A 777 27.297 -3.641 22.821 1.00 42.90 C ANISOU 2618 CG HIS A 777 5888 6290 4122 1056 -663 146 C ATOM 2619 ND1 HIS A 777 28.103 -3.323 21.725 1.00 44.11 N ANISOU 2619 ND1 HIS A 777 5943 6401 4416 996 -707 72 N ATOM 2620 CD2 HIS A 777 27.830 -3.069 23.926 1.00 45.41 C ANISOU 2620 CD2 HIS A 777 6255 6686 4314 1121 -762 95 C ATOM 2621 CE1 HIS A 777 29.085 -2.574 22.202 1.00 43.61 C ANISOU 2621 CE1 HIS A 777 5861 6383 4325 1020 -828 -15 C ATOM 2622 NE2 HIS A 777 28.963 -2.389 23.520 1.00 45.03 N ANISOU 2622 NE2 HIS A 777 6128 6636 4346 1095 -874 -11 N ATOM 0 H HIS A 777 24.972 -2.376 23.086 1.00 36.14 H new ATOM 0 HA HIS A 777 25.255 -3.720 20.943 1.00 36.91 H new ATOM 0 HB2 HIS A 777 25.738 -4.727 23.566 1.00 38.94 H new ATOM 0 HB3 HIS A 777 26.342 -5.360 22.275 1.00 38.94 H new ATOM 0 HD2 HIS A 777 27.497 -3.123 24.793 1.00 45.41 H new ATOM 0 HE1 HIS A 777 29.773 -2.221 21.685 1.00 43.61 H new ATOM 0 HE2 HIS A 777 29.491 -1.932 24.022 1.00 45.03 H new ATOM 2623 N ASN A 778 22.734 -4.779 22.522 1.00 37.34 N ANISOU 2623 N ASN A 778 5279 5475 3433 984 -223 402 N ATOM 2624 CA ASN A 778 21.626 -5.729 22.478 1.00 37.31 C ANISOU 2624 CA ASN A 778 5286 5415 3474 976 -103 522 C ATOM 2625 C ASN A 778 20.374 -5.217 21.778 1.00 39.95 C ANISOU 2625 C ASN A 778 5585 5705 3889 903 -11 504 C ATOM 2626 O ASN A 778 19.302 -5.793 21.946 1.00 38.49 O ANISOU 2626 O ASN A 778 5410 5482 3732 900 94 598 O ATOM 2627 CB ASN A 778 21.311 -6.177 23.906 1.00 39.05 C ANISOU 2627 CB ASN A 778 5601 5690 3547 1069 -57 625 C ATOM 2628 CG ASN A 778 20.717 -5.077 24.753 1.00 55.29 C ANISOU 2628 CG ASN A 778 7719 7822 5468 1101 -25 580 C ATOM 2629 OD1 ASN A 778 21.059 -3.903 24.602 1.00 43.83 O ANISOU 2629 OD1 ASN A 778 6253 6406 3993 1081 -92 452 O ATOM 2630 ND2 ASN A 778 19.797 -5.433 25.645 1.00 44.85 N ANISOU 2630 ND2 ASN A 778 6463 6519 4061 1152 87 684 N ATOM 0 H ASN A 778 22.659 -4.167 23.121 1.00 37.34 H new ATOM 0 HA ASN A 778 21.916 -6.478 21.934 1.00 37.31 H new ATOM 0 HB2 ASN A 778 20.693 -6.924 23.876 1.00 39.05 H new ATOM 0 HB3 ASN A 778 22.125 -6.498 24.326 1.00 39.05 H new ATOM 0 HD21 ASN A 778 19.422 -4.836 26.137 1.00 44.85 H new ATOM 0 HD22 ASN A 778 19.577 -6.260 25.729 1.00 44.85 H new ATOM 2631 N GLU A 779 20.510 -4.164 20.963 1.00 37.25 N ANISOU 2631 N GLU A 779 5194 5360 3599 843 -52 389 N ATOM 2632 CA GLU A 779 19.365 -3.514 20.324 1.00 35.65 C ANISOU 2632 CA GLU A 779 4957 5122 3466 779 20 364 C ATOM 2633 C GLU A 779 19.452 -3.405 18.823 1.00 38.72 C ANISOU 2633 C GLU A 779 5270 5447 3995 697 -5 310 C ATOM 2634 O GLU A 779 20.536 -3.299 18.267 1.00 38.93 O ANISOU 2634 O GLU A 779 5267 5475 4049 684 -86 250 O ATOM 2635 CB GLU A 779 19.205 -2.085 20.885 1.00 36.68 C ANISOU 2635 CB GLU A 779 5114 5314 3507 794 9 277 C ATOM 2636 CG GLU A 779 19.051 -2.017 22.397 1.00 45.15 C ANISOU 2636 CG GLU A 779 6277 6462 4416 883 36 312 C ATOM 2637 CD GLU A 779 18.781 -0.627 22.927 1.00 60.74 C ANISOU 2637 CD GLU A 779 8280 8488 6308 899 33 217 C ATOM 2638 OE1 GLU A 779 19.699 0.224 22.882 1.00 48.45 O ANISOU 2638 OE1 GLU A 779 6716 6962 4730 897 -72 107 O ATOM 2639 OE2 GLU A 779 17.639 -0.385 23.379 1.00 54.78 O ANISOU 2639 OE2 GLU A 779 7552 7738 5523 913 139 252 O ATOM 0 H GLU A 779 21.269 -3.809 20.767 1.00 37.25 H new ATOM 0 HA GLU A 779 18.607 -4.084 20.525 1.00 35.65 H new ATOM 0 HB2 GLU A 779 19.978 -1.559 20.626 1.00 36.68 H new ATOM 0 HB3 GLU A 779 18.430 -1.672 20.473 1.00 36.68 H new ATOM 0 HG2 GLU A 779 18.325 -2.602 22.665 1.00 45.15 H new ATOM 0 HG3 GLU A 779 19.859 -2.359 22.811 1.00 45.15 H new ATOM 2640 N CYS A 780 18.300 -3.290 18.177 1.00 34.59 N ANISOU 2640 N CYS A 780 4714 4873 3555 642 62 324 N ATOM 2641 CA CYS A 780 18.202 -3.026 16.752 1.00 34.70 C ANISOU 2641 CA CYS A 780 4666 4834 3683 567 41 269 C ATOM 2642 C CYS A 780 16.970 -2.149 16.527 1.00 35.06 C ANISOU 2642 C CYS A 780 4692 4868 3762 529 97 252 C ATOM 2643 O CYS A 780 16.146 -2.000 17.429 1.00 34.45 O ANISOU 2643 O CYS A 780 4643 4811 3637 560 165 296 O ATOM 2644 CB CYS A 780 18.095 -4.336 15.980 1.00 37.11 C ANISOU 2644 CB CYS A 780 4945 5065 4091 540 53 324 C ATOM 2645 SG CYS A 780 16.488 -5.149 16.151 1.00 42.77 S ANISOU 2645 SG CYS A 780 5652 5715 4882 524 157 429 S ATOM 0 H CYS A 780 17.536 -3.365 18.565 1.00 34.59 H new ATOM 0 HA CYS A 780 18.994 -2.568 16.431 1.00 34.70 H new ATOM 0 HB2 CYS A 780 18.263 -4.164 15.040 1.00 37.11 H new ATOM 0 HB3 CYS A 780 18.789 -4.941 16.286 1.00 37.11 H new ATOM 0 HG CYS A 780 16.514 -5.894 17.091 1.00 42.77 H new ATOM 2646 N LEU A 781 16.848 -1.568 15.335 1.00 31.24 N ANISOU 2646 N LEU A 781 4161 4352 3357 467 70 193 N ATOM 2647 CA LEU A 781 15.674 -0.782 14.940 1.00 30.59 C ANISOU 2647 CA LEU A 781 4049 4247 3327 428 112 180 C ATOM 2648 C LEU A 781 15.050 -1.460 13.710 1.00 32.56 C ANISOU 2648 C LEU A 781 4253 4421 3697 370 115 203 C ATOM 2649 O LEU A 781 15.759 -1.748 12.757 1.00 31.42 O ANISOU 2649 O LEU A 781 4095 4257 3586 345 61 169 O ATOM 2650 CB LEU A 781 16.045 0.677 14.627 1.00 29.91 C ANISOU 2650 CB LEU A 781 3950 4190 3224 410 69 88 C ATOM 2651 CG LEU A 781 14.874 1.587 14.218 1.00 34.08 C ANISOU 2651 CG LEU A 781 4445 4694 3812 374 107 74 C ATOM 2652 CD1 LEU A 781 13.955 1.894 15.410 1.00 34.41 C ANISOU 2652 CD1 LEU A 781 4510 4758 3806 416 185 105 C ATOM 2653 CD2 LEU A 781 15.387 2.864 13.582 1.00 35.29 C ANISOU 2653 CD2 LEU A 781 4577 4856 3976 347 54 -10 C ATOM 0 H LEU A 781 17.451 -1.618 14.724 1.00 31.24 H new ATOM 0 HA LEU A 781 15.040 -0.754 15.673 1.00 30.59 H new ATOM 0 HB2 LEU A 781 16.474 1.060 15.409 1.00 29.91 H new ATOM 0 HB3 LEU A 781 16.702 0.681 13.913 1.00 29.91 H new ATOM 0 HG LEU A 781 14.344 1.111 13.560 1.00 34.08 H new ATOM 0 HD11 LEU A 781 13.229 2.468 15.120 1.00 34.41 H new ATOM 0 HD12 LEU A 781 13.591 1.066 15.760 1.00 34.41 H new ATOM 0 HD13 LEU A 781 14.463 2.342 16.104 1.00 34.41 H new ATOM 0 HD21 LEU A 781 14.636 3.425 13.331 1.00 35.29 H new ATOM 0 HD22 LEU A 781 15.947 3.339 14.216 1.00 35.29 H new ATOM 0 HD23 LEU A 781 15.906 2.646 12.792 1.00 35.29 H new ATOM 2654 N ILE A 782 13.763 -1.782 13.777 1.00 28.75 N ANISOU 2654 N ILE A 782 3747 3896 3280 354 178 261 N ATOM 2655 CA ILE A 782 13.040 -2.423 12.681 1.00 29.00 C ANISOU 2655 CA ILE A 782 3733 3852 3434 299 171 278 C ATOM 2656 C ILE A 782 12.105 -1.368 12.089 1.00 33.06 C ANISOU 2656 C ILE A 782 4206 4352 4001 260 173 245 C ATOM 2657 O ILE A 782 11.296 -0.763 12.817 1.00 33.45 O ANISOU 2657 O ILE A 782 4247 4416 4046 275 234 267 O ATOM 2658 CB ILE A 782 12.255 -3.673 13.187 1.00 33.48 C ANISOU 2658 CB ILE A 782 4290 4364 4065 307 236 375 C ATOM 2659 CG1 ILE A 782 13.181 -4.671 13.922 1.00 34.41 C ANISOU 2659 CG1 ILE A 782 4453 4497 4125 356 238 421 C ATOM 2660 CG2 ILE A 782 11.487 -4.368 12.039 1.00 33.25 C ANISOU 2660 CG2 ILE A 782 4208 4247 4178 247 214 381 C ATOM 2661 CD1 ILE A 782 12.441 -5.608 14.922 1.00 34.78 C ANISOU 2661 CD1 ILE A 782 4506 4514 4195 387 329 536 C ATOM 0 H ILE A 782 13.277 -1.633 14.470 1.00 28.75 H new ATOM 0 HA ILE A 782 13.652 -2.747 12.002 1.00 29.00 H new ATOM 0 HB ILE A 782 11.600 -3.355 13.828 1.00 33.48 H new ATOM 0 HG12 ILE A 782 13.641 -5.215 13.264 1.00 34.41 H new ATOM 0 HG13 ILE A 782 13.860 -4.173 14.403 1.00 34.41 H new ATOM 0 HG21 ILE A 782 11.012 -5.138 12.387 1.00 33.25 H new ATOM 0 HG22 ILE A 782 10.852 -3.746 11.651 1.00 33.25 H new ATOM 0 HG23 ILE A 782 12.114 -4.657 11.358 1.00 33.25 H new ATOM 0 HD11 ILE A 782 13.081 -6.203 15.343 1.00 34.78 H new ATOM 0 HD12 ILE A 782 12.001 -5.074 15.602 1.00 34.78 H new ATOM 0 HD13 ILE A 782 11.779 -6.132 14.445 1.00 34.78 H new ATOM 2662 N AILE A 783 12.231 -1.138 10.781 0.50 28.74 N ANISOU 2662 N AILE A 783 3637 3781 3501 215 109 194 N ATOM 2663 N BILE A 783 12.246 -1.091 10.785 0.50 28.76 N ANISOU 2663 N BILE A 783 3640 3785 3501 215 109 192 N ATOM 2664 CA AILE A 783 11.434 -0.145 10.057 0.50 27.72 C ANISOU 2664 CA AILE A 783 3471 3638 3425 179 94 164 C ATOM 2665 CA BILE A 783 11.385 -0.109 10.109 0.50 27.74 C ANISOU 2665 CA BILE A 783 3472 3641 3427 180 98 166 C ATOM 2666 C AILE A 783 10.604 -0.821 8.980 0.50 30.30 C ANISOU 2666 C AILE A 783 3758 3894 3861 132 63 177 C ATOM 2667 C BILE A 783 10.604 -0.774 8.992 0.50 30.21 C ANISOU 2667 C BILE A 783 3746 3884 3847 133 64 176 C ATOM 2668 O AILE A 783 11.162 -1.367 8.025 0.50 30.86 O ANISOU 2668 O AILE A 783 3842 3946 3939 113 5 147 O ATOM 2669 O BILE A 783 11.194 -1.257 8.023 0.50 30.64 O ANISOU 2669 O BILE A 783 3815 3922 3905 114 5 144 O ATOM 2670 CB AILE A 783 12.290 1.027 9.487 0.50 29.75 C ANISOU 2670 CB AILE A 783 3740 3935 3628 173 44 92 C ATOM 2671 CB BILE A 783 12.096 1.195 9.646 0.50 29.85 C ANISOU 2671 CB BILE A 783 3749 3949 3643 175 54 96 C ATOM 2672 CG1AILE A 783 13.407 1.482 10.468 0.50 29.04 C ANISOU 2672 CG1AILE A 783 3690 3908 3437 217 49 65 C ATOM 2673 CG1BILE A 783 12.973 1.797 10.782 0.50 28.99 C ANISOU 2673 CG1BILE A 783 3678 3904 3434 222 72 72 C ATOM 2674 CG2AILE A 783 11.368 2.208 9.161 0.50 31.32 C ANISOU 2674 CG2AILE A 783 3904 4124 3873 151 48 78 C ATOM 2675 CG2BILE A 783 11.019 2.209 9.199 0.50 30.14 C ANISOU 2675 CG2BILE A 783 3744 3965 3742 148 58 88 C ATOM 2676 CD1AILE A 783 14.840 0.841 10.241 0.50 27.26 C ANISOU 2676 CD1AILE A 783 3492 3701 3167 230 4 43 C ATOM 2677 CD1BILE A 783 13.840 2.975 10.399 0.50 30.93 C ANISOU 2677 CD1BILE A 783 3926 4180 3645 216 27 3 C ATOM 0 H AILE A 783 12.790 -1.560 10.282 0.50 28.76 H new ATOM 0 H BILE A 783 12.833 -1.460 10.276 0.50 28.76 H new ATOM 0 HA AILE A 783 10.831 0.265 10.697 0.50 27.74 H new ATOM 0 HA BILE A 783 10.765 0.206 10.785 0.50 27.74 H new ATOM 0 HB AILE A 783 12.732 0.708 8.685 0.50 29.85 H new ATOM 0 HB BILE A 783 12.688 0.990 8.906 0.50 29.85 H new ATOM 0 HG12AILE A 783 13.491 2.446 10.408 0.50 28.99 H new ATOM 0 HG12BILE A 783 12.389 2.071 11.506 0.50 28.99 H new ATOM 0 HG13AILE A 783 13.121 1.278 11.372 0.50 28.99 H new ATOM 0 HG13BILE A 783 13.546 1.096 11.129 0.50 28.99 H new ATOM 0 HG21AILE A 783 11.894 2.941 8.806 0.50 30.14 H new ATOM 0 HG21BILE A 783 11.447 3.029 8.907 0.50 30.14 H new ATOM 0 HG22AILE A 783 10.711 1.934 8.503 0.50 30.14 H new ATOM 0 HG22BILE A 783 10.506 1.834 8.466 0.50 30.14 H new ATOM 0 HG23AILE A 783 10.915 2.497 9.968 0.50 30.14 H new ATOM 0 HG23BILE A 783 10.427 2.401 9.943 0.50 30.14 H new ATOM 0 HD11AILE A 783 15.459 1.190 10.902 0.50 30.93 H new ATOM 0 HD11BILE A 783 14.343 3.272 11.173 0.50 30.93 H new ATOM 0 HD12AILE A 783 14.781 -0.123 10.331 0.50 30.93 H new ATOM 0 HD12BILE A 783 14.455 2.710 9.697 0.50 30.93 H new ATOM 0 HD13AILE A 783 15.157 1.064 9.352 0.50 30.93 H new ATOM 0 HD13BILE A 783 13.279 3.700 10.080 0.50 30.93 H new ATOM 2678 N THR A 784 9.276 -0.770 9.128 1.00 25.31 N ANISOU 2678 N THR A 784 3077 3223 3318 115 100 217 N ATOM 2679 CA THR A 784 8.346 -1.367 8.176 1.00 25.07 C ANISOU 2679 CA THR A 784 2998 3120 3409 70 60 227 C ATOM 2680 C THR A 784 7.523 -0.320 7.441 1.00 26.70 C ANISOU 2680 C THR A 784 3161 3316 3667 42 25 202 C ATOM 2681 O THR A 784 6.875 0.510 8.065 1.00 27.91 O ANISOU 2681 O THR A 784 3287 3483 3836 54 77 221 O ATOM 2682 CB THR A 784 7.422 -2.362 8.934 1.00 36.08 C ANISOU 2682 CB THR A 784 4352 4459 4899 70 129 307 C ATOM 2683 OG1 THR A 784 8.248 -3.222 9.718 1.00 38.34 O ANISOU 2683 OG1 THR A 784 4684 4760 5123 106 166 339 O ATOM 2684 CG2 THR A 784 6.565 -3.199 8.008 1.00 35.29 C ANISOU 2684 CG2 THR A 784 4197 4271 4941 21 77 312 C ATOM 0 H ATHR A 784 8.891 -0.383 9.792 0.50 25.31 H new ATOM 0 H BTHR A 784 8.882 -0.407 9.801 0.50 25.31 H new ATOM 0 HA THR A 784 8.858 -1.838 7.500 1.00 25.07 H new ATOM 0 HB THR A 784 6.814 -1.845 9.485 1.00 36.08 H new ATOM 0 HG1 THR A 784 8.415 -2.855 10.455 1.00 38.34 H new ATOM 0 HG21 THR A 784 6.012 -3.799 8.533 1.00 35.29 H new ATOM 0 HG22 THR A 784 5.998 -2.617 7.478 1.00 35.29 H new ATOM 0 HG23 THR A 784 7.135 -3.718 7.420 1.00 35.29 H new ATOM 2685 N GLY A 785 7.497 -0.403 6.126 1.00 22.87 N ANISOU 2685 N GLY A 785 2673 2805 3210 9 -63 162 N ATOM 2686 CA GLY A 785 6.648 0.476 5.332 1.00 23.57 C ANISOU 2686 CA GLY A 785 2721 2879 3356 -16 -110 148 C ATOM 2687 C GLY A 785 7.300 1.605 4.578 1.00 27.94 C ANISOU 2687 C GLY A 785 3309 3478 3831 -14 -157 100 C ATOM 2688 O GLY A 785 6.605 2.307 3.850 1.00 28.98 O ANISOU 2688 O GLY A 785 3410 3594 4008 -32 -203 95 O ATOM 0 H GLY A 785 7.963 -0.962 5.667 1.00 22.87 H new ATOM 0 HA2 GLY A 785 6.172 -0.073 4.690 1.00 23.57 H new ATOM 0 HA3 GLY A 785 5.983 0.860 5.925 1.00 23.57 H new ATOM 2689 N THR A 786 8.611 1.790 4.699 1.00 24.10 N ANISOU 2689 N THR A 786 2880 3041 3236 7 -148 71 N ATOM 2690 CA THR A 786 9.224 2.910 3.950 1.00 25.04 C ANISOU 2690 CA THR A 786 3023 3196 3297 7 -184 35 C ATOM 2691 C THR A 786 9.128 2.664 2.466 1.00 29.68 C ANISOU 2691 C THR A 786 3625 3762 3890 -17 -266 13 C ATOM 2692 O THR A 786 9.095 1.525 2.019 1.00 29.36 O ANISOU 2692 O THR A 786 3597 3692 3867 -27 -300 4 O ATOM 2693 CB THR A 786 10.652 3.235 4.391 1.00 30.55 C ANISOU 2693 CB THR A 786 3765 3945 3896 32 -157 8 C ATOM 2694 OG1 THR A 786 11.485 2.118 4.066 1.00 31.24 O ANISOU 2694 OG1 THR A 786 3888 4032 3948 36 -175 -5 O ATOM 2695 CG2 THR A 786 10.730 3.586 5.861 1.00 24.05 C ANISOU 2695 CG2 THR A 786 2936 3148 3052 62 -89 20 C ATOM 0 H THR A 786 9.145 1.315 5.177 1.00 24.10 H new ATOM 0 HA THR A 786 8.711 3.705 4.164 1.00 25.04 H new ATOM 0 HB THR A 786 10.963 4.023 3.919 1.00 30.55 H new ATOM 0 HG1 THR A 786 11.255 1.454 4.526 1.00 31.24 H new ATOM 0 HG21 THR A 786 11.649 3.784 6.098 1.00 24.05 H new ATOM 0 HG22 THR A 786 10.176 4.362 6.038 1.00 24.05 H new ATOM 0 HG23 THR A 786 10.415 2.837 6.390 1.00 24.05 H new ATOM 2696 N GLU A 787 9.012 3.745 1.718 1.00 25.80 N ANISOU 2696 N GLU A 787 3134 3283 3387 -22 -300 6 N ATOM 2697 CA GLU A 787 8.814 3.723 0.283 1.00 23.71 C ANISOU 2697 CA GLU A 787 2890 3006 3113 -37 -381 -9 C ATOM 2698 C GLU A 787 10.076 4.211 -0.406 1.00 26.61 C ANISOU 2698 C GLU A 787 3315 3417 3378 -24 -382 -32 C ATOM 2699 O GLU A 787 10.748 5.132 0.083 1.00 23.59 O ANISOU 2699 O GLU A 787 2933 3065 2966 -12 -334 -29 O ATOM 2700 CB GLU A 787 7.636 4.663 -0.037 1.00 24.36 C ANISOU 2700 CB GLU A 787 2923 3066 3265 -48 -416 16 C ATOM 2701 CG GLU A 787 7.264 4.753 -1.509 1.00 30.86 C ANISOU 2701 CG GLU A 787 3769 3880 4077 -58 -513 7 C ATOM 2702 CD GLU A 787 5.923 5.398 -1.804 1.00 45.36 C ANISOU 2702 CD GLU A 787 5545 5683 6007 -68 -564 37 C ATOM 2703 OE1 GLU A 787 5.035 5.373 -0.921 1.00 39.80 O ANISOU 2703 OE1 GLU A 787 4770 4947 5407 -75 -530 61 O ATOM 2704 OE2 GLU A 787 5.733 5.860 -2.951 1.00 42.50 O ANISOU 2704 OE2 GLU A 787 5206 5325 5616 -66 -640 38 O ATOM 0 H GLU A 787 9.048 4.540 2.043 1.00 25.80 H new ATOM 0 HA GLU A 787 8.621 2.825 -0.029 1.00 23.71 H new ATOM 0 HB2 GLU A 787 6.859 4.366 0.461 1.00 24.36 H new ATOM 0 HB3 GLU A 787 7.854 5.553 0.282 1.00 24.36 H new ATOM 0 HG2 GLU A 787 7.955 5.253 -1.971 1.00 30.86 H new ATOM 0 HG3 GLU A 787 7.264 3.858 -1.882 1.00 30.86 H new ATOM 2705 N GLN A 788 10.392 3.588 -1.531 1.00 24.07 N ANISOU 2705 N GLN A 788 3041 3096 3009 -24 -433 -57 N ATOM 2706 CA GLN A 788 11.537 3.981 -2.339 1.00 25.36 C ANISOU 2706 CA GLN A 788 3261 3299 3078 -9 -426 -73 C ATOM 2707 C GLN A 788 11.072 5.048 -3.341 1.00 31.43 C ANISOU 2707 C GLN A 788 4037 4073 3831 -11 -470 -50 C ATOM 2708 O GLN A 788 10.169 4.778 -4.122 1.00 31.49 O ANISOU 2708 O GLN A 788 4051 4059 3856 -18 -546 -53 O ATOM 2709 CB GLN A 788 12.132 2.760 -3.074 1.00 25.68 C ANISOU 2709 CB GLN A 788 3356 3338 3063 1 -450 -113 C ATOM 2710 CG GLN A 788 13.473 3.121 -3.722 1.00 27.53 C ANISOU 2710 CG GLN A 788 3641 3615 3203 23 -414 -124 C ATOM 2711 CD GLN A 788 14.108 1.984 -4.483 1.00 43.47 C ANISOU 2711 CD GLN A 788 5718 5634 5165 40 -426 -169 C ATOM 2712 OE1 GLN A 788 13.892 0.804 -4.174 1.00 36.20 O ANISOU 2712 OE1 GLN A 788 4794 4679 4280 37 -444 -196 O ATOM 2713 NE2 GLN A 788 14.942 2.320 -5.482 1.00 26.84 N ANISOU 2713 NE2 GLN A 788 3665 3562 2971 62 -408 -176 N ATOM 0 H GLN A 788 9.948 2.924 -1.849 1.00 24.07 H new ATOM 0 HA GLN A 788 12.235 4.344 -1.771 1.00 25.36 H new ATOM 0 HB2 GLN A 788 12.256 2.029 -2.449 1.00 25.68 H new ATOM 0 HB3 GLN A 788 11.512 2.451 -3.753 1.00 25.68 H new ATOM 0 HG2 GLN A 788 13.340 3.868 -4.326 1.00 27.53 H new ATOM 0 HG3 GLN A 788 14.086 3.419 -3.032 1.00 27.53 H new ATOM 0 HE21 GLN A 788 15.072 3.148 -5.673 1.00 26.84 H new ATOM 0 HE22 GLN A 788 15.346 1.707 -5.930 1.00 26.84 H new ATOM 2714 N TYR A 789 11.691 6.243 -3.315 1.00 29.33 N ANISOU 2714 N TYR A 789 3772 3833 3541 -3 -427 -28 N ATOM 2715 CA TYR A 789 11.329 7.382 -4.175 1.00 28.59 C ANISOU 2715 CA TYR A 789 3685 3741 3438 -1 -456 8 C ATOM 2716 C TYR A 789 12.310 7.658 -5.286 1.00 32.77 C ANISOU 2716 C TYR A 789 4277 4302 3870 17 -445 15 C ATOM 2717 O TYR A 789 11.972 8.395 -6.219 1.00 33.59 O ANISOU 2717 O TYR A 789 4403 4410 3948 24 -479 50 O ATOM 2718 CB TYR A 789 11.219 8.654 -3.321 1.00 29.24 C ANISOU 2718 CB TYR A 789 3712 3814 3583 -5 -410 35 C ATOM 2719 CG TYR A 789 9.999 8.655 -2.433 1.00 29.99 C ANISOU 2719 CG TYR A 789 3744 3875 3774 -15 -420 41 C ATOM 2720 CD1 TYR A 789 10.040 8.094 -1.155 1.00 31.09 C ANISOU 2720 CD1 TYR A 789 3856 4012 3945 -16 -372 20 C ATOM 2721 CD2 TYR A 789 8.798 9.221 -2.864 1.00 30.34 C ANISOU 2721 CD2 TYR A 789 3756 3891 3880 -19 -472 72 C ATOM 2722 CE1 TYR A 789 8.913 8.091 -0.330 1.00 30.72 C ANISOU 2722 CE1 TYR A 789 3752 3935 3984 -20 -363 32 C ATOM 2723 CE2 TYR A 789 7.659 9.206 -2.055 1.00 31.23 C ANISOU 2723 CE2 TYR A 789 3802 3970 4095 -26 -470 80 C ATOM 2724 CZ TYR A 789 7.731 8.665 -0.778 1.00 37.93 C ANISOU 2724 CZ TYR A 789 4625 4818 4970 -27 -407 62 C ATOM 2725 OH TYR A 789 6.622 8.673 0.037 1.00 37.66 O ANISOU 2725 OH TYR A 789 4525 4751 5033 -29 -387 76 O ATOM 0 H TYR A 789 12.346 6.414 -2.785 1.00 29.33 H new ATOM 0 HA TYR A 789 10.485 7.139 -4.587 1.00 28.59 H new ATOM 0 HB2 TYR A 789 12.014 8.740 -2.772 1.00 29.24 H new ATOM 0 HB3 TYR A 789 11.191 9.429 -3.904 1.00 29.24 H new ATOM 0 HD1 TYR A 789 10.832 7.716 -0.848 1.00 31.09 H new ATOM 0 HD2 TYR A 789 8.755 9.615 -3.705 1.00 30.34 H new ATOM 0 HE1 TYR A 789 8.954 7.706 0.516 1.00 30.72 H new ATOM 0 HE2 TYR A 789 6.857 9.556 -2.370 1.00 31.23 H new ATOM 0 HH TYR A 789 6.853 8.506 0.827 1.00 37.66 H new ATOM 2726 N SER A 790 13.534 7.132 -5.166 1.00 27.91 N ANISOU 2726 N SER A 790 3689 3711 3206 27 -391 -12 N ATOM 2727 CA SER A 790 14.582 7.364 -6.145 1.00 28.29 C ANISOU 2727 CA SER A 790 3790 3789 3167 47 -358 -2 C ATOM 2728 C SER A 790 15.291 6.070 -6.523 1.00 32.46 C ANISOU 2728 C SER A 790 4369 4333 3631 64 -350 -49 C ATOM 2729 O SER A 790 15.297 5.079 -5.781 1.00 31.77 O ANISOU 2729 O SER A 790 4264 4232 3576 59 -352 -87 O ATOM 2730 CB SER A 790 15.632 8.313 -5.553 1.00 30.85 C ANISOU 2730 CB SER A 790 4080 4123 3520 45 -278 19 C ATOM 2731 OG SER A 790 15.107 9.603 -5.292 1.00 38.33 O ANISOU 2731 OG SER A 790 4985 5050 4529 33 -279 59 O ATOM 0 H SER A 790 13.773 6.630 -4.510 1.00 27.91 H new ATOM 0 HA SER A 790 14.165 7.744 -6.934 1.00 28.29 H new ATOM 0 HB2 SER A 790 15.979 7.935 -4.730 1.00 30.85 H new ATOM 0 HB3 SER A 790 16.379 8.389 -6.167 1.00 30.85 H new ATOM 0 HG SER A 790 14.965 9.687 -4.468 1.00 38.33 H new ATOM 2732 N GLU A 791 15.971 6.151 -7.631 1.00 29.23 N ANISOU 2732 N GLU A 791 4020 3952 3134 89 -327 -41 N ATOM 2733 CA GLU A 791 16.868 5.160 -8.190 1.00 29.49 C ANISOU 2733 CA GLU A 791 4108 4004 3093 115 -298 -82 C ATOM 2734 C GLU A 791 18.209 5.859 -8.264 1.00 34.51 C ANISOU 2734 C GLU A 791 4733 4664 3713 128 -200 -51 C ATOM 2735 O GLU A 791 18.278 7.096 -8.357 1.00 33.68 O ANISOU 2735 O GLU A 791 4607 4562 3628 121 -172 5 O ATOM 2736 CB GLU A 791 16.402 4.733 -9.579 1.00 31.41 C ANISOU 2736 CB GLU A 791 4439 4261 3236 140 -357 -99 C ATOM 2737 CG GLU A 791 15.099 3.961 -9.513 1.00 42.69 C ANISOU 2737 CG GLU A 791 5865 5656 4700 123 -465 -137 C ATOM 2738 CD GLU A 791 14.651 3.351 -10.825 1.00 69.51 C ANISOU 2738 CD GLU A 791 9351 9061 7999 149 -544 -177 C ATOM 2739 OE1 GLU A 791 15.501 3.185 -11.730 1.00 65.60 O ANISOU 2739 OE1 GLU A 791 8931 8601 7392 188 -501 -190 O ATOM 2740 OE2 GLU A 791 13.453 3.007 -10.937 1.00 65.91 O ANISOU 2740 OE2 GLU A 791 8887 8575 7581 133 -649 -198 O ATOM 0 H GLU A 791 15.921 6.850 -8.130 1.00 29.23 H new ATOM 0 HA GLU A 791 16.904 4.352 -7.655 1.00 29.49 H new ATOM 0 HB2 GLU A 791 16.287 5.517 -10.139 1.00 31.41 H new ATOM 0 HB3 GLU A 791 17.084 4.184 -9.996 1.00 31.41 H new ATOM 0 HG2 GLU A 791 15.191 3.253 -8.857 1.00 42.69 H new ATOM 0 HG3 GLU A 791 14.402 4.555 -9.193 1.00 42.69 H new ATOM 2741 N TYR A 792 19.271 5.080 -8.203 1.00 31.81 N ANISOU 2741 N TYR A 792 4401 4333 3353 148 -146 -85 N ATOM 2742 CA TYR A 792 20.617 5.616 -8.163 1.00 31.31 C ANISOU 2742 CA TYR A 792 4310 4286 3299 158 -51 -60 C ATOM 2743 C TYR A 792 21.545 4.682 -8.952 1.00 36.51 C ANISOU 2743 C TYR A 792 5023 4964 3883 198 0 -93 C ATOM 2744 O TYR A 792 21.153 3.570 -9.303 1.00 35.67 O ANISOU 2744 O TYR A 792 4969 4854 3730 214 -45 -146 O ATOM 2745 CB TYR A 792 21.073 5.674 -6.675 1.00 31.34 C ANISOU 2745 CB TYR A 792 4229 4274 3406 137 -35 -74 C ATOM 2746 CG TYR A 792 21.301 4.303 -6.053 1.00 31.96 C ANISOU 2746 CG TYR A 792 4304 4343 3495 147 -50 -129 C ATOM 2747 CD1 TYR A 792 20.230 3.547 -5.578 1.00 33.10 C ANISOU 2747 CD1 TYR A 792 4455 4464 3656 135 -120 -155 C ATOM 2748 CD2 TYR A 792 22.571 3.719 -6.041 1.00 32.23 C ANISOU 2748 CD2 TYR A 792 4329 4386 3529 172 9 -150 C ATOM 2749 CE1 TYR A 792 20.415 2.256 -5.092 1.00 31.73 C ANISOU 2749 CE1 TYR A 792 4283 4275 3498 146 -130 -197 C ATOM 2750 CE2 TYR A 792 22.771 2.429 -5.536 1.00 32.30 C ANISOU 2750 CE2 TYR A 792 4339 4381 3551 187 -6 -195 C ATOM 2751 CZ TYR A 792 21.685 1.702 -5.066 1.00 38.21 C ANISOU 2751 CZ TYR A 792 5100 5105 4315 173 -76 -216 C ATOM 2752 OH TYR A 792 21.818 0.406 -4.636 1.00 35.50 O ANISOU 2752 OH TYR A 792 4759 4738 3990 188 -89 -253 O ATOM 0 H TYR A 792 19.233 4.221 -8.183 1.00 31.81 H new ATOM 0 HA TYR A 792 20.647 6.504 -8.553 1.00 31.31 H new ATOM 0 HB2 TYR A 792 21.893 6.188 -6.616 1.00 31.34 H new ATOM 0 HB3 TYR A 792 20.403 6.148 -6.158 1.00 31.34 H new ATOM 0 HD1 TYR A 792 19.375 3.913 -5.586 1.00 33.10 H new ATOM 0 HD2 TYR A 792 23.296 4.196 -6.375 1.00 32.23 H new ATOM 0 HE1 TYR A 792 19.687 1.766 -4.785 1.00 31.73 H new ATOM 0 HE2 TYR A 792 23.625 2.061 -5.515 1.00 32.30 H new ATOM 0 HH TYR A 792 21.057 0.067 -4.528 1.00 35.50 H new ATOM 2753 N THR A 793 22.782 5.133 -9.179 1.00 33.36 N ANISOU 2753 N THR A 793 4604 4582 3490 214 96 -65 N ATOM 2754 CA THR A 793 23.869 4.344 -9.742 1.00 34.16 C ANISOU 2754 CA THR A 793 4734 4700 3546 255 169 -92 C ATOM 2755 C THR A 793 25.049 4.633 -8.848 1.00 36.08 C ANISOU 2755 C THR A 793 4882 4934 3893 245 234 -81 C ATOM 2756 O THR A 793 25.058 5.657 -8.155 1.00 33.62 O ANISOU 2756 O THR A 793 4503 4609 3661 212 232 -45 O ATOM 2757 CB THR A 793 24.205 4.683 -11.216 1.00 40.90 C ANISOU 2757 CB THR A 793 5666 5587 4288 294 236 -56 C ATOM 2758 OG1 THR A 793 24.463 6.076 -11.347 1.00 45.18 O ANISOU 2758 OG1 THR A 793 6171 6132 4865 278 289 27 O ATOM 2759 CG2 THR A 793 23.140 4.231 -12.188 1.00 36.82 C ANISOU 2759 CG2 THR A 793 5256 5084 3651 314 159 -81 C ATOM 0 H THR A 793 23.015 5.941 -9.000 1.00 33.36 H new ATOM 0 HA THR A 793 23.620 3.407 -9.769 1.00 34.16 H new ATOM 0 HB THR A 793 25.004 4.185 -11.449 1.00 40.90 H new ATOM 0 HG1 THR A 793 24.646 6.253 -12.147 1.00 45.18 H new ATOM 0 HG21 THR A 793 23.403 4.469 -13.091 1.00 36.82 H new ATOM 0 HG22 THR A 793 23.032 3.269 -12.126 1.00 36.82 H new ATOM 0 HG23 THR A 793 22.300 4.665 -11.972 1.00 36.82 H new ATOM 2760 N GLY A 794 26.037 3.753 -8.889 1.00 33.28 N ANISOU 2760 N GLY A 794 4522 4582 3542 277 287 -116 N ATOM 2761 CA GLY A 794 27.259 3.936 -8.129 1.00 33.30 C ANISOU 2761 CA GLY A 794 4430 4576 3647 274 344 -109 C ATOM 2762 C GLY A 794 27.107 3.691 -6.645 1.00 34.96 C ANISOU 2762 C GLY A 794 4573 4765 3944 248 274 -137 C ATOM 2763 O GLY A 794 26.082 3.198 -6.162 1.00 31.21 O ANISOU 2763 O GLY A 794 4125 4279 3453 234 193 -163 O ATOM 0 H GLY A 794 26.017 3.033 -9.359 1.00 33.28 H new ATOM 0 HA2 GLY A 794 27.938 3.337 -8.478 1.00 33.30 H new ATOM 0 HA3 GLY A 794 27.581 4.841 -8.266 1.00 33.30 H new ATOM 2764 N TYR A 795 28.148 4.077 -5.921 1.00 33.22 N ANISOU 2764 N TYR A 795 4264 4539 3820 242 306 -130 N ATOM 2765 CA TYR A 795 28.312 3.832 -4.507 1.00 32.28 C ANISOU 2765 CA TYR A 795 4081 4407 3776 230 250 -157 C ATOM 2766 C TYR A 795 29.427 4.735 -4.041 1.00 37.26 C ANISOU 2766 C TYR A 795 4615 5031 4509 218 287 -138 C ATOM 2767 O TYR A 795 30.400 4.899 -4.769 1.00 37.37 O ANISOU 2767 O TYR A 795 4604 5047 4547 235 371 -116 O ATOM 2768 CB TYR A 795 28.770 2.354 -4.338 1.00 32.37 C ANISOU 2768 CB TYR A 795 4105 4414 3781 268 248 -199 C ATOM 2769 CG TYR A 795 28.726 1.866 -2.907 1.00 32.40 C ANISOU 2769 CG TYR A 795 4068 4408 3837 264 179 -221 C ATOM 2770 CD1 TYR A 795 27.539 1.413 -2.343 1.00 32.87 C ANISOU 2770 CD1 TYR A 795 4167 4459 3865 251 108 -231 C ATOM 2771 CD2 TYR A 795 29.862 1.896 -2.104 1.00 33.12 C ANISOU 2771 CD2 TYR A 795 4076 4497 4010 276 183 -226 C ATOM 2772 CE1 TYR A 795 27.486 0.991 -1.020 1.00 33.58 C ANISOU 2772 CE1 TYR A 795 4226 4543 3989 253 56 -240 C ATOM 2773 CE2 TYR A 795 29.825 1.457 -0.782 1.00 33.38 C ANISOU 2773 CE2 TYR A 795 4082 4528 4074 280 115 -242 C ATOM 2774 CZ TYR A 795 28.636 0.992 -0.249 1.00 37.98 C ANISOU 2774 CZ TYR A 795 4715 5105 4609 271 57 -246 C ATOM 2775 OH TYR A 795 28.582 0.546 1.052 1.00 36.98 O ANISOU 2775 OH TYR A 795 4570 4980 4502 282 0 -251 O ATOM 0 H TYR A 795 28.808 4.510 -6.262 1.00 33.22 H new ATOM 0 HA TYR A 795 27.496 3.993 -4.009 1.00 32.28 H new ATOM 0 HB2 TYR A 795 28.206 1.784 -4.884 1.00 32.37 H new ATOM 0 HB3 TYR A 795 29.675 2.263 -4.675 1.00 32.37 H new ATOM 0 HD1 TYR A 795 26.766 1.392 -2.860 1.00 32.87 H new ATOM 0 HD2 TYR A 795 30.661 2.215 -2.456 1.00 33.12 H new ATOM 0 HE1 TYR A 795 26.679 0.708 -0.653 1.00 33.58 H new ATOM 0 HE2 TYR A 795 30.595 1.476 -0.261 1.00 33.38 H new ATOM 0 HH TYR A 795 29.357 0.535 1.377 1.00 36.98 H new ATOM 2776 N ALA A 796 29.319 5.272 -2.812 1.00 33.77 N ANISOU 2776 N ALA A 796 4117 4581 4133 192 225 -149 N ATOM 2777 CA ALA A 796 30.327 6.160 -2.225 1.00 34.25 C ANISOU 2777 CA ALA A 796 4080 4629 4306 176 236 -145 C ATOM 2778 C ALA A 796 30.699 7.313 -3.170 1.00 38.16 C ANISOU 2778 C ALA A 796 4550 5110 4839 158 314 -94 C ATOM 2779 O ALA A 796 29.799 8.056 -3.555 1.00 36.80 O ANISOU 2779 O ALA A 796 4418 4934 4631 136 308 -65 O ATOM 2780 CB ALA A 796 31.558 5.375 -1.728 1.00 35.10 C ANISOU 2780 CB ALA A 796 4126 4737 4475 206 241 -172 C ATOM 0 H ALA A 796 28.648 5.125 -2.294 1.00 33.77 H new ATOM 0 HA ALA A 796 29.929 6.571 -1.442 1.00 34.25 H new ATOM 0 HB1 ALA A 796 32.203 5.991 -1.347 1.00 35.10 H new ATOM 0 HB2 ALA A 796 31.283 4.736 -1.052 1.00 35.10 H new ATOM 0 HB3 ALA A 796 31.963 4.903 -2.472 1.00 35.10 H new ATOM 2781 N GLU A 797 31.965 7.442 -3.596 1.00 35.58 N ANISOU 2781 N GLU A 797 4157 4774 4586 170 391 -75 N ATOM 2782 CA GLU A 797 32.378 8.561 -4.455 1.00 36.32 C ANISOU 2782 CA GLU A 797 4219 4849 4731 153 479 -14 C ATOM 2783 C GLU A 797 31.774 8.520 -5.885 1.00 39.82 C ANISOU 2783 C GLU A 797 4764 5312 5052 172 548 36 C ATOM 2784 O GLU A 797 31.832 9.539 -6.579 1.00 39.96 O ANISOU 2784 O GLU A 797 4774 5316 5092 157 611 100 O ATOM 2785 CB GLU A 797 33.921 8.704 -4.498 1.00 38.67 C ANISOU 2785 CB GLU A 797 4408 5127 5159 160 551 -1 C ATOM 2786 CG GLU A 797 34.637 7.573 -5.241 1.00 53.93 C ANISOU 2786 CG GLU A 797 6360 7081 7049 212 633 -2 C ATOM 2787 CD GLU A 797 34.935 6.272 -4.508 1.00 83.81 C ANISOU 2787 CD GLU A 797 10137 10877 10828 244 574 -64 C ATOM 2788 OE1 GLU A 797 34.361 6.037 -3.417 1.00 63.54 O ANISOU 2788 OE1 GLU A 797 7578 8314 8252 231 462 -108 O ATOM 2789 OE2 GLU A 797 35.749 5.480 -5.040 1.00 84.08 O ANISOU 2789 OE2 GLU A 797 10162 10918 10869 286 648 -66 O ATOM 0 H GLU A 797 32.597 6.893 -3.399 1.00 35.58 H new ATOM 0 HA GLU A 797 32.007 9.355 -4.039 1.00 36.32 H new ATOM 0 HB2 GLU A 797 34.146 9.548 -4.921 1.00 38.67 H new ATOM 0 HB3 GLU A 797 34.257 8.744 -3.589 1.00 38.67 H new ATOM 0 HG2 GLU A 797 34.104 7.353 -6.021 1.00 53.93 H new ATOM 0 HG3 GLU A 797 35.481 7.925 -5.565 1.00 53.93 H new ATOM 2790 N THR A 798 31.201 7.377 -6.324 1.00 34.83 N ANISOU 2790 N THR A 798 4228 4711 4296 205 533 9 N ATOM 2791 CA THR A 798 30.590 7.314 -7.667 1.00 35.46 C ANISOU 2791 CA THR A 798 4413 4813 4246 227 580 45 C ATOM 2792 C THR A 798 29.056 7.395 -7.627 1.00 38.10 C ANISOU 2792 C THR A 798 4825 5154 4497 210 486 37 C ATOM 2793 O THR A 798 28.418 7.294 -8.676 1.00 39.63 O ANISOU 2793 O THR A 798 5111 5368 4578 229 497 58 O ATOM 2794 CB THR A 798 31.050 6.071 -8.454 1.00 41.49 C ANISOU 2794 CB THR A 798 5236 5602 4928 282 638 18 C ATOM 2795 OG1 THR A 798 30.524 4.913 -7.818 1.00 38.48 O ANISOU 2795 OG1 THR A 798 4887 5222 4512 291 549 -51 O ATOM 2796 CG2 THR A 798 32.585 5.988 -8.614 1.00 39.47 C ANISOU 2796 CG2 THR A 798 4898 5338 4760 307 747 32 C ATOM 0 H THR A 798 31.158 6.648 -5.871 1.00 34.83 H new ATOM 0 HA THR A 798 30.907 8.101 -8.137 1.00 35.46 H new ATOM 0 HB THR A 798 30.706 6.136 -9.359 1.00 41.49 H new ATOM 0 HG1 THR A 798 30.767 4.228 -8.239 1.00 38.48 H new ATOM 0 HG21 THR A 798 32.816 5.190 -9.115 1.00 39.47 H new ATOM 0 HG22 THR A 798 32.904 6.771 -9.090 1.00 39.47 H new ATOM 0 HG23 THR A 798 33.000 5.951 -7.738 1.00 39.47 H new ATOM 2797 N TYR A 799 28.466 7.530 -6.430 1.00 32.01 N ANISOU 2797 N TYR A 799 4018 4367 3778 178 393 5 N ATOM 2798 CA TYR A 799 27.008 7.601 -6.283 1.00 30.58 C ANISOU 2798 CA TYR A 799 3892 4186 3539 160 309 -2 C ATOM 2799 C TYR A 799 26.418 8.734 -7.100 1.00 34.26 C ANISOU 2799 C TYR A 799 4389 4648 3981 147 326 62 C ATOM 2800 O TYR A 799 26.873 9.874 -6.990 1.00 34.96 O ANISOU 2800 O TYR A 799 4416 4714 4154 126 364 104 O ATOM 2801 CB TYR A 799 26.586 7.768 -4.801 1.00 29.92 C ANISOU 2801 CB TYR A 799 3755 4085 3526 132 228 -38 C ATOM 2802 CG TYR A 799 25.090 8.039 -4.624 1.00 31.02 C ANISOU 2802 CG TYR A 799 3936 4219 3632 112 157 -36 C ATOM 2803 CD1 TYR A 799 24.176 6.990 -4.528 1.00 31.27 C ANISOU 2803 CD1 TYR A 799 4021 4258 3602 121 100 -67 C ATOM 2804 CD2 TYR A 799 24.595 9.343 -4.560 1.00 30.69 C ANISOU 2804 CD2 TYR A 799 3870 4156 3633 85 149 1 C ATOM 2805 CE1 TYR A 799 22.811 7.231 -4.343 1.00 28.65 C ANISOU 2805 CE1 TYR A 799 3711 3916 3258 103 38 -62 C ATOM 2806 CE2 TYR A 799 23.229 9.594 -4.411 1.00 31.21 C ANISOU 2806 CE2 TYR A 799 3965 4214 3679 71 88 5 C ATOM 2807 CZ TYR A 799 22.340 8.534 -4.310 1.00 33.53 C ANISOU 2807 CZ TYR A 799 4306 4519 3916 80 33 -25 C ATOM 2808 OH TYR A 799 20.995 8.777 -4.199 1.00 30.35 O ANISOU 2808 OH TYR A 799 3919 4104 3508 66 -23 -17 O ATOM 0 H TYR A 799 28.898 7.582 -5.688 1.00 32.01 H new ATOM 0 HA TYR A 799 26.661 6.758 -6.614 1.00 30.58 H new ATOM 0 HB2 TYR A 799 26.823 6.965 -4.311 1.00 29.92 H new ATOM 0 HB3 TYR A 799 27.089 8.498 -4.408 1.00 29.92 H new ATOM 0 HD1 TYR A 799 24.480 6.113 -4.588 1.00 31.27 H new ATOM 0 HD2 TYR A 799 25.186 10.058 -4.618 1.00 30.69 H new ATOM 0 HE1 TYR A 799 22.221 6.519 -4.242 1.00 28.65 H new ATOM 0 HE2 TYR A 799 22.916 10.469 -4.380 1.00 31.21 H new ATOM 0 HH TYR A 799 20.851 9.600 -4.286 1.00 30.35 H new ATOM 2809 N ARG A 800 25.338 8.444 -7.834 1.00 29.54 N ANISOU 2809 N ARG A 800 3878 4065 3279 159 286 68 N ATOM 2810 CA ARG A 800 24.602 9.478 -8.546 1.00 28.33 C ANISOU 2810 CA ARG A 800 3758 3908 3098 150 281 132 C ATOM 2811 C ARG A 800 23.114 9.194 -8.413 1.00 32.36 C ANISOU 2811 C ARG A 800 4314 4417 3564 141 177 109 C ATOM 2812 O ARG A 800 22.699 8.027 -8.427 1.00 31.32 O ANISOU 2812 O ARG A 800 4226 4298 3375 155 130 56 O ATOM 2813 CB ARG A 800 24.999 9.524 -10.040 1.00 32.05 C ANISOU 2813 CB ARG A 800 4302 4408 3470 188 360 185 C ATOM 2814 CG ARG A 800 26.381 10.118 -10.322 1.00 43.28 C ANISOU 2814 CG ARG A 800 5670 5823 4953 195 483 235 C ATOM 2815 CD ARG A 800 26.378 10.959 -11.584 1.00 53.95 C ANISOU 2815 CD ARG A 800 7074 7185 6241 216 554 331 C ATOM 0 H ARG A 800 25.020 7.651 -7.929 1.00 29.54 H new ATOM 0 HA ARG A 800 24.817 10.341 -8.159 1.00 28.33 H new ATOM 0 HB2 ARG A 800 24.970 8.622 -10.397 1.00 32.05 H new ATOM 0 HB3 ARG A 800 24.335 10.041 -10.522 1.00 32.05 H new ATOM 0 HG2 ARG A 800 26.660 10.663 -9.569 1.00 43.28 H new ATOM 0 HG3 ARG A 800 27.030 9.403 -10.410 1.00 43.28 H new ATOM 2816 N TRP A 801 22.297 10.261 -8.329 1.00 29.61 N ANISOU 2816 N TRP A 801 3951 4048 3251 118 143 152 N ATOM 2817 CA TRP A 801 20.860 10.109 -8.377 1.00 30.05 C ANISOU 2817 CA TRP A 801 4043 4100 3274 112 50 143 C ATOM 2818 C TRP A 801 20.556 9.805 -9.845 1.00 34.76 C ANISOU 2818 C TRP A 801 4737 4726 3742 147 44 170 C ATOM 2819 O TRP A 801 21.129 10.467 -10.706 1.00 34.77 O ANISOU 2819 O TRP A 801 4764 4740 3708 165 112 233 O ATOM 2820 CB TRP A 801 20.194 11.428 -7.970 1.00 28.96 C ANISOU 2820 CB TRP A 801 3857 3928 3218 86 28 187 C ATOM 2821 CG TRP A 801 18.695 11.398 -8.088 1.00 29.55 C ANISOU 2821 CG TRP A 801 3959 3995 3275 82 -63 189 C ATOM 2822 CD1 TRP A 801 17.809 10.875 -7.191 1.00 31.29 C ANISOU 2822 CD1 TRP A 801 4153 4201 3534 66 -128 141 C ATOM 2823 CD2 TRP A 801 17.916 11.924 -9.165 1.00 30.24 C ANISOU 2823 CD2 TRP A 801 4097 4085 3308 96 -98 248 C ATOM 2824 NE1 TRP A 801 16.529 11.032 -7.651 1.00 31.46 N ANISOU 2824 NE1 TRP A 801 4197 4213 3541 67 -201 162 N ATOM 2825 CE2 TRP A 801 16.560 11.709 -8.844 1.00 33.35 C ANISOU 2825 CE2 TRP A 801 4484 4464 3724 86 -192 227 C ATOM 2826 CE3 TRP A 801 18.229 12.621 -10.342 1.00 32.81 C ANISOU 2826 CE3 TRP A 801 4470 4424 3574 120 -57 325 C ATOM 2827 CZ2 TRP A 801 15.517 12.185 -9.645 1.00 32.98 C ANISOU 2827 CZ2 TRP A 801 4469 4411 3649 96 -257 274 C ATOM 2828 CZ3 TRP A 801 17.192 13.036 -11.172 1.00 34.72 C ANISOU 2828 CZ3 TRP A 801 4759 4667 3767 135 -122 374 C ATOM 2829 CH2 TRP A 801 15.855 12.835 -10.810 1.00 34.67 C ANISOU 2829 CH2 TRP A 801 4738 4644 3793 122 -227 347 C ATOM 0 H TRP A 801 22.569 11.072 -8.244 1.00 29.61 H new ATOM 0 HA TRP A 801 20.535 9.417 -7.781 1.00 30.05 H new ATOM 0 HB2 TRP A 801 20.436 11.636 -7.054 1.00 28.96 H new ATOM 0 HB3 TRP A 801 20.542 12.144 -8.525 1.00 28.96 H new ATOM 0 HD1 TRP A 801 18.041 10.471 -6.386 1.00 31.29 H new ATOM 0 HE1 TRP A 801 15.819 10.751 -7.255 1.00 31.46 H new ATOM 0 HE3 TRP A 801 19.114 12.802 -10.563 1.00 32.81 H new ATOM 0 HZ2 TRP A 801 14.628 12.067 -9.399 1.00 32.98 H new ATOM 0 HZ3 TRP A 801 17.390 13.453 -11.979 1.00 34.72 H new ATOM 0 HH2 TRP A 801 15.180 13.147 -11.369 1.00 34.67 H new ATOM 2830 N SER A 802 19.706 8.818 -10.149 1.00 32.84 N ANISOU 2830 N SER A 802 4552 4495 3431 159 -35 124 N ATOM 2831 CA SER A 802 19.402 8.505 -11.562 1.00 34.81 C ANISOU 2831 CA SER A 802 4905 4776 3545 197 -56 136 C ATOM 2832 C SER A 802 18.098 9.105 -12.029 1.00 41.24 C ANISOU 2832 C SER A 802 5745 5584 4340 193 -146 175 C ATOM 2833 O SER A 802 18.066 9.789 -13.053 1.00 44.65 O ANISOU 2833 O SER A 802 6232 6036 4696 220 -132 240 O ATOM 2834 CB SER A 802 19.343 7.000 -11.796 1.00 38.84 C ANISOU 2834 CB SER A 802 5472 5300 3988 218 -95 52 C ATOM 2835 OG SER A 802 20.647 6.465 -11.690 1.00 57.44 O ANISOU 2835 OG SER A 802 7818 7666 6340 236 -2 27 O ATOM 0 H SER A 802 19.301 8.326 -9.571 1.00 32.84 H new ATOM 0 HA SER A 802 20.126 8.898 -12.074 1.00 34.81 H new ATOM 0 HB2 SER A 802 18.756 6.583 -11.146 1.00 38.84 H new ATOM 0 HB3 SER A 802 18.974 6.812 -12.673 1.00 38.84 H new ATOM 0 HG SER A 802 21.016 6.474 -12.445 1.00 57.44 H new ATOM 2836 N ARG A 803 17.008 8.828 -11.292 1.00 35.28 N ANISOU 2836 N ARG A 803 4950 4801 3654 165 -238 139 N ATOM 2837 CA ARG A 803 15.658 9.225 -11.667 1.00 34.04 C ANISOU 2837 CA ARG A 803 4805 4631 3498 161 -339 164 C ATOM 2838 C ARG A 803 14.710 8.936 -10.528 1.00 35.40 C ANISOU 2838 C ARG A 803 4902 4764 3785 125 -402 126 C ATOM 2839 O ARG A 803 15.079 8.285 -9.525 1.00 31.49 O ANISOU 2839 O ARG A 803 4363 4257 3346 107 -373 77 O ATOM 2840 CB ARG A 803 15.209 8.419 -12.935 1.00 36.44 C ANISOU 2840 CB ARG A 803 5214 4965 3666 198 -415 135 C ATOM 2841 CG ARG A 803 15.187 6.902 -12.711 1.00 44.26 C ANISOU 2841 CG ARG A 803 6222 5950 4644 197 -453 36 C ATOM 2842 CD ARG A 803 14.934 6.076 -13.966 1.00 49.34 C ANISOU 2842 CD ARG A 803 6975 6620 5151 237 -522 -11 C ATOM 2843 NE ARG A 803 16.115 5.996 -14.830 1.00 56.99 N ANISOU 2843 NE ARG A 803 8026 7636 5993 284 -428 -4 N ATOM 2844 CZ ARG A 803 17.137 5.158 -14.674 1.00 75.77 C ANISOU 2844 CZ ARG A 803 10416 10020 8354 297 -350 -57 C ATOM 2845 NH1 ARG A 803 17.159 4.304 -13.654 1.00 63.74 N ANISOU 2845 NH1 ARG A 803 8829 8459 6928 268 -360 -117 N ATOM 2846 NH2 ARG A 803 18.160 5.189 -15.516 1.00 67.30 N ANISOU 2846 NH2 ARG A 803 9413 8989 7168 344 -256 -41 N ATOM 0 H ARG A 803 17.044 8.396 -10.549 1.00 35.28 H new ATOM 0 HA ARG A 803 15.646 10.175 -11.864 1.00 34.04 H new ATOM 0 HB2 ARG A 803 14.324 8.713 -13.201 1.00 36.44 H new ATOM 0 HB3 ARG A 803 15.809 8.623 -13.670 1.00 36.44 H new ATOM 0 HG2 ARG A 803 16.036 6.632 -12.327 1.00 44.26 H new ATOM 0 HG3 ARG A 803 14.501 6.694 -12.058 1.00 44.26 H new ATOM 0 HD2 ARG A 803 14.662 5.181 -13.711 1.00 49.34 H new ATOM 0 HD3 ARG A 803 14.198 6.466 -14.464 1.00 49.34 H new ATOM 0 HE ARG A 803 16.151 6.538 -15.496 1.00 56.99 H new ATOM 0 HH11 ARG A 803 16.510 4.291 -13.090 1.00 63.74 H new ATOM 0 HH12 ARG A 803 17.822 3.765 -13.559 1.00 63.74 H new ATOM 0 HH21 ARG A 803 18.165 5.752 -16.166 1.00 67.30 H new ATOM 0 HH22 ARG A 803 18.819 4.646 -15.412 1.00 67.30 H new ATOM 2847 N SER A 804 13.456 9.377 -10.718 1.00 32.57 N ANISOU 2847 N SER A 804 4530 4385 3458 118 -489 152 N ATOM 2848 CA SER A 804 12.373 9.133 -9.782 1.00 32.78 C ANISOU 2848 CA SER A 804 4485 4373 3596 88 -549 125 C ATOM 2849 C SER A 804 11.988 7.636 -9.837 1.00 34.39 C ANISOU 2849 C SER A 804 4714 4572 3782 85 -613 50 C ATOM 2850 O SER A 804 11.954 7.061 -10.914 1.00 33.66 O ANISOU 2850 O SER A 804 4699 4500 3590 109 -665 26 O ATOM 2851 CB SER A 804 11.166 9.975 -10.194 1.00 36.52 C ANISOU 2851 CB SER A 804 4941 4827 4107 88 -629 176 C ATOM 2852 OG SER A 804 10.383 10.281 -9.057 1.00 48.54 O ANISOU 2852 OG SER A 804 6371 6308 5766 60 -634 176 O ATOM 0 H SER A 804 13.218 9.832 -11.408 1.00 32.57 H new ATOM 0 HA SER A 804 12.650 9.369 -8.883 1.00 32.78 H new ATOM 0 HB2 SER A 804 11.463 10.793 -10.622 1.00 36.52 H new ATOM 0 HB3 SER A 804 10.632 9.493 -10.844 1.00 36.52 H new ATOM 0 HG SER A 804 10.693 10.964 -8.679 1.00 48.54 H new ATOM 2853 N HIS A 805 11.700 7.018 -8.701 1.00 31.15 N ANISOU 2853 N HIS A 805 4241 4132 3464 59 -607 14 N ATOM 2854 CA HIS A 805 11.240 5.626 -8.670 1.00 32.06 C ANISOU 2854 CA HIS A 805 4364 4225 3591 51 -667 -49 C ATOM 2855 C HIS A 805 9.779 5.592 -8.256 1.00 38.96 C ANISOU 2855 C HIS A 805 5171 5055 4578 26 -745 -43 C ATOM 2856 O HIS A 805 9.400 6.234 -7.272 1.00 38.29 O ANISOU 2856 O HIS A 805 5011 4950 4587 9 -708 -11 O ATOM 2857 CB HIS A 805 12.065 4.795 -7.667 1.00 31.62 C ANISOU 2857 CB HIS A 805 4287 4165 3563 44 -593 -86 C ATOM 2858 CG HIS A 805 11.693 3.342 -7.610 1.00 34.52 C ANISOU 2858 CG HIS A 805 4662 4501 3954 37 -643 -145 C ATOM 2859 ND1 HIS A 805 12.172 2.432 -8.546 1.00 36.94 N ANISOU 2859 ND1 HIS A 805 5045 4817 4172 60 -668 -198 N ATOM 2860 CD2 HIS A 805 10.938 2.677 -6.707 1.00 35.42 C ANISOU 2860 CD2 HIS A 805 4714 4569 4174 12 -662 -156 C ATOM 2861 CE1 HIS A 805 11.689 1.252 -8.189 1.00 36.08 C ANISOU 2861 CE1 HIS A 805 4917 4662 4129 45 -710 -244 C ATOM 2862 NE2 HIS A 805 10.953 1.342 -7.082 1.00 35.96 N ANISOU 2862 NE2 HIS A 805 4818 4613 4234 15 -704 -214 N ATOM 0 H HIS A 805 11.763 7.387 -7.927 1.00 31.15 H new ATOM 0 HA HIS A 805 11.351 5.245 -9.555 1.00 32.06 H new ATOM 0 HB2 HIS A 805 13.004 4.868 -7.899 1.00 31.62 H new ATOM 0 HB3 HIS A 805 11.960 5.179 -6.782 1.00 31.62 H new ATOM 0 HD1 HIS A 805 12.679 2.601 -9.220 1.00 36.94 H new ATOM 0 HD2 HIS A 805 10.495 3.044 -5.976 1.00 35.42 H new ATOM 0 HE1 HIS A 805 11.844 0.461 -8.652 1.00 36.08 H new ATOM 2863 N GLU A 806 8.971 4.798 -8.958 1.00 38.87 N ANISOU 2863 N GLU A 806 5181 5022 4565 25 -851 -81 N ATOM 2864 CA GLU A 806 7.561 4.606 -8.594 1.00 39.53 C ANISOU 2864 CA GLU A 806 5188 5055 4777 -2 -929 -79 C ATOM 2865 C GLU A 806 7.486 3.262 -7.891 1.00 41.00 C ANISOU 2865 C GLU A 806 5345 5201 5033 -24 -921 -128 C ATOM 2866 O GLU A 806 7.615 2.233 -8.538 1.00 42.38 O ANISOU 2866 O GLU A 806 5571 5366 5164 -18 -975 -187 O ATOM 2867 CB GLU A 806 6.667 4.644 -9.835 1.00 42.39 C ANISOU 2867 CB GLU A 806 5583 5413 5112 8 -1067 -87 C ATOM 2868 CG GLU A 806 6.565 6.026 -10.471 1.00 60.31 C ANISOU 2868 CG GLU A 806 7873 7713 7331 31 -1081 -20 C ATOM 2869 CD GLU A 806 5.697 7.051 -9.761 1.00 92.86 C ANISOU 2869 CD GLU A 806 11896 11805 11584 15 -1072 42 C ATOM 2870 OE1 GLU A 806 4.763 6.648 -9.027 1.00 79.60 O ANISOU 2870 OE1 GLU A 806 10128 10076 10041 -13 -1097 31 O ATOM 2871 OE2 GLU A 806 5.941 8.265 -9.958 1.00 93.73 O ANISOU 2871 OE2 GLU A 806 12014 11935 11665 32 -1036 103 O ATOM 0 H GLU A 806 9.219 4.358 -9.654 1.00 38.87 H new ATOM 0 HA GLU A 806 7.244 5.316 -8.014 1.00 39.53 H new ATOM 0 HB2 GLU A 806 7.011 4.019 -10.492 1.00 42.39 H new ATOM 0 HB3 GLU A 806 5.778 4.341 -9.593 1.00 42.39 H new ATOM 0 HG2 GLU A 806 7.461 6.390 -10.546 1.00 60.31 H new ATOM 0 HG3 GLU A 806 6.226 5.918 -11.374 1.00 60.31 H new ATOM 2872 N ASP A 807 7.411 3.272 -6.564 1.00 36.55 N ANISOU 2872 N ASP A 807 4708 4616 4563 -42 -843 -105 N ATOM 2873 CA ASP A 807 7.424 2.039 -5.760 1.00 36.77 C ANISOU 2873 CA ASP A 807 4708 4606 4657 -58 -816 -134 C ATOM 2874 C ASP A 807 6.194 1.144 -6.033 1.00 41.41 C ANISOU 2874 C ASP A 807 5253 5129 5353 -84 -917 -160 C ATOM 2875 O ASP A 807 5.062 1.577 -5.837 1.00 39.83 O ANISOU 2875 O ASP A 807 4979 4897 5258 -101 -955 -127 O ATOM 2876 CB ASP A 807 7.569 2.375 -4.252 1.00 37.35 C ANISOU 2876 CB ASP A 807 4719 4679 4793 -65 -707 -93 C ATOM 2877 CG ASP A 807 7.962 1.215 -3.334 1.00 41.94 C ANISOU 2877 CG ASP A 807 5290 5237 5408 -69 -651 -107 C ATOM 2878 OD1 ASP A 807 7.489 0.080 -3.564 1.00 43.16 O ANISOU 2878 OD1 ASP A 807 5437 5343 5619 -84 -703 -136 O ATOM 2879 OD2 ASP A 807 8.698 1.454 -2.361 1.00 38.99 O ANISOU 2879 OD2 ASP A 807 4910 4890 5013 -57 -561 -88 O ATOM 0 H ASP A 807 7.351 3.992 -6.098 1.00 36.55 H new ATOM 0 HA ASP A 807 8.198 1.522 -6.031 1.00 36.77 H new ATOM 0 HB2 ASP A 807 8.233 3.076 -4.159 1.00 37.35 H new ATOM 0 HB3 ASP A 807 6.726 2.739 -3.939 1.00 37.35 H new ATOM 2880 N GLY A 808 6.450 -0.086 -6.475 1.00 40.80 N ANISOU 2880 N GLY A 808 5217 5025 5259 -84 -959 -220 N ATOM 2881 CA GLY A 808 5.406 -1.053 -6.796 1.00 43.28 C ANISOU 2881 CA GLY A 808 5493 5268 5683 -111 -1062 -259 C ATOM 2882 C GLY A 808 4.986 -1.999 -5.679 1.00 49.00 C ANISOU 2882 C GLY A 808 6138 5924 6554 -140 -1015 -244 C ATOM 2883 O GLY A 808 4.083 -2.819 -5.886 1.00 50.20 O ANISOU 2883 O GLY A 808 6244 6003 6825 -167 -1097 -272 O ATOM 0 H GLY A 808 7.247 -0.385 -6.598 1.00 40.80 H new ATOM 0 HA2 GLY A 808 4.621 -0.565 -7.091 1.00 43.28 H new ATOM 0 HA3 GLY A 808 5.708 -1.587 -7.548 1.00 43.28 H new ATOM 2884 N SER A 809 5.623 -1.895 -4.489 1.00 42.98 N ANISOU 2884 N SER A 809 5359 5181 5789 -132 -886 -199 N ATOM 2885 CA SER A 809 5.331 -2.728 -3.311 1.00 41.97 C ANISOU 2885 CA SER A 809 5165 4999 5781 -150 -819 -167 C ATOM 2886 C SER A 809 3.854 -2.652 -2.921 1.00 45.65 C ANISOU 2886 C SER A 809 5524 5405 6418 -183 -845 -126 C ATOM 2887 O SER A 809 3.259 -1.576 -2.973 1.00 44.44 O ANISOU 2887 O SER A 809 5333 5272 6279 -183 -856 -95 O ATOM 2888 CB SER A 809 6.153 -2.270 -2.113 1.00 41.49 C ANISOU 2888 CB SER A 809 5108 4988 5668 -129 -686 -118 C ATOM 2889 OG SER A 809 7.545 -2.347 -2.362 1.00 50.76 O ANISOU 2889 OG SER A 809 6366 6214 6708 -100 -655 -150 O ATOM 0 H SER A 809 6.250 -1.323 -4.349 1.00 42.98 H new ATOM 0 HA SER A 809 5.558 -3.640 -3.551 1.00 41.97 H new ATOM 0 HB2 SER A 809 5.916 -1.356 -1.890 1.00 41.49 H new ATOM 0 HB3 SER A 809 5.933 -2.817 -1.343 1.00 41.49 H new ATOM 0 HG SER A 809 7.797 -1.653 -2.763 1.00 50.76 H new ATOM 2890 N GLU A 810 3.271 -3.797 -2.541 1.00 42.67 N ANISOU 2890 N GLU A 810 5089 4944 6178 -210 -852 -124 N ATOM 2891 CA GLU A 810 1.884 -3.854 -2.091 1.00 43.09 C ANISOU 2891 CA GLU A 810 5026 4930 6418 -242 -861 -78 C ATOM 2892 C GLU A 810 1.866 -3.359 -0.645 1.00 43.42 C ANISOU 2892 C GLU A 810 5022 4995 6482 -229 -710 7 C ATOM 2893 O GLU A 810 2.902 -3.365 -0.003 1.00 42.50 O ANISOU 2893 O GLU A 810 4963 4927 6256 -202 -620 20 O ATOM 2894 CB GLU A 810 1.341 -5.295 -2.146 1.00 46.19 C ANISOU 2894 CB GLU A 810 5369 5216 6963 -277 -908 -99 C ATOM 2895 CG GLU A 810 1.185 -5.859 -3.551 1.00 63.90 C ANISOU 2895 CG GLU A 810 7652 7424 9204 -290 -1070 -197 C ATOM 2896 CD GLU A 810 0.530 -7.227 -3.662 1.00 98.54 C ANISOU 2896 CD GLU A 810 11979 11691 13770 -330 -1135 -228 C ATOM 2897 OE1 GLU A 810 0.662 -8.045 -2.720 1.00 95.20 O ANISOU 2897 OE1 GLU A 810 11522 11218 13433 -338 -1038 -183 O ATOM 2898 OE2 GLU A 810 -0.101 -7.487 -4.714 1.00 96.47 O ANISOU 2898 OE2 GLU A 810 11707 11384 13563 -350 -1288 -300 O ATOM 0 H GLU A 810 3.672 -4.558 -2.539 1.00 42.67 H new ATOM 0 HA GLU A 810 1.325 -3.308 -2.665 1.00 43.09 H new ATOM 0 HB2 GLU A 810 1.936 -5.872 -1.643 1.00 46.19 H new ATOM 0 HB3 GLU A 810 0.479 -5.321 -1.702 1.00 46.19 H new ATOM 0 HG2 GLU A 810 0.665 -5.230 -4.075 1.00 63.90 H new ATOM 0 HG3 GLU A 810 2.064 -5.909 -3.958 1.00 63.90 H new ATOM 2899 N ARG A 811 0.721 -2.887 -0.144 1.00 37.81 N ANISOU 2899 N ARG A 811 4211 4253 5904 -244 -684 63 N ATOM 2900 CA ARG A 811 0.653 -2.488 1.247 1.00 35.95 C ANISOU 2900 CA ARG A 811 3939 4038 5682 -225 -535 138 C ATOM 2901 C ARG A 811 0.004 -3.627 2.041 1.00 40.56 C ANISOU 2901 C ARG A 811 4446 4539 6427 -247 -473 191 C ATOM 2902 O ARG A 811 -0.823 -4.371 1.510 1.00 41.55 O ANISOU 2902 O ARG A 811 4503 4578 6706 -285 -553 179 O ATOM 2903 CB ARG A 811 -0.099 -1.151 1.423 1.00 33.56 C ANISOU 2903 CB ARG A 811 3580 3761 5411 -216 -514 171 C ATOM 2904 CG ARG A 811 0.595 0.044 0.737 1.00 35.57 C ANISOU 2904 CG ARG A 811 3909 4093 5513 -192 -559 133 C ATOM 2905 CD ARG A 811 -0.175 1.315 0.970 1.00 43.69 C ANISOU 2905 CD ARG A 811 4876 5133 6593 -181 -536 168 C ATOM 2906 NE ARG A 811 0.365 2.476 0.258 1.00 50.03 N ANISOU 2906 NE ARG A 811 5739 5994 7276 -162 -582 142 N ATOM 2907 CZ ARG A 811 0.035 2.826 -0.985 1.00 70.95 C ANISOU 2907 CZ ARG A 811 8394 8639 9926 -170 -709 118 C ATOM 2908 NH1 ARG A 811 -0.777 2.059 -1.708 1.00 54.06 N ANISOU 2908 NH1 ARG A 811 6209 6440 7891 -199 -819 100 N ATOM 2909 NH2 ARG A 811 0.547 3.924 -1.532 1.00 57.70 N ANISOU 2909 NH2 ARG A 811 6770 7012 8140 -148 -731 111 N ATOM 0 H ARG A 811 -0.009 -2.794 -0.589 1.00 37.81 H new ATOM 0 HA ARG A 811 1.548 -2.330 1.587 1.00 35.95 H new ATOM 0 HB2 ARG A 811 -0.996 -1.244 1.065 1.00 33.56 H new ATOM 0 HB3 ARG A 811 -0.190 -0.962 2.370 1.00 33.56 H new ATOM 0 HG2 ARG A 811 1.497 0.140 1.080 1.00 35.57 H new ATOM 0 HG3 ARG A 811 0.670 -0.124 -0.215 1.00 35.57 H new ATOM 0 HD2 ARG A 811 -1.096 1.179 0.697 1.00 43.69 H new ATOM 0 HD3 ARG A 811 -0.186 1.506 1.921 1.00 43.69 H new ATOM 0 HE ARG A 811 0.936 2.967 0.672 1.00 50.03 H new ATOM 0 HH11 ARG A 811 -1.093 1.332 -1.374 1.00 54.06 H new ATOM 0 HH12 ARG A 811 -0.986 2.290 -2.509 1.00 54.06 H new ATOM 0 HH21 ARG A 811 1.094 4.413 -1.084 1.00 57.70 H new ATOM 0 HH22 ARG A 811 0.331 4.146 -2.334 1.00 57.70 H new ATOM 2910 N ASP A 812 0.381 -3.776 3.304 1.00 35.55 N ANISOU 2910 N ASP A 812 3822 3926 5759 -221 -334 251 N ATOM 2911 CA ASP A 812 -0.236 -4.777 4.167 1.00 35.37 C ANISOU 2911 CA ASP A 812 3728 3828 5884 -234 -250 323 C ATOM 2912 C ASP A 812 -1.570 -4.188 4.715 1.00 39.30 C ANISOU 2912 C ASP A 812 4109 4294 6530 -242 -188 389 C ATOM 2913 O ASP A 812 -1.974 -3.101 4.288 1.00 37.17 O ANISOU 2913 O ASP A 812 3817 4054 6251 -240 -231 367 O ATOM 2914 CB ASP A 812 0.750 -5.169 5.293 1.00 36.61 C ANISOU 2914 CB ASP A 812 3954 4028 5928 -194 -128 368 C ATOM 2915 CG ASP A 812 1.171 -4.041 6.237 1.00 41.78 C ANISOU 2915 CG ASP A 812 4649 4779 6447 -145 -24 396 C ATOM 2916 OD1 ASP A 812 0.388 -3.061 6.396 1.00 40.84 O ANISOU 2916 OD1 ASP A 812 4475 4672 6369 -142 2 412 O ATOM 2917 OD2 ASP A 812 2.200 -4.202 6.927 1.00 45.29 O ANISOU 2917 OD2 ASP A 812 5171 5277 6760 -107 37 406 O ATOM 0 H ASP A 812 0.994 -3.307 3.683 1.00 35.55 H new ATOM 0 HA ASP A 812 -0.440 -5.590 3.678 1.00 35.37 H new ATOM 0 HB2 ASP A 812 0.346 -5.875 5.821 1.00 36.61 H new ATOM 0 HB3 ASP A 812 1.548 -5.541 4.885 1.00 36.61 H new ATOM 2918 N ASP A 813 -2.211 -4.870 5.695 1.00 38.91 N ANISOU 2918 N ASP A 813 3987 4185 6613 -247 -74 476 N ATOM 2919 CA ASP A 813 -3.474 -4.471 6.338 1.00 39.91 C ANISOU 2919 CA ASP A 813 3994 4273 6896 -250 14 551 C ATOM 2920 C ASP A 813 -3.406 -3.185 7.164 1.00 42.60 C ANISOU 2920 C ASP A 813 4359 4702 7126 -198 125 577 C ATOM 2921 O ASP A 813 -4.452 -2.661 7.554 1.00 43.04 O ANISOU 2921 O ASP A 813 4318 4733 7303 -195 190 625 O ATOM 2922 CB ASP A 813 -4.034 -5.612 7.195 1.00 43.93 C ANISOU 2922 CB ASP A 813 4431 4697 7562 -263 125 646 C ATOM 2923 CG ASP A 813 -4.586 -6.772 6.387 1.00 67.30 C ANISOU 2923 CG ASP A 813 7316 7536 10720 -325 15 626 C ATOM 2924 OD1 ASP A 813 -5.453 -6.529 5.511 1.00 69.91 O ANISOU 2924 OD1 ASP A 813 7559 7815 11187 -364 -101 586 O ATOM 2925 OD2 ASP A 813 -4.179 -7.931 6.655 1.00 77.40 O ANISOU 2925 OD2 ASP A 813 8617 8765 12025 -333 42 651 O ATOM 0 H ASP A 813 -1.901 -5.608 6.010 1.00 38.91 H new ATOM 0 HA ASP A 813 -4.072 -4.276 5.600 1.00 39.91 H new ATOM 0 HB2 ASP A 813 -3.333 -5.941 7.779 1.00 43.93 H new ATOM 0 HB3 ASP A 813 -4.737 -5.262 7.765 1.00 43.93 H new ATOM 2926 N TRP A 814 -2.196 -2.653 7.414 1.00 37.21 N ANISOU 2926 N TRP A 814 3798 4117 6224 -157 143 541 N ATOM 2927 CA TRP A 814 -2.029 -1.395 8.150 1.00 34.17 C ANISOU 2927 CA TRP A 814 3444 3813 5726 -107 231 546 C ATOM 2928 C TRP A 814 -1.626 -0.307 7.177 1.00 35.59 C ANISOU 2928 C TRP A 814 3664 4040 5817 -109 117 465 C ATOM 2929 O TRP A 814 -1.152 0.737 7.591 1.00 35.22 O ANISOU 2929 O TRP A 814 3669 4064 5650 -71 161 446 O ATOM 2930 CB TRP A 814 -0.961 -1.541 9.238 1.00 31.65 C ANISOU 2930 CB TRP A 814 3227 3564 5234 -56 334 566 C ATOM 2931 CG TRP A 814 -1.303 -2.419 10.405 1.00 33.29 C ANISOU 2931 CG TRP A 814 3411 3742 5495 -37 473 663 C ATOM 2932 CD1 TRP A 814 -2.438 -3.158 10.589 1.00 37.08 C ANISOU 2932 CD1 TRP A 814 3783 4131 6176 -64 527 739 C ATOM 2933 CD2 TRP A 814 -0.449 -2.706 11.525 1.00 33.23 C ANISOU 2933 CD2 TRP A 814 3493 3794 5337 17 573 700 C ATOM 2934 NE1 TRP A 814 -2.354 -3.867 11.767 1.00 37.39 N ANISOU 2934 NE1 TRP A 814 3842 4170 6197 -30 667 830 N ATOM 2935 CE2 TRP A 814 -1.140 -3.618 12.358 1.00 37.83 C ANISOU 2935 CE2 TRP A 814 4023 4320 6030 22 693 807 C ATOM 2936 CE3 TRP A 814 0.812 -2.235 11.936 1.00 34.08 C ANISOU 2936 CE3 TRP A 814 3718 3998 5234 63 572 656 C ATOM 2937 CZ2 TRP A 814 -0.629 -4.044 13.589 1.00 37.31 C ANISOU 2937 CZ2 TRP A 814 4027 4297 5852 79 815 876 C ATOM 2938 CZ3 TRP A 814 1.339 -2.688 13.143 1.00 36.31 C ANISOU 2938 CZ3 TRP A 814 4065 4321 5410 116 677 714 C ATOM 2939 CH2 TRP A 814 0.618 -3.582 13.956 1.00 37.90 C ANISOU 2939 CH2 TRP A 814 4222 4471 5707 126 797 825 C ATOM 0 H TRP A 814 -1.457 -3.013 7.161 1.00 37.21 H new ATOM 0 HA TRP A 814 -2.868 -1.164 8.578 1.00 34.17 H new ATOM 0 HB2 TRP A 814 -0.154 -1.887 8.825 1.00 31.65 H new ATOM 0 HB3 TRP A 814 -0.750 -0.657 9.576 1.00 31.65 H new ATOM 0 HD1 TRP A 814 -3.161 -3.179 10.004 1.00 37.08 H new ATOM 0 HE1 TRP A 814 -2.965 -4.384 12.082 1.00 37.39 H new ATOM 0 HE3 TRP A 814 1.285 -1.631 11.410 1.00 34.08 H new ATOM 0 HZ2 TRP A 814 -1.112 -4.617 14.139 1.00 37.31 H new ATOM 0 HZ3 TRP A 814 2.179 -2.396 13.415 1.00 36.31 H new ATOM 0 HH2 TRP A 814 0.990 -3.868 14.759 1.00 37.90 H new ATOM 2940 N GLN A 815 -1.792 -0.549 5.878 1.00 31.50 N ANISOU 2940 N GLN A 815 3130 3484 5355 -151 -30 416 N ATOM 2941 CA GLN A 815 -1.439 0.398 4.823 1.00 30.27 C ANISOU 2941 CA GLN A 815 3016 3369 5117 -153 -143 349 C ATOM 2942 C GLN A 815 0.049 0.725 4.802 1.00 31.98 C ANISOU 2942 C GLN A 815 3357 3669 5125 -125 -144 303 C ATOM 2943 O GLN A 815 0.428 1.819 4.406 1.00 29.25 O ANISOU 2943 O GLN A 815 3048 3373 4695 -110 -175 270 O ATOM 2944 CB GLN A 815 -2.315 1.680 4.867 1.00 32.48 C ANISOU 2944 CB GLN A 815 3227 3652 5463 -141 -129 365 C ATOM 2945 CG GLN A 815 -3.804 1.392 4.636 1.00 38.78 C ANISOU 2945 CG GLN A 815 3887 4361 6486 -172 -157 403 C ATOM 2946 CD GLN A 815 -4.044 0.550 3.403 1.00 48.48 C ANISOU 2946 CD GLN A 815 5097 5533 7791 -220 -317 364 C ATOM 2947 OE1 GLN A 815 -3.521 0.815 2.312 1.00 41.09 O ANISOU 2947 OE1 GLN A 815 4227 4627 6759 -225 -443 302 O ATOM 2948 NE2 GLN A 815 -4.834 -0.491 3.558 1.00 38.77 N ANISOU 2948 NE2 GLN A 815 3778 4218 6733 -253 -312 398 N ATOM 0 H GLN A 815 -2.121 -1.285 5.579 1.00 31.50 H new ATOM 0 HA GLN A 815 -1.634 -0.048 3.984 1.00 30.27 H new ATOM 0 HB2 GLN A 815 -2.204 2.113 5.728 1.00 32.48 H new ATOM 0 HB3 GLN A 815 -2.002 2.304 4.193 1.00 32.48 H new ATOM 0 HG2 GLN A 815 -4.167 0.936 5.412 1.00 38.78 H new ATOM 0 HG3 GLN A 815 -4.284 2.231 4.550 1.00 38.78 H new ATOM 0 HE21 GLN A 815 -5.185 -0.654 4.326 1.00 38.77 H new ATOM 0 HE22 GLN A 815 -4.999 -1.009 2.891 1.00 38.77 H new ATOM 2949 N ARG A 816 0.896 -0.253 5.174 1.00 28.47 N ANISOU 2949 N ARG A 816 2972 3232 4612 -119 -113 303 N ATOM 2950 CA ARG A 816 2.349 -0.092 5.145 1.00 27.15 C ANISOU 2950 CA ARG A 816 2913 3137 4267 -94 -118 260 C ATOM 2951 C ARG A 816 2.885 -0.799 3.944 1.00 32.05 C ANISOU 2951 C ARG A 816 3577 3741 4861 -118 -232 205 C ATOM 2952 O ARG A 816 2.571 -1.967 3.766 1.00 31.56 O ANISOU 2952 O ARG A 816 3490 3615 4887 -142 -258 211 O ATOM 2953 CB ARG A 816 2.999 -0.744 6.396 1.00 24.67 C ANISOU 2953 CB ARG A 816 2638 2846 3890 -62 -10 298 C ATOM 2954 CG ARG A 816 2.570 -0.124 7.725 1.00 26.67 C ANISOU 2954 CG ARG A 816 2868 3125 4140 -26 117 351 C ATOM 2955 CD ARG A 816 3.244 -0.790 8.909 1.00 32.83 C ANISOU 2955 CD ARG A 816 3700 3935 4838 13 211 391 C ATOM 2956 NE ARG A 816 3.068 -2.247 8.907 1.00 33.91 N ANISOU 2956 NE ARG A 816 3817 4006 5061 -8 214 435 N ATOM 2957 CZ ARG A 816 3.477 -3.052 9.878 1.00 43.39 C ANISOU 2957 CZ ARG A 816 5050 5212 6223 22 294 490 C ATOM 2958 NH1 ARG A 816 3.281 -4.358 9.790 1.00 38.35 N ANISOU 2958 NH1 ARG A 816 4387 4501 5683 0 292 531 N ATOM 2959 NH2 ARG A 816 4.044 -2.554 10.969 1.00 27.66 N ANISOU 2959 NH2 ARG A 816 3116 3295 4100 77 375 507 N ATOM 0 H ARG A 816 0.636 -1.025 5.449 1.00 28.47 H new ATOM 0 HA ARG A 816 2.553 0.856 5.125 1.00 27.15 H new ATOM 0 HB2 ARG A 816 2.779 -1.689 6.406 1.00 24.67 H new ATOM 0 HB3 ARG A 816 3.964 -0.678 6.317 1.00 24.67 H new ATOM 0 HG2 ARG A 816 2.784 0.822 7.723 1.00 26.67 H new ATOM 0 HG3 ARG A 816 1.607 -0.197 7.819 1.00 26.67 H new ATOM 0 HD2 ARG A 816 4.191 -0.581 8.898 1.00 32.83 H new ATOM 0 HD3 ARG A 816 2.882 -0.424 9.731 1.00 32.83 H new ATOM 0 HE ARG A 816 2.673 -2.602 8.231 1.00 33.91 H new ATOM 0 HH11 ARG A 816 2.887 -4.688 9.101 1.00 38.35 H new ATOM 0 HH12 ARG A 816 3.548 -4.876 10.422 1.00 38.35 H new ATOM 0 HH21 ARG A 816 4.148 -1.704 11.050 1.00 27.66 H new ATOM 0 HH22 ARG A 816 4.307 -3.081 11.596 1.00 27.66 H new ATOM 2960 N ARG A 817 3.759 -0.157 3.158 1.00 30.61 N ANISOU 2960 N ARG A 817 3463 3611 4556 -109 -291 151 N ATOM 2961 CA ARG A 817 4.450 -0.864 2.069 1.00 30.80 C ANISOU 2961 CA ARG A 817 3546 3630 4526 -120 -380 95 C ATOM 2962 C ARG A 817 5.058 -2.151 2.656 1.00 33.79 C ANISOU 2962 C ARG A 817 3950 3988 4900 -113 -335 104 C ATOM 2963 O ARG A 817 5.545 -2.123 3.788 1.00 29.78 O ANISOU 2963 O ARG A 817 3457 3512 4347 -86 -240 141 O ATOM 2964 CB ARG A 817 5.611 -0.032 1.538 1.00 30.25 C ANISOU 2964 CB ARG A 817 3555 3634 4305 -98 -397 54 C ATOM 2965 CG ARG A 817 5.221 1.247 0.813 1.00 39.52 C ANISOU 2965 CG ARG A 817 4720 4830 5466 -100 -447 47 C ATOM 2966 CD ARG A 817 4.490 0.972 -0.473 1.00 38.42 C ANISOU 2966 CD ARG A 817 4569 4651 5379 -124 -567 20 C ATOM 2967 NE ARG A 817 4.167 2.217 -1.158 1.00 39.83 N ANISOU 2967 NE ARG A 817 4744 4853 5538 -120 -615 25 N ATOM 2968 CZ ARG A 817 3.773 2.287 -2.418 1.00 51.85 C ANISOU 2968 CZ ARG A 817 6282 6365 7055 -128 -729 0 C ATOM 2969 NH1 ARG A 817 3.499 3.459 -2.966 1.00 42.01 N ANISOU 2969 NH1 ARG A 817 5033 5140 5790 -118 -765 17 N ATOM 2970 NH2 ARG A 817 3.647 1.182 -3.143 1.00 44.00 N ANISOU 2970 NH2 ARG A 817 5309 5336 6073 -143 -811 -43 N ATOM 0 H ARG A 817 3.964 0.675 3.236 1.00 30.61 H new ATOM 0 HA ARG A 817 3.816 -1.040 1.356 1.00 30.80 H new ATOM 0 HB2 ARG A 817 6.189 0.199 2.281 1.00 30.25 H new ATOM 0 HB3 ARG A 817 6.133 -0.582 0.933 1.00 30.25 H new ATOM 0 HG2 ARG A 817 4.661 1.787 1.392 1.00 39.52 H new ATOM 0 HG3 ARG A 817 6.019 1.766 0.625 1.00 39.52 H new ATOM 0 HD2 ARG A 817 5.036 0.413 -1.048 1.00 38.42 H new ATOM 0 HD3 ARG A 817 3.676 0.478 -0.288 1.00 38.42 H new ATOM 0 HE ARG A 817 4.237 2.951 -0.716 1.00 39.83 H new ATOM 0 HH11 ARG A 817 3.577 4.179 -2.502 1.00 42.01 H new ATOM 0 HH12 ARG A 817 3.243 3.501 -3.786 1.00 42.01 H new ATOM 0 HH21 ARG A 817 3.822 0.416 -2.793 1.00 44.00 H new ATOM 0 HH22 ARG A 817 3.390 1.232 -3.962 1.00 44.00 H new ATOM 2971 N CYS A 818 5.029 -3.261 1.900 1.00 33.59 N ANISOU 2971 N CYS A 818 3933 3907 4922 -135 -407 70 N ATOM 2972 CA CYS A 818 5.581 -4.542 2.350 1.00 36.11 C ANISOU 2972 CA CYS A 818 4274 4192 5255 -128 -372 78 C ATOM 2973 C CYS A 818 7.108 -4.566 2.165 1.00 38.54 C ANISOU 2973 C CYS A 818 4673 4561 5410 -95 -365 37 C ATOM 2974 O CYS A 818 7.641 -5.240 1.276 1.00 40.01 O ANISOU 2974 O CYS A 818 4904 4729 5569 -97 -427 -21 O ATOM 2975 CB CYS A 818 4.884 -5.712 1.655 1.00 39.40 C ANISOU 2975 CB CYS A 818 4655 4511 5804 -165 -452 52 C ATOM 2976 SG CYS A 818 3.095 -5.786 1.973 1.00 45.57 S ANISOU 2976 SG CYS A 818 5307 5207 6799 -206 -454 109 S ATOM 0 H CYS A 818 4.687 -3.287 1.111 1.00 33.59 H new ATOM 0 HA CYS A 818 5.409 -4.642 3.299 1.00 36.11 H new ATOM 0 HB2 CYS A 818 5.032 -5.645 0.699 1.00 39.40 H new ATOM 0 HB3 CYS A 818 5.292 -6.542 1.948 1.00 39.40 H new ATOM 0 HG CYS A 818 2.547 -4.891 1.391 1.00 45.57 H new ATOM 2977 N THR A 819 7.799 -3.802 3.017 1.00 31.77 N ANISOU 2977 N THR A 819 3839 3774 4459 -64 -290 63 N ATOM 2978 CA THR A 819 9.250 -3.614 3.017 1.00 30.16 C ANISOU 2978 CA THR A 819 3703 3633 4124 -31 -274 33 C ATOM 2979 C THR A 819 9.665 -3.479 4.484 1.00 32.57 C ANISOU 2979 C THR A 819 4009 3975 4391 2 -181 86 C ATOM 2980 O THR A 819 9.287 -2.506 5.137 1.00 31.65 O ANISOU 2980 O THR A 819 3871 3893 4260 10 -139 111 O ATOM 2981 CB THR A 819 9.618 -2.310 2.233 1.00 37.38 C ANISOU 2981 CB THR A 819 4644 4607 4951 -29 -309 -6 C ATOM 2982 OG1 THR A 819 9.138 -2.435 0.890 1.00 43.76 O ANISOU 2982 OG1 THR A 819 5459 5385 5782 -53 -398 -48 O ATOM 2983 CG2 THR A 819 11.123 -2.032 2.211 1.00 31.52 C ANISOU 2983 CG2 THR A 819 3959 3925 4092 1 -288 -34 C ATOM 0 H THR A 819 7.411 -3.357 3.643 1.00 31.77 H new ATOM 0 HA THR A 819 9.704 -4.356 2.589 1.00 30.16 H new ATOM 0 HB THR A 819 9.200 -1.563 2.690 1.00 37.38 H new ATOM 0 HG1 THR A 819 9.328 -1.740 0.458 1.00 43.76 H new ATOM 0 HG21 THR A 819 11.294 -1.216 1.715 1.00 31.52 H new ATOM 0 HG22 THR A 819 11.447 -1.931 3.120 1.00 31.52 H new ATOM 0 HG23 THR A 819 11.583 -2.772 1.785 1.00 31.52 H new ATOM 2984 N GLU A 820 10.447 -4.440 4.979 1.00 27.03 N ANISOU 2984 N GLU A 820 3334 3266 3669 25 -154 100 N ATOM 2985 CA GLU A 820 10.943 -4.474 6.341 1.00 26.52 C ANISOU 2985 CA GLU A 820 3282 3239 3554 64 -79 150 C ATOM 2986 C GLU A 820 12.456 -4.369 6.287 1.00 30.92 C ANISOU 2986 C GLU A 820 3891 3851 4005 96 -92 111 C ATOM 2987 O GLU A 820 13.144 -5.173 5.641 1.00 28.29 O ANISOU 2987 O GLU A 820 3583 3495 3672 99 -125 80 O ATOM 2988 CB GLU A 820 10.542 -5.785 7.026 1.00 28.05 C ANISOU 2988 CB GLU A 820 3458 3370 3829 70 -37 215 C ATOM 2989 CG GLU A 820 10.668 -5.760 8.549 1.00 30.49 C ANISOU 2989 CG GLU A 820 3777 3716 4090 113 50 287 C ATOM 2990 CD GLU A 820 10.647 -7.143 9.181 1.00 55.60 C ANISOU 2990 CD GLU A 820 6958 6840 7329 129 91 358 C ATOM 2991 OE1 GLU A 820 10.349 -8.132 8.469 1.00 51.07 O ANISOU 2991 OE1 GLU A 820 6363 6184 6859 99 54 350 O ATOM 2992 OE2 GLU A 820 10.985 -7.246 10.381 1.00 48.35 O ANISOU 2992 OE2 GLU A 820 6065 5959 6348 176 154 418 O ATOM 0 H GLU A 820 10.709 -5.111 4.508 1.00 27.03 H new ATOM 0 HA GLU A 820 10.564 -3.740 6.849 1.00 26.52 H new ATOM 0 HB2 GLU A 820 9.624 -5.994 6.791 1.00 28.05 H new ATOM 0 HB3 GLU A 820 11.094 -6.502 6.678 1.00 28.05 H new ATOM 0 HG2 GLU A 820 11.495 -5.314 8.791 1.00 30.49 H new ATOM 0 HG3 GLU A 820 9.943 -5.232 8.918 1.00 30.49 H new ATOM 2993 N ILE A 821 12.953 -3.347 6.946 1.00 27.19 N ANISOU 2993 N ILE A 821 3432 3447 3452 120 -66 108 N ATOM 2994 CA ILE A 821 14.364 -3.050 7.011 1.00 25.96 C ANISOU 2994 CA ILE A 821 3310 3345 3208 149 -78 73 C ATOM 2995 C ILE A 821 14.755 -3.103 8.482 1.00 30.40 C ANISOU 2995 C ILE A 821 3886 3946 3717 194 -32 114 C ATOM 2996 O ILE A 821 14.054 -2.535 9.309 1.00 28.79 O ANISOU 2996 O ILE A 821 3673 3760 3505 202 9 144 O ATOM 2997 CB ILE A 821 14.678 -1.655 6.381 1.00 27.34 C ANISOU 2997 CB ILE A 821 3485 3564 3340 136 -103 22 C ATOM 2998 CG1 ILE A 821 14.247 -1.580 4.886 1.00 26.30 C ANISOU 2998 CG1 ILE A 821 3350 3400 3244 99 -151 -12 C ATOM 2999 CG2 ILE A 821 16.161 -1.277 6.567 1.00 28.13 C ANISOU 2999 CG2 ILE A 821 3606 3716 3368 164 -110 -11 C ATOM 3000 CD1 ILE A 821 14.172 -0.114 4.312 1.00 31.17 C ANISOU 3000 CD1 ILE A 821 3960 4050 3835 83 -167 -38 C ATOM 0 H ILE A 821 12.465 -2.789 7.382 1.00 27.19 H new ATOM 0 HA ILE A 821 14.878 -3.694 6.500 1.00 25.96 H new ATOM 0 HB ILE A 821 14.147 -0.998 6.859 1.00 27.34 H new ATOM 0 HG12 ILE A 821 14.873 -2.094 4.353 1.00 26.30 H new ATOM 0 HG13 ILE A 821 13.378 -2.000 4.788 1.00 26.30 H new ATOM 0 HG21 ILE A 821 16.326 -0.409 6.167 1.00 28.13 H new ATOM 0 HG22 ILE A 821 16.370 -1.242 7.514 1.00 28.13 H new ATOM 0 HG23 ILE A 821 16.721 -1.942 6.137 1.00 28.13 H new ATOM 0 HD11 ILE A 821 13.899 -0.144 3.382 1.00 31.17 H new ATOM 0 HD12 ILE A 821 13.527 0.401 4.821 1.00 31.17 H new ATOM 0 HD13 ILE A 821 15.044 0.305 4.379 1.00 31.17 H new ATOM 3001 N VAL A 822 15.866 -3.780 8.802 1.00 28.01 N ANISOU 3001 N VAL A 822 3609 3657 3378 228 -40 116 N ATOM 3002 CA VAL A 822 16.393 -3.840 10.167 1.00 27.84 C ANISOU 3002 CA VAL A 822 3609 3680 3289 279 -14 152 C ATOM 3003 C VAL A 822 17.808 -3.170 10.178 1.00 30.11 C ANISOU 3003 C VAL A 822 3909 4026 3507 301 -55 96 C ATOM 3004 O VAL A 822 18.691 -3.525 9.383 1.00 28.44 O ANISOU 3004 O VAL A 822 3693 3802 3309 298 -87 62 O ATOM 3005 CB VAL A 822 16.388 -5.293 10.749 1.00 31.28 C ANISOU 3005 CB VAL A 822 4056 4074 3753 307 12 223 C ATOM 3006 CG1 VAL A 822 17.292 -6.245 9.944 1.00 30.50 C ANISOU 3006 CG1 VAL A 822 3961 3938 3688 308 -28 198 C ATOM 3007 CG2 VAL A 822 16.780 -5.310 12.217 1.00 30.68 C ANISOU 3007 CG2 VAL A 822 4013 4050 3594 366 40 272 C ATOM 0 H VAL A 822 16.334 -4.218 8.229 1.00 28.01 H new ATOM 0 HA VAL A 822 15.810 -3.345 10.763 1.00 27.84 H new ATOM 0 HB VAL A 822 15.476 -5.614 10.672 1.00 31.28 H new ATOM 0 HG11 VAL A 822 17.260 -7.131 10.337 1.00 30.50 H new ATOM 0 HG12 VAL A 822 16.982 -6.287 9.026 1.00 30.50 H new ATOM 0 HG13 VAL A 822 18.205 -5.917 9.961 1.00 30.50 H new ATOM 0 HG21 VAL A 822 16.767 -6.223 12.545 1.00 30.68 H new ATOM 0 HG22 VAL A 822 17.672 -4.943 12.318 1.00 30.68 H new ATOM 0 HG23 VAL A 822 16.151 -4.775 12.726 1.00 30.68 H new ATOM 3008 N ALA A 823 17.985 -2.201 11.061 1.00 26.30 N ANISOU 3008 N ALA A 823 3435 3600 2959 324 -51 83 N ATOM 3009 CA ALA A 823 19.268 -1.530 11.287 1.00 26.70 C ANISOU 3009 CA ALA A 823 3487 3701 2956 347 -94 31 C ATOM 3010 C ALA A 823 20.045 -2.306 12.356 1.00 31.66 C ANISOU 3010 C ALA A 823 4142 4356 3533 405 -106 65 C ATOM 3011 O ALA A 823 19.595 -2.377 13.506 1.00 30.80 O ANISOU 3011 O ALA A 823 4063 4272 3368 441 -79 107 O ATOM 3012 CB ALA A 823 19.045 -0.082 11.747 1.00 26.67 C ANISOU 3012 CB ALA A 823 3481 3738 2915 344 -95 -10 C ATOM 0 H ALA A 823 17.351 -1.904 11.561 1.00 26.30 H new ATOM 0 HA ALA A 823 19.773 -1.509 10.459 1.00 26.70 H new ATOM 0 HB1 ALA A 823 19.903 0.347 11.892 1.00 26.67 H new ATOM 0 HB2 ALA A 823 18.553 0.402 11.066 1.00 26.67 H new ATOM 0 HB3 ALA A 823 18.539 -0.079 12.574 1.00 26.67 H new ATOM 3013 N ILE A 824 21.181 -2.931 11.962 1.00 29.75 N ANISOU 3013 N ILE A 824 3889 4106 3307 419 -143 52 N ATOM 3014 CA ILE A 824 22.090 -3.662 12.881 1.00 30.66 C ANISOU 3014 CA ILE A 824 4022 4245 3383 478 -170 83 C ATOM 3015 C ILE A 824 23.512 -3.140 12.683 1.00 33.67 C ANISOU 3015 C ILE A 824 4373 4657 3761 489 -231 20 C ATOM 3016 O ILE A 824 24.053 -3.188 11.578 1.00 30.02 O ANISOU 3016 O ILE A 824 3879 4169 3360 462 -237 -14 O ATOM 3017 CB ILE A 824 22.006 -5.208 12.885 1.00 34.25 C ANISOU 3017 CB ILE A 824 4488 4647 3877 499 -149 153 C ATOM 3018 CG1 ILE A 824 22.019 -5.797 11.460 1.00 34.28 C ANISOU 3018 CG1 ILE A 824 4466 4586 3972 458 -144 128 C ATOM 3019 CG2 ILE A 824 20.782 -5.670 13.698 1.00 36.58 C ANISOU 3019 CG2 ILE A 824 4814 4927 4157 511 -90 234 C ATOM 3020 CD1 ILE A 824 22.324 -7.328 11.386 1.00 48.54 C ANISOU 3020 CD1 ILE A 824 6278 6335 5832 484 -139 175 C ATOM 0 H ILE A 824 21.446 -2.941 11.144 1.00 29.75 H new ATOM 0 HA ILE A 824 21.773 -3.465 13.776 1.00 30.66 H new ATOM 0 HB ILE A 824 22.802 -5.552 13.319 1.00 34.25 H new ATOM 0 HG12 ILE A 824 21.157 -5.632 11.047 1.00 34.28 H new ATOM 0 HG13 ILE A 824 22.681 -5.322 10.934 1.00 34.28 H new ATOM 0 HG21 ILE A 824 20.738 -6.639 13.695 1.00 36.58 H new ATOM 0 HG22 ILE A 824 20.862 -5.354 14.611 1.00 36.58 H new ATOM 0 HG23 ILE A 824 19.974 -5.309 13.301 1.00 36.58 H new ATOM 0 HD11 ILE A 824 22.313 -7.616 10.460 1.00 48.54 H new ATOM 0 HD12 ILE A 824 23.198 -7.503 11.768 1.00 48.54 H new ATOM 0 HD13 ILE A 824 21.650 -7.817 11.884 1.00 48.54 H new ATOM 3021 N ASP A 825 24.088 -2.597 13.751 1.00 30.84 N ANISOU 3021 N ASP A 825 4026 4355 3336 530 -274 3 N ATOM 3022 CA ASP A 825 25.395 -1.978 13.659 1.00 30.92 C ANISOU 3022 CA ASP A 825 3995 4392 3359 537 -339 -60 C ATOM 3023 C ASP A 825 26.510 -2.918 13.998 1.00 35.60 C ANISOU 3023 C ASP A 825 4577 4988 3961 587 -384 -37 C ATOM 3024 O ASP A 825 26.555 -3.460 15.094 1.00 36.86 O ANISOU 3024 O ASP A 825 4774 5174 4056 642 -407 8 O ATOM 3025 CB ASP A 825 25.436 -0.708 14.530 1.00 33.27 C ANISOU 3025 CB ASP A 825 4303 4743 3596 547 -377 -112 C ATOM 3026 CG ASP A 825 25.178 -0.956 15.998 1.00 45.02 C ANISOU 3026 CG ASP A 825 5852 6278 4976 610 -393 -78 C ATOM 3027 OD1 ASP A 825 24.058 -1.389 16.338 1.00 45.17 O ANISOU 3027 OD1 ASP A 825 5916 6290 4958 617 -329 -17 O ATOM 3028 OD2 ASP A 825 26.111 -0.766 16.800 1.00 53.47 O ANISOU 3028 OD2 ASP A 825 6923 7391 6002 655 -470 -107 O ATOM 0 H ASP A 825 23.736 -2.579 14.535 1.00 30.84 H new ATOM 0 HA ASP A 825 25.537 -1.728 12.732 1.00 30.92 H new ATOM 0 HB2 ASP A 825 26.305 -0.288 14.431 1.00 33.27 H new ATOM 0 HB3 ASP A 825 24.777 -0.079 14.198 1.00 33.27 H new ATOM 3029 N ALA A 826 27.404 -3.140 13.054 1.00 33.10 N ANISOU 3029 N ALA A 826 4208 4643 3724 572 -393 -63 N ATOM 3030 CA ALA A 826 28.589 -3.973 13.300 1.00 33.65 C ANISOU 3030 CA ALA A 826 4251 4711 3822 622 -439 -48 C ATOM 3031 C ALA A 826 29.598 -3.126 14.081 1.00 37.19 C ANISOU 3031 C ALA A 826 4668 5212 4250 648 -525 -98 C ATOM 3032 O ALA A 826 29.522 -1.905 14.022 1.00 35.39 O ANISOU 3032 O ALA A 826 4423 5004 4018 615 -537 -156 O ATOM 3033 CB ALA A 826 29.210 -4.385 11.979 1.00 33.30 C ANISOU 3033 CB ALA A 826 4159 4620 3875 599 -409 -68 C ATOM 0 H ALA A 826 27.352 -2.821 12.257 1.00 33.10 H new ATOM 0 HA ALA A 826 28.343 -4.769 13.796 1.00 33.65 H new ATOM 0 HB1 ALA A 826 29.992 -4.935 12.146 1.00 33.30 H new ATOM 0 HB2 ALA A 826 28.564 -4.891 11.461 1.00 33.30 H new ATOM 0 HB3 ALA A 826 29.472 -3.593 11.483 1.00 33.30 H new ATOM 3034 N LEU A 827 30.561 -3.772 14.751 1.00 36.47 N ANISOU 3034 N LEU A 827 4563 5136 4159 708 -589 -77 N ATOM 3035 CA LEU A 827 31.649 -3.125 15.468 1.00 38.68 C ANISOU 3035 CA LEU A 827 4801 5459 4436 738 -690 -127 C ATOM 3036 C LEU A 827 32.715 -2.608 14.516 1.00 45.96 C ANISOU 3036 C LEU A 827 5626 6357 5481 704 -701 -186 C ATOM 3037 O LEU A 827 32.918 -3.164 13.436 1.00 43.95 O ANISOU 3037 O LEU A 827 5338 6055 5304 684 -638 -172 O ATOM 3038 CB LEU A 827 32.317 -4.096 16.473 1.00 39.67 C ANISOU 3038 CB LEU A 827 4941 5606 4524 819 -762 -75 C ATOM 3039 CG LEU A 827 31.543 -4.427 17.747 1.00 45.95 C ANISOU 3039 CG LEU A 827 5834 6444 5181 872 -774 -16 C ATOM 3040 CD1 LEU A 827 32.295 -5.483 18.594 1.00 46.28 C ANISOU 3040 CD1 LEU A 827 5887 6500 5197 956 -843 49 C ATOM 3041 CD2 LEU A 827 31.237 -3.161 18.578 1.00 48.46 C ANISOU 3041 CD2 LEU A 827 6187 6823 5401 872 -821 -79 C ATOM 0 H LEU A 827 30.593 -4.630 14.797 1.00 36.47 H new ATOM 0 HA LEU A 827 31.257 -2.379 15.948 1.00 38.68 H new ATOM 0 HB2 LEU A 827 32.502 -4.928 16.009 1.00 39.67 H new ATOM 0 HB3 LEU A 827 33.173 -3.719 16.731 1.00 39.67 H new ATOM 0 HG LEU A 827 30.692 -4.807 17.479 1.00 45.95 H new ATOM 0 HD11 LEU A 827 31.786 -5.677 19.396 1.00 46.28 H new ATOM 0 HD12 LEU A 827 32.404 -6.296 18.076 1.00 46.28 H new ATOM 0 HD13 LEU A 827 33.167 -5.138 18.841 1.00 46.28 H new ATOM 0 HD21 LEU A 827 30.746 -3.409 19.377 1.00 48.46 H new ATOM 0 HD22 LEU A 827 32.069 -2.731 18.831 1.00 48.46 H new ATOM 0 HD23 LEU A 827 30.704 -2.547 18.049 1.00 48.46 H new ATOM 3042 N HIS A 828 33.423 -1.563 14.946 1.00 48.78 N ANISOU 3042 N HIS A 828 5935 6744 5857 701 -779 -253 N ATOM 3043 CA HIS A 828 34.552 -0.978 14.228 1.00 52.58 C ANISOU 3043 CA HIS A 828 6309 7202 6466 673 -798 -306 C ATOM 3044 C HIS A 828 35.786 -1.554 14.937 1.00 56.41 C ANISOU 3044 C HIS A 828 6743 7702 6989 736 -899 -302 C ATOM 3045 O HIS A 828 35.918 -1.392 16.151 1.00 56.99 O ANISOU 3045 O HIS A 828 6845 7822 6986 781 -1001 -316 O ATOM 3046 CB HIS A 828 34.514 0.561 14.362 1.00 56.27 C ANISOU 3046 CB HIS A 828 6750 7683 6946 629 -831 -383 C ATOM 3047 CG HIS A 828 35.481 1.308 13.488 1.00 61.84 C ANISOU 3047 CG HIS A 828 7344 8354 7797 585 -824 -429 C ATOM 3048 ND1 HIS A 828 36.822 0.942 13.396 1.00 65.22 N ANISOU 3048 ND1 HIS A 828 7677 8769 8335 610 -870 -434 N ATOM 3049 CD2 HIS A 828 35.289 2.438 12.767 1.00 64.49 C ANISOU 3049 CD2 HIS A 828 7648 8666 8191 522 -778 -465 C ATOM 3050 CE1 HIS A 828 37.379 1.819 12.575 1.00 65.12 C ANISOU 3050 CE1 HIS A 828 7576 8723 8444 560 -837 -470 C ATOM 3051 NE2 HIS A 828 36.501 2.750 12.184 1.00 64.97 N ANISOU 3051 NE2 HIS A 828 7593 8695 8395 506 -783 -488 N ATOM 0 H HIS A 828 33.252 -1.163 15.688 1.00 48.78 H new ATOM 0 HA HIS A 828 34.547 -1.179 13.279 1.00 52.58 H new ATOM 0 HB2 HIS A 828 33.616 0.866 14.159 1.00 56.27 H new ATOM 0 HB3 HIS A 828 34.691 0.794 15.287 1.00 56.27 H new ATOM 0 HD2 HIS A 828 34.494 2.913 12.681 1.00 64.49 H new ATOM 0 HE1 HIS A 828 38.268 1.791 12.304 1.00 65.12 H new ATOM 0 HE2 HIS A 828 36.662 3.418 11.666 1.00 64.97 H new ATOM 3052 N PHE A 829 36.642 -2.274 14.197 1.00 51.36 N ANISOU 3052 N PHE A 829 6032 7024 6457 747 -872 -282 N ATOM 3053 CA PHE A 829 37.835 -2.913 14.732 1.00 51.97 C ANISOU 3053 CA PHE A 829 6048 7106 6593 809 -961 -271 C ATOM 3054 C PHE A 829 39.120 -2.160 14.409 1.00 61.90 C ANISOU 3054 C PHE A 829 7172 8348 7998 791 -1010 -332 C ATOM 3055 O PHE A 829 39.519 -2.097 13.236 1.00 61.60 O ANISOU 3055 O PHE A 829 7067 8267 8073 755 -921 -337 O ATOM 3056 CB PHE A 829 37.942 -4.383 14.267 1.00 52.27 C ANISOU 3056 CB PHE A 829 6094 7103 6662 847 -901 -200 C ATOM 3057 CG PHE A 829 36.744 -5.222 14.633 1.00 51.46 C ANISOU 3057 CG PHE A 829 6110 7003 6440 867 -858 -132 C ATOM 3058 CD1 PHE A 829 36.561 -5.672 15.937 1.00 52.72 C ANISOU 3058 CD1 PHE A 829 6333 7202 6496 929 -936 -86 C ATOM 3059 CD2 PHE A 829 35.782 -5.544 13.678 1.00 50.83 C ANISOU 3059 CD2 PHE A 829 6077 6884 6352 824 -740 -112 C ATOM 3060 CE1 PHE A 829 35.421 -6.401 16.287 1.00 52.57 C ANISOU 3060 CE1 PHE A 829 6416 7180 6377 944 -883 -14 C ATOM 3061 CE2 PHE A 829 34.659 -6.305 14.024 1.00 52.22 C ANISOU 3061 CE2 PHE A 829 6348 7053 6439 837 -701 -48 C ATOM 3062 CZ PHE A 829 34.482 -6.718 15.329 1.00 50.15 C ANISOU 3062 CZ PHE A 829 6142 6827 6086 895 -766 4 C ATOM 0 H PHE A 829 36.535 -2.402 13.353 1.00 51.36 H new ATOM 0 HA PHE A 829 37.734 -2.893 15.696 1.00 51.97 H new ATOM 0 HB2 PHE A 829 38.058 -4.402 13.304 1.00 52.27 H new ATOM 0 HB3 PHE A 829 38.737 -4.780 14.657 1.00 52.27 H new ATOM 0 HD1 PHE A 829 37.204 -5.486 16.582 1.00 52.72 H new ATOM 0 HD2 PHE A 829 35.887 -5.250 12.802 1.00 50.83 H new ATOM 0 HE1 PHE A 829 35.296 -6.673 17.168 1.00 52.57 H new ATOM 0 HE2 PHE A 829 34.033 -6.532 13.375 1.00 52.22 H new ATOM 0 HZ PHE A 829 33.728 -7.211 15.562 1.00 50.15 H new ATOM 3063 N ARG A 830 39.788 -1.623 15.469 1.00 62.43 N ANISOU 3063 N ARG A 830 7202 8451 8066 819 -1152 -377 N ATOM 3064 CA ARG A 830 41.076 -0.909 15.391 1.00 63.71 C ANISOU 3064 CA ARG A 830 7225 8597 8384 807 -1227 -438 C ATOM 3065 C ARG A 830 42.089 -1.812 14.701 1.00 67.50 C ANISOU 3065 C ARG A 830 7608 9034 9004 834 -1189 -399 C ATOM 3066 O ARG A 830 42.658 -1.424 13.678 1.00 68.39 O ANISOU 3066 O ARG A 830 7624 9105 9258 792 -1114 -417 O ATOM 3067 CB ARG A 830 41.580 -0.522 16.798 1.00 65.99 C ANISOU 3067 CB ARG A 830 7508 8934 8632 853 -1410 -486 C ATOM 0 H ARG A 830 39.485 -1.672 16.272 1.00 62.43 H new ATOM 0 HA ARG A 830 40.959 -0.090 14.885 1.00 63.71 H new ATOM 3068 N ARG A 831 42.241 -3.048 15.225 1.00 61.92 N ANISOU 3068 N ARG A 831 6935 8336 8254 908 -1228 -340 N ATOM 3069 CA ARG A 831 43.109 -4.100 14.696 1.00 60.77 C ANISOU 3069 CA ARG A 831 6714 8149 8228 949 -1194 -296 C ATOM 3070 C ARG A 831 42.243 -5.206 14.095 1.00 61.21 C ANISOU 3070 C ARG A 831 6864 8177 8215 959 -1068 -229 C ATOM 3071 O ARG A 831 41.159 -5.489 14.608 1.00 60.36 O ANISOU 3071 O ARG A 831 6879 8095 7960 966 -1062 -195 O ATOM 3072 CB ARG A 831 43.998 -4.679 15.811 1.00 61.87 C ANISOU 3072 CB ARG A 831 6813 8310 8385 1032 -1349 -278 C ATOM 3073 CG ARG A 831 45.069 -3.722 16.315 1.00 71.09 C ANISOU 3073 CG ARG A 831 7859 9491 9660 1028 -1489 -351 C ATOM 0 H ARG A 831 41.817 -3.296 15.931 1.00 61.92 H new ATOM 0 HA ARG A 831 43.684 -3.724 14.012 1.00 60.77 H new ATOM 0 HB2 ARG A 831 43.435 -4.940 16.557 1.00 61.87 H new ATOM 0 HB3 ARG A 831 44.427 -5.485 15.483 1.00 61.87 H new ATOM 3074 N TYR A 832 42.719 -5.838 13.024 1.00 56.49 N ANISOU 3074 N TYR A 832 6209 7526 7731 962 -967 -212 N ATOM 3075 CA TYR A 832 41.997 -6.908 12.343 1.00 55.49 C ANISOU 3075 CA TYR A 832 6161 7361 7561 970 -852 -164 C ATOM 3076 C TYR A 832 41.594 -8.064 13.275 1.00 59.94 C ANISOU 3076 C TYR A 832 6807 7929 8038 1037 -906 -93 C ATOM 3077 O TYR A 832 40.416 -8.406 13.347 1.00 59.57 O ANISOU 3077 O TYR A 832 6873 7883 7878 1023 -859 -59 O ATOM 3078 CB TYR A 832 42.807 -7.414 11.135 1.00 56.67 C ANISOU 3078 CB TYR A 832 6224 7453 7856 978 -749 -168 C ATOM 3079 CG TYR A 832 42.263 -8.664 10.474 1.00 57.94 C ANISOU 3079 CG TYR A 832 6457 7565 7994 1000 -649 -129 C ATOM 3080 CD1 TYR A 832 41.255 -8.589 9.515 1.00 58.80 C ANISOU 3080 CD1 TYR A 832 6646 7658 8038 948 -535 -142 C ATOM 3081 CD2 TYR A 832 42.816 -9.913 10.741 1.00 59.80 C ANISOU 3081 CD2 TYR A 832 6671 7762 8289 1075 -671 -85 C ATOM 3082 CE1 TYR A 832 40.767 -9.737 8.887 1.00 58.59 C ANISOU 3082 CE1 TYR A 832 6682 7579 8000 968 -454 -119 C ATOM 3083 CE2 TYR A 832 42.331 -11.066 10.129 1.00 60.64 C ANISOU 3083 CE2 TYR A 832 6839 7812 8390 1095 -582 -58 C ATOM 3084 CZ TYR A 832 41.305 -10.975 9.203 1.00 68.19 C ANISOU 3084 CZ TYR A 832 7877 8753 9278 1040 -476 -79 C ATOM 3085 OH TYR A 832 40.845 -12.125 8.599 1.00 72.22 O ANISOU 3085 OH TYR A 832 8446 9201 9793 1060 -401 -64 O ATOM 0 H TYR A 832 43.480 -5.654 12.669 1.00 56.49 H new ATOM 0 HA TYR A 832 41.163 -6.527 12.027 1.00 55.49 H new ATOM 0 HB2 TYR A 832 42.849 -6.707 10.472 1.00 56.67 H new ATOM 0 HB3 TYR A 832 43.717 -7.587 11.423 1.00 56.67 H new ATOM 0 HD1 TYR A 832 40.901 -7.759 9.289 1.00 58.80 H new ATOM 0 HD2 TYR A 832 43.524 -9.979 11.340 1.00 59.80 H new ATOM 0 HE1 TYR A 832 40.084 -9.671 8.259 1.00 58.59 H new ATOM 0 HE2 TYR A 832 42.695 -11.895 10.341 1.00 60.64 H new ATOM 0 HH TYR A 832 40.293 -11.925 7.999 1.00 72.22 H new ATOM 3086 N LEU A 833 42.569 -8.625 13.997 1.00 56.40 N ANISOU 3086 N LEU A 833 6297 7481 7650 1108 -1006 -67 N ATOM 3087 CA LEU A 833 42.442 -9.781 14.882 1.00 56.32 C ANISOU 3087 CA LEU A 833 6347 7469 7584 1185 -1064 13 C ATOM 3088 C LEU A 833 41.516 -9.613 16.093 1.00 53.81 C ANISOU 3088 C LEU A 833 6148 7211 7086 1199 -1135 48 C ATOM 3089 O LEU A 833 41.133 -10.631 16.680 1.00 50.37 O ANISOU 3089 O LEU A 833 5784 6766 6589 1255 -1145 131 O ATOM 3090 CB LEU A 833 43.830 -10.230 15.339 1.00 58.71 C ANISOU 3090 CB LEU A 833 6538 7761 8006 1258 -1168 27 C ATOM 3091 CG LEU A 833 44.637 -10.900 14.254 1.00 65.83 C ANISOU 3091 CG LEU A 833 7343 8590 9078 1272 -1078 23 C ATOM 3092 CD1 LEU A 833 45.936 -10.153 14.004 1.00 67.45 C ANISOU 3092 CD1 LEU A 833 7389 8796 9441 1267 -1125 -35 C ATOM 3093 CD2 LEU A 833 44.874 -12.366 14.583 1.00 71.90 C ANISOU 3093 CD2 LEU A 833 8127 9313 9879 1357 -1091 104 C ATOM 0 H LEU A 833 43.372 -8.319 13.980 1.00 56.40 H new ATOM 0 HA LEU A 833 42.005 -10.459 14.343 1.00 56.32 H new ATOM 0 HB2 LEU A 833 44.319 -9.459 15.666 1.00 58.71 H new ATOM 0 HB3 LEU A 833 43.734 -10.843 16.085 1.00 58.71 H new ATOM 0 HG LEU A 833 44.127 -10.870 13.429 1.00 65.83 H new ATOM 0 HD11 LEU A 833 46.437 -10.600 13.304 1.00 67.45 H new ATOM 0 HD12 LEU A 833 45.739 -9.244 13.729 1.00 67.45 H new ATOM 0 HD13 LEU A 833 46.462 -10.137 14.819 1.00 67.45 H new ATOM 0 HD21 LEU A 833 45.393 -12.777 13.874 1.00 71.90 H new ATOM 0 HD22 LEU A 833 45.358 -12.436 15.420 1.00 71.90 H new ATOM 0 HD23 LEU A 833 44.021 -12.822 14.664 1.00 71.90 H new ATOM 3094 N ASP A 834 41.136 -8.355 16.449 1.00 48.78 N ANISOU 3094 N ASP A 834 5534 6631 6369 1153 -1175 -10 N ATOM 3095 CA ASP A 834 40.206 -8.049 17.549 1.00 48.08 C ANISOU 3095 CA ASP A 834 5562 6603 6102 1165 -1226 11 C ATOM 3096 C ASP A 834 38.861 -8.750 17.363 1.00 47.82 C ANISOU 3096 C ASP A 834 5644 6548 5979 1152 -1112 78 C ATOM 3097 O ASP A 834 38.216 -9.112 18.341 1.00 47.71 O ANISOU 3097 O ASP A 834 5725 6566 5835 1193 -1139 141 O ATOM 3098 CB ASP A 834 39.910 -6.539 17.603 1.00 50.01 C ANISOU 3098 CB ASP A 834 5806 6892 6303 1101 -1248 -79 C ATOM 3099 CG ASP A 834 41.028 -5.611 18.064 1.00 67.78 C ANISOU 3099 CG ASP A 834 7959 9173 8621 1107 -1384 -157 C ATOM 3100 OD1 ASP A 834 42.159 -6.104 18.301 1.00 67.24 O ANISOU 3100 OD1 ASP A 834 7806 9094 8648 1161 -1469 -145 O ATOM 3101 OD2 ASP A 834 40.774 -4.380 18.166 1.00 77.55 O ANISOU 3101 OD2 ASP A 834 9199 10439 9829 1057 -1407 -232 O ATOM 0 H ASP A 834 41.423 -7.653 16.044 1.00 48.78 H new ATOM 0 HA ASP A 834 40.636 -8.356 18.363 1.00 48.08 H new ATOM 0 HB2 ASP A 834 39.636 -6.257 16.716 1.00 50.01 H new ATOM 0 HB3 ASP A 834 39.150 -6.405 18.191 1.00 50.01 H new ATOM 3102 N GLN A 835 38.422 -8.911 16.105 1.00 41.04 N ANISOU 3102 N GLN A 835 4775 5632 5186 1094 -984 65 N ATOM 3103 CA GLN A 835 37.113 -9.481 15.793 1.00 38.97 C ANISOU 3103 CA GLN A 835 4608 5339 4860 1069 -879 115 C ATOM 3104 C GLN A 835 36.987 -10.963 16.107 1.00 40.80 C ANISOU 3104 C GLN A 835 4880 5524 5100 1130 -863 212 C ATOM 3105 O GLN A 835 35.868 -11.448 16.227 1.00 38.60 O ANISOU 3105 O GLN A 835 4684 5226 4756 1120 -801 268 O ATOM 3106 CB GLN A 835 36.725 -9.191 14.354 1.00 38.60 C ANISOU 3106 CB GLN A 835 4541 5248 4878 993 -765 64 C ATOM 3107 CG GLN A 835 37.553 -9.932 13.315 1.00 45.16 C ANISOU 3107 CG GLN A 835 5298 6013 5846 1005 -714 54 C ATOM 3108 CD GLN A 835 37.293 -9.318 11.978 1.00 56.21 C ANISOU 3108 CD GLN A 835 6681 7392 7286 935 -619 -8 C ATOM 3109 OE1 GLN A 835 36.197 -9.441 11.414 1.00 51.61 O ANISOU 3109 OE1 GLN A 835 6166 6787 6657 893 -543 -4 O ATOM 3110 NE2 GLN A 835 38.265 -8.572 11.491 1.00 45.72 N ANISOU 3110 NE2 GLN A 835 5260 6073 6039 919 -625 -64 N ATOM 0 H GLN A 835 38.880 -8.690 15.412 1.00 41.04 H new ATOM 0 HA GLN A 835 36.486 -9.038 16.386 1.00 38.97 H new ATOM 0 HB2 GLN A 835 35.791 -9.421 14.230 1.00 38.60 H new ATOM 0 HB3 GLN A 835 36.806 -8.238 14.195 1.00 38.60 H new ATOM 0 HG2 GLN A 835 38.496 -9.877 13.534 1.00 45.16 H new ATOM 0 HG3 GLN A 835 37.318 -10.873 13.305 1.00 45.16 H new ATOM 0 HE21 GLN A 835 39.013 -8.511 11.912 1.00 45.72 H new ATOM 0 HE22 GLN A 835 38.151 -8.146 10.753 1.00 45.72 H new ATOM 3111 N PHE A 836 38.125 -11.666 16.249 1.00 38.38 N ANISOU 3111 N PHE A 836 4507 5194 4884 1193 -919 235 N ATOM 3112 CA PHE A 836 38.160 -13.094 16.556 1.00 38.80 C ANISOU 3112 CA PHE A 836 4585 5193 4964 1259 -912 331 C ATOM 3113 C PHE A 836 38.112 -13.356 18.050 1.00 43.90 C ANISOU 3113 C PHE A 836 5293 5892 5496 1333 -1009 414 C ATOM 3114 O PHE A 836 37.929 -14.502 18.445 1.00 44.76 O ANISOU 3114 O PHE A 836 5443 5959 5606 1388 -997 513 O ATOM 3115 CB PHE A 836 39.332 -13.795 15.856 1.00 40.59 C ANISOU 3115 CB PHE A 836 4711 5356 5355 1294 -909 319 C ATOM 3116 CG PHE A 836 39.203 -13.742 14.343 1.00 40.78 C ANISOU 3116 CG PHE A 836 4701 5324 5470 1231 -790 250 C ATOM 3117 CD1 PHE A 836 38.412 -14.662 13.661 1.00 41.66 C ANISOU 3117 CD1 PHE A 836 4866 5359 5603 1215 -689 275 C ATOM 3118 CD2 PHE A 836 39.874 -12.773 13.604 1.00 42.64 C ANISOU 3118 CD2 PHE A 836 4854 5580 5768 1189 -779 161 C ATOM 3119 CE1 PHE A 836 38.300 -14.615 12.267 1.00 41.70 C ANISOU 3119 CE1 PHE A 836 4851 5318 5674 1164 -589 205 C ATOM 3120 CE2 PHE A 836 39.747 -12.718 12.207 1.00 43.78 C ANISOU 3120 CE2 PHE A 836 4979 5679 5976 1138 -664 104 C ATOM 3121 CZ PHE A 836 38.964 -13.641 11.549 1.00 40.59 C ANISOU 3121 CZ PHE A 836 4638 5208 5575 1129 -574 124 C ATOM 0 H PHE A 836 38.905 -11.314 16.167 1.00 38.38 H new ATOM 0 HA PHE A 836 37.353 -13.491 16.193 1.00 38.80 H new ATOM 0 HB2 PHE A 836 40.165 -13.377 16.124 1.00 40.59 H new ATOM 0 HB3 PHE A 836 39.374 -14.720 16.144 1.00 40.59 H new ATOM 0 HD1 PHE A 836 37.953 -15.315 14.137 1.00 41.66 H new ATOM 0 HD2 PHE A 836 40.413 -12.154 14.041 1.00 42.64 H new ATOM 0 HE1 PHE A 836 37.776 -15.242 11.823 1.00 41.70 H new ATOM 0 HE2 PHE A 836 40.192 -12.058 11.725 1.00 43.78 H new ATOM 0 HZ PHE A 836 38.883 -13.608 10.623 1.00 40.59 H new ATOM 3122 N VAL A 837 38.184 -12.289 18.880 1.00 41.11 N ANISOU 3122 N VAL A 837 4957 5629 5036 1335 -1099 376 N ATOM 3123 CA VAL A 837 38.061 -12.373 20.335 1.00 41.91 C ANISOU 3123 CA VAL A 837 5136 5797 4992 1408 -1193 444 C ATOM 3124 C VAL A 837 36.642 -12.928 20.651 1.00 43.31 C ANISOU 3124 C VAL A 837 5433 5960 5065 1404 -1092 536 C ATOM 3125 O VAL A 837 35.688 -12.410 20.097 1.00 41.58 O ANISOU 3125 O VAL A 837 5242 5733 4825 1329 -1000 498 O ATOM 3126 CB VAL A 837 38.370 -11.006 21.029 1.00 46.77 C ANISOU 3126 CB VAL A 837 5749 6507 5515 1403 -1305 357 C ATOM 3127 CG1 VAL A 837 37.992 -11.021 22.511 1.00 47.38 C ANISOU 3127 CG1 VAL A 837 5937 6663 5403 1476 -1383 421 C ATOM 3128 CG2 VAL A 837 39.845 -10.630 20.863 1.00 47.41 C ANISOU 3128 CG2 VAL A 837 5702 6592 5721 1418 -1418 285 C ATOM 0 H VAL A 837 38.308 -11.487 18.596 1.00 41.11 H new ATOM 0 HA VAL A 837 38.725 -12.978 20.701 1.00 41.91 H new ATOM 0 HB VAL A 837 37.824 -10.334 20.591 1.00 46.77 H new ATOM 0 HG11 VAL A 837 38.197 -10.159 22.906 1.00 47.38 H new ATOM 0 HG12 VAL A 837 37.043 -11.200 22.601 1.00 47.38 H new ATOM 0 HG13 VAL A 837 38.496 -11.714 22.967 1.00 47.38 H new ATOM 0 HG21 VAL A 837 40.014 -9.781 21.300 1.00 47.41 H new ATOM 0 HG22 VAL A 837 40.401 -11.316 21.264 1.00 47.41 H new ATOM 0 HG23 VAL A 837 40.056 -10.555 19.919 1.00 47.41 H new ATOM 3129 N PRO A 838 36.494 -14.015 21.466 1.00 41.34 N ANISOU 3129 N PRO A 838 5244 5696 4768 1481 -1102 663 N ATOM 3130 CA PRO A 838 35.156 -14.585 21.728 1.00 40.55 C ANISOU 3130 CA PRO A 838 5242 5569 4594 1474 -993 760 C ATOM 3131 C PRO A 838 34.074 -13.589 22.099 1.00 42.84 C ANISOU 3131 C PRO A 838 5608 5926 4743 1431 -951 730 C ATOM 3132 O PRO A 838 32.971 -13.687 21.580 1.00 40.67 O ANISOU 3132 O PRO A 838 5362 5608 4484 1371 -834 744 O ATOM 3133 CB PRO A 838 35.417 -15.588 22.858 1.00 43.94 C ANISOU 3133 CB PRO A 838 5725 6005 4964 1581 -1046 899 C ATOM 3134 CG PRO A 838 36.809 -16.025 22.638 1.00 48.50 C ANISOU 3134 CG PRO A 838 6209 6555 5665 1628 -1140 882 C ATOM 3135 CD PRO A 838 37.537 -14.776 22.191 1.00 43.34 C ANISOU 3135 CD PRO A 838 5474 5953 5041 1582 -1211 733 C ATOM 0 HA PRO A 838 34.791 -14.976 20.919 1.00 40.55 H new ATOM 0 HB2 PRO A 838 35.308 -15.176 23.730 1.00 43.94 H new ATOM 0 HB3 PRO A 838 34.800 -16.336 22.818 1.00 43.94 H new ATOM 0 HG2 PRO A 838 37.197 -16.388 23.450 1.00 48.50 H new ATOM 0 HG3 PRO A 838 36.858 -16.721 21.965 1.00 48.50 H new ATOM 0 HD2 PRO A 838 37.886 -14.276 22.945 1.00 43.34 H new ATOM 0 HD3 PRO A 838 38.290 -14.987 21.617 1.00 43.34 H new ATOM 3136 N GLU A 839 34.401 -12.606 22.952 1.00 41.35 N ANISOU 3136 N GLU A 839 5446 5838 4429 1460 -1051 679 N ATOM 3137 CA GLU A 839 33.466 -11.574 23.379 1.00 40.91 C ANISOU 3137 CA GLU A 839 5459 5848 4235 1428 -1020 638 C ATOM 3138 C GLU A 839 33.013 -10.731 22.159 1.00 43.40 C ANISOU 3138 C GLU A 839 5720 6131 4639 1318 -945 529 C ATOM 3139 O GLU A 839 31.840 -10.373 22.080 1.00 42.91 O ANISOU 3139 O GLU A 839 5709 6070 4524 1273 -852 533 O ATOM 3140 CB GLU A 839 34.113 -10.690 24.455 1.00 43.37 C ANISOU 3140 CB GLU A 839 5799 6265 4413 1485 -1162 581 C ATOM 3141 CG GLU A 839 33.126 -9.837 25.236 1.00 58.49 C ANISOU 3141 CG GLU A 839 7817 8256 6151 1486 -1132 566 C ATOM 0 H GLU A 839 35.184 -12.526 23.299 1.00 41.35 H new ATOM 0 HA GLU A 839 32.681 -11.992 23.765 1.00 40.91 H new ATOM 0 HB2 GLU A 839 34.598 -11.256 25.076 1.00 43.37 H new ATOM 0 HB3 GLU A 839 34.765 -10.108 24.033 1.00 43.37 H new ATOM 3142 N LYS A 840 33.932 -10.451 21.205 1.00 39.12 N ANISOU 3142 N LYS A 840 5073 5557 4233 1278 -980 442 N ATOM 3143 CA LYS A 840 33.614 -9.664 20.007 1.00 38.07 C ANISOU 3143 CA LYS A 840 4889 5395 4181 1181 -912 347 C ATOM 3144 C LYS A 840 32.787 -10.496 19.033 1.00 39.27 C ANISOU 3144 C LYS A 840 5046 5459 4414 1135 -784 393 C ATOM 3145 O LYS A 840 31.839 -9.972 18.462 1.00 39.11 O ANISOU 3145 O LYS A 840 5044 5428 4388 1067 -707 360 O ATOM 3146 CB LYS A 840 34.883 -9.078 19.363 1.00 41.18 C ANISOU 3146 CB LYS A 840 5172 5786 4689 1160 -982 249 C ATOM 3147 CG LYS A 840 35.521 -7.957 20.207 1.00 44.22 C ANISOU 3147 CG LYS A 840 5544 6251 5005 1182 -1109 175 C ATOM 0 H LYS A 840 34.750 -10.715 21.243 1.00 39.12 H new ATOM 0 HA LYS A 840 33.073 -8.903 20.269 1.00 38.07 H new ATOM 0 HB2 LYS A 840 35.531 -9.788 19.233 1.00 41.18 H new ATOM 0 HB3 LYS A 840 34.663 -8.730 18.485 1.00 41.18 H new ATOM 3148 N MET A 841 33.101 -11.797 18.886 1.00 33.87 N ANISOU 3148 N MET A 841 4350 4710 3808 1175 -768 468 N ATOM 3149 CA MET A 841 32.307 -12.714 18.044 1.00 33.21 C ANISOU 3149 CA MET A 841 4276 4534 3808 1138 -658 511 C ATOM 3150 C MET A 841 30.905 -12.874 18.623 1.00 36.17 C ANISOU 3150 C MET A 841 4739 4912 4094 1129 -587 588 C ATOM 3151 O MET A 841 29.948 -12.760 17.889 1.00 33.55 O ANISOU 3151 O MET A 841 4413 4540 3796 1061 -504 567 O ATOM 3152 CB MET A 841 32.981 -14.087 17.908 1.00 35.55 C ANISOU 3152 CB MET A 841 4543 4755 4208 1192 -664 576 C ATOM 3153 CG MET A 841 34.257 -14.009 17.117 1.00 38.97 C ANISOU 3153 CG MET A 841 4881 5170 4756 1194 -706 498 C ATOM 3154 SD MET A 841 34.890 -15.589 16.577 1.00 44.08 S ANISOU 3154 SD MET A 841 5485 5707 5556 1241 -680 549 S ATOM 3155 CE MET A 841 35.131 -16.450 18.198 1.00 41.65 C ANISOU 3155 CE MET A 841 5228 5420 5179 1350 -758 695 C ATOM 0 H MET A 841 33.775 -12.169 19.269 1.00 33.87 H new ATOM 0 HA MET A 841 32.248 -12.325 17.157 1.00 33.21 H new ATOM 0 HB2 MET A 841 33.169 -14.443 18.790 1.00 35.55 H new ATOM 0 HB3 MET A 841 32.371 -14.705 17.477 1.00 35.55 H new ATOM 0 HG2 MET A 841 34.108 -13.450 16.339 1.00 38.97 H new ATOM 0 HG3 MET A 841 34.933 -13.570 17.657 1.00 38.97 H new ATOM 0 HE1 MET A 841 35.690 -17.232 18.069 1.00 41.65 H new ATOM 0 HE2 MET A 841 35.559 -15.846 18.825 1.00 41.65 H new ATOM 0 HE3 MET A 841 34.270 -16.724 18.550 1.00 41.65 H new ATOM 3156 N ARG A 842 30.791 -13.105 19.949 1.00 35.88 N ANISOU 3156 N ARG A 842 4767 4924 3942 1200 -619 678 N ATOM 3157 CA ARG A 842 29.511 -13.242 20.651 1.00 37.21 C ANISOU 3157 CA ARG A 842 5018 5102 4018 1204 -542 764 C ATOM 3158 C ARG A 842 28.664 -11.978 20.505 1.00 42.07 C ANISOU 3158 C ARG A 842 5652 5766 4567 1141 -504 687 C ATOM 3159 O ARG A 842 27.444 -12.076 20.400 1.00 41.63 O ANISOU 3159 O ARG A 842 5627 5680 4511 1103 -408 728 O ATOM 3160 CB ARG A 842 29.765 -13.503 22.128 1.00 39.45 C ANISOU 3160 CB ARG A 842 5373 5452 4164 1303 -596 859 C ATOM 3161 CG ARG A 842 28.672 -14.278 22.820 1.00 50.65 C ANISOU 3161 CG ARG A 842 6868 6846 5533 1332 -499 1002 C ATOM 3162 CD ARG A 842 29.189 -14.957 24.073 1.00 54.55 C ANISOU 3162 CD ARG A 842 7422 7377 5927 1443 -554 1121 C ATOM 3163 NE ARG A 842 29.964 -14.043 24.914 1.00 62.66 N ANISOU 3163 NE ARG A 842 8478 8522 6807 1499 -677 1061 N ATOM 3164 CZ ARG A 842 31.246 -14.213 25.230 1.00 71.40 C ANISOU 3164 CZ ARG A 842 9557 9657 7914 1563 -807 1049 C ATOM 3165 NH1 ARG A 842 31.912 -15.278 24.792 1.00 54.16 N ANISOU 3165 NH1 ARG A 842 7317 7393 5869 1583 -823 1100 N ATOM 3166 NH2 ARG A 842 31.871 -13.322 25.989 1.00 52.60 N ANISOU 3166 NH2 ARG A 842 7201 7382 5404 1608 -926 982 N ATOM 0 H ARG A 842 31.473 -13.186 20.467 1.00 35.88 H new ATOM 0 HA ARG A 842 29.029 -13.986 20.257 1.00 37.21 H new ATOM 0 HB2 ARG A 842 30.599 -13.989 22.221 1.00 39.45 H new ATOM 0 HB3 ARG A 842 29.880 -12.653 22.580 1.00 39.45 H new ATOM 0 HG2 ARG A 842 27.944 -13.680 23.050 1.00 50.65 H new ATOM 0 HG3 ARG A 842 28.311 -14.944 22.214 1.00 50.65 H new ATOM 0 HD2 ARG A 842 28.441 -15.307 24.582 1.00 54.55 H new ATOM 0 HD3 ARG A 842 29.742 -15.714 23.825 1.00 54.55 H new ATOM 0 HE ARG A 842 29.564 -13.349 25.225 1.00 62.66 H new ATOM 0 HH11 ARG A 842 31.515 -15.862 24.301 1.00 54.16 H new ATOM 0 HH12 ARG A 842 32.740 -15.383 24.999 1.00 54.16 H new ATOM 0 HH21 ARG A 842 31.448 -12.632 26.279 1.00 52.60 H new ATOM 0 HH22 ARG A 842 32.699 -13.435 26.191 1.00 52.60 H new ATOM 3167 N ARG A 843 29.312 -10.793 20.515 1.00 38.93 N ANISOU 3167 N ARG A 843 5228 5437 4125 1130 -583 578 N ATOM 3168 CA ARG A 843 28.625 -9.522 20.381 1.00 38.12 C ANISOU 3168 CA ARG A 843 5137 5378 3969 1075 -558 498 C ATOM 3169 C ARG A 843 27.943 -9.439 18.990 1.00 39.27 C ANISOU 3169 C ARG A 843 5237 5452 4232 982 -474 455 C ATOM 3170 O ARG A 843 26.772 -9.036 18.893 1.00 38.09 O ANISOU 3170 O ARG A 843 5116 5298 4059 940 -400 458 O ATOM 3171 CB ARG A 843 29.618 -8.347 20.609 1.00 38.26 C ANISOU 3171 CB ARG A 843 5122 5467 3947 1082 -669 387 C ATOM 3172 CG ARG A 843 28.952 -6.961 20.696 1.00 43.62 C ANISOU 3172 CG ARG A 843 5822 6195 4559 1038 -654 305 C ATOM 3173 CD ARG A 843 28.689 -6.380 19.320 1.00 38.86 C ANISOU 3173 CD ARG A 843 5155 5542 4069 945 -602 231 C ATOM 3174 NE ARG A 843 28.241 -4.999 19.376 1.00 39.57 N ANISOU 3174 NE ARG A 843 5252 5672 4112 907 -602 148 N ATOM 3175 CZ ARG A 843 27.765 -4.320 18.339 1.00 45.08 C ANISOU 3175 CZ ARG A 843 5911 6336 4881 830 -552 92 C ATOM 3176 NH1 ARG A 843 27.673 -4.893 17.146 1.00 26.44 N ANISOU 3176 NH1 ARG A 843 3508 3908 2630 783 -500 105 N ATOM 3177 NH2 ARG A 843 27.372 -3.067 18.487 1.00 37.77 N ANISOU 3177 NH2 ARG A 843 4993 5444 3915 803 -556 23 N ATOM 0 H ARG A 843 30.165 -10.721 20.601 1.00 38.93 H new ATOM 0 HA ARG A 843 27.933 -9.453 21.058 1.00 38.12 H new ATOM 0 HB2 ARG A 843 30.111 -8.509 21.428 1.00 38.26 H new ATOM 0 HB3 ARG A 843 30.264 -8.339 19.886 1.00 38.26 H new ATOM 0 HG2 ARG A 843 28.116 -7.033 21.183 1.00 43.62 H new ATOM 0 HG3 ARG A 843 29.522 -6.358 21.199 1.00 43.62 H new ATOM 0 HD2 ARG A 843 29.499 -6.433 18.790 1.00 38.86 H new ATOM 0 HD3 ARG A 843 28.019 -6.916 18.868 1.00 38.86 H new ATOM 0 HE ARG A 843 28.287 -4.593 20.133 1.00 39.57 H new ATOM 0 HH11 ARG A 843 27.922 -5.709 17.041 1.00 26.44 H new ATOM 0 HH12 ARG A 843 27.364 -4.448 16.478 1.00 26.44 H new ATOM 0 HH21 ARG A 843 27.424 -2.688 19.257 1.00 37.77 H new ATOM 0 HH22 ARG A 843 27.064 -2.630 17.813 1.00 37.77 H new ATOM 3178 N GLU A 844 28.687 -9.812 17.935 1.00 33.87 N ANISOU 3178 N GLU A 844 4485 4714 3671 957 -488 413 N ATOM 3179 CA GLU A 844 28.213 -9.763 16.548 1.00 32.56 C ANISOU 3179 CA GLU A 844 4281 4484 3606 879 -424 364 C ATOM 3180 C GLU A 844 27.070 -10.735 16.321 1.00 34.63 C ANISOU 3180 C GLU A 844 4573 4672 3911 859 -338 441 C ATOM 3181 O GLU A 844 26.064 -10.367 15.700 1.00 31.19 O ANISOU 3181 O GLU A 844 4140 4214 3497 797 -281 417 O ATOM 3182 CB GLU A 844 29.358 -9.931 15.531 1.00 33.79 C ANISOU 3182 CB GLU A 844 4364 4606 3868 869 -454 301 C ATOM 3183 CG GLU A 844 30.420 -8.827 15.589 1.00 41.91 C ANISOU 3183 CG GLU A 844 5344 5697 4884 870 -531 218 C ATOM 3184 CD GLU A 844 29.992 -7.395 15.299 1.00 51.20 C ANISOU 3184 CD GLU A 844 6515 6913 6026 812 -523 140 C ATOM 3185 OE1 GLU A 844 29.009 -6.940 15.920 1.00 40.39 O ANISOU 3185 OE1 GLU A 844 5202 5574 4571 804 -500 158 O ATOM 3186 OE2 GLU A 844 30.686 -6.701 14.520 1.00 51.47 O ANISOU 3186 OE2 GLU A 844 6488 6949 6120 778 -538 65 O ATOM 0 H GLU A 844 29.492 -10.104 18.011 1.00 33.87 H new ATOM 0 HA GLU A 844 27.857 -8.874 16.394 1.00 32.56 H new ATOM 0 HB2 GLU A 844 29.788 -10.787 15.682 1.00 33.79 H new ATOM 0 HB3 GLU A 844 28.982 -9.957 14.637 1.00 33.79 H new ATOM 0 HG2 GLU A 844 30.815 -8.844 16.475 1.00 41.91 H new ATOM 0 HG3 GLU A 844 31.122 -9.059 14.961 1.00 41.91 H new ATOM 3187 N LEU A 845 27.176 -11.937 16.925 1.00 31.37 N ANISOU 3187 N LEU A 845 4184 4223 3513 916 -332 540 N ATOM 3188 CA LEU A 845 26.124 -12.951 16.869 1.00 31.06 C ANISOU 3188 CA LEU A 845 4168 4103 3529 903 -252 627 C ATOM 3189 C LEU A 845 24.856 -12.449 17.508 1.00 35.23 C ANISOU 3189 C LEU A 845 4742 4662 3980 886 -192 671 C ATOM 3190 O LEU A 845 23.785 -12.610 16.928 1.00 35.80 O ANISOU 3190 O LEU A 845 4808 4676 4119 830 -124 678 O ATOM 3191 CB LEU A 845 26.589 -14.215 17.597 1.00 32.28 C ANISOU 3191 CB LEU A 845 4341 4222 3703 978 -263 737 C ATOM 3192 CG LEU A 845 27.479 -15.152 16.802 1.00 37.56 C ANISOU 3192 CG LEU A 845 4961 4813 4498 990 -286 719 C ATOM 3193 CD1 LEU A 845 28.181 -16.126 17.726 1.00 38.77 C ANISOU 3193 CD1 LEU A 845 5130 4954 4647 1079 -322 823 C ATOM 3194 CD2 LEU A 845 26.671 -15.910 15.749 1.00 38.33 C ANISOU 3194 CD2 LEU A 845 5041 4798 4725 931 -217 711 C ATOM 0 H LEU A 845 27.866 -12.178 17.378 1.00 31.37 H new ATOM 0 HA LEU A 845 25.944 -13.151 15.937 1.00 31.06 H new ATOM 0 HB2 LEU A 845 27.065 -13.948 18.399 1.00 32.28 H new ATOM 0 HB3 LEU A 845 25.805 -14.708 17.884 1.00 32.28 H new ATOM 0 HG LEU A 845 28.148 -14.617 16.346 1.00 37.56 H new ATOM 0 HD11 LEU A 845 28.745 -16.718 17.204 1.00 38.77 H new ATOM 0 HD12 LEU A 845 28.727 -15.635 18.360 1.00 38.77 H new ATOM 0 HD13 LEU A 845 27.521 -16.650 18.206 1.00 38.77 H new ATOM 0 HD21 LEU A 845 27.259 -16.502 15.254 1.00 38.33 H new ATOM 0 HD22 LEU A 845 25.980 -16.432 16.185 1.00 38.33 H new ATOM 0 HD23 LEU A 845 26.261 -15.278 15.139 1.00 38.33 H new ATOM 3195 N ASN A 846 24.972 -11.834 18.713 1.00 32.42 N ANISOU 3195 N ASN A 846 4435 4399 3485 938 -218 696 N ATOM 3196 CA ASN A 846 23.833 -11.343 19.486 1.00 32.45 C ANISOU 3196 CA ASN A 846 4490 4442 3399 939 -152 741 C ATOM 3197 C ASN A 846 23.156 -10.190 18.809 1.00 36.14 C ANISOU 3197 C ASN A 846 4933 4923 3874 866 -129 647 C ATOM 3198 O ASN A 846 21.933 -10.127 18.829 1.00 36.96 O ANISOU 3198 O ASN A 846 5047 5003 3992 834 -48 684 O ATOM 3199 CB ASN A 846 24.233 -11.013 20.928 1.00 31.87 C ANISOU 3199 CB ASN A 846 4483 4466 3161 1025 -192 782 C ATOM 3200 CG ASN A 846 24.551 -12.239 21.743 1.00 41.01 C ANISOU 3200 CG ASN A 846 5679 5604 4298 1104 -192 913 C ATOM 3201 OD1 ASN A 846 24.145 -13.357 21.432 1.00 40.23 O ANISOU 3201 OD1 ASN A 846 5566 5413 4305 1094 -131 998 O ATOM 3202 ND2 ASN A 846 25.311 -12.065 22.788 1.00 32.66 N ANISOU 3202 ND2 ASN A 846 4669 4629 3110 1185 -266 930 N ATOM 0 H ASN A 846 25.730 -11.696 19.096 1.00 32.42 H new ATOM 0 HA ASN A 846 23.182 -12.061 19.530 1.00 32.45 H new ATOM 0 HB2 ASN A 846 25.006 -10.427 20.918 1.00 31.87 H new ATOM 0 HB3 ASN A 846 23.512 -10.524 21.355 1.00 31.87 H new ATOM 0 HD21 ASN A 846 25.536 -12.739 23.273 1.00 32.66 H new ATOM 0 HD22 ASN A 846 25.587 -11.277 22.992 1.00 32.66 H new ATOM 3203 N LYS A 847 23.941 -9.309 18.175 1.00 32.35 N ANISOU 3203 N LYS A 847 4415 4475 3400 838 -198 532 N ATOM 3204 CA LYS A 847 23.425 -8.155 17.422 1.00 31.78 C ANISOU 3204 CA LYS A 847 4316 4413 3345 769 -184 440 C ATOM 3205 C LYS A 847 22.619 -8.645 16.246 1.00 35.47 C ANISOU 3205 C LYS A 847 4749 4793 3934 702 -128 441 C ATOM 3206 O LYS A 847 21.485 -8.203 16.086 1.00 36.82 O ANISOU 3206 O LYS A 847 4922 4954 4116 661 -74 442 O ATOM 3207 CB LYS A 847 24.567 -7.226 16.937 1.00 32.57 C ANISOU 3207 CB LYS A 847 4376 4554 3446 756 -266 329 C ATOM 3208 CG LYS A 847 24.116 -6.056 16.034 1.00 33.03 C ANISOU 3208 CG LYS A 847 4403 4613 3535 684 -251 242 C ATOM 3209 CD LYS A 847 23.179 -5.016 16.709 1.00 33.37 C ANISOU 3209 CD LYS A 847 4480 4702 3497 679 -220 230 C ATOM 3210 CE LYS A 847 23.934 -4.292 17.787 1.00 37.34 C ANISOU 3210 CE LYS A 847 5010 5285 3894 733 -289 193 C ATOM 3211 NZ LYS A 847 23.220 -3.109 18.257 1.00 36.38 N ANISOU 3211 NZ LYS A 847 4914 5205 3705 725 -269 149 N ATOM 0 H LYS A 847 24.799 -9.366 18.170 1.00 32.35 H new ATOM 0 HA LYS A 847 22.861 -7.635 18.015 1.00 31.78 H new ATOM 0 HB2 LYS A 847 25.021 -6.862 17.713 1.00 32.57 H new ATOM 0 HB3 LYS A 847 25.216 -7.759 16.452 1.00 32.57 H new ATOM 0 HG2 LYS A 847 24.905 -5.595 15.710 1.00 33.03 H new ATOM 0 HG3 LYS A 847 23.663 -6.422 15.259 1.00 33.03 H new ATOM 0 HD2 LYS A 847 22.851 -4.385 16.050 1.00 33.37 H new ATOM 0 HD3 LYS A 847 22.404 -5.461 17.086 1.00 33.37 H new ATOM 0 HE2 LYS A 847 24.087 -4.893 18.533 1.00 37.34 H new ATOM 0 HE3 LYS A 847 24.805 -4.030 17.450 1.00 37.34 H new ATOM 0 HZ1 LYS A 847 23.374 -2.995 19.126 1.00 36.38 H new ATOM 0 HZ2 LYS A 847 23.503 -2.394 17.809 1.00 36.38 H new ATOM 0 HZ3 LYS A 847 22.347 -3.216 18.122 1.00 36.38 H new ATOM 3212 N ALA A 848 23.192 -9.548 15.417 1.00 30.84 N ANISOU 3212 N ALA A 848 4132 4143 3443 694 -145 436 N ATOM 3213 CA ALA A 848 22.490 -10.093 14.243 1.00 29.66 C ANISOU 3213 CA ALA A 848 3955 3907 3408 635 -106 424 C ATOM 3214 C ALA A 848 21.268 -10.902 14.685 1.00 34.95 C ANISOU 3214 C ALA A 848 4643 4519 4118 630 -35 522 C ATOM 3215 O ALA A 848 20.198 -10.724 14.133 1.00 35.45 O ANISOU 3215 O ALA A 848 4690 4544 4235 575 3 511 O ATOM 3216 CB ALA A 848 23.440 -10.942 13.393 1.00 29.96 C ANISOU 3216 CB ALA A 848 3966 3890 3529 641 -136 395 C ATOM 0 H ALA A 848 23.989 -9.854 15.523 1.00 30.84 H new ATOM 0 HA ALA A 848 22.181 -9.356 13.694 1.00 29.66 H new ATOM 0 HB1 ALA A 848 22.962 -11.292 12.625 1.00 29.96 H new ATOM 0 HB2 ALA A 848 24.180 -10.394 13.090 1.00 29.96 H new ATOM 0 HB3 ALA A 848 23.780 -11.678 13.925 1.00 29.96 H new ATOM 3217 N TYR A 849 21.396 -11.708 15.742 1.00 33.39 N ANISOU 3217 N TYR A 849 4476 4318 3892 691 -17 624 N ATOM 3218 CA TYR A 849 20.266 -12.481 16.275 1.00 33.31 C ANISOU 3218 CA TYR A 849 4480 4251 3926 692 63 734 C ATOM 3219 C TYR A 849 19.113 -11.552 16.673 1.00 36.38 C ANISOU 3219 C TYR A 849 4879 4681 4263 667 120 742 C ATOM 3220 O TYR A 849 17.969 -11.873 16.375 1.00 35.54 O ANISOU 3220 O TYR A 849 4747 4507 4247 623 181 778 O ATOM 3221 CB TYR A 849 20.720 -13.332 17.483 1.00 34.51 C ANISOU 3221 CB TYR A 849 4673 4411 4028 774 73 852 C ATOM 3222 CG TYR A 849 19.632 -14.152 18.128 1.00 35.39 C ANISOU 3222 CG TYR A 849 4800 4464 4184 783 169 985 C ATOM 3223 CD1 TYR A 849 19.109 -15.274 17.492 1.00 37.60 C ANISOU 3223 CD1 TYR A 849 5041 4618 4627 746 204 1026 C ATOM 3224 CD2 TYR A 849 19.191 -13.868 19.418 1.00 37.48 C ANISOU 3224 CD2 TYR A 849 5117 4794 4329 836 224 1075 C ATOM 3225 CE1 TYR A 849 18.188 -16.104 18.128 1.00 39.72 C ANISOU 3225 CE1 TYR A 849 5313 4820 4957 756 295 1162 C ATOM 3226 CE2 TYR A 849 18.253 -14.684 20.061 1.00 39.10 C ANISOU 3226 CE2 TYR A 849 5334 4942 4578 851 326 1215 C ATOM 3227 CZ TYR A 849 17.754 -15.799 19.409 1.00 45.18 C ANISOU 3227 CZ TYR A 849 6055 5580 5530 808 362 1262 C ATOM 3228 OH TYR A 849 16.825 -16.603 20.012 1.00 48.93 O ANISOU 3228 OH TYR A 849 6530 5987 6073 817 466 1405 O ATOM 0 H TYR A 849 22.134 -11.823 16.168 1.00 33.39 H new ATOM 0 HA TYR A 849 19.947 -13.077 15.580 1.00 33.31 H new ATOM 0 HB2 TYR A 849 21.428 -13.929 17.194 1.00 34.51 H new ATOM 0 HB3 TYR A 849 21.102 -12.742 18.152 1.00 34.51 H new ATOM 0 HD1 TYR A 849 19.380 -15.474 16.625 1.00 37.60 H new ATOM 0 HD2 TYR A 849 19.526 -13.122 19.861 1.00 37.48 H new ATOM 0 HE1 TYR A 849 17.865 -16.861 17.694 1.00 39.72 H new ATOM 0 HE2 TYR A 849 17.966 -14.478 20.922 1.00 39.10 H new ATOM 0 HH TYR A 849 16.653 -16.307 20.779 1.00 48.93 H new ATOM 3229 N CYS A 850 19.407 -10.451 17.390 1.00 34.83 N ANISOU 3229 N CYS A 850 4715 4588 3931 698 100 708 N ATOM 3230 CA CYS A 850 18.400 -9.479 17.816 1.00 37.14 C ANISOU 3230 CA CYS A 850 5020 4923 4169 684 155 705 C ATOM 3231 C CYS A 850 17.672 -8.882 16.592 1.00 40.04 C ANISOU 3231 C CYS A 850 5333 5250 4631 599 158 626 C ATOM 3232 O CYS A 850 16.449 -8.810 16.597 1.00 38.84 O ANISOU 3232 O CYS A 850 5164 5066 4530 569 227 663 O ATOM 3233 CB CYS A 850 18.998 -8.386 18.700 1.00 40.04 C ANISOU 3233 CB CYS A 850 5433 5402 4379 734 116 659 C ATOM 3234 SG CYS A 850 17.812 -7.078 19.141 1.00 45.93 S ANISOU 3234 SG CYS A 850 6192 6197 5064 718 183 632 S ATOM 0 H CYS A 850 20.205 -10.253 17.641 1.00 34.83 H new ATOM 0 HA CYS A 850 17.747 -9.949 18.358 1.00 37.14 H new ATOM 0 HB2 CYS A 850 19.341 -8.789 19.513 1.00 40.04 H new ATOM 0 HB3 CYS A 850 19.753 -7.986 18.241 1.00 40.04 H new ATOM 0 HG CYS A 850 18.199 -6.499 20.118 1.00 45.93 H new ATOM 3235 N GLY A 851 18.418 -8.523 15.546 1.00 34.52 N ANISOU 3235 N GLY A 851 4606 4549 3961 566 86 528 N ATOM 3236 CA GLY A 851 17.818 -7.985 14.329 1.00 33.65 C ANISOU 3236 CA GLY A 851 4454 4404 3928 493 79 456 C ATOM 3237 C GLY A 851 16.927 -8.984 13.606 1.00 35.61 C ANISOU 3237 C GLY A 851 4669 4549 4311 449 110 493 C ATOM 3238 O GLY A 851 15.937 -8.607 12.979 1.00 33.66 O ANISOU 3238 O GLY A 851 4391 4271 4126 397 125 471 O ATOM 0 H GLY A 851 19.276 -8.584 15.523 1.00 34.52 H new ATOM 0 HA2 GLY A 851 17.296 -7.199 14.553 1.00 33.65 H new ATOM 0 HA3 GLY A 851 18.523 -7.696 13.729 1.00 33.65 H new ATOM 3239 N PHE A 852 17.245 -10.270 13.734 1.00 30.58 N ANISOU 3239 N PHE A 852 4037 3855 3727 473 115 551 N ATOM 3240 CA PHE A 852 16.541 -11.333 13.005 1.00 30.40 C ANISOU 3240 CA PHE A 852 3982 3721 3850 431 130 574 C ATOM 3241 C PHE A 852 15.401 -11.974 13.767 1.00 37.20 C ANISOU 3241 C PHE A 852 4831 4528 4777 432 213 688 C ATOM 3242 O PHE A 852 14.499 -12.526 13.148 1.00 35.98 O ANISOU 3242 O PHE A 852 4635 4282 4756 382 226 696 O ATOM 3243 CB PHE A 852 17.540 -12.419 12.531 1.00 30.44 C ANISOU 3243 CB PHE A 852 3989 3672 3904 451 89 561 C ATOM 3244 CG PHE A 852 18.717 -11.973 11.677 1.00 30.26 C ANISOU 3244 CG PHE A 852 3969 3689 3840 452 21 455 C ATOM 3245 CD1 PHE A 852 18.700 -10.742 11.015 1.00 30.87 C ANISOU 3245 CD1 PHE A 852 4039 3821 3869 418 -6 368 C ATOM 3246 CD2 PHE A 852 19.819 -12.810 11.487 1.00 30.48 C ANISOU 3246 CD2 PHE A 852 4002 3689 3891 489 -10 446 C ATOM 3247 CE1 PHE A 852 19.791 -10.332 10.238 1.00 31.69 C ANISOU 3247 CE1 PHE A 852 4141 3958 3942 420 -54 283 C ATOM 3248 CE2 PHE A 852 20.911 -12.399 10.701 1.00 32.23 C ANISOU 3248 CE2 PHE A 852 4218 3945 4083 493 -58 354 C ATOM 3249 CZ PHE A 852 20.891 -11.168 10.079 1.00 29.64 C ANISOU 3249 CZ PHE A 852 3884 3675 3704 457 -77 276 C ATOM 0 H PHE A 852 17.875 -10.555 14.246 1.00 30.58 H new ATOM 0 HA PHE A 852 16.134 -10.893 12.243 1.00 30.40 H new ATOM 0 HB2 PHE A 852 17.893 -12.863 13.318 1.00 30.44 H new ATOM 0 HB3 PHE A 852 17.042 -13.084 12.030 1.00 30.44 H new ATOM 0 HD1 PHE A 852 17.956 -10.189 11.091 1.00 30.87 H new ATOM 0 HD2 PHE A 852 19.831 -13.650 11.885 1.00 30.48 H new ATOM 0 HE1 PHE A 852 19.780 -9.498 9.827 1.00 31.69 H new ATOM 0 HE2 PHE A 852 21.647 -12.958 10.601 1.00 32.23 H new ATOM 0 HZ PHE A 852 21.610 -10.898 9.555 1.00 29.64 H new ATOM 3250 N LEU A 853 15.467 -11.958 15.100 1.00 37.51 N ANISOU 3250 N LEU A 853 4908 4618 4726 491 266 778 N ATOM 3251 CA LEU A 853 14.467 -12.592 15.939 1.00 39.62 C ANISOU 3251 CA LEU A 853 5169 4839 5046 503 363 905 C ATOM 3252 C LEU A 853 13.203 -11.779 16.010 1.00 46.56 C ANISOU 3252 C LEU A 853 6018 5729 5945 467 422 908 C ATOM 3253 O LEU A 853 13.256 -10.564 16.187 1.00 45.27 O ANISOU 3253 O LEU A 853 5873 5652 5674 475 412 850 O ATOM 3254 CB LEU A 853 15.016 -12.831 17.355 1.00 40.68 C ANISOU 3254 CB LEU A 853 5367 5036 5055 591 402 1004 C ATOM 3255 CG LEU A 853 14.197 -13.737 18.291 1.00 46.44 C ANISOU 3255 CG LEU A 853 6101 5711 5834 619 513 1162 C ATOM 3256 CD1 LEU A 853 14.230 -15.213 17.832 1.00 46.35 C ANISOU 3256 CD1 LEU A 853 6055 5569 5988 601 511 1219 C ATOM 3257 CD2 LEU A 853 14.705 -13.626 19.702 1.00 46.62 C ANISOU 3257 CD2 LEU A 853 6203 5827 5684 713 546 1245 C ATOM 0 H LEU A 853 16.100 -11.575 15.539 1.00 37.51 H new ATOM 0 HA LEU A 853 14.253 -13.447 15.533 1.00 39.62 H new ATOM 0 HB2 LEU A 853 15.904 -13.212 17.271 1.00 40.68 H new ATOM 0 HB3 LEU A 853 15.117 -11.968 17.786 1.00 40.68 H new ATOM 0 HG LEU A 853 13.276 -13.435 18.257 1.00 46.44 H new ATOM 0 HD11 LEU A 853 13.705 -15.754 18.443 1.00 46.35 H new ATOM 0 HD12 LEU A 853 13.859 -15.283 16.939 1.00 46.35 H new ATOM 0 HD13 LEU A 853 15.147 -15.530 17.826 1.00 46.35 H new ATOM 0 HD21 LEU A 853 14.181 -14.201 20.281 1.00 46.62 H new ATOM 0 HD22 LEU A 853 15.636 -13.898 19.733 1.00 46.62 H new ATOM 0 HD23 LEU A 853 14.627 -12.707 20.003 1.00 46.62 H new ATOM 3258 N ARG A 854 12.064 -12.477 15.892 1.00 46.11 N ANISOU 3258 N ARG A 854 5909 5574 6039 429 485 978 N ATOM 3259 CA ARG A 854 10.716 -11.938 16.041 1.00 47.07 C ANISOU 3259 CA ARG A 854 5984 5683 6218 397 558 1007 C ATOM 3260 C ARG A 854 10.042 -12.807 17.118 1.00 55.60 C ANISOU 3260 C ARG A 854 7060 6716 7351 430 681 1167 C ATOM 3261 O ARG A 854 9.545 -13.891 16.795 1.00 55.52 O ANISOU 3261 O ARG A 854 6998 6588 7510 395 701 1224 O ATOM 3262 CB ARG A 854 9.942 -11.967 14.714 1.00 43.49 C ANISOU 3262 CB ARG A 854 5453 5143 5927 311 506 935 C ATOM 3263 CG ARG A 854 10.531 -11.108 13.610 1.00 40.22 C ANISOU 3263 CG ARG A 854 5047 4775 5459 282 397 791 C ATOM 3264 CD ARG A 854 10.602 -9.625 13.941 1.00 31.15 C ANISOU 3264 CD ARG A 854 3924 3736 4175 300 402 742 C ATOM 3265 NE ARG A 854 11.322 -8.896 12.892 1.00 33.41 N ANISOU 3265 NE ARG A 854 4221 4060 4415 276 301 619 N ATOM 3266 CZ ARG A 854 12.628 -8.657 12.913 1.00 43.05 C ANISOU 3266 CZ ARG A 854 5491 5344 5522 310 250 568 C ATOM 3267 NH1 ARG A 854 13.366 -9.049 13.942 1.00 31.72 N ANISOU 3267 NH1 ARG A 854 4103 3948 4002 372 276 624 N ATOM 3268 NH2 ARG A 854 13.197 -7.984 11.929 1.00 37.22 N ANISOU 3268 NH2 ARG A 854 4754 4633 4756 285 175 467 N ATOM 0 H ARG A 854 12.064 -13.318 15.714 1.00 46.11 H new ATOM 0 HA ARG A 854 10.734 -11.004 16.302 1.00 47.07 H new ATOM 0 HB2 ARG A 854 9.896 -12.884 14.402 1.00 43.49 H new ATOM 0 HB3 ARG A 854 9.031 -11.677 14.880 1.00 43.49 H new ATOM 0 HG2 ARG A 854 11.425 -11.427 13.409 1.00 40.22 H new ATOM 0 HG3 ARG A 854 10.000 -11.224 12.806 1.00 40.22 H new ATOM 0 HD2 ARG A 854 9.706 -9.266 14.034 1.00 31.15 H new ATOM 0 HD3 ARG A 854 11.048 -9.500 14.793 1.00 31.15 H new ATOM 0 HE ARG A 854 10.870 -8.605 12.221 1.00 33.41 H new ATOM 0 HH11 ARG A 854 12.999 -9.461 14.602 1.00 31.72 H new ATOM 0 HH12 ARG A 854 14.211 -8.891 13.950 1.00 31.72 H new ATOM 0 HH21 ARG A 854 12.721 -7.699 11.272 1.00 37.22 H new ATOM 0 HH22 ARG A 854 14.043 -7.831 11.946 1.00 37.22 H new ATOM 3269 N PRO A 855 10.147 -12.411 18.416 1.00 55.70 N ANISOU 3269 N PRO A 855 7134 6817 7211 503 760 1240 N ATOM 3270 CA PRO A 855 9.589 -13.247 19.493 1.00 58.91 C ANISOU 3270 CA PRO A 855 7550 7188 7646 546 888 1407 C ATOM 3271 C PRO A 855 8.069 -13.392 19.408 1.00 67.90 C ANISOU 3271 C PRO A 855 8600 8240 8959 495 990 1474 C ATOM 3272 O PRO A 855 7.350 -12.404 19.209 1.00 67.64 O ANISOU 3272 O PRO A 855 8532 8237 8931 468 1008 1419 O ATOM 3273 CB PRO A 855 10.048 -12.534 20.776 1.00 60.83 C ANISOU 3273 CB PRO A 855 7889 7565 7657 639 934 1439 C ATOM 3274 CG PRO A 855 11.133 -11.602 20.348 1.00 63.17 C ANISOU 3274 CG PRO A 855 8226 7952 7824 644 805 1290 C ATOM 3275 CD PRO A 855 10.760 -11.189 18.967 1.00 57.31 C ANISOU 3275 CD PRO A 855 7407 7157 7212 553 736 1175 C ATOM 0 HA PRO A 855 9.899 -14.165 19.446 1.00 58.91 H new ATOM 0 HB2 PRO A 855 9.315 -12.051 21.188 1.00 60.83 H new ATOM 0 HB3 PRO A 855 10.373 -13.170 21.432 1.00 60.83 H new ATOM 0 HG2 PRO A 855 11.192 -10.836 20.940 1.00 63.17 H new ATOM 0 HG3 PRO A 855 11.999 -12.040 20.362 1.00 63.17 H new ATOM 0 HD2 PRO A 855 10.139 -10.444 18.969 1.00 57.31 H new ATOM 0 HD3 PRO A 855 11.534 -10.911 18.453 1.00 57.31 H new ATOM 3276 N GLY A 856 7.613 -14.638 19.491 1.00 67.79 N ANISOU 3276 N GLY A 856 8541 8108 9107 480 1049 1588 N ATOM 3277 CA GLY A 856 6.199 -14.979 19.379 1.00 69.56 C ANISOU 3277 CA GLY A 856 8664 8226 9539 426 1143 1663 C ATOM 3278 C GLY A 856 5.826 -15.551 18.023 1.00 73.57 C ANISOU 3278 C GLY A 856 9077 8603 10272 331 1048 1587 C ATOM 3279 O GLY A 856 5.033 -16.500 17.955 1.00 75.00 O ANISOU 3279 O GLY A 856 9178 8654 10663 292 1104 1674 O ATOM 0 H GLY A 856 8.124 -15.319 19.616 1.00 67.79 H new ATOM 0 HA2 GLY A 856 5.972 -15.623 20.068 1.00 69.56 H new ATOM 0 HA3 GLY A 856 5.667 -14.185 19.546 1.00 69.56 H new ATOM 3280 N VAL A 857 6.404 -14.976 16.930 1.00 66.88 N ANISOU 3280 N VAL A 857 8239 7789 9383 295 904 1424 N ATOM 3281 CA VAL A 857 6.168 -15.390 15.537 1.00 65.14 C ANISOU 3281 CA VAL A 857 7949 7465 9336 213 792 1324 C ATOM 3282 C VAL A 857 6.755 -16.804 15.264 1.00 69.58 C ANISOU 3282 C VAL A 857 8515 7922 10000 210 753 1350 C ATOM 3283 O VAL A 857 7.896 -17.074 15.638 1.00 69.26 O ANISOU 3283 O VAL A 857 8553 7930 9831 268 734 1360 O ATOM 3284 CB VAL A 857 6.695 -14.340 14.513 1.00 66.48 C ANISOU 3284 CB VAL A 857 8144 7713 9403 190 663 1154 C ATOM 3285 CG1 VAL A 857 6.207 -14.648 13.099 1.00 65.77 C ANISOU 3285 CG1 VAL A 857 7983 7523 9483 109 556 1055 C ATOM 3286 CG2 VAL A 857 6.305 -12.919 14.910 1.00 65.61 C ANISOU 3286 CG2 VAL A 857 8042 7711 9176 206 703 1132 C ATOM 0 H VAL A 857 6.956 -14.319 16.994 1.00 66.88 H new ATOM 0 HA VAL A 857 5.207 -15.440 15.412 1.00 65.14 H new ATOM 0 HB VAL A 857 7.663 -14.399 14.522 1.00 66.48 H new ATOM 0 HG11 VAL A 857 6.550 -13.980 12.485 1.00 65.77 H new ATOM 0 HG12 VAL A 857 6.523 -15.525 12.831 1.00 65.77 H new ATOM 0 HG13 VAL A 857 5.237 -14.635 13.081 1.00 65.77 H new ATOM 0 HG21 VAL A 857 6.648 -12.293 14.253 1.00 65.61 H new ATOM 0 HG22 VAL A 857 5.338 -12.848 14.950 1.00 65.61 H new ATOM 0 HG23 VAL A 857 6.680 -12.711 15.780 1.00 65.61 H new ATOM 3287 N SER A 858 5.970 -17.693 14.617 1.00 66.05 N ANISOU 3287 N SER A 858 7980 7325 9791 144 737 1358 N ATOM 3288 CA SER A 858 6.420 -19.041 14.252 1.00 66.37 C ANISOU 3288 CA SER A 858 8015 7245 9958 135 695 1368 C ATOM 3289 C SER A 858 7.319 -18.989 13.015 1.00 68.64 C ANISOU 3289 C SER A 858 8338 7543 10200 116 542 1198 C ATOM 3290 O SER A 858 7.108 -18.146 12.144 1.00 68.49 O ANISOU 3290 O SER A 858 8307 7566 10152 77 462 1076 O ATOM 3291 CB SER A 858 5.230 -19.961 14.002 1.00 71.22 C ANISOU 3291 CB SER A 858 8517 7689 10856 68 727 1428 C ATOM 0 H SER A 858 5.161 -17.522 14.381 1.00 66.05 H new ATOM 0 HA SER A 858 6.932 -19.399 14.994 1.00 66.37 H new ATOM 3292 N SER A 859 8.301 -19.907 12.937 1.00 64.63 N ANISOU 3292 N SER A 859 7873 6992 9690 148 508 1197 N ATOM 3293 CA SER A 859 9.326 -20.020 11.886 1.00 63.24 C ANISOU 3293 CA SER A 859 7740 6822 9465 148 385 1052 C ATOM 3294 C SER A 859 8.782 -20.059 10.449 1.00 65.27 C ANISOU 3294 C SER A 859 7949 7004 9847 72 277 910 C ATOM 3295 O SER A 859 9.383 -19.456 9.549 1.00 64.68 O ANISOU 3295 O SER A 859 7915 6996 9664 69 186 775 O ATOM 3296 CB SER A 859 10.237 -21.217 12.149 1.00 67.24 C ANISOU 3296 CB SER A 859 8279 7259 10010 193 389 1102 C ATOM 3297 OG SER A 859 9.898 -22.353 11.371 1.00 78.81 O ANISOU 3297 OG SER A 859 9697 8565 11682 146 334 1051 O ATOM 0 H SER A 859 8.389 -20.517 13.536 1.00 64.63 H new ATOM 0 HA SER A 859 9.836 -19.197 11.941 1.00 63.24 H new ATOM 0 HB2 SER A 859 11.155 -20.966 11.962 1.00 67.24 H new ATOM 0 HB3 SER A 859 10.193 -21.450 13.089 1.00 67.24 H new ATOM 0 HG SER A 859 10.425 -22.982 11.549 1.00 78.81 H new ATOM 3298 N GLU A 860 7.654 -20.747 10.236 1.00 59.94 N ANISOU 3298 N GLU A 860 7188 6190 9397 13 285 941 N ATOM 3299 CA GLU A 860 7.025 -20.856 8.916 1.00 59.46 C ANISOU 3299 CA GLU A 860 7078 6048 9468 -58 171 808 C ATOM 3300 C GLU A 860 6.402 -19.528 8.436 1.00 60.59 C ANISOU 3300 C GLU A 860 7203 6284 9536 -90 130 736 C ATOM 3301 O GLU A 860 6.027 -19.416 7.267 1.00 61.35 O ANISOU 3301 O GLU A 860 7277 6344 9689 -139 17 612 O ATOM 3302 CB GLU A 860 6.013 -22.020 8.871 1.00 62.81 C ANISOU 3302 CB GLU A 860 7404 6284 10176 -113 184 862 C ATOM 3303 CG GLU A 860 4.830 -21.884 9.828 1.00 77.87 C ANISOU 3303 CG GLU A 860 9226 8162 12198 -134 304 1013 C ATOM 3304 CD GLU A 860 5.019 -22.339 11.265 1.00107.19 C ANISOU 3304 CD GLU A 860 12956 11879 15894 -77 459 1202 C ATOM 3305 OE1 GLU A 860 4.035 -22.254 12.034 1.00109.56 O ANISOU 3305 OE1 GLU A 860 13188 12154 16287 -90 571 1330 O ATOM 3306 OE2 GLU A 860 6.130 -22.797 11.620 1.00104.20 O ANISOU 3306 OE2 GLU A 860 12655 11525 15413 -17 469 1228 O ATOM 0 H GLU A 860 7.231 -21.165 10.858 1.00 59.94 H new ATOM 0 HA GLU A 860 7.734 -21.059 8.286 1.00 59.46 H new ATOM 0 HB2 GLU A 860 5.672 -22.100 7.966 1.00 62.81 H new ATOM 0 HB3 GLU A 860 6.481 -22.846 9.072 1.00 62.81 H new ATOM 0 HG2 GLU A 860 4.567 -20.951 9.844 1.00 77.87 H new ATOM 0 HG3 GLU A 860 4.086 -22.382 9.454 1.00 77.87 H new ATOM 3307 N ASN A 861 6.305 -18.531 9.336 1.00 53.69 N ANISOU 3307 N ASN A 861 6343 5528 8529 -59 217 813 N ATOM 3308 CA ASN A 861 5.773 -17.204 9.030 1.00 52.00 C ANISOU 3308 CA ASN A 861 6115 5407 8237 -79 193 759 C ATOM 3309 C ASN A 861 6.910 -16.160 8.943 1.00 53.17 C ANISOU 3309 C ASN A 861 6358 5710 8135 -31 164 690 C ATOM 3310 O ASN A 861 6.637 -14.959 8.877 1.00 51.33 O ANISOU 3310 O ASN A 861 6126 5567 7811 -34 160 660 O ATOM 3311 CB ASN A 861 4.710 -16.788 10.067 1.00 53.83 C ANISOU 3311 CB ASN A 861 6281 5645 8525 -82 315 888 C ATOM 3312 CG ASN A 861 3.538 -17.751 10.165 1.00 74.41 C ANISOU 3312 CG ASN A 861 8779 8096 11399 -133 354 966 C ATOM 3313 OD1 ASN A 861 3.020 -18.248 9.154 1.00 67.95 O ANISOU 3313 OD1 ASN A 861 7902 7170 10747 -194 252 886 O ATOM 3314 ND2 ASN A 861 3.123 -18.070 11.390 1.00 58.77 N ANISOU 3314 ND2 ASN A 861 6770 6094 9467 -107 502 1126 N ATOM 0 H ASN A 861 6.554 -18.617 10.155 1.00 53.69 H new ATOM 0 HA ASN A 861 5.342 -17.243 8.162 1.00 52.00 H new ATOM 0 HB2 ASN A 861 5.131 -16.715 10.938 1.00 53.83 H new ATOM 0 HB3 ASN A 861 4.375 -15.907 9.839 1.00 53.83 H new ATOM 0 HD21 ASN A 861 2.481 -18.633 11.494 1.00 58.77 H new ATOM 0 HD22 ASN A 861 3.497 -17.713 12.077 1.00 58.77 H new ATOM 3315 N LEU A 862 8.181 -16.619 8.957 1.00 47.40 N ANISOU 3315 N LEU A 862 5700 5003 7308 15 146 667 N ATOM 3316 CA LEU A 862 9.316 -15.701 8.874 1.00 44.79 C ANISOU 3316 CA LEU A 862 5447 4807 6765 58 119 603 C ATOM 3317 C LEU A 862 9.968 -15.744 7.522 1.00 44.15 C ANISOU 3317 C LEU A 862 5398 4721 6655 44 7 462 C ATOM 3318 O LEU A 862 10.428 -16.797 7.081 1.00 46.14 O ANISOU 3318 O LEU A 862 5662 4893 6976 47 -28 430 O ATOM 3319 CB LEU A 862 10.347 -15.914 10.004 1.00 44.84 C ANISOU 3319 CB LEU A 862 5510 4872 6654 131 186 686 C ATOM 3320 CG LEU A 862 9.873 -15.551 11.413 1.00 50.36 C ANISOU 3320 CG LEU A 862 6205 5621 7307 164 300 817 C ATOM 3321 CD1 LEU A 862 10.865 -16.001 12.456 1.00 50.94 C ANISOU 3321 CD1 LEU A 862 6339 5735 7282 238 349 900 C ATOM 3322 CD2 LEU A 862 9.577 -14.075 11.542 1.00 52.76 C ANISOU 3322 CD2 LEU A 862 6516 6037 7493 163 308 782 C ATOM 0 H LEU A 862 8.395 -17.450 9.014 1.00 47.40 H new ATOM 0 HA LEU A 862 8.951 -14.811 8.999 1.00 44.79 H new ATOM 0 HB2 LEU A 862 10.617 -16.846 10.002 1.00 44.84 H new ATOM 0 HB3 LEU A 862 11.137 -15.389 9.801 1.00 44.84 H new ATOM 0 HG LEU A 862 9.042 -16.026 11.568 1.00 50.36 H new ATOM 0 HD11 LEU A 862 10.540 -15.759 13.337 1.00 50.94 H new ATOM 0 HD12 LEU A 862 10.974 -16.964 12.405 1.00 50.94 H new ATOM 0 HD13 LEU A 862 11.720 -15.570 12.297 1.00 50.94 H new ATOM 0 HD21 LEU A 862 9.280 -13.882 12.445 1.00 52.76 H new ATOM 0 HD22 LEU A 862 10.380 -13.566 11.350 1.00 52.76 H new ATOM 0 HD23 LEU A 862 8.881 -13.828 10.914 1.00 52.76 H new ATOM 3323 N SER A 863 9.999 -14.598 6.854 1.00 36.66 N ANISOU 3323 N SER A 863 4467 3857 5606 31 -43 379 N ATOM 3324 CA SER A 863 10.647 -14.432 5.556 1.00 35.76 C ANISOU 3324 CA SER A 863 4395 3761 5432 24 -138 248 C ATOM 3325 C SER A 863 12.165 -14.704 5.711 1.00 37.94 C ANISOU 3325 C SER A 863 4734 4083 5597 82 -128 232 C ATOM 3326 O SER A 863 12.682 -14.674 6.832 1.00 37.11 O ANISOU 3326 O SER A 863 4643 4024 5432 126 -61 314 O ATOM 3327 CB SER A 863 10.453 -13.001 5.063 1.00 38.71 C ANISOU 3327 CB SER A 863 4776 4230 5700 10 -170 195 C ATOM 3328 OG SER A 863 11.214 -12.073 5.828 1.00 41.64 O ANISOU 3328 OG SER A 863 5183 4715 5924 53 -118 226 O ATOM 0 H SER A 863 9.635 -13.877 7.149 1.00 36.66 H new ATOM 0 HA SER A 863 10.257 -15.052 4.920 1.00 35.76 H new ATOM 0 HB2 SER A 863 10.713 -12.942 4.130 1.00 38.71 H new ATOM 0 HB3 SER A 863 9.513 -12.767 5.111 1.00 38.71 H new ATOM 0 HG SER A 863 11.088 -11.297 5.533 1.00 41.64 H new ATOM 3329 N ALA A 864 12.871 -14.937 4.596 1.00 33.29 N ANISOU 3329 N ALA A 864 4184 3486 4979 86 -194 125 N ATOM 3330 CA ALA A 864 14.325 -15.081 4.612 1.00 32.31 C ANISOU 3330 CA ALA A 864 4111 3409 4757 141 -186 99 C ATOM 3331 C ALA A 864 14.951 -13.711 4.973 1.00 35.97 C ANISOU 3331 C ALA A 864 4597 4009 5063 164 -164 103 C ATOM 3332 O ALA A 864 14.265 -12.686 4.877 1.00 34.68 O ANISOU 3332 O ALA A 864 4419 3893 4866 135 -170 99 O ATOM 3333 CB ALA A 864 14.814 -15.520 3.242 1.00 32.97 C ANISOU 3333 CB ALA A 864 4229 3456 4841 139 -252 -22 C ATOM 0 H ALA A 864 12.518 -15.015 3.816 1.00 33.29 H new ATOM 0 HA ALA A 864 14.584 -15.749 5.266 1.00 32.31 H new ATOM 0 HB1 ALA A 864 15.779 -15.614 3.258 1.00 32.97 H new ATOM 0 HB2 ALA A 864 14.410 -16.371 3.012 1.00 32.97 H new ATOM 0 HB3 ALA A 864 14.565 -14.855 2.581 1.00 32.97 H new ATOM 3334 N VAL A 865 16.248 -13.688 5.370 1.00 33.04 N ANISOU 3334 N VAL A 865 4256 3693 4607 217 -143 110 N ATOM 3335 CA VAL A 865 17.004 -12.447 5.651 1.00 32.74 C ANISOU 3335 CA VAL A 865 4234 3773 4433 240 -133 100 C ATOM 3336 C VAL A 865 17.785 -12.102 4.366 1.00 32.56 C ANISOU 3336 C VAL A 865 4238 3778 4355 241 -173 -4 C ATOM 3337 O VAL A 865 18.539 -12.955 3.922 1.00 32.09 O ANISOU 3337 O VAL A 865 4195 3678 4320 267 -181 -40 O ATOM 3338 CB VAL A 865 18.032 -12.618 6.806 1.00 38.83 C ANISOU 3338 CB VAL A 865 5014 4587 5151 298 -99 163 C ATOM 3339 CG1 VAL A 865 18.671 -11.282 7.142 1.00 38.44 C ANISOU 3339 CG1 VAL A 865 4973 4650 4981 314 -98 147 C ATOM 3340 CG2 VAL A 865 17.405 -13.233 8.045 1.00 40.01 C ANISOU 3340 CG2 VAL A 865 5151 4701 5350 312 -51 276 C ATOM 0 H VAL A 865 16.713 -14.403 5.483 1.00 33.04 H new ATOM 0 HA VAL A 865 16.378 -11.756 5.918 1.00 32.74 H new ATOM 0 HB VAL A 865 18.717 -13.231 6.497 1.00 38.83 H new ATOM 0 HG11 VAL A 865 19.309 -11.401 7.863 1.00 38.44 H new ATOM 0 HG12 VAL A 865 19.128 -10.936 6.360 1.00 38.44 H new ATOM 0 HG13 VAL A 865 17.984 -10.655 7.419 1.00 38.44 H new ATOM 0 HG21 VAL A 865 18.078 -13.322 8.738 1.00 40.01 H new ATOM 0 HG22 VAL A 865 16.688 -12.662 8.362 1.00 40.01 H new ATOM 0 HG23 VAL A 865 17.049 -14.108 7.827 1.00 40.01 H new ATOM 3341 N ALA A 866 17.630 -10.888 3.791 1.00 26.68 N ANISOU 3341 N ALA A 866 3499 3098 3539 217 -190 -47 N ATOM 3342 CA ALA A 866 18.402 -10.435 2.619 1.00 26.55 C ANISOU 3342 CA ALA A 866 3512 3118 3456 223 -212 -131 C ATOM 3343 C ALA A 866 19.527 -9.554 3.188 1.00 30.12 C ANISOU 3343 C ALA A 866 3960 3659 3825 256 -183 -116 C ATOM 3344 O ALA A 866 19.286 -8.476 3.754 1.00 26.98 O ANISOU 3344 O ALA A 866 3549 3321 3384 245 -173 -88 O ATOM 3345 CB ALA A 866 17.528 -9.651 1.631 1.00 26.92 C ANISOU 3345 CB ALA A 866 3566 3177 3483 181 -250 -175 C ATOM 0 H ALA A 866 17.068 -10.304 4.077 1.00 26.68 H new ATOM 0 HA ALA A 866 18.752 -11.186 2.115 1.00 26.55 H new ATOM 0 HB1 ALA A 866 18.067 -9.369 0.875 1.00 26.92 H new ATOM 0 HB2 ALA A 866 16.804 -10.217 1.319 1.00 26.92 H new ATOM 0 HB3 ALA A 866 17.160 -8.870 2.073 1.00 26.92 H new ATOM 3346 N THR A 867 20.743 -10.097 3.175 1.00 27.98 N ANISOU 3346 N THR A 867 3695 3388 3547 298 -171 -131 N ATOM 3347 CA THR A 867 21.910 -9.409 3.753 1.00 27.40 C ANISOU 3347 CA THR A 867 3607 3388 3417 331 -154 -119 C ATOM 3348 C THR A 867 23.143 -9.510 2.822 1.00 31.13 C ANISOU 3348 C THR A 867 4086 3870 3873 359 -144 -179 C ATOM 3349 O THR A 867 23.050 -9.981 1.701 1.00 32.23 O ANISOU 3349 O THR A 867 4252 3971 4023 354 -147 -234 O ATOM 3350 CB THR A 867 22.153 -9.913 5.198 1.00 33.42 C ANISOU 3350 CB THR A 867 4353 4149 4195 366 -144 -44 C ATOM 3351 OG1 THR A 867 23.067 -9.031 5.862 1.00 32.32 O ANISOU 3351 OG1 THR A 867 4197 4087 3997 391 -144 -37 O ATOM 3352 CG2 THR A 867 22.646 -11.373 5.270 1.00 30.95 C ANISOU 3352 CG2 THR A 867 4043 3765 3950 403 -140 -30 C ATOM 0 H THR A 867 20.919 -10.867 2.835 1.00 27.98 H new ATOM 0 HA THR A 867 21.732 -8.458 3.821 1.00 27.40 H new ATOM 0 HB THR A 867 21.295 -9.907 5.651 1.00 33.42 H new ATOM 0 HG1 THR A 867 23.457 -9.445 6.480 1.00 32.32 H new ATOM 0 HG21 THR A 867 22.778 -11.625 6.197 1.00 30.95 H new ATOM 0 HG22 THR A 867 21.985 -11.958 4.867 1.00 30.95 H new ATOM 0 HG23 THR A 867 23.485 -11.455 4.791 1.00 30.95 H new ATOM 3353 N GLY A 868 24.259 -9.008 3.279 1.00 27.58 N ANISOU 3353 N GLY A 868 3610 3473 3397 388 -132 -171 N ATOM 3354 CA GLY A 868 25.504 -9.047 2.546 1.00 27.39 C ANISOU 3354 CA GLY A 868 3576 3460 3370 418 -110 -216 C ATOM 3355 C GLY A 868 26.662 -8.775 3.469 1.00 31.81 C ANISOU 3355 C GLY A 868 4091 4062 3935 455 -110 -189 C ATOM 3356 O GLY A 868 26.544 -8.970 4.683 1.00 29.32 O ANISOU 3356 O GLY A 868 3763 3752 3623 470 -133 -136 O ATOM 0 H GLY A 868 24.322 -8.623 4.045 1.00 27.58 H new ATOM 0 HA2 GLY A 868 25.613 -9.915 2.127 1.00 27.39 H new ATOM 0 HA3 GLY A 868 25.488 -8.389 1.834 1.00 27.39 H new ATOM 3357 N ASN A 869 27.773 -8.295 2.890 1.00 32.68 N ANISOU 3357 N ASN A 869 4174 4203 4042 471 -86 -224 N ATOM 3358 CA ASN A 869 29.030 -7.955 3.561 1.00 34.98 C ANISOU 3358 CA ASN A 869 4407 4531 4355 504 -92 -211 C ATOM 3359 C ASN A 869 28.872 -6.867 4.619 1.00 42.96 C ANISOU 3359 C ASN A 869 5394 5596 5332 486 -129 -183 C ATOM 3360 O ASN A 869 29.217 -5.712 4.382 1.00 44.37 O ANISOU 3360 O ASN A 869 5545 5815 5499 465 -123 -204 O ATOM 3361 CB ASN A 869 30.070 -7.539 2.536 1.00 39.52 C ANISOU 3361 CB ASN A 869 4951 5119 4944 514 -45 -254 C ATOM 3362 CG ASN A 869 30.560 -8.639 1.638 1.00 71.02 C ANISOU 3362 CG ASN A 869 8956 9060 8969 551 -4 -287 C ATOM 3363 OD1 ASN A 869 29.939 -9.697 1.486 1.00 65.25 O ANISOU 3363 OD1 ASN A 869 8270 8275 8249 559 -11 -293 O ATOM 3364 ND2 ASN A 869 31.682 -8.381 0.994 1.00 67.33 N ANISOU 3364 ND2 ASN A 869 8449 8607 8527 575 46 -313 N ATOM 0 H ASN A 869 27.810 -8.152 2.043 1.00 32.68 H new ATOM 0 HA ASN A 869 29.323 -8.754 4.026 1.00 34.98 H new ATOM 0 HB2 ASN A 869 29.696 -6.834 1.985 1.00 39.52 H new ATOM 0 HB3 ASN A 869 30.831 -7.160 3.004 1.00 39.52 H new ATOM 0 HD21 ASN A 869 32.006 -8.959 0.446 1.00 67.33 H new ATOM 0 HD22 ASN A 869 32.090 -7.635 1.122 1.00 67.33 H new ATOM 3365 N TRP A 870 28.387 -7.261 5.800 1.00 40.75 N ANISOU 3365 N TRP A 870 5128 5315 5040 500 -164 -136 N ATOM 3366 CA TRP A 870 28.099 -6.405 6.952 1.00 40.50 C ANISOU 3366 CA TRP A 870 5092 5334 4964 493 -200 -112 C ATOM 3367 C TRP A 870 29.364 -6.102 7.726 1.00 50.40 C ANISOU 3367 C TRP A 870 6294 6626 6229 531 -241 -114 C ATOM 3368 O TRP A 870 30.095 -7.016 8.079 1.00 52.39 O ANISOU 3368 O TRP A 870 6530 6860 6516 579 -257 -93 O ATOM 3369 CB TRP A 870 27.039 -7.116 7.829 1.00 37.85 C ANISOU 3369 CB TRP A 870 4799 4977 4606 500 -207 -54 C ATOM 3370 CG TRP A 870 26.683 -6.475 9.137 1.00 37.27 C ANISOU 3370 CG TRP A 870 4735 4954 4473 509 -235 -22 C ATOM 3371 CD1 TRP A 870 26.313 -5.179 9.348 1.00 39.37 C ANISOU 3371 CD1 TRP A 870 4998 5264 4695 479 -242 -46 C ATOM 3372 CD2 TRP A 870 26.548 -7.146 10.404 1.00 36.88 C ANISOU 3372 CD2 TRP A 870 4709 4910 4395 554 -252 43 C ATOM 3373 NE1 TRP A 870 25.983 -4.991 10.672 1.00 38.39 N ANISOU 3373 NE1 TRP A 870 4897 5177 4513 505 -263 -11 N ATOM 3374 CE2 TRP A 870 26.130 -6.181 11.346 1.00 39.56 C ANISOU 3374 CE2 TRP A 870 5063 5305 4661 553 -269 48 C ATOM 3375 CE3 TRP A 870 26.723 -8.476 10.831 1.00 37.96 C ANISOU 3375 CE3 TRP A 870 4858 5005 4559 598 -252 101 C ATOM 3376 CZ2 TRP A 870 25.950 -6.488 12.703 1.00 38.79 C ANISOU 3376 CZ2 TRP A 870 5000 5236 4503 600 -285 107 C ATOM 3377 CZ3 TRP A 870 26.518 -8.783 12.171 1.00 39.07 C ANISOU 3377 CZ3 TRP A 870 5029 5170 4647 641 -268 171 C ATOM 3378 CH2 TRP A 870 26.135 -7.795 13.090 1.00 39.28 C ANISOU 3378 CH2 TRP A 870 5077 5263 4586 644 -282 174 C ATOM 0 H TRP A 870 28.207 -8.087 5.958 1.00 40.75 H new ATOM 0 HA TRP A 870 27.747 -5.551 6.658 1.00 40.50 H new ATOM 0 HB2 TRP A 870 26.226 -7.202 7.306 1.00 37.85 H new ATOM 0 HB3 TRP A 870 27.355 -8.015 8.012 1.00 37.85 H new ATOM 0 HD1 TRP A 870 26.287 -4.519 8.693 1.00 39.37 H new ATOM 0 HE1 TRP A 870 25.726 -4.248 11.021 1.00 38.39 H new ATOM 0 HE3 TRP A 870 26.972 -9.138 10.227 1.00 37.96 H new ATOM 0 HZ2 TRP A 870 25.714 -5.832 13.318 1.00 38.79 H new ATOM 0 HZ3 TRP A 870 26.637 -9.658 12.463 1.00 39.07 H new ATOM 0 HH2 TRP A 870 26.003 -8.029 13.980 1.00 39.28 H new ATOM 3379 N GLY A 871 29.612 -4.822 7.970 1.00 50.73 N ANISOU 3379 N GLY A 871 6308 6714 6252 511 -262 -141 N ATOM 3380 CA GLY A 871 30.758 -4.343 8.738 1.00 52.97 C ANISOU 3380 CA GLY A 871 6537 7035 6554 540 -317 -155 C ATOM 3381 C GLY A 871 32.101 -4.352 8.038 1.00 62.70 C ANISOU 3381 C GLY A 871 7697 8256 7869 554 -306 -184 C ATOM 3382 O GLY A 871 33.141 -4.313 8.702 1.00 62.86 O ANISOU 3382 O GLY A 871 7663 8295 7926 589 -361 -189 O ATOM 0 H GLY A 871 29.105 -4.188 7.686 1.00 50.73 H new ATOM 0 HA2 GLY A 871 30.572 -3.435 9.024 1.00 52.97 H new ATOM 0 HA3 GLY A 871 30.832 -4.883 9.540 1.00 52.97 H new ATOM 3383 N CYS A 872 32.093 -4.368 6.703 1.00 64.55 N ANISOU 3383 N CYS A 872 7930 8463 8133 529 -237 -205 N ATOM 3384 CA CYS A 872 33.298 -4.378 5.878 1.00 67.75 C ANISOU 3384 CA CYS A 872 8271 8855 8617 542 -199 -228 C ATOM 3385 C CYS A 872 33.872 -2.978 5.604 1.00 73.68 C ANISOU 3385 C CYS A 872 8959 9631 9406 509 -192 -257 C ATOM 3386 O CYS A 872 33.314 -1.966 6.052 1.00 72.34 O ANISOU 3386 O CYS A 872 8799 9486 9200 474 -222 -264 O ATOM 3387 CB CYS A 872 33.053 -5.150 4.583 1.00 69.54 C ANISOU 3387 CB CYS A 872 8535 9041 8845 543 -122 -237 C ATOM 3388 SG CYS A 872 33.996 -6.691 4.459 1.00 75.20 S ANISOU 3388 SG CYS A 872 9228 9712 9631 611 -105 -232 S ATOM 0 H CYS A 872 31.366 -4.373 6.243 1.00 64.55 H new ATOM 0 HA CYS A 872 33.981 -4.837 6.392 1.00 67.75 H new ATOM 0 HB2 CYS A 872 32.107 -5.353 4.512 1.00 69.54 H new ATOM 0 HB3 CYS A 872 33.279 -4.581 3.830 1.00 69.54 H new ATOM 0 HG CYS A 872 34.685 -6.818 5.433 1.00 75.20 H new ATOM 3389 N GLY A 873 34.998 -2.956 4.877 1.00 72.82 N ANISOU 3389 N GLY A 873 8782 9508 9379 522 -145 -270 N ATOM 3390 CA GLY A 873 35.705 -1.743 4.483 1.00 72.79 C ANISOU 3390 CA GLY A 873 8702 9513 9440 492 -121 -288 C ATOM 3391 C GLY A 873 36.296 -1.001 5.660 1.00 76.34 C ANISOU 3391 C GLY A 873 9083 9984 9937 491 -215 -303 C ATOM 3392 O GLY A 873 37.125 -1.554 6.387 1.00 76.33 O ANISOU 3392 O GLY A 873 9032 9985 9986 535 -274 -303 O ATOM 0 H GLY A 873 35.378 -3.674 4.594 1.00 72.82 H new ATOM 0 HA2 GLY A 873 36.414 -1.974 3.863 1.00 72.79 H new ATOM 0 HA3 GLY A 873 35.094 -1.157 4.010 1.00 72.79 H new ATOM 3393 N ALA A 874 35.823 0.239 5.879 1.00 72.42 N ANISOU 3393 N ALA A 874 8589 9504 9425 445 -236 -319 N ATOM 3394 CA ALA A 874 36.272 1.150 6.942 1.00 72.57 C ANISOU 3394 CA ALA A 874 8549 9540 9484 437 -330 -350 C ATOM 3395 C ALA A 874 36.207 0.575 8.367 1.00 74.11 C ANISOU 3395 C ALA A 874 8772 9763 9624 481 -438 -353 C ATOM 3396 O ALA A 874 37.062 0.912 9.187 1.00 74.85 O ANISOU 3396 O ALA A 874 8798 9868 9774 498 -526 -382 O ATOM 3397 CB ALA A 874 35.500 2.462 6.869 1.00 72.77 C ANISOU 3397 CB ALA A 874 8596 9568 9484 382 -324 -367 C ATOM 0 H ALA A 874 35.206 0.583 5.389 1.00 72.42 H new ATOM 0 HA ALA A 874 37.215 1.296 6.770 1.00 72.57 H new ATOM 0 HB1 ALA A 874 35.803 3.056 7.574 1.00 72.77 H new ATOM 0 HB2 ALA A 874 35.652 2.880 6.007 1.00 72.77 H new ATOM 0 HB3 ALA A 874 34.552 2.287 6.980 1.00 72.77 H new ATOM 3398 N PHE A 875 35.216 -0.294 8.648 1.00 67.30 N ANISOU 3398 N PHE A 875 8005 8910 8656 501 -433 -322 N ATOM 3399 CA PHE A 875 35.018 -0.902 9.963 1.00 66.19 C ANISOU 3399 CA PHE A 875 7907 8797 8446 547 -517 -307 C ATOM 3400 C PHE A 875 35.982 -2.085 10.261 1.00 64.82 C ANISOU 3400 C PHE A 875 7696 8614 8318 610 -551 -282 C ATOM 3401 O PHE A 875 36.115 -2.479 11.420 1.00 64.48 O ANISOU 3401 O PHE A 875 7671 8597 8231 656 -636 -268 O ATOM 3402 CB PHE A 875 33.540 -1.278 10.173 1.00 67.98 C ANISOU 3402 CB PHE A 875 8241 9030 8557 541 -489 -274 C ATOM 3403 CG PHE A 875 32.729 -0.181 10.836 1.00 70.37 C ANISOU 3403 CG PHE A 875 8581 9363 8794 513 -519 -300 C ATOM 3404 CD1 PHE A 875 32.937 1.160 10.511 1.00 74.52 C ANISOU 3404 CD1 PHE A 875 9059 9887 9369 468 -520 -348 C ATOM 3405 CD2 PHE A 875 31.755 -0.486 11.779 1.00 73.05 C ANISOU 3405 CD2 PHE A 875 9000 9727 9028 535 -538 -273 C ATOM 3406 CE1 PHE A 875 32.207 2.175 11.142 1.00 75.56 C ANISOU 3406 CE1 PHE A 875 9222 10038 9448 448 -548 -379 C ATOM 3407 CE2 PHE A 875 31.019 0.531 12.403 1.00 76.29 C ANISOU 3407 CE2 PHE A 875 9444 10164 9378 517 -557 -302 C ATOM 3408 CZ PHE A 875 31.249 1.854 12.078 1.00 74.34 C ANISOU 3408 CZ PHE A 875 9150 9912 9183 474 -565 -359 C ATOM 0 H PHE A 875 34.636 -0.545 8.065 1.00 67.30 H new ATOM 0 HA PHE A 875 35.253 -0.226 10.618 1.00 66.19 H new ATOM 0 HB2 PHE A 875 33.142 -1.491 9.314 1.00 67.98 H new ATOM 0 HB3 PHE A 875 33.491 -2.080 10.716 1.00 67.98 H new ATOM 0 HD1 PHE A 875 33.569 1.383 9.866 1.00 74.52 H new ATOM 0 HD2 PHE A 875 31.590 -1.374 11.999 1.00 73.05 H new ATOM 0 HE1 PHE A 875 32.369 3.066 10.929 1.00 75.56 H new ATOM 0 HE2 PHE A 875 30.374 0.315 13.037 1.00 76.29 H new ATOM 0 HZ PHE A 875 30.758 2.527 12.491 1.00 74.34 H new ATOM 3409 N GLY A 876 36.675 -2.582 9.239 1.00 57.51 N ANISOU 3409 N GLY A 876 6719 7653 7480 614 -484 -276 N ATOM 3410 CA GLY A 876 37.679 -3.634 9.388 1.00 56.90 C ANISOU 3410 CA GLY A 876 6591 7557 7471 674 -506 -256 C ATOM 3411 C GLY A 876 37.203 -5.062 9.580 1.00 56.75 C ANISOU 3411 C GLY A 876 6642 7518 7402 719 -495 -207 C ATOM 3412 O GLY A 876 37.995 -5.930 9.956 1.00 57.15 O ANISOU 3412 O GLY A 876 6654 7554 7504 776 -533 -184 O ATOM 0 H GLY A 876 36.574 -2.314 8.428 1.00 57.51 H new ATOM 0 HA2 GLY A 876 38.246 -3.615 8.602 1.00 56.90 H new ATOM 0 HA3 GLY A 876 38.238 -3.404 10.147 1.00 56.90 H new ATOM 3413 N GLY A 877 35.934 -5.320 9.299 1.00 50.57 N ANISOU 3413 N GLY A 877 5953 6726 6535 693 -443 -188 N ATOM 3414 CA GLY A 877 35.376 -6.665 9.399 1.00 49.23 C ANISOU 3414 CA GLY A 877 5847 6524 6334 727 -423 -139 C ATOM 3415 C GLY A 877 35.884 -7.623 8.330 1.00 50.12 C ANISOU 3415 C GLY A 877 5937 6580 6526 748 -352 -143 C ATOM 3416 O GLY A 877 36.107 -7.232 7.171 1.00 50.75 O ANISOU 3416 O GLY A 877 5992 6647 6643 719 -280 -180 O ATOM 0 H GLY A 877 35.370 -4.722 9.045 1.00 50.57 H new ATOM 0 HA2 GLY A 877 35.586 -7.029 10.273 1.00 49.23 H new ATOM 0 HA3 GLY A 877 34.409 -6.610 9.339 1.00 49.23 H new ATOM 3417 N ASP A 878 36.098 -8.880 8.731 1.00 41.85 N ANISOU 3417 N ASP A 878 4900 5499 5503 804 -370 -102 N ATOM 3418 CA ASP A 878 36.485 -9.966 7.835 1.00 40.98 C ANISOU 3418 CA ASP A 878 4778 5325 5466 834 -306 -106 C ATOM 3419 C ASP A 878 35.177 -10.548 7.281 1.00 40.55 C ANISOU 3419 C ASP A 878 4817 5230 5360 804 -251 -100 C ATOM 3420 O ASP A 878 34.372 -11.090 8.044 1.00 38.22 O ANISOU 3420 O ASP A 878 4577 4923 5020 811 -280 -51 O ATOM 3421 CB ASP A 878 37.268 -11.066 8.586 1.00 43.36 C ANISOU 3421 CB ASP A 878 5047 5598 5831 910 -356 -61 C ATOM 3422 CG ASP A 878 37.698 -12.186 7.656 1.00 55.91 C ANISOU 3422 CG ASP A 878 6623 7115 7507 945 -286 -73 C ATOM 3423 OD1 ASP A 878 38.690 -11.995 6.919 1.00 59.82 O ANISOU 3423 OD1 ASP A 878 7044 7602 8083 957 -244 -113 O ATOM 3424 OD2 ASP A 878 37.025 -13.239 7.643 1.00 56.54 O ANISOU 3424 OD2 ASP A 878 6764 7138 7579 959 -267 -44 O ATOM 0 H ASP A 878 36.019 -9.127 9.551 1.00 41.85 H new ATOM 0 HA ASP A 878 37.066 -9.635 7.132 1.00 40.98 H new ATOM 0 HB2 ASP A 878 38.050 -10.676 9.007 1.00 43.36 H new ATOM 0 HB3 ASP A 878 36.716 -11.429 9.296 1.00 43.36 H new ATOM 3425 N ALA A 879 34.975 -10.418 5.963 1.00 35.88 N ANISOU 3425 N ALA A 879 4241 4617 4774 773 -173 -149 N ATOM 3426 CA ALA A 879 33.779 -10.867 5.243 1.00 34.02 C ANISOU 3426 CA ALA A 879 4088 4343 4497 741 -130 -161 C ATOM 3427 C ALA A 879 33.429 -12.342 5.452 1.00 35.10 C ANISOU 3427 C ALA A 879 4261 4407 4669 776 -133 -131 C ATOM 3428 O ALA A 879 32.261 -12.665 5.545 1.00 35.14 O ANISOU 3428 O ALA A 879 4327 4386 4640 748 -135 -112 O ATOM 3429 CB ALA A 879 33.918 -10.562 3.763 1.00 34.63 C ANISOU 3429 CB ALA A 879 4172 4413 4575 719 -53 -223 C ATOM 0 H ALA A 879 35.556 -10.051 5.446 1.00 35.88 H new ATOM 0 HA ALA A 879 33.038 -10.369 5.623 1.00 34.02 H new ATOM 0 HB1 ALA A 879 33.123 -10.862 3.295 1.00 34.63 H new ATOM 0 HB2 ALA A 879 34.025 -9.606 3.638 1.00 34.63 H new ATOM 0 HB3 ALA A 879 34.695 -11.023 3.409 1.00 34.63 H new ATOM 3430 N ARG A 880 34.430 -13.226 5.535 1.00 31.10 N ANISOU 3430 N ARG A 880 3711 3861 4245 838 -132 -123 N ATOM 3431 CA ARG A 880 34.234 -14.658 5.719 1.00 30.58 C ANISOU 3431 CA ARG A 880 3671 3713 4233 878 -132 -92 C ATOM 3432 C ARG A 880 33.734 -14.966 7.126 1.00 33.95 C ANISOU 3432 C ARG A 880 4118 4146 4634 892 -195 -3 C ATOM 3433 O ARG A 880 32.805 -15.762 7.293 1.00 32.64 O ANISOU 3433 O ARG A 880 4004 3923 4474 884 -189 33 O ATOM 3434 CB ARG A 880 35.481 -15.438 5.318 1.00 30.87 C ANISOU 3434 CB ARG A 880 3652 3704 4372 943 -106 -112 C ATOM 3435 CG ARG A 880 35.527 -15.644 3.804 1.00 38.94 C ANISOU 3435 CG ARG A 880 4695 4689 5411 935 -22 -197 C ATOM 3436 CD ARG A 880 36.937 -15.909 3.280 1.00 33.78 C ANISOU 3436 CD ARG A 880 3970 4021 4846 994 24 -231 C ATOM 3437 NE ARG A 880 36.936 -15.920 1.818 1.00 39.81 N ANISOU 3437 NE ARG A 880 4766 4765 5596 987 113 -314 N ATOM 3438 CZ ARG A 880 37.106 -14.839 1.065 1.00 43.45 C ANISOU 3438 CZ ARG A 880 5220 5286 6003 955 162 -351 C ATOM 3439 NH1 ARG A 880 37.313 -13.662 1.625 1.00 30.62 N ANISOU 3439 NH1 ARG A 880 3548 3735 4352 922 129 -320 N ATOM 3440 NH2 ARG A 880 37.057 -14.928 -0.254 1.00 32.43 N ANISOU 3440 NH2 ARG A 880 3870 3875 4579 958 244 -421 N ATOM 0 H ARG A 880 35.258 -12.999 5.484 1.00 31.10 H new ATOM 0 HA ARG A 880 33.533 -14.960 5.120 1.00 30.58 H new ATOM 0 HB2 ARG A 880 36.274 -14.960 5.608 1.00 30.87 H new ATOM 0 HB3 ARG A 880 35.488 -16.298 5.766 1.00 30.87 H new ATOM 0 HG2 ARG A 880 34.954 -16.390 3.567 1.00 38.94 H new ATOM 0 HG3 ARG A 880 35.167 -14.858 3.365 1.00 38.94 H new ATOM 0 HD2 ARG A 880 37.544 -15.226 3.605 1.00 33.78 H new ATOM 0 HD3 ARG A 880 37.260 -16.759 3.617 1.00 33.78 H new ATOM 0 HE ARG A 880 36.818 -16.674 1.421 1.00 39.81 H new ATOM 0 HH11 ARG A 880 37.338 -13.592 2.482 1.00 30.62 H new ATOM 0 HH12 ARG A 880 37.423 -12.965 1.133 1.00 30.62 H new ATOM 0 HH21 ARG A 880 36.914 -15.689 -0.629 1.00 32.43 H new ATOM 0 HH22 ARG A 880 37.168 -14.225 -0.737 1.00 32.43 H new ATOM 3441 N LEU A 881 34.257 -14.255 8.120 1.00 31.38 N ANISOU 3441 N LEU A 881 3756 3891 4275 908 -254 31 N ATOM 3442 CA LEU A 881 33.780 -14.368 9.502 1.00 31.30 C ANISOU 3442 CA LEU A 881 3777 3906 4210 926 -312 115 C ATOM 3443 C LEU A 881 32.377 -13.750 9.635 1.00 34.89 C ANISOU 3443 C LEU A 881 4295 4386 4574 863 -297 123 C ATOM 3444 O LEU A 881 31.493 -14.380 10.220 1.00 34.61 O ANISOU 3444 O LEU A 881 4308 4318 4522 866 -293 188 O ATOM 3445 CB LEU A 881 34.756 -13.711 10.489 1.00 31.69 C ANISOU 3445 CB LEU A 881 3775 4029 4237 964 -391 132 C ATOM 3446 CG LEU A 881 34.279 -13.624 11.955 1.00 37.78 C ANISOU 3446 CG LEU A 881 4592 4846 4918 987 -454 211 C ATOM 3447 CD1 LEU A 881 34.088 -15.023 12.568 1.00 38.60 C ANISOU 3447 CD1 LEU A 881 4728 4886 5051 1044 -457 305 C ATOM 3448 CD2 LEU A 881 35.228 -12.774 12.811 1.00 39.45 C ANISOU 3448 CD2 LEU A 881 4754 5137 5096 1018 -546 201 C ATOM 0 H LEU A 881 34.899 -13.692 8.016 1.00 31.38 H new ATOM 0 HA LEU A 881 33.729 -15.311 9.724 1.00 31.30 H new ATOM 0 HB2 LEU A 881 35.591 -14.204 10.468 1.00 31.69 H new ATOM 0 HB3 LEU A 881 34.949 -12.813 10.176 1.00 31.69 H new ATOM 0 HG LEU A 881 33.416 -13.182 11.948 1.00 37.78 H new ATOM 0 HD11 LEU A 881 33.789 -14.936 13.487 1.00 38.60 H new ATOM 0 HD12 LEU A 881 33.424 -15.512 12.057 1.00 38.60 H new ATOM 0 HD13 LEU A 881 34.930 -15.504 12.547 1.00 38.60 H new ATOM 0 HD21 LEU A 881 34.899 -12.741 13.723 1.00 39.45 H new ATOM 0 HD22 LEU A 881 36.114 -13.169 12.801 1.00 39.45 H new ATOM 0 HD23 LEU A 881 35.271 -11.875 12.450 1.00 39.45 H new ATOM 3449 N LYS A 882 32.156 -12.550 9.085 1.00 31.05 N ANISOU 3449 N LYS A 882 3805 3951 4042 809 -283 62 N ATOM 3450 CA LYS A 882 30.829 -11.925 9.210 1.00 30.80 C ANISOU 3450 CA LYS A 882 3826 3942 3935 753 -270 70 C ATOM 3451 C LYS A 882 29.764 -12.709 8.518 1.00 31.76 C ANISOU 3451 C LYS A 882 3992 3989 4085 722 -222 71 C ATOM 3452 O LYS A 882 28.661 -12.791 9.027 1.00 32.99 O ANISOU 3452 O LYS A 882 4188 4137 4211 701 -217 118 O ATOM 3453 CB LYS A 882 30.815 -10.468 8.753 1.00 32.64 C ANISOU 3453 CB LYS A 882 4043 4237 4123 703 -266 9 C ATOM 3454 CG LYS A 882 31.257 -9.513 9.835 1.00 43.31 C ANISOU 3454 CG LYS A 882 5372 5664 5421 716 -326 17 C ATOM 3455 CD LYS A 882 30.204 -9.317 10.932 1.00 48.64 C ANISOU 3455 CD LYS A 882 6102 6368 6011 713 -344 70 C ATOM 3456 CE LYS A 882 30.253 -7.932 11.527 1.00 52.30 C ANISOU 3456 CE LYS A 882 6558 6907 6408 696 -384 39 C ATOM 3457 NZ LYS A 882 31.629 -7.529 11.964 1.00 55.21 N ANISOU 3457 NZ LYS A 882 6866 7315 6797 733 -453 11 N ATOM 0 H LYS A 882 32.739 -12.093 8.649 1.00 31.05 H new ATOM 0 HA LYS A 882 30.629 -11.930 10.159 1.00 30.80 H new ATOM 0 HB2 LYS A 882 31.396 -10.369 7.983 1.00 32.64 H new ATOM 0 HB3 LYS A 882 29.919 -10.232 8.465 1.00 32.64 H new ATOM 0 HG2 LYS A 882 32.076 -9.844 10.236 1.00 43.31 H new ATOM 0 HG3 LYS A 882 31.464 -8.654 9.436 1.00 43.31 H new ATOM 0 HD2 LYS A 882 29.321 -9.478 10.563 1.00 48.64 H new ATOM 0 HD3 LYS A 882 30.343 -9.973 11.633 1.00 48.64 H new ATOM 0 HE2 LYS A 882 29.927 -7.293 10.874 1.00 52.30 H new ATOM 0 HE3 LYS A 882 29.653 -7.891 12.288 1.00 52.30 H new ATOM 0 HZ1 LYS A 882 31.590 -7.179 12.781 1.00 55.21 H new ATOM 0 HZ2 LYS A 882 32.159 -8.244 11.973 1.00 55.21 H new ATOM 0 HZ3 LYS A 882 31.955 -6.925 11.398 1.00 55.21 H new ATOM 3458 N ALA A 883 30.105 -13.346 7.402 1.00 26.42 N ANISOU 3458 N ALA A 883 3309 3255 3476 725 -188 21 N ATOM 3459 CA ALA A 883 29.151 -14.169 6.684 1.00 26.30 C ANISOU 3459 CA ALA A 883 3334 3159 3498 699 -157 8 C ATOM 3460 C ALA A 883 28.743 -15.336 7.587 1.00 32.65 C ANISOU 3460 C ALA A 883 4155 3900 4350 730 -166 93 C ATOM 3461 O ALA A 883 27.557 -15.549 7.759 1.00 33.54 O ANISOU 3461 O ALA A 883 4299 3979 4464 695 -156 126 O ATOM 3462 CB ALA A 883 29.760 -14.669 5.386 1.00 26.73 C ANISOU 3462 CB ALA A 883 3383 3167 3607 711 -123 -70 C ATOM 0 H ALA A 883 30.887 -13.312 7.046 1.00 26.42 H new ATOM 0 HA ALA A 883 28.365 -13.649 6.456 1.00 26.30 H new ATOM 0 HB1 ALA A 883 29.113 -15.218 4.915 1.00 26.73 H new ATOM 0 HB2 ALA A 883 30.006 -13.912 4.831 1.00 26.73 H new ATOM 0 HB3 ALA A 883 30.550 -15.197 5.581 1.00 26.73 H new ATOM 3463 N LEU A 884 29.711 -16.019 8.235 1.00 30.88 N ANISOU 3463 N LEU A 884 3903 3661 4168 796 -186 138 N ATOM 3464 CA LEU A 884 29.417 -17.111 9.153 1.00 32.43 C ANISOU 3464 CA LEU A 884 4116 3797 4410 833 -193 235 C ATOM 3465 C LEU A 884 28.559 -16.685 10.330 1.00 35.30 C ANISOU 3465 C LEU A 884 4509 4208 4694 822 -203 320 C ATOM 3466 O LEU A 884 27.583 -17.357 10.651 1.00 36.13 O ANISOU 3466 O LEU A 884 4643 4254 4832 809 -177 384 O ATOM 3467 CB LEU A 884 30.703 -17.793 9.656 1.00 33.54 C ANISOU 3467 CB LEU A 884 4218 3923 4602 913 -221 272 C ATOM 3468 CG LEU A 884 30.920 -19.215 9.164 1.00 39.98 C ANISOU 3468 CG LEU A 884 5028 4619 5542 947 -197 273 C ATOM 3469 CD1 LEU A 884 32.082 -19.867 9.896 1.00 40.23 C ANISOU 3469 CD1 LEU A 884 5022 4640 5625 1031 -232 335 C ATOM 3470 CD2 LEU A 884 29.642 -20.071 9.301 1.00 42.23 C ANISOU 3470 CD2 LEU A 884 5356 4813 5876 918 -170 328 C ATOM 0 H LEU A 884 30.550 -15.853 8.146 1.00 30.88 H new ATOM 0 HA LEU A 884 28.903 -17.752 8.638 1.00 32.43 H new ATOM 0 HB2 LEU A 884 31.463 -17.254 9.387 1.00 33.54 H new ATOM 0 HB3 LEU A 884 30.689 -17.801 10.626 1.00 33.54 H new ATOM 0 HG LEU A 884 31.138 -19.164 8.220 1.00 39.98 H new ATOM 0 HD11 LEU A 884 32.204 -20.772 9.569 1.00 40.23 H new ATOM 0 HD12 LEU A 884 32.891 -19.355 9.740 1.00 40.23 H new ATOM 0 HD13 LEU A 884 31.893 -19.891 10.847 1.00 40.23 H new ATOM 0 HD21 LEU A 884 29.818 -20.969 8.978 1.00 42.23 H new ATOM 0 HD22 LEU A 884 29.376 -20.109 10.233 1.00 42.23 H new ATOM 0 HD23 LEU A 884 28.929 -19.674 8.778 1.00 42.23 H new ATOM 3471 N ILE A 885 28.927 -15.578 10.967 1.00 29.66 N ANISOU 3471 N ILE A 885 3787 3597 3884 828 -237 319 N ATOM 3472 CA ILE A 885 28.202 -14.997 12.084 1.00 29.57 C ANISOU 3472 CA ILE A 885 3810 3647 3777 824 -245 384 C ATOM 3473 C ILE A 885 26.724 -14.791 11.718 1.00 32.87 C ANISOU 3473 C ILE A 885 4258 4039 4193 756 -195 382 C ATOM 3474 O ILE A 885 25.864 -15.213 12.481 1.00 31.69 O ANISOU 3474 O ILE A 885 4137 3866 4036 761 -169 469 O ATOM 3475 CB ILE A 885 28.889 -13.700 12.624 1.00 31.48 C ANISOU 3475 CB ILE A 885 4037 4001 3924 835 -296 349 C ATOM 3476 CG1 ILE A 885 30.097 -14.093 13.483 1.00 33.33 C ANISOU 3476 CG1 ILE A 885 4249 4260 4155 914 -358 392 C ATOM 3477 CG2 ILE A 885 27.876 -12.848 13.448 1.00 32.30 C ANISOU 3477 CG2 ILE A 885 4184 4167 3922 812 -288 380 C ATOM 3478 CD1 ILE A 885 31.170 -12.948 13.774 1.00 42.80 C ANISOU 3478 CD1 ILE A 885 5407 5550 5305 929 -429 333 C ATOM 0 H ILE A 885 29.630 -15.132 10.751 1.00 29.66 H new ATOM 0 HA ILE A 885 28.228 -15.626 12.822 1.00 29.57 H new ATOM 0 HB ILE A 885 29.191 -13.159 11.878 1.00 31.48 H new ATOM 0 HG12 ILE A 885 29.769 -14.424 14.334 1.00 33.33 H new ATOM 0 HG13 ILE A 885 30.552 -14.831 13.047 1.00 33.33 H new ATOM 0 HG21 ILE A 885 28.317 -12.048 13.776 1.00 32.30 H new ATOM 0 HG22 ILE A 885 27.129 -12.597 12.882 1.00 32.30 H new ATOM 0 HG23 ILE A 885 27.551 -13.368 14.199 1.00 32.30 H new ATOM 0 HD11 ILE A 885 31.885 -13.306 14.322 1.00 42.80 H new ATOM 0 HD12 ILE A 885 31.536 -12.627 12.935 1.00 42.80 H new ATOM 0 HD13 ILE A 885 30.742 -12.214 14.242 1.00 42.80 H new ATOM 3479 N GLN A 886 26.440 -14.176 10.554 1.00 29.34 N ANISOU 3479 N GLN A 886 3800 3590 3756 698 -182 290 N ATOM 3480 CA GLN A 886 25.061 -13.951 10.109 1.00 30.03 C ANISOU 3480 CA GLN A 886 3908 3652 3851 634 -149 281 C ATOM 3481 C GLN A 886 24.342 -15.258 9.814 1.00 34.86 C ANISOU 3481 C GLN A 886 4527 4149 4569 624 -121 316 C ATOM 3482 O GLN A 886 23.164 -15.366 10.105 1.00 34.60 O ANISOU 3482 O GLN A 886 4505 4086 4554 593 -93 364 O ATOM 3483 CB GLN A 886 24.986 -13.018 8.889 1.00 30.04 C ANISOU 3483 CB GLN A 886 3899 3678 3835 581 -150 178 C ATOM 3484 CG GLN A 886 25.589 -11.652 9.145 1.00 35.51 C ANISOU 3484 CG GLN A 886 4578 4471 4443 582 -173 144 C ATOM 3485 CD GLN A 886 25.216 -10.724 8.040 1.00 42.19 C ANISOU 3485 CD GLN A 886 5422 5335 5274 526 -164 68 C ATOM 3486 OE1 GLN A 886 24.103 -10.200 8.002 1.00 33.72 O ANISOU 3486 OE1 GLN A 886 4363 4268 4180 483 -152 72 O ATOM 3487 NE2 GLN A 886 26.108 -10.561 7.087 1.00 32.55 N ANISOU 3487 NE2 GLN A 886 4182 4117 4068 529 -163 3 N ATOM 0 H GLN A 886 27.038 -13.883 10.010 1.00 29.34 H new ATOM 0 HA GLN A 886 24.609 -13.513 10.847 1.00 30.03 H new ATOM 0 HB2 GLN A 886 25.446 -13.433 8.143 1.00 30.04 H new ATOM 0 HB3 GLN A 886 24.058 -12.912 8.627 1.00 30.04 H new ATOM 0 HG2 GLN A 886 25.273 -11.303 9.993 1.00 35.51 H new ATOM 0 HG3 GLN A 886 26.554 -11.722 9.209 1.00 35.51 H new ATOM 0 HE21 GLN A 886 26.876 -10.943 7.147 1.00 32.55 H new ATOM 0 HE22 GLN A 886 25.923 -10.073 6.404 1.00 32.55 H new ATOM 3488 N ILE A 887 25.036 -16.233 9.226 1.00 33.31 N ANISOU 3488 N ILE A 887 4320 3883 4454 651 -126 289 N ATOM 3489 CA ILE A 887 24.451 -17.538 8.931 1.00 33.65 C ANISOU 3489 CA ILE A 887 4367 3803 4615 644 -107 313 C ATOM 3490 C ILE A 887 24.052 -18.250 10.258 1.00 37.39 C ANISOU 3490 C ILE A 887 4849 4245 5113 677 -86 451 C ATOM 3491 O ILE A 887 22.972 -18.842 10.333 1.00 37.60 O ANISOU 3491 O ILE A 887 4878 4193 5215 646 -55 499 O ATOM 3492 CB ILE A 887 25.415 -18.366 8.044 1.00 36.30 C ANISOU 3492 CB ILE A 887 4691 4074 5027 676 -116 246 C ATOM 3493 CG1 ILE A 887 25.363 -17.851 6.575 1.00 35.97 C ANISOU 3493 CG1 ILE A 887 4657 4040 4972 633 -119 116 C ATOM 3494 CG2 ILE A 887 25.137 -19.895 8.153 1.00 34.39 C ANISOU 3494 CG2 ILE A 887 4449 3697 4919 695 -102 296 C ATOM 3495 CD1 ILE A 887 26.426 -18.410 5.654 1.00 43.39 C ANISOU 3495 CD1 ILE A 887 5589 4941 5956 671 -115 36 C ATOM 0 H ILE A 887 25.859 -16.155 8.988 1.00 33.31 H new ATOM 0 HA ILE A 887 23.634 -17.434 8.418 1.00 33.65 H new ATOM 0 HB ILE A 887 26.320 -18.240 8.370 1.00 36.30 H new ATOM 0 HG12 ILE A 887 24.492 -18.062 6.205 1.00 35.97 H new ATOM 0 HG13 ILE A 887 25.440 -16.884 6.584 1.00 35.97 H new ATOM 0 HG21 ILE A 887 25.758 -20.378 7.586 1.00 34.39 H new ATOM 0 HG22 ILE A 887 25.251 -20.180 9.073 1.00 34.39 H new ATOM 0 HG23 ILE A 887 24.228 -20.080 7.868 1.00 34.39 H new ATOM 0 HD11 ILE A 887 26.315 -18.035 4.766 1.00 43.39 H new ATOM 0 HD12 ILE A 887 27.304 -18.179 5.995 1.00 43.39 H new ATOM 0 HD13 ILE A 887 26.341 -19.375 5.610 1.00 43.39 H new ATOM 3496 N LEU A 888 24.894 -18.131 11.297 1.00 32.40 N ANISOU 3496 N LEU A 888 4220 3676 4414 741 -102 516 N ATOM 3497 CA LEU A 888 24.619 -18.726 12.607 1.00 32.80 C ANISOU 3497 CA LEU A 888 4290 3714 4459 785 -82 655 C ATOM 3498 C LEU A 888 23.448 -18.043 13.314 1.00 36.64 C ANISOU 3498 C LEU A 888 4800 4249 4874 754 -43 713 C ATOM 3499 O LEU A 888 22.629 -18.725 13.921 1.00 35.50 O ANISOU 3499 O LEU A 888 4667 4046 4777 756 5 818 O ATOM 3500 CB LEU A 888 25.843 -18.669 13.508 1.00 32.82 C ANISOU 3500 CB LEU A 888 4296 3785 4390 865 -125 700 C ATOM 3501 CG LEU A 888 27.081 -19.503 13.126 1.00 38.08 C ANISOU 3501 CG LEU A 888 4932 4398 5138 917 -157 678 C ATOM 3502 CD1 LEU A 888 28.121 -19.438 14.244 1.00 38.47 C ANISOU 3502 CD1 LEU A 888 4983 4519 5115 1000 -209 746 C ATOM 3503 CD2 LEU A 888 26.731 -20.936 12.813 1.00 40.55 C ANISOU 3503 CD2 LEU A 888 5241 4568 5599 922 -123 722 C ATOM 0 H LEU A 888 25.639 -17.703 11.257 1.00 32.40 H new ATOM 0 HA LEU A 888 24.383 -19.652 12.440 1.00 32.80 H new ATOM 0 HB2 LEU A 888 26.120 -17.742 13.569 1.00 32.82 H new ATOM 0 HB3 LEU A 888 25.567 -18.942 14.397 1.00 32.82 H new ATOM 0 HG LEU A 888 27.453 -19.119 12.317 1.00 38.08 H new ATOM 0 HD11 LEU A 888 28.897 -19.965 13.996 1.00 38.47 H new ATOM 0 HD12 LEU A 888 28.389 -18.516 14.384 1.00 38.47 H new ATOM 0 HD13 LEU A 888 27.739 -19.791 15.063 1.00 38.47 H new ATOM 0 HD21 LEU A 888 27.537 -21.422 12.579 1.00 40.55 H new ATOM 0 HD22 LEU A 888 26.321 -21.346 13.590 1.00 40.55 H new ATOM 0 HD23 LEU A 888 26.110 -20.962 12.068 1.00 40.55 H new ATOM 3504 N ALA A 889 23.366 -16.701 13.231 1.00 32.46 N ANISOU 3504 N ALA A 889 4275 3820 4240 726 -59 647 N ATOM 3505 CA ALA A 889 22.314 -15.957 13.914 1.00 32.53 C ANISOU 3505 CA ALA A 889 4304 3880 4175 703 -20 692 C ATOM 3506 C ALA A 889 20.962 -16.184 13.238 1.00 35.98 C ANISOU 3506 C ALA A 889 4723 4236 4712 631 25 685 C ATOM 3507 O ALA A 889 19.949 -16.318 13.923 1.00 36.02 O ANISOU 3507 O ALA A 889 4735 4224 4727 624 82 773 O ATOM 3508 CB ALA A 889 22.660 -14.486 13.965 1.00 32.45 C ANISOU 3508 CB ALA A 889 4298 3987 4044 694 -54 615 C ATOM 0 H ALA A 889 23.914 -16.213 12.783 1.00 32.46 H new ATOM 0 HA ALA A 889 22.246 -16.283 14.825 1.00 32.53 H new ATOM 0 HB1 ALA A 889 21.953 -14.003 14.421 1.00 32.45 H new ATOM 0 HB2 ALA A 889 23.495 -14.366 14.444 1.00 32.45 H new ATOM 0 HB3 ALA A 889 22.754 -14.144 13.062 1.00 32.45 H new ATOM 3509 N ALA A 890 20.977 -16.332 11.904 1.00 30.91 N ANISOU 3509 N ALA A 890 4057 3538 4150 585 -1 584 N ATOM 3510 CA ALA A 890 19.801 -16.602 11.092 1.00 30.33 C ANISOU 3510 CA ALA A 890 3962 3381 4181 517 17 557 C ATOM 3511 C ALA A 890 19.276 -17.991 11.392 1.00 36.20 C ANISOU 3511 C ALA A 890 4694 4002 5059 523 53 647 C ATOM 3512 O ALA A 890 18.071 -18.171 11.515 1.00 37.24 O ANISOU 3512 O ALA A 890 4806 4079 5265 482 93 695 O ATOM 3513 CB ALA A 890 20.137 -16.450 9.624 1.00 29.74 C ANISOU 3513 CB ALA A 890 3878 3286 4134 483 -30 424 C ATOM 0 H ALA A 890 21.700 -16.274 11.441 1.00 30.91 H new ATOM 0 HA ALA A 890 19.106 -15.961 11.309 1.00 30.33 H new ATOM 0 HB1 ALA A 890 19.347 -16.632 9.091 1.00 29.74 H new ATOM 0 HB2 ALA A 890 20.441 -15.545 9.453 1.00 29.74 H new ATOM 0 HB3 ALA A 890 20.839 -17.076 9.386 1.00 29.74 H new ATOM 3514 N ALA A 891 20.185 -18.949 11.611 1.00 32.62 N ANISOU 3514 N ALA A 891 4247 3503 4645 577 43 680 N ATOM 3515 CA ALA A 891 19.864 -20.322 11.983 1.00 33.37 C ANISOU 3515 CA ALA A 891 4331 3475 4874 592 78 777 C ATOM 3516 C ALA A 891 19.204 -20.323 13.362 1.00 39.07 C ANISOU 3516 C ALA A 891 5066 4220 5559 616 145 930 C ATOM 3517 O ALA A 891 18.149 -20.930 13.512 1.00 40.13 O ANISOU 3517 O ALA A 891 5176 4262 5809 584 198 1001 O ATOM 3518 CB ALA A 891 21.136 -21.176 11.995 1.00 33.94 C ANISOU 3518 CB ALA A 891 4410 3512 4975 657 49 782 C ATOM 0 H ALA A 891 21.031 -18.807 11.544 1.00 32.62 H new ATOM 0 HA ALA A 891 19.251 -20.702 11.334 1.00 33.37 H new ATOM 0 HB1 ALA A 891 20.912 -22.087 12.243 1.00 33.94 H new ATOM 0 HB2 ALA A 891 21.537 -21.171 11.112 1.00 33.94 H new ATOM 0 HB3 ALA A 891 21.765 -20.811 12.637 1.00 33.94 H new ATOM 3519 N ALA A 892 19.786 -19.606 14.354 1.00 36.05 N ANISOU 3519 N ALA A 892 4720 3961 5016 673 145 976 N ATOM 3520 CA ALA A 892 19.211 -19.530 15.703 1.00 36.72 C ANISOU 3520 CA ALA A 892 4832 4085 5034 708 213 1118 C ATOM 3521 C ALA A 892 17.842 -18.856 15.684 1.00 43.41 C ANISOU 3521 C ALA A 892 5662 4941 5890 647 270 1121 C ATOM 3522 O ALA A 892 16.933 -19.308 16.383 1.00 46.51 O ANISOU 3522 O ALA A 892 6050 5287 6335 648 352 1243 O ATOM 3523 CB ALA A 892 20.156 -18.827 16.664 1.00 37.16 C ANISOU 3523 CB ALA A 892 4937 4276 4905 782 183 1139 C ATOM 0 H ALA A 892 20.515 -19.160 14.256 1.00 36.05 H new ATOM 0 HA ALA A 892 19.087 -20.438 16.021 1.00 36.72 H new ATOM 0 HB1 ALA A 892 19.753 -18.790 17.546 1.00 37.16 H new ATOM 0 HB2 ALA A 892 20.992 -19.316 16.711 1.00 37.16 H new ATOM 0 HB3 ALA A 892 20.326 -17.925 16.349 1.00 37.16 H new ATOM 3524 N ALA A 893 17.657 -17.857 14.799 1.00 38.46 N ANISOU 3524 N ALA A 893 5018 4360 5235 592 230 992 N ATOM 3525 CA ALA A 893 16.375 -17.180 14.627 1.00 37.79 C ANISOU 3525 CA ALA A 893 4907 4277 5174 532 271 981 C ATOM 3526 C ALA A 893 15.443 -17.977 13.675 1.00 42.59 C ANISOU 3526 C ALA A 893 5457 4744 5980 461 274 960 C ATOM 3527 O ALA A 893 14.332 -17.543 13.437 1.00 41.07 O ANISOU 3527 O ALA A 893 5230 4536 5840 407 300 952 O ATOM 3528 CB ALA A 893 16.601 -15.767 14.109 1.00 37.08 C ANISOU 3528 CB ALA A 893 4824 4292 4973 508 221 859 C ATOM 0 H ALA A 893 18.279 -17.560 14.285 1.00 38.46 H new ATOM 0 HA ALA A 893 15.935 -17.130 15.490 1.00 37.79 H new ATOM 0 HB1 ALA A 893 15.746 -15.323 13.997 1.00 37.08 H new ATOM 0 HB2 ALA A 893 17.141 -15.272 14.744 1.00 37.08 H new ATOM 0 HB3 ALA A 893 17.060 -15.805 13.255 1.00 37.08 H new ATOM 3529 N GLU A 894 15.906 -19.133 13.120 1.00 41.83 N ANISOU 3529 N GLU A 894 5350 4544 6001 463 242 946 N ATOM 3530 CA GLU A 894 15.132 -20.010 12.220 1.00 42.75 C ANISOU 3530 CA GLU A 894 5416 4514 6313 402 230 915 C ATOM 3531 C GLU A 894 14.669 -19.312 10.909 1.00 45.49 C ANISOU 3531 C GLU A 894 5741 4867 6679 332 165 767 C ATOM 3532 O GLU A 894 13.525 -19.481 10.459 1.00 45.93 O ANISOU 3532 O GLU A 894 5747 4842 6862 271 167 758 O ATOM 3533 CB GLU A 894 13.945 -20.662 12.972 1.00 45.72 C ANISOU 3533 CB GLU A 894 5752 4799 6819 384 320 1056 C ATOM 3534 CG GLU A 894 14.364 -21.560 14.126 1.00 58.09 C ANISOU 3534 CG GLU A 894 7343 6336 8392 453 384 1210 C ATOM 3535 CD GLU A 894 13.204 -22.157 14.895 1.00 87.50 C ANISOU 3535 CD GLU A 894 11028 9974 12243 438 490 1363 C ATOM 3536 OE1 GLU A 894 12.640 -21.447 15.760 1.00 90.73 O ANISOU 3536 OE1 GLU A 894 11449 10466 12560 453 566 1443 O ATOM 3537 OE2 GLU A 894 12.845 -23.326 14.622 1.00 84.32 O ANISOU 3537 OE2 GLU A 894 10581 9418 12040 412 501 1402 O ATOM 0 H GLU A 894 16.701 -19.426 13.268 1.00 41.83 H new ATOM 0 HA GLU A 894 15.740 -20.711 11.936 1.00 42.75 H new ATOM 0 HB2 GLU A 894 13.366 -19.962 13.312 1.00 45.72 H new ATOM 0 HB3 GLU A 894 13.422 -21.182 12.343 1.00 45.72 H new ATOM 0 HG2 GLU A 894 14.915 -22.279 13.780 1.00 58.09 H new ATOM 0 HG3 GLU A 894 14.916 -21.048 14.738 1.00 58.09 H new ATOM 3538 N ARG A 895 15.561 -18.526 10.304 1.00 38.30 N ANISOU 3538 N ARG A 895 4863 4048 5643 344 106 657 N ATOM 3539 CA ARG A 895 15.267 -17.869 9.026 1.00 37.36 C ANISOU 3539 CA ARG A 895 4735 3941 5521 290 43 523 C ATOM 3540 C ARG A 895 16.305 -18.331 8.036 1.00 38.72 C ANISOU 3540 C ARG A 895 4931 4089 5693 307 -18 418 C ATOM 3541 O ARG A 895 17.428 -18.622 8.447 1.00 38.31 O ANISOU 3541 O ARG A 895 4904 4065 5588 365 -12 439 O ATOM 3542 CB ARG A 895 15.331 -16.320 9.141 1.00 36.72 C ANISOU 3542 CB ARG A 895 4670 3998 5283 288 39 489 C ATOM 3543 CG ARG A 895 14.636 -15.758 10.373 1.00 46.93 C ANISOU 3543 CG ARG A 895 5955 5344 6532 298 111 596 C ATOM 3544 CD ARG A 895 14.671 -14.253 10.415 1.00 45.12 C ANISOU 3544 CD ARG A 895 5741 5237 6167 295 103 549 C ATOM 3545 NE ARG A 895 13.754 -13.718 9.425 1.00 44.72 N ANISOU 3545 NE ARG A 895 5656 5164 6170 231 69 477 N ATOM 3546 CZ ARG A 895 12.849 -12.784 9.657 1.00 49.53 C ANISOU 3546 CZ ARG A 895 6242 5812 6764 206 95 492 C ATOM 3547 NH1 ARG A 895 12.729 -12.250 10.867 1.00 33.44 N ANISOU 3547 NH1 ARG A 895 4216 3840 4648 241 164 569 N ATOM 3548 NH2 ARG A 895 12.066 -12.362 8.681 1.00 36.62 N ANISOU 3548 NH2 ARG A 895 4575 4152 5186 151 51 426 N ATOM 0 H ARG A 895 16.344 -18.359 10.617 1.00 38.30 H new ATOM 0 HA ARG A 895 14.368 -18.103 8.747 1.00 37.36 H new ATOM 0 HB2 ARG A 895 16.261 -16.045 9.153 1.00 36.72 H new ATOM 0 HB3 ARG A 895 14.929 -15.930 8.349 1.00 36.72 H new ATOM 0 HG2 ARG A 895 13.714 -16.058 10.386 1.00 46.93 H new ATOM 0 HG3 ARG A 895 15.061 -16.111 11.170 1.00 46.93 H new ATOM 0 HD2 ARG A 895 14.426 -13.939 11.299 1.00 45.12 H new ATOM 0 HD3 ARG A 895 15.571 -13.936 10.241 1.00 45.12 H new ATOM 0 HE ARG A 895 13.804 -14.033 8.626 1.00 44.72 H new ATOM 0 HH11 ARG A 895 13.242 -12.512 11.505 1.00 33.44 H new ATOM 0 HH12 ARG A 895 12.138 -11.642 11.012 1.00 33.44 H new ATOM 0 HH21 ARG A 895 12.145 -12.695 7.892 1.00 36.62 H new ATOM 0 HH22 ARG A 895 11.478 -11.754 8.834 1.00 36.62 H new ATOM 3549 N ASP A 896 15.940 -18.410 6.753 1.00 34.61 N ANISOU 3549 N ASP A 896 4404 3518 5229 261 -75 305 N ATOM 3550 CA ASP A 896 16.861 -18.694 5.646 1.00 34.82 C ANISOU 3550 CA ASP A 896 4462 3533 5235 278 -128 186 C ATOM 3551 C ASP A 896 17.615 -17.383 5.296 1.00 37.34 C ANISOU 3551 C ASP A 896 4812 3990 5386 292 -141 124 C ATOM 3552 O ASP A 896 17.187 -16.316 5.730 1.00 35.01 O ANISOU 3552 O ASP A 896 4510 3778 5016 276 -126 156 O ATOM 3553 CB ASP A 896 16.113 -19.239 4.418 1.00 36.94 C ANISOU 3553 CB ASP A 896 4723 3700 5612 228 -188 86 C ATOM 3554 CG ASP A 896 15.503 -20.625 4.635 1.00 49.10 C ANISOU 3554 CG ASP A 896 6227 5084 7344 212 -182 130 C ATOM 3555 OD1 ASP A 896 16.128 -21.456 5.352 1.00 51.19 O ANISOU 3555 OD1 ASP A 896 6492 5304 7654 257 -141 205 O ATOM 3556 OD2 ASP A 896 14.433 -20.894 4.060 1.00 51.40 O ANISOU 3556 OD2 ASP A 896 6488 5293 7748 156 -224 90 O ATOM 0 H ASP A 896 15.127 -18.297 6.495 1.00 34.61 H new ATOM 0 HA ASP A 896 17.491 -19.380 5.917 1.00 34.82 H new ATOM 0 HB2 ASP A 896 15.408 -18.618 4.177 1.00 36.94 H new ATOM 0 HB3 ASP A 896 16.726 -19.278 3.667 1.00 36.94 H new ATOM 3557 N VAL A 897 18.770 -17.478 4.583 1.00 33.31 N ANISOU 3557 N VAL A 897 4331 3501 4826 327 -162 43 N ATOM 3558 CA VAL A 897 19.642 -16.344 4.257 1.00 30.56 C ANISOU 3558 CA VAL A 897 4003 3270 4338 345 -165 -8 C ATOM 3559 C VAL A 897 19.789 -16.175 2.741 1.00 32.64 C ANISOU 3559 C VAL A 897 4296 3531 4574 330 -204 -134 C ATOM 3560 O VAL A 897 20.069 -17.130 2.021 1.00 31.33 O ANISOU 3560 O VAL A 897 4148 3288 4469 345 -220 -197 O ATOM 3561 CB VAL A 897 21.053 -16.507 4.937 1.00 34.53 C ANISOU 3561 CB VAL A 897 4507 3814 4797 412 -141 28 C ATOM 3562 CG1 VAL A 897 21.993 -15.321 4.636 1.00 32.74 C ANISOU 3562 CG1 VAL A 897 4288 3701 4450 428 -143 -21 C ATOM 3563 CG2 VAL A 897 20.925 -16.707 6.442 1.00 34.40 C ANISOU 3563 CG2 VAL A 897 4474 3806 4788 437 -110 155 C ATOM 0 H VAL A 897 19.062 -18.226 4.275 1.00 33.31 H new ATOM 0 HA VAL A 897 19.226 -15.541 4.608 1.00 30.56 H new ATOM 0 HB VAL A 897 21.451 -17.302 4.550 1.00 34.53 H new ATOM 0 HG11 VAL A 897 22.846 -15.465 5.074 1.00 32.74 H new ATOM 0 HG12 VAL A 897 22.129 -15.251 3.678 1.00 32.74 H new ATOM 0 HG13 VAL A 897 21.595 -14.500 4.967 1.00 32.74 H new ATOM 0 HG21 VAL A 897 21.808 -16.804 6.832 1.00 34.40 H new ATOM 0 HG22 VAL A 897 20.481 -15.939 6.834 1.00 34.40 H new ATOM 0 HG23 VAL A 897 20.404 -17.506 6.619 1.00 34.40 H new ATOM 3564 N VAL A 898 19.638 -14.941 2.277 1.00 28.03 N ANISOU 3564 N VAL A 898 3722 3033 3894 306 -215 -169 N ATOM 3565 CA VAL A 898 19.891 -14.529 0.906 1.00 26.93 C ANISOU 3565 CA VAL A 898 3621 2920 3692 301 -241 -273 C ATOM 3566 C VAL A 898 21.078 -13.555 1.093 1.00 31.36 C ANISOU 3566 C VAL A 898 4181 3587 4148 335 -206 -266 C ATOM 3567 O VAL A 898 20.966 -12.551 1.812 1.00 31.40 O ANISOU 3567 O VAL A 898 4165 3663 4102 323 -193 -213 O ATOM 3568 CB VAL A 898 18.642 -13.917 0.245 1.00 29.47 C ANISOU 3568 CB VAL A 898 3948 3245 4006 246 -287 -304 C ATOM 3569 CG1 VAL A 898 18.973 -13.366 -1.136 1.00 27.81 C ANISOU 3569 CG1 VAL A 898 3786 3077 3703 250 -311 -400 C ATOM 3570 CG2 VAL A 898 17.502 -14.949 0.169 1.00 30.03 C ANISOU 3570 CG2 VAL A 898 4001 3199 4208 211 -327 -307 C ATOM 0 H VAL A 898 19.373 -14.293 2.776 1.00 28.03 H new ATOM 0 HA VAL A 898 20.102 -15.249 0.291 1.00 26.93 H new ATOM 0 HB VAL A 898 18.341 -13.178 0.796 1.00 29.47 H new ATOM 0 HG11 VAL A 898 18.174 -12.986 -1.533 1.00 27.81 H new ATOM 0 HG12 VAL A 898 19.652 -12.678 -1.056 1.00 27.81 H new ATOM 0 HG13 VAL A 898 19.304 -14.083 -1.700 1.00 27.81 H new ATOM 0 HG21 VAL A 898 16.726 -14.544 -0.250 1.00 30.03 H new ATOM 0 HG22 VAL A 898 17.791 -15.712 -0.355 1.00 30.03 H new ATOM 0 HG23 VAL A 898 17.270 -15.242 1.064 1.00 30.03 H new ATOM 3571 N TYR A 899 22.250 -13.932 0.564 1.00 28.26 N ANISOU 3571 N TYR A 899 3805 3195 3739 380 -186 -315 N ATOM 3572 CA TYR A 899 23.509 -13.203 0.787 1.00 26.79 C ANISOU 3572 CA TYR A 899 3602 3090 3486 415 -150 -306 C ATOM 3573 C TYR A 899 24.023 -12.589 -0.486 1.00 31.46 C ANISOU 3573 C TYR A 899 4224 3726 4004 420 -135 -383 C ATOM 3574 O TYR A 899 24.288 -13.296 -1.460 1.00 32.49 O ANISOU 3574 O TYR A 899 4390 3814 4143 442 -130 -454 O ATOM 3575 CB TYR A 899 24.575 -14.145 1.422 1.00 27.61 C ANISOU 3575 CB TYR A 899 3682 3161 3647 472 -128 -278 C ATOM 3576 CG TYR A 899 25.634 -13.435 2.243 1.00 30.34 C ANISOU 3576 CG TYR A 899 3989 3585 3955 503 -110 -233 C ATOM 3577 CD1 TYR A 899 26.748 -12.855 1.637 1.00 32.18 C ANISOU 3577 CD1 TYR A 899 4210 3870 4147 527 -82 -277 C ATOM 3578 CD2 TYR A 899 25.516 -13.328 3.625 1.00 32.53 C ANISOU 3578 CD2 TYR A 899 4241 3883 4237 509 -121 -147 C ATOM 3579 CE1 TYR A 899 27.726 -12.199 2.393 1.00 32.94 C ANISOU 3579 CE1 TYR A 899 4259 4030 4227 551 -77 -241 C ATOM 3580 CE2 TYR A 899 26.500 -12.698 4.391 1.00 34.74 C ANISOU 3580 CE2 TYR A 899 4487 4233 4481 540 -121 -116 C ATOM 3581 CZ TYR A 899 27.591 -12.115 3.767 1.00 40.02 C ANISOU 3581 CZ TYR A 899 5134 4947 5127 557 -105 -166 C ATOM 3582 OH TYR A 899 28.533 -11.463 4.519 1.00 47.47 O ANISOU 3582 OH TYR A 899 6032 5951 6052 582 -116 -141 O ATOM 0 H TYR A 899 22.337 -14.624 0.061 1.00 28.26 H new ATOM 0 HA TYR A 899 23.330 -12.478 1.406 1.00 26.79 H new ATOM 0 HB2 TYR A 899 24.123 -14.791 1.987 1.00 27.61 H new ATOM 0 HB3 TYR A 899 25.012 -14.644 0.714 1.00 27.61 H new ATOM 0 HD1 TYR A 899 26.843 -12.905 0.713 1.00 32.18 H new ATOM 0 HD2 TYR A 899 24.767 -13.683 4.047 1.00 32.53 H new ATOM 0 HE1 TYR A 899 28.464 -11.821 1.973 1.00 32.94 H new ATOM 0 HE2 TYR A 899 26.423 -12.670 5.317 1.00 34.74 H new ATOM 0 HH TYR A 899 28.232 -10.717 4.760 1.00 47.47 H new ATOM 3583 N PHE A 900 24.229 -11.283 -0.465 1.00 27.82 N ANISOU 3583 N PHE A 900 3750 3349 3471 405 -122 -367 N ATOM 3584 CA PHE A 900 24.736 -10.532 -1.628 1.00 27.62 C ANISOU 3584 CA PHE A 900 3750 3373 3370 411 -95 -420 C ATOM 3585 C PHE A 900 26.199 -10.202 -1.397 1.00 32.48 C ANISOU 3585 C PHE A 900 4326 4033 3982 451 -44 -409 C ATOM 3586 O PHE A 900 26.520 -9.608 -0.376 1.00 32.87 O ANISOU 3586 O PHE A 900 4327 4122 4040 448 -47 -355 O ATOM 3587 CB PHE A 900 23.910 -9.233 -1.824 1.00 27.68 C ANISOU 3587 CB PHE A 900 3765 3435 3318 363 -114 -404 C ATOM 3588 CG PHE A 900 22.482 -9.511 -2.181 1.00 28.44 C ANISOU 3588 CG PHE A 900 3892 3487 3426 324 -169 -420 C ATOM 3589 CD1 PHE A 900 22.110 -9.728 -3.506 1.00 33.26 C ANISOU 3589 CD1 PHE A 900 4561 4080 3997 323 -193 -490 C ATOM 3590 CD2 PHE A 900 21.509 -9.611 -1.194 1.00 28.53 C ANISOU 3590 CD2 PHE A 900 3873 3473 3494 293 -199 -367 C ATOM 3591 CE1 PHE A 900 20.799 -10.077 -3.831 1.00 33.78 C ANISOU 3591 CE1 PHE A 900 4648 4097 4091 287 -259 -512 C ATOM 3592 CE2 PHE A 900 20.192 -9.907 -1.519 1.00 31.64 C ANISOU 3592 CE2 PHE A 900 4281 3818 3923 255 -250 -380 C ATOM 3593 CZ PHE A 900 19.847 -10.166 -2.832 1.00 32.00 C ANISOU 3593 CZ PHE A 900 4378 3840 3942 251 -287 -455 C ATOM 0 H PHE A 900 24.080 -10.793 0.226 1.00 27.82 H new ATOM 0 HA PHE A 900 24.649 -11.069 -2.431 1.00 27.62 H new ATOM 0 HB2 PHE A 900 23.940 -8.708 -1.009 1.00 27.68 H new ATOM 0 HB3 PHE A 900 24.317 -8.697 -2.523 1.00 27.68 H new ATOM 0 HD1 PHE A 900 22.743 -9.639 -4.182 1.00 33.26 H new ATOM 0 HD2 PHE A 900 21.743 -9.478 -0.304 1.00 28.53 H new ATOM 0 HE1 PHE A 900 20.566 -10.249 -4.715 1.00 33.78 H new ATOM 0 HE2 PHE A 900 19.543 -9.931 -0.854 1.00 31.64 H new ATOM 0 HZ PHE A 900 18.972 -10.401 -3.044 1.00 32.00 H new ATOM 3594 N THR A 901 27.091 -10.592 -2.303 1.00 29.53 N ANISOU 3594 N THR A 901 3968 3651 3599 492 1 -461 N ATOM 3595 CA THR A 901 28.517 -10.309 -2.081 1.00 29.93 C ANISOU 3595 CA THR A 901 3966 3737 3669 531 52 -448 C ATOM 3596 C THR A 901 29.015 -9.097 -2.886 1.00 35.46 C ANISOU 3596 C THR A 901 4663 4503 4306 524 103 -458 C ATOM 3597 O THR A 901 30.212 -8.820 -2.866 1.00 34.96 O ANISOU 3597 O THR A 901 4549 4465 4269 554 154 -450 O ATOM 3598 CB THR A 901 29.420 -11.541 -2.293 1.00 31.73 C ANISOU 3598 CB THR A 901 4187 3911 3957 591 85 -481 C ATOM 3599 OG1 THR A 901 29.441 -11.821 -3.671 1.00 30.35 O ANISOU 3599 OG1 THR A 901 4074 3721 3735 610 124 -555 O ATOM 3600 CG2 THR A 901 28.963 -12.761 -1.538 1.00 30.12 C ANISOU 3600 CG2 THR A 901 3984 3631 3827 600 41 -463 C ATOM 0 H THR A 901 26.906 -11.009 -3.032 1.00 29.53 H new ATOM 0 HA THR A 901 28.587 -10.074 -1.142 1.00 29.93 H new ATOM 0 HB THR A 901 30.302 -11.329 -1.949 1.00 31.73 H new ATOM 0 HG1 THR A 901 30.212 -12.066 -3.896 1.00 30.35 H new ATOM 0 HG21 THR A 901 29.570 -13.497 -1.713 1.00 30.12 H new ATOM 0 HG22 THR A 901 28.954 -12.569 -0.587 1.00 30.12 H new ATOM 0 HG23 THR A 901 28.069 -13.004 -1.826 1.00 30.12 H new ATOM 3601 N PHE A 902 28.108 -8.373 -3.580 1.00 32.74 N ANISOU 3601 N PHE A 902 4369 4184 3889 486 89 -468 N ATOM 3602 CA PHE A 902 28.426 -7.120 -4.299 1.00 32.56 C ANISOU 3602 CA PHE A 902 4347 4221 3805 475 136 -460 C ATOM 3603 C PHE A 902 29.659 -7.182 -5.219 1.00 37.19 C ANISOU 3603 C PHE A 902 4932 4821 4379 524 227 -487 C ATOM 3604 O PHE A 902 30.603 -6.407 -5.056 1.00 36.48 O ANISOU 3604 O PHE A 902 4779 4766 4316 529 279 -455 O ATOM 3605 CB PHE A 902 28.561 -5.943 -3.294 1.00 33.00 C ANISOU 3605 CB PHE A 902 4332 4318 3887 442 122 -400 C ATOM 3606 CG PHE A 902 27.431 -5.902 -2.302 1.00 32.58 C ANISOU 3606 CG PHE A 902 4278 4254 3846 404 48 -372 C ATOM 3607 CD1 PHE A 902 26.112 -5.809 -2.731 1.00 35.10 C ANISOU 3607 CD1 PHE A 902 4650 4562 4123 370 8 -380 C ATOM 3608 CD2 PHE A 902 27.673 -6.063 -0.948 1.00 34.74 C ANISOU 3608 CD2 PHE A 902 4500 4525 4174 408 18 -337 C ATOM 3609 CE1 PHE A 902 25.050 -5.886 -1.823 1.00 35.33 C ANISOU 3609 CE1 PHE A 902 4672 4573 4178 339 -48 -351 C ATOM 3610 CE2 PHE A 902 26.610 -6.071 -0.030 1.00 38.20 C ANISOU 3610 CE2 PHE A 902 4943 4955 4617 380 -35 -306 C ATOM 3611 CZ PHE A 902 25.305 -5.995 -0.480 1.00 35.00 C ANISOU 3611 CZ PHE A 902 4583 4533 4182 345 -61 -312 C ATOM 0 H PHE A 902 27.282 -8.602 -3.645 1.00 32.74 H new ATOM 0 HA PHE A 902 27.676 -6.975 -4.896 1.00 32.56 H new ATOM 0 HB2 PHE A 902 29.403 -6.022 -2.818 1.00 33.00 H new ATOM 0 HB3 PHE A 902 28.589 -5.106 -3.783 1.00 33.00 H new ATOM 0 HD1 PHE A 902 25.932 -5.694 -3.636 1.00 35.10 H new ATOM 0 HD2 PHE A 902 28.546 -6.167 -0.644 1.00 34.74 H new ATOM 0 HE1 PHE A 902 24.172 -5.863 -2.130 1.00 35.33 H new ATOM 0 HE2 PHE A 902 26.784 -6.127 0.882 1.00 38.20 H new ATOM 0 HZ PHE A 902 24.601 -6.018 0.127 1.00 35.00 H new ATOM 3612 N GLY A 903 29.623 -8.094 -6.181 1.00 35.32 N ANISOU 3612 N GLY A 903 4763 4553 4106 559 249 -549 N ATOM 3613 CA GLY A 903 30.680 -8.209 -7.174 1.00 36.99 C ANISOU 3613 CA GLY A 903 4988 4777 4289 613 348 -580 C ATOM 3614 C GLY A 903 31.801 -9.155 -6.829 1.00 43.90 C ANISOU 3614 C GLY A 903 5811 5616 5255 667 392 -597 C ATOM 3615 O GLY A 903 32.576 -9.524 -7.718 1.00 46.74 O ANISOU 3615 O GLY A 903 6192 5973 5596 720 478 -637 O ATOM 0 H GLY A 903 28.985 -8.663 -6.276 1.00 35.32 H new ATOM 0 HA2 GLY A 903 30.284 -8.495 -8.012 1.00 36.99 H new ATOM 0 HA3 GLY A 903 31.057 -7.328 -7.324 1.00 36.99 H new ATOM 3616 N ASP A 904 31.898 -9.572 -5.554 1.00 38.88 N ANISOU 3616 N ASP A 904 5109 4950 4712 659 337 -564 N ATOM 3617 CA ASP A 904 32.944 -10.507 -5.143 1.00 37.50 C ANISOU 3617 CA ASP A 904 4880 4736 4634 714 366 -572 C ATOM 3618 C ASP A 904 32.514 -11.976 -5.404 1.00 39.50 C ANISOU 3618 C ASP A 904 5193 4911 4904 744 341 -632 C ATOM 3619 O ASP A 904 31.957 -12.653 -4.537 1.00 37.02 O ANISOU 3619 O ASP A 904 4873 4550 4643 730 269 -614 O ATOM 3620 CB ASP A 904 33.409 -10.238 -3.694 1.00 37.87 C ANISOU 3620 CB ASP A 904 4828 4793 4769 702 320 -506 C ATOM 3621 CG ASP A 904 34.696 -10.961 -3.282 1.00 46.89 C ANISOU 3621 CG ASP A 904 5893 5905 6017 763 351 -502 C ATOM 3622 OD1 ASP A 904 35.087 -11.928 -3.969 1.00 48.99 O ANISOU 3622 OD1 ASP A 904 6185 6125 6303 814 402 -552 O ATOM 3623 OD2 ASP A 904 35.277 -10.595 -2.235 1.00 49.06 O ANISOU 3623 OD2 ASP A 904 6084 6200 6359 761 316 -452 O ATOM 0 H ASP A 904 31.370 -9.324 -4.922 1.00 38.88 H new ATOM 0 HA ASP A 904 33.727 -10.357 -5.696 1.00 37.50 H new ATOM 0 HB2 ASP A 904 33.541 -9.283 -3.583 1.00 37.87 H new ATOM 0 HB3 ASP A 904 32.699 -10.499 -3.087 1.00 37.87 H new ATOM 3624 N SER A 905 32.825 -12.468 -6.608 1.00 38.71 N ANISOU 3624 N SER A 905 5151 4794 4762 790 408 -703 N ATOM 3625 CA SER A 905 32.529 -13.840 -7.032 1.00 38.57 C ANISOU 3625 CA SER A 905 5195 4697 4763 826 392 -779 C ATOM 3626 C SER A 905 33.246 -14.918 -6.197 1.00 39.46 C ANISOU 3626 C SER A 905 5242 4741 5010 869 389 -767 C ATOM 3627 O SER A 905 32.649 -15.968 -5.938 1.00 38.70 O ANISOU 3627 O SER A 905 5174 4566 4964 870 333 -792 O ATOM 3628 CB SER A 905 32.821 -14.024 -8.516 1.00 43.40 C ANISOU 3628 CB SER A 905 5888 5315 5286 875 472 -865 C ATOM 3629 OG SER A 905 34.167 -13.697 -8.815 1.00 57.95 O ANISOU 3629 OG SER A 905 7677 7193 7149 925 587 -850 O ATOM 0 H SER A 905 33.222 -12.003 -7.213 1.00 38.71 H new ATOM 0 HA SER A 905 31.580 -13.967 -6.874 1.00 38.57 H new ATOM 0 HB2 SER A 905 32.644 -14.943 -8.772 1.00 43.40 H new ATOM 0 HB3 SER A 905 32.225 -13.464 -9.038 1.00 43.40 H new ATOM 0 HG SER A 905 34.306 -13.807 -9.636 1.00 57.95 H new ATOM 3630 N GLU A 906 34.501 -14.660 -5.779 1.00 34.07 N ANISOU 3630 N GLU A 906 4468 4084 4395 904 446 -725 N ATOM 3631 CA GLU A 906 35.277 -15.612 -4.965 1.00 34.55 C ANISOU 3631 CA GLU A 906 4458 4085 4586 952 439 -703 C ATOM 3632 C GLU A 906 34.650 -15.770 -3.576 1.00 37.35 C ANISOU 3632 C GLU A 906 4781 4421 4991 913 335 -630 C ATOM 3633 O GLU A 906 34.531 -16.895 -3.082 1.00 37.73 O ANISOU 3633 O GLU A 906 4828 4390 5118 938 299 -626 O ATOM 3634 CB GLU A 906 36.757 -15.190 -4.878 1.00 36.40 C ANISOU 3634 CB GLU A 906 4592 4355 4885 996 517 -674 C ATOM 3635 CG GLU A 906 37.658 -16.171 -4.145 1.00 49.92 C ANISOU 3635 CG GLU A 906 6226 6005 6736 1057 512 -655 C ATOM 3636 CD GLU A 906 39.065 -15.687 -3.821 1.00 83.11 C ANISOU 3636 CD GLU A 906 10306 10243 11027 1092 561 -613 C ATOM 3637 OE1 GLU A 906 39.299 -14.455 -3.806 1.00 75.45 O ANISOU 3637 OE1 GLU A 906 9295 9347 10024 1055 577 -580 O ATOM 3638 OE2 GLU A 906 39.931 -16.551 -3.547 1.00 83.72 O ANISOU 3638 OE2 GLU A 906 10323 10267 11220 1157 578 -612 O ATOM 0 H GLU A 906 34.921 -13.932 -5.960 1.00 34.07 H new ATOM 0 HA GLU A 906 35.251 -16.478 -5.401 1.00 34.55 H new ATOM 0 HB2 GLU A 906 37.098 -15.067 -5.778 1.00 36.40 H new ATOM 0 HB3 GLU A 906 36.809 -14.329 -4.434 1.00 36.40 H new ATOM 0 HG2 GLU A 906 37.224 -16.420 -3.314 1.00 49.92 H new ATOM 0 HG3 GLU A 906 37.730 -16.977 -4.681 1.00 49.92 H new ATOM 3639 N LEU A 907 34.216 -14.648 -2.969 1.00 32.80 N ANISOU 3639 N LEU A 907 4184 3913 4367 856 292 -571 N ATOM 3640 CA LEU A 907 33.521 -14.654 -1.682 1.00 31.82 C ANISOU 3640 CA LEU A 907 4043 3784 4264 820 203 -502 C ATOM 3641 C LEU A 907 32.203 -15.450 -1.794 1.00 35.04 C ANISOU 3641 C LEU A 907 4526 4126 4661 792 155 -523 C ATOM 3642 O LEU A 907 31.901 -16.244 -0.908 1.00 35.65 O ANISOU 3642 O LEU A 907 4592 4147 4805 798 109 -480 O ATOM 3643 CB LEU A 907 33.258 -13.219 -1.179 1.00 30.83 C ANISOU 3643 CB LEU A 907 3891 3744 4077 765 176 -453 C ATOM 3644 CG LEU A 907 32.576 -13.100 0.170 1.00 34.43 C ANISOU 3644 CG LEU A 907 4334 4208 4539 734 96 -383 C ATOM 3645 CD1 LEU A 907 33.392 -13.808 1.286 1.00 35.92 C ANISOU 3645 CD1 LEU A 907 4461 4372 4817 785 66 -331 C ATOM 3646 CD2 LEU A 907 32.276 -11.672 0.488 1.00 33.87 C ANISOU 3646 CD2 LEU A 907 4248 4216 4406 684 77 -355 C ATOM 0 H LEU A 907 34.321 -13.862 -3.301 1.00 32.80 H new ATOM 0 HA LEU A 907 34.092 -15.089 -1.030 1.00 31.82 H new ATOM 0 HB2 LEU A 907 34.106 -12.751 -1.135 1.00 30.83 H new ATOM 0 HB3 LEU A 907 32.714 -12.759 -1.838 1.00 30.83 H new ATOM 0 HG LEU A 907 31.725 -13.564 0.124 1.00 34.43 H new ATOM 0 HD11 LEU A 907 32.930 -13.714 2.134 1.00 35.92 H new ATOM 0 HD12 LEU A 907 33.485 -14.749 1.072 1.00 35.92 H new ATOM 0 HD13 LEU A 907 34.271 -13.403 1.350 1.00 35.92 H new ATOM 0 HD21 LEU A 907 31.841 -11.617 1.353 1.00 33.87 H new ATOM 0 HD22 LEU A 907 33.102 -11.165 0.510 1.00 33.87 H new ATOM 0 HD23 LEU A 907 31.690 -11.305 -0.192 1.00 33.87 H new ATOM 3647 N MET A 908 31.456 -15.286 -2.893 1.00 31.71 N ANISOU 3647 N MET A 908 4179 3704 4164 765 165 -589 N ATOM 3648 CA MET A 908 30.228 -16.068 -3.110 1.00 31.23 C ANISOU 3648 CA MET A 908 4183 3572 4111 738 113 -622 C ATOM 3649 C MET A 908 30.544 -17.590 -3.083 1.00 37.13 C ANISOU 3649 C MET A 908 4932 4211 4964 790 116 -654 C ATOM 3650 O MET A 908 29.862 -18.342 -2.370 1.00 37.22 O ANISOU 3650 O MET A 908 4940 4153 5049 774 65 -617 O ATOM 3651 CB MET A 908 29.543 -15.671 -4.438 1.00 32.92 C ANISOU 3651 CB MET A 908 4479 3805 4224 714 117 -702 C ATOM 3652 CG MET A 908 28.443 -16.629 -4.849 1.00 35.89 C ANISOU 3652 CG MET A 908 4917 4094 4626 696 59 -761 C ATOM 3653 SD MET A 908 28.002 -16.514 -6.576 1.00 40.43 S ANISOU 3653 SD MET A 908 5597 4679 5084 700 62 -882 S ATOM 3654 CE MET A 908 29.438 -17.342 -7.351 1.00 38.52 C ANISOU 3654 CE MET A 908 5371 4406 4858 795 158 -961 C ATOM 0 H MET A 908 31.641 -14.730 -3.523 1.00 31.71 H new ATOM 0 HA MET A 908 29.610 -15.870 -2.389 1.00 31.23 H new ATOM 0 HB2 MET A 908 29.172 -14.779 -4.350 1.00 32.92 H new ATOM 0 HB3 MET A 908 30.210 -15.632 -5.141 1.00 32.92 H new ATOM 0 HG2 MET A 908 28.726 -17.536 -4.655 1.00 35.89 H new ATOM 0 HG3 MET A 908 27.656 -16.456 -4.310 1.00 35.89 H new ATOM 0 HE1 MET A 908 29.808 -16.770 -8.042 1.00 38.52 H new ATOM 0 HE2 MET A 908 30.115 -17.514 -6.678 1.00 38.52 H new ATOM 0 HE3 MET A 908 29.154 -18.182 -7.745 1.00 38.52 H new ATOM 3655 N AARG A 909 31.576 -18.024 -3.834 0.70 35.47 N ANISOU 3655 N AARG A 909 4724 3984 4770 853 183 -716 N ATOM 3656 N BARG A 909 31.585 -18.013 -3.833 0.30 34.27 N ANISOU 3656 N BARG A 909 4571 3833 4617 853 184 -716 N ATOM 3657 CA AARG A 909 31.994 -19.430 -3.912 0.70 37.15 C ANISOU 3657 CA AARG A 909 4937 4090 5088 910 196 -756 C ATOM 3658 CA BARG A 909 32.038 -19.404 -3.933 0.30 35.17 C ANISOU 3658 CA BARG A 909 4686 3843 4836 912 199 -757 C ATOM 3659 C AARG A 909 32.434 -19.983 -2.546 0.70 40.24 C ANISOU 3659 C AARG A 909 5252 4444 5595 933 170 -659 C ATOM 3660 C BARG A 909 32.485 -19.987 -2.587 0.30 39.43 C ANISOU 3660 C BARG A 909 5149 4342 5491 936 173 -663 C ATOM 3661 O AARG A 909 32.007 -21.086 -2.177 0.70 39.74 O ANISOU 3661 O AARG A 909 5196 4279 5623 941 135 -651 O ATOM 3662 O BARG A 909 32.108 -21.115 -2.265 0.30 39.34 O ANISOU 3662 O BARG A 909 5147 4229 5574 947 142 -659 O ATOM 3663 CB AARG A 909 33.075 -19.627 -4.991 0.70 38.84 C ANISOU 3663 CB AARG A 909 5164 4305 5288 979 288 -841 C ATOM 3664 CB BARG A 909 33.123 -19.554 -5.007 0.30 34.47 C ANISOU 3664 CB BARG A 909 4608 3760 4729 979 292 -839 C ATOM 3665 CG AARG A 909 33.650 -21.055 -5.115 0.70 51.61 C ANISOU 3665 CG AARG A 909 6778 5809 7024 1049 311 -891 C ATOM 3666 CG BARG A 909 32.538 -19.841 -6.386 0.30 37.82 C ANISOU 3666 CG BARG A 909 5137 4158 5073 982 303 -960 C ATOM 3667 CD AARG A 909 32.634 -22.162 -5.431 0.70 60.79 C ANISOU 3667 CD AARG A 909 8010 6857 8230 1035 254 -960 C ATOM 3668 CD BARG A 909 33.601 -20.005 -7.461 0.30 34.36 C ANISOU 3668 CD BARG A 909 4721 3730 4603 1058 410 -1041 C ATOM 3669 NE AARG A 909 32.111 -22.086 -6.797 0.70 62.65 N ANISOU 3669 NE AARG A 909 8345 7099 8359 1031 265 -1082 N ATOM 3670 NE BARG A 909 33.968 -18.720 -8.052 0.30 33.11 N ANISOU 3670 NE BARG A 909 4569 3687 4325 1049 474 -1028 N ATOM 3671 CZ AARG A 909 31.284 -22.974 -7.343 0.70 67.57 C ANISOU 3671 CZ AARG A 909 9040 7629 9006 1023 214 -1175 C ATOM 3672 CZ BARG A 909 35.123 -18.098 -7.843 0.30 41.33 C ANISOU 3672 CZ BARG A 909 5528 4786 5388 1078 552 -975 C ATOM 3673 NH1AARG A 909 30.881 -24.035 -6.650 0.70 44.91 N ANISOU 3673 NH1AARG A 909 6145 4640 6278 1015 159 -1154 N ATOM 3674 NH1BARG A 909 36.054 -18.652 -7.075 0.30 26.42 N ANISOU 3674 NH1BARG A 909 3549 2857 3632 1122 571 -935 N ATOM 3675 NH2AARG A 909 30.853 -22.808 -8.585 0.70 55.13 N ANISOU 3675 NH2AARG A 909 7559 6073 7314 1024 214 -1287 N ATOM 3676 NH2BARG A 909 35.361 -16.921 -8.406 0.30 21.07 N ANISOU 3676 NH2BARG A 909 2969 2315 2723 1064 611 -958 N ATOM 0 H AARG A 909 32.055 -17.498 -4.317 0.70 34.27 H new ATOM 0 H BARG A 909 32.056 -17.474 -4.309 0.30 34.27 H new ATOM 0 HA AARG A 909 31.218 -19.948 -4.177 0.70 35.17 H new ATOM 0 HA BARG A 909 31.269 -19.928 -4.207 0.30 35.17 H new ATOM 0 HB2AARG A 909 32.702 -19.371 -5.849 0.70 34.47 H new ATOM 0 HB2BARG A 909 33.652 -18.742 -5.045 0.30 34.47 H new ATOM 0 HB3AARG A 909 33.806 -19.017 -4.807 0.70 34.47 H new ATOM 0 HB3BARG A 909 33.725 -20.273 -4.757 0.30 34.47 H new ATOM 0 HG2AARG A 909 34.327 -21.053 -5.810 0.70 37.82 H new ATOM 0 HG2BARG A 909 32.002 -20.648 -6.343 0.30 37.82 H new ATOM 0 HG3AARG A 909 34.097 -21.278 -4.284 0.70 37.82 H new ATOM 0 HG3BARG A 909 31.942 -19.118 -6.636 0.30 37.82 H new ATOM 0 HD2AARG A 909 33.053 -23.026 -5.298 0.70 34.36 H new ATOM 0 HD2BARG A 909 34.388 -20.423 -7.078 0.30 34.36 H new ATOM 0 HD3AARG A 909 31.896 -22.105 -4.804 0.70 34.36 H new ATOM 0 HD3BARG A 909 33.273 -20.599 -8.154 0.30 34.36 H new ATOM 0 HE AARG A 909 32.356 -21.419 -7.281 0.70 33.11 H new ATOM 0 HE BARG A 909 33.397 -18.340 -8.571 0.30 33.11 H new ATOM 0 HH11AARG A 909 31.155 -24.151 -5.843 0.70 26.42 H new ATOM 0 HH11BARG A 909 35.911 -19.417 -6.710 0.30 26.42 H new ATOM 0 HH12AARG A 909 30.346 -24.605 -7.009 0.70 26.42 H new ATOM 0 HH12BARG A 909 36.800 -18.245 -6.943 0.30 26.42 H new ATOM 0 HH21AARG A 909 31.108 -22.125 -9.041 0.70 21.07 H new ATOM 0 HH21BARG A 909 34.766 -16.557 -8.909 0.30 21.07 H new ATOM 0 HH22AARG A 909 30.319 -23.384 -8.935 0.70 21.07 H new ATOM 0 HH22BARG A 909 36.110 -16.522 -8.268 0.30 21.07 H new ATOM 3677 N ASP A 910 33.242 -19.199 -1.792 1.00 35.82 N ANISOU 3677 N ASP A 910 4619 3963 5030 942 180 -585 N ATOM 3678 CA ASP A 910 33.730 -19.579 -0.450 1.00 35.61 C ANISOU 3678 CA ASP A 910 4521 3918 5090 970 144 -488 C ATOM 3679 C ASP A 910 32.607 -19.721 0.558 1.00 36.58 C ANISOU 3679 C ASP A 910 4660 4021 5216 924 73 -410 C ATOM 3680 O ASP A 910 32.607 -20.715 1.276 1.00 36.64 O ANISOU 3680 O ASP A 910 4653 3952 5316 953 49 -359 O ATOM 3681 CB ASP A 910 34.774 -18.575 0.064 1.00 37.87 C ANISOU 3681 CB ASP A 910 4730 4300 5361 984 156 -440 C ATOM 3682 CG ASP A 910 36.064 -18.581 -0.730 1.00 51.48 C ANISOU 3682 CG ASP A 910 6411 6030 7120 1042 236 -494 C ATOM 3683 OD1 ASP A 910 36.339 -19.600 -1.414 1.00 53.98 O ANISOU 3683 OD1 ASP A 910 6749 6267 7493 1092 280 -556 O ATOM 3684 OD2 ASP A 910 36.817 -17.584 -0.646 1.00 54.60 O ANISOU 3684 OD2 ASP A 910 6746 6505 7496 1041 258 -475 O ATOM 0 H AASP A 910 33.521 -18.428 -2.052 0.70 35.82 H new ATOM 0 H BASP A 910 33.490 -18.410 -2.028 0.30 35.82 H new ATOM 0 HA ASP A 910 34.148 -20.449 -0.547 1.00 35.61 H new ATOM 0 HB2 ASP A 910 34.393 -17.683 0.041 1.00 37.87 H new ATOM 0 HB3 ASP A 910 34.973 -18.774 0.992 1.00 37.87 H new ATOM 3685 N ILE A 911 31.646 -18.729 0.623 1.00 30.22 N ANISOU 3685 N ILE A 911 3885 3281 4316 854 46 -396 N ATOM 3686 CA ILE A 911 30.501 -18.806 1.537 1.00 30.03 C ANISOU 3686 CA ILE A 911 3876 3240 4294 809 -7 -323 C ATOM 3687 C ILE A 911 29.674 -20.063 1.201 1.00 34.91 C ANISOU 3687 C ILE A 911 4535 3735 4993 803 -20 -352 C ATOM 3688 O ILE A 911 29.353 -20.843 2.098 1.00 36.10 O ANISOU 3688 O ILE A 911 4672 3820 5223 811 -42 -275 O ATOM 3689 CB ILE A 911 29.616 -17.507 1.545 1.00 31.75 C ANISOU 3689 CB ILE A 911 4114 3544 4405 739 -26 -314 C ATOM 3690 CG1 ILE A 911 30.427 -16.280 2.084 1.00 30.66 C ANISOU 3690 CG1 ILE A 911 3926 3516 4206 744 -23 -278 C ATOM 3691 CG2 ILE A 911 28.336 -17.732 2.382 1.00 29.53 C ANISOU 3691 CG2 ILE A 911 3849 3231 4141 696 -67 -245 C ATOM 3692 CD1 ILE A 911 29.813 -14.961 1.755 1.00 32.09 C ANISOU 3692 CD1 ILE A 911 4126 3775 4292 686 -26 -294 C ATOM 0 H ILE A 911 31.662 -18.018 0.139 1.00 30.22 H new ATOM 0 HA ILE A 911 30.846 -18.875 2.441 1.00 30.03 H new ATOM 0 HB ILE A 911 29.354 -17.311 0.632 1.00 31.75 H new ATOM 0 HG12 ILE A 911 30.511 -16.357 3.047 1.00 30.66 H new ATOM 0 HG13 ILE A 911 31.325 -16.310 1.717 1.00 30.66 H new ATOM 0 HG21 ILE A 911 27.800 -16.923 2.378 1.00 29.53 H new ATOM 0 HG22 ILE A 911 27.823 -18.461 2.000 1.00 29.53 H new ATOM 0 HG23 ILE A 911 28.580 -17.953 3.294 1.00 29.53 H new ATOM 0 HD11 ILE A 911 30.363 -14.249 2.116 1.00 32.09 H new ATOM 0 HD12 ILE A 911 29.751 -14.864 0.792 1.00 32.09 H new ATOM 0 HD13 ILE A 911 28.925 -14.911 2.142 1.00 32.09 H new ATOM 3693 N TYR A 912 29.368 -20.271 -0.089 1.00 30.94 N ANISOU 3693 N TYR A 912 4083 3197 4476 791 -6 -461 N ATOM 3694 CA TYR A 912 28.606 -21.445 -0.527 1.00 31.79 C ANISOU 3694 CA TYR A 912 4230 3181 4670 783 -27 -510 C ATOM 3695 C TYR A 912 29.302 -22.751 -0.145 1.00 37.08 C ANISOU 3695 C TYR A 912 4871 3745 5472 847 -13 -491 C ATOM 3696 O TYR A 912 28.643 -23.639 0.409 1.00 36.26 O ANISOU 3696 O TYR A 912 4765 3544 5470 836 -41 -443 O ATOM 3697 CB TYR A 912 28.339 -21.417 -2.040 1.00 32.98 C ANISOU 3697 CB TYR A 912 4446 3321 4766 774 -21 -647 C ATOM 3698 CG TYR A 912 27.759 -22.715 -2.556 1.00 36.68 C ANISOU 3698 CG TYR A 912 4952 3650 5337 777 -49 -720 C ATOM 3699 CD1 TYR A 912 26.441 -23.067 -2.287 1.00 39.12 C ANISOU 3699 CD1 TYR A 912 5268 3889 5706 717 -109 -699 C ATOM 3700 CD2 TYR A 912 28.535 -23.601 -3.306 1.00 39.42 C ANISOU 3700 CD2 TYR A 912 5319 3926 5732 841 -14 -813 C ATOM 3701 CE1 TYR A 912 25.918 -24.287 -2.712 1.00 42.95 C ANISOU 3701 CE1 TYR A 912 5776 4232 6310 717 -141 -767 C ATOM 3702 CE2 TYR A 912 28.019 -24.821 -3.745 1.00 41.46 C ANISOU 3702 CE2 TYR A 912 5610 4044 6098 846 -46 -888 C ATOM 3703 CZ TYR A 912 26.706 -25.152 -3.458 1.00 50.76 C ANISOU 3703 CZ TYR A 912 6791 5150 7343 780 -114 -866 C ATOM 3704 OH TYR A 912 26.183 -26.343 -3.890 1.00 58.68 O ANISOU 3704 OH TYR A 912 7818 6006 8470 779 -152 -943 O ATOM 0 H TYR A 912 29.595 -19.740 -0.726 1.00 30.94 H new ATOM 0 HA TYR A 912 27.755 -21.407 -0.064 1.00 31.79 H new ATOM 0 HB2 TYR A 912 27.728 -20.691 -2.243 1.00 32.98 H new ATOM 0 HB3 TYR A 912 29.168 -21.229 -2.507 1.00 32.98 H new ATOM 0 HD1 TYR A 912 25.898 -22.477 -1.815 1.00 39.12 H new ATOM 0 HD2 TYR A 912 29.412 -23.374 -3.517 1.00 39.42 H new ATOM 0 HE1 TYR A 912 25.044 -24.521 -2.496 1.00 42.95 H new ATOM 0 HE2 TYR A 912 28.554 -25.408 -4.228 1.00 41.46 H new ATOM 0 HH TYR A 912 26.765 -26.763 -4.327 1.00 58.68 H new ATOM 3705 N SER A 913 30.621 -22.885 -0.472 1.00 33.96 N ANISOU 3705 N SER A 913 4452 3364 5087 916 35 -526 N ATOM 3706 CA SER A 913 31.400 -24.096 -0.162 1.00 34.70 C ANISOU 3706 CA SER A 913 4513 3358 5313 986 52 -510 C ATOM 3707 C SER A 913 31.427 -24.327 1.325 1.00 38.24 C ANISOU 3707 C SER A 913 4911 3798 5820 996 20 -365 C ATOM 3708 O SER A 913 31.213 -25.448 1.748 1.00 39.58 O ANISOU 3708 O SER A 913 5076 3853 6109 1016 6 -325 O ATOM 3709 CB SER A 913 32.827 -24.007 -0.699 1.00 38.81 C ANISOU 3709 CB SER A 913 5003 3913 5832 1057 113 -561 C ATOM 3710 OG SER A 913 32.836 -23.737 -2.091 1.00 57.20 O ANISOU 3710 OG SER A 913 7387 6262 8085 1055 156 -690 O ATOM 0 H SER A 913 31.073 -22.275 -0.876 1.00 33.96 H new ATOM 0 HA SER A 913 30.964 -24.844 -0.600 1.00 34.70 H new ATOM 0 HB2 SER A 913 33.309 -23.309 -0.229 1.00 38.81 H new ATOM 0 HB3 SER A 913 33.293 -24.840 -0.526 1.00 38.81 H new ATOM 0 HG SER A 913 32.630 -22.933 -2.222 1.00 57.20 H new ATOM 3711 N MET A 914 31.636 -23.278 2.129 1.00 33.89 N ANISOU 3711 N MET A 914 4328 3363 5185 982 5 -285 N ATOM 3712 CA MET A 914 31.622 -23.451 3.589 1.00 33.39 C ANISOU 3712 CA MET A 914 4231 3305 5152 997 -30 -147 C ATOM 3713 C MET A 914 30.249 -23.952 4.080 1.00 36.47 C ANISOU 3713 C MET A 914 4653 3624 5579 948 -55 -86 C ATOM 3714 O MET A 914 30.191 -24.882 4.883 1.00 36.30 O ANISOU 3714 O MET A 914 4618 3522 5651 978 -64 4 O ATOM 3715 CB MET A 914 32.009 -22.143 4.316 1.00 34.23 C ANISOU 3715 CB MET A 914 4306 3553 5147 987 -49 -91 C ATOM 3716 CG MET A 914 32.082 -22.288 5.847 1.00 37.35 C ANISOU 3716 CG MET A 914 4676 3965 5549 1015 -91 47 C ATOM 3717 SD MET A 914 32.982 -23.784 6.407 1.00 42.44 S ANISOU 3717 SD MET A 914 5282 4499 6343 1109 -96 115 S ATOM 3718 CE MET A 914 34.624 -23.316 6.028 1.00 39.28 C ANISOU 3718 CE MET A 914 4814 4163 5947 1168 -87 58 C ATOM 0 H MET A 914 31.785 -22.475 1.858 1.00 33.89 H new ATOM 0 HA MET A 914 32.286 -24.124 3.804 1.00 33.39 H new ATOM 0 HB2 MET A 914 32.869 -21.841 3.986 1.00 34.23 H new ATOM 0 HB3 MET A 914 31.362 -21.455 4.094 1.00 34.23 H new ATOM 0 HG2 MET A 914 32.515 -21.503 6.217 1.00 37.35 H new ATOM 0 HG3 MET A 914 31.181 -22.310 6.205 1.00 37.35 H new ATOM 0 HE1 MET A 914 35.223 -24.055 6.218 1.00 39.28 H new ATOM 0 HE2 MET A 914 34.686 -23.084 5.088 1.00 39.28 H new ATOM 0 HE3 MET A 914 34.875 -22.550 6.567 1.00 39.28 H new ATOM 3719 N HIS A 915 29.169 -23.304 3.628 1.00 32.06 N ANISOU 3719 N HIS A 915 4133 3098 4952 874 -63 -127 N ATOM 3720 CA HIS A 915 27.804 -23.637 4.029 1.00 32.85 C ANISOU 3720 CA HIS A 915 4252 3137 5093 819 -82 -73 C ATOM 3721 C HIS A 915 27.443 -25.072 3.668 1.00 37.43 C ANISOU 3721 C HIS A 915 4841 3554 5827 828 -82 -98 C ATOM 3722 O HIS A 915 27.033 -25.841 4.550 1.00 36.72 O ANISOU 3722 O HIS A 915 4736 3386 5832 835 -84 9 O ATOM 3723 CB HIS A 915 26.807 -22.637 3.419 1.00 32.68 C ANISOU 3723 CB HIS A 915 4261 3178 4979 743 -95 -130 C ATOM 3724 CG HIS A 915 25.413 -22.753 3.965 1.00 35.79 C ANISOU 3724 CG HIS A 915 4659 3530 5410 685 -111 -62 C ATOM 3725 ND1 HIS A 915 24.522 -23.684 3.468 1.00 38.12 N ANISOU 3725 ND1 HIS A 915 4965 3696 5824 653 -125 -98 N ATOM 3726 CD2 HIS A 915 24.800 -22.037 4.936 1.00 35.70 C ANISOU 3726 CD2 HIS A 915 4638 3588 5339 656 -110 36 C ATOM 3727 CE1 HIS A 915 23.397 -23.500 4.136 1.00 36.40 C ANISOU 3727 CE1 HIS A 915 4736 3472 5623 603 -129 -15 C ATOM 3728 NE2 HIS A 915 23.521 -22.530 5.042 1.00 35.78 N ANISOU 3728 NE2 HIS A 915 4648 3512 5436 607 -115 68 N ATOM 0 H HIS A 915 29.214 -22.650 3.072 1.00 32.06 H new ATOM 0 HA HIS A 915 27.752 -23.569 4.995 1.00 32.85 H new ATOM 0 HB2 HIS A 915 27.131 -21.736 3.574 1.00 32.68 H new ATOM 0 HB3 HIS A 915 26.780 -22.767 2.458 1.00 32.68 H new ATOM 0 HD2 HIS A 915 25.172 -21.346 5.435 1.00 35.70 H new ATOM 0 HE1 HIS A 915 22.617 -23.986 3.992 1.00 36.40 H new ATOM 0 HE2 HIS A 915 22.915 -22.263 5.590 1.00 35.78 H new ATOM 3729 N ILE A 916 27.670 -25.462 2.400 1.00 36.33 N ANISOU 3729 N ILE A 916 4727 3359 5716 836 -77 -236 N ATOM 3730 CA ILE A 916 27.373 -26.820 1.942 1.00 38.61 C ANISOU 3730 CA ILE A 916 5028 3485 6158 847 -83 -286 C ATOM 3731 C ILE A 916 28.179 -27.854 2.758 1.00 41.47 C ANISOU 3731 C ILE A 916 5351 3764 6641 919 -65 -196 C ATOM 3732 O ILE A 916 27.642 -28.906 3.125 1.00 41.12 O ANISOU 3732 O ILE A 916 5299 3586 6740 916 -72 -144 O ATOM 3733 CB ILE A 916 27.528 -26.967 0.389 1.00 44.23 C ANISOU 3733 CB ILE A 916 5787 4167 6852 851 -81 -466 C ATOM 3734 CG1 ILE A 916 26.562 -28.024 -0.175 1.00 48.07 C ANISOU 3734 CG1 ILE A 916 6299 4497 7469 818 -118 -539 C ATOM 3735 CG2 ILE A 916 28.961 -27.279 -0.047 1.00 44.60 C ANISOU 3735 CG2 ILE A 916 5825 4215 6907 937 -36 -524 C ATOM 3736 CD1 ILE A 916 25.285 -27.430 -0.720 1.00 60.83 C ANISOU 3736 CD1 ILE A 916 7947 6137 9028 735 -166 -592 C ATOM 0 H ILE A 916 27.997 -24.948 1.793 1.00 36.33 H new ATOM 0 HA ILE A 916 26.436 -27.007 2.112 1.00 38.61 H new ATOM 0 HB ILE A 916 27.299 -26.100 0.020 1.00 44.23 H new ATOM 0 HG12 ILE A 916 27.009 -28.519 -0.880 1.00 48.07 H new ATOM 0 HG13 ILE A 916 26.344 -28.660 0.524 1.00 48.07 H new ATOM 0 HG21 ILE A 916 28.995 -27.358 -1.013 1.00 44.60 H new ATOM 0 HG22 ILE A 916 29.550 -26.563 0.239 1.00 44.60 H new ATOM 0 HG23 ILE A 916 29.248 -28.113 0.356 1.00 44.60 H new ATOM 0 HD11 ILE A 916 24.717 -28.139 -1.060 1.00 60.83 H new ATOM 0 HD12 ILE A 916 24.821 -26.956 -0.012 1.00 60.83 H new ATOM 0 HD13 ILE A 916 25.496 -26.813 -1.438 1.00 60.83 H new ATOM 3737 N PHE A 917 29.443 -27.516 3.100 1.00 37.14 N ANISOU 3737 N PHE A 917 4773 3295 6044 984 -44 -167 N ATOM 3738 CA PHE A 917 30.325 -28.367 3.900 1.00 37.81 C ANISOU 3738 CA PHE A 917 4815 3320 6231 1062 -35 -76 C ATOM 3739 C PHE A 917 29.740 -28.617 5.308 1.00 40.94 C ANISOU 3739 C PHE A 917 5197 3699 6660 1054 -53 98 C ATOM 3740 O PHE A 917 29.662 -29.763 5.752 1.00 38.96 O ANISOU 3740 O PHE A 917 4933 3319 6550 1084 -50 168 O ATOM 3741 CB PHE A 917 31.728 -27.738 4.001 1.00 39.65 C ANISOU 3741 CB PHE A 917 5010 3662 6394 1123 -21 -78 C ATOM 3742 CG PHE A 917 32.704 -28.524 4.857 1.00 42.82 C ANISOU 3742 CG PHE A 917 5361 4014 6895 1209 -25 20 C ATOM 3743 CD1 PHE A 917 33.321 -29.676 4.364 1.00 46.63 C ANISOU 3743 CD1 PHE A 917 5828 4368 7522 1272 -1 -30 C ATOM 3744 CD2 PHE A 917 33.033 -28.094 6.139 1.00 44.45 C ANISOU 3744 CD2 PHE A 917 5536 4303 7049 1233 -57 157 C ATOM 3745 CE1 PHE A 917 34.244 -30.387 5.145 1.00 48.15 C ANISOU 3745 CE1 PHE A 917 5969 4514 7813 1356 -9 65 C ATOM 3746 CE2 PHE A 917 33.948 -28.811 6.923 1.00 47.77 C ANISOU 3746 CE2 PHE A 917 5911 4682 7557 1318 -72 251 C ATOM 3747 CZ PHE A 917 34.552 -29.948 6.415 1.00 47.35 C ANISOU 3747 CZ PHE A 917 5836 4499 7655 1378 -47 208 C ATOM 0 H PHE A 917 29.807 -26.773 2.865 1.00 37.14 H new ATOM 0 HA PHE A 917 30.398 -29.225 3.454 1.00 37.81 H new ATOM 0 HB2 PHE A 917 32.096 -27.649 3.108 1.00 39.65 H new ATOM 0 HB3 PHE A 917 31.644 -26.842 4.364 1.00 39.65 H new ATOM 0 HD1 PHE A 917 33.117 -29.975 3.507 1.00 46.63 H new ATOM 0 HD2 PHE A 917 32.641 -27.322 6.480 1.00 44.45 H new ATOM 0 HE1 PHE A 917 34.648 -31.153 4.807 1.00 48.15 H new ATOM 0 HE2 PHE A 917 34.149 -28.523 7.784 1.00 47.77 H new ATOM 0 HZ PHE A 917 35.167 -30.417 6.932 1.00 47.35 H new ATOM 3748 N LEU A 918 29.354 -27.539 6.015 1.00 37.53 N ANISOU 3748 N LEU A 918 4769 3396 6097 1017 -66 170 N ATOM 3749 CA LEU A 918 28.810 -27.669 7.376 1.00 37.90 C ANISOU 3749 CA LEU A 918 4810 3443 6146 1017 -72 336 C ATOM 3750 C LEU A 918 27.439 -28.352 7.402 1.00 42.80 C ANISOU 3750 C LEU A 918 5447 3945 6871 959 -60 373 C ATOM 3751 O LEU A 918 27.152 -29.089 8.341 1.00 43.21 O ANISOU 3751 O LEU A 918 5489 3924 7004 981 -48 509 O ATOM 3752 CB LEU A 918 28.744 -26.300 8.081 1.00 36.55 C ANISOU 3752 CB LEU A 918 4644 3440 5803 997 -86 387 C ATOM 3753 CG LEU A 918 30.064 -25.514 8.217 1.00 40.74 C ANISOU 3753 CG LEU A 918 5149 4093 6239 1048 -106 365 C ATOM 3754 CD1 LEU A 918 29.794 -24.035 8.558 1.00 39.60 C ANISOU 3754 CD1 LEU A 918 5015 4101 5931 1005 -122 367 C ATOM 3755 CD2 LEU A 918 31.003 -26.160 9.229 1.00 43.05 C ANISOU 3755 CD2 LEU A 918 5411 4370 6577 1136 -127 477 C ATOM 0 H LEU A 918 29.400 -26.731 5.725 1.00 37.53 H new ATOM 0 HA LEU A 918 29.423 -28.242 7.862 1.00 37.90 H new ATOM 0 HB2 LEU A 918 28.111 -25.744 7.600 1.00 36.55 H new ATOM 0 HB3 LEU A 918 28.382 -26.437 8.971 1.00 36.55 H new ATOM 0 HG LEU A 918 30.512 -25.542 7.357 1.00 40.74 H new ATOM 0 HD11 LEU A 918 30.637 -23.562 8.638 1.00 39.60 H new ATOM 0 HD12 LEU A 918 29.263 -23.632 7.853 1.00 39.60 H new ATOM 0 HD13 LEU A 918 29.311 -23.979 9.397 1.00 39.60 H new ATOM 0 HD21 LEU A 918 31.821 -25.641 9.289 1.00 43.05 H new ATOM 0 HD22 LEU A 918 30.573 -26.187 10.098 1.00 43.05 H new ATOM 0 HD23 LEU A 918 31.214 -27.063 8.945 1.00 43.05 H new ATOM 3756 N THR A 919 26.603 -28.087 6.385 1.00 39.30 N ANISOU 3756 N THR A 919 5024 3482 6427 888 -66 256 N ATOM 3757 CA THR A 919 25.253 -28.641 6.227 1.00 40.67 C ANISOU 3757 CA THR A 919 5202 3541 6710 821 -66 263 C ATOM 3758 C THR A 919 25.305 -30.156 5.989 1.00 48.25 C ANISOU 3758 C THR A 919 6149 4311 7873 848 -62 256 C ATOM 3759 O THR A 919 24.586 -30.898 6.667 1.00 49.70 O ANISOU 3759 O THR A 919 6314 4388 8181 832 -47 367 O ATOM 3760 CB THR A 919 24.484 -27.849 5.147 1.00 46.83 C ANISOU 3760 CB THR A 919 6006 4366 7421 746 -91 128 C ATOM 3761 OG1 THR A 919 24.079 -26.605 5.713 1.00 51.58 O ANISOU 3761 OG1 THR A 919 6610 5109 7878 713 -87 186 O ATOM 3762 CG2 THR A 919 23.254 -28.557 4.650 1.00 50.09 C ANISOU 3762 CG2 THR A 919 6417 4640 7977 683 -110 88 C ATOM 0 H THR A 919 26.820 -27.557 5.743 1.00 39.30 H new ATOM 0 HA THR A 919 24.751 -28.534 7.050 1.00 40.67 H new ATOM 0 HB THR A 919 25.081 -27.739 4.390 1.00 46.83 H new ATOM 0 HG1 THR A 919 23.659 -26.159 5.138 1.00 51.58 H new ATOM 0 HG21 THR A 919 22.817 -28.012 3.977 1.00 50.09 H new ATOM 0 HG22 THR A 919 23.506 -29.410 4.262 1.00 50.09 H new ATOM 0 HG23 THR A 919 22.645 -28.706 5.390 1.00 50.09 H new ATOM 3763 N GLU A 920 26.155 -30.606 5.039 1.00 46.30 N ANISOU 3763 N GLU A 920 5910 4017 7664 890 -70 126 N ATOM 3764 CA GLU A 920 26.335 -32.021 4.685 1.00 48.15 C ANISOU 3764 CA GLU A 920 6135 4068 8093 923 -67 91 C ATOM 3765 C GLU A 920 26.893 -32.812 5.849 1.00 54.58 C ANISOU 3765 C GLU A 920 6916 4821 9000 992 -44 256 C ATOM 3766 O GLU A 920 26.592 -33.996 5.979 1.00 56.48 O ANISOU 3766 O GLU A 920 7141 4892 9427 999 -37 296 O ATOM 3767 CB GLU A 920 27.219 -32.181 3.446 1.00 50.10 C ANISOU 3767 CB GLU A 920 6404 4302 8331 964 -70 -87 C ATOM 3768 CG GLU A 920 26.507 -31.792 2.156 1.00 65.82 C ANISOU 3768 CG GLU A 920 8439 6299 10272 901 -100 -259 C ATOM 3769 CD GLU A 920 27.306 -31.939 0.872 1.00 90.61 C ANISOU 3769 CD GLU A 920 11614 9430 13384 946 -93 -440 C ATOM 3770 OE1 GLU A 920 26.669 -32.080 -0.198 1.00 72.40 O ANISOU 3770 OE1 GLU A 920 9350 7071 11087 907 -125 -585 O ATOM 3771 OE2 GLU A 920 28.559 -31.892 0.926 1.00 85.81 O ANISOU 3771 OE2 GLU A 920 10991 8871 12741 1022 -56 -438 O ATOM 0 H GLU A 920 26.651 -30.078 4.576 1.00 46.30 H new ATOM 0 HA GLU A 920 25.459 -32.378 4.472 1.00 48.15 H new ATOM 0 HB2 GLU A 920 28.014 -31.635 3.549 1.00 50.10 H new ATOM 0 HB3 GLU A 920 27.514 -33.103 3.382 1.00 50.10 H new ATOM 0 HG2 GLU A 920 25.704 -32.331 2.078 1.00 65.82 H new ATOM 0 HG3 GLU A 920 26.222 -30.868 2.233 1.00 65.82 H new ATOM 3772 N ARG A 921 27.677 -32.153 6.714 1.00 50.99 N ANISOU 3772 N ARG A 921 6451 4502 8420 1041 -38 355 N ATOM 3773 CA ARG A 921 28.236 -32.773 7.908 1.00 52.05 C ANISOU 3773 CA ARG A 921 6560 4604 8611 1114 -26 525 C ATOM 3774 C ARG A 921 27.291 -32.638 9.133 1.00 56.24 C ANISOU 3774 C ARG A 921 7095 5155 9118 1084 -10 705 C ATOM 3775 O ARG A 921 27.618 -33.115 10.218 1.00 57.03 O ANISOU 3775 O ARG A 921 7185 5238 9245 1144 1 866 O ATOM 3776 CB ARG A 921 29.651 -32.258 8.178 1.00 51.46 C ANISOU 3776 CB ARG A 921 6468 4650 8432 1192 -40 529 C ATOM 3777 CG ARG A 921 30.614 -32.635 7.062 1.00 63.63 C ANISOU 3777 CG ARG A 921 7998 6143 10037 1236 -36 376 C ATOM 3778 CD ARG A 921 31.921 -33.128 7.599 1.00 72.85 C ANISOU 3778 CD ARG A 921 9124 7298 11258 1339 -40 445 C ATOM 3779 NE ARG A 921 32.865 -33.445 6.530 1.00 82.74 N ANISOU 3779 NE ARG A 921 10358 8508 12570 1386 -23 297 N ATOM 3780 CZ ARG A 921 33.903 -34.264 6.675 1.00100.60 C ANISOU 3780 CZ ARG A 921 12579 10694 14950 1478 -17 323 C ATOM 3781 NH1 ARG A 921 34.128 -34.863 7.839 1.00 89.95 N ANISOU 3781 NH1 ARG A 921 11204 9302 13670 1532 -36 494 N ATOM 3782 NH2 ARG A 921 34.715 -34.502 5.654 1.00 86.02 N ANISOU 3782 NH2 ARG A 921 10717 8813 13153 1520 11 181 N ATOM 0 H ARG A 921 27.897 -31.327 6.617 1.00 50.99 H new ATOM 0 HA ARG A 921 28.311 -33.726 7.744 1.00 52.05 H new ATOM 0 HB2 ARG A 921 29.631 -31.293 8.275 1.00 51.46 H new ATOM 0 HB3 ARG A 921 29.972 -32.621 9.018 1.00 51.46 H new ATOM 0 HG2 ARG A 921 30.213 -33.322 6.507 1.00 63.63 H new ATOM 0 HG3 ARG A 921 30.768 -31.864 6.493 1.00 63.63 H new ATOM 0 HD2 ARG A 921 32.306 -32.454 8.181 1.00 72.85 H new ATOM 0 HD3 ARG A 921 31.770 -33.918 8.141 1.00 72.85 H new ATOM 0 HE ARG A 921 32.742 -33.080 5.761 1.00 82.74 H new ATOM 0 HH11 ARG A 921 33.601 -34.722 8.504 1.00 89.95 H new ATOM 0 HH12 ARG A 921 34.801 -35.392 7.928 1.00 89.95 H new ATOM 0 HH21 ARG A 921 34.572 -34.126 4.894 1.00 86.02 H new ATOM 0 HH22 ARG A 921 35.385 -35.032 5.752 1.00 86.02 H new ATOM 3783 N LYS A 922 26.108 -32.020 8.936 1.00 52.39 N ANISOU 3783 N LYS A 922 6623 4701 8583 996 -4 680 N ATOM 3784 CA LYS A 922 25.057 -31.826 9.948 1.00 52.60 C ANISOU 3784 CA LYS A 922 6651 4743 8590 958 26 833 C ATOM 3785 C LYS A 922 25.565 -31.137 11.245 1.00 54.59 C ANISOU 3785 C LYS A 922 6918 5147 8678 1014 33 978 C ATOM 3786 O LYS A 922 25.097 -31.443 12.340 1.00 54.66 O ANISOU 3786 O LYS A 922 6931 5136 8701 1030 69 1149 O ATOM 3787 CB LYS A 922 24.316 -33.158 10.245 1.00 56.28 C ANISOU 3787 CB LYS A 922 7094 5011 9278 946 60 932 C ATOM 0 H LYS A 922 25.892 -31.689 8.172 1.00 52.39 H new ATOM 0 HA LYS A 922 24.417 -31.206 9.564 1.00 52.60 H new ATOM 3788 N LEU A 923 26.507 -30.191 11.105 1.00 49.29 N ANISOU 3788 N LEU A 923 6254 4623 7850 1044 -2 906 N ATOM 3789 CA LEU A 923 27.016 -29.424 12.235 1.00 48.16 C ANISOU 3789 CA LEU A 923 6125 4629 7543 1094 -15 1012 C ATOM 3790 C LEU A 923 25.958 -28.416 12.684 1.00 49.87 C ANISOU 3790 C LEU A 923 6367 4947 7634 1032 7 1048 C ATOM 3791 O LEU A 923 25.322 -27.767 11.853 1.00 48.10 O ANISOU 3791 O LEU A 923 6144 4748 7383 957 6 933 O ATOM 3792 CB LEU A 923 28.336 -28.702 11.886 1.00 47.26 C ANISOU 3792 CB LEU A 923 6000 4632 7326 1137 -63 913 C ATOM 3793 CG LEU A 923 29.618 -29.563 11.710 1.00 52.81 C ANISOU 3793 CG LEU A 923 6670 5266 8129 1221 -85 901 C ATOM 3794 CD1 LEU A 923 30.845 -28.756 12.041 1.00 52.90 C ANISOU 3794 CD1 LEU A 923 6663 5418 8019 1277 -132 887 C ATOM 3795 CD2 LEU A 923 29.633 -30.766 12.625 1.00 56.92 C ANISOU 3795 CD2 LEU A 923 7188 5674 8766 1283 -72 1064 C ATOM 0 H LEU A 923 26.863 -29.982 10.351 1.00 49.29 H new ATOM 0 HA LEU A 923 27.207 -30.039 12.960 1.00 48.16 H new ATOM 0 HB2 LEU A 923 28.195 -28.208 11.063 1.00 47.26 H new ATOM 0 HB3 LEU A 923 28.510 -28.050 12.582 1.00 47.26 H new ATOM 0 HG LEU A 923 29.618 -29.853 10.784 1.00 52.81 H new ATOM 0 HD11 LEU A 923 31.635 -29.307 11.926 1.00 52.90 H new ATOM 0 HD12 LEU A 923 30.897 -27.989 11.450 1.00 52.90 H new ATOM 0 HD13 LEU A 923 30.794 -28.452 12.961 1.00 52.90 H new ATOM 0 HD21 LEU A 923 30.448 -31.272 12.481 1.00 56.92 H new ATOM 0 HD22 LEU A 923 29.595 -30.471 13.548 1.00 56.92 H new ATOM 0 HD23 LEU A 923 28.866 -31.328 12.433 1.00 56.92 H new ATOM 3796 N THR A 924 25.742 -28.324 13.999 1.00 45.35 N ANISOU 3796 N THR A 924 5817 4427 6986 1068 28 1211 N ATOM 3797 CA THR A 924 24.783 -27.389 14.597 1.00 43.00 C ANISOU 3797 CA THR A 924 5546 4229 6562 1025 59 1261 C ATOM 3798 C THR A 924 25.459 -26.007 14.732 1.00 45.01 C ANISOU 3798 C THR A 924 5818 4666 6618 1039 10 1189 C ATOM 3799 O THR A 924 26.653 -25.867 14.458 1.00 42.86 O ANISOU 3799 O THR A 924 5531 4435 6318 1083 -44 1121 O ATOM 3800 CB THR A 924 24.387 -27.882 16.002 1.00 45.91 C ANISOU 3800 CB THR A 924 5943 4586 6917 1075 110 1469 C ATOM 3801 OG1 THR A 924 25.568 -27.862 16.819 1.00 45.52 O ANISOU 3801 OG1 THR A 924 5913 4616 6766 1172 63 1536 O ATOM 3802 CG2 THR A 924 23.753 -29.300 15.998 1.00 41.13 C ANISOU 3802 CG2 THR A 924 5313 3787 6526 1066 166 1567 C ATOM 0 H THR A 924 26.154 -28.810 14.577 1.00 45.35 H new ATOM 0 HA THR A 924 23.993 -27.330 14.037 1.00 43.00 H new ATOM 0 HB THR A 924 23.703 -27.292 16.354 1.00 45.91 H new ATOM 0 HG1 THR A 924 25.348 -27.819 17.629 1.00 45.52 H new ATOM 0 HG21 THR A 924 23.525 -29.555 16.906 1.00 41.13 H new ATOM 0 HG22 THR A 924 22.950 -29.294 15.453 1.00 41.13 H new ATOM 0 HG23 THR A 924 24.387 -29.937 15.633 1.00 41.13 H new ATOM 3803 N VAL A 925 24.695 -25.004 15.215 1.00 41.14 N ANISOU 3803 N VAL A 925 5353 4278 6000 1004 33 1210 N ATOM 3804 CA VAL A 925 25.162 -23.650 15.501 1.00 39.39 C ANISOU 3804 CA VAL A 925 5150 4223 5594 1013 -9 1156 C ATOM 3805 C VAL A 925 26.274 -23.729 16.553 1.00 44.13 C ANISOU 3805 C VAL A 925 5769 4894 6104 1112 -56 1239 C ATOM 3806 O VAL A 925 27.318 -23.113 16.367 1.00 44.00 O ANISOU 3806 O VAL A 925 5737 4959 6020 1137 -122 1157 O ATOM 3807 CB VAL A 925 23.961 -22.766 15.926 1.00 42.09 C ANISOU 3807 CB VAL A 925 5517 4632 5843 962 38 1183 C ATOM 3808 CG1 VAL A 925 24.408 -21.434 16.521 1.00 40.60 C ANISOU 3808 CG1 VAL A 925 5356 4609 5460 985 -1 1154 C ATOM 3809 CG2 VAL A 925 23.027 -22.549 14.748 1.00 40.99 C ANISOU 3809 CG2 VAL A 925 5350 4436 5789 866 59 1076 C ATOM 0 H VAL A 925 23.859 -25.110 15.388 1.00 41.14 H new ATOM 0 HA VAL A 925 25.542 -23.229 14.714 1.00 39.39 H new ATOM 0 HB VAL A 925 23.482 -23.238 16.625 1.00 42.09 H new ATOM 0 HG11 VAL A 925 23.629 -20.914 16.772 1.00 40.60 H new ATOM 0 HG12 VAL A 925 24.954 -21.597 17.306 1.00 40.60 H new ATOM 0 HG13 VAL A 925 24.925 -20.943 15.864 1.00 40.60 H new ATOM 0 HG21 VAL A 925 22.280 -21.995 15.025 1.00 40.99 H new ATOM 0 HG22 VAL A 925 23.508 -22.107 14.031 1.00 40.99 H new ATOM 0 HG23 VAL A 925 22.696 -23.405 14.435 1.00 40.99 H new ATOM 3810 N GLY A 926 26.060 -24.545 17.592 1.00 41.67 N ANISOU 3810 N GLY A 926 5485 4541 5806 1168 -24 1405 N ATOM 3811 CA GLY A 926 27.016 -24.806 18.666 1.00 42.08 C ANISOU 3811 CA GLY A 926 5562 4646 5779 1271 -72 1508 C ATOM 3812 C GLY A 926 28.327 -25.377 18.175 1.00 45.75 C ANISOU 3812 C GLY A 926 5983 5066 6336 1320 -139 1457 C ATOM 3813 O GLY A 926 29.392 -24.876 18.537 1.00 45.29 O ANISOU 3813 O GLY A 926 5919 5103 6186 1376 -218 1433 O ATOM 0 H GLY A 926 25.323 -24.977 17.690 1.00 41.67 H new ATOM 0 HA2 GLY A 926 27.189 -23.980 19.144 1.00 42.08 H new ATOM 0 HA3 GLY A 926 26.619 -25.423 19.301 1.00 42.08 H new ATOM 3814 N ASP A 927 28.253 -26.407 17.308 1.00 43.51 N ANISOU 3814 N ASP A 927 5661 4631 6240 1298 -108 1430 N ATOM 3815 CA ASP A 927 29.413 -27.046 16.666 1.00 42.95 C ANISOU 3815 CA ASP A 927 5541 4493 6283 1340 -153 1367 C ATOM 3816 C ASP A 927 30.233 -26.007 15.898 1.00 43.29 C ANISOU 3816 C ASP A 927 5553 4635 6262 1321 -207 1202 C ATOM 3817 O ASP A 927 31.447 -25.966 16.065 1.00 41.95 O ANISOU 3817 O ASP A 927 5352 4505 6082 1386 -269 1189 O ATOM 3818 CB ASP A 927 28.968 -28.166 15.715 1.00 45.44 C ANISOU 3818 CB ASP A 927 5829 4629 6805 1303 -103 1333 C ATOM 3819 CG ASP A 927 28.385 -29.407 16.376 1.00 63.00 C ANISOU 3819 CG ASP A 927 8067 6721 9148 1332 -53 1498 C ATOM 3820 OD1 ASP A 927 28.789 -29.721 17.514 1.00 68.27 O ANISOU 3820 OD1 ASP A 927 8758 7417 9765 1413 -68 1649 O ATOM 3821 OD2 ASP A 927 27.574 -30.106 15.723 1.00 68.95 O ANISOU 3821 OD2 ASP A 927 8805 7335 10057 1276 -3 1476 O ATOM 0 H ASP A 927 27.504 -26.759 17.074 1.00 43.51 H new ATOM 0 HA ASP A 927 29.964 -27.436 17.362 1.00 42.95 H new ATOM 0 HB2 ASP A 927 28.306 -27.805 15.105 1.00 45.44 H new ATOM 0 HB3 ASP A 927 29.731 -28.434 15.180 1.00 45.44 H new ATOM 3822 N VAL A 928 29.566 -25.121 15.107 1.00 38.83 N ANISOU 3822 N VAL A 928 4990 4112 5653 1233 -183 1085 N ATOM 3823 CA VAL A 928 30.259 -24.075 14.348 1.00 37.27 C ANISOU 3823 CA VAL A 928 4764 4005 5394 1209 -221 938 C ATOM 3824 C VAL A 928 30.835 -23.001 15.293 1.00 42.60 C ANISOU 3824 C VAL A 928 5447 4832 5906 1245 -283 961 C ATOM 3825 O VAL A 928 31.985 -22.615 15.112 1.00 42.74 O ANISOU 3825 O VAL A 928 5422 4902 5915 1278 -338 898 O ATOM 3826 CB VAL A 928 29.428 -23.478 13.178 1.00 39.06 C ANISOU 3826 CB VAL A 928 4992 4225 5625 1112 -182 811 C ATOM 3827 CG1 VAL A 928 30.263 -22.499 12.348 1.00 37.62 C ANISOU 3827 CG1 VAL A 928 4777 4123 5393 1096 -212 672 C ATOM 3828 CG2 VAL A 928 28.873 -24.579 12.283 1.00 38.79 C ANISOU 3828 CG2 VAL A 928 4952 4035 5750 1081 -138 780 C ATOM 0 H VAL A 928 28.712 -25.121 15.006 1.00 38.83 H new ATOM 0 HA VAL A 928 31.005 -24.507 13.904 1.00 37.27 H new ATOM 0 HB VAL A 928 28.685 -22.993 13.569 1.00 39.06 H new ATOM 0 HG11 VAL A 928 29.721 -22.142 11.627 1.00 37.62 H new ATOM 0 HG12 VAL A 928 30.567 -21.772 12.914 1.00 37.62 H new ATOM 0 HG13 VAL A 928 31.031 -22.962 11.977 1.00 37.62 H new ATOM 0 HG21 VAL A 928 28.359 -24.182 11.562 1.00 38.79 H new ATOM 0 HG22 VAL A 928 29.606 -25.095 11.912 1.00 38.79 H new ATOM 0 HG23 VAL A 928 28.300 -25.162 12.805 1.00 38.79 H new ATOM 3829 N TYR A 929 30.084 -22.568 16.323 1.00 40.27 N ANISOU 3829 N TYR A 929 5205 4604 5492 1245 -274 1052 N ATOM 3830 CA TYR A 929 30.598 -21.576 17.275 1.00 40.94 C ANISOU 3830 CA TYR A 929 5309 4831 5417 1284 -341 1066 C ATOM 3831 C TYR A 929 31.863 -22.066 18.009 1.00 43.94 C ANISOU 3831 C TYR A 929 5669 5227 5799 1385 -421 1130 C ATOM 3832 O TYR A 929 32.826 -21.300 18.148 1.00 42.53 O ANISOU 3832 O TYR A 929 5460 5139 5562 1410 -501 1067 O ATOM 3833 CB TYR A 929 29.512 -21.134 18.258 1.00 44.18 C ANISOU 3833 CB TYR A 929 5787 5301 5697 1275 -305 1154 C ATOM 3834 CG TYR A 929 29.985 -20.128 19.282 1.00 48.80 C ANISOU 3834 CG TYR A 929 6404 6031 6107 1321 -377 1160 C ATOM 3835 CD1 TYR A 929 30.175 -18.791 18.940 1.00 51.35 C ANISOU 3835 CD1 TYR A 929 6710 6447 6354 1276 -413 1033 C ATOM 3836 CD2 TYR A 929 30.196 -20.499 20.602 1.00 51.22 C ANISOU 3836 CD2 TYR A 929 6761 6378 6321 1410 -410 1292 C ATOM 3837 CE1 TYR A 929 30.581 -17.851 19.887 1.00 53.33 C ANISOU 3837 CE1 TYR A 929 6989 6823 6452 1315 -486 1026 C ATOM 3838 CE2 TYR A 929 30.603 -19.570 21.556 1.00 53.75 C ANISOU 3838 CE2 TYR A 929 7119 6833 6470 1455 -486 1285 C ATOM 3839 CZ TYR A 929 30.793 -18.246 21.195 1.00 65.51 C ANISOU 3839 CZ TYR A 929 8586 8408 7896 1406 -527 1147 C ATOM 3840 OH TYR A 929 31.200 -17.329 22.136 1.00 75.31 O ANISOU 3840 OH TYR A 929 9863 9772 8978 1450 -610 1128 O ATOM 0 H TYR A 929 29.283 -22.836 16.483 1.00 40.27 H new ATOM 0 HA TYR A 929 30.862 -20.799 16.757 1.00 40.94 H new ATOM 0 HB2 TYR A 929 28.773 -20.752 17.759 1.00 44.18 H new ATOM 0 HB3 TYR A 929 29.169 -21.915 18.720 1.00 44.18 H new ATOM 0 HD1 TYR A 929 30.028 -18.520 18.063 1.00 51.35 H new ATOM 0 HD2 TYR A 929 30.063 -21.384 20.854 1.00 51.22 H new ATOM 0 HE1 TYR A 929 30.708 -16.963 19.640 1.00 53.33 H new ATOM 0 HE2 TYR A 929 30.747 -19.838 22.435 1.00 53.75 H new ATOM 0 HH TYR A 929 31.286 -17.710 22.880 1.00 75.31 H new ATOM 3841 N LYS A 930 31.890 -23.355 18.412 1.00 41.36 N ANISOU 3841 N LYS A 930 5352 4805 5559 1442 -404 1252 N ATOM 3842 CA LYS A 930 33.056 -23.946 19.077 1.00 42.37 C ANISOU 3842 CA LYS A 930 5459 4933 5706 1544 -482 1325 C ATOM 3843 C LYS A 930 34.281 -23.961 18.135 1.00 45.88 C ANISOU 3843 C LYS A 930 5816 5353 6265 1554 -526 1206 C ATOM 3844 O LYS A 930 35.403 -23.818 18.609 1.00 44.98 O ANISOU 3844 O LYS A 930 5666 5293 6133 1623 -617 1214 O ATOM 3845 CB LYS A 930 32.749 -25.356 19.593 1.00 46.67 C ANISOU 3845 CB LYS A 930 6030 5363 6341 1599 -442 1483 C ATOM 3846 CG LYS A 930 31.836 -25.408 20.812 1.00 55.44 C ANISOU 3846 CG LYS A 930 7227 6512 7327 1624 -407 1638 C ATOM 3847 CD LYS A 930 31.643 -26.862 21.232 1.00 60.34 C ANISOU 3847 CD LYS A 930 7862 7003 8063 1680 -363 1802 C ATOM 3848 CE LYS A 930 30.640 -27.006 22.342 1.00 76.97 C ANISOU 3848 CE LYS A 930 10050 9130 10064 1700 -299 1966 C ATOM 3849 NZ LYS A 930 30.152 -28.403 22.468 1.00 90.86 N ANISOU 3849 NZ LYS A 930 11813 10731 11978 1721 -222 2113 N ATOM 0 H LYS A 930 31.234 -23.900 18.305 1.00 41.36 H new ATOM 0 HA LYS A 930 33.270 -23.390 19.843 1.00 42.37 H new ATOM 0 HB2 LYS A 930 32.340 -25.867 18.877 1.00 46.67 H new ATOM 0 HB3 LYS A 930 33.585 -25.795 19.813 1.00 46.67 H new ATOM 0 HG2 LYS A 930 32.222 -24.898 21.541 1.00 55.44 H new ATOM 0 HG3 LYS A 930 30.979 -25.003 20.605 1.00 55.44 H new ATOM 0 HD2 LYS A 930 31.352 -27.382 20.466 1.00 60.34 H new ATOM 0 HD3 LYS A 930 32.494 -27.230 21.518 1.00 60.34 H new ATOM 0 HE2 LYS A 930 31.042 -26.727 23.179 1.00 76.97 H new ATOM 0 HE3 LYS A 930 29.889 -26.415 22.178 1.00 76.97 H new ATOM 0 HZ1 LYS A 930 29.562 -28.453 23.132 1.00 90.86 H new ATOM 0 HZ2 LYS A 930 29.763 -28.652 21.707 1.00 90.86 H new ATOM 0 HZ3 LYS A 930 30.838 -28.943 22.640 1.00 90.86 H new ATOM 3850 N LEU A 931 34.061 -24.108 16.804 1.00 42.97 N ANISOU 3850 N LEU A 931 5412 4905 6010 1487 -463 1095 N ATOM 3851 CA LEU A 931 35.145 -24.042 15.811 1.00 42.95 C ANISOU 3851 CA LEU A 931 5330 4883 6106 1492 -481 975 C ATOM 3852 C LEU A 931 35.720 -22.620 15.749 1.00 46.43 C ANISOU 3852 C LEU A 931 5740 5458 6445 1469 -536 878 C ATOM 3853 O LEU A 931 36.928 -22.460 15.605 1.00 48.21 O ANISOU 3853 O LEU A 931 5894 5707 6718 1510 -590 833 O ATOM 3854 CB LEU A 931 34.701 -24.516 14.419 1.00 42.40 C ANISOU 3854 CB LEU A 931 5248 4704 6159 1432 -397 878 C ATOM 3855 CG LEU A 931 34.370 -26.019 14.286 1.00 48.90 C ANISOU 3855 CG LEU A 931 6080 5369 7131 1458 -350 946 C ATOM 3856 CD1 LEU A 931 33.606 -26.288 12.999 1.00 49.03 C ANISOU 3856 CD1 LEU A 931 6104 5293 7230 1383 -276 839 C ATOM 3857 CD2 LEU A 931 35.618 -26.879 14.350 1.00 51.72 C ANISOU 3857 CD2 LEU A 931 6379 5664 7609 1550 -386 972 C ATOM 0 H LEU A 931 33.283 -24.247 16.464 1.00 42.97 H new ATOM 0 HA LEU A 931 35.840 -24.653 16.101 1.00 42.95 H new ATOM 0 HB2 LEU A 931 33.918 -24.007 14.159 1.00 42.40 H new ATOM 0 HB3 LEU A 931 35.403 -24.301 13.785 1.00 42.40 H new ATOM 0 HG LEU A 931 33.809 -26.260 15.040 1.00 48.90 H new ATOM 0 HD11 LEU A 931 33.407 -27.235 12.932 1.00 49.03 H new ATOM 0 HD12 LEU A 931 32.778 -25.784 13.003 1.00 49.03 H new ATOM 0 HD13 LEU A 931 34.145 -26.017 12.240 1.00 49.03 H new ATOM 0 HD21 LEU A 931 35.372 -27.813 14.263 1.00 51.72 H new ATOM 0 HD22 LEU A 931 36.217 -26.634 13.627 1.00 51.72 H new ATOM 0 HD23 LEU A 931 36.064 -26.740 15.200 1.00 51.72 H new ATOM 3858 N LEU A 932 34.867 -21.603 15.924 1.00 41.24 N ANISOU 3858 N LEU A 932 5130 4882 5658 1405 -523 852 N ATOM 3859 CA LEU A 932 35.290 -20.207 15.953 1.00 39.97 C ANISOU 3859 CA LEU A 932 4945 4841 5400 1379 -574 767 C ATOM 3860 C LEU A 932 36.094 -19.946 17.212 1.00 43.63 C ANISOU 3860 C LEU A 932 5404 5390 5785 1457 -685 829 C ATOM 3861 O LEU A 932 37.098 -19.249 17.139 1.00 42.54 O ANISOU 3861 O LEU A 932 5200 5309 5652 1469 -753 759 O ATOM 3862 CB LEU A 932 34.111 -19.211 15.815 1.00 38.44 C ANISOU 3862 CB LEU A 932 4804 4702 5097 1295 -529 725 C ATOM 3863 CG LEU A 932 33.176 -19.365 14.596 1.00 42.50 C ANISOU 3863 CG LEU A 932 5331 5143 5675 1214 -434 661 C ATOM 3864 CD1 LEU A 932 32.092 -18.294 14.600 1.00 39.91 C ANISOU 3864 CD1 LEU A 932 5047 4879 5238 1140 -406 629 C ATOM 3865 CD2 LEU A 932 33.928 -19.270 13.290 1.00 46.21 C ANISOU 3865 CD2 LEU A 932 5738 5582 6239 1193 -415 543 C ATOM 0 H LEU A 932 34.020 -21.711 16.030 1.00 41.24 H new ATOM 0 HA LEU A 932 35.851 -20.054 15.176 1.00 39.97 H new ATOM 0 HB2 LEU A 932 33.569 -19.278 16.617 1.00 38.44 H new ATOM 0 HB3 LEU A 932 34.480 -18.314 15.796 1.00 38.44 H new ATOM 0 HG LEU A 932 32.777 -20.246 14.670 1.00 42.50 H new ATOM 0 HD11 LEU A 932 31.518 -18.411 13.827 1.00 39.91 H new ATOM 0 HD12 LEU A 932 31.563 -18.372 15.409 1.00 39.91 H new ATOM 0 HD13 LEU A 932 32.504 -17.416 14.567 1.00 39.91 H new ATOM 0 HD21 LEU A 932 33.308 -19.371 12.551 1.00 46.21 H new ATOM 0 HD22 LEU A 932 34.364 -18.406 13.230 1.00 46.21 H new ATOM 0 HD23 LEU A 932 34.596 -19.972 13.249 1.00 46.21 H new ATOM 3866 N LEU A 933 35.702 -20.553 18.353 1.00 42.63 N ANISOU 3866 N LEU A 933 5341 5264 5591 1514 -704 964 N ATOM 3867 CA LEU A 933 36.463 -20.443 19.621 1.00 43.06 C ANISOU 3867 CA LEU A 933 5405 5399 5558 1603 -821 1035 C ATOM 3868 C LEU A 933 37.824 -21.112 19.507 1.00 47.19 C ANISOU 3868 C LEU A 933 5842 5878 6210 1676 -890 1041 C ATOM 3869 O LEU A 933 38.798 -20.595 20.051 1.00 48.10 O ANISOU 3869 O LEU A 933 5915 6069 6291 1724 -1004 1021 O ATOM 3870 CB LEU A 933 35.704 -21.029 20.819 1.00 43.66 C ANISOU 3870 CB LEU A 933 5579 5482 5529 1657 -811 1192 C ATOM 3871 CG LEU A 933 34.346 -20.403 21.169 1.00 46.98 C ANISOU 3871 CG LEU A 933 6086 5951 5812 1602 -741 1210 C ATOM 3872 CD1 LEU A 933 33.825 -20.975 22.458 1.00 47.11 C ANISOU 3872 CD1 LEU A 933 6193 5985 5721 1674 -735 1375 C ATOM 3873 CD2 LEU A 933 34.412 -18.868 21.229 1.00 46.15 C ANISOU 3873 CD2 LEU A 933 5981 5967 5588 1558 -790 1092 C ATOM 0 H LEU A 933 34.993 -21.036 18.413 1.00 42.63 H new ATOM 0 HA LEU A 933 36.583 -19.494 19.779 1.00 43.06 H new ATOM 0 HB2 LEU A 933 35.564 -21.974 20.652 1.00 43.66 H new ATOM 0 HB3 LEU A 933 36.276 -20.960 21.599 1.00 43.66 H new ATOM 0 HG LEU A 933 33.727 -20.627 20.456 1.00 46.98 H new ATOM 0 HD11 LEU A 933 32.968 -20.572 22.668 1.00 47.11 H new ATOM 0 HD12 LEU A 933 33.717 -21.935 22.366 1.00 47.11 H new ATOM 0 HD13 LEU A 933 34.453 -20.788 23.173 1.00 47.11 H new ATOM 0 HD21 LEU A 933 33.537 -18.515 21.452 1.00 46.15 H new ATOM 0 HD22 LEU A 933 35.052 -18.598 21.906 1.00 46.15 H new ATOM 0 HD23 LEU A 933 34.690 -18.522 20.366 1.00 46.15 H new ATOM 3874 N ARG A 934 37.904 -22.241 18.775 1.00 43.15 N ANISOU 3874 N ARG A 934 5298 5239 5857 1684 -823 1061 N ATOM 3875 CA ARG A 934 39.163 -22.954 18.562 1.00 43.69 C ANISOU 3875 CA ARG A 934 5279 5250 6072 1755 -871 1064 C ATOM 3876 C ARG A 934 40.100 -22.123 17.672 1.00 45.86 C ANISOU 3876 C ARG A 934 5453 5558 6414 1722 -890 918 C ATOM 3877 O ARG A 934 41.287 -22.054 17.953 1.00 46.14 O ANISOU 3877 O ARG A 934 5410 5620 6502 1783 -982 912 O ATOM 3878 CB ARG A 934 38.914 -24.333 17.943 1.00 43.63 C ANISOU 3878 CB ARG A 934 5268 5090 6220 1767 -783 1108 C ATOM 3879 CG ARG A 934 38.397 -25.353 18.939 1.00 53.47 C ANISOU 3879 CG ARG A 934 6583 6285 7448 1830 -784 1279 C ATOM 3880 CD ARG A 934 38.048 -26.656 18.258 1.00 57.27 C ANISOU 3880 CD ARG A 934 7059 6602 8098 1828 -692 1309 C ATOM 3881 NE ARG A 934 39.213 -27.271 17.620 1.00 59.33 N ANISOU 3881 NE ARG A 934 7227 6787 8530 1879 -709 1260 N ATOM 3882 CZ ARG A 934 39.160 -28.367 16.869 1.00 71.87 C ANISOU 3882 CZ ARG A 934 8794 8227 10288 1885 -638 1253 C ATOM 3883 NH1 ARG A 934 37.999 -28.979 16.655 1.00 54.74 N ANISOU 3883 NH1 ARG A 934 6686 5965 8149 1839 -553 1291 N ATOM 3884 NH2 ARG A 934 40.268 -28.868 16.336 1.00 53.95 N ANISOU 3884 NH2 ARG A 934 6436 5894 8167 1940 -651 1205 N ATOM 0 H ARG A 934 37.226 -22.607 18.392 1.00 43.15 H new ATOM 0 HA ARG A 934 39.588 -23.086 19.424 1.00 43.69 H new ATOM 0 HB2 ARG A 934 38.275 -24.245 17.219 1.00 43.63 H new ATOM 0 HB3 ARG A 934 39.740 -24.660 17.554 1.00 43.63 H new ATOM 0 HG2 ARG A 934 39.068 -25.512 19.621 1.00 53.47 H new ATOM 0 HG3 ARG A 934 37.613 -25.001 19.389 1.00 53.47 H new ATOM 0 HD2 ARG A 934 37.675 -27.271 18.909 1.00 57.27 H new ATOM 0 HD3 ARG A 934 37.361 -26.498 17.591 1.00 57.27 H new ATOM 0 HE ARG A 934 39.980 -26.900 17.738 1.00 59.33 H new ATOM 0 HH11 ARG A 934 37.277 -28.666 17.003 1.00 54.74 H new ATOM 0 HH12 ARG A 934 37.970 -29.688 16.169 1.00 54.74 H new ATOM 0 HH21 ARG A 934 41.024 -28.483 16.476 1.00 53.95 H new ATOM 0 HH22 ARG A 934 40.229 -29.577 15.851 1.00 53.95 H new ATOM 3885 N TYR A 935 39.556 -21.454 16.646 1.00 40.68 N ANISOU 3885 N TYR A 935 4797 4904 5753 1629 -807 808 N ATOM 3886 CA TYR A 935 40.351 -20.609 15.750 1.00 39.69 C ANISOU 3886 CA TYR A 935 4584 4810 5687 1592 -804 678 C ATOM 3887 C TYR A 935 41.051 -19.506 16.538 1.00 43.02 C ANISOU 3887 C TYR A 935 4967 5349 6030 1608 -924 656 C ATOM 3888 O TYR A 935 42.281 -19.385 16.454 1.00 41.65 O ANISOU 3888 O TYR A 935 4690 5183 5953 1648 -985 622 O ATOM 3889 CB TYR A 935 39.481 -20.006 14.633 1.00 38.71 C ANISOU 3889 CB TYR A 935 4489 4681 5538 1491 -699 581 C ATOM 3890 CG TYR A 935 40.285 -19.190 13.642 1.00 39.42 C ANISOU 3890 CG TYR A 935 4492 4796 5690 1456 -678 460 C ATOM 3891 CD1 TYR A 935 41.211 -19.798 12.794 1.00 41.58 C ANISOU 3891 CD1 TYR A 935 4684 4998 6116 1491 -637 419 C ATOM 3892 CD2 TYR A 935 40.137 -17.811 13.564 1.00 38.59 C ANISOU 3892 CD2 TYR A 935 4383 4781 5498 1393 -692 392 C ATOM 3893 CE1 TYR A 935 41.957 -19.052 11.885 1.00 41.25 C ANISOU 3893 CE1 TYR A 935 4561 4979 6133 1463 -602 319 C ATOM 3894 CE2 TYR A 935 40.863 -17.056 12.644 1.00 39.20 C ANISOU 3894 CE2 TYR A 935 4379 4876 5641 1361 -662 295 C ATOM 3895 CZ TYR A 935 41.777 -17.681 11.810 1.00 46.96 C ANISOU 3895 CZ TYR A 935 5281 5791 6770 1397 -614 262 C ATOM 3896 OH TYR A 935 42.496 -16.945 10.899 1.00 46.04 O ANISOU 3896 OH TYR A 935 5082 5690 6719 1369 -569 176 O ATOM 0 H TYR A 935 38.718 -21.479 16.453 1.00 40.68 H new ATOM 0 HA TYR A 935 41.025 -21.168 15.333 1.00 39.69 H new ATOM 0 HB2 TYR A 935 39.024 -20.721 14.163 1.00 38.71 H new ATOM 0 HB3 TYR A 935 38.797 -19.444 15.029 1.00 38.71 H new ATOM 0 HD1 TYR A 935 41.332 -20.719 12.837 1.00 41.58 H new ATOM 0 HD2 TYR A 935 39.542 -17.383 14.137 1.00 38.59 H new ATOM 0 HE1 TYR A 935 42.574 -19.473 11.330 1.00 41.25 H new ATOM 0 HE2 TYR A 935 40.735 -16.136 12.590 1.00 39.20 H new ATOM 0 HH TYR A 935 43.103 -17.423 10.569 1.00 46.04 H new ATOM 3897 N TYR A 936 40.273 -18.757 17.358 1.00 39.39 N ANISOU 3897 N TYR A 936 4588 4976 5404 1583 -961 678 N ATOM 3898 CA TYR A 936 40.816 -17.706 18.217 1.00 41.12 C ANISOU 3898 CA TYR A 936 4788 5306 5532 1599 -1084 652 C ATOM 3899 C TYR A 936 41.972 -18.249 19.043 1.00 47.58 C ANISOU 3899 C TYR A 936 5550 6129 6398 1703 -1211 715 C ATOM 3900 O TYR A 936 43.043 -17.665 19.084 1.00 48.54 O ANISOU 3900 O TYR A 936 5576 6290 6576 1719 -1303 654 O ATOM 3901 CB TYR A 936 39.747 -17.151 19.189 1.00 41.89 C ANISOU 3901 CB TYR A 936 5002 5482 5433 1585 -1103 694 C ATOM 3902 CG TYR A 936 40.341 -16.184 20.196 1.00 45.76 C ANISOU 3902 CG TYR A 936 5484 6082 5822 1618 -1247 667 C ATOM 3903 CD1 TYR A 936 40.878 -14.961 19.788 1.00 47.65 C ANISOU 3903 CD1 TYR A 936 5649 6369 6088 1565 -1287 544 C ATOM 3904 CD2 TYR A 936 40.465 -16.534 21.541 1.00 47.73 C ANISOU 3904 CD2 TYR A 936 5793 6381 5960 1707 -1351 764 C ATOM 3905 CE1 TYR A 936 41.502 -14.104 20.694 1.00 48.21 C ANISOU 3905 CE1 TYR A 936 5701 6529 6088 1596 -1433 506 C ATOM 3906 CE2 TYR A 936 41.051 -15.665 22.464 1.00 49.13 C ANISOU 3906 CE2 TYR A 936 5967 6660 6042 1743 -1499 726 C ATOM 3907 CZ TYR A 936 41.556 -14.446 22.035 1.00 55.72 C ANISOU 3907 CZ TYR A 936 6722 7534 6914 1684 -1543 591 C ATOM 3908 OH TYR A 936 42.119 -13.568 22.925 1.00 58.70 O ANISOU 3908 OH TYR A 936 7092 8002 7210 1715 -1696 540 O ATOM 0 H TYR A 936 39.421 -18.854 17.422 1.00 39.39 H new ATOM 0 HA TYR A 936 41.117 -16.991 17.635 1.00 41.12 H new ATOM 0 HB2 TYR A 936 39.052 -16.702 18.682 1.00 41.89 H new ATOM 0 HB3 TYR A 936 39.325 -17.887 19.659 1.00 41.89 H new ATOM 0 HD1 TYR A 936 40.818 -14.713 18.894 1.00 47.65 H new ATOM 0 HD2 TYR A 936 40.152 -17.361 21.828 1.00 47.73 H new ATOM 0 HE1 TYR A 936 41.880 -13.307 20.399 1.00 48.21 H new ATOM 0 HE2 TYR A 936 41.102 -15.902 23.362 1.00 49.13 H new ATOM 0 HH TYR A 936 42.088 -13.894 23.698 1.00 58.70 H new ATOM 3909 N ASN A 937 41.730 -19.374 19.692 1.00 45.57 N ANISOU 3909 N ASN A 937 5353 5832 6130 1772 -1217 840 N ATOM 3910 CA ASN A 937 42.638 -20.030 20.599 1.00 48.13 C ANISOU 3910 CA ASN A 937 5648 6159 6479 1881 -1338 928 C ATOM 3911 C ASN A 937 43.932 -20.518 19.966 1.00 55.72 C ANISOU 3911 C ASN A 937 6472 7055 7646 1921 -1362 895 C ATOM 3912 O ASN A 937 45.009 -20.263 20.508 1.00 56.17 O ANISOU 3912 O ASN A 937 6452 7156 7734 1979 -1497 889 O ATOM 3913 CB ASN A 937 41.902 -21.162 21.287 1.00 49.23 C ANISOU 3913 CB ASN A 937 5890 6252 6563 1936 -1305 1081 C ATOM 3914 CG ASN A 937 42.148 -21.159 22.750 1.00 71.79 C ANISOU 3914 CG ASN A 937 8804 9193 9281 2027 -1442 1180 C ATOM 3915 OD1 ASN A 937 41.504 -20.425 23.510 1.00 72.83 O ANISOU 3915 OD1 ASN A 937 9027 9419 9224 2016 -1469 1187 O ATOM 3916 ND2 ASN A 937 43.134 -21.938 23.154 1.00 58.55 N ANISOU 3916 ND2 ASN A 937 7072 7484 7692 2124 -1534 1251 N ATOM 0 H ASN A 937 40.986 -19.797 19.607 1.00 45.57 H new ATOM 0 HA ASN A 937 42.926 -19.364 21.242 1.00 48.13 H new ATOM 0 HB2 ASN A 937 40.950 -21.081 21.117 1.00 49.23 H new ATOM 0 HB3 ASN A 937 42.186 -22.010 20.911 1.00 49.23 H new ATOM 0 HD21 ASN A 937 43.358 -21.953 23.984 1.00 58.55 H new ATOM 0 HD22 ASN A 937 43.552 -22.431 22.587 1.00 58.55 H new ATOM 3917 N GLU A 938 43.831 -21.200 18.823 1.00 54.58 N ANISOU 3917 N GLU A 938 6293 6802 7641 1892 -1234 868 N ATOM 3918 CA GLU A 938 44.975 -21.768 18.115 1.00 56.33 C ANISOU 3918 CA GLU A 938 6390 6948 8066 1933 -1225 836 C ATOM 3919 C GLU A 938 45.784 -20.744 17.328 1.00 63.02 C ANISOU 3919 C GLU A 938 7122 7831 8993 1885 -1224 703 C ATOM 3920 O GLU A 938 47.013 -20.848 17.294 1.00 62.31 O ANISOU 3920 O GLU A 938 6908 7726 9040 1939 -1287 688 O ATOM 3921 CB GLU A 938 44.498 -22.856 17.140 1.00 57.21 C ANISOU 3921 CB GLU A 938 6521 6929 8287 1920 -1080 843 C ATOM 3922 CG GLU A 938 43.933 -24.092 17.807 1.00 69.53 C ANISOU 3922 CG GLU A 938 8161 8418 9837 1980 -1075 984 C ATOM 3923 CD GLU A 938 43.696 -25.242 16.851 1.00 96.33 C ANISOU 3923 CD GLU A 938 11552 11667 13381 1979 -952 980 C ATOM 3924 OE1 GLU A 938 44.664 -25.688 16.192 1.00 85.90 O ANISOU 3924 OE1 GLU A 938 10131 10280 12226 2018 -934 933 O ATOM 3925 OE2 GLU A 938 42.547 -25.739 16.808 1.00 98.34 O ANISOU 3925 OE2 GLU A 938 11902 11869 13593 1945 -875 1026 O ATOM 0 H GLU A 938 43.079 -21.347 18.432 1.00 54.58 H new ATOM 0 HA GLU A 938 45.555 -22.132 18.802 1.00 56.33 H new ATOM 0 HB2 GLU A 938 43.820 -22.478 16.558 1.00 57.21 H new ATOM 0 HB3 GLU A 938 45.242 -23.118 16.576 1.00 57.21 H new ATOM 0 HG2 GLU A 938 44.542 -24.381 18.504 1.00 69.53 H new ATOM 0 HG3 GLU A 938 43.095 -23.863 18.239 1.00 69.53 H new ATOM 3926 N GLU A 939 45.093 -19.788 16.665 1.00 61.93 N ANISOU 3926 N GLU A 939 7017 7731 8783 1785 -1145 613 N ATOM 3927 CA GLU A 939 45.689 -18.831 15.730 1.00 63.34 C ANISOU 3927 CA GLU A 939 7098 7930 9040 1728 -1106 493 C ATOM 3928 C GLU A 939 45.726 -17.339 16.118 1.00 73.06 C ANISOU 3928 C GLU A 939 8314 9268 10176 1674 -1184 428 C ATOM 3929 O GLU A 939 46.626 -16.651 15.632 1.00 74.38 O ANISOU 3929 O GLU A 939 8364 9447 10449 1655 -1194 352 O ATOM 3930 CB GLU A 939 44.974 -18.946 14.371 1.00 63.15 C ANISOU 3930 CB GLU A 939 7110 7847 9038 1656 -936 430 C ATOM 0 H GLU A 939 44.244 -19.685 16.757 1.00 61.93 H new ATOM 0 HA GLU A 939 46.622 -19.095 15.722 1.00 63.34 H new ATOM 3931 N CYS A 940 44.761 -16.818 16.913 1.00 71.25 N ANISOU 3931 N CYS A 940 8198 9109 9764 1646 -1225 452 N ATOM 3932 CA CYS A 940 44.693 -15.374 17.202 1.00 71.53 C ANISOU 3932 CA CYS A 940 8229 9236 9711 1590 -1286 378 C ATOM 3933 C CYS A 940 45.203 -14.942 18.595 1.00 78.70 C ANISOU 3933 C CYS A 940 9134 10227 10541 1648 -1471 400 C ATOM 3934 O CYS A 940 45.861 -13.901 18.687 1.00 78.76 O ANISOU 3934 O CYS A 940 9061 10282 10580 1624 -1552 321 O ATOM 3935 CB CYS A 940 43.280 -14.854 16.953 1.00 70.26 C ANISOU 3935 CB CYS A 940 8187 9099 9410 1510 -1193 359 C ATOM 3936 SG CYS A 940 42.612 -15.286 15.323 1.00 72.84 S ANISOU 3936 SG CYS A 940 8530 9337 9810 1442 -997 322 S ATOM 0 H CYS A 940 44.144 -17.285 17.289 1.00 71.25 H new ATOM 0 HA CYS A 940 45.319 -14.965 16.584 1.00 71.53 H new ATOM 0 HB2 CYS A 940 42.690 -15.206 17.638 1.00 70.26 H new ATOM 0 HB3 CYS A 940 43.279 -13.889 17.047 1.00 70.26 H new ATOM 0 HG CYS A 940 41.851 -16.207 15.433 1.00 72.84 H new ATOM 3937 N ARG A 941 44.857 -15.690 19.662 1.00 77.27 N ANISOU 3937 N ARG A 941 9045 10061 10251 1721 -1536 506 N ATOM 3938 CA ARG A 941 45.209 -15.391 21.053 1.00 79.21 C ANISOU 3938 CA ARG A 941 9319 10393 10385 1788 -1713 538 C ATOM 3939 C ARG A 941 46.708 -15.171 21.247 1.00 87.96 C ANISOU 3939 C ARG A 941 10279 11510 11632 1836 -1857 496 C ATOM 3940 O ARG A 941 47.100 -14.081 21.667 1.00 87.54 O ANISOU 3940 O ARG A 941 10189 11526 11548 1816 -1970 417 O ATOM 3941 CB ARG A 941 44.659 -16.478 21.998 1.00 80.33 C ANISOU 3941 CB ARG A 941 9579 10531 10411 1871 -1732 681 C ATOM 3942 CG ARG A 941 44.774 -16.143 23.488 1.00 92.28 C ANISOU 3942 CG ARG A 941 11163 12148 11753 1944 -1902 721 C ATOM 3943 CD ARG A 941 43.879 -17.012 24.354 1.00102.52 C ANISOU 3943 CD ARG A 941 12608 13452 12893 2006 -1876 866 C ATOM 3944 NE ARG A 941 44.278 -18.419 24.327 1.00111.73 N ANISOU 3944 NE ARG A 941 13749 14532 14171 2082 -1861 983 N ATOM 3945 CZ ARG A 941 44.948 -19.027 25.300 1.00129.95 C ANISOU 3945 CZ ARG A 941 16061 16859 16454 2194 -1996 1079 C ATOM 3946 NH1 ARG A 941 45.284 -18.364 26.399 1.00116.74 N ANISOU 3946 NH1 ARG A 941 14423 15296 14635 2247 -2164 1067 N ATOM 3947 NH2 ARG A 941 45.274 -20.308 25.188 1.00121.44 N ANISOU 3947 NH2 ARG A 941 14956 15690 15496 2259 -1970 1186 N ATOM 0 H ARG A 941 44.394 -16.410 19.584 1.00 77.27 H new ATOM 0 HA ARG A 941 44.786 -14.549 21.283 1.00 79.21 H new ATOM 0 HB2 ARG A 941 43.726 -16.634 21.784 1.00 80.33 H new ATOM 0 HB3 ARG A 941 45.131 -17.308 21.827 1.00 80.33 H new ATOM 0 HG2 ARG A 941 45.696 -16.252 23.770 1.00 92.28 H new ATOM 0 HG3 ARG A 941 44.544 -15.211 23.625 1.00 92.28 H new ATOM 0 HD2 ARG A 941 43.904 -16.688 25.268 1.00102.52 H new ATOM 0 HD3 ARG A 941 42.961 -16.932 24.050 1.00102.52 H new ATOM 0 HE ARG A 941 44.065 -18.884 23.635 1.00111.73 H new ATOM 0 HH11 ARG A 941 45.068 -17.536 26.485 1.00116.74 H new ATOM 0 HH12 ARG A 941 45.718 -18.762 27.026 1.00116.74 H new ATOM 0 HH21 ARG A 941 45.052 -20.748 24.484 1.00121.44 H new ATOM 0 HH22 ARG A 941 45.708 -20.698 25.820 1.00121.44 H new ATOM 3948 N ASN A 942 47.538 -16.182 20.898 1.00 88.37 N ANISOU 3948 N ASN A 942 10240 11486 11852 1895 -1851 544 N ATOM 3949 CA ASN A 942 48.999 -16.137 21.029 1.00 91.19 C ANISOU 3949 CA ASN A 942 10439 11836 12374 1948 -1980 518 C ATOM 3950 C ASN A 942 49.717 -15.353 19.904 1.00 98.40 C ANISOU 3950 C ASN A 942 11199 12719 13470 1876 -1918 400 C ATOM 3951 O ASN A 942 50.923 -15.103 20.013 1.00 99.02 O ANISOU 3951 O ASN A 942 11130 12796 13695 1906 -2026 365 O ATOM 3952 CB ASN A 942 49.560 -17.553 21.157 1.00 93.71 C ANISOU 3952 CB ASN A 942 10722 12081 12801 2048 -1994 624 C ATOM 0 H ASN A 942 47.251 -16.925 20.573 1.00 88.37 H new ATOM 0 HA ASN A 942 49.181 -15.638 21.840 1.00 91.19 H new ATOM 3953 N CYS A 943 48.972 -14.954 18.845 1.00 96.31 N ANISOU 3953 N CYS A 943 10968 12431 13196 1782 -1746 345 N ATOM 3954 CA CYS A 943 49.482 -14.218 17.683 1.00 96.69 C ANISOU 3954 CA CYS A 943 10895 12450 13394 1709 -1654 248 C ATOM 3955 C CYS A 943 49.930 -12.793 18.032 1.00102.36 C ANISOU 3955 C CYS A 943 11542 13234 14115 1663 -1765 158 C ATOM 3956 O CYS A 943 49.123 -11.983 18.501 1.00101.07 O ANISOU 3956 O CYS A 943 11478 13135 13788 1617 -1796 128 O ATOM 3957 CB CYS A 943 48.457 -14.226 16.551 1.00 95.61 C ANISOU 3957 CB CYS A 943 10838 12277 13214 1632 -1454 224 C ATOM 3958 SG CYS A 943 49.085 -13.620 14.962 1.00 99.14 S ANISOU 3958 SG CYS A 943 11151 12675 13843 1563 -1305 131 S ATOM 0 H CYS A 943 48.129 -15.115 18.792 1.00 96.31 H new ATOM 0 HA CYS A 943 50.278 -14.680 17.378 1.00 96.69 H new ATOM 0 HB2 CYS A 943 48.130 -15.132 16.432 1.00 95.61 H new ATOM 0 HB3 CYS A 943 47.698 -13.683 16.814 1.00 95.61 H new ATOM 0 HG CYS A 943 48.211 -13.667 14.142 1.00 99.14 H new ATOM 3959 N SER A 944 51.222 -12.497 17.788 1.00101.31 N ANISOU 3959 N SER A 944 11230 13078 14184 1675 -1821 114 N ATOM 3960 CA SER A 944 51.841 -11.191 18.046 1.00102.14 C ANISOU 3960 CA SER A 944 11233 13225 14349 1631 -1933 25 C ATOM 3961 C SER A 944 51.854 -10.294 16.791 1.00105.40 C ANISOU 3961 C SER A 944 11574 13608 14867 1531 -1778 -51 C ATOM 3962 O SER A 944 51.674 -9.078 16.907 1.00104.55 O ANISOU 3962 O SER A 944 11461 13539 14725 1464 -1816 -122 O ATOM 3963 CB SER A 944 53.259 -11.372 18.583 1.00107.89 C ANISOU 3963 CB SER A 944 11798 13943 15254 1703 -2097 27 C ATOM 3964 OG SER A 944 53.795 -10.149 19.061 1.00118.43 O ANISOU 3964 OG SER A 944 13045 15319 16632 1667 -2242 -59 O ATOM 0 H SER A 944 51.772 -13.070 17.459 1.00101.31 H new ATOM 0 HA SER A 944 51.300 -10.743 18.715 1.00102.14 H new ATOM 0 HB2 SER A 944 53.254 -12.026 19.299 1.00107.89 H new ATOM 0 HB3 SER A 944 53.829 -11.724 17.882 1.00107.89 H new ATOM 0 HG SER A 944 54.573 -10.278 19.351 1.00118.43 H new ATOM 3965 N THR A 945 52.069 -10.904 15.602 1.00101.57 N ANISOU 3965 N THR A 945 11037 13051 14504 1528 -1603 -35 N ATOM 3966 CA THR A 945 52.125 -10.237 14.294 1.00127.85 C ANISOU 3966 CA THR A 945 14303 16346 17930 1448 -1432 -90 C ATOM 3967 C THR A 945 50.800 -9.569 13.916 1.00142.78 C ANISOU 3967 C THR A 945 16340 18270 19642 1364 -1335 -116 C ATOM 3968 O THR A 945 49.731 -10.048 14.289 1.00 97.96 O ANISOU 3968 O THR A 945 10820 12615 13786 1372 -1329 -78 O ATOM 3969 CB THR A 945 52.582 -11.218 13.200 1.00136.19 C ANISOU 3969 CB THR A 945 15299 17325 19124 1483 -1270 -62 C ATOM 3970 OG1 THR A 945 51.701 -12.343 13.173 1.00135.80 O ANISOU 3970 OG1 THR A 945 15395 17255 18946 1519 -1208 -4 O ATOM 3971 CG2 THR A 945 54.027 -11.681 13.380 1.00135.63 C ANISOU 3971 CG2 THR A 945 15045 17213 19276 1557 -1344 -47 C ATOM 0 H THR A 945 52.190 -11.753 15.543 1.00101.57 H new ATOM 0 HA THR A 945 52.782 -9.527 14.367 1.00127.85 H new ATOM 0 HB THR A 945 52.548 -10.745 12.354 1.00136.19 H new ATOM 0 HG1 THR A 945 51.141 -12.275 13.795 1.00135.80 H new ATOM 0 HG21 THR A 945 54.262 -12.295 12.666 1.00135.63 H new ATOM 0 HG22 THR A 945 54.619 -10.913 13.353 1.00135.63 H new ATOM 0 HG23 THR A 945 54.119 -12.130 14.235 1.00135.63 H new ATOM 3972 N PRO A 948 47.074 -13.488 10.981 1.00 69.52 N ANISOU 3972 N PRO A 948 7547 8816 10050 1374 -755 16 N ATOM 3973 CA PRO A 948 47.223 -14.897 11.380 1.00 69.49 C ANISOU 3973 CA PRO A 948 7562 8758 10084 1458 -780 82 C ATOM 3974 C PRO A 948 47.971 -15.751 10.346 1.00 70.50 C ANISOU 3974 C PRO A 948 7615 8803 10370 1502 -665 66 C ATOM 3975 O PRO A 948 48.068 -15.370 9.177 1.00 69.24 O ANISOU 3975 O PRO A 948 7430 8629 10251 1462 -535 6 O ATOM 3976 CB PRO A 948 45.772 -15.356 11.544 1.00 70.26 C ANISOU 3976 CB PRO A 948 7823 8851 10021 1434 -748 118 C ATOM 3977 CG PRO A 948 45.004 -14.514 10.541 1.00 73.73 C ANISOU 3977 CG PRO A 948 8312 9308 10393 1343 -636 51 C ATOM 3978 CD PRO A 948 45.815 -13.266 10.243 1.00 69.55 C ANISOU 3978 CD PRO A 948 7673 8822 9930 1305 -644 -8 C ATOM 0 HA PRO A 948 47.761 -14.994 12.181 1.00 69.49 H new ATOM 0 HB2 PRO A 948 45.676 -16.303 11.359 1.00 70.26 H new ATOM 0 HB3 PRO A 948 45.453 -15.210 12.448 1.00 70.26 H new ATOM 0 HG2 PRO A 948 44.848 -15.018 9.727 1.00 73.73 H new ATOM 0 HG3 PRO A 948 44.134 -14.274 10.897 1.00 73.73 H new ATOM 0 HD2 PRO A 948 45.972 -13.161 9.292 1.00 69.55 H new ATOM 0 HD3 PRO A 948 45.361 -12.464 10.545 1.00 69.55 H new ATOM 3979 N ASP A 949 48.467 -16.923 10.774 1.00 66.46 N ANISOU 3979 N ASP A 949 7074 8236 9941 1589 -707 123 N ATOM 3980 CA ASP A 949 49.191 -17.852 9.896 1.00 66.09 C ANISOU 3980 CA ASP A 949 6956 8101 10052 1645 -603 110 C ATOM 3981 C ASP A 949 48.239 -18.577 8.931 1.00 65.37 C ANISOU 3981 C ASP A 949 6983 7949 9906 1625 -461 86 C ATOM 3982 O ASP A 949 48.516 -18.656 7.733 1.00 65.98 O ANISOU 3982 O ASP A 949 7032 7988 10051 1621 -326 25 O ATOM 3983 CB ASP A 949 50.009 -18.860 10.719 1.00 69.27 C ANISOU 3983 CB ASP A 949 7291 8460 10569 1748 -704 181 C ATOM 0 H ASP A 949 48.391 -17.200 11.585 1.00 66.46 H new ATOM 0 HA ASP A 949 49.806 -17.327 9.360 1.00 66.09 H new ATOM 3984 N ILE A 950 47.116 -19.082 9.464 1.00 56.61 N ANISOU 3984 N ILE A 950 6005 6832 8673 1614 -494 134 N ATOM 3985 CA ILE A 950 46.084 -19.829 8.737 1.00 53.39 C ANISOU 3985 CA ILE A 950 5712 6359 8213 1593 -390 118 C ATOM 3986 C ILE A 950 44.790 -19.015 8.765 1.00 50.32 C ANISOU 3986 C ILE A 950 5436 6032 7650 1502 -386 104 C ATOM 3987 O ILE A 950 44.472 -18.402 9.783 1.00 49.66 O ANISOU 3987 O ILE A 950 5377 6018 7474 1483 -488 147 O ATOM 3988 CB ILE A 950 45.918 -21.255 9.363 1.00 56.46 C ANISOU 3988 CB ILE A 950 6140 6665 8648 1666 -429 200 C ATOM 3989 CG1 ILE A 950 47.228 -22.042 9.255 1.00 58.99 C ANISOU 3989 CG1 ILE A 950 6340 6918 9154 1760 -428 210 C ATOM 3990 CG2 ILE A 950 44.775 -22.050 8.723 1.00 54.86 C ANISOU 3990 CG2 ILE A 950 6055 6386 8403 1639 -339 184 C ATOM 3991 CD1 ILE A 950 47.563 -22.962 10.452 1.00 68.82 C ANISOU 3991 CD1 ILE A 950 7569 8129 10452 1846 -546 322 C ATOM 0 H ILE A 950 46.930 -18.992 10.299 1.00 56.61 H new ATOM 0 HA ILE A 950 46.336 -19.962 7.810 1.00 53.39 H new ATOM 0 HB ILE A 950 45.692 -21.127 10.297 1.00 56.46 H new ATOM 0 HG12 ILE A 950 47.194 -22.585 8.452 1.00 58.99 H new ATOM 0 HG13 ILE A 950 47.956 -21.411 9.140 1.00 58.99 H new ATOM 0 HG21 ILE A 950 44.713 -22.922 9.143 1.00 54.86 H new ATOM 0 HG22 ILE A 950 43.940 -21.572 8.846 1.00 54.86 H new ATOM 0 HG23 ILE A 950 44.948 -22.160 7.775 1.00 54.86 H new ATOM 0 HD11 ILE A 950 48.406 -23.413 10.288 1.00 68.82 H new ATOM 0 HD12 ILE A 950 47.633 -22.430 11.260 1.00 68.82 H new ATOM 0 HD13 ILE A 950 46.860 -23.621 10.560 1.00 68.82 H new ATOM 3992 N LYS A 951 44.074 -18.983 7.642 1.00 43.39 N ANISOU 3992 N LYS A 951 4627 5130 6730 1451 -272 40 N ATOM 3993 CA LYS A 951 42.785 -18.302 7.516 1.00 40.93 C ANISOU 3993 CA LYS A 951 4421 4864 6268 1366 -258 23 C ATOM 3994 C LYS A 951 41.666 -19.164 8.113 1.00 40.44 C ANISOU 3994 C LYS A 951 4462 4757 6146 1367 -288 86 C ATOM 3995 O LYS A 951 41.822 -20.369 8.247 1.00 39.74 O ANISOU 3995 O LYS A 951 4375 4585 6139 1426 -286 124 O ATOM 3996 CB LYS A 951 42.498 -17.952 6.051 1.00 44.00 C ANISOU 3996 CB LYS A 951 4839 5242 6637 1319 -134 -68 C ATOM 3997 CG LYS A 951 43.220 -16.687 5.577 1.00 56.62 C ANISOU 3997 CG LYS A 951 6357 6908 8247 1288 -102 -115 C ATOM 0 H LYS A 951 44.330 -19.365 6.915 1.00 43.39 H new ATOM 0 HA LYS A 951 42.822 -17.471 8.015 1.00 40.93 H new ATOM 0 HB2 LYS A 951 42.762 -18.697 5.489 1.00 44.00 H new ATOM 0 HB3 LYS A 951 41.542 -17.834 5.935 1.00 44.00 H new ATOM 3998 N LEU A 952 40.563 -18.535 8.504 1.00 37.36 N ANISOU 3998 N LEU A 952 4152 4419 5626 1304 -312 102 N ATOM 3999 CA LEU A 952 39.423 -19.177 9.145 1.00 36.93 C ANISOU 3999 CA LEU A 952 4189 4332 5510 1296 -334 171 C ATOM 4000 C LEU A 952 38.830 -20.353 8.375 1.00 40.46 C ANISOU 4000 C LEU A 952 4688 4667 6017 1299 -260 154 C ATOM 4001 O LEU A 952 38.683 -21.415 8.968 1.00 42.73 O ANISOU 4001 O LEU A 952 4995 4885 6354 1344 -283 229 O ATOM 4002 CB LEU A 952 38.321 -18.150 9.494 1.00 34.90 C ANISOU 4002 CB LEU A 952 3999 4151 5109 1221 -352 175 C ATOM 4003 CG LEU A 952 37.045 -18.686 10.143 1.00 38.18 C ANISOU 4003 CG LEU A 952 4506 4539 5462 1204 -359 248 C ATOM 4004 CD1 LEU A 952 37.292 -19.169 11.577 1.00 38.33 C ANISOU 4004 CD1 LEU A 952 4526 4569 5468 1270 -442 361 C ATOM 4005 CD2 LEU A 952 35.903 -17.628 10.096 1.00 40.67 C ANISOU 4005 CD2 LEU A 952 4880 4919 5654 1122 -347 225 C ATOM 0 H LEU A 952 40.455 -17.688 8.399 1.00 37.36 H new ATOM 0 HA LEU A 952 39.785 -19.556 9.961 1.00 36.93 H new ATOM 0 HB2 LEU A 952 38.705 -17.488 10.089 1.00 34.90 H new ATOM 0 HB3 LEU A 952 38.072 -17.688 8.678 1.00 34.90 H new ATOM 0 HG LEU A 952 36.762 -19.456 9.625 1.00 38.18 H new ATOM 0 HD11 LEU A 952 36.462 -19.501 11.954 1.00 38.33 H new ATOM 0 HD12 LEU A 952 37.951 -19.881 11.570 1.00 38.33 H new ATOM 0 HD13 LEU A 952 37.619 -18.431 12.115 1.00 38.33 H new ATOM 0 HD21 LEU A 952 35.107 -17.992 10.513 1.00 40.67 H new ATOM 0 HD22 LEU A 952 36.181 -16.830 10.573 1.00 40.67 H new ATOM 0 HD23 LEU A 952 35.709 -17.402 9.173 1.00 40.67 H new ATOM 4006 N TYR A 953 38.459 -20.181 7.109 1.00 36.12 N ANISOU 4006 N TYR A 953 4167 4097 5461 1253 -178 61 N ATOM 4007 CA TYR A 953 37.781 -21.281 6.376 1.00 36.18 C ANISOU 4007 CA TYR A 953 4234 3995 5519 1252 -121 32 C ATOM 4008 C TYR A 953 38.704 -22.484 6.195 1.00 41.99 C ANISOU 4008 C TYR A 953 4922 4634 6399 1335 -101 32 C ATOM 4009 O TYR A 953 38.307 -23.557 6.635 1.00 42.18 O ANISOU 4009 O TYR A 953 4973 4570 6482 1363 -117 91 O ATOM 4010 CB TYR A 953 37.130 -20.821 5.061 1.00 35.00 C ANISOU 4010 CB TYR A 953 4136 3849 5313 1189 -51 -73 C ATOM 4011 CG TYR A 953 35.853 -19.999 5.178 1.00 32.93 C ANISOU 4011 CG TYR A 953 3939 3643 4930 1106 -69 -67 C ATOM 4012 CD1 TYR A 953 35.458 -19.441 6.396 1.00 33.87 C ANISOU 4012 CD1 TYR A 953 4062 3826 4982 1088 -133 18 C ATOM 4013 CD2 TYR A 953 35.042 -19.776 4.067 1.00 31.76 C ANISOU 4013 CD2 TYR A 953 3850 3484 4734 1051 -22 -149 C ATOM 4014 CE1 TYR A 953 34.295 -18.667 6.496 1.00 34.00 C ANISOU 4014 CE1 TYR A 953 4132 3891 4896 1016 -141 21 C ATOM 4015 CE2 TYR A 953 33.893 -18.984 4.148 1.00 31.12 C ANISOU 4015 CE2 TYR A 953 3818 3452 4553 978 -40 -143 C ATOM 4016 CZ TYR A 953 33.513 -18.448 5.366 1.00 37.61 C ANISOU 4016 CZ TYR A 953 4637 4333 5322 960 -95 -57 C ATOM 4017 OH TYR A 953 32.374 -17.684 5.421 1.00 32.27 O ANISOU 4017 OH TYR A 953 4005 3698 4558 892 -104 -54 O ATOM 0 H TYR A 953 38.581 -19.460 6.656 1.00 36.12 H new ATOM 0 HA TYR A 953 37.042 -21.573 6.933 1.00 36.18 H new ATOM 0 HB2 TYR A 953 37.782 -20.299 4.568 1.00 35.00 H new ATOM 0 HB3 TYR A 953 36.935 -21.608 4.528 1.00 35.00 H new ATOM 0 HD1 TYR A 953 35.977 -19.586 7.154 1.00 33.87 H new ATOM 0 HD2 TYR A 953 35.270 -20.163 3.253 1.00 31.76 H new ATOM 0 HE1 TYR A 953 34.046 -18.301 7.314 1.00 34.00 H new ATOM 0 HE2 TYR A 953 33.386 -18.818 3.386 1.00 31.12 H new ATOM 0 HH TYR A 953 32.471 -17.077 5.993 1.00 32.27 H new ATOM 4018 N PRO A 954 39.973 -22.335 5.721 1.00 41.18 N ANISOU 4018 N PRO A 954 4737 4544 6366 1382 -70 -14 N ATOM 4019 CA PRO A 954 40.898 -23.491 5.725 1.00 41.89 C ANISOU 4019 CA PRO A 954 4770 4541 6606 1472 -58 -1 C ATOM 4020 C PRO A 954 40.989 -24.153 7.108 1.00 44.98 C ANISOU 4020 C PRO A 954 5146 4905 7039 1523 -149 127 C ATOM 4021 O PRO A 954 40.938 -25.373 7.199 1.00 45.59 O ANISOU 4021 O PRO A 954 5235 4873 7215 1571 -142 160 O ATOM 4022 CB PRO A 954 42.245 -22.859 5.351 1.00 44.11 C ANISOU 4022 CB PRO A 954 4946 4875 6938 1506 -31 -44 C ATOM 4023 CG PRO A 954 41.900 -21.654 4.572 1.00 47.14 C ANISOU 4023 CG PRO A 954 5356 5341 7212 1431 18 -116 C ATOM 4024 CD PRO A 954 40.640 -21.122 5.175 1.00 41.95 C ANISOU 4024 CD PRO A 954 4781 4733 6426 1358 -39 -75 C ATOM 0 HA PRO A 954 40.610 -24.194 5.122 1.00 41.89 H new ATOM 0 HB2 PRO A 954 42.757 -22.631 6.142 1.00 44.11 H new ATOM 0 HB3 PRO A 954 42.787 -23.471 4.829 1.00 44.11 H new ATOM 0 HG2 PRO A 954 42.611 -20.996 4.617 1.00 47.14 H new ATOM 0 HG3 PRO A 954 41.772 -21.871 3.635 1.00 47.14 H new ATOM 0 HD2 PRO A 954 40.824 -20.472 5.871 1.00 41.95 H new ATOM 0 HD3 PRO A 954 40.087 -20.679 4.513 1.00 41.95 H new ATOM 4025 N PHE A 955 41.071 -23.351 8.192 1.00 41.11 N ANISOU 4025 N PHE A 955 4638 4514 6469 1513 -236 199 N ATOM 4026 CA PHE A 955 41.106 -23.882 9.563 1.00 41.12 C ANISOU 4026 CA PHE A 955 4640 4508 6477 1565 -328 328 C ATOM 4027 C PHE A 955 39.887 -24.770 9.822 1.00 43.42 C ANISOU 4027 C PHE A 955 5023 4717 6756 1547 -312 389 C ATOM 4028 O PHE A 955 40.040 -25.853 10.350 1.00 43.62 O ANISOU 4028 O PHE A 955 5046 4659 6870 1610 -332 472 O ATOM 4029 CB PHE A 955 41.128 -22.742 10.608 1.00 42.48 C ANISOU 4029 CB PHE A 955 4806 4810 6525 1544 -420 376 C ATOM 4030 CG PHE A 955 41.064 -23.261 12.032 1.00 44.52 C ANISOU 4030 CG PHE A 955 5086 5071 6758 1602 -513 511 C ATOM 4031 CD1 PHE A 955 42.219 -23.665 12.696 1.00 47.82 C ANISOU 4031 CD1 PHE A 955 5427 5485 7259 1691 -591 568 C ATOM 4032 CD2 PHE A 955 39.844 -23.368 12.700 1.00 46.12 C ANISOU 4032 CD2 PHE A 955 5386 5280 6857 1570 -519 586 C ATOM 4033 CE1 PHE A 955 42.151 -24.181 13.986 1.00 49.27 C ANISOU 4033 CE1 PHE A 955 5640 5672 7407 1752 -677 700 C ATOM 4034 CE2 PHE A 955 39.779 -23.895 13.987 1.00 49.15 C ANISOU 4034 CE2 PHE A 955 5799 5665 7210 1631 -591 721 C ATOM 4035 CZ PHE A 955 40.934 -24.284 14.625 1.00 48.41 C ANISOU 4035 CZ PHE A 955 5638 5572 7184 1722 -673 777 C ATOM 0 H PHE A 955 41.107 -22.493 8.147 1.00 41.11 H new ATOM 0 HA PHE A 955 41.919 -24.404 9.651 1.00 41.12 H new ATOM 0 HB2 PHE A 955 41.936 -22.218 10.494 1.00 42.48 H new ATOM 0 HB3 PHE A 955 40.379 -22.147 10.449 1.00 42.48 H new ATOM 0 HD1 PHE A 955 43.044 -23.589 12.273 1.00 47.82 H new ATOM 0 HD2 PHE A 955 39.064 -23.084 12.280 1.00 46.12 H new ATOM 0 HE1 PHE A 955 42.927 -24.457 14.418 1.00 49.27 H new ATOM 0 HE2 PHE A 955 38.958 -23.984 14.414 1.00 49.15 H new ATOM 0 HZ PHE A 955 40.894 -24.618 15.492 1.00 48.41 H new ATOM 4036 N ILE A 956 38.676 -24.276 9.506 1.00 39.58 N ANISOU 4036 N ILE A 956 4614 4254 6169 1463 -278 357 N ATOM 4037 CA ILE A 956 37.433 -25.019 9.713 1.00 39.24 C ANISOU 4037 CA ILE A 956 4650 4133 6126 1434 -259 412 C ATOM 4038 C ILE A 956 37.418 -26.344 8.958 1.00 44.01 C ANISOU 4038 C ILE A 956 5258 4586 6879 1463 -203 378 C ATOM 4039 O ILE A 956 37.114 -27.363 9.562 1.00 44.86 O ANISOU 4039 O ILE A 956 5383 4602 7060 1497 -215 472 O ATOM 4040 CB ILE A 956 36.199 -24.158 9.405 1.00 39.89 C ANISOU 4040 CB ILE A 956 4798 4272 6088 1337 -234 370 C ATOM 4041 CG1 ILE A 956 36.095 -23.012 10.424 1.00 39.05 C ANISOU 4041 CG1 ILE A 956 4698 4299 5842 1319 -295 427 C ATOM 4042 CG2 ILE A 956 34.918 -25.030 9.375 1.00 40.53 C ANISOU 4042 CG2 ILE A 956 4944 4247 6206 1302 -202 408 C ATOM 4043 CD1 ILE A 956 35.043 -21.897 10.027 1.00 35.92 C ANISOU 4043 CD1 ILE A 956 4350 3973 5325 1224 -271 370 C ATOM 0 H ILE A 956 38.560 -23.495 9.164 1.00 39.58 H new ATOM 0 HA ILE A 956 37.392 -25.244 10.656 1.00 39.24 H new ATOM 0 HB ILE A 956 36.294 -23.764 8.524 1.00 39.89 H new ATOM 0 HG12 ILE A 956 35.853 -23.380 11.288 1.00 39.05 H new ATOM 0 HG13 ILE A 956 36.967 -22.600 10.525 1.00 39.05 H new ATOM 0 HG21 ILE A 956 34.150 -24.471 9.179 1.00 40.53 H new ATOM 0 HG22 ILE A 956 35.005 -25.710 8.689 1.00 40.53 H new ATOM 0 HG23 ILE A 956 34.796 -25.456 10.238 1.00 40.53 H new ATOM 0 HD11 ILE A 956 35.028 -21.208 10.710 1.00 35.92 H new ATOM 0 HD12 ILE A 956 35.293 -21.504 9.176 1.00 35.92 H new ATOM 0 HD13 ILE A 956 34.162 -22.295 9.951 1.00 35.92 H new ATOM 4044 N TYR A 957 37.725 -26.328 7.650 1.00 41.20 N ANISOU 4044 N TYR A 957 4890 4201 6565 1451 -141 245 N ATOM 4045 CA TYR A 957 37.783 -27.547 6.847 1.00 42.77 C ANISOU 4045 CA TYR A 957 5095 4255 6902 1484 -88 188 C ATOM 4046 C TYR A 957 38.772 -28.543 7.458 1.00 50.11 C ANISOU 4046 C TYR A 957 5963 5108 7969 1584 -112 266 C ATOM 4047 O TYR A 957 38.434 -29.722 7.571 1.00 51.27 O ANISOU 4047 O TYR A 957 6130 5123 8229 1611 -103 306 O ATOM 4048 CB TYR A 957 38.205 -27.238 5.408 1.00 43.88 C ANISOU 4048 CB TYR A 957 5228 4400 7043 1474 -17 33 C ATOM 4049 CG TYR A 957 37.218 -26.414 4.608 1.00 44.21 C ANISOU 4049 CG TYR A 957 5338 4497 6963 1383 10 -53 C ATOM 4050 CD1 TYR A 957 35.918 -26.863 4.395 1.00 45.99 C ANISOU 4050 CD1 TYR A 957 5637 4652 7187 1327 10 -65 C ATOM 4051 CD2 TYR A 957 37.627 -25.269 3.931 1.00 44.01 C ANISOU 4051 CD2 TYR A 957 5298 4580 6846 1357 41 -130 C ATOM 4052 CE1 TYR A 957 35.030 -26.158 3.586 1.00 45.53 C ANISOU 4052 CE1 TYR A 957 5636 4636 7026 1250 27 -150 C ATOM 4053 CE2 TYR A 957 36.744 -24.548 3.129 1.00 44.39 C ANISOU 4053 CE2 TYR A 957 5410 4672 6785 1281 65 -207 C ATOM 4054 CZ TYR A 957 35.449 -25.004 2.953 1.00 52.66 C ANISOU 4054 CZ TYR A 957 6531 5653 7825 1229 54 -219 C ATOM 4055 OH TYR A 957 34.575 -24.315 2.158 1.00 58.10 O ANISOU 4055 OH TYR A 957 7279 6384 8412 1159 67 -293 O ATOM 0 H TYR A 957 37.904 -25.610 7.212 1.00 41.20 H new ATOM 0 HA TYR A 957 36.894 -27.936 6.838 1.00 42.77 H new ATOM 0 HB2 TYR A 957 39.054 -26.769 5.429 1.00 43.88 H new ATOM 0 HB3 TYR A 957 38.356 -28.076 4.944 1.00 43.88 H new ATOM 0 HD1 TYR A 957 35.636 -27.651 4.802 1.00 45.99 H new ATOM 0 HD2 TYR A 957 38.507 -24.979 4.015 1.00 44.01 H new ATOM 0 HE1 TYR A 957 34.159 -26.463 3.473 1.00 45.53 H new ATOM 0 HE2 TYR A 957 37.024 -23.764 2.714 1.00 44.39 H new ATOM 0 HH TYR A 957 34.959 -23.639 1.840 1.00 58.10 H new ATOM 4056 N AHIS A 958 39.974 -28.072 7.865 0.50 47.15 N ANISOU 4056 N AHIS A 958 5508 4809 7598 1639 -148 291 N ATOM 4057 N BHIS A 958 39.970 -28.070 7.866 0.50 46.99 N ANISOU 4057 N BHIS A 958 5488 4789 7577 1638 -148 291 N ATOM 4058 CA AHIS A 958 40.998 -28.917 8.478 0.50 48.47 C ANISOU 4058 CA AHIS A 958 5604 4915 7895 1740 -184 368 C ATOM 4059 CA BHIS A 958 40.999 -28.912 8.471 0.50 48.22 C ANISOU 4059 CA BHIS A 958 5574 4885 7864 1739 -184 367 C ATOM 4060 C AHIS A 958 40.519 -29.517 9.797 0.50 52.97 C ANISOU 4060 C AHIS A 958 6206 5454 8465 1766 -252 530 C ATOM 4061 C BHIS A 958 40.551 -29.507 9.805 0.50 52.86 C ANISOU 4061 C BHIS A 958 6190 5442 8452 1768 -253 531 C ATOM 4062 O AHIS A 958 40.638 -30.727 9.978 0.50 53.99 O ANISOU 4062 O AHIS A 958 6328 5456 8728 1825 -246 588 O ATOM 4063 O BHIS A 958 40.696 -30.711 9.992 0.50 53.90 O ANISOU 4063 O BHIS A 958 6313 5447 8718 1828 -248 588 O ATOM 4064 CB AHIS A 958 42.320 -28.158 8.679 0.50 49.50 C ANISOU 4064 CB AHIS A 958 5636 5144 8028 1784 -221 360 C ATOM 4065 CB BHIS A 958 42.327 -28.162 8.619 0.50 49.17 C ANISOU 4065 CB BHIS A 958 5593 5100 7988 1783 -217 354 C ATOM 4066 CG AHIS A 958 43.381 -28.997 9.325 0.50 54.62 C ANISOU 4066 CG AHIS A 958 6204 5733 8816 1891 -270 442 C ATOM 4067 CG BHIS A 958 43.481 -29.071 8.904 0.50 54.24 C ANISOU 4067 CG BHIS A 958 6150 5666 8794 1891 -239 401 C ATOM 4068 ND1AHIS A 958 43.510 -29.067 10.703 0.50 56.85 N ANISOU 4068 ND1AHIS A 958 6479 6053 9070 1934 -376 585 N ATOM 4069 ND1BHIS A 958 44.239 -29.613 7.882 0.50 56.78 N ANISOU 4069 ND1BHIS A 958 6417 5907 9250 1938 -159 306 N ATOM 4070 CD2AHIS A 958 44.295 -29.818 8.759 0.50 57.77 C ANISOU 4070 CD2AHIS A 958 6534 6034 9381 1966 -225 402 C ATOM 4071 CD2BHIS A 958 43.953 -29.524 10.089 0.50 57.11 C ANISOU 4071 CD2BHIS A 958 6476 6021 9201 1963 -330 534 C ATOM 4072 CE1AHIS A 958 44.505 -29.906 10.929 0.50 57.90 C ANISOU 4072 CE1AHIS A 958 6535 6112 9353 2031 -401 630 C ATOM 4073 CE1BHIS A 958 45.149 -30.371 8.474 0.50 57.78 C ANISOU 4073 CE1BHIS A 958 6467 5974 9512 2034 -204 384 C ATOM 4074 NE2AHIS A 958 45.010 -30.384 9.791 0.50 58.78 N ANISOU 4074 NE2AHIS A 958 6603 6138 9593 2054 -309 523 N ATOM 4075 NE2BHIS A 958 45.016 -30.349 9.802 0.50 58.35 N ANISOU 4075 NE2BHIS A 958 6548 6088 9533 2053 -312 524 N ATOM 0 H AHIS A 958 40.207 -27.248 7.787 0.50 46.99 H new ATOM 0 H BHIS A 958 40.199 -27.244 7.794 0.50 46.99 H new ATOM 0 HA AHIS A 958 41.164 -29.646 7.860 0.50 48.22 H new ATOM 0 HA BHIS A 958 41.143 -29.653 7.862 0.50 48.22 H new ATOM 0 HB2AHIS A 958 42.641 -27.844 7.819 0.50 49.17 H new ATOM 0 HB2BHIS A 958 42.505 -27.666 7.805 0.50 49.17 H new ATOM 0 HB3AHIS A 958 42.157 -27.373 9.225 0.50 49.17 H new ATOM 0 HB3BHIS A 958 42.248 -27.513 9.335 0.50 49.17 H new ATOM 0 HD2AHIS A 958 44.417 -29.971 7.850 0.50 57.11 H new ATOM 0 HD2BHIS A 958 43.623 -29.318 10.934 0.50 57.11 H new ATOM 0 HE1AHIS A 958 44.815 -30.135 11.776 0.50 57.78 H new ATOM 0 HE1BHIS A 958 45.799 -30.858 8.021 0.50 57.78 H new ATOM 0 HE2AHIS A 958 45.661 -30.941 9.716 0.50 58.35 H new ATOM 0 HE2BHIS A 958 45.503 -30.771 10.371 0.50 58.35 H new ATOM 4076 N ALA A 959 39.986 -28.677 10.711 1.00 48.90 N ANISOU 4076 N ALA A 959 5727 5052 7801 1727 -309 605 N ATOM 4077 CA ALA A 959 39.500 -29.096 12.034 1.00 49.27 C ANISOU 4077 CA ALA A 959 5815 5093 7812 1754 -367 768 C ATOM 4078 C ALA A 959 38.424 -30.179 11.952 1.00 55.78 C ANISOU 4078 C ALA A 959 6702 5779 8712 1734 -314 817 C ATOM 4079 O ALA A 959 38.492 -31.154 12.699 1.00 57.11 O ANISOU 4079 O ALA A 959 6872 5863 8963 1797 -335 943 O ATOM 4080 CB ALA A 959 38.972 -27.897 12.816 1.00 48.51 C ANISOU 4080 CB ALA A 959 5760 5145 7525 1705 -416 807 C ATOM 0 H AALA A 959 39.898 -27.833 10.570 0.50 48.90 H new ATOM 0 H BALA A 959 39.876 -27.837 10.562 0.50 48.90 H new ATOM 0 HA ALA A 959 40.260 -29.479 12.500 1.00 49.27 H new ATOM 0 HB1 ALA A 959 38.656 -28.191 13.685 1.00 48.51 H new ATOM 0 HB2 ALA A 959 39.684 -27.248 12.934 1.00 48.51 H new ATOM 0 HB3 ALA A 959 38.240 -27.489 12.327 1.00 48.51 H new ATOM 4081 N VAL A 960 37.463 -30.027 11.030 1.00 51.51 N ANISOU 4081 N VAL A 960 6208 5206 8155 1648 -250 718 N ATOM 4082 CA VAL A 960 36.361 -30.983 10.883 1.00 52.23 C ANISOU 4082 CA VAL A 960 6351 5161 8331 1615 -205 749 C ATOM 4083 C VAL A 960 36.818 -32.263 10.191 1.00 60.55 C ANISOU 4083 C VAL A 960 7376 6047 9582 1666 -168 702 C ATOM 4084 O VAL A 960 36.534 -33.350 10.697 1.00 61.74 O ANISOU 4084 O VAL A 960 7536 6073 9849 1700 -165 807 O ATOM 4085 CB VAL A 960 35.117 -30.348 10.211 1.00 53.76 C ANISOU 4085 CB VAL A 960 6602 5382 8441 1505 -166 662 C ATOM 4086 CG1 VAL A 960 34.033 -31.389 9.943 1.00 53.50 C ANISOU 4086 CG1 VAL A 960 6608 5192 8528 1469 -126 677 C ATOM 4087 CG2 VAL A 960 34.561 -29.201 11.053 1.00 51.91 C ANISOU 4087 CG2 VAL A 960 6400 5296 8027 1461 -198 729 C ATOM 0 H VAL A 960 37.434 -29.370 10.476 1.00 51.51 H new ATOM 0 HA VAL A 960 36.079 -31.235 11.776 1.00 52.23 H new ATOM 0 HB VAL A 960 35.403 -29.988 9.357 1.00 53.76 H new ATOM 0 HG11 VAL A 960 33.270 -30.961 9.523 1.00 53.50 H new ATOM 0 HG12 VAL A 960 34.382 -32.076 9.354 1.00 53.50 H new ATOM 0 HG13 VAL A 960 33.757 -31.792 10.781 1.00 53.50 H new ATOM 0 HG21 VAL A 960 33.785 -28.822 10.611 1.00 51.91 H new ATOM 0 HG22 VAL A 960 34.304 -29.536 11.927 1.00 51.91 H new ATOM 0 HG23 VAL A 960 35.240 -28.516 11.156 1.00 51.91 H new ATOM 4088 N GLU A 961 37.524 -32.132 9.047 1.00 59.17 N ANISOU 4088 N GLU A 961 7168 5867 9447 1676 -135 549 N ATOM 4089 CA GLU A 961 38.022 -33.253 8.248 1.00 61.65 C ANISOU 4089 CA GLU A 961 7456 6029 9940 1729 -91 475 C ATOM 4090 C GLU A 961 39.031 -34.151 8.967 1.00 69.23 C ANISOU 4090 C GLU A 961 8353 6916 11035 1839 -121 582 C ATOM 4091 O GLU A 961 39.149 -35.322 8.603 1.00 70.82 O ANISOU 4091 O GLU A 961 8545 6957 11407 1883 -90 566 O ATOM 4092 CB GLU A 961 38.598 -32.763 6.915 1.00 62.76 C ANISOU 4092 CB GLU A 961 7579 6204 10061 1721 -39 291 C ATOM 0 H GLU A 961 37.726 -31.365 8.714 1.00 59.17 H new ATOM 0 HA GLU A 961 37.245 -33.810 8.085 1.00 61.65 H new ATOM 4093 N SER A 962 39.764 -33.618 9.966 1.00 67.03 N ANISOU 4093 N SER A 962 8032 6749 10688 1887 -187 688 N ATOM 4094 CA SER A 962 40.761 -34.398 10.714 1.00 68.69 C ANISOU 4094 CA SER A 962 8179 6904 11017 1998 -233 800 C ATOM 4095 C SER A 962 40.197 -34.982 12.020 1.00 75.40 C ANISOU 4095 C SER A 962 9068 7716 11866 2023 -280 998 C ATOM 4096 O SER A 962 40.843 -35.831 12.646 1.00 77.50 O ANISOU 4096 O SER A 962 9295 7907 12246 2116 -315 1109 O ATOM 4097 CB SER A 962 42.036 -33.588 10.955 1.00 71.57 C ANISOU 4097 CB SER A 962 8461 7397 11335 2049 -286 789 C ATOM 4098 OG SER A 962 41.824 -32.442 11.764 1.00 77.58 O ANISOU 4098 OG SER A 962 9242 8321 11912 2011 -352 845 O ATOM 0 H SER A 962 39.694 -32.800 10.223 1.00 67.03 H new ATOM 0 HA SER A 962 40.997 -35.157 10.158 1.00 68.69 H new ATOM 0 HB2 SER A 962 42.699 -34.157 11.377 1.00 71.57 H new ATOM 0 HB3 SER A 962 42.403 -33.311 10.101 1.00 71.57 H new ATOM 0 HG SER A 962 41.458 -31.840 11.307 1.00 77.58 H new ATOM 4099 N CYS A 963 38.982 -34.550 12.411 1.00 71.34 N ANISOU 4099 N CYS A 963 8629 7248 11227 1943 -274 1047 N ATOM 4100 CA CYS A 963 38.286 -35.035 13.602 1.00109.27 C ANISOU 4100 CA CYS A 963 13481 12022 16014 1958 -296 1236 C ATOM 4101 C CYS A 963 37.487 -36.295 13.264 1.00144.88 C ANISOU 4101 C CYS A 963 18017 16333 20699 1942 -232 1260 C ATOM 4102 O CYS A 963 38.023 -37.400 13.296 1.00111.17 O ANISOU 4102 O CYS A 963 13713 11927 16602 2019 -231 1315 O ATOM 4103 CB CYS A 963 37.391 -33.945 14.184 1.00108.43 C ANISOU 4103 CB CYS A 963 13437 12060 15700 1884 -309 1275 C ATOM 4104 SG CYS A 963 36.553 -34.417 15.717 1.00113.36 S ANISOU 4104 SG CYS A 963 14127 12672 16272 1910 -321 1518 S ATOM 0 H CYS A 963 38.538 -33.955 11.977 1.00 71.34 H new ATOM 0 HA CYS A 963 38.941 -35.265 14.279 1.00109.27 H new ATOM 0 HB2 CYS A 963 37.927 -33.154 14.350 1.00108.43 H new ATOM 0 HB3 CYS A 963 36.724 -33.701 13.524 1.00108.43 H new ATOM 0 HG CYS A 963 35.877 -33.503 16.101 1.00113.36 H new TER 4105 CYS A 963 HETATM 4106 C1 6WJ A1001 32.122 -5.594 -1.223 1.00 40.17 C HETATM 4107 C2 6WJ A1001 30.953 -4.501 0.317 1.00 39.72 C HETATM 4108 C3 6WJ A1001 30.968 -3.514 -0.613 1.00 39.85 C HETATM 4109 C7 6WJ A1001 25.494 -2.534 -1.139 1.00 30.68 C HETATM 4110 C8 6WJ A1001 24.374 -2.487 -1.963 1.00 30.55 C HETATM 4111 C9 6WJ A1001 24.494 -2.124 -3.297 1.00 29.96 C HETATM 4112 C10 6WJ A1001 25.733 -1.857 -3.814 1.00 28.39 C HETATM 4113 C11 6WJ A1001 26.888 -1.926 -3.035 1.00 30.64 C HETATM 4114 C12 6WJ A1001 29.330 -1.733 -2.750 1.00 37.09 C HETATM 4115 C13 6WJ A1001 28.370 -1.271 -5.011 1.00 42.61 C HETATM 4116 C14 6WJ A1001 28.151 -2.423 -5.978 1.00 44.70 C HETATM 4117 C15 6WJ A1001 29.071 -3.588 -5.914 1.00 45.65 C HETATM 4118 C16 6WJ A1001 29.155 -2.646 -7.062 1.00 45.83 C HETATM 4119 C19 6WJ A1001 21.304 0.053 0.265 1.00 31.94 C HETATM 4120 C20 6WJ A1001 23.318 0.538 -1.332 1.00 29.81 C HETATM 4121 O3 6WJ A1001 22.250 -3.926 -2.022 1.00 30.49 O HETATM 4122 S1 6WJ A1001 22.785 -2.821 -1.294 1.00 32.20 S HETATM 4123 O2 6WJ A1001 22.903 -2.933 0.128 1.00 34.99 O HETATM 4124 N3 6WJ A1001 21.865 -1.517 -1.636 1.00 32.78 N HETATM 4125 C17 6WJ A1001 21.988 -0.150 -1.049 1.00 33.40 C HETATM 4126 C18 6WJ A1001 20.735 0.665 -0.988 1.00 32.63 C HETATM 4127 C6 6WJ A1001 26.745 -2.281 -1.668 1.00 31.07 C HETATM 4128 C5 6WJ A1001 27.915 -2.357 -0.781 1.00 34.54 C HETATM 4129 O 6WJ A1001 27.898 -2.631 0.396 1.00 34.86 O HETATM 4130 N2 6WJ A1001 28.199 -1.668 -3.545 1.00 38.24 N HETATM 4131 O1 6WJ A1001 30.428 -1.495 -3.182 1.00 44.34 O HETATM 4132 N1 6WJ A1001 29.148 -2.055 -1.381 1.00 36.48 N HETATM 4133 C4 6WJ A1001 30.334 -2.158 -0.533 1.00 39.52 C HETATM 4134 N 6WJ A1001 31.596 -5.689 -0.012 1.00 39.36 N HETATM 4135 S 6WJ A1001 31.821 -4.060 -1.984 1.00 39.49 S HETATM 4136 C 6WJ A1001 32.904 -6.641 -1.958 1.00 36.14 C HETATM 4161 S SO4 A1002 25.992 -28.902 20.268 1.00128.43 S HETATM 4162 O1 SO4 A1002 25.485 -30.058 19.517 1.00128.17 O HETATM 4163 O2 SO4 A1002 25.711 -27.700 19.521 1.00128.39 O HETATM 4164 O3 SO4 A1002 27.444 -29.005 20.464 1.00128.00 O HETATM 4165 O4 SO4 A1002 25.317 -28.824 21.564 1.00128.78 O HETATM 4166 S SO4 A1003 19.066 25.185 19.929 1.00 56.06 S HETATM 4167 O1 SO4 A1003 19.238 26.616 20.084 1.00 59.36 O HETATM 4168 O2 SO4 A1003 18.647 24.995 18.586 1.00 63.84 O HETATM 4169 O3 SO4 A1003 18.012 24.753 20.817 1.00 59.51 O HETATM 4170 O4 SO4 A1003 20.279 24.379 20.154 1.00 53.82 O HETATM 4171 S SO4 A1004 34.866 -15.777 27.093 1.00109.99 S HETATM 4172 O1 SO4 A1004 36.287 -16.028 26.809 1.00109.62 O HETATM 4173 O2 SO4 A1004 34.047 -16.521 26.129 1.00109.14 O HETATM 4174 O3 SO4 A1004 34.548 -16.237 28.445 1.00111.05 O HETATM 4175 O4 SO4 A1004 34.584 -14.336 27.004 1.00109.04 O HETATM 4176 S DMS A1005 -7.017 5.723 17.374 1.00 69.42 S HETATM 4177 O DMS A1005 -7.351 6.399 16.171 1.00 71.50 O HETATM 4178 C1 DMS A1005 -5.294 6.096 17.653 1.00 66.22 C HETATM 4179 C2 DMS A1005 -7.813 6.693 18.618 1.00 69.07 C HETATM 0 H23 DMS A1005 -7.158 6.981 19.273 1.00 69.07 H new HETATM 0 H22 DMS A1005 -8.224 7.471 18.209 1.00 69.07 H new HETATM 0 H21 DMS A1005 -8.495 6.161 19.056 1.00 69.07 H new HETATM 0 H13 DMS A1005 -5.130 6.177 18.606 1.00 66.22 H new HETATM 0 H12 DMS A1005 -4.745 5.383 17.290 1.00 66.22 H new HETATM 0 H11 DMS A1005 -5.069 6.931 17.215 1.00 66.22 H new HETATM 4180 S DMS A1006 17.014 32.247 17.701 1.00 75.25 S HETATM 4181 O DMS A1006 18.209 32.049 16.867 1.00 74.24 O HETATM 4182 C1 DMS A1006 17.664 32.166 19.343 1.00 77.08 C HETATM 4183 C2 DMS A1006 16.699 33.984 17.598 1.00 72.88 C HETATM 0 H23 DMS A1006 15.751 34.149 17.720 1.00 72.88 H new HETATM 0 H22 DMS A1006 17.199 34.445 18.290 1.00 72.88 H new HETATM 0 H21 DMS A1006 16.974 34.312 16.728 1.00 72.88 H new HETATM 0 H13 DMS A1006 17.241 31.437 19.823 1.00 77.08 H new HETATM 0 H12 DMS A1006 18.621 32.015 19.305 1.00 77.08 H new HETATM 0 H11 DMS A1006 17.487 33.001 19.803 1.00 77.08 H new HETATM 4184 S DMS A1007 25.362 11.899 13.815 1.00 76.48 S HETATM 4185 O DMS A1007 23.960 11.723 13.528 1.00 76.74 O HETATM 4186 C1 DMS A1007 25.504 11.786 15.583 1.00 76.16 C HETATM 4187 C2 DMS A1007 26.105 10.347 13.372 1.00 75.70 C HETATM 0 H23 DMS A1007 26.949 10.247 13.839 1.00 75.70 H new HETATM 0 H22 DMS A1007 25.511 9.621 13.620 1.00 75.70 H new HETATM 0 H21 DMS A1007 26.260 10.324 12.415 1.00 75.70 H new HETATM 0 H13 DMS A1007 26.410 12.007 15.850 1.00 76.16 H new HETATM 0 H12 DMS A1007 24.885 12.407 15.998 1.00 76.16 H new HETATM 0 H11 DMS A1007 25.294 10.883 15.868 1.00 76.16 H new HETATM 4188 O HOH A1101 6.697 10.778 3.470 1.00 27.26 O HETATM 4189 O HOH A1102 10.781 6.408 2.326 1.00 26.16 O HETATM 4190 O HOH A1103 13.149 15.619 24.834 1.00 42.65 O HETATM 4191 O HOH A1104 -0.902 6.468 20.739 1.00 39.21 O HETATM 4192 O HOH A1105 26.640 1.528 5.979 1.00 35.18 O HETATM 4193 O HOH A1106 9.156 -0.051 -0.206 1.00 41.96 O HETATM 4194 O HOH A1107 22.547 12.778 -10.886 1.00 40.60 O HETATM 4195 O HOH A1108 13.548 35.093 5.815 1.00 40.72 O HETATM 4196 O HOH A1109 25.278 -5.393 -6.370 1.00 38.04 O HETATM 4197 O HOH A1110 7.224 28.718 19.873 1.00 35.65 O HETATM 4198 O HOH A1111 25.473 -7.758 20.947 1.00 37.41 O HETATM 4199 O HOH A1112 10.882 -6.363 3.091 1.00 37.06 O HETATM 4200 O HOH A1113 0.250 9.224 4.792 1.00 34.18 O HETATM 4201 O HOH A1114 13.720 18.750 18.843 1.00 27.79 O HETATM 4202 O HOH A1115 21.829 -20.442 8.541 1.00 35.72 O HETATM 4203 O HOH A1116 -7.040 7.547 9.413 1.00 29.14 O HETATM 4204 O HOH A1117 9.224 16.826 24.416 1.00 39.45 O HETATM 4205 O HOH A1118 11.396 -15.904 -3.045 1.00 61.59 O HETATM 4206 O HOH A1119 -14.360 6.563 2.695 1.00 52.36 O HETATM 4207 O HOH A1120 12.805 -18.810 3.697 1.00 46.71 O HETATM 4208 O HOH A1121 10.626 -10.320 9.976 1.00 50.83 O HETATM 4209 O HOH A1122 8.696 -2.013 12.061 1.00 33.76 O HETATM 4210 O HOH A1123 2.528 3.704 1.243 1.00 50.25 O HETATM 4211 O HOH A1124 16.450 36.565 14.094 1.00 55.26 O HETATM 4212 O HOH A1125 1.957 9.911 22.122 1.00 50.59 O HETATM 4213 O HOH A1126 8.511 -18.062 -5.173 1.00 55.09 O HETATM 4214 O HOH A1127 -8.754 12.884 15.080 1.00 46.79 O HETATM 4215 O HOH A1128 13.242 25.752 16.911 1.00 31.77 O HETATM 4216 O HOH A1129 29.571 6.784 6.620 1.00 48.21 O HETATM 4217 O HOH A1130 -4.145 4.609 3.950 1.00 40.26 O HETATM 4218 O HOH A1131 21.733 3.384 24.131 1.00 50.50 O HETATM 4219 O HOH A1132 3.005 21.857 0.179 1.00 43.38 O HETATM 4220 O HOH A1133 20.911 11.947 25.341 1.00 44.28 O HETATM 4221 O HOH A1134 14.625 10.087 -2.687 1.00 28.44 O HETATM 4222 O HOH A1135 -6.078 -1.029 6.157 1.00 62.25 O HETATM 4223 O HOH A1136 3.931 2.722 3.705 1.00 21.73 O HETATM 4224 O HOH A1137 17.724 -23.469 12.699 1.00 47.60 O HETATM 4225 O HOH A1138 10.240 7.898 25.542 1.00 46.35 O HETATM 4226 O HOH A1139 -1.708 12.024 7.890 1.00 34.04 O HETATM 4227 O HOH A1140 3.489 10.889 -3.049 1.00 54.83 O HETATM 4228 O HOH A1141 32.860 -5.062 -5.706 1.00 57.87 O HETATM 4229 O HOH A1142 1.241 25.744 5.679 1.00 41.39 O HETATM 4230 O HOH A1143 6.441 15.291 21.049 1.00 38.61 O HETATM 4231 O HOH A1144 25.535 -0.787 19.454 1.00 49.54 O HETATM 4232 O HOH A1145 31.143 -29.724 18.861 1.00 63.66 O HETATM 4233 O HOH A1146 23.155 18.130 9.880 1.00 42.23 O HETATM 4234 O HOH A1147 6.157 12.235 29.883 1.00 56.28 O HETATM 4235 O HOH A1148 28.660 -0.130 16.113 1.00 42.71 O HETATM 4236 O HOH A1149 1.127 16.655 -0.411 1.00 57.50 O HETATM 4237 O HOH A1150 -5.294 -6.025 10.951 1.00 58.51 O HETATM 4238 O HOH A1151 22.841 7.786 -12.701 1.00 49.39 O HETATM 4239 O HOH A1152 -5.453 17.707 12.785 1.00 37.37 O HETATM 4240 O HOH A1153 29.865 28.873 -2.710 1.00 50.53 O HETATM 4241 O HOH A1154 18.562 32.041 -8.470 1.00 62.31 O HETATM 4242 O HOH A1155 2.165 13.064 15.851 1.00 32.15 O HETATM 4243 O HOH A1156 27.151 -2.029 10.460 1.00 37.15 O HETATM 4244 O HOH A1157 14.041 21.606 -9.695 1.00 62.22 O HETATM 4245 O HOH A1158 27.148 6.398 -11.016 1.00 44.90 O HETATM 4246 O HOH A1159 14.724 -25.197 13.989 1.00 65.64 O HETATM 4247 O HOH A1160 2.883 16.881 19.665 1.00 39.13 O HETATM 4248 O HOH A1161 24.739 18.537 13.090 1.00 61.44 O HETATM 4249 O HOH A1162 29.706 22.626 -3.187 1.00 59.21 O HETATM 4250 O HOH A1163 -1.554 -7.867 5.916 1.00 51.08 O HETATM 4251 O HOH A1164 10.736 -0.119 5.586 1.00 23.39 O HETATM 4252 O HOH A1165 17.668 1.686 -11.022 1.00 59.22 O HETATM 4253 O HOH A1166 7.231 36.802 6.544 1.00 57.65 O HETATM 4254 O HOH A1167 27.702 16.820 23.606 1.00 80.61 O HETATM 4255 O HOH A1168 12.557 -3.370 -1.443 1.00 38.59 O HETATM 4256 O HOH A1169 26.341 21.099 -4.060 1.00 44.94 O HETATM 4257 O HOH A1170 25.175 22.620 14.841 1.00 36.32 O HETATM 4258 O HOH A1171 -0.105 19.815 -2.345 1.00 66.62 O HETATM 4259 O HOH A1172 21.470 27.744 -11.448 1.00 40.43 O HETATM 4260 O HOH A1173 36.262 -12.102 -6.434 1.00 53.07 O HETATM 4261 O HOH A1174 5.932 -2.683 20.194 1.00 53.93 O HETATM 4262 O HOH A1175 22.177 20.472 13.786 1.00 39.05 O HETATM 4263 O HOH A1176 20.506 18.018 14.373 1.00 33.04 O HETATM 4264 O HOH A1177 6.567 20.535 30.031 1.00 64.12 O HETATM 4265 O HOH A1178 29.186 13.550 0.984 1.00 47.50 O HETATM 4266 O HOH A1179 19.614 35.744 8.919 1.00 44.72 O HETATM 4267 O HOH A1180 10.200 -4.108 20.574 1.00 43.44 O HETATM 4268 O HOH A1181 33.468 -10.254 15.597 1.00 38.73 O HETATM 4269 O HOH A1182 32.725 -28.300 16.774 1.00 49.30 O HETATM 4270 O HOH A1183 32.480 3.291 -5.591 1.00 48.45 O HETATM 4271 O HOH A1184 30.518 3.004 -9.811 1.00 49.07 O HETATM 4272 O HOH A1185 24.341 16.631 -9.921 1.00 69.04 O HETATM 4273 O HOH A1186 7.585 5.750 -5.001 1.00 29.34 O HETATM 4274 O HOH A1187 29.547 24.179 8.830 1.00 53.33 O HETATM 4275 O HOH A1188 7.513 -3.725 13.836 1.00 48.92 O HETATM 4276 O HOH A1189 13.935 16.203 19.596 1.00 39.49 O HETATM 4277 O HOH A1190 27.609 -17.959 24.419 1.00 77.04 O HETATM 4278 O HOH A1191 17.695 -18.501 -7.826 1.00 39.08 O HETATM 4279 O HOH A1192 28.913 17.424 5.482 1.00 54.14 O HETATM 4280 O HOH A1193 17.327 -25.962 -0.945 1.00 56.72 O HETATM 4281 O HOH A1194 -3.410 0.257 -0.413 1.00 59.61 O HETATM 4282 O HOH A1195 29.117 -25.290 -8.402 1.00 79.50 O HETATM 4283 O HOH A1196 20.807 0.226 4.162 1.00 43.84 O HETATM 4284 O HOH A1197 22.277 -20.174 5.864 1.00 41.91 O HETATM 4285 O HOH A1198 20.604 -27.978 7.554 1.00 58.49 O HETATM 4286 O HOH A1199 37.396 -12.694 4.239 1.00 47.27 O HETATM 4287 O HOH A1200 7.920 30.432 1.438 1.00 52.12 O HETATM 4288 O HOH A1201 27.058 -6.846 -7.972 1.00 43.29 O HETATM 4289 O HOH A1202 -1.022 12.845 15.327 1.00 36.94 O HETATM 4290 O HOH A1203 9.923 -9.611 6.116 1.00 61.78 O HETATM 4291 O HOH A1204 27.987 29.778 3.992 1.00 43.44 O HETATM 4292 O HOH A1205 12.708 19.152 29.180 1.00 58.87 O HETATM 4293 O HOH A1206 6.972 19.400 21.946 1.00 43.39 O HETATM 4294 O HOH A1207 16.448 9.502 26.023 1.00 51.25 O HETATM 4295 O HOH A1208 -2.863 11.675 -2.298 1.00 47.20 O HETATM 4296 O HOH A1209 2.521 23.915 22.760 1.00 51.49 O HETATM 4297 O HOH A1210 17.035 24.624 15.329 1.00 45.54 O HETATM 4298 O HOH A1211 14.870 35.203 3.544 1.00 42.79 O HETATM 4299 O HOH A1212 28.507 2.171 14.708 1.00 34.71 O HETATM 4300 O HOH A1213 30.589 18.781 1.246 1.00 51.18 O HETATM 4301 O HOH A1214 33.434 -9.518 12.808 1.00 46.78 O HETATM 4302 O HOH A1215 19.018 -1.698 3.401 1.00 40.00 O HETATM 4303 O HOH A1216 -8.525 8.719 6.299 1.00 38.74 O HETATM 4304 O HOH A1217 -10.867 10.846 3.251 1.00 34.13 O HETATM 4305 O HOH A1218 25.659 33.407 -1.405 1.00 36.51 O HETATM 4306 O HOH A1219 26.659 -25.691 -7.258 1.00 64.55 O HETATM 4307 O HOH A1220 7.133 -3.736 25.135 1.00 56.32 O HETATM 4308 O HOH A1221 5.456 30.507 22.543 1.00 59.60 O HETATM 4309 O HOH A1222 1.980 31.170 15.503 1.00 66.49 O HETATM 4310 O HOH A1223 37.338 -12.506 -1.716 1.00 52.64 O HETATM 4311 O HOH A1224 -6.694 6.343 5.472 1.00 38.35 O HETATM 4312 O HOH A1225 38.818 -15.365 7.007 1.00 53.99 O HETATM 4313 O HOH A1226 11.167 25.973 -14.389 1.00 56.02 O HETATM 4314 O HOH A1227 31.851 14.677 11.125 1.00 87.91 O HETATM 4315 O HOH A1228 19.777 -14.280 -7.500 1.00 56.12 O HETATM 4316 O HOH A1229 13.175 -17.918 6.219 1.00 43.37 O HETATM 4317 O HOH A1230 20.799 15.462 17.986 1.00 54.00 O HETATM 4318 O HOH A1231 21.081 -23.933 0.954 1.00 33.65 O HETATM 4319 O HOH A1232 33.799 11.601 -6.307 1.00 73.75 O HETATM 4320 O HOH A1233 27.428 31.139 -6.851 1.00 33.41 O HETATM 4321 O HOH A1234 11.672 37.677 8.607 1.00 62.17 O HETATM 4322 O HOH A1235 20.106 5.962 16.888 1.00 32.49 O HETATM 4323 O HOH A1236 29.823 12.519 8.596 1.00 66.48 O HETATM 4324 O HOH A1237 31.288 0.335 1.970 1.00 47.65 O HETATM 4325 O HOH A1238 16.629 0.428 -6.827 1.00 56.33 O HETATM 4326 O HOH A1239 38.639 -17.745 5.597 1.00 38.68 O HETATM 4327 O HOH A1240 5.465 16.938 30.032 1.00 53.56 O HETATM 4328 O HOH A1241 4.649 17.262 21.636 1.00 36.41 O HETATM 4329 O HOH A1242 20.832 27.121 -17.527 1.00 56.99 O HETATM 4330 O HOH A1243 -8.543 11.852 4.174 1.00 46.87 O HETATM 4331 O HOH A1244 7.137 -6.650 -1.197 1.00 51.59 O HETATM 4332 O HOH A1245 9.660 -7.727 16.630 1.00 59.96 O HETATM 4333 O HOH A1246 13.140 11.310 -12.846 1.00 46.99 O HETATM 4334 O HOH A1247 25.403 -15.025 24.389 1.00 62.49 O HETATM 4335 O HOH A1248 4.540 -6.301 11.539 1.00 62.88 O HETATM 4336 O HOH A1249 14.732 -11.121 25.987 1.00 62.64 O HETATM 4337 O HOH A1250 23.668 -0.934 -6.431 1.00 46.99 O HETATM 4338 O HOH A1251 -3.994 21.323 15.702 1.00 56.85 O HETATM 4339 O HOH A1252 7.792 -10.199 17.366 1.00 65.60 O HETATM 4340 O AHOH A1253 17.018 12.369 26.432 0.50 47.79 O HETATM 4341 O HOH A1254 30.956 7.646 3.135 1.00 61.07 O HETATM 4342 O HOH A1255 14.712 -1.298 -6.033 1.00 55.87 O HETATM 4343 O HOH A1256 25.368 -8.732 -5.033 1.00 31.86 O HETATM 4344 O HOH A1257 11.537 -19.174 -11.866 1.00 46.25 O HETATM 4345 O HOH A1258 36.405 -12.941 25.057 1.00 48.88 O HETATM 4346 O HOH A1259 51.190 -17.592 7.195 1.00 61.72 O HETATM 4347 O HOH A1260 25.970 2.472 22.210 1.00 59.03 O HETATM 4348 O HOH A1261 8.839 27.318 -12.119 1.00 69.39 O HETATM 4349 O HOH A1262 8.542 -7.444 11.997 1.00 57.87 O HETATM 4350 O HOH A1263 2.809 7.581 23.151 1.00 54.04 O HETATM 4351 O HOH A1264 4.905 -4.218 13.244 1.00 47.48 O HETATM 4352 O HOH A1265 20.187 30.190 18.026 1.00 47.12 O HETATM 4353 O HOH A1266 7.253 0.896 26.006 1.00 49.22 O HETATM 4354 O HOH A1267 36.025 -36.120 9.786 1.00 63.98 O HETATM 4355 O HOH A1268 20.358 35.443 11.511 1.00 57.84 O HETATM 4356 O HOH A1269 26.454 23.065 9.065 1.00 45.75 O HETATM 4357 O HOH A1270 4.586 34.957 13.215 1.00 52.74 O HETATM 4358 O HOH A1271 4.927 -6.274 -2.740 1.00 47.00 O HETATM 4359 O HOH A1272 45.345 -4.723 12.131 1.00 66.49 O HETATM 4360 O HOH A1273 0.857 27.247 13.781 1.00 54.18 O HETATM 4361 O HOH A1274 20.453 -20.715 25.189 1.00 60.32 O HETATM 4362 O HOH A1275 13.622 37.681 -2.147 1.00 81.56 O HETATM 4363 O HOH A1276 21.549 19.373 -13.058 1.00 68.99 O HETATM 4364 O HOH A1277 -6.980 15.443 12.820 1.00 46.49 O HETATM 4365 O HOH A1278 12.402 -13.573 26.899 1.00 75.73 O HETATM 4366 O HOH A1279 -2.964 3.629 1.392 1.00 50.27 O HETATM 4367 O HOH A1280 -2.780 -2.145 26.042 1.00 66.84 O HETATM 4368 O HOH A1281 28.096 23.476 21.818 1.00 51.14 O HETATM 4369 O HOH A1282 11.630 -7.909 23.428 1.00 62.63 O HETATM 4370 O HOH A1283 24.151 -24.247 -6.502 1.00 50.66 O HETATM 4371 O HOH A1284 -9.284 -0.026 2.958 1.00 55.04 O HETATM 4372 O HOH A1285 25.892 1.138 -10.486 1.00 47.38 O HETATM 4373 O HOH A1286 40.990 -15.348 8.754 1.00 54.19 O HETATM 4374 O HOH A1287 15.501 -4.111 27.593 1.00 74.47 O HETATM 4375 O HOH A1288 10.074 3.403 -11.479 1.00 54.13 O HETATM 4376 O HOH A1289 14.066 9.342 27.305 1.00 51.09 O HETATM 4377 O HOH A1290 18.411 2.119 -8.027 1.00 38.82 O HETATM 4378 O HOH A1291 19.849 12.118 -14.028 1.00 65.52 O HETATM 4379 O HOH A1292 11.902 -0.089 -0.742 1.00 40.65 O HETATM 4380 O HOH A1293 29.725 29.608 -0.155 1.00 51.05 O HETATM 4381 O HOH A1294 22.353 -29.860 8.560 1.00 48.76 O HETATM 4382 O HOH A1295 9.980 -0.909 -5.137 1.00 62.66 O HETATM 4383 O HOH A1296 20.399 -26.253 5.267 1.00 68.77 O HETATM 4384 O HOH A1297 -7.986 16.949 20.229 1.00 60.47 O HETATM 4385 O HOH A1298 -12.621 3.424 7.486 1.00 78.34 O HETATM 4386 O HOH A1299 17.568 25.758 -18.098 1.00 61.91 O HETATM 4387 O HOH A1300 5.501 19.324 -9.570 1.00 70.91 O HETATM 4388 O HOH A1301 3.680 8.200 -2.638 1.00 75.46 O HETATM 4389 O HOH A1302 27.726 3.806 7.003 1.00 50.80 O HETATM 4390 O HOH A1303 23.925 -35.120 4.757 1.00 71.49 O HETATM 4391 O HOH A1304 -9.472 13.877 19.139 1.00 69.47 O HETATM 4392 O HOH A1305 -4.281 -2.791 1.453 1.00 64.43 O HETATM 4393 O HOH A1306 19.939 -18.959 -13.421 1.00 63.19 O HETATM 4394 O HOH A1307 24.792 -6.671 -10.106 1.00 62.24 O HETATM 4395 O HOH A1308 4.628 19.177 28.729 1.00 55.87 O HETATM 4396 O HOH A1309 5.095 -13.604 -3.929 1.00 67.93 O HETATM 4397 O HOH A1310 3.824 27.243 -4.764 1.00 73.52 O HETATM 4398 O HOH A1311 6.969 -11.650 22.319 1.00 67.00 O HETATM 4399 O HOH A1312 15.985 11.583 -14.755 1.00 61.48 O HETATM 4400 O HOH A1313 -12.700 13.998 14.250 1.00 53.05 O HETATM 4401 O HOH A1314 37.381 -9.543 3.975 1.00 47.75 O HETATM 4402 O HOH A1315 5.335 29.138 1.056 1.00 56.22 O HETATM 4403 O HOH A1316 30.715 -19.689 -9.483 1.00 56.66 O HETATM 4404 O HOH A1317 -1.505 20.789 24.696 1.00 63.41 O HETATM 4405 O HOH A1318 14.335 23.972 27.441 1.00 54.91 O HETATM 4406 O HOH A1319 -6.403 -2.639 11.631 1.00 44.18 O HETATM 4407 O HOH A1320 10.424 33.036 -6.262 1.00 59.72 O HETATM 4408 O HOH A1321 -3.501 7.121 20.221 1.00 51.84 O HETATM 4409 O HOH A1322 42.141 -2.862 10.761 1.00 76.57 O HETATM 4410 O HOH A1323 14.921 37.447 27.878 1.00 89.05 O HETATM 4411 O HOH A1324 22.439 -32.859 5.084 1.00 65.08 O HETATM 4412 O HOH A1325 -0.120 4.986 22.866 1.00 49.47 O HETATM 4413 O HOH A1326 21.006 19.979 26.560 1.00 75.17 O HETATM 4414 O HOH A1327 1.144 -1.270 -5.542 1.00 81.45 O HETATM 4415 O HOH A1328 -1.178 -3.066 17.635 1.00 52.22 O HETATM 4416 O HOH A1329 -8.041 6.372 -3.786 1.00 60.54 O HETATM 4417 O HOH A1330 29.234 -9.837 24.188 1.00 58.66 O HETATM 4418 O HOH A1331 32.929 -1.782 2.436 1.00 62.67 O HETATM 4419 O HOH A1332 19.778 -25.340 23.408 1.00 67.92 O HETATM 4420 O HOH A1333 -0.799 -0.720 -3.716 1.00 77.72 O HETATM 4421 O HOH A1334 37.752 -20.240 1.648 1.00 61.68 O HETATM 4422 O HOH A1335 0.809 24.954 17.984 1.00 50.00 O HETATM 4423 O HOH A1336 3.363 12.200 13.657 1.00 50.66 O HETATM 4424 O HOH A1337 33.686 13.762 0.522 1.00 67.76 O HETATM 4425 O HOH A1338 -14.192 11.943 12.389 1.00 67.00 O HETATM 4426 O HOH A1339 18.352 1.730 -15.998 1.00 74.33 O HETATM 4427 O HOH A1340 -0.588 26.116 -2.685 1.00 59.93 O HETATM 4428 O HOH A1341 7.401 -10.104 -3.077 1.00 68.93 O HETATM 4429 O HOH A1342 22.430 -13.086 27.787 1.00 71.90 O HETATM 4430 O HOH A1343 40.324 -14.683 3.149 1.00 65.87 O HETATM 4431 O HOH A1344 24.042 -4.362 26.433 1.00 63.90 O HETATM 4432 O HOH A1345 34.926 -7.279 -6.300 1.00 67.51 O HETATM 4433 O HOH A1346 3.922 -3.456 16.922 1.00 68.09 O HETATM 4434 O HOH A1347 28.558 -0.114 4.577 1.00 46.79 O HETATM 4435 O HOH A1348 0.961 -8.892 5.908 1.00 61.32 O HETATM 4436 O HOH A1349 32.362 15.061 -10.414 1.00 69.00 O HETATM 4437 O HOH A1350 27.147 -12.075 25.973 1.00 77.07 O HETATM 4438 O HOH A1351 28.765 8.627 10.896 1.00 58.74 O HETATM 4439 O HOH A1352 30.157 0.742 19.886 1.00 66.63 O HETATM 4440 O HOH A1353 27.407 15.277 26.772 1.00 81.66 O HETATM 4441 O HOH A1354 13.784 1.831 29.699 1.00 68.49 O HETATM 4442 O HOH A1355 31.389 29.321 8.241 1.00 71.47 O HETATM 4443 O HOH A1356 35.182 15.224 -7.875 1.00 54.05 O HETATM 4444 O HOH A1357 31.440 9.268 0.791 1.00 67.30 O HETATM 4445 O HOH A1358 22.896 0.266 -9.667 1.00 58.14 O HETATM 4446 O HOH A1359 8.251 -7.687 4.064 1.00 64.10 O HETATM 4447 O HOH A1360 16.233 37.513 4.070 1.00 67.25 O HETATM 4448 O HOH A1361 6.390 -6.290 5.484 1.00 51.01 O HETATM 4449 O HOH A1362 22.632 -26.376 -2.585 1.00 59.65 O HETATM 4450 O HOH A1363 39.734 -18.090 3.198 1.00 57.62 O HETATM 4451 O HOH A1364 27.430 17.567 -9.705 1.00 54.43 O HETATM 4452 O HOH A1365 28.912 -35.819 3.421 1.00 70.41 O HETATM 4453 O HOH A1366 12.737 38.829 15.064 1.00 66.26 O HETATM 4454 O HOH A1367 18.301 -16.129 -8.993 1.00 50.25 O HETATM 4455 O HOH A1368 27.846 24.997 19.557 1.00 65.14 O HETATM 4456 O HOH A1369 22.801 36.674 12.026 1.00 77.59 O HETATM 4457 O HOH A1370 29.346 -0.492 8.540 1.00 51.26 O HETATM 4458 O HOH A1371 -4.138 26.880 22.958 1.00 76.74 O HETATM 4459 O HOH A1372 35.472 16.585 -5.515 1.00 44.13 O HETATM 4460 O HOH A1373 16.139 -25.361 6.639 1.00 63.15 O HETATM 4461 O HOH A1374 31.443 0.649 -6.509 1.00 66.90 O HETATM 4462 O HOH A1375 29.321 -5.549 -9.370 1.00 58.35 O HETATM 4463 O HOH A1376 43.669 -10.170 19.871 1.00 69.61 O HETATM 4464 O HOH A1377 21.013 14.148 -12.613 1.00 60.67 O HETATM 4465 O HOH A1378 7.667 -9.861 11.154 1.00 58.04 O HETATM 4466 O HOH A1379 19.622 40.495 23.549 1.00 73.34 O HETATM 4467 O HOH A1380 5.322 32.875 0.547 1.00 72.74 O HETATM 4468 O HOH A1381 8.416 -6.289 14.409 1.00 43.67 O HETATM 4469 O HOH A1382 26.194 8.158 23.631 1.00 60.91 O HETATM 4470 O HOH A1383 20.645 -26.061 2.494 1.00 48.68 O HETATM 4471 O HOH A1384 7.619 7.118 26.962 1.00 70.54 O HETATM 4472 O HOH A1385 1.311 11.268 24.387 1.00 58.79 O HETATM 4473 O HOH A1386 31.752 -4.351 -8.738 1.00 62.02 O HETATM 4474 O HOH A1387 18.689 37.564 12.940 1.00 56.40 O HETATM 4475 O HOH A1388 24.588 -3.148 -7.667 1.00 46.26 O HETATM 4476 O HOH A1389 11.100 0.518 29.637 1.00 77.22 O HETATM 4477 O HOH A1390 29.597 -6.790 24.445 1.00 75.93 O HETATM 4478 O HOH A1391 -14.536 12.004 17.620 1.00 80.50 O HETATM 4479 O HOH A1392 31.987 -5.887 23.386 1.00 53.88 O HETATM 4480 O HOH A1393 25.156 6.519 25.573 1.00 62.12 O HETATM 4481 O HOH A1394 33.592 2.972 0.427 1.00 65.46 O HETATM 4482 O HOH A1395 33.585 0.215 0.423 1.00 81.33 O HETATM 4483 O HOH A1396 33.068 -31.419 14.425 1.00 70.64 O HETATM 4484 O HOH A1397 -5.647 6.300 22.179 1.00 55.37 O HETATM 4485 O HOH A1398 15.847 49.145 25.754 1.00 74.63 O HETATM 4486 O HOH A1399 39.221 -4.009 -4.240 1.00 69.87 O HETATM 4487 O HOH A1400 13.938 -33.356 7.550 1.00 64.86 O CONECT 1833 1842 CONECT 1842 1833 1843 CONECT 1843 1842 1844 1846 CONECT 1844 1843 1845 CONECT 1845 1844 1855 CONECT 1846 1843 1847 1856 CONECT 1847 1846 CONECT 1848 1849 CONECT 1849 1848 1850 CONECT 1850 1849 1851 1852 CONECT 1851 1850 CONECT 1852 1850 1853 1854 CONECT 1853 1852 CONECT 1854 1852 1855 CONECT 1855 1845 1854 CONECT 1856 1846 CONECT 4106 4134 4135 4136 CONECT 4107 4108 4134 4137 CONECT 4108 4107 4133 4135 CONECT 4109 4110 4127 4138 CONECT 4110 4109 4111 4122 CONECT 4111 4110 4112 4139 CONECT 4112 4111 4113 4140 CONECT 4113 4112 4127 4130 CONECT 4114 4130 4131 4132 CONECT 4115 4116 4130 4141 4142 CONECT 4116 4115 4117 4118 4143 CONECT 4117 4116 4118 4144 4145 CONECT 4118 4116 4117 4146 4147 CONECT 4119 4125 4126 4148 4149 CONECT 4120 4125 4150 4151 4152 CONECT 4121 4122 CONECT 4122 4110 4121 4123 4124 CONECT 4123 4122 CONECT 4124 4122 4125 4153 CONECT 4125 4119 4120 4124 4126 CONECT 4126 4119 4125 4154 4155 CONECT 4127 4109 4113 4128 CONECT 4128 4127 4129 4132 CONECT 4129 4128 CONECT 4130 4113 4114 4115 CONECT 4131 4114 CONECT 4132 4114 4128 4133 CONECT 4133 4108 4132 4156 4157 CONECT 4134 4106 4107 CONECT 4135 4106 4108 CONECT 4136 4106 4158 4159 4160 CONECT 4137 4107 CONECT 4138 4109 CONECT 4139 4111 CONECT 4140 4112 CONECT 4141 4115 CONECT 4142 4115 CONECT 4143 4116 CONECT 4144 4117 CONECT 4145 4117 CONECT 4146 4118 CONECT 4147 4118 CONECT 4148 4119 CONECT 4149 4119 CONECT 4150 4120 CONECT 4151 4120 CONECT 4152 4120 CONECT 4153 4124 CONECT 4154 4126 CONECT 4155 4126 CONECT 4156 4133 CONECT 4157 4133 CONECT 4158 4136 CONECT 4159 4136 CONECT 4160 4136 CONECT 4161 4162 4163 4164 4165 CONECT 4162 4161 CONECT 4163 4161 CONECT 4164 4161 CONECT 4165 4161 CONECT 4166 4167 4168 4169 4170 CONECT 4167 4166 CONECT 4168 4166 CONECT 4169 4166 CONECT 4170 4166 CONECT 4171 4172 4173 4174 4175 CONECT 4172 4171 CONECT 4173 4171 CONECT 4174 4171 CONECT 4175 4171 CONECT 4176 4177 4178 4179 CONECT 4177 4176 CONECT 4178 4176 CONECT 4179 4176 CONECT 4180 4181 4182 4183 CONECT 4181 4180 CONECT 4182 4180 CONECT 4183 4180 CONECT 4184 4185 4186 4187 CONECT 4185 4184 CONECT 4186 4184 CONECT 4187 4184 END