USER MOD reduce.3.24.130724 H: found=0, std=0, add=4083, rem=0, adj=140 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER TRANSCRIPTION 12-FEB-09 3G8O TITLE PROGESTERONE RECEPTOR WITH BOUND PYRROLIDINE 1 COMPND MOL_ID: 1; COMPND 2 MOLECULE: PROGESTERONE RECEPTOR; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: LIGAND BINDING DOMAIN; COMPND 5 SYNONYM: PR, NUCLEAR RECEPTOR SUBFAMILY 3 GROUP C MEMBER 3; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: NR3C3, PGR; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 0 EXPRESSION_SYSTEM_PLASMID: PHIS GST KEYWDS PROGESTERONE RECEPTOR, STEROID HORMONE RECEPTOR, NUCLEAR RECEPTOR, KEYWDS 2 PR, PROGESTERONE, ALPHA HELICAL SANDWICH, DNA-BINDING, LIPID- KEYWDS 3 BINDING, METAL-BINDING, NUCLEUS, PHOSPHOPROTEIN, RECEPTOR, STEROID- KEYWDS 4 BINDING, TRANSCRIPTION, TRANSCRIPTION REGULATION, ZINC-FINGER EXPDTA X-RAY DIFFRACTION AUTHOR S.K.THOMPSON,D.G.WASHBURN,K.P.MADAUSS,S.P.WILLIAMS,E.L.STEWART REVDAT 2 11-APR-12 3G8O 1 SPRSDE TITLE REMARK VERSN REVDAT 1 16-FEB-10 3G8O 0 SPRSDE 11-APR-12 3G8O 3G8N JRNL AUTH S.K.THOMPSON,D.G.WASHBURN,J.S.FRAZEE,K.P.MADAUSS,T.H.HOANG, JRNL AUTH 2 L.LAPINSKI,E.T.GRYGIELKO,L.E.GLACE,W.TRIZNA,S.P.WILLIAMS, JRNL AUTH 3 C.DURAISWAMI,J.D.BRAY,N.J.LAPING JRNL TITL RATIONAL DESIGN OF ORALLY-ACTIVE, PYRROLIDINE-BASED JRNL TITL 2 PROGESTERONE RECEPTOR PARTIAL AGONISTS. JRNL REF BIOORG.MED.CHEM.LETT. V. 19 4777 2009 JRNL REFN ISSN 0960-894X JRNL PMID 19595590 JRNL DOI 10.1016/J.BMCL.2009.06.055 REMARK 2 REMARK 2 RESOLUTION. 1.90 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- REMARK 3 : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES,PANNU, REMARK 3 : READ,RICE,SIMONSON,WARREN REMARK 3 REMARK 3 REFINEMENT TARGET : ENGH & HUBER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.90 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 20.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 95.4 REMARK 3 NUMBER OF REFLECTIONS : 38617 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING SET) : 0.204 REMARK 3 FREE R VALUE : 0.241 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 6.600 REMARK 3 FREE R VALUE TEST SET COUNT : 2688 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 (A) : NULL REMARK 3 BIN RESOLUTION RANGE LOW (A) : NULL REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 REFLECTIONS IN BIN (WORKING SET) : NULL REMARK 3 BIN R VALUE (WORKING SET) : NULL REMARK 3 BIN FREE R VALUE : NULL REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 BIN FREE R VALUE TEST SET COUNT : NULL 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 : 3976 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 55 REMARK 3 SOLVENT ATOMS : 352 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 25.96 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.22400 REMARK 3 B22 (A**2) : -0.12700 REMARK 3 B33 (A**2) : -0.09700 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : -0.00900 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM SIGMAA (A) : NULL REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM C-V SIGMAA (A) : NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.006 REMARK 3 BOND ANGLES (DEGREES) : NULL REMARK 3 DIHEDRAL ANGLES (DEGREES) : NULL REMARK 3 IMPROPER ANGLES (DEGREES) : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : NULL REMARK 3 KSOL : NULL REMARK 3 BSOL : NULL REMARK 3 REMARK 3 NCS MODEL : NULL REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : PROTEIN_REP.PARAM REMARK 3 PARAMETER FILE 2 : DNA-RNA_REP.PARAM REMARK 3 PARAMETER FILE 3 : WATER_REP.PARAM REMARK 3 PARAMETER FILE 4 : ION.PARAM REMARK 3 PARAMETER FILE 5 : 309.PAR REMARK 3 PARAMETER FILE 6 : NULL REMARK 3 TOPOLOGY FILE 1 : NULL REMARK 3 TOPOLOGY FILE 2 : NULL REMARK 3 TOPOLOGY FILE 3 : NULL REMARK 3 TOPOLOGY FILE 4 : NULL REMARK 3 TOPOLOGY FILE 5 : NULL REMARK 3 TOPOLOGY FILE 6 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 3G8O COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 06-MAR-09. REMARK 100 THE RCSB ID CODE IS RCSB051562. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 01-NOV-04 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.0 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 17-ID REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.0 REMARK 200 MONOCHROMATOR : SI(111) REMARK 200 OPTICS : QUANTUM 210 REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 38672 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.900 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 95.4 REMARK 200 DATA REDUNDANCY : 3.500 REMARK 200 R MERGE (I) : 0.07600 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 13.2430 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.90 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.97 REMARK 200 COMPLETENESS FOR SHELL (%) : 73.2 REMARK 200 DATA REDUNDANCY IN SHELL : 2.60 REMARK 200 R MERGE FOR SHELL (I) : 0.42100 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: AMORE REMARK 200 STARTING MODEL: PDB ENTRY 1A28 REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 42.62 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.14 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.1M HEPES, 0.2M LITHIUM SULFATE, 15% REMARK 280 PEG3350, PH 7.0, HANGING DROP, TEMPERATURE 298K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1 21 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 1.000000 0.000000 32.10400 REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 1240 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 22470 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -21.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 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 671 REMARK 465 SER A 672 REMARK 465 PHE A 673 REMARK 465 THR A 674 REMARK 465 PHE A 675 REMARK 465 SER A 676 REMARK 465 PRO A 677 REMARK 465 GLY A 678 REMARK 465 GLN A 679 REMARK 465 ASP A 680 REMARK 465 ILE A 681 REMARK 465 PRO A 708 REMARK 465 LYS A 933 REMARK 465 GLY B 671 REMARK 465 SER B 672 REMARK 465 PHE B 673 REMARK 465 THR B 674 REMARK 465 PHE B 675 REMARK 465 SER B 676 REMARK 465 PRO B 677 REMARK 465 GLY B 678 REMARK 465 GLN B 679 REMARK 465 ASP B 680 REMARK 465 ILE B 681 REMARK 465 GLN B 682 REMARK 465 LYS B 933 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 GLN A 682 CG CD OE1 NE2 REMARK 470 LEU A 683 CG CD1 CD2 REMARK 470 LYS A 707 CG CD CE NZ REMARK 470 ASP A 709 CG OD1 OD2 REMARK 470 ARG A 859 CG CD NE CZ NH1 NH2 REMARK 470 GLN A 860 CG CD OE1 NE2 REMARK 470 LYS A 861 CG CD CE NZ REMARK 470 GLN A 868 CG CD OE1 NE2 REMARK 470 ARG A 899 CG CD NE CZ NH1 NH2 REMARK 470 GLU A 904 CG CD OE1 OE2 REMARK 470 LYS A 932 CG CD CE NZ REMARK 470 LEU B 683 CG CD1 CD2 REMARK 470 LYS B 790 CG CD CE NZ REMARK 470 GLN B 812 CG CD OE1 NE2 REMARK 470 ARG B 859 CG CD NE CZ NH1 NH2 REMARK 470 LYS B 861 CG CD CE NZ REMARK 470 GLN B 868 CG CD OE1 NE2 REMARK 470 ASP B 882 CG OD1 OD2 REMARK 470 LYS B 932 CG CD CE NZ 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 THR A 706 -72.76 -74.53 REMARK 500 LEU A 782 81.26 -150.63 REMARK 500 SER A 837 49.87 -99.72 REMARK 500 GLN A 860 86.91 -67.51 REMARK 500 MET A 924 35.07 -90.26 REMARK 500 SER B 772 24.31 49.15 REMARK 500 SER B 837 47.54 -101.69 REMARK 500 ARG B 859 -42.09 -131.00 REMARK 500 MET B 924 43.11 -94.93 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A 382 DISTANCE = 6.07 ANGSTROMS REMARK 525 HOH B 287 DISTANCE = 7.55 ANGSTROMS REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 30X A 1 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE 30X B 2 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3HQ5 RELATED DB: PDB REMARK 900 PROGESTERONE RECEPTOR WITH BOUND PYRROLIDINE 22 DBREF 3G8O A 673 933 UNP P06401 PRGR_HUMAN 673 933 DBREF 3G8O B 673 933 UNP P06401 PRGR_HUMAN 673 933 SEQADV 3G8O GLY A 671 UNP P06401 EXPRESSION TAG SEQADV 3G8O SER A 672 UNP P06401 EXPRESSION TAG SEQADV 3G8O GLY B 671 UNP P06401 EXPRESSION TAG SEQADV 3G8O SER B 672 UNP P06401 EXPRESSION TAG SEQRES 1 A 263 GLY SER PHE THR PHE SER PRO GLY GLN ASP ILE GLN LEU SEQRES 2 A 263 ILE PRO PRO LEU ILE ASN LEU LEU MET SER ILE GLU PRO SEQRES 3 A 263 ASP VAL ILE TYR ALA GLY HIS ASP ASN THR LYS PRO ASP SEQRES 4 A 263 THR SER SER SER LEU LEU THR SER LEU ASN GLN LEU GLY SEQRES 5 A 263 GLU ARG GLN LEU LEU SER VAL VAL LYS TRP SER LYS SER SEQRES 6 A 263 LEU PRO GLY PHE ARG ASN LEU HIS ILE ASP ASP GLN ILE SEQRES 7 A 263 THR LEU ILE GLN TYR SER TRP MET SER LEU MET VAL PHE SEQRES 8 A 263 GLY LEU GLY TRP ARG SER TYR LYS HIS VAL SER GLY GLN SEQRES 9 A 263 MET LEU TYR PHE ALA PRO ASP LEU ILE LEU ASN GLU GLN SEQRES 10 A 263 ARG MET LYS GLU SER SER PHE TYR SER LEU CYS LEU THR SEQRES 11 A 263 MET TRP GLN ILE PRO GLN GLU PHE VAL LYS LEU GLN VAL SEQRES 12 A 263 SER GLN GLU GLU PHE LEU CYS MET LYS VAL LEU LEU LEU SEQRES 13 A 263 LEU ASN THR ILE PRO LEU GLU GLY LEU ARG SER GLN THR SEQRES 14 A 263 GLN PHE GLU GLU MET ARG SER SER TYR ILE ARG GLU LEU SEQRES 15 A 263 ILE LYS ALA ILE GLY LEU ARG GLN LYS GLY VAL VAL SER SEQRES 16 A 263 SER SER GLN ARG PHE TYR GLN LEU THR LYS LEU LEU ASP SEQRES 17 A 263 ASN LEU HIS ASP LEU VAL LYS GLN LEU HIS LEU TYR CYS SEQRES 18 A 263 LEU ASN THR PHE ILE GLN SER ARG ALA LEU SER VAL GLU SEQRES 19 A 263 PHE PRO GLU MET MET SER GLU VAL ILE ALA ALA GLN LEU SEQRES 20 A 263 PRO LYS ILE LEU ALA GLY MET VAL LYS PRO LEU LEU PHE SEQRES 21 A 263 HIS LYS LYS SEQRES 1 B 263 GLY SER PHE THR PHE SER PRO GLY GLN ASP ILE GLN LEU SEQRES 2 B 263 ILE PRO PRO LEU ILE ASN LEU LEU MET SER ILE GLU PRO SEQRES 3 B 263 ASP VAL ILE TYR ALA GLY HIS ASP ASN THR LYS PRO ASP SEQRES 4 B 263 THR SER SER SER LEU LEU THR SER LEU ASN GLN LEU GLY SEQRES 5 B 263 GLU ARG GLN LEU LEU SER VAL VAL LYS TRP SER LYS SER SEQRES 6 B 263 LEU PRO GLY PHE ARG ASN LEU HIS ILE ASP ASP GLN ILE SEQRES 7 B 263 THR LEU ILE GLN TYR SER TRP MET SER LEU MET VAL PHE SEQRES 8 B 263 GLY LEU GLY TRP ARG SER TYR LYS HIS VAL SER GLY GLN SEQRES 9 B 263 MET LEU TYR PHE ALA PRO ASP LEU ILE LEU ASN GLU GLN SEQRES 10 B 263 ARG MET LYS GLU SER SER PHE TYR SER LEU CYS LEU THR SEQRES 11 B 263 MET TRP GLN ILE PRO GLN GLU PHE VAL LYS LEU GLN VAL SEQRES 12 B 263 SER GLN GLU GLU PHE LEU CYS MET LYS VAL LEU LEU LEU SEQRES 13 B 263 LEU ASN THR ILE PRO LEU GLU GLY LEU ARG SER GLN THR SEQRES 14 B 263 GLN PHE GLU GLU MET ARG SER SER TYR ILE ARG GLU LEU SEQRES 15 B 263 ILE LYS ALA ILE GLY LEU ARG GLN LYS GLY VAL VAL SER SEQRES 16 B 263 SER SER GLN ARG PHE TYR GLN LEU THR LYS LEU LEU ASP SEQRES 17 B 263 ASN LEU HIS ASP LEU VAL LYS GLN LEU HIS LEU TYR CYS SEQRES 18 B 263 LEU ASN THR PHE ILE GLN SER ARG ALA LEU SER VAL GLU SEQRES 19 B 263 PHE PRO GLU MET MET SER GLU VAL ILE ALA ALA GLN LEU SEQRES 20 B 263 PRO LYS ILE LEU ALA GLY MET VAL LYS PRO LEU LEU PHE SEQRES 21 B 263 HIS LYS LYS HET 30X A 1 25 HET 30X B 2 25 HET SO4 B 1 5 HETNAM 30X N~2~-[4-CYANO-3-(TRIFLUOROMETHYL)PHENYL]-N,N-DIMETHYL- HETNAM 2 30X N~2~-(2,2,2-TRIFLUOROETHYL)-L-ALANINAMIDE HETNAM SO4 SULFATE ION FORMUL 3 30X 2(C15 H15 F6 N3 O) FORMUL 5 SO4 O4 S 2- FORMUL 6 HOH *352(H2 O) HELIX 1 1 PRO A 685 ILE A 694 1 10 HELIX 2 2 THR A 710 LYS A 734 1 25 HELIX 3 3 GLY A 738 LEU A 742 5 5 HELIX 4 4 HIS A 743 SER A 772 1 30 HELIX 5 5 GLU A 791 TRP A 802 1 12 HELIX 6 6 TRP A 802 GLN A 812 1 11 HELIX 7 7 SER A 814 LEU A 827 1 14 HELIX 8 8 SER A 837 GLN A 860 1 24 HELIX 9 9 GLY A 862 GLN A 897 1 36 HELIX 10 10 GLN A 897 SER A 902 1 6 HELIX 11 11 PRO A 906 ALA A 922 1 17 HELIX 12 12 PRO B 685 ILE B 694 1 10 HELIX 13 13 THR B 710 LEU B 736 1 27 HELIX 14 14 GLY B 738 LEU B 742 5 5 HELIX 15 15 HIS B 743 VAL B 771 1 29 HELIX 16 16 ASN B 785 SER B 792 1 8 HELIX 17 17 PHE B 794 GLN B 812 1 19 HELIX 18 18 SER B 814 LEU B 827 1 14 HELIX 19 19 SER B 837 LEU B 858 1 22 HELIX 20 20 GLY B 862 GLN B 897 1 36 HELIX 21 21 GLN B 897 SER B 902 1 6 HELIX 22 22 PRO B 906 ALA B 922 1 17 SHEET 1 A 2 LEU A 776 ALA A 779 0 SHEET 2 A 2 LEU A 782 LEU A 784 -1 O LEU A 784 N LEU A 776 SHEET 1 B 2 THR A 829 PRO A 831 0 SHEET 2 B 2 VAL A 925 PRO A 927 -1 O LYS A 926 N ILE A 830 SHEET 1 C 2 LEU B 776 ALA B 779 0 SHEET 2 C 2 LEU B 782 LEU B 784 -1 O LEU B 784 N LEU B 776 SHEET 1 D 2 THR B 829 ILE B 830 0 SHEET 2 D 2 LYS B 926 PRO B 927 -1 O LYS B 926 N ILE B 830 SITE *** AC1 15 LEU A 718 ASN A 719 LEU A 721 TRP A 755 SITE *** AC1 15 MET A 759 VAL A 760 LEU A 763 ARG A 766 SITE *** AC1 15 LEU A 797 MET A 801 LEU A 887 TYR A 890 SITE *** AC1 15 CYS A 891 THR A 894 PHE A 905 SITE *** AC2 15 LEU B 715 LEU B 718 ASN B 719 MET B 759 SITE *** AC2 15 VAL B 760 LEU B 763 ARG B 766 PHE B 778 SITE *** AC2 15 LEU B 797 LEU B 887 TYR B 890 CYS B 891 SITE *** AC2 15 THR B 894 PHE B 905 MET B 909 CRYST1 57.670 64.208 70.500 90.00 96.01 90.00 P 1 21 1 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 0.017340 0.000000 0.001826 0.00000 SCALE2 0.000000 0.015574 0.000000 0.00000 SCALE3 0.000000 0.000000 0.014263 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 874 THR OG1 : rot -97:sc= 0.657 USER MOD Set 1.2: B 931 HIS :FLIP no HD1:sc= -0.841 F(o=-2.6!,f=-0.18) USER MOD Set 2.1: B 860 GLN : amide:sc= -0.126 X(o=0.15,f=-0.052) USER MOD Set 2.2: B 865 SER OG : rot -124:sc= 0.279 USER MOD Set 3.1: B 774 GLN : amide:sc= 0.23 K(o=-0.92,f=-4.7!) USER MOD Set 3.2: B 806 GLN : amide:sc= -1.15 K(o=-0.92,f=-5.1!) USER MOD Set 4.1: B 756 MET CE :methyl -124:sc= -0.354 (180deg=-1.97!) USER MOD Set 4.2: B 888 HIS : no HE2:sc= -0.163! C(o=-0.52!,f=-6.2!) USER MOD Set 5.1: B 752 GLN : amide:sc= 1.07 K(o=2.2,f=-0.5) USER MOD Set 5.2: B 916 GLN : amide:sc= 1.18 K(o=2.2,f=0.31) USER MOD Set 6.1: B 703 HIS : no HD1:sc= 2.06 K(o=6.2,f=-9.1!) USER MOD Set 6.2: B 705 ASN : amide:sc= 2.01 K(o=6.2,f=2) USER MOD Set 6.3: B 717 SER OG : rot 177:sc= 2.12 USER MOD Set 7.1: B 710 THR OG1 : rot -44:sc= 2.28 USER MOD Set 7.2: B 712 SER OG : rot -78:sc= 0.503 USER MOD Set 7.3: B 713 SER OG : rot -172:sc= 1.97 USER MOD Set 8.1: B 711 SER OG : rot 91:sc= 0.539 USER MOD Set 8.2: B 793 SER OG : rot -7:sc= 0.323 USER MOD Set 9.1: A 829 THR OG1 : rot -42:sc= 1.35 USER MOD Set 9.2: A 881 HIS : no HD1:sc= 1.26 K(o=2.6,f=-0.6) USER MOD Set10.1: A 874 THR OG1 : rot 83:sc= 1.23 USER MOD Set10.2: A 931 HIS :FLIP no HE2:sc= -0.822 F(o=-2.7,f=0.4) USER MOD Set11.1: A 692 MET CE :methyl -113:sc= 0 (180deg=0) USER MOD Set11.2: A 815 GLN :FLIP amide:sc= -0.119 F(o=-1.3!,f=-0.12) USER MOD Set12.1: A 800 THR OG1 : rot -160:sc= 0.666 USER MOD Set12.2: A 886 GLN : amide:sc= 0.456 K(o=1.1,f=-0.022) USER MOD Set13.1: A 798 CYS SG : rot 77:sc= -0.352 USER MOD Set13.2: A 801 MET CE :methyl 155:sc= -8.34! (180deg=-9.65!) USER MOD Set14.1: A 756 MET CE :methyl -141:sc= -0.117 (180deg=-0.863) USER MOD Set14.2: A 888 HIS : no HE2:sc= 2.26 K(o=2.1,f=-5.3!) USER MOD Set15.1: A 752 GLN : amide:sc= 0.395 X(o=0.4,f=-0.066) USER MOD Set15.2: A 916 GLN : amide:sc= 0 X(o=0.4,f=0.13) USER MOD Set16.1: A 719 ASN : amide:sc= 0.503 K(o=-0.32,f=-5.7!) USER MOD Set16.2: A 909 MET CE :methyl 145:sc= -0.824 (180deg=-0.768) USER MOD Set17.1: A 703 HIS : no HE2:sc= 0.868 K(o=3.3,f=-9!) USER MOD Set17.2: A 717 SER OG : rot -46:sc= 2.38 USER MOD Single : A 689 ASN : amide:sc= 0 X(o=0,f=0.065) USER MOD Single : A 693 SER OG : rot -43:sc= 1 USER MOD Single : A 700 TYR OH : rot 180:sc= 0 USER MOD Single : A 705 ASN : amide:sc= -0.18 K(o=-0.18,f=-1.7!) USER MOD Single : A 706 THR OG1 : rot 180:sc= -0.0017! USER MOD Single : A 710 THR OG1 : rot 48:sc= -0.15 USER MOD Single : A 711 SER OG : rot 180:sc= 0 USER MOD Single : A 712 SER OG : rot -124:sc= 0.659 USER MOD Single : A 713 SER OG : rot 180:sc= 0 USER MOD Single : A 716 THR OG1 : rot 81:sc= 0.484 USER MOD Single : A 720 GLN : amide:sc= -0.546 K(o=-0.55,f=-2.8!) USER MOD Single : A 725 GLN :FLIP amide:sc= 0.698 F(o=-1.2!,f=0.7) USER MOD Single : A 728 SER OG : rot 30:sc= -1.18 USER MOD Single : A 731 LYS NZ :NH3+ -178:sc= 0.018 (180deg=0.0179) USER MOD Single : A 733 SER OG : rot -58:sc= 1.87 USER MOD Single : A 734 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 735 SER OG : rot 180:sc= 0 USER MOD Single : A 741 ASN :FLIP amide:sc= -0.0257 F(o=-1.6,f=-0.026) USER MOD Single : A 743 HIS :FLIP no HD1:sc= -1.59! C(o=-7.3!,f=-1.6!) USER MOD Single : A 747 GLN : amide:sc= 1.07 K(o=1.1,f=-0.083) USER MOD Single : A 749 THR OG1 : rot 80:sc= 0.548 USER MOD Single : A 753 TYR OH : rot 70:sc= 0 USER MOD Single : A 754 SER OG : rot -73:sc= 0.755 USER MOD Single : A 757 SER OG : rot -145:sc= 1.27 USER MOD Single : A 759 MET CE :methyl 153:sc= -16.2! (180deg=-20.6!) USER MOD Single : A 767 SER OG : rot 78:sc= 1.09 USER MOD Single : A 768 TYR OH : rot 163:sc= 1.7 USER MOD Single : A 769 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 770 HIS : no HE2:sc= 1.06 K(o=1.1,f=-1.7!) USER MOD Single : A 772 SER OG : rot 72:sc= 0.116 USER MOD Single : A 774 GLN : amide:sc= 0.508 K(o=0.51,f=-0.24) USER MOD Single : A 775 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 777 TYR OH : rot 180:sc= 1.26 USER MOD Single : A 785 ASN : amide:sc= -0.311 K(o=-0.31,f=-2.9!) USER MOD Single : A 787 GLN : amide:sc= -0.513! X(o=-0.51!,f=-0.83) USER MOD Single : A 789 MET CE :methyl 136:sc= -0.895 (180deg=-2.38!) USER MOD Single : A 790 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 792 SER OG : rot 180:sc= 0.00136 USER MOD Single : A 793 SER OG : rot 180:sc= 0 USER MOD Single : A 795 TYR OH : rot 180:sc= 0 USER MOD Single : A 796 SER OG : rot 80:sc= 0.904 USER MOD Single : A 803 GLN :FLIP amide:sc= -1.41 F(o=-6.6!,f=-1.4) USER MOD Single : A 806 GLN : amide:sc= 0.0419 K(o=0.042,f=-0.61) USER MOD Single : A 810 LYS NZ :NH3+ 164:sc= 0.633 (180deg=0.52) USER MOD Single : A 812 GLN :FLIP amide:sc= -0.147 F(o=-1.9!,f=-0.15) USER MOD Single : A 814 SER OG : rot -138:sc= 1.33 USER MOD Single : A 820 CYS SG : rot 170:sc= 0 USER MOD Single : A 821 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 822 LYS NZ :NH3+ 167:sc= 0.157 (180deg=0.123) USER MOD Single : A 828 ASN : amide:sc= 2.39 K(o=2.4,f=0.073!) USER MOD Single : A 837 SER OG : rot -90:sc= 0.777 USER MOD Single : A 838 GLN : amide:sc= 0.873 K(o=0.87,f=-3.6!) USER MOD Single : A 839 THR OG1 : rot 83:sc= 1.1 USER MOD Single : A 840 GLN : amide:sc= 0.357 K(o=0.36,f=-0.2) USER MOD Single : A 844 MET CE :methyl -168:sc= 0 (180deg=-0.0347) USER MOD Single : A 846 SER OG : rot 77:sc= 0.534 USER MOD Single : A 847 SER OG : rot -29:sc= 0.56 USER MOD Single : A 848 TYR OH : rot 2:sc= 0.647 USER MOD Single : A 854 LYS NZ :NH3+ 175:sc= 0.271 (180deg=0.262) USER MOD Single : A 865 SER OG : rot 180:sc= -0.0116 USER MOD Single : A 866 SER OG : rot 180:sc= -0.0321 USER MOD Single : A 867 SER OG : rot 180:sc= 0 USER MOD Single : A 871 TYR OH : rot 180:sc= 0 USER MOD Single : A 872 GLN : amide:sc= 1.04 K(o=1,f=-1.8!) USER MOD Single : A 875 LYS NZ :NH3+ -164:sc= 1.3 (180deg=1.1) USER MOD Single : A 879 ASN : amide:sc= 0 K(o=0,f=-2.1) USER MOD Single : A 885 LYS NZ :NH3+ -173:sc= 1.24 (180deg=1.19) USER MOD Single : A 890 TYR OH : rot 30:sc= 0 USER MOD Single : A 891 CYS SG : rot 71:sc= 0.0517 USER MOD Single : A 893 ASN : amide:sc= 1.3 K(o=1.3,f=-1.2!) USER MOD Single : A 894 THR OG1 : rot 75:sc= 0.581 USER MOD Single : A 897 GLN :FLIP amide:sc= 0.246 F(o=-0.35,f=0.25) USER MOD Single : A 898 SER OG : rot 180:sc= -0.0716 USER MOD Single : A 902 SER OG : rot 180:sc= 0 USER MOD Single : A 908 MET CE :methyl -176:sc= -0.0243 (180deg=-0.0679) USER MOD Single : A 910 SER OG : rot 87:sc= 1.33 USER MOD Single : A 919 LYS NZ :NH3+ -101:sc= -1.83 (180deg=-4.02!) USER MOD Single : A 924 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 926 LYS NZ :NH3+ 144:sc= -0.0446 (180deg=-0.367) USER MOD Single : B 689 ASN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : B 692 MET CE :methyl -146:sc= -0.312 (180deg=-1.87!) USER MOD Single : B 693 SER OG : rot -42:sc= 0.989 USER MOD Single : B 700 TYR OH : rot 180:sc= 0 USER MOD Single : B 706 THR OG1 : rot 180:sc= 0 USER MOD Single : B 707 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 716 THR OG1 : rot 88:sc= 1.11 USER MOD Single : B 719 ASN : amide:sc= 0.101 K(o=0.1,f=-3.8!) USER MOD Single : B 720 GLN : amide:sc= 0.136 X(o=0.14,f=-0.028) USER MOD Single : B 725 GLN :FLIP amide:sc= 0.996 F(o=-1.5!,f=1) USER MOD Single : B 728 SER OG : rot 8:sc= -0.882 USER MOD Single : B 731 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 733 SER OG : rot -44:sc= 1.32 USER MOD Single : B 734 LYS NZ :NH3+ 173:sc= 0.529 (180deg=0.499) USER MOD Single : B 735 SER OG : rot 152:sc= 0.0527 USER MOD Single : B 741 ASN : amide:sc= 1.22 K(o=1.2,f=0.35) USER MOD Single : B 743 HIS :FLIP no HD1:sc= 0.768 F(o=-6.8!,f=0.77) USER MOD Single : B 747 GLN : amide:sc= 0.655 X(o=0.66,f=0.25) USER MOD Single : B 749 THR OG1 : rot 80:sc= 0.276 USER MOD Single : B 753 TYR OH : rot 19:sc= 1.35 USER MOD Single : B 754 SER OG : rot -79:sc= 0.997 USER MOD Single : B 757 SER OG : rot -110:sc= 2.82 USER MOD Single : B 759 MET CE :methyl 170:sc= -0.827 (180deg=-1.2) USER MOD Single : B 767 SER OG : rot 78:sc= 1.18 USER MOD Single : B 768 TYR OH : rot 152:sc= -0.305 USER MOD Single : B 769 LYS NZ A:NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 769 LYS NZ B:NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 770 HIS : no HE2:sc= -0.017 X(o=-0.017,f=0.0054) USER MOD Single : B 772 SER OG : rot 180:sc= 0 USER MOD Single : B 775 MET CE :methyl -155:sc= -10.1! (180deg=-12.4!) USER MOD Single : B 777 TYR OH : rot 30:sc= 0.862 USER MOD Single : B 785 ASN : amide:sc= -0.315 K(o=-0.32,f=-5.8!) USER MOD Single : B 787 GLN : amide:sc= 0.824 K(o=0.82,f=-0.25) USER MOD Single : B 789 MET CE :methyl -129:sc= -0.392 (180deg=-2.38) USER MOD Single : B 792 SER OG : rot -68:sc= 0.897 USER MOD Single : B 795 TYR OH : rot -5:sc= 0.83 USER MOD Single : B 796 SER OG : rot 21:sc= 0.0158 USER MOD Single : B 798 CYS SG : rot 47:sc= 0.545 USER MOD Single : B 800 THR OG1 : rot -69:sc= 1.32 USER MOD Single : B 801 MET CE :methyl -172:sc= -2.84! (180deg=-2.89!) USER MOD Single : B 803 GLN :FLIP amide:sc= -0.025 F(o=-1.8!,f=-0.025) USER MOD Single : B 810 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 814 SER OG : rot -158:sc= 0.998 USER MOD Single : B 815 GLN :FLIP amide:sc= -1.97 F(o=-2.8,f=-2) USER MOD Single : B 820 CYS SG : rot 170:sc= 0 USER MOD Single : B 821 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 822 LYS NZ :NH3+ 163:sc= 2.59 (180deg=2.01) USER MOD Single : B 828 ASN : amide:sc= 2.87 K(o=2.9,f=1.2) USER MOD Single : B 829 THR OG1 : rot 103:sc= 1.35 USER MOD Single : B 837 SER OG : rot -99:sc= 0.694 USER MOD Single : B 838 GLN : amide:sc= 0.611 K(o=0.61,f=-3.3!) USER MOD Single : B 839 THR OG1 : rot 180:sc= 0 USER MOD Single : B 840 GLN : amide:sc= -0.0491 X(o=-0.049,f=-0.47) USER MOD Single : B 844 MET CE :methyl -157:sc= 0 (180deg=-0.133) USER MOD Single : B 846 SER OG : rot -156:sc= 1.46 USER MOD Single : B 847 SER OG A: rot 77:sc= 1.88 USER MOD Single : B 847 SER OG B: rot 55:sc= 0.00529 USER MOD Single : B 848 TYR OH : rot -179:sc= 0.885 USER MOD Single : B 854 LYS NZ :NH3+ -111:sc= 1.04 (180deg=0.31) USER MOD Single : B 866 SER OG : rot 180:sc= 0 USER MOD Single : B 867 SER OG : rot 180:sc= 0 USER MOD Single : B 871 TYR OH : rot 180:sc= 0 USER MOD Single : B 872 GLN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : B 875 LYS NZ :NH3+ -174:sc= 0.974 (180deg=0.948) USER MOD Single : B 879 ASN : amide:sc= 0.363 K(o=0.36,f=-0.31) USER MOD Single : B 881 HIS : no HD1:sc= 1.59 K(o=1.6,f=-0.82) USER MOD Single : B 885 LYS NZ :NH3+ 175:sc= 1.23 (180deg=1.21) USER MOD Single : B 886 GLN : amide:sc= 1.11 X(o=1.1,f=1.1) USER MOD Single : B 890 TYR OH : rot 180:sc= 0.467 USER MOD Single : B 891 CYS SG : rot 69:sc= 0.00043 USER MOD Single : B 893 ASN : amide:sc= 0.864 K(o=0.86,f=-0.37) USER MOD Single : B 894 THR OG1 : rot 81:sc= 1.54 USER MOD Single : B 897 GLN : amide:sc= 0.521 X(o=0.52,f=0.59) USER MOD Single : B 898 SER OG : rot -84:sc= 1.42 USER MOD Single : B 902 SER OG : rot 180:sc= 0 USER MOD Single : B 908 MET CE :methyl 168:sc= 0 (180deg=-0.222) USER MOD Single : B 909 MET CE :methyl -166:sc= -6.09! (180deg=-6.73!) USER MOD Single : B 910 SER OG : rot 76:sc= 1.75 USER MOD Single : B 919 LYS NZ :NH3+ 170:sc= 0.986 (180deg=0.925) USER MOD Single : B 924 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 926 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 682 5.035 -20.249 59.518 1.00 55.45 N ATOM 2 CA GLN A 682 5.801 -21.468 59.914 1.00 54.71 C ATOM 3 C GLN A 682 6.869 -21.812 58.885 1.00 53.86 C ATOM 4 O GLN A 682 7.928 -21.189 58.856 1.00 55.16 O ATOM 5 CB GLN A 682 4.852 -22.661 60.083 1.00 55.56 C ATOM 0 HA GLN A 682 6.238 -21.278 60.759 1.00 54.71 H new ATOM 6 N LEU A 683 6.589 -22.809 58.048 1.00 52.16 N ATOM 7 CA LEU A 683 7.528 -23.243 57.018 1.00 49.12 C ATOM 8 C LEU A 683 7.565 -22.235 55.871 1.00 46.83 C ATOM 9 O LEU A 683 8.514 -22.217 55.090 1.00 46.90 O ATOM 10 CB LEU A 683 7.130 -24.620 56.497 1.00 49.36 C ATOM 0 H LEU A 683 5.851 -23.251 58.062 1.00 52.16 H new ATOM 0 HA LEU A 683 8.415 -23.298 57.408 1.00 49.12 H new ATOM 11 N ILE A 684 6.541 -21.393 55.778 1.00 42.96 N ATOM 12 CA ILE A 684 6.473 -20.403 54.717 1.00 39.13 C ATOM 13 C ILE A 684 7.043 -19.061 55.171 1.00 35.21 C ATOM 14 O ILE A 684 6.568 -18.471 56.134 1.00 35.04 O ATOM 15 CB ILE A 684 5.018 -20.219 54.245 1.00 38.85 C ATOM 16 CG1 ILE A 684 4.524 -21.513 53.591 1.00 40.38 C ATOM 17 CG2 ILE A 684 4.918 -19.084 53.257 1.00 38.98 C ATOM 18 CD1 ILE A 684 3.264 -21.359 52.790 1.00 40.33 C ATOM 0 H ILE A 684 5.875 -21.381 56.322 1.00 42.96 H new ATOM 0 HA ILE A 684 7.010 -20.728 53.978 1.00 39.13 H new ATOM 0 HB ILE A 684 4.467 -20.009 55.015 1.00 38.85 H new ATOM 0 HG12 ILE A 684 5.222 -21.858 53.013 1.00 40.38 H new ATOM 0 HG13 ILE A 684 4.376 -22.176 54.283 1.00 40.38 H new ATOM 0 HG21 ILE A 684 3.996 -18.983 52.972 1.00 38.98 H new ATOM 0 HG22 ILE A 684 5.218 -18.262 53.676 1.00 38.98 H new ATOM 0 HG23 ILE A 684 5.476 -19.275 52.487 1.00 38.98 H new ATOM 0 HD11 ILE A 684 3.016 -22.216 52.409 1.00 40.33 H new ATOM 0 HD12 ILE A 684 2.551 -21.043 53.366 1.00 40.33 H new ATOM 0 HD13 ILE A 684 3.410 -20.719 52.076 1.00 40.33 H new ATOM 19 N PRO A 685 8.091 -18.560 54.491 1.00 31.76 N ATOM 20 CA PRO A 685 8.715 -17.271 54.844 1.00 29.82 C ATOM 21 C PRO A 685 7.664 -16.150 54.853 1.00 27.82 C ATOM 22 O PRO A 685 6.841 -16.056 53.958 1.00 28.85 O ATOM 23 CB PRO A 685 9.735 -17.063 53.749 1.00 30.44 C ATOM 24 CG PRO A 685 10.000 -18.430 53.229 1.00 32.34 C ATOM 25 CD PRO A 685 8.702 -19.139 53.289 1.00 31.60 C ATOM 0 HA PRO A 685 9.114 -17.265 55.728 1.00 29.82 H new ATOM 0 HB2 PRO A 685 9.393 -16.480 53.053 1.00 30.44 H new ATOM 0 HB3 PRO A 685 10.544 -16.652 54.092 1.00 30.44 H new ATOM 0 HG2 PRO A 685 10.338 -18.398 52.320 1.00 32.34 H new ATOM 0 HG3 PRO A 685 10.670 -18.883 53.765 1.00 32.34 H new ATOM 0 HD2 PRO A 685 8.165 -18.980 52.497 1.00 31.60 H new ATOM 0 HD3 PRO A 685 8.816 -20.099 53.367 1.00 31.60 H new ATOM 26 N PRO A 686 7.698 -15.260 55.852 1.00 26.58 N ATOM 27 CA PRO A 686 6.741 -14.146 55.973 1.00 25.93 C ATOM 28 C PRO A 686 6.607 -13.279 54.714 1.00 23.85 C ATOM 29 O PRO A 686 5.502 -12.849 54.371 1.00 24.67 O ATOM 30 CB PRO A 686 7.297 -13.315 57.131 1.00 25.78 C ATOM 31 CG PRO A 686 8.257 -14.229 57.804 1.00 28.68 C ATOM 32 CD PRO A 686 8.839 -15.070 56.757 1.00 27.61 C ATOM 0 HA PRO A 686 5.844 -14.487 56.114 1.00 25.93 H new ATOM 0 HB2 PRO A 686 7.736 -12.511 56.812 1.00 25.78 H new ATOM 0 HB3 PRO A 686 6.593 -13.033 57.735 1.00 25.78 H new ATOM 0 HG2 PRO A 686 8.946 -13.726 58.265 1.00 28.68 H new ATOM 0 HG3 PRO A 686 7.807 -14.771 58.471 1.00 28.68 H new ATOM 0 HD2 PRO A 686 9.585 -14.636 56.315 1.00 27.61 H new ATOM 0 HD3 PRO A 686 9.168 -15.912 57.108 1.00 27.61 H new ATOM 33 N LEU A 687 7.714 -12.979 54.036 1.00 22.56 N ATOM 34 CA LEU A 687 7.644 -12.137 52.828 1.00 21.48 C ATOM 35 C LEU A 687 6.799 -12.808 51.748 1.00 20.50 C ATOM 36 O LEU A 687 6.024 -12.140 51.065 1.00 21.14 O ATOM 37 CB LEU A 687 9.043 -11.840 52.287 1.00 20.64 C ATOM 38 CG LEU A 687 9.030 -11.000 51.022 1.00 19.80 C ATOM 39 CD1 LEU A 687 8.149 -9.773 51.253 1.00 18.89 C ATOM 40 CD2 LEU A 687 10.458 -10.613 50.653 1.00 20.59 C ATOM 0 H LEU A 687 8.504 -13.244 54.249 1.00 22.56 H new ATOM 0 HA LEU A 687 7.224 -11.299 53.076 1.00 21.48 H new ATOM 0 HB2 LEU A 687 9.556 -11.379 52.969 1.00 20.64 H new ATOM 0 HB3 LEU A 687 9.498 -12.677 52.107 1.00 20.64 H new ATOM 0 HG LEU A 687 8.661 -11.504 50.280 1.00 19.80 H new ATOM 0 HD11 LEU A 687 8.134 -9.229 50.450 1.00 18.89 H new ATOM 0 HD12 LEU A 687 7.247 -10.058 51.467 1.00 18.89 H new ATOM 0 HD13 LEU A 687 8.506 -9.252 51.989 1.00 18.89 H new ATOM 0 HD21 LEU A 687 10.450 -10.076 49.845 1.00 20.59 H new ATOM 0 HD22 LEU A 687 10.852 -10.101 51.377 1.00 20.59 H new ATOM 0 HD23 LEU A 687 10.982 -11.415 50.502 1.00 20.59 H new ATOM 41 N ILE A 688 6.930 -14.121 51.610 1.00 18.49 N ATOM 42 CA ILE A 688 6.165 -14.855 50.609 1.00 20.59 C ATOM 43 C ILE A 688 4.688 -14.881 50.984 1.00 19.95 C ATOM 44 O ILE A 688 3.823 -14.762 50.126 1.00 20.24 O ATOM 45 CB ILE A 688 6.699 -16.287 50.458 1.00 20.98 C ATOM 46 CG1 ILE A 688 8.081 -16.245 49.811 1.00 21.66 C ATOM 47 CG2 ILE A 688 5.757 -17.126 49.620 1.00 20.99 C ATOM 48 CD1 ILE A 688 8.749 -17.594 49.718 1.00 24.70 C ATOM 0 H ILE A 688 7.457 -14.607 52.086 1.00 18.49 H new ATOM 0 HA ILE A 688 6.264 -14.400 49.758 1.00 20.59 H new ATOM 0 HB ILE A 688 6.763 -16.693 51.337 1.00 20.98 H new ATOM 0 HG12 ILE A 688 8.001 -15.871 48.920 1.00 21.66 H new ATOM 0 HG13 ILE A 688 8.649 -15.646 50.320 1.00 21.66 H new ATOM 0 HG21 ILE A 688 6.111 -18.025 49.537 1.00 20.99 H new ATOM 0 HG22 ILE A 688 4.887 -17.160 50.047 1.00 20.99 H new ATOM 0 HG23 ILE A 688 5.669 -16.731 48.739 1.00 20.99 H new ATOM 0 HD11 ILE A 688 9.619 -17.497 49.299 1.00 24.70 H new ATOM 0 HD12 ILE A 688 8.859 -17.963 50.608 1.00 24.70 H new ATOM 0 HD13 ILE A 688 8.200 -18.191 49.186 1.00 24.70 H new ATOM 49 N ASN A 689 4.404 -15.026 52.269 1.00 20.26 N ATOM 50 CA ASN A 689 3.027 -15.043 52.728 1.00 21.32 C ATOM 51 C ASN A 689 2.398 -13.677 52.451 1.00 21.31 C ATOM 52 O ASN A 689 1.225 -13.572 52.107 1.00 20.52 O ATOM 53 CB ASN A 689 2.977 -15.336 54.223 1.00 25.01 C ATOM 54 CG ASN A 689 1.584 -15.210 54.787 1.00 30.73 C ATOM 55 OD1 ASN A 689 0.717 -16.041 54.515 1.00 33.52 O ATOM 56 ND2 ASN A 689 1.349 -14.157 55.561 1.00 32.06 N ATOM 0 H ASN A 689 4.993 -15.116 52.890 1.00 20.26 H new ATOM 0 HA ASN A 689 2.537 -15.736 52.258 1.00 21.32 H new ATOM 0 HB2 ASN A 689 3.309 -16.233 54.386 1.00 25.01 H new ATOM 0 HB3 ASN A 689 3.569 -14.725 54.690 1.00 25.01 H new ATOM 0 HD21 ASN A 689 0.566 -14.035 55.894 1.00 32.06 H new ATOM 0 HD22 ASN A 689 1.980 -13.597 55.729 1.00 32.06 H new ATOM 57 N LEU A 690 3.195 -12.631 52.612 1.00 20.01 N ATOM 58 CA LEU A 690 2.733 -11.272 52.375 1.00 21.13 C ATOM 59 C LEU A 690 2.399 -11.112 50.894 1.00 20.41 C ATOM 60 O LEU A 690 1.348 -10.577 50.539 1.00 20.68 O ATOM 61 CB LEU A 690 3.814 -10.270 52.792 1.00 19.98 C ATOM 62 CG LEU A 690 3.484 -8.776 52.830 1.00 23.39 C ATOM 63 CD1 LEU A 690 4.609 -8.056 53.565 1.00 25.04 C ATOM 64 CD2 LEU A 690 3.316 -8.218 51.420 1.00 22.67 C ATOM 0 H LEU A 690 4.016 -12.688 52.861 1.00 20.01 H new ATOM 0 HA LEU A 690 1.938 -11.099 52.904 1.00 21.13 H new ATOM 0 HB2 LEU A 690 4.118 -10.523 53.678 1.00 19.98 H new ATOM 0 HB3 LEU A 690 4.566 -10.386 52.190 1.00 19.98 H new ATOM 0 HG LEU A 690 2.644 -8.638 53.295 1.00 23.39 H new ATOM 0 HD11 LEU A 690 4.417 -7.106 53.599 1.00 25.04 H new ATOM 0 HD12 LEU A 690 4.681 -8.404 54.468 1.00 25.04 H new ATOM 0 HD13 LEU A 690 5.446 -8.200 53.096 1.00 25.04 H new ATOM 0 HD21 LEU A 690 3.108 -7.272 51.469 1.00 22.67 H new ATOM 0 HD22 LEU A 690 4.139 -8.342 50.922 1.00 22.67 H new ATOM 0 HD23 LEU A 690 2.594 -8.685 50.971 1.00 22.67 H new ATOM 65 N LEU A 691 3.287 -11.591 50.030 1.00 20.39 N ATOM 66 CA LEU A 691 3.054 -11.505 48.589 1.00 20.03 C ATOM 67 C LEU A 691 1.758 -12.219 48.194 1.00 20.26 C ATOM 68 O LEU A 691 1.007 -11.735 47.348 1.00 19.79 O ATOM 69 CB LEU A 691 4.233 -12.109 47.818 1.00 17.91 C ATOM 70 CG LEU A 691 5.584 -11.396 47.956 1.00 16.57 C ATOM 71 CD1 LEU A 691 6.624 -12.116 47.103 1.00 18.07 C ATOM 72 CD2 LEU A 691 5.460 -9.938 47.512 1.00 18.88 C ATOM 0 H LEU A 691 4.027 -11.968 50.254 1.00 20.39 H new ATOM 0 HA LEU A 691 2.970 -10.566 48.360 1.00 20.03 H new ATOM 0 HB2 LEU A 691 4.345 -13.028 48.107 1.00 17.91 H new ATOM 0 HB3 LEU A 691 3.999 -12.134 46.877 1.00 17.91 H new ATOM 0 HG LEU A 691 5.861 -11.413 48.885 1.00 16.57 H new ATOM 0 HD11 LEU A 691 7.480 -11.667 47.188 1.00 18.07 H new ATOM 0 HD12 LEU A 691 6.710 -13.034 47.403 1.00 18.07 H new ATOM 0 HD13 LEU A 691 6.345 -12.105 46.174 1.00 18.07 H new ATOM 0 HD21 LEU A 691 6.319 -9.497 47.603 1.00 18.88 H new ATOM 0 HD22 LEU A 691 5.177 -9.905 46.585 1.00 18.88 H new ATOM 0 HD23 LEU A 691 4.805 -9.486 48.066 1.00 18.88 H new ATOM 73 N MET A 692 1.497 -13.372 48.806 1.00 20.46 N ATOM 74 CA MET A 692 0.283 -14.126 48.512 1.00 22.67 C ATOM 75 C MET A 692 -0.943 -13.287 48.862 1.00 21.90 C ATOM 76 O MET A 692 -1.912 -13.237 48.107 1.00 21.23 O ATOM 77 CB MET A 692 0.226 -15.424 49.333 1.00 24.02 C ATOM 78 CG MET A 692 1.347 -16.424 49.075 1.00 26.28 C ATOM 79 SD MET A 692 1.205 -17.879 50.158 1.00 29.27 S ATOM 80 CE MET A 692 2.102 -19.096 49.201 1.00 27.28 C ATOM 0 H MET A 692 2.010 -13.734 49.394 1.00 20.46 H new ATOM 0 HA MET A 692 0.291 -14.343 47.567 1.00 22.67 H new ATOM 0 HB2 MET A 692 0.234 -15.191 50.275 1.00 24.02 H new ATOM 0 HB3 MET A 692 -0.621 -15.861 49.156 1.00 24.02 H new ATOM 0 HG2 MET A 692 1.323 -16.706 48.147 1.00 26.28 H new ATOM 0 HG3 MET A 692 2.205 -15.995 49.219 1.00 26.28 H new ATOM 0 HE1 MET A 692 1.489 -19.781 48.892 1.00 27.28 H new ATOM 0 HE2 MET A 692 2.517 -18.665 48.437 1.00 27.28 H new ATOM 0 HE3 MET A 692 2.787 -19.502 49.755 1.00 27.28 H new ATOM 81 N SER A 693 -0.884 -12.625 50.012 1.00 21.24 N ATOM 82 CA SER A 693 -1.994 -11.813 50.490 1.00 22.95 C ATOM 83 C SER A 693 -2.255 -10.539 49.692 1.00 23.23 C ATOM 84 O SER A 693 -3.352 -9.991 49.755 1.00 23.36 O ATOM 85 CB SER A 693 -1.792 -11.449 51.968 1.00 22.83 C ATOM 86 OG SER A 693 -0.891 -10.365 52.114 1.00 25.54 O ATOM 0 H SER A 693 -0.201 -12.634 50.535 1.00 21.24 H new ATOM 0 HA SER A 693 -2.778 -12.371 50.369 1.00 22.95 H new ATOM 0 HB2 SER A 693 -2.646 -11.218 52.366 1.00 22.83 H new ATOM 0 HB3 SER A 693 -1.454 -12.220 52.450 1.00 22.83 H new ATOM 0 HG SER A 693 -0.234 -10.476 51.602 1.00 25.54 H new ATOM 87 N ILE A 694 -1.269 -10.048 48.948 1.00 22.93 N ATOM 88 CA ILE A 694 -1.515 -8.829 48.183 1.00 23.06 C ATOM 89 C ILE A 694 -1.845 -9.089 46.715 1.00 22.47 C ATOM 90 O ILE A 694 -1.990 -8.151 45.934 1.00 21.36 O ATOM 91 CB ILE A 694 -0.336 -7.827 48.284 1.00 21.98 C ATOM 92 CG1 ILE A 694 0.959 -8.456 47.767 1.00 21.94 C ATOM 93 CG2 ILE A 694 -0.162 -7.386 49.737 1.00 22.71 C ATOM 94 CD1 ILE A 694 2.068 -7.434 47.553 1.00 21.44 C ATOM 0 H ILE A 694 -0.482 -10.387 48.872 1.00 22.93 H new ATOM 0 HA ILE A 694 -2.300 -8.434 48.593 1.00 23.06 H new ATOM 0 HB ILE A 694 -0.537 -7.054 47.734 1.00 21.98 H new ATOM 0 HG12 ILE A 694 1.262 -9.128 48.398 1.00 21.94 H new ATOM 0 HG13 ILE A 694 0.780 -8.913 46.930 1.00 21.94 H new ATOM 0 HG21 ILE A 694 0.576 -6.759 49.799 1.00 22.71 H new ATOM 0 HG22 ILE A 694 -0.976 -6.958 50.045 1.00 22.71 H new ATOM 0 HG23 ILE A 694 0.025 -8.160 50.290 1.00 22.71 H new ATOM 0 HD11 ILE A 694 2.863 -7.883 47.226 1.00 21.44 H new ATOM 0 HD12 ILE A 694 1.779 -6.774 46.903 1.00 21.44 H new ATOM 0 HD13 ILE A 694 2.268 -6.993 48.393 1.00 21.44 H new ATOM 95 N GLU A 695 -1.970 -10.362 46.342 1.00 21.06 N ATOM 96 CA GLU A 695 -2.312 -10.711 44.968 1.00 21.85 C ATOM 97 C GLU A 695 -3.707 -10.184 44.655 1.00 23.03 C ATOM 98 O GLU A 695 -4.580 -10.173 45.515 1.00 20.47 O ATOM 99 CB GLU A 695 -2.273 -12.226 44.776 1.00 22.72 C ATOM 100 CG GLU A 695 -0.883 -12.760 44.503 1.00 22.78 C ATOM 101 CD GLU A 695 -0.383 -12.360 43.122 1.00 23.78 C ATOM 102 OE1 GLU A 695 -0.865 -12.935 42.124 1.00 23.91 O ATOM 103 OE2 GLU A 695 0.482 -11.467 43.036 1.00 21.40 O ATOM 0 H GLU A 695 -1.861 -11.034 46.868 1.00 21.06 H new ATOM 0 HA GLU A 695 -1.666 -10.310 44.366 1.00 21.85 H new ATOM 0 HB2 GLU A 695 -2.627 -12.655 45.570 1.00 22.72 H new ATOM 0 HB3 GLU A 695 -2.856 -12.467 44.039 1.00 22.72 H new ATOM 0 HG2 GLU A 695 -0.271 -12.427 45.177 1.00 22.78 H new ATOM 0 HG3 GLU A 695 -0.888 -13.727 44.577 1.00 22.78 H new ATOM 104 N PRO A 696 -3.929 -9.733 43.416 1.00 24.78 N ATOM 105 CA PRO A 696 -5.230 -9.199 42.999 1.00 26.56 C ATOM 106 C PRO A 696 -6.341 -10.237 43.001 1.00 26.90 C ATOM 107 O PRO A 696 -6.080 -11.436 42.963 1.00 25.46 O ATOM 108 CB PRO A 696 -4.949 -8.664 41.593 1.00 27.53 C ATOM 109 CG PRO A 696 -3.908 -9.614 41.086 1.00 28.56 C ATOM 110 CD PRO A 696 -2.979 -9.743 42.289 1.00 27.09 C ATOM 0 HA PRO A 696 -5.559 -8.524 43.612 1.00 26.56 H new ATOM 0 HB2 PRO A 696 -5.745 -8.671 41.038 1.00 27.53 H new ATOM 0 HB3 PRO A 696 -4.625 -7.750 41.613 1.00 27.53 H new ATOM 0 HG2 PRO A 696 -4.290 -10.468 40.830 1.00 28.56 H new ATOM 0 HG3 PRO A 696 -3.447 -9.265 40.307 1.00 28.56 H new ATOM 0 HD2 PRO A 696 -2.460 -10.562 42.260 1.00 27.09 H new ATOM 0 HD3 PRO A 696 -2.348 -9.008 42.340 1.00 27.09 H new ATOM 111 N ASP A 697 -7.582 -9.769 43.066 1.00 28.23 N ATOM 112 CA ASP A 697 -8.721 -10.674 43.036 1.00 29.80 C ATOM 113 C ASP A 697 -8.924 -10.981 41.554 1.00 28.24 C ATOM 114 O ASP A 697 -8.237 -10.416 40.705 1.00 25.70 O ATOM 115 CB ASP A 697 -9.964 -9.996 43.622 1.00 32.95 C ATOM 116 CG ASP A 697 -11.114 -10.967 43.840 1.00 38.60 C ATOM 117 OD1 ASP A 697 -10.910 -12.191 43.658 1.00 38.39 O ATOM 118 OD2 ASP A 697 -12.223 -10.505 44.201 1.00 40.31 O ATOM 0 H ASP A 697 -7.784 -8.935 43.127 1.00 28.23 H new ATOM 0 HA ASP A 697 -8.571 -11.475 43.562 1.00 29.80 H new ATOM 0 HB2 ASP A 697 -9.733 -9.580 44.467 1.00 32.95 H new ATOM 0 HB3 ASP A 697 -10.253 -9.287 43.026 1.00 32.95 H new ATOM 119 N VAL A 698 -9.851 -11.876 41.240 1.00 27.74 N ATOM 120 CA VAL A 698 -10.101 -12.227 39.852 1.00 27.02 C ATOM 121 C VAL A 698 -10.426 -10.977 39.041 1.00 25.35 C ATOM 122 O VAL A 698 -11.157 -10.095 39.492 1.00 24.80 O ATOM 123 CB VAL A 698 -11.280 -13.221 39.725 1.00 28.73 C ATOM 124 CG1 VAL A 698 -12.590 -12.526 40.073 1.00 31.01 C ATOM 125 CG2 VAL A 698 -11.335 -13.781 38.319 1.00 29.79 C ATOM 0 H VAL A 698 -10.343 -12.289 41.812 1.00 27.74 H new ATOM 0 HA VAL A 698 -9.296 -12.647 39.510 1.00 27.02 H new ATOM 0 HB VAL A 698 -11.145 -13.954 40.346 1.00 28.73 H new ATOM 0 HG11 VAL A 698 -13.323 -13.156 39.991 1.00 31.01 H new ATOM 0 HG12 VAL A 698 -12.549 -12.196 40.984 1.00 31.01 H new ATOM 0 HG13 VAL A 698 -12.733 -11.783 39.466 1.00 31.01 H new ATOM 0 HG21 VAL A 698 -12.076 -14.403 38.247 1.00 29.79 H new ATOM 0 HG22 VAL A 698 -11.459 -13.056 37.686 1.00 29.79 H new ATOM 0 HG23 VAL A 698 -10.505 -14.243 38.122 1.00 29.79 H new ATOM 126 N ILE A 699 -9.869 -10.894 37.840 1.00 24.92 N ATOM 127 CA ILE A 699 -10.130 -9.754 36.976 1.00 22.91 C ATOM 128 C ILE A 699 -10.826 -10.227 35.703 1.00 23.78 C ATOM 129 O ILE A 699 -10.319 -11.097 34.988 1.00 21.48 O ATOM 130 CB ILE A 699 -8.824 -9.026 36.604 1.00 22.73 C ATOM 131 CG1 ILE A 699 -8.160 -8.474 37.872 1.00 22.03 C ATOM 132 CG2 ILE A 699 -9.124 -7.900 35.613 1.00 22.17 C ATOM 133 CD1 ILE A 699 -6.826 -7.804 37.624 1.00 19.92 C ATOM 0 H ILE A 699 -9.339 -11.485 37.508 1.00 24.92 H new ATOM 0 HA ILE A 699 -10.700 -9.134 37.457 1.00 22.91 H new ATOM 0 HB ILE A 699 -8.212 -9.650 36.183 1.00 22.73 H new ATOM 0 HG12 ILE A 699 -8.760 -7.836 38.289 1.00 22.03 H new ATOM 0 HG13 ILE A 699 -8.035 -9.200 38.503 1.00 22.03 H new ATOM 0 HG21 ILE A 699 -8.300 -7.444 35.381 1.00 22.17 H new ATOM 0 HG22 ILE A 699 -9.523 -8.272 34.811 1.00 22.17 H new ATOM 0 HG23 ILE A 699 -9.739 -7.268 36.017 1.00 22.17 H new ATOM 0 HD11 ILE A 699 -6.465 -7.480 38.464 1.00 19.92 H new ATOM 0 HD12 ILE A 699 -6.210 -8.443 37.233 1.00 19.92 H new ATOM 0 HD13 ILE A 699 -6.946 -7.058 37.016 1.00 19.92 H new ATOM 134 N TYR A 700 -11.998 -9.666 35.430 1.00 23.35 N ATOM 135 CA TYR A 700 -12.740 -10.034 34.230 1.00 25.20 C ATOM 136 C TYR A 700 -12.423 -9.089 33.081 1.00 25.57 C ATOM 137 O TYR A 700 -12.067 -7.927 33.294 1.00 24.73 O ATOM 138 CB TYR A 700 -14.246 -10.008 34.490 1.00 26.50 C ATOM 139 CG TYR A 700 -14.725 -11.036 35.484 1.00 29.26 C ATOM 140 CD1 TYR A 700 -14.698 -10.777 36.846 1.00 30.35 C ATOM 141 CD2 TYR A 700 -15.198 -12.272 35.060 1.00 30.48 C ATOM 142 CE1 TYR A 700 -15.130 -11.714 37.760 1.00 32.26 C ATOM 143 CE2 TYR A 700 -15.631 -13.222 35.974 1.00 32.50 C ATOM 144 CZ TYR A 700 -15.594 -12.933 37.321 1.00 31.90 C ATOM 145 OH TYR A 700 -16.026 -13.862 38.238 1.00 35.98 O ATOM 0 H TYR A 700 -12.380 -9.074 35.923 1.00 23.35 H new ATOM 0 HA TYR A 700 -12.469 -10.934 33.990 1.00 25.20 H new ATOM 0 HB2 TYR A 700 -14.493 -9.126 34.809 1.00 26.50 H new ATOM 0 HB3 TYR A 700 -14.711 -10.146 33.650 1.00 26.50 H new ATOM 0 HD1 TYR A 700 -14.383 -9.956 37.148 1.00 30.35 H new ATOM 0 HD2 TYR A 700 -15.225 -12.465 34.151 1.00 30.48 H new ATOM 0 HE1 TYR A 700 -15.108 -11.523 38.670 1.00 32.26 H new ATOM 0 HE2 TYR A 700 -15.944 -14.047 35.680 1.00 32.50 H new ATOM 0 HH TYR A 700 -16.281 -14.554 37.837 1.00 35.98 H new ATOM 146 N ALA A 701 -12.545 -9.592 31.860 1.00 25.67 N ATOM 147 CA ALA A 701 -12.296 -8.768 30.688 1.00 27.15 C ATOM 148 C ALA A 701 -13.584 -8.019 30.350 1.00 28.61 C ATOM 149 O ALA A 701 -13.575 -7.060 29.582 1.00 29.00 O ATOM 150 CB ALA A 701 -11.867 -9.640 29.512 1.00 24.46 C ATOM 0 H ALA A 701 -12.770 -10.404 31.689 1.00 25.67 H new ATOM 0 HA ALA A 701 -11.582 -8.137 30.869 1.00 27.15 H new ATOM 0 HB1 ALA A 701 -11.704 -9.080 28.737 1.00 24.46 H new ATOM 0 HB2 ALA A 701 -11.055 -10.118 29.742 1.00 24.46 H new ATOM 0 HB3 ALA A 701 -12.569 -10.277 29.308 1.00 24.46 H new ATOM 151 N GLY A 702 -14.691 -8.460 30.938 1.00 29.98 N ATOM 152 CA GLY A 702 -15.967 -7.825 30.670 1.00 34.23 C ATOM 153 C GLY A 702 -16.356 -8.086 29.226 1.00 38.07 C ATOM 154 O GLY A 702 -17.029 -7.287 28.585 1.00 37.88 O ATOM 0 H GLY A 702 -14.722 -9.119 31.489 1.00 29.98 H new ATOM 0 HA2 GLY A 702 -16.647 -8.173 31.268 1.00 34.23 H new ATOM 0 HA3 GLY A 702 -15.907 -6.871 30.834 1.00 34.23 H new ATOM 155 N HIS A 703 -15.914 -9.226 28.713 1.00 40.53 N ATOM 156 CA HIS A 703 -16.168 -9.604 27.336 1.00 45.21 C ATOM 157 C HIS A 703 -17.631 -9.947 27.066 1.00 48.55 C ATOM 158 O HIS A 703 -18.311 -10.543 27.904 1.00 48.68 O ATOM 159 CB HIS A 703 -15.297 -10.802 26.960 1.00 45.74 C ATOM 160 CG HIS A 703 -15.398 -11.196 25.516 1.00 46.56 C ATOM 161 ND1 HIS A 703 -14.996 -10.369 24.496 1.00 47.28 N ATOM 162 CD2 HIS A 703 -15.869 -12.322 24.945 1.00 46.96 C ATOM 163 CE1 HIS A 703 -15.217 -10.978 23.335 1.00 47.28 C ATOM 164 NE2 HIS A 703 -15.740 -12.154 23.580 1.00 47.76 N ATOM 0 H HIS A 703 -15.457 -9.803 29.157 1.00 40.53 H new ATOM 0 HA HIS A 703 -15.948 -8.832 26.792 1.00 45.21 H new ATOM 0 HB2 HIS A 703 -14.372 -10.596 27.166 1.00 45.74 H new ATOM 0 HB3 HIS A 703 -15.548 -11.559 27.511 1.00 45.74 H new ATOM 0 HD1 HIS A 703 -14.657 -9.585 24.593 1.00 47.28 H new ATOM 0 HD2 HIS A 703 -16.213 -13.066 25.384 1.00 46.96 H new ATOM 0 HE1 HIS A 703 -15.032 -10.629 22.493 1.00 47.28 H new ATOM 165 N ASP A 704 -18.107 -9.598 25.878 1.00 52.61 N ATOM 166 CA ASP A 704 -19.484 -9.884 25.516 1.00 56.51 C ATOM 167 C ASP A 704 -19.580 -11.270 24.912 1.00 58.48 C ATOM 168 O ASP A 704 -18.929 -11.569 23.908 1.00 58.96 O ATOM 169 CB ASP A 704 -20.013 -8.844 24.531 1.00 58.23 C ATOM 170 CG ASP A 704 -21.515 -8.930 24.350 1.00 60.44 C ATOM 171 OD1 ASP A 704 -22.190 -9.290 25.341 1.00 62.13 O ATOM 172 OD2 ASP A 704 -22.007 -8.632 23.241 1.00 61.38 O ATOM 0 H ASP A 704 -17.650 -9.196 25.270 1.00 52.61 H new ATOM 0 HA ASP A 704 -20.028 -9.847 26.318 1.00 56.51 H new ATOM 0 HB2 ASP A 704 -19.778 -7.957 24.844 1.00 58.23 H new ATOM 0 HB3 ASP A 704 -19.579 -8.966 23.672 1.00 58.23 H new ATOM 173 N ASN A 705 -20.391 -12.118 25.530 1.00 60.59 N ATOM 174 CA ASN A 705 -20.553 -13.481 25.052 1.00 62.60 C ATOM 175 C ASN A 705 -21.791 -13.684 24.197 1.00 64.10 C ATOM 176 O ASN A 705 -21.963 -14.736 23.571 1.00 64.14 O ATOM 177 CB ASN A 705 -20.546 -14.449 26.229 1.00 62.67 C ATOM 178 CG ASN A 705 -19.177 -15.053 26.463 1.00 63.00 C ATOM 179 OD1 ASN A 705 -18.188 -14.605 25.875 1.00 63.62 O ATOM 180 ND2 ASN A 705 -19.105 -16.064 27.313 1.00 63.29 N ATOM 0 H ASN A 705 -20.856 -11.923 26.227 1.00 60.59 H new ATOM 0 HA ASN A 705 -19.798 -13.663 24.471 1.00 62.60 H new ATOM 0 HB2 ASN A 705 -20.834 -13.984 27.030 1.00 62.67 H new ATOM 0 HB3 ASN A 705 -21.187 -15.158 26.067 1.00 62.67 H new ATOM 0 HD21 ASN A 705 -18.347 -16.437 27.475 1.00 63.29 H new ATOM 0 HD22 ASN A 705 -19.816 -16.349 27.704 1.00 63.29 H new ATOM 181 N THR A 706 -22.639 -12.666 24.159 1.00 65.38 N ATOM 182 CA THR A 706 -23.856 -12.705 23.375 1.00 66.43 C ATOM 183 C THR A 706 -23.434 -12.541 21.926 1.00 67.11 C ATOM 184 O THR A 706 -23.437 -13.508 21.169 1.00 68.14 O ATOM 185 CB THR A 706 -24.789 -11.564 23.799 1.00 66.31 C ATOM 186 OG1 THR A 706 -24.161 -10.312 23.508 1.00 66.31 O ATOM 187 CG2 THR A 706 -25.062 -11.630 25.288 1.00 65.99 C ATOM 0 H THR A 706 -22.522 -11.931 24.590 1.00 65.38 H new ATOM 0 HA THR A 706 -24.338 -13.537 23.504 1.00 66.43 H new ATOM 0 HB THR A 706 -25.625 -11.648 23.314 1.00 66.31 H new ATOM 0 HG1 THR A 706 -24.669 -9.684 23.738 1.00 66.31 H new ATOM 0 HG21 THR A 706 -25.653 -10.903 25.541 1.00 65.99 H new ATOM 0 HG22 THR A 706 -25.482 -12.477 25.503 1.00 65.99 H new ATOM 0 HG23 THR A 706 -24.226 -11.551 25.774 1.00 65.99 H new ATOM 188 N LYS A 707 -23.032 -11.329 21.560 1.00 67.59 N ATOM 189 CA LYS A 707 -22.592 -11.040 20.200 1.00 67.90 C ATOM 190 C LYS A 707 -21.287 -11.771 19.924 1.00 67.96 C ATOM 191 O LYS A 707 -21.251 -12.728 19.161 1.00 68.20 O ATOM 192 CB LYS A 707 -22.394 -9.530 20.013 1.00 68.04 C ATOM 0 H LYS A 707 -23.007 -10.653 22.091 1.00 67.59 H new ATOM 0 HA LYS A 707 -23.271 -11.342 19.577 1.00 67.90 H new ATOM 193 N ASP A 709 -18.156 -13.221 18.126 1.00 58.45 N ATOM 194 CA ASP A 709 -16.932 -12.461 18.365 1.00 58.49 C ATOM 195 C ASP A 709 -16.214 -12.124 17.065 1.00 58.09 C ATOM 196 O ASP A 709 -16.652 -12.509 15.981 1.00 58.49 O ATOM 197 CB ASP A 709 -15.993 -13.246 19.284 1.00 58.73 C ATOM 0 HA ASP A 709 -17.185 -11.628 18.793 1.00 58.49 H new ATOM 198 N THR A 710 -15.102 -11.408 17.176 1.00 57.16 N ATOM 199 CA THR A 710 -14.363 -11.013 15.987 1.00 55.37 C ATOM 200 C THR A 710 -12.988 -10.451 16.321 1.00 53.77 C ATOM 201 O THR A 710 -12.602 -10.399 17.488 1.00 54.36 O ATOM 202 CB THR A 710 -15.165 -9.961 15.199 1.00 55.67 C ATOM 203 OG1 THR A 710 -14.522 -9.694 13.951 1.00 57.42 O ATOM 204 CG2 THR A 710 -15.260 -8.676 15.979 1.00 55.84 C ATOM 0 H THR A 710 -14.762 -11.144 17.921 1.00 57.16 H new ATOM 0 HA THR A 710 -14.234 -11.811 15.451 1.00 55.37 H new ATOM 0 HB THR A 710 -16.056 -10.311 15.045 1.00 55.67 H new ATOM 0 HG1 THR A 710 -14.328 -10.419 13.574 1.00 57.42 H new ATOM 0 HG21 THR A 710 -15.767 -8.025 15.470 1.00 55.84 H new ATOM 0 HG22 THR A 710 -15.705 -8.843 16.825 1.00 55.84 H new ATOM 0 HG23 THR A 710 -14.369 -8.332 16.146 1.00 55.84 H new ATOM 205 N SER A 711 -12.251 -10.037 15.296 1.00 51.52 N ATOM 206 CA SER A 711 -10.912 -9.491 15.490 1.00 50.29 C ATOM 207 C SER A 711 -10.924 -8.287 16.418 1.00 48.44 C ATOM 208 O SER A 711 -10.405 -8.358 17.530 1.00 48.38 O ATOM 209 CB SER A 711 -10.301 -9.095 14.148 1.00 50.88 C ATOM 210 OG SER A 711 -10.092 -10.250 13.348 1.00 53.78 O ATOM 0 H SER A 711 -12.509 -10.064 14.476 1.00 51.52 H new ATOM 0 HA SER A 711 -10.373 -10.185 15.901 1.00 50.29 H new ATOM 0 HB2 SER A 711 -10.888 -8.475 13.687 1.00 50.88 H new ATOM 0 HB3 SER A 711 -9.459 -8.635 14.291 1.00 50.88 H new ATOM 0 HG SER A 711 -9.757 -10.024 12.611 1.00 53.78 H new ATOM 211 N SER A 712 -11.513 -7.187 15.959 1.00 46.21 N ATOM 212 CA SER A 712 -11.579 -5.965 16.749 1.00 44.56 C ATOM 213 C SER A 712 -12.282 -6.207 18.075 1.00 41.86 C ATOM 214 O SER A 712 -11.899 -5.638 19.096 1.00 41.28 O ATOM 215 CB SER A 712 -12.300 -4.881 15.958 1.00 46.11 C ATOM 216 OG SER A 712 -11.623 -4.671 14.729 1.00 49.66 O ATOM 0 H SER A 712 -11.883 -7.129 15.185 1.00 46.21 H new ATOM 0 HA SER A 712 -10.674 -5.674 16.941 1.00 44.56 H new ATOM 0 HB2 SER A 712 -13.219 -5.143 15.793 1.00 46.11 H new ATOM 0 HB3 SER A 712 -12.328 -4.057 16.469 1.00 46.11 H new ATOM 0 HG SER A 712 -11.413 -3.861 14.659 1.00 49.66 H new ATOM 217 N SER A 713 -13.303 -7.054 18.062 1.00 38.57 N ATOM 218 CA SER A 713 -14.050 -7.370 19.271 1.00 35.65 C ATOM 219 C SER A 713 -13.166 -8.083 20.290 1.00 33.21 C ATOM 220 O SER A 713 -13.193 -7.752 21.479 1.00 30.95 O ATOM 221 CB SER A 713 -15.249 -8.254 18.928 1.00 36.70 C ATOM 222 OG SER A 713 -15.748 -8.927 20.072 1.00 37.64 O ATOM 0 H SER A 713 -13.581 -7.460 17.357 1.00 38.57 H new ATOM 0 HA SER A 713 -14.360 -6.537 19.660 1.00 35.65 H new ATOM 0 HB2 SER A 713 -15.952 -7.710 18.540 1.00 36.70 H new ATOM 0 HB3 SER A 713 -14.990 -8.905 18.257 1.00 36.70 H new ATOM 0 HG SER A 713 -16.405 -9.402 19.853 1.00 37.64 H new ATOM 223 N LEU A 714 -12.396 -9.061 19.825 1.00 30.49 N ATOM 224 CA LEU A 714 -11.512 -9.810 20.705 1.00 28.80 C ATOM 225 C LEU A 714 -10.376 -8.914 21.166 1.00 26.77 C ATOM 226 O LEU A 714 -10.005 -8.947 22.335 1.00 23.72 O ATOM 227 CB LEU A 714 -10.942 -11.035 19.987 1.00 29.81 C ATOM 228 CG LEU A 714 -9.979 -11.870 20.805 1.00 30.51 C ATOM 229 CD1 LEU A 714 -10.683 -12.326 22.067 1.00 31.73 C ATOM 230 CD2 LEU A 714 -9.494 -13.046 19.982 1.00 32.95 C ATOM 0 H LEU A 714 -12.372 -9.306 19.001 1.00 30.49 H new ATOM 0 HA LEU A 714 -12.023 -10.113 21.472 1.00 28.80 H new ATOM 0 HB2 LEU A 714 -11.679 -11.599 19.706 1.00 29.81 H new ATOM 0 HB3 LEU A 714 -10.488 -10.739 19.182 1.00 29.81 H new ATOM 0 HG LEU A 714 -9.202 -11.346 21.055 1.00 30.51 H new ATOM 0 HD11 LEU A 714 -10.076 -12.863 22.600 1.00 31.73 H new ATOM 0 HD12 LEU A 714 -10.964 -11.551 22.579 1.00 31.73 H new ATOM 0 HD13 LEU A 714 -11.460 -12.856 21.831 1.00 31.73 H new ATOM 0 HD21 LEU A 714 -8.878 -13.578 20.509 1.00 32.95 H new ATOM 0 HD22 LEU A 714 -10.251 -13.593 19.721 1.00 32.95 H new ATOM 0 HD23 LEU A 714 -9.042 -12.721 19.188 1.00 32.95 H new ATOM 231 N LEU A 715 -9.841 -8.104 20.253 1.00 25.25 N ATOM 232 CA LEU A 715 -8.734 -7.211 20.580 1.00 22.63 C ATOM 233 C LEU A 715 -9.212 -6.136 21.550 1.00 21.98 C ATOM 234 O LEU A 715 -8.507 -5.796 22.500 1.00 21.57 O ATOM 235 CB LEU A 715 -8.165 -6.586 19.307 1.00 22.46 C ATOM 236 CG LEU A 715 -7.516 -7.586 18.356 1.00 22.43 C ATOM 237 CD1 LEU A 715 -7.036 -6.881 17.097 1.00 21.02 C ATOM 238 CD2 LEU A 715 -6.364 -8.269 19.082 1.00 20.37 C ATOM 0 H LEU A 715 -10.107 -8.058 19.436 1.00 25.25 H new ATOM 0 HA LEU A 715 -8.026 -7.719 21.006 1.00 22.63 H new ATOM 0 HB2 LEU A 715 -8.878 -6.125 18.838 1.00 22.46 H new ATOM 0 HB3 LEU A 715 -7.508 -5.916 19.553 1.00 22.46 H new ATOM 0 HG LEU A 715 -8.162 -8.257 18.084 1.00 22.43 H new ATOM 0 HD11 LEU A 715 -6.626 -7.527 16.501 1.00 21.02 H new ATOM 0 HD12 LEU A 715 -7.790 -6.464 16.652 1.00 21.02 H new ATOM 0 HD13 LEU A 715 -6.386 -6.202 17.334 1.00 21.02 H new ATOM 0 HD21 LEU A 715 -5.941 -8.909 18.488 1.00 20.37 H new ATOM 0 HD22 LEU A 715 -5.714 -7.603 19.356 1.00 20.37 H new ATOM 0 HD23 LEU A 715 -6.703 -8.730 19.865 1.00 20.37 H new ATOM 239 N THR A 716 -10.423 -5.631 21.341 1.00 21.40 N ATOM 240 CA THR A 716 -10.970 -4.606 22.220 1.00 21.07 C ATOM 241 C THR A 716 -11.143 -5.142 23.639 1.00 21.36 C ATOM 242 O THR A 716 -10.806 -4.458 24.610 1.00 19.29 O ATOM 243 CB THR A 716 -12.325 -4.081 21.688 1.00 22.00 C ATOM 244 OG1 THR A 716 -12.091 -3.227 20.557 1.00 23.15 O ATOM 245 CG2 THR A 716 -13.053 -3.289 22.758 1.00 20.99 C ATOM 0 H THR A 716 -10.942 -5.868 20.698 1.00 21.40 H new ATOM 0 HA THR A 716 -10.339 -3.870 22.238 1.00 21.07 H new ATOM 0 HB THR A 716 -12.871 -4.841 21.432 1.00 22.00 H new ATOM 0 HG1 THR A 716 -11.978 -3.697 19.870 1.00 23.15 H new ATOM 0 HG21 THR A 716 -13.898 -2.969 22.405 1.00 20.99 H new ATOM 0 HG22 THR A 716 -13.218 -3.858 23.526 1.00 20.99 H new ATOM 0 HG23 THR A 716 -12.509 -2.533 23.028 1.00 20.99 H new ATOM 246 N SER A 717 -11.655 -6.365 23.757 1.00 21.44 N ATOM 247 CA SER A 717 -11.865 -6.981 25.061 1.00 21.51 C ATOM 248 C SER A 717 -10.538 -7.215 25.756 1.00 22.15 C ATOM 249 O SER A 717 -10.429 -7.057 26.976 1.00 22.08 O ATOM 250 CB SER A 717 -12.609 -8.308 24.916 1.00 22.82 C ATOM 251 OG SER A 717 -13.999 -8.124 25.156 1.00 28.25 O ATOM 0 H SER A 717 -11.888 -6.855 23.090 1.00 21.44 H new ATOM 0 HA SER A 717 -12.402 -6.376 25.597 1.00 21.51 H new ATOM 0 HB2 SER A 717 -12.473 -8.666 24.025 1.00 22.82 H new ATOM 0 HB3 SER A 717 -12.250 -8.957 25.541 1.00 22.82 H new ATOM 0 HG SER A 717 -14.105 -7.654 25.844 1.00 28.25 H new ATOM 252 N LEU A 718 -9.530 -7.599 24.982 1.00 19.92 N ATOM 253 CA LEU A 718 -8.212 -7.850 25.544 1.00 21.71 C ATOM 254 C LEU A 718 -7.648 -6.531 26.068 1.00 20.83 C ATOM 255 O LEU A 718 -6.964 -6.507 27.098 1.00 20.54 O ATOM 256 CB LEU A 718 -7.289 -8.440 24.485 1.00 21.34 C ATOM 257 CG LEU A 718 -7.499 -9.901 24.125 1.00 22.77 C ATOM 258 CD1 LEU A 718 -6.611 -10.268 22.939 1.00 22.12 C ATOM 259 CD2 LEU A 718 -7.192 -10.760 25.347 1.00 24.53 C ATOM 0 H LEU A 718 -9.589 -7.719 24.132 1.00 19.92 H new ATOM 0 HA LEU A 718 -8.280 -8.489 26.271 1.00 21.71 H new ATOM 0 HB2 LEU A 718 -7.383 -7.913 23.676 1.00 21.34 H new ATOM 0 HB3 LEU A 718 -6.374 -8.333 24.789 1.00 21.34 H new ATOM 0 HG LEU A 718 -8.420 -10.059 23.864 1.00 22.77 H new ATOM 0 HD11 LEU A 718 -6.746 -11.201 22.710 1.00 22.12 H new ATOM 0 HD12 LEU A 718 -6.841 -9.712 22.178 1.00 22.12 H new ATOM 0 HD13 LEU A 718 -5.681 -10.124 23.174 1.00 22.12 H new ATOM 0 HD21 LEU A 718 -7.323 -11.695 25.127 1.00 24.53 H new ATOM 0 HD22 LEU A 718 -6.272 -10.619 25.619 1.00 24.53 H new ATOM 0 HD23 LEU A 718 -7.785 -10.513 26.074 1.00 24.53 H new ATOM 260 N ASN A 719 -7.944 -5.440 25.365 1.00 20.32 N ATOM 261 CA ASN A 719 -7.485 -4.118 25.782 1.00 21.03 C ATOM 262 C ASN A 719 -8.225 -3.683 27.039 1.00 21.21 C ATOM 263 O ASN A 719 -7.644 -3.029 27.907 1.00 20.59 O ATOM 264 CB ASN A 719 -7.706 -3.084 24.676 1.00 20.80 C ATOM 265 CG ASN A 719 -6.652 -3.155 23.591 1.00 22.40 C ATOM 266 OD1 ASN A 719 -5.571 -3.714 23.797 1.00 22.00 O ATOM 267 ND2 ASN A 719 -6.949 -2.573 22.433 1.00 20.34 N ATOM 0 H ASN A 719 -8.410 -5.444 24.642 1.00 20.32 H new ATOM 0 HA ASN A 719 -6.534 -4.175 25.966 1.00 21.03 H new ATOM 0 HB2 ASN A 719 -8.581 -3.221 24.281 1.00 20.80 H new ATOM 0 HB3 ASN A 719 -7.706 -2.195 25.064 1.00 20.80 H new ATOM 0 HD21 ASN A 719 -6.377 -2.577 21.791 1.00 20.34 H new ATOM 0 HD22 ASN A 719 -7.713 -2.193 22.326 1.00 20.34 H new ATOM 268 N GLN A 720 -9.505 -4.032 27.134 1.00 21.60 N ATOM 269 CA GLN A 720 -10.292 -3.675 28.308 1.00 23.49 C ATOM 270 C GLN A 720 -9.670 -4.403 29.491 1.00 23.87 C ATOM 271 O GLN A 720 -9.496 -3.828 30.578 1.00 21.87 O ATOM 272 CB GLN A 720 -11.747 -4.109 28.138 1.00 24.38 C ATOM 273 CG GLN A 720 -12.561 -3.987 29.420 1.00 29.23 C ATOM 274 CD GLN A 720 -12.728 -2.552 29.869 1.00 32.67 C ATOM 275 OE1 GLN A 720 -12.876 -2.281 31.058 1.00 34.78 O ATOM 276 NE2 GLN A 720 -12.739 -1.625 28.917 1.00 33.94 N ATOM 0 H GLN A 720 -9.934 -4.473 26.533 1.00 21.60 H new ATOM 0 HA GLN A 720 -10.288 -2.714 28.441 1.00 23.49 H new ATOM 0 HB2 GLN A 720 -12.161 -3.570 27.446 1.00 24.38 H new ATOM 0 HB3 GLN A 720 -11.771 -5.029 27.833 1.00 24.38 H new ATOM 0 HG2 GLN A 720 -13.436 -4.383 29.283 1.00 29.23 H new ATOM 0 HG3 GLN A 720 -12.127 -4.494 30.124 1.00 29.23 H new ATOM 0 HE21 GLN A 720 -12.632 -1.852 28.094 1.00 33.94 H new ATOM 0 HE22 GLN A 720 -12.853 -0.798 29.123 1.00 33.94 H new ATOM 277 N LEU A 721 -9.337 -5.671 29.268 1.00 21.97 N ATOM 278 CA LEU A 721 -8.715 -6.493 30.304 1.00 20.89 C ATOM 279 C LEU A 721 -7.378 -5.865 30.667 1.00 18.73 C ATOM 280 O LEU A 721 -6.996 -5.844 31.831 1.00 17.97 O ATOM 281 CB LEU A 721 -8.500 -7.930 29.797 1.00 19.15 C ATOM 282 CG LEU A 721 -7.707 -8.885 30.677 1.00 18.77 C ATOM 283 CD1 LEU A 721 -8.425 -9.053 32.009 1.00 19.32 C ATOM 284 CD2 LEU A 721 -7.536 -10.222 29.967 1.00 18.18 C ATOM 0 H LEU A 721 -9.463 -6.077 28.520 1.00 21.97 H new ATOM 0 HA LEU A 721 -9.292 -6.533 31.082 1.00 20.89 H new ATOM 0 HB2 LEU A 721 -9.373 -8.324 29.641 1.00 19.15 H new ATOM 0 HB3 LEU A 721 -8.054 -7.878 28.937 1.00 19.15 H new ATOM 0 HG LEU A 721 -6.823 -8.523 30.847 1.00 18.77 H new ATOM 0 HD11 LEU A 721 -7.923 -9.661 32.573 1.00 19.32 H new ATOM 0 HD12 LEU A 721 -8.498 -8.191 32.448 1.00 19.32 H new ATOM 0 HD13 LEU A 721 -9.312 -9.414 31.855 1.00 19.32 H new ATOM 0 HD21 LEU A 721 -7.030 -10.826 30.532 1.00 18.18 H new ATOM 0 HD22 LEU A 721 -8.408 -10.605 29.784 1.00 18.18 H new ATOM 0 HD23 LEU A 721 -7.061 -10.087 29.132 1.00 18.18 H new ATOM 285 N GLY A 722 -6.680 -5.349 29.663 1.00 18.02 N ATOM 286 CA GLY A 722 -5.384 -4.732 29.894 1.00 18.58 C ATOM 287 C GLY A 722 -5.484 -3.502 30.786 1.00 19.33 C ATOM 288 O GLY A 722 -4.592 -3.247 31.603 1.00 18.69 O ATOM 0 H GLY A 722 -6.939 -5.346 28.843 1.00 18.02 H new ATOM 0 HA2 GLY A 722 -4.788 -5.379 30.303 1.00 18.58 H new ATOM 0 HA3 GLY A 722 -4.990 -4.482 29.043 1.00 18.58 H new ATOM 289 N GLU A 723 -6.559 -2.737 30.623 1.00 18.13 N ATOM 290 CA GLU A 723 -6.795 -1.537 31.420 1.00 18.79 C ATOM 291 C GLU A 723 -7.019 -1.925 32.878 1.00 20.46 C ATOM 292 O GLU A 723 -6.468 -1.298 33.791 1.00 20.60 O ATOM 293 CB GLU A 723 -8.029 -0.808 30.888 1.00 19.65 C ATOM 294 CG GLU A 723 -8.340 0.522 31.565 1.00 19.27 C ATOM 295 CD GLU A 723 -7.429 1.645 31.095 1.00 21.43 C ATOM 296 OE1 GLU A 723 -7.766 2.823 31.344 1.00 21.64 O ATOM 297 OE2 GLU A 723 -6.380 1.339 30.494 1.00 19.05 O ATOM 0 H GLU A 723 -7.175 -2.900 30.045 1.00 18.13 H new ATOM 0 HA GLU A 723 -6.023 -0.953 31.360 1.00 18.79 H new ATOM 0 HB2 GLU A 723 -7.910 -0.651 29.938 1.00 19.65 H new ATOM 0 HB3 GLU A 723 -8.798 -1.391 30.985 1.00 19.65 H new ATOM 0 HG2 GLU A 723 -9.263 0.763 31.388 1.00 19.27 H new ATOM 0 HG3 GLU A 723 -8.253 0.420 32.526 1.00 19.27 H new ATOM 298 N ARG A 724 -7.832 -2.958 33.094 1.00 20.11 N ATOM 299 CA ARG A 724 -8.127 -3.418 34.445 1.00 21.08 C ATOM 300 C ARG A 724 -6.903 -4.056 35.093 1.00 21.53 C ATOM 301 O ARG A 724 -6.739 -3.991 36.310 1.00 21.61 O ATOM 302 CB ARG A 724 -9.301 -4.403 34.428 1.00 22.07 C ATOM 303 CG ARG A 724 -10.575 -3.779 33.888 1.00 24.24 C ATOM 304 CD ARG A 724 -11.711 -4.786 33.824 1.00 25.26 C ATOM 305 NE ARG A 724 -12.922 -4.163 33.299 1.00 27.02 N ATOM 306 CZ ARG A 724 -14.064 -4.813 33.087 1.00 28.21 C ATOM 307 NH1 ARG A 724 -14.162 -6.118 33.356 1.00 26.62 N ATOM 308 NH2 ARG A 724 -15.118 -4.168 32.603 1.00 30.06 N ATOM 0 H ARG A 724 -8.222 -3.404 32.471 1.00 20.11 H new ATOM 0 HA ARG A 724 -8.375 -2.646 34.977 1.00 21.08 H new ATOM 0 HB2 ARG A 724 -9.066 -5.172 33.886 1.00 22.07 H new ATOM 0 HB3 ARG A 724 -9.460 -4.728 35.328 1.00 22.07 H new ATOM 0 HG2 ARG A 724 -10.835 -3.033 34.452 1.00 24.24 H new ATOM 0 HG3 ARG A 724 -10.410 -3.421 33.002 1.00 24.24 H new ATOM 0 HD2 ARG A 724 -11.456 -5.533 33.261 1.00 25.26 H new ATOM 0 HD3 ARG A 724 -11.883 -5.144 34.709 1.00 25.26 H new ATOM 0 HE ARG A 724 -12.896 -3.323 33.115 1.00 27.02 H new ATOM 0 HH11 ARG A 724 -13.484 -6.545 33.669 1.00 26.62 H new ATOM 0 HH12 ARG A 724 -14.903 -6.531 33.216 1.00 26.62 H new ATOM 0 HH21 ARG A 724 -15.064 -3.328 32.426 1.00 30.06 H new ATOM 0 HH22 ARG A 724 -15.855 -4.590 32.467 1.00 30.06 H new ATOM 309 N GLN A 725 -6.037 -4.656 34.284 1.00 21.98 N ATOM 310 CA GLN A 725 -4.830 -5.289 34.801 1.00 22.30 C ATOM 311 C GLN A 725 -3.828 -4.224 35.250 1.00 22.41 C ATOM 312 O GLN A 725 -3.200 -4.363 36.307 1.00 22.86 O ATOM 313 CB GLN A 725 -4.207 -6.179 33.724 1.00 24.88 C ATOM 314 CG GLN A 725 -4.921 -7.517 33.523 1.00 28.09 C ATOM 315 CD GLN A 725 -4.601 -8.517 34.622 1.00 31.77 C ATOM 316 OE1 GLN A 725 -3.524 -8.266 35.363 1.00 32.61 O flip ATOM 317 NE2 GLN A 725 -5.304 -9.514 34.790 1.00 32.41 N flip ATOM 0 H GLN A 725 -6.130 -4.708 33.431 1.00 21.98 H new ATOM 0 HA GLN A 725 -5.064 -5.838 35.566 1.00 22.30 H new ATOM 0 HB2 GLN A 725 -4.204 -5.696 32.883 1.00 24.88 H new ATOM 0 HB3 GLN A 725 -3.281 -6.350 33.956 1.00 24.88 H new ATOM 0 HG2 GLN A 725 -5.879 -7.368 33.494 1.00 28.09 H new ATOM 0 HG3 GLN A 725 -4.666 -7.891 32.665 1.00 28.09 H new ATOM 0 HE21 GLN A 725 -5.993 -9.643 34.292 1.00 32.41 H new ATOM 0 HE22 GLN A 725 -5.106 -10.081 35.406 1.00 32.41 H new ATOM 318 N LEU A 726 -3.675 -3.163 34.457 1.00 20.57 N ATOM 319 CA LEU A 726 -2.742 -2.085 34.801 1.00 19.22 C ATOM 320 C LEU A 726 -3.142 -1.465 36.139 1.00 19.13 C ATOM 321 O LEU A 726 -2.285 -1.224 36.996 1.00 19.04 O ATOM 322 CB LEU A 726 -2.724 -1.018 33.700 1.00 18.47 C ATOM 323 CG LEU A 726 -1.885 0.229 33.943 1.00 17.10 C ATOM 324 CD1 LEU A 726 -0.435 -0.166 34.167 1.00 15.01 C ATOM 325 CD2 LEU A 726 -2.027 1.182 32.758 1.00 18.13 C ATOM 0 H LEU A 726 -4.099 -3.047 33.718 1.00 20.57 H new ATOM 0 HA LEU A 726 -1.849 -2.455 34.879 1.00 19.22 H new ATOM 0 HB2 LEU A 726 -2.409 -1.436 32.883 1.00 18.47 H new ATOM 0 HB3 LEU A 726 -3.639 -0.737 33.541 1.00 18.47 H new ATOM 0 HG LEU A 726 -2.198 0.688 34.738 1.00 17.10 H new ATOM 0 HD11 LEU A 726 0.097 0.630 34.322 1.00 15.01 H new ATOM 0 HD12 LEU A 726 -0.374 -0.750 34.939 1.00 15.01 H new ATOM 0 HD13 LEU A 726 -0.101 -0.631 33.384 1.00 15.01 H new ATOM 0 HD21 LEU A 726 -1.492 1.976 32.915 1.00 18.13 H new ATOM 0 HD22 LEU A 726 -1.722 0.741 31.950 1.00 18.13 H new ATOM 0 HD23 LEU A 726 -2.958 1.435 32.656 1.00 18.13 H new ATOM 326 N LEU A 727 -4.436 -1.218 36.325 1.00 18.45 N ATOM 327 CA LEU A 727 -4.919 -0.640 37.578 1.00 18.76 C ATOM 328 C LEU A 727 -4.553 -1.575 38.715 1.00 19.81 C ATOM 329 O LEU A 727 -4.175 -1.130 39.800 1.00 20.36 O ATOM 330 CB LEU A 727 -6.437 -0.462 37.542 1.00 16.99 C ATOM 331 CG LEU A 727 -7.115 0.021 38.819 1.00 16.67 C ATOM 332 CD1 LEU A 727 -6.562 1.373 39.200 1.00 17.26 C ATOM 333 CD2 LEU A 727 -8.625 0.089 38.604 1.00 19.20 C ATOM 0 H LEU A 727 -5.048 -1.376 35.742 1.00 18.45 H new ATOM 0 HA LEU A 727 -4.510 0.230 37.705 1.00 18.76 H new ATOM 0 HB2 LEU A 727 -6.649 0.166 36.834 1.00 16.99 H new ATOM 0 HB3 LEU A 727 -6.833 -1.312 37.295 1.00 16.99 H new ATOM 0 HG LEU A 727 -6.938 -0.600 39.543 1.00 16.67 H new ATOM 0 HD11 LEU A 727 -6.993 1.682 40.013 1.00 17.26 H new ATOM 0 HD12 LEU A 727 -5.606 1.302 39.348 1.00 17.26 H new ATOM 0 HD13 LEU A 727 -6.732 2.006 38.484 1.00 17.26 H new ATOM 0 HD21 LEU A 727 -9.054 0.396 39.418 1.00 19.20 H new ATOM 0 HD22 LEU A 727 -8.822 0.706 37.882 1.00 19.20 H new ATOM 0 HD23 LEU A 727 -8.960 -0.792 38.376 1.00 19.20 H new ATOM 334 N SER A 728 -4.670 -2.875 38.456 1.00 18.62 N ATOM 335 CA SER A 728 -4.371 -3.894 39.448 1.00 19.75 C ATOM 336 C SER A 728 -2.886 -3.887 39.816 1.00 18.62 C ATOM 337 O SER A 728 -2.539 -3.931 40.997 1.00 18.09 O ATOM 338 CB SER A 728 -4.774 -5.266 38.909 1.00 21.46 C ATOM 339 OG SER A 728 -4.903 -6.205 39.963 1.00 26.35 O ATOM 0 H SER A 728 -4.926 -3.188 37.697 1.00 18.62 H new ATOM 0 HA SER A 728 -4.878 -3.700 40.252 1.00 19.75 H new ATOM 0 HB2 SER A 728 -5.614 -5.195 38.429 1.00 21.46 H new ATOM 0 HB3 SER A 728 -4.110 -5.576 38.274 1.00 21.46 H new ATOM 0 HG SER A 728 -5.140 -5.808 40.665 1.00 26.35 H new ATOM 340 N VAL A 729 -2.011 -3.827 38.818 1.00 17.06 N ATOM 341 CA VAL A 729 -0.573 -3.810 39.092 1.00 20.53 C ATOM 342 C VAL A 729 -0.186 -2.573 39.911 1.00 19.80 C ATOM 343 O VAL A 729 0.633 -2.666 40.830 1.00 19.83 O ATOM 344 CB VAL A 729 0.255 -3.842 37.783 1.00 22.90 C ATOM 345 CG1 VAL A 729 1.710 -3.487 38.073 1.00 22.77 C ATOM 346 CG2 VAL A 729 0.178 -5.235 37.149 1.00 22.38 C ATOM 0 H VAL A 729 -2.222 -3.796 37.985 1.00 17.06 H new ATOM 0 HA VAL A 729 -0.372 -4.608 39.605 1.00 20.53 H new ATOM 0 HB VAL A 729 -0.112 -3.190 37.165 1.00 22.90 H new ATOM 0 HG11 VAL A 729 2.219 -3.510 37.248 1.00 22.77 H new ATOM 0 HG12 VAL A 729 1.756 -2.597 38.456 1.00 22.77 H new ATOM 0 HG13 VAL A 729 2.081 -4.128 38.699 1.00 22.77 H new ATOM 0 HG21 VAL A 729 0.698 -5.247 36.330 1.00 22.38 H new ATOM 0 HG22 VAL A 729 0.533 -5.892 37.768 1.00 22.38 H new ATOM 0 HG23 VAL A 729 -0.746 -5.448 36.947 1.00 22.38 H new ATOM 347 N VAL A 730 -0.772 -1.424 39.588 1.00 19.34 N ATOM 348 CA VAL A 730 -0.469 -0.199 40.316 1.00 19.37 C ATOM 349 C VAL A 730 -0.882 -0.334 41.785 1.00 20.80 C ATOM 350 O VAL A 730 -0.102 -0.011 42.684 1.00 23.54 O ATOM 351 CB VAL A 730 -1.186 1.008 39.683 1.00 18.87 C ATOM 352 CG1 VAL A 730 -1.044 2.227 40.574 1.00 19.80 C ATOM 353 CG2 VAL A 730 -0.606 1.295 38.297 1.00 16.76 C ATOM 0 H VAL A 730 -1.345 -1.333 38.953 1.00 19.34 H new ATOM 0 HA VAL A 730 0.488 -0.052 40.267 1.00 19.37 H new ATOM 0 HB VAL A 730 -2.129 0.799 39.590 1.00 18.87 H new ATOM 0 HG11 VAL A 730 -1.499 2.981 40.166 1.00 19.80 H new ATOM 0 HG12 VAL A 730 -1.438 2.042 41.441 1.00 19.80 H new ATOM 0 HG13 VAL A 730 -0.104 2.439 40.685 1.00 19.80 H new ATOM 0 HG21 VAL A 730 -1.063 2.056 37.906 1.00 16.76 H new ATOM 0 HG22 VAL A 730 0.340 1.493 38.377 1.00 16.76 H new ATOM 0 HG23 VAL A 730 -0.727 0.519 37.728 1.00 16.76 H new ATOM 354 N LYS A 731 -2.093 -0.820 42.036 1.00 19.63 N ATOM 355 CA LYS A 731 -2.560 -0.982 43.410 1.00 21.21 C ATOM 356 C LYS A 731 -1.638 -1.947 44.136 1.00 21.29 C ATOM 357 O LYS A 731 -1.213 -1.689 45.267 1.00 18.96 O ATOM 358 CB LYS A 731 -3.991 -1.523 43.452 1.00 22.33 C ATOM 359 CG LYS A 731 -5.058 -0.492 43.138 1.00 24.67 C ATOM 360 CD LYS A 731 -6.442 -1.113 43.229 1.00 27.79 C ATOM 361 CE LYS A 731 -7.514 -0.153 42.734 1.00 31.48 C ATOM 362 NZ LYS A 731 -8.872 -0.793 42.741 1.00 34.54 N ATOM 0 H LYS A 731 -2.656 -1.060 41.432 1.00 19.63 H new ATOM 0 HA LYS A 731 -2.552 -0.113 43.841 1.00 21.21 H new ATOM 0 HB2 LYS A 731 -4.067 -2.255 42.820 1.00 22.33 H new ATOM 0 HB3 LYS A 731 -4.161 -1.891 44.333 1.00 22.33 H new ATOM 0 HG2 LYS A 731 -4.990 0.251 43.758 1.00 24.67 H new ATOM 0 HG3 LYS A 731 -4.917 -0.133 42.248 1.00 24.67 H new ATOM 0 HD2 LYS A 731 -6.468 -1.928 42.704 1.00 27.79 H new ATOM 0 HD3 LYS A 731 -6.627 -1.362 44.148 1.00 27.79 H new ATOM 0 HE2 LYS A 731 -7.525 0.638 43.295 1.00 31.48 H new ATOM 0 HE3 LYS A 731 -7.298 0.140 41.835 1.00 31.48 H new ATOM 0 HZ1 LYS A 731 -9.472 -0.220 42.420 1.00 34.54 H new ATOM 0 HZ2 LYS A 731 -8.859 -1.523 42.233 1.00 34.54 H new ATOM 0 HZ3 LYS A 731 -9.091 -1.016 43.574 1.00 34.54 H new ATOM 363 N TRP A 732 -1.336 -3.059 43.474 1.00 19.45 N ATOM 364 CA TRP A 732 -0.464 -4.091 44.016 1.00 18.87 C ATOM 365 C TRP A 732 0.867 -3.485 44.432 1.00 17.61 C ATOM 366 O TRP A 732 1.344 -3.743 45.535 1.00 16.26 O ATOM 367 CB TRP A 732 -0.241 -5.171 42.947 1.00 17.56 C ATOM 368 CG TRP A 732 0.877 -6.136 43.212 1.00 19.14 C ATOM 369 CD1 TRP A 732 0.894 -7.127 44.155 1.00 19.27 C ATOM 370 CD2 TRP A 732 2.117 -6.238 42.516 1.00 19.82 C ATOM 371 NE1 TRP A 732 2.055 -7.847 44.075 1.00 20.64 N ATOM 372 CE2 TRP A 732 2.817 -7.328 43.073 1.00 20.62 C ATOM 373 CE3 TRP A 732 2.693 -5.539 41.451 1.00 18.06 C ATOM 374 CZ2 TRP A 732 4.089 -7.701 42.622 1.00 18.43 C ATOM 375 CZ3 TRP A 732 3.943 -5.915 41.011 1.00 19.86 C ATOM 376 CH2 TRP A 732 4.622 -6.991 41.581 1.00 20.22 C ATOM 0 H TRP A 732 -1.636 -3.236 42.688 1.00 19.45 H new ATOM 0 HA TRP A 732 -0.879 -4.489 44.798 1.00 18.87 H new ATOM 0 HB2 TRP A 732 -1.063 -5.676 42.846 1.00 17.56 H new ATOM 0 HB3 TRP A 732 -0.071 -4.732 42.099 1.00 17.56 H new ATOM 0 HD1 TRP A 732 0.211 -7.289 44.766 1.00 19.27 H new ATOM 0 HE1 TRP A 732 2.268 -8.515 44.574 1.00 20.64 H new ATOM 0 HE3 TRP A 732 2.241 -4.834 41.047 1.00 18.06 H new ATOM 0 HZ2 TRP A 732 4.554 -8.404 43.015 1.00 18.43 H new ATOM 0 HZ3 TRP A 732 4.343 -5.441 40.318 1.00 19.86 H new ATOM 0 HH2 TRP A 732 5.456 -7.231 41.246 1.00 20.22 H new ATOM 377 N SER A 733 1.458 -2.686 43.547 1.00 18.94 N ATOM 378 CA SER A 733 2.749 -2.067 43.816 1.00 19.24 C ATOM 379 C SER A 733 2.759 -1.175 45.056 1.00 19.99 C ATOM 380 O SER A 733 3.828 -0.904 45.606 1.00 18.13 O ATOM 381 CB SER A 733 3.212 -1.253 42.604 1.00 20.15 C ATOM 382 OG SER A 733 2.463 -0.055 42.477 1.00 21.52 O ATOM 0 H SER A 733 1.123 -2.490 42.780 1.00 18.94 H new ATOM 0 HA SER A 733 3.361 -2.799 43.990 1.00 19.24 H new ATOM 0 HB2 SER A 733 4.154 -1.041 42.694 1.00 20.15 H new ATOM 0 HB3 SER A 733 3.117 -1.784 41.798 1.00 20.15 H new ATOM 0 HG SER A 733 1.647 -0.241 42.406 1.00 21.52 H new ATOM 383 N LYS A 734 1.589 -0.713 45.491 1.00 19.54 N ATOM 384 CA LYS A 734 1.517 0.148 46.670 1.00 22.45 C ATOM 385 C LYS A 734 1.659 -0.636 47.974 1.00 22.34 C ATOM 386 O LYS A 734 1.915 -0.050 49.033 1.00 21.81 O ATOM 387 CB LYS A 734 0.207 0.944 46.683 1.00 24.38 C ATOM 388 CG LYS A 734 0.064 1.890 45.498 1.00 29.34 C ATOM 389 CD LYS A 734 -0.468 3.244 45.923 1.00 34.55 C ATOM 390 CE LYS A 734 -1.853 3.154 46.535 1.00 38.23 C ATOM 391 NZ LYS A 734 -2.405 4.521 46.832 1.00 37.58 N ATOM 0 H LYS A 734 0.831 -0.884 45.122 1.00 19.54 H new ATOM 0 HA LYS A 734 2.266 0.761 46.612 1.00 22.45 H new ATOM 0 HB2 LYS A 734 -0.540 0.325 46.687 1.00 24.38 H new ATOM 0 HB3 LYS A 734 0.155 1.456 47.505 1.00 24.38 H new ATOM 0 HG2 LYS A 734 0.926 2.001 45.067 1.00 29.34 H new ATOM 0 HG3 LYS A 734 -0.533 1.499 44.841 1.00 29.34 H new ATOM 0 HD2 LYS A 734 0.141 3.641 46.565 1.00 34.55 H new ATOM 0 HD3 LYS A 734 -0.495 3.834 45.154 1.00 34.55 H new ATOM 0 HE2 LYS A 734 -2.448 2.687 45.928 1.00 38.23 H new ATOM 0 HE3 LYS A 734 -1.815 2.633 47.352 1.00 38.23 H new ATOM 0 HZ1 LYS A 734 -3.216 4.443 47.190 1.00 37.58 H new ATOM 0 HZ2 LYS A 734 -1.868 4.940 47.405 1.00 37.58 H new ATOM 0 HZ3 LYS A 734 -2.458 4.990 46.078 1.00 37.58 H new ATOM 392 N SER A 735 1.508 -1.954 47.896 1.00 20.52 N ATOM 393 CA SER A 735 1.620 -2.801 49.075 1.00 19.62 C ATOM 394 C SER A 735 2.861 -3.679 48.998 1.00 19.20 C ATOM 395 O SER A 735 3.185 -4.383 49.958 1.00 18.11 O ATOM 396 CB SER A 735 0.382 -3.690 49.201 1.00 20.91 C ATOM 397 OG SER A 735 -0.801 -2.907 49.290 1.00 23.32 O ATOM 0 H SER A 735 1.340 -2.378 47.167 1.00 20.52 H new ATOM 0 HA SER A 735 1.691 -2.225 49.852 1.00 19.62 H new ATOM 0 HB2 SER A 735 0.325 -4.282 48.434 1.00 20.91 H new ATOM 0 HB3 SER A 735 0.462 -4.252 49.988 1.00 20.91 H new ATOM 0 HG SER A 735 -1.468 -3.413 49.357 1.00 23.32 H new ATOM 398 N LEU A 736 3.548 -3.643 47.858 1.00 17.37 N ATOM 399 CA LEU A 736 4.754 -4.466 47.657 1.00 16.63 C ATOM 400 C LEU A 736 5.897 -3.923 48.504 1.00 16.99 C ATOM 401 O LEU A 736 6.398 -2.830 48.250 1.00 16.89 O ATOM 402 CB LEU A 736 5.146 -4.467 46.175 1.00 15.77 C ATOM 403 CG LEU A 736 6.430 -5.179 45.755 1.00 15.77 C ATOM 404 CD1 LEU A 736 6.331 -6.675 46.082 1.00 15.15 C ATOM 405 CD2 LEU A 736 6.662 -4.958 44.264 1.00 15.95 C ATOM 0 H LEU A 736 3.337 -3.151 47.185 1.00 17.37 H new ATOM 0 HA LEU A 736 4.567 -5.378 47.930 1.00 16.63 H new ATOM 0 HB2 LEU A 736 4.414 -4.864 45.678 1.00 15.77 H new ATOM 0 HB3 LEU A 736 5.215 -3.543 45.889 1.00 15.77 H new ATOM 0 HG LEU A 736 7.184 -4.815 46.245 1.00 15.77 H new ATOM 0 HD11 LEU A 736 7.150 -7.120 45.813 1.00 15.15 H new ATOM 0 HD12 LEU A 736 6.200 -6.790 47.036 1.00 15.15 H new ATOM 0 HD13 LEU A 736 5.581 -7.062 45.604 1.00 15.15 H new ATOM 0 HD21 LEU A 736 7.477 -5.409 43.993 1.00 15.95 H new ATOM 0 HD22 LEU A 736 5.913 -5.316 43.763 1.00 15.95 H new ATOM 0 HD23 LEU A 736 6.744 -4.008 44.086 1.00 15.95 H new ATOM 406 N PRO A 737 6.327 -4.681 49.521 1.00 18.92 N ATOM 407 CA PRO A 737 7.416 -4.257 50.403 1.00 20.09 C ATOM 408 C PRO A 737 8.617 -3.680 49.663 1.00 20.66 C ATOM 409 O PRO A 737 9.202 -4.325 48.773 1.00 20.44 O ATOM 410 CB PRO A 737 7.759 -5.534 51.153 1.00 20.20 C ATOM 411 CG PRO A 737 6.414 -6.164 51.279 1.00 19.78 C ATOM 412 CD PRO A 737 5.835 -6.009 49.912 1.00 16.70 C ATOM 0 HA PRO A 737 7.153 -3.525 50.983 1.00 20.09 H new ATOM 0 HB2 PRO A 737 8.381 -6.093 50.660 1.00 20.20 H new ATOM 0 HB3 PRO A 737 8.162 -5.355 52.017 1.00 20.20 H new ATOM 0 HG2 PRO A 737 6.478 -7.097 51.537 1.00 19.78 H new ATOM 0 HG3 PRO A 737 5.872 -5.720 51.950 1.00 19.78 H new ATOM 0 HD2 PRO A 737 6.142 -6.702 49.307 1.00 16.70 H new ATOM 0 HD3 PRO A 737 4.866 -6.049 49.921 1.00 16.70 H new ATOM 413 N GLY A 738 8.974 -2.450 50.015 1.00 20.34 N ATOM 414 CA GLY A 738 10.113 -1.788 49.396 1.00 20.66 C ATOM 415 C GLY A 738 9.817 -0.889 48.197 1.00 21.33 C ATOM 416 O GLY A 738 10.520 0.109 47.990 1.00 19.46 O ATOM 0 H GLY A 738 8.568 -1.982 50.611 1.00 20.34 H new ATOM 0 HA2 GLY A 738 10.557 -1.253 50.073 1.00 20.66 H new ATOM 0 HA3 GLY A 738 10.743 -2.470 49.115 1.00 20.66 H new ATOM 417 N PHE A 739 8.802 -1.223 47.402 1.00 20.82 N ATOM 418 CA PHE A 739 8.508 -0.451 46.197 1.00 19.63 C ATOM 419 C PHE A 739 8.174 1.024 46.438 1.00 20.37 C ATOM 420 O PHE A 739 8.727 1.901 45.763 1.00 19.21 O ATOM 421 CB PHE A 739 7.373 -1.096 45.405 1.00 19.68 C ATOM 422 CG PHE A 739 7.292 -0.609 43.982 1.00 17.87 C ATOM 423 CD1 PHE A 739 8.302 -0.908 43.073 1.00 16.83 C ATOM 424 CD2 PHE A 739 6.204 0.138 43.543 1.00 17.69 C ATOM 425 CE1 PHE A 739 8.224 -0.464 41.761 1.00 16.92 C ATOM 426 CE2 PHE A 739 6.129 0.581 42.235 1.00 15.47 C ATOM 427 CZ PHE A 739 7.133 0.275 41.341 1.00 16.93 C ATOM 0 H PHE A 739 8.275 -1.888 47.541 1.00 20.82 H new ATOM 0 HA PHE A 739 9.336 -0.464 45.692 1.00 19.63 H new ATOM 0 HB2 PHE A 739 7.493 -2.059 45.405 1.00 19.68 H new ATOM 0 HB3 PHE A 739 6.531 -0.915 45.851 1.00 19.68 H new ATOM 0 HD1 PHE A 739 9.036 -1.410 43.347 1.00 16.83 H new ATOM 0 HD2 PHE A 739 5.518 0.342 44.137 1.00 17.69 H new ATOM 0 HE1 PHE A 739 8.907 -0.664 41.162 1.00 16.92 H new ATOM 0 HE2 PHE A 739 5.399 1.087 41.958 1.00 15.47 H new ATOM 0 HZ PHE A 739 7.077 0.564 40.459 1.00 16.93 H new ATOM 428 N ARG A 740 7.255 1.290 47.366 1.00 19.57 N ATOM 429 CA ARG A 740 6.832 2.656 47.683 1.00 21.61 C ATOM 430 C ARG A 740 7.983 3.522 48.193 1.00 21.98 C ATOM 431 O ARG A 740 7.844 4.739 48.288 1.00 22.04 O ATOM 432 CB ARG A 740 5.717 2.630 48.734 1.00 22.18 C ATOM 433 CG ARG A 740 6.165 2.066 50.078 1.00 23.25 C ATOM 434 CD ARG A 740 5.111 2.296 51.166 1.00 23.77 C ATOM 435 NE ARG A 740 5.542 1.764 52.459 1.00 22.23 N ATOM 436 CZ ARG A 740 4.912 2.005 53.610 1.00 22.02 C ATOM 437 NH1 ARG A 740 3.819 2.776 53.640 1.00 19.30 N ATOM 438 NH2 ARG A 740 5.362 1.479 54.742 1.00 22.48 N ATOM 0 H ARG A 740 6.859 0.684 47.830 1.00 19.57 H new ATOM 0 HA ARG A 740 6.509 3.050 46.857 1.00 21.61 H new ATOM 0 HB2 ARG A 740 5.383 3.531 48.864 1.00 22.18 H new ATOM 0 HB3 ARG A 740 4.978 2.099 48.398 1.00 22.18 H new ATOM 0 HG2 ARG A 740 6.338 1.116 49.990 1.00 23.25 H new ATOM 0 HG3 ARG A 740 7.000 2.483 50.342 1.00 23.25 H new ATOM 0 HD2 ARG A 740 4.934 3.246 51.250 1.00 23.77 H new ATOM 0 HD3 ARG A 740 4.278 1.874 50.904 1.00 23.77 H new ATOM 0 HE ARG A 740 6.243 1.266 52.478 1.00 22.23 H new ATOM 0 HH11 ARG A 740 3.516 3.121 52.913 1.00 19.30 H new ATOM 0 HH12 ARG A 740 3.419 2.926 54.386 1.00 19.30 H new ATOM 0 HH21 ARG A 740 6.063 0.980 54.736 1.00 22.48 H new ATOM 0 HH22 ARG A 740 4.953 1.637 55.482 1.00 22.48 H new ATOM 439 N ASN A 741 9.110 2.898 48.522 1.00 22.04 N ATOM 440 CA ASN A 741 10.268 3.627 49.030 1.00 24.03 C ATOM 441 C ASN A 741 11.126 4.185 47.900 1.00 24.37 C ATOM 442 O ASN A 741 11.974 5.053 48.126 1.00 24.88 O ATOM 443 CB ASN A 741 11.083 2.709 49.934 1.00 26.21 C ATOM 444 CG ASN A 741 10.281 2.241 51.136 1.00 28.22 C ATOM 445 OD1 ASN A 741 9.257 3.017 51.502 1.00 30.46 O flip ATOM 446 ND2 ASN A 741 10.575 1.210 51.734 1.00 28.10 N flip ATOM 0 H ASN A 741 9.225 2.048 48.458 1.00 22.04 H new ATOM 0 HA ASN A 741 9.954 4.388 49.543 1.00 24.03 H new ATOM 0 HB2 ASN A 741 11.383 1.939 49.426 1.00 26.21 H new ATOM 0 HB3 ASN A 741 11.877 3.176 50.237 1.00 26.21 H new ATOM 0 HD21 ASN A 741 11.241 0.735 51.470 1.00 28.10 H new ATOM 0 HD22 ASN A 741 10.115 0.963 52.417 1.00 28.10 H new ATOM 447 N LEU A 742 10.905 3.694 46.686 1.00 23.68 N ATOM 448 CA LEU A 742 11.650 4.179 45.531 1.00 23.07 C ATOM 449 C LEU A 742 11.065 5.531 45.133 1.00 22.04 C ATOM 450 O LEU A 742 9.892 5.811 45.400 1.00 22.52 O ATOM 451 CB LEU A 742 11.525 3.204 44.360 1.00 22.42 C ATOM 452 CG LEU A 742 12.117 1.813 44.531 1.00 22.13 C ATOM 453 CD1 LEU A 742 11.711 0.935 43.351 1.00 23.07 C ATOM 454 CD2 LEU A 742 13.619 1.925 44.642 1.00 23.19 C ATOM 0 H LEU A 742 10.329 3.080 46.510 1.00 23.68 H new ATOM 0 HA LEU A 742 12.590 4.260 45.757 1.00 23.07 H new ATOM 0 HB2 LEU A 742 10.582 3.104 44.154 1.00 22.42 H new ATOM 0 HB3 LEU A 742 11.942 3.613 43.586 1.00 22.42 H new ATOM 0 HG LEU A 742 11.779 1.401 45.341 1.00 22.13 H new ATOM 0 HD11 LEU A 742 12.089 0.049 43.462 1.00 23.07 H new ATOM 0 HD12 LEU A 742 10.744 0.871 43.313 1.00 23.07 H new ATOM 0 HD13 LEU A 742 12.041 1.327 42.527 1.00 23.07 H new ATOM 0 HD21 LEU A 742 14.002 1.041 44.751 1.00 23.19 H new ATOM 0 HD22 LEU A 742 13.974 2.333 43.837 1.00 23.19 H new ATOM 0 HD23 LEU A 742 13.847 2.473 45.409 1.00 23.19 H new ATOM 455 N HIS A 743 11.884 6.373 44.518 1.00 22.24 N ATOM 456 CA HIS A 743 11.421 7.678 44.064 1.00 23.47 C ATOM 457 C HIS A 743 10.157 7.461 43.230 1.00 22.78 C ATOM 458 O HIS A 743 10.065 6.464 42.498 1.00 23.02 O ATOM 459 CB HIS A 743 12.494 8.346 43.201 1.00 23.99 C ATOM 460 CG HIS A 743 12.174 9.761 42.809 1.00 26.98 C ATOM 461 ND1 HIS A 743 11.478 10.254 41.765 1.00 30.08 N flip ATOM 462 CD2 HIS A 743 12.579 10.843 43.558 1.00 27.05 C flip ATOM 463 CE1 HIS A 743 11.478 11.630 41.898 1.00 28.07 C flip ATOM 464 NE2 HIS A 743 12.144 11.956 42.982 1.00 28.65 N flip ATOM 0 H HIS A 743 12.712 6.209 44.353 1.00 22.24 H new ATOM 0 HA HIS A 743 11.237 8.251 44.825 1.00 23.47 H new ATOM 0 HB2 HIS A 743 13.335 8.337 43.684 1.00 23.99 H new ATOM 0 HB3 HIS A 743 12.623 7.819 42.397 1.00 23.99 H new ATOM 0 HD2 HIS A 743 13.078 10.800 44.342 1.00 27.05 H new ATOM 0 HE1 HIS A 743 11.072 12.229 41.314 1.00 28.07 H new ATOM 0 HE2 HIS A 743 12.276 12.756 43.270 1.00 28.65 H new ATOM 465 N ILE A 744 9.191 8.372 43.340 1.00 22.79 N ATOM 466 CA ILE A 744 7.938 8.265 42.590 1.00 22.79 C ATOM 467 C ILE A 744 8.152 8.071 41.089 1.00 22.44 C ATOM 468 O ILE A 744 7.455 7.263 40.461 1.00 21.29 O ATOM 469 CB ILE A 744 7.062 9.517 42.782 1.00 24.88 C ATOM 470 CG1 ILE A 744 6.723 9.706 44.264 1.00 27.57 C ATOM 471 CG2 ILE A 744 5.761 9.375 41.991 1.00 25.32 C ATOM 472 CD1 ILE A 744 5.795 8.674 44.809 1.00 29.96 C ATOM 0 H ILE A 744 9.242 9.065 43.847 1.00 22.79 H new ATOM 0 HA ILE A 744 7.496 7.479 42.947 1.00 22.79 H new ATOM 0 HB ILE A 744 7.557 10.287 42.462 1.00 24.88 H new ATOM 0 HG12 ILE A 744 7.545 9.693 44.779 1.00 27.57 H new ATOM 0 HG13 ILE A 744 6.326 10.582 44.386 1.00 27.57 H new ATOM 0 HG21 ILE A 744 5.217 10.168 42.118 1.00 25.32 H new ATOM 0 HG22 ILE A 744 5.965 9.271 41.048 1.00 25.32 H new ATOM 0 HG23 ILE A 744 5.275 8.596 42.304 1.00 25.32 H new ATOM 0 HD11 ILE A 744 5.625 8.854 45.747 1.00 29.96 H new ATOM 0 HD12 ILE A 744 4.959 8.699 44.318 1.00 29.96 H new ATOM 0 HD13 ILE A 744 6.197 7.796 44.717 1.00 29.96 H new ATOM 473 N ASP A 745 9.099 8.808 40.513 1.00 21.06 N ATOM 474 CA ASP A 745 9.382 8.699 39.085 1.00 22.99 C ATOM 475 C ASP A 745 9.853 7.295 38.738 1.00 22.39 C ATOM 476 O ASP A 745 9.513 6.778 37.675 1.00 23.82 O ATOM 477 CB ASP A 745 10.441 9.718 38.659 1.00 25.19 C ATOM 478 CG ASP A 745 9.946 11.152 38.760 1.00 27.41 C ATOM 479 OD1 ASP A 745 8.774 11.359 39.132 1.00 30.69 O ATOM 480 OD2 ASP A 745 10.737 12.066 38.466 1.00 30.84 O ATOM 0 H ASP A 745 9.589 9.377 40.932 1.00 21.06 H new ATOM 0 HA ASP A 745 8.560 8.885 38.605 1.00 22.99 H new ATOM 0 HB2 ASP A 745 11.229 9.612 39.214 1.00 25.19 H new ATOM 0 HB3 ASP A 745 10.711 9.536 37.745 1.00 25.19 H new ATOM 481 N ASP A 746 10.641 6.685 39.618 1.00 22.73 N ATOM 482 CA ASP A 746 11.131 5.332 39.377 1.00 21.47 C ATOM 483 C ASP A 746 9.958 4.351 39.422 1.00 21.67 C ATOM 484 O ASP A 746 9.892 3.416 38.620 1.00 20.60 O ATOM 485 CB ASP A 746 12.163 4.928 40.431 1.00 21.52 C ATOM 486 CG ASP A 746 13.412 5.802 40.410 1.00 23.31 C ATOM 487 OD1 ASP A 746 13.705 6.426 39.369 1.00 23.72 O ATOM 488 OD2 ASP A 746 14.108 5.834 41.441 1.00 23.55 O ATOM 0 H ASP A 746 10.903 7.036 40.358 1.00 22.73 H new ATOM 0 HA ASP A 746 11.554 5.310 38.504 1.00 21.47 H new ATOM 0 HB2 ASP A 746 11.756 4.976 41.310 1.00 21.52 H new ATOM 0 HB3 ASP A 746 12.419 4.004 40.287 1.00 21.52 H new ATOM 489 N GLN A 747 9.039 4.556 40.363 1.00 20.24 N ATOM 490 CA GLN A 747 7.876 3.676 40.492 1.00 18.14 C ATOM 491 C GLN A 747 7.061 3.673 39.198 1.00 19.56 C ATOM 492 O GLN A 747 6.707 2.606 38.676 1.00 18.10 O ATOM 493 CB GLN A 747 6.987 4.136 41.643 1.00 19.14 C ATOM 494 CG GLN A 747 7.592 3.925 43.019 1.00 19.34 C ATOM 495 CD GLN A 747 6.658 4.377 44.119 1.00 19.36 C ATOM 496 OE1 GLN A 747 5.490 3.996 44.143 1.00 20.20 O ATOM 497 NE2 GLN A 747 7.163 5.187 45.037 1.00 18.07 N ATOM 0 H GLN A 747 9.069 5.197 40.936 1.00 20.24 H new ATOM 0 HA GLN A 747 8.196 2.778 40.671 1.00 18.14 H new ATOM 0 HB2 GLN A 747 6.789 5.079 41.529 1.00 19.14 H new ATOM 0 HB3 GLN A 747 6.142 3.661 41.596 1.00 19.14 H new ATOM 0 HG2 GLN A 747 7.802 2.986 43.139 1.00 19.34 H new ATOM 0 HG3 GLN A 747 8.428 4.413 43.083 1.00 19.34 H new ATOM 0 HE21 GLN A 747 7.986 5.433 44.988 1.00 18.07 H new ATOM 0 HE22 GLN A 747 6.668 5.467 45.682 1.00 18.07 H new ATOM 498 N ILE A 748 6.763 4.868 38.692 1.00 18.95 N ATOM 499 CA ILE A 748 5.989 5.030 37.465 1.00 18.84 C ATOM 500 C ILE A 748 6.730 4.371 36.311 1.00 18.22 C ATOM 501 O ILE A 748 6.142 3.608 35.540 1.00 17.82 O ATOM 502 CB ILE A 748 5.777 6.522 37.141 1.00 18.01 C ATOM 503 CG1 ILE A 748 4.962 7.191 38.258 1.00 18.85 C ATOM 504 CG2 ILE A 748 5.065 6.663 35.814 1.00 18.55 C ATOM 505 CD1 ILE A 748 4.791 8.684 38.086 1.00 16.78 C ATOM 0 H ILE A 748 7.005 5.610 39.053 1.00 18.95 H new ATOM 0 HA ILE A 748 5.123 4.613 37.591 1.00 18.84 H new ATOM 0 HB ILE A 748 6.640 6.961 37.081 1.00 18.01 H new ATOM 0 HG12 ILE A 748 4.086 6.777 38.298 1.00 18.85 H new ATOM 0 HG13 ILE A 748 5.396 7.020 39.109 1.00 18.85 H new ATOM 0 HG21 ILE A 748 4.934 7.603 35.615 1.00 18.55 H new ATOM 0 HG22 ILE A 748 5.600 6.256 35.115 1.00 18.55 H new ATOM 0 HG23 ILE A 748 4.203 6.220 35.860 1.00 18.55 H new ATOM 0 HD11 ILE A 748 4.269 9.037 38.824 1.00 16.78 H new ATOM 0 HD12 ILE A 748 5.662 9.110 38.073 1.00 16.78 H new ATOM 0 HD13 ILE A 748 4.332 8.863 37.251 1.00 16.78 H new ATOM 506 N THR A 749 8.021 4.661 36.192 1.00 18.17 N ATOM 507 CA THR A 749 8.833 4.081 35.130 1.00 18.08 C ATOM 508 C THR A 749 8.848 2.547 35.181 1.00 17.77 C ATOM 509 O THR A 749 8.636 1.884 34.163 1.00 16.80 O ATOM 510 CB THR A 749 10.275 4.600 35.201 1.00 19.75 C ATOM 511 OG1 THR A 749 10.272 6.019 35.003 1.00 21.38 O ATOM 512 CG2 THR A 749 11.137 3.938 34.126 1.00 22.19 C ATOM 0 H THR A 749 8.446 5.193 36.717 1.00 18.17 H new ATOM 0 HA THR A 749 8.426 4.354 34.293 1.00 18.08 H new ATOM 0 HB THR A 749 10.646 4.385 36.071 1.00 19.75 H new ATOM 0 HG1 THR A 749 10.060 6.402 35.720 1.00 21.38 H new ATOM 0 HG21 THR A 749 12.044 4.277 34.184 1.00 22.19 H new ATOM 0 HG22 THR A 749 11.141 2.977 34.261 1.00 22.19 H new ATOM 0 HG23 THR A 749 10.773 4.139 33.250 1.00 22.19 H new ATOM 513 N LEU A 750 9.096 1.981 36.358 1.00 18.38 N ATOM 514 CA LEU A 750 9.147 0.530 36.502 1.00 17.79 C ATOM 515 C LEU A 750 7.798 -0.109 36.122 1.00 18.00 C ATOM 516 O LEU A 750 7.770 -1.147 35.443 1.00 16.77 O ATOM 517 CB LEU A 750 9.543 0.166 37.935 1.00 18.08 C ATOM 518 CG LEU A 750 11.000 0.463 38.281 1.00 17.78 C ATOM 519 CD1 LEU A 750 11.280 0.159 39.765 1.00 17.47 C ATOM 520 CD2 LEU A 750 11.882 -0.371 37.374 1.00 16.54 C ATOM 0 H LEU A 750 9.237 2.419 37.085 1.00 18.38 H new ATOM 0 HA LEU A 750 9.817 0.179 35.895 1.00 17.79 H new ATOM 0 HB2 LEU A 750 8.971 0.651 38.550 1.00 18.08 H new ATOM 0 HB3 LEU A 750 9.375 -0.779 38.075 1.00 18.08 H new ATOM 0 HG LEU A 750 11.190 1.404 38.143 1.00 17.78 H new ATOM 0 HD11 LEU A 750 12.209 0.353 39.966 1.00 17.47 H new ATOM 0 HD12 LEU A 750 10.707 0.709 40.322 1.00 17.47 H new ATOM 0 HD13 LEU A 750 11.100 -0.777 39.943 1.00 17.47 H new ATOM 0 HD21 LEU A 750 12.814 -0.196 37.579 1.00 16.54 H new ATOM 0 HD22 LEU A 750 11.692 -1.312 37.513 1.00 16.54 H new ATOM 0 HD23 LEU A 750 11.706 -0.139 36.449 1.00 16.54 H new ATOM 521 N ILE A 751 6.695 0.510 36.533 1.00 17.16 N ATOM 522 CA ILE A 751 5.370 -0.013 36.210 1.00 20.62 C ATOM 523 C ILE A 751 5.177 -0.049 34.699 1.00 21.28 C ATOM 524 O ILE A 751 4.831 -1.092 34.138 1.00 23.08 O ATOM 525 CB ILE A 751 4.250 0.854 36.813 1.00 20.73 C ATOM 526 CG1 ILE A 751 4.297 0.803 38.347 1.00 22.78 C ATOM 527 CG2 ILE A 751 2.894 0.384 36.298 1.00 20.91 C ATOM 528 CD1 ILE A 751 4.203 -0.581 38.903 1.00 27.80 C ATOM 0 H ILE A 751 6.691 1.233 36.999 1.00 17.16 H new ATOM 0 HA ILE A 751 5.317 -0.905 36.587 1.00 20.62 H new ATOM 0 HB ILE A 751 4.383 1.775 36.539 1.00 20.73 H new ATOM 0 HG12 ILE A 751 5.123 1.210 38.651 1.00 22.78 H new ATOM 0 HG13 ILE A 751 3.570 1.337 38.703 1.00 22.78 H new ATOM 0 HG21 ILE A 751 2.193 0.934 36.682 1.00 20.91 H new ATOM 0 HG22 ILE A 751 2.871 0.460 35.331 1.00 20.91 H new ATOM 0 HG23 ILE A 751 2.754 -0.541 36.553 1.00 20.91 H new ATOM 0 HD11 ILE A 751 4.238 -0.544 39.872 1.00 27.80 H new ATOM 0 HD12 ILE A 751 3.366 -0.985 38.626 1.00 27.80 H new ATOM 0 HD13 ILE A 751 4.944 -1.113 38.573 1.00 27.80 H new ATOM 529 N GLN A 752 5.414 1.084 34.046 1.00 21.96 N ATOM 530 CA GLN A 752 5.240 1.192 32.598 1.00 21.77 C ATOM 531 C GLN A 752 6.170 0.257 31.845 1.00 20.81 C ATOM 532 O GLN A 752 5.761 -0.367 30.861 1.00 20.91 O ATOM 533 CB GLN A 752 5.480 2.632 32.143 1.00 21.77 C ATOM 534 CG GLN A 752 4.595 3.641 32.858 1.00 23.80 C ATOM 535 CD GLN A 752 4.760 5.044 32.305 1.00 27.40 C ATOM 536 OE1 GLN A 752 5.881 5.539 32.159 1.00 28.04 O ATOM 537 NE2 GLN A 752 3.646 5.702 32.011 1.00 27.28 N ATOM 0 H GLN A 752 5.679 1.809 34.426 1.00 21.96 H new ATOM 0 HA GLN A 752 4.327 0.933 32.396 1.00 21.77 H new ATOM 0 HB2 GLN A 752 6.410 2.862 32.294 1.00 21.77 H new ATOM 0 HB3 GLN A 752 5.324 2.693 31.188 1.00 21.77 H new ATOM 0 HG2 GLN A 752 3.667 3.370 32.776 1.00 23.80 H new ATOM 0 HG3 GLN A 752 4.808 3.641 33.804 1.00 23.80 H new ATOM 0 HE21 GLN A 752 2.881 5.326 32.125 1.00 27.28 H new ATOM 0 HE22 GLN A 752 3.689 6.505 31.706 1.00 27.28 H new ATOM 538 N TYR A 753 7.419 0.172 32.291 1.00 19.56 N ATOM 539 CA TYR A 753 8.415 -0.692 31.663 1.00 17.94 C ATOM 540 C TYR A 753 7.979 -2.155 31.718 1.00 17.82 C ATOM 541 O TYR A 753 8.074 -2.867 30.719 1.00 19.65 O ATOM 542 CB TYR A 753 9.762 -0.584 32.397 1.00 19.06 C ATOM 543 CG TYR A 753 10.701 0.514 31.940 1.00 18.95 C ATOM 544 CD1 TYR A 753 10.274 1.539 31.105 1.00 19.85 C ATOM 545 CD2 TYR A 753 12.027 0.524 32.358 1.00 20.41 C ATOM 546 CE1 TYR A 753 11.146 2.537 30.706 1.00 20.65 C ATOM 547 CE2 TYR A 753 12.900 1.524 31.958 1.00 20.71 C ATOM 548 CZ TYR A 753 12.455 2.521 31.141 1.00 21.75 C ATOM 549 OH TYR A 753 13.322 3.520 30.769 1.00 25.27 O ATOM 0 H TYR A 753 7.714 0.614 32.967 1.00 19.56 H new ATOM 0 HA TYR A 753 8.504 -0.403 30.741 1.00 17.94 H new ATOM 0 HB2 TYR A 753 9.582 -0.455 33.341 1.00 19.06 H new ATOM 0 HB3 TYR A 753 10.223 -1.433 32.309 1.00 19.06 H new ATOM 0 HD1 TYR A 753 9.392 1.555 30.811 1.00 19.85 H new ATOM 0 HD2 TYR A 753 12.334 -0.153 32.917 1.00 20.41 H new ATOM 0 HE1 TYR A 753 10.850 3.217 30.145 1.00 20.65 H new ATOM 0 HE2 TYR A 753 13.784 1.515 32.245 1.00 20.71 H new ATOM 0 HH TYR A 753 13.106 4.236 31.152 1.00 25.27 H new ATOM 550 N SER A 754 7.521 -2.598 32.886 1.00 16.83 N ATOM 551 CA SER A 754 7.147 -4.000 33.093 1.00 18.43 C ATOM 552 C SER A 754 5.685 -4.383 32.860 1.00 17.70 C ATOM 553 O SER A 754 5.328 -5.565 32.938 1.00 18.78 O ATOM 554 CB SER A 754 7.529 -4.413 34.511 1.00 17.17 C ATOM 555 OG SER A 754 6.759 -3.692 35.461 1.00 17.58 O ATOM 0 H SER A 754 7.418 -2.099 33.579 1.00 16.83 H new ATOM 0 HA SER A 754 7.637 -4.473 32.402 1.00 18.43 H new ATOM 0 HB2 SER A 754 7.386 -5.365 34.626 1.00 17.17 H new ATOM 0 HB3 SER A 754 8.473 -4.248 34.659 1.00 17.17 H new ATOM 0 HG SER A 754 7.030 -2.898 35.497 1.00 17.58 H new ATOM 556 N TRP A 755 4.839 -3.404 32.583 1.00 18.02 N ATOM 557 CA TRP A 755 3.416 -3.659 32.363 1.00 17.46 C ATOM 558 C TRP A 755 3.113 -4.889 31.491 1.00 18.37 C ATOM 559 O TRP A 755 2.428 -5.803 31.944 1.00 15.37 O ATOM 560 CB TRP A 755 2.788 -2.414 31.741 1.00 19.83 C ATOM 561 CG TRP A 755 1.421 -2.620 31.207 1.00 21.12 C ATOM 562 CD1 TRP A 755 0.313 -2.993 31.917 1.00 22.67 C ATOM 563 CD2 TRP A 755 0.997 -2.472 29.862 1.00 20.63 C ATOM 564 NE1 TRP A 755 -0.776 -3.073 31.092 1.00 21.99 N ATOM 565 CE2 TRP A 755 -0.384 -2.750 29.830 1.00 21.78 C ATOM 566 CE3 TRP A 755 1.639 -2.099 28.681 1.00 21.66 C ATOM 567 CZ2 TRP A 755 -1.122 -2.705 28.643 1.00 23.14 C ATOM 568 CZ3 TRP A 755 0.905 -2.051 27.516 1.00 21.67 C ATOM 569 CH2 TRP A 755 -0.456 -2.338 27.504 1.00 22.02 C ATOM 0 H TRP A 755 5.066 -2.577 32.517 1.00 18.02 H new ATOM 0 HA TRP A 755 3.032 -3.859 33.231 1.00 17.46 H new ATOM 0 HB2 TRP A 755 2.760 -1.711 32.409 1.00 19.83 H new ATOM 0 HB3 TRP A 755 3.360 -2.101 31.023 1.00 19.83 H new ATOM 0 HD1 TRP A 755 0.301 -3.167 32.830 1.00 22.67 H new ATOM 0 HE1 TRP A 755 -1.573 -3.291 31.331 1.00 21.99 H new ATOM 0 HE3 TRP A 755 2.544 -1.887 28.680 1.00 21.66 H new ATOM 0 HZ2 TRP A 755 -2.028 -2.916 28.628 1.00 23.14 H new ATOM 0 HZ3 TRP A 755 1.329 -1.822 26.720 1.00 21.67 H new ATOM 0 HH2 TRP A 755 -0.925 -2.279 26.703 1.00 22.02 H new ATOM 570 N MET A 756 3.600 -4.906 30.254 1.00 19.98 N ATOM 571 CA MET A 756 3.349 -6.025 29.351 1.00 20.58 C ATOM 572 C MET A 756 3.896 -7.338 29.913 1.00 21.16 C ATOM 573 O MET A 756 3.225 -8.370 29.843 1.00 20.68 O ATOM 574 CB MET A 756 3.989 -5.747 27.994 1.00 21.15 C ATOM 575 CG MET A 756 3.546 -6.697 26.888 1.00 25.12 C ATOM 576 SD MET A 756 1.798 -6.500 26.471 1.00 27.27 S ATOM 577 CE MET A 756 1.878 -5.012 25.424 1.00 25.63 C ATOM 0 H MET A 756 4.080 -4.277 29.917 1.00 19.98 H new ATOM 0 HA MET A 756 2.388 -6.116 29.253 1.00 20.58 H new ATOM 0 HB2 MET A 756 3.779 -4.838 27.729 1.00 21.15 H new ATOM 0 HB3 MET A 756 4.953 -5.800 28.085 1.00 21.15 H new ATOM 0 HG2 MET A 756 4.084 -6.541 26.096 1.00 25.12 H new ATOM 0 HG3 MET A 756 3.709 -7.612 27.166 1.00 25.12 H new ATOM 0 HE1 MET A 756 1.115 -4.443 25.611 1.00 25.63 H new ATOM 0 HE2 MET A 756 2.696 -4.527 25.613 1.00 25.63 H new ATOM 0 HE3 MET A 756 1.866 -5.272 24.490 1.00 25.63 H new ATOM 578 N SER A 757 5.115 -7.300 30.447 1.00 20.39 N ATOM 579 CA SER A 757 5.751 -8.492 30.999 1.00 20.00 C ATOM 580 C SER A 757 4.930 -9.075 32.134 1.00 18.64 C ATOM 581 O SER A 757 4.664 -10.276 32.147 1.00 19.38 O ATOM 582 CB SER A 757 7.156 -8.163 31.516 1.00 20.95 C ATOM 583 OG SER A 757 8.007 -7.793 30.442 1.00 26.14 O ATOM 0 H SER A 757 5.593 -6.587 30.499 1.00 20.39 H new ATOM 0 HA SER A 757 5.812 -9.146 30.285 1.00 20.00 H new ATOM 0 HB2 SER A 757 7.108 -7.441 32.161 1.00 20.95 H new ATOM 0 HB3 SER A 757 7.525 -8.932 31.978 1.00 20.95 H new ATOM 0 HG SER A 757 8.787 -8.063 30.597 1.00 26.14 H new ATOM 584 N LEU A 758 4.538 -8.234 33.090 1.00 18.14 N ATOM 585 CA LEU A 758 3.756 -8.708 34.225 1.00 19.01 C ATOM 586 C LEU A 758 2.429 -9.282 33.730 1.00 18.84 C ATOM 587 O LEU A 758 1.925 -10.256 34.289 1.00 19.79 O ATOM 588 CB LEU A 758 3.494 -7.575 35.217 1.00 17.42 C ATOM 589 CG LEU A 758 4.705 -6.895 35.844 1.00 23.16 C ATOM 590 CD1 LEU A 758 4.252 -5.732 36.717 1.00 22.58 C ATOM 591 CD2 LEU A 758 5.484 -7.907 36.649 1.00 23.49 C ATOM 0 H LEU A 758 4.714 -7.392 33.099 1.00 18.14 H new ATOM 0 HA LEU A 758 4.260 -9.401 34.680 1.00 19.01 H new ATOM 0 HB2 LEU A 758 2.970 -6.896 34.764 1.00 17.42 H new ATOM 0 HB3 LEU A 758 2.943 -7.926 35.934 1.00 17.42 H new ATOM 0 HG LEU A 758 5.282 -6.542 35.149 1.00 23.16 H new ATOM 0 HD11 LEU A 758 5.027 -5.303 37.113 1.00 22.58 H new ATOM 0 HD12 LEU A 758 3.769 -5.089 36.175 1.00 22.58 H new ATOM 0 HD13 LEU A 758 3.671 -6.062 37.420 1.00 22.58 H new ATOM 0 HD21 LEU A 758 6.256 -7.477 37.050 1.00 23.49 H new ATOM 0 HD22 LEU A 758 4.918 -8.270 37.348 1.00 23.49 H new ATOM 0 HD23 LEU A 758 5.780 -8.625 36.068 1.00 23.49 H new ATOM 592 N MET A 759 1.871 -8.699 32.675 1.00 18.22 N ATOM 593 CA MET A 759 0.597 -9.177 32.151 1.00 18.84 C ATOM 594 C MET A 759 0.711 -10.555 31.505 1.00 18.49 C ATOM 595 O MET A 759 -0.101 -11.434 31.786 1.00 18.08 O ATOM 596 CB MET A 759 0.028 -8.180 31.148 1.00 20.39 C ATOM 597 CG MET A 759 -1.285 -7.567 31.611 1.00 24.22 C ATOM 598 SD MET A 759 -2.086 -6.506 30.391 1.00 25.10 S ATOM 599 CE MET A 759 -2.488 -5.120 31.369 1.00 28.61 C ATOM 0 H MET A 759 2.210 -8.032 32.251 1.00 18.22 H new ATOM 0 HA MET A 759 -0.005 -9.260 32.907 1.00 18.84 H new ATOM 0 HB2 MET A 759 0.675 -7.473 30.997 1.00 20.39 H new ATOM 0 HB3 MET A 759 -0.109 -8.625 30.297 1.00 20.39 H new ATOM 0 HG2 MET A 759 -1.895 -8.281 31.852 1.00 24.22 H new ATOM 0 HG3 MET A 759 -1.122 -7.050 32.415 1.00 24.22 H new ATOM 0 HE1 MET A 759 -2.528 -4.329 30.809 1.00 28.61 H new ATOM 0 HE2 MET A 759 -3.350 -5.261 31.791 1.00 28.61 H new ATOM 0 HE3 MET A 759 -1.810 -4.998 32.052 1.00 28.61 H new ATOM 600 N VAL A 760 1.707 -10.752 30.648 1.00 19.02 N ATOM 601 CA VAL A 760 1.869 -12.042 29.982 1.00 19.98 C ATOM 602 C VAL A 760 2.287 -13.130 30.984 1.00 20.11 C ATOM 603 O VAL A 760 1.894 -14.292 30.852 1.00 20.69 O ATOM 604 CB VAL A 760 2.891 -11.938 28.826 1.00 19.34 C ATOM 605 CG1 VAL A 760 4.288 -11.697 29.370 1.00 19.11 C ATOM 606 CG2 VAL A 760 2.834 -13.190 27.962 1.00 19.44 C ATOM 0 H VAL A 760 2.295 -10.160 30.439 1.00 19.02 H new ATOM 0 HA VAL A 760 1.011 -12.295 29.606 1.00 19.98 H new ATOM 0 HB VAL A 760 2.661 -11.179 28.267 1.00 19.34 H new ATOM 0 HG11 VAL A 760 4.916 -11.634 28.633 1.00 19.11 H new ATOM 0 HG12 VAL A 760 4.300 -10.870 29.876 1.00 19.11 H new ATOM 0 HG13 VAL A 760 4.542 -12.433 29.949 1.00 19.11 H new ATOM 0 HG21 VAL A 760 3.478 -13.115 27.241 1.00 19.44 H new ATOM 0 HG22 VAL A 760 3.044 -13.967 28.503 1.00 19.44 H new ATOM 0 HG23 VAL A 760 1.943 -13.287 27.591 1.00 19.44 H new ATOM 607 N PHE A 761 3.071 -12.742 31.987 1.00 18.46 N ATOM 608 CA PHE A 761 3.534 -13.660 33.026 1.00 19.61 C ATOM 609 C PHE A 761 2.309 -14.109 33.817 1.00 19.83 C ATOM 610 O PHE A 761 2.183 -15.282 34.167 1.00 19.68 O ATOM 611 CB PHE A 761 4.536 -12.933 33.941 1.00 18.24 C ATOM 612 CG PHE A 761 5.378 -13.841 34.800 1.00 18.74 C ATOM 613 CD1 PHE A 761 6.241 -14.764 34.227 1.00 19.57 C ATOM 614 CD2 PHE A 761 5.362 -13.723 36.181 1.00 19.57 C ATOM 615 CE1 PHE A 761 7.061 -15.551 35.009 1.00 18.78 C ATOM 616 CE2 PHE A 761 6.184 -14.511 36.967 1.00 18.55 C ATOM 617 CZ PHE A 761 7.042 -15.425 36.377 1.00 18.96 C ATOM 0 H PHE A 761 3.351 -11.935 32.085 1.00 18.46 H new ATOM 0 HA PHE A 761 3.982 -14.430 32.642 1.00 19.61 H new ATOM 0 HB2 PHE A 761 5.124 -12.392 33.391 1.00 18.24 H new ATOM 0 HB3 PHE A 761 4.047 -12.325 34.517 1.00 18.24 H new ATOM 0 HD1 PHE A 761 6.267 -14.854 33.302 1.00 19.57 H new ATOM 0 HD2 PHE A 761 4.793 -13.108 36.584 1.00 19.57 H new ATOM 0 HE1 PHE A 761 7.629 -16.169 34.609 1.00 18.78 H new ATOM 0 HE2 PHE A 761 6.161 -14.427 37.893 1.00 18.55 H new ATOM 0 HZ PHE A 761 7.601 -15.950 36.903 1.00 18.96 H new ATOM 618 N GLY A 762 1.408 -13.167 34.083 1.00 20.45 N ATOM 619 CA GLY A 762 0.196 -13.465 34.826 1.00 19.85 C ATOM 620 C GLY A 762 -0.705 -14.371 34.008 1.00 20.32 C ATOM 621 O GLY A 762 -1.381 -15.249 34.558 1.00 19.85 O ATOM 0 H GLY A 762 1.484 -12.346 33.839 1.00 20.45 H new ATOM 0 HA2 GLY A 762 0.420 -13.893 35.667 1.00 19.85 H new ATOM 0 HA3 GLY A 762 -0.270 -12.642 35.042 1.00 19.85 H new ATOM 622 N LEU A 763 -0.727 -14.149 32.697 1.00 19.23 N ATOM 623 CA LEU A 763 -1.521 -14.971 31.787 1.00 18.84 C ATOM 624 C LEU A 763 -0.978 -16.391 31.883 1.00 19.54 C ATOM 625 O LEU A 763 -1.736 -17.364 31.912 1.00 18.39 O ATOM 626 CB LEU A 763 -1.375 -14.460 30.347 1.00 16.94 C ATOM 627 CG LEU A 763 -1.743 -15.429 29.231 1.00 17.82 C ATOM 628 CD1 LEU A 763 -3.233 -15.711 29.280 1.00 17.61 C ATOM 629 CD2 LEU A 763 -1.350 -14.836 27.880 1.00 16.20 C ATOM 0 H LEU A 763 -0.284 -13.521 32.311 1.00 19.23 H new ATOM 0 HA LEU A 763 -2.461 -14.936 32.025 1.00 18.84 H new ATOM 0 HB2 LEU A 763 -1.925 -13.666 30.251 1.00 16.94 H new ATOM 0 HB3 LEU A 763 -0.454 -14.185 30.216 1.00 16.94 H new ATOM 0 HG LEU A 763 -1.263 -16.263 29.350 1.00 17.82 H new ATOM 0 HD11 LEU A 763 -3.469 -16.328 28.570 1.00 17.61 H new ATOM 0 HD12 LEU A 763 -3.460 -16.103 30.138 1.00 17.61 H new ATOM 0 HD13 LEU A 763 -3.723 -14.882 29.164 1.00 17.61 H new ATOM 0 HD21 LEU A 763 -1.586 -15.457 27.173 1.00 16.20 H new ATOM 0 HD22 LEU A 763 -1.820 -13.998 27.745 1.00 16.20 H new ATOM 0 HD23 LEU A 763 -0.393 -14.676 27.863 1.00 16.20 H new ATOM 630 N GLY A 764 0.345 -16.498 31.930 1.00 18.32 N ATOM 631 CA GLY A 764 0.984 -17.796 32.013 1.00 18.09 C ATOM 632 C GLY A 764 0.568 -18.523 33.280 1.00 19.39 C ATOM 633 O GLY A 764 0.262 -19.720 33.252 1.00 19.08 O ATOM 0 H GLY A 764 0.887 -15.830 31.915 1.00 18.32 H new ATOM 0 HA2 GLY A 764 0.747 -18.328 31.237 1.00 18.09 H new ATOM 0 HA3 GLY A 764 1.948 -17.688 31.999 1.00 18.09 H new ATOM 634 N TRP A 765 0.544 -17.805 34.397 1.00 18.99 N ATOM 635 CA TRP A 765 0.169 -18.412 35.665 1.00 18.33 C ATOM 636 C TRP A 765 -1.272 -18.909 35.635 1.00 19.18 C ATOM 637 O TRP A 765 -1.550 -20.045 36.029 1.00 18.67 O ATOM 638 CB TRP A 765 0.356 -17.418 36.812 1.00 19.39 C ATOM 639 CG TRP A 765 0.014 -18.000 38.143 1.00 21.22 C ATOM 640 CD1 TRP A 765 -1.095 -17.715 38.899 1.00 23.30 C ATOM 641 CD2 TRP A 765 0.732 -18.994 38.863 1.00 22.02 C ATOM 642 NE1 TRP A 765 -1.108 -18.476 40.037 1.00 22.42 N ATOM 643 CE2 TRP A 765 -0.006 -19.276 40.032 1.00 21.59 C ATOM 644 CE3 TRP A 765 1.915 -19.698 38.626 1.00 22.50 C ATOM 645 CZ2 TRP A 765 0.427 -20.220 40.976 1.00 23.33 C ATOM 646 CZ3 TRP A 765 2.332 -20.625 39.558 1.00 23.95 C ATOM 647 CH2 TRP A 765 1.589 -20.888 40.709 1.00 22.58 C ATOM 0 H TRP A 765 0.741 -16.969 34.441 1.00 18.99 H new ATOM 0 HA TRP A 765 0.751 -19.175 35.810 1.00 18.33 H new ATOM 0 HB2 TRP A 765 1.277 -17.114 36.824 1.00 19.39 H new ATOM 0 HB3 TRP A 765 -0.199 -16.638 36.652 1.00 19.39 H new ATOM 0 HD1 TRP A 765 -1.747 -17.092 38.670 1.00 23.30 H new ATOM 0 HE1 TRP A 765 -1.710 -18.453 40.651 1.00 22.42 H new ATOM 0 HE3 TRP A 765 2.412 -19.545 37.855 1.00 22.50 H new ATOM 0 HZ2 TRP A 765 -0.058 -20.384 41.753 1.00 23.33 H new ATOM 0 HZ3 TRP A 765 3.127 -21.086 39.416 1.00 23.95 H new ATOM 0 HH2 TRP A 765 1.891 -21.532 41.308 1.00 22.58 H new ATOM 648 N ARG A 766 -2.187 -18.061 35.178 1.00 19.05 N ATOM 649 CA ARG A 766 -3.601 -18.422 35.117 1.00 19.76 C ATOM 650 C ARG A 766 -3.873 -19.604 34.184 1.00 19.73 C ATOM 651 O ARG A 766 -4.691 -20.476 34.500 1.00 19.18 O ATOM 652 CB ARG A 766 -4.435 -17.214 34.683 1.00 18.86 C ATOM 653 CG ARG A 766 -4.442 -16.071 35.696 1.00 18.14 C ATOM 654 CD ARG A 766 -5.555 -15.087 35.374 1.00 19.41 C ATOM 655 NE ARG A 766 -5.383 -14.408 34.087 1.00 17.00 N ATOM 656 CZ ARG A 766 -4.498 -13.436 33.862 1.00 18.59 C ATOM 657 NH1 ARG A 766 -3.686 -13.013 34.836 1.00 21.64 N ATOM 658 NH2 ARG A 766 -4.428 -12.863 32.671 1.00 19.02 N ATOM 0 H ARG A 766 -2.010 -17.268 34.897 1.00 19.05 H new ATOM 0 HA ARG A 766 -3.859 -18.699 36.010 1.00 19.76 H new ATOM 0 HB2 ARG A 766 -4.093 -16.883 33.838 1.00 18.86 H new ATOM 0 HB3 ARG A 766 -5.348 -17.502 34.527 1.00 18.86 H new ATOM 0 HG2 ARG A 766 -4.563 -16.425 36.591 1.00 18.14 H new ATOM 0 HG3 ARG A 766 -3.586 -15.615 35.685 1.00 18.14 H new ATOM 0 HD2 ARG A 766 -6.403 -15.558 35.372 1.00 19.41 H new ATOM 0 HD3 ARG A 766 -5.602 -14.422 36.078 1.00 19.41 H new ATOM 0 HE ARG A 766 -5.886 -14.652 33.434 1.00 17.00 H new ATOM 0 HH11 ARG A 766 -3.731 -13.368 35.618 1.00 21.64 H new ATOM 0 HH12 ARG A 766 -3.119 -12.386 34.681 1.00 21.64 H new ATOM 0 HH21 ARG A 766 -4.954 -13.117 32.040 1.00 19.02 H new ATOM 0 HH22 ARG A 766 -3.857 -12.236 32.528 1.00 19.02 H new ATOM 659 N SER A 767 -3.197 -19.639 33.043 1.00 20.30 N ATOM 660 CA SER A 767 -3.389 -20.724 32.088 1.00 22.36 C ATOM 661 C SER A 767 -2.912 -22.028 32.718 1.00 22.29 C ATOM 662 O SER A 767 -3.569 -23.067 32.600 1.00 21.69 O ATOM 663 CB SER A 767 -2.609 -20.436 30.810 1.00 21.86 C ATOM 664 OG SER A 767 -3.082 -19.239 30.205 1.00 23.15 O ATOM 0 H SER A 767 -2.623 -19.046 32.802 1.00 20.30 H new ATOM 0 HA SER A 767 -4.329 -20.800 31.862 1.00 22.36 H new ATOM 0 HB2 SER A 767 -1.664 -20.353 31.012 1.00 21.86 H new ATOM 0 HB3 SER A 767 -2.703 -21.178 30.192 1.00 21.86 H new ATOM 0 HG SER A 767 -2.775 -18.575 30.618 1.00 23.15 H new ATOM 665 N TYR A 768 -1.765 -21.951 33.384 1.00 21.65 N ATOM 666 CA TYR A 768 -1.145 -23.080 34.075 1.00 20.17 C ATOM 667 C TYR A 768 -2.065 -23.607 35.180 1.00 20.69 C ATOM 668 O TYR A 768 -2.366 -24.805 35.227 1.00 17.81 O ATOM 669 CB TYR A 768 0.198 -22.604 34.656 1.00 21.80 C ATOM 670 CG TYR A 768 0.876 -23.505 35.662 1.00 21.87 C ATOM 671 CD1 TYR A 768 1.099 -24.857 35.400 1.00 21.33 C ATOM 672 CD2 TYR A 768 1.370 -22.982 36.852 1.00 20.39 C ATOM 673 CE1 TYR A 768 1.810 -25.649 36.294 1.00 20.33 C ATOM 674 CE2 TYR A 768 2.075 -23.765 37.741 1.00 19.41 C ATOM 675 CZ TYR A 768 2.298 -25.093 37.458 1.00 20.62 C ATOM 676 OH TYR A 768 3.051 -25.847 38.327 1.00 18.94 O ATOM 0 H TYR A 768 -1.313 -21.222 33.449 1.00 21.65 H new ATOM 0 HA TYR A 768 -0.994 -23.810 33.455 1.00 20.17 H new ATOM 0 HB2 TYR A 768 0.811 -22.463 33.918 1.00 21.80 H new ATOM 0 HB3 TYR A 768 0.055 -21.741 35.075 1.00 21.80 H new ATOM 0 HD1 TYR A 768 0.768 -25.233 34.617 1.00 21.33 H new ATOM 0 HD2 TYR A 768 1.222 -22.086 37.052 1.00 20.39 H new ATOM 0 HE1 TYR A 768 1.956 -26.549 36.108 1.00 20.33 H new ATOM 0 HE2 TYR A 768 2.399 -23.396 38.531 1.00 19.41 H new ATOM 0 HH TYR A 768 3.465 -25.339 38.852 1.00 18.94 H new ATOM 677 N LYS A 769 -2.519 -22.710 36.052 1.00 19.73 N ATOM 678 CA LYS A 769 -3.374 -23.084 37.180 1.00 21.06 C ATOM 679 C LYS A 769 -4.808 -23.522 36.835 1.00 20.61 C ATOM 680 O LYS A 769 -5.335 -24.452 37.456 1.00 21.62 O ATOM 681 CB LYS A 769 -3.453 -21.923 38.186 1.00 21.05 C ATOM 682 CG LYS A 769 -2.152 -21.631 38.921 1.00 22.68 C ATOM 683 CD LYS A 769 -1.863 -22.640 40.027 1.00 23.42 C ATOM 684 CE LYS A 769 -2.839 -22.521 41.191 1.00 21.23 C ATOM 685 NZ LYS A 769 -2.567 -23.517 42.281 1.00 16.93 N ATOM 0 H LYS A 769 -2.342 -21.870 36.008 1.00 19.73 H new ATOM 0 HA LYS A 769 -2.941 -23.870 37.549 1.00 21.06 H new ATOM 0 HB2 LYS A 769 -3.732 -21.122 37.716 1.00 21.05 H new ATOM 0 HB3 LYS A 769 -4.142 -22.123 38.839 1.00 21.05 H new ATOM 0 HG2 LYS A 769 -1.419 -21.633 38.286 1.00 22.68 H new ATOM 0 HG3 LYS A 769 -2.193 -20.740 39.303 1.00 22.68 H new ATOM 0 HD2 LYS A 769 -1.907 -23.538 39.662 1.00 23.42 H new ATOM 0 HD3 LYS A 769 -0.958 -22.510 40.352 1.00 23.42 H new ATOM 0 HE2 LYS A 769 -2.791 -21.624 41.558 1.00 21.23 H new ATOM 0 HE3 LYS A 769 -3.744 -22.645 40.863 1.00 21.23 H new ATOM 0 HZ1 LYS A 769 -3.160 -23.410 42.936 1.00 16.93 H new ATOM 0 HZ2 LYS A 769 -2.634 -24.342 41.953 1.00 16.93 H new ATOM 0 HZ3 LYS A 769 -1.746 -23.391 42.601 1.00 16.93 H new ATOM 686 N HIS A 770 -5.450 -22.871 35.867 1.00 20.61 N ATOM 687 CA HIS A 770 -6.840 -23.210 35.546 1.00 20.89 C ATOM 688 C HIS A 770 -7.067 -24.211 34.422 1.00 20.98 C ATOM 689 O HIS A 770 -8.029 -24.980 34.478 1.00 22.39 O ATOM 690 CB HIS A 770 -7.629 -21.926 35.253 1.00 21.69 C ATOM 691 CG HIS A 770 -7.680 -20.984 36.415 1.00 21.51 C ATOM 692 ND1 HIS A 770 -8.418 -21.245 37.546 1.00 24.58 N ATOM 693 CD2 HIS A 770 -7.030 -19.826 36.633 1.00 23.23 C ATOM 694 CE1 HIS A 770 -8.218 -20.271 38.425 1.00 25.26 C ATOM 695 NE2 HIS A 770 -7.385 -19.404 37.898 1.00 25.16 N ATOM 0 H HIS A 770 -5.109 -22.241 35.391 1.00 20.61 H new ATOM 0 HA HIS A 770 -7.158 -23.668 36.340 1.00 20.89 H new ATOM 0 HB2 HIS A 770 -7.228 -21.473 34.495 1.00 21.69 H new ATOM 0 HB3 HIS A 770 -8.534 -22.162 34.996 1.00 21.69 H new ATOM 0 HD1 HIS A 770 -8.926 -21.928 37.664 1.00 24.58 H new ATOM 0 HD2 HIS A 770 -6.453 -19.394 36.045 1.00 23.23 H new ATOM 0 HE1 HIS A 770 -8.602 -20.213 39.270 1.00 25.26 H new ATOM 696 N VAL A 771 -6.217 -24.200 33.401 1.00 20.74 N ATOM 697 CA VAL A 771 -6.406 -25.098 32.267 1.00 18.50 C ATOM 698 C VAL A 771 -5.167 -25.904 31.895 1.00 18.50 C ATOM 699 O VAL A 771 -4.976 -26.250 30.726 1.00 17.99 O ATOM 700 CB VAL A 771 -6.888 -24.303 31.037 1.00 18.67 C ATOM 701 CG1 VAL A 771 -8.329 -23.838 31.241 1.00 19.33 C ATOM 702 CG2 VAL A 771 -6.003 -23.088 30.823 1.00 17.66 C ATOM 0 H VAL A 771 -5.530 -23.685 33.345 1.00 20.74 H new ATOM 0 HA VAL A 771 -7.077 -25.740 32.549 1.00 18.50 H new ATOM 0 HB VAL A 771 -6.841 -24.882 30.260 1.00 18.67 H new ATOM 0 HG11 VAL A 771 -8.622 -23.339 30.462 1.00 19.33 H new ATOM 0 HG12 VAL A 771 -8.904 -24.610 31.365 1.00 19.33 H new ATOM 0 HG13 VAL A 771 -8.378 -23.269 32.025 1.00 19.33 H new ATOM 0 HG21 VAL A 771 -6.313 -22.594 30.048 1.00 17.66 H new ATOM 0 HG22 VAL A 771 -6.042 -22.517 31.606 1.00 17.66 H new ATOM 0 HG23 VAL A 771 -5.088 -23.375 30.678 1.00 17.66 H new ATOM 703 N SER A 772 -4.339 -26.211 32.893 1.00 17.72 N ATOM 704 CA SER A 772 -3.117 -26.990 32.694 1.00 17.77 C ATOM 705 C SER A 772 -2.310 -26.519 31.497 1.00 17.35 C ATOM 706 O SER A 772 -1.657 -27.318 30.818 1.00 17.53 O ATOM 707 CB SER A 772 -3.457 -28.474 32.537 1.00 17.75 C ATOM 708 OG SER A 772 -4.064 -28.980 33.721 1.00 19.96 O ATOM 0 H SER A 772 -4.471 -25.972 33.708 1.00 17.72 H new ATOM 0 HA SER A 772 -2.568 -26.857 33.482 1.00 17.77 H new ATOM 0 HB2 SER A 772 -4.056 -28.595 31.784 1.00 17.75 H new ATOM 0 HB3 SER A 772 -2.651 -28.976 32.342 1.00 17.75 H new ATOM 0 HG SER A 772 -4.844 -28.676 33.788 1.00 19.96 H new ATOM 709 N GLY A 773 -2.347 -25.213 31.256 1.00 17.87 N ATOM 710 CA GLY A 773 -1.604 -24.626 30.155 1.00 20.07 C ATOM 711 C GLY A 773 -2.069 -25.000 28.761 1.00 20.10 C ATOM 712 O GLY A 773 -1.423 -24.617 27.781 1.00 21.02 O ATOM 0 H GLY A 773 -2.799 -24.649 31.722 1.00 17.87 H new ATOM 0 HA2 GLY A 773 -1.643 -23.661 30.241 1.00 20.07 H new ATOM 0 HA3 GLY A 773 -0.673 -24.881 30.245 1.00 20.07 H new ATOM 713 N GLN A 774 -3.177 -25.728 28.650 1.00 19.22 N ATOM 714 CA GLN A 774 -3.661 -26.145 27.342 1.00 21.36 C ATOM 715 C GLN A 774 -4.559 -25.118 26.657 1.00 21.75 C ATOM 716 O GLN A 774 -5.022 -25.345 25.539 1.00 20.89 O ATOM 717 CB GLN A 774 -4.379 -27.481 27.462 1.00 21.62 C ATOM 718 CG GLN A 774 -3.495 -28.548 28.068 1.00 25.83 C ATOM 719 CD GLN A 774 -2.125 -28.583 27.420 1.00 28.01 C ATOM 720 OE1 GLN A 774 -1.996 -28.908 26.241 1.00 26.07 O ATOM 721 NE2 GLN A 774 -1.088 -28.251 28.195 1.00 32.29 N ATOM 0 H GLN A 774 -3.658 -25.988 29.314 1.00 19.22 H new ATOM 0 HA GLN A 774 -2.879 -26.232 26.774 1.00 21.36 H new ATOM 0 HB2 GLN A 774 -5.173 -27.372 28.008 1.00 21.62 H new ATOM 0 HB3 GLN A 774 -4.675 -27.768 26.584 1.00 21.62 H new ATOM 0 HG2 GLN A 774 -3.398 -28.385 29.019 1.00 25.83 H new ATOM 0 HG3 GLN A 774 -3.921 -29.414 27.970 1.00 25.83 H new ATOM 0 HE21 GLN A 774 -1.218 -28.029 29.016 1.00 32.29 H new ATOM 0 HE22 GLN A 774 -0.291 -28.259 27.873 1.00 32.29 H new ATOM 722 N MET A 775 -4.795 -23.993 27.326 1.00 21.66 N ATOM 723 CA MET A 775 -5.600 -22.889 26.787 1.00 22.18 C ATOM 724 C MET A 775 -5.046 -21.595 27.376 1.00 20.06 C ATOM 725 O MET A 775 -4.401 -21.627 28.424 1.00 19.34 O ATOM 726 CB MET A 775 -7.068 -23.021 27.187 1.00 24.30 C ATOM 727 CG MET A 775 -7.810 -24.149 26.508 1.00 28.77 C ATOM 728 SD MET A 775 -9.571 -23.993 26.745 1.00 33.13 S ATOM 729 CE MET A 775 -9.971 -25.473 27.661 1.00 34.25 C ATOM 0 H MET A 775 -4.490 -23.844 28.116 1.00 21.66 H new ATOM 0 HA MET A 775 -5.552 -22.899 25.818 1.00 22.18 H new ATOM 0 HB2 MET A 775 -7.118 -23.149 28.147 1.00 24.30 H new ATOM 0 HB3 MET A 775 -7.521 -22.187 26.988 1.00 24.30 H new ATOM 0 HG2 MET A 775 -7.607 -24.149 25.559 1.00 28.77 H new ATOM 0 HG3 MET A 775 -7.507 -24.999 26.863 1.00 28.77 H new ATOM 0 HE1 MET A 775 -10.923 -25.491 27.847 1.00 34.25 H new ATOM 0 HE2 MET A 775 -9.730 -26.253 27.137 1.00 34.25 H new ATOM 0 HE3 MET A 775 -9.478 -25.480 28.496 1.00 34.25 H new ATOM 730 N LEU A 776 -5.278 -20.474 26.704 1.00 17.99 N ATOM 731 CA LEU A 776 -4.806 -19.192 27.217 1.00 18.93 C ATOM 732 C LEU A 776 -5.916 -18.568 28.042 1.00 18.48 C ATOM 733 O LEU A 776 -6.926 -18.111 27.506 1.00 19.88 O ATOM 734 CB LEU A 776 -4.387 -18.254 26.080 1.00 18.87 C ATOM 735 CG LEU A 776 -3.145 -18.736 25.341 1.00 20.31 C ATOM 736 CD1 LEU A 776 -2.721 -17.737 24.281 1.00 20.23 C ATOM 737 CD2 LEU A 776 -2.036 -18.968 26.349 1.00 21.63 C ATOM 0 H LEU A 776 -5.702 -20.432 25.957 1.00 17.99 H new ATOM 0 HA LEU A 776 -4.022 -19.337 27.769 1.00 18.93 H new ATOM 0 HB2 LEU A 776 -5.120 -18.169 25.450 1.00 18.87 H new ATOM 0 HB3 LEU A 776 -4.220 -17.370 26.442 1.00 18.87 H new ATOM 0 HG LEU A 776 -3.343 -19.568 24.884 1.00 20.31 H new ATOM 0 HD11 LEU A 776 -1.930 -18.065 23.825 1.00 20.23 H new ATOM 0 HD12 LEU A 776 -3.439 -17.621 23.639 1.00 20.23 H new ATOM 0 HD13 LEU A 776 -2.522 -16.885 24.700 1.00 20.23 H new ATOM 0 HD21 LEU A 776 -1.239 -19.276 25.889 1.00 21.63 H new ATOM 0 HD22 LEU A 776 -1.841 -18.139 26.813 1.00 21.63 H new ATOM 0 HD23 LEU A 776 -2.317 -19.639 26.991 1.00 21.63 H new ATOM 738 N TYR A 777 -5.733 -18.580 29.357 1.00 18.59 N ATOM 739 CA TYR A 777 -6.726 -18.052 30.288 1.00 17.34 C ATOM 740 C TYR A 777 -6.499 -16.560 30.593 1.00 18.45 C ATOM 741 O TYR A 777 -5.989 -16.191 31.658 1.00 16.70 O ATOM 742 CB TYR A 777 -6.676 -18.897 31.564 1.00 16.85 C ATOM 743 CG TYR A 777 -7.857 -18.788 32.507 1.00 18.08 C ATOM 744 CD1 TYR A 777 -8.026 -17.676 33.327 1.00 19.81 C ATOM 745 CD2 TYR A 777 -8.760 -19.843 32.644 1.00 18.09 C ATOM 746 CE1 TYR A 777 -9.040 -17.636 34.275 1.00 18.83 C ATOM 747 CE2 TYR A 777 -9.772 -19.803 33.589 1.00 17.65 C ATOM 748 CZ TYR A 777 -9.905 -18.703 34.399 1.00 19.25 C ATOM 749 OH TYR A 777 -10.861 -18.691 35.385 1.00 18.35 O ATOM 0 H TYR A 777 -5.028 -18.895 29.737 1.00 18.59 H new ATOM 0 HA TYR A 777 -7.606 -18.109 29.885 1.00 17.34 H new ATOM 0 HB2 TYR A 777 -6.581 -19.827 31.306 1.00 16.85 H new ATOM 0 HB3 TYR A 777 -5.875 -18.655 32.055 1.00 16.85 H new ATOM 0 HD1 TYR A 777 -7.452 -16.950 33.239 1.00 19.81 H new ATOM 0 HD2 TYR A 777 -8.681 -20.586 32.091 1.00 18.09 H new ATOM 0 HE1 TYR A 777 -9.135 -16.892 34.825 1.00 18.83 H new ATOM 0 HE2 TYR A 777 -10.359 -20.519 33.674 1.00 17.65 H new ATOM 0 HH TYR A 777 -11.315 -19.397 35.344 1.00 18.35 H new ATOM 750 N PHE A 778 -6.874 -15.702 29.651 1.00 19.39 N ATOM 751 CA PHE A 778 -6.717 -14.264 29.844 1.00 18.25 C ATOM 752 C PHE A 778 -7.597 -13.809 31.011 1.00 18.95 C ATOM 753 O PHE A 778 -7.203 -12.950 31.804 1.00 18.70 O ATOM 754 CB PHE A 778 -7.108 -13.503 28.574 1.00 17.82 C ATOM 755 CG PHE A 778 -6.198 -13.768 27.405 1.00 18.38 C ATOM 756 CD1 PHE A 778 -6.472 -14.786 26.500 1.00 17.85 C ATOM 757 CD2 PHE A 778 -5.068 -12.993 27.202 1.00 17.48 C ATOM 758 CE1 PHE A 778 -5.630 -15.025 25.426 1.00 16.28 C ATOM 759 CE2 PHE A 778 -4.231 -13.236 26.131 1.00 18.34 C ATOM 760 CZ PHE A 778 -4.515 -14.247 25.236 1.00 15.77 C ATOM 0 H PHE A 778 -7.220 -15.929 28.897 1.00 19.39 H new ATOM 0 HA PHE A 778 -5.786 -14.074 30.042 1.00 18.25 H new ATOM 0 HB2 PHE A 778 -8.015 -13.744 28.329 1.00 17.82 H new ATOM 0 HB3 PHE A 778 -7.109 -12.552 28.764 1.00 17.82 H new ATOM 0 HD1 PHE A 778 -7.229 -15.313 26.616 1.00 17.85 H new ATOM 0 HD2 PHE A 778 -4.871 -12.302 27.793 1.00 17.48 H new ATOM 0 HE1 PHE A 778 -5.821 -15.715 24.832 1.00 16.28 H new ATOM 0 HE2 PHE A 778 -3.470 -12.714 26.012 1.00 18.34 H new ATOM 0 HZ PHE A 778 -3.955 -14.400 24.509 1.00 15.77 H new ATOM 761 N ALA A 779 -8.792 -14.386 31.100 1.00 17.99 N ATOM 762 CA ALA A 779 -9.748 -14.058 32.158 1.00 19.18 C ATOM 763 C ALA A 779 -10.842 -15.117 32.193 1.00 20.23 C ATOM 764 O ALA A 779 -11.024 -15.853 31.223 1.00 20.61 O ATOM 765 CB ALA A 779 -10.363 -12.678 31.898 1.00 16.85 C ATOM 0 H ALA A 779 -9.074 -14.981 30.547 1.00 17.99 H new ATOM 0 HA ALA A 779 -9.290 -14.039 33.013 1.00 19.18 H new ATOM 0 HB1 ALA A 779 -10.995 -12.467 32.603 1.00 16.85 H new ATOM 0 HB2 ALA A 779 -9.661 -12.008 31.883 1.00 16.85 H new ATOM 0 HB3 ALA A 779 -10.822 -12.684 31.044 1.00 16.85 H new ATOM 766 N PRO A 780 -11.585 -15.210 33.304 1.00 22.99 N ATOM 767 CA PRO A 780 -12.662 -16.198 33.421 1.00 23.35 C ATOM 768 C PRO A 780 -13.667 -16.092 32.281 1.00 24.13 C ATOM 769 O PRO A 780 -14.214 -17.101 31.826 1.00 26.17 O ATOM 770 CB PRO A 780 -13.290 -15.861 34.771 1.00 22.56 C ATOM 771 CG PRO A 780 -12.138 -15.328 35.531 1.00 23.96 C ATOM 772 CD PRO A 780 -11.453 -14.441 34.551 1.00 22.99 C ATOM 0 HA PRO A 780 -12.343 -17.112 33.368 1.00 23.35 H new ATOM 0 HB2 PRO A 780 -14.001 -15.207 34.686 1.00 22.56 H new ATOM 0 HB3 PRO A 780 -13.674 -16.643 35.197 1.00 22.56 H new ATOM 0 HG2 PRO A 780 -12.425 -14.837 36.317 1.00 23.96 H new ATOM 0 HG3 PRO A 780 -11.554 -16.039 35.838 1.00 23.96 H new ATOM 0 HD2 PRO A 780 -11.878 -13.571 34.489 1.00 22.99 H new ATOM 0 HD3 PRO A 780 -10.525 -14.287 34.787 1.00 22.99 H new ATOM 773 N ASP A 781 -13.890 -14.873 31.803 1.00 23.64 N ATOM 774 CA ASP A 781 -14.830 -14.626 30.711 1.00 22.54 C ATOM 775 C ASP A 781 -14.139 -14.504 29.359 1.00 22.70 C ATOM 776 O ASP A 781 -14.754 -14.103 28.370 1.00 22.14 O ATOM 777 CB ASP A 781 -15.638 -13.356 31.009 1.00 22.83 C ATOM 778 CG ASP A 781 -14.765 -12.114 31.132 1.00 24.26 C ATOM 779 OD1 ASP A 781 -13.553 -12.249 31.414 1.00 20.79 O ATOM 780 OD2 ASP A 781 -15.305 -11.002 30.961 1.00 26.52 O ATOM 0 H ASP A 781 -13.502 -14.165 32.101 1.00 23.64 H new ATOM 0 HA ASP A 781 -15.422 -15.393 30.655 1.00 22.54 H new ATOM 0 HB2 ASP A 781 -16.289 -13.219 30.303 1.00 22.83 H new ATOM 0 HB3 ASP A 781 -16.134 -13.480 31.833 1.00 22.83 H new ATOM 781 N LEU A 782 -12.858 -14.848 29.314 1.00 20.94 N ATOM 782 CA LEU A 782 -12.098 -14.782 28.068 1.00 21.15 C ATOM 783 C LEU A 782 -10.994 -15.832 28.071 1.00 22.67 C ATOM 784 O LEU A 782 -9.831 -15.546 28.365 1.00 20.53 O ATOM 785 CB LEU A 782 -11.505 -13.381 27.888 1.00 21.80 C ATOM 786 CG LEU A 782 -10.885 -13.009 26.549 1.00 22.48 C ATOM 787 CD1 LEU A 782 -11.817 -13.438 25.429 1.00 20.96 C ATOM 788 CD2 LEU A 782 -10.620 -11.501 26.512 1.00 20.68 C ATOM 0 H LEU A 782 -12.408 -15.123 29.993 1.00 20.94 H new ATOM 0 HA LEU A 782 -12.694 -14.964 27.325 1.00 21.15 H new ATOM 0 HB2 LEU A 782 -12.208 -12.739 28.073 1.00 21.80 H new ATOM 0 HB3 LEU A 782 -10.825 -13.261 28.569 1.00 21.80 H new ATOM 0 HG LEU A 782 -10.038 -13.466 26.431 1.00 22.48 H new ATOM 0 HD11 LEU A 782 -11.425 -13.202 24.574 1.00 20.96 H new ATOM 0 HD12 LEU A 782 -11.951 -14.398 25.469 1.00 20.96 H new ATOM 0 HD13 LEU A 782 -12.671 -12.988 25.528 1.00 20.96 H new ATOM 0 HD21 LEU A 782 -10.225 -11.263 25.659 1.00 20.68 H new ATOM 0 HD22 LEU A 782 -11.456 -11.022 26.626 1.00 20.68 H new ATOM 0 HD23 LEU A 782 -10.011 -11.262 27.228 1.00 20.68 H new ATOM 789 N ILE A 783 -11.385 -17.056 27.743 1.00 22.66 N ATOM 790 CA ILE A 783 -10.463 -18.176 27.674 1.00 24.06 C ATOM 791 C ILE A 783 -10.344 -18.555 26.205 1.00 24.36 C ATOM 792 O ILE A 783 -11.319 -18.977 25.580 1.00 24.88 O ATOM 793 CB ILE A 783 -11.001 -19.357 28.483 1.00 23.03 C ATOM 794 CG1 ILE A 783 -11.324 -18.876 29.897 1.00 22.83 C ATOM 795 CG2 ILE A 783 -9.983 -20.495 28.498 1.00 23.57 C ATOM 796 CD1 ILE A 783 -12.047 -19.886 30.753 1.00 23.41 C ATOM 0 H ILE A 783 -12.199 -17.260 27.553 1.00 22.66 H new ATOM 0 HA ILE A 783 -9.599 -17.938 28.044 1.00 24.06 H new ATOM 0 HB ILE A 783 -11.811 -19.700 28.075 1.00 23.03 H new ATOM 0 HG12 ILE A 783 -10.497 -18.628 30.339 1.00 22.83 H new ATOM 0 HG13 ILE A 783 -11.865 -18.073 29.837 1.00 22.83 H new ATOM 0 HG21 ILE A 783 -10.335 -21.238 29.013 1.00 23.57 H new ATOM 0 HG22 ILE A 783 -9.810 -20.786 27.589 1.00 23.57 H new ATOM 0 HG23 ILE A 783 -9.157 -20.185 28.901 1.00 23.57 H new ATOM 0 HD11 ILE A 783 -12.214 -19.507 31.630 1.00 23.41 H new ATOM 0 HD12 ILE A 783 -12.891 -20.119 30.336 1.00 23.41 H new ATOM 0 HD13 ILE A 783 -11.501 -20.683 30.845 1.00 23.41 H new ATOM 797 N LEU A 784 -9.154 -18.391 25.646 1.00 24.98 N ATOM 798 CA LEU A 784 -8.968 -18.681 24.234 1.00 27.73 C ATOM 799 C LEU A 784 -8.248 -19.990 23.910 1.00 30.39 C ATOM 800 O LEU A 784 -7.312 -20.406 24.601 1.00 29.05 O ATOM 801 CB LEU A 784 -8.223 -17.529 23.565 1.00 26.39 C ATOM 802 CG LEU A 784 -8.907 -16.178 23.625 1.00 29.15 C ATOM 803 CD1 LEU A 784 -8.127 -15.150 22.809 1.00 28.02 C ATOM 804 CD2 LEU A 784 -10.315 -16.337 23.106 1.00 27.10 C ATOM 0 H LEU A 784 -8.451 -18.117 26.059 1.00 24.98 H new ATOM 0 HA LEU A 784 -9.867 -18.787 23.886 1.00 27.73 H new ATOM 0 HB2 LEU A 784 -7.349 -17.449 23.977 1.00 26.39 H new ATOM 0 HB3 LEU A 784 -8.077 -17.758 22.634 1.00 26.39 H new ATOM 0 HG LEU A 784 -8.936 -15.856 24.539 1.00 29.15 H new ATOM 0 HD11 LEU A 784 -8.576 -14.291 22.856 1.00 28.02 H new ATOM 0 HD12 LEU A 784 -7.230 -15.066 23.167 1.00 28.02 H new ATOM 0 HD13 LEU A 784 -8.080 -15.439 21.884 1.00 28.02 H new ATOM 0 HD21 LEU A 784 -10.770 -15.481 23.137 1.00 27.10 H new ATOM 0 HD22 LEU A 784 -10.288 -16.656 22.190 1.00 27.10 H new ATOM 0 HD23 LEU A 784 -10.793 -16.976 23.657 1.00 27.10 H new ATOM 805 N ASN A 785 -8.702 -20.646 22.851 1.00 32.79 N ATOM 806 CA ASN A 785 -8.094 -21.894 22.399 1.00 35.42 C ATOM 807 C ASN A 785 -7.780 -21.721 20.929 1.00 36.99 C ATOM 808 O ASN A 785 -7.928 -20.619 20.400 1.00 35.73 O ATOM 809 CB ASN A 785 -9.023 -23.098 22.620 1.00 36.09 C ATOM 810 CG ASN A 785 -10.427 -22.865 22.113 1.00 36.49 C ATOM 811 OD1 ASN A 785 -10.626 -22.155 21.136 1.00 38.33 O ATOM 812 ND2 ASN A 785 -11.406 -23.476 22.765 1.00 37.41 N ATOM 0 H ASN A 785 -9.368 -20.384 22.374 1.00 32.79 H new ATOM 0 HA ASN A 785 -7.291 -22.077 22.911 1.00 35.42 H new ATOM 0 HB2 ASN A 785 -8.649 -23.874 22.175 1.00 36.09 H new ATOM 0 HB3 ASN A 785 -9.057 -23.304 23.567 1.00 36.09 H new ATOM 0 HD21 ASN A 785 -12.220 -23.381 22.505 1.00 37.41 H new ATOM 0 HD22 ASN A 785 -11.227 -23.967 23.448 1.00 37.41 H new ATOM 813 N GLU A 786 -7.352 -22.794 20.271 1.00 38.94 N ATOM 814 CA GLU A 786 -6.996 -22.714 18.857 1.00 40.98 C ATOM 815 C GLU A 786 -8.100 -22.136 17.989 1.00 40.21 C ATOM 816 O GLU A 786 -7.845 -21.243 17.190 1.00 40.44 O ATOM 817 CB GLU A 786 -6.606 -24.088 18.302 1.00 43.45 C ATOM 818 CG GLU A 786 -5.268 -24.603 18.829 1.00 46.04 C ATOM 819 CD GLU A 786 -5.340 -25.074 20.281 1.00 47.73 C ATOM 820 OE1 GLU A 786 -4.290 -25.487 20.815 1.00 48.49 O ATOM 821 OE2 GLU A 786 -6.442 -25.032 20.872 1.00 48.35 O ATOM 0 H GLU A 786 -7.261 -23.574 20.622 1.00 38.94 H new ATOM 0 HA GLU A 786 -6.238 -22.110 18.820 1.00 40.98 H new ATOM 0 HB2 GLU A 786 -7.301 -24.727 18.525 1.00 43.45 H new ATOM 0 HB3 GLU A 786 -6.566 -24.038 17.334 1.00 43.45 H new ATOM 0 HG2 GLU A 786 -4.967 -25.337 18.271 1.00 46.04 H new ATOM 0 HG3 GLU A 786 -4.604 -23.899 18.755 1.00 46.04 H new ATOM 822 N GLN A 787 -9.314 -22.645 18.149 1.00 40.89 N ATOM 823 CA GLN A 787 -10.444 -22.194 17.358 1.00 41.64 C ATOM 824 C GLN A 787 -10.655 -20.681 17.371 1.00 41.21 C ATOM 825 O GLN A 787 -10.968 -20.098 16.334 1.00 41.73 O ATOM 826 CB GLN A 787 -11.714 -22.876 17.849 1.00 42.76 C ATOM 827 CG GLN A 787 -11.576 -24.381 17.995 1.00 45.75 C ATOM 828 CD GLN A 787 -12.809 -24.976 18.645 1.00 46.58 C ATOM 829 OE1 GLN A 787 -12.880 -26.178 18.897 1.00 46.36 O ATOM 830 NE2 GLN A 787 -13.800 -24.124 18.916 1.00 45.92 N ATOM 0 H GLN A 787 -9.504 -23.261 18.719 1.00 40.89 H new ATOM 0 HA GLN A 787 -10.242 -22.437 16.441 1.00 41.64 H new ATOM 0 HB2 GLN A 787 -11.966 -22.497 18.706 1.00 42.76 H new ATOM 0 HB3 GLN A 787 -12.436 -22.683 17.230 1.00 42.76 H new ATOM 0 HG2 GLN A 787 -11.439 -24.783 17.123 1.00 45.75 H new ATOM 0 HG3 GLN A 787 -10.793 -24.588 18.529 1.00 45.75 H new ATOM 0 HE21 GLN A 787 -13.714 -23.290 18.725 1.00 45.92 H new ATOM 0 HE22 GLN A 787 -14.524 -24.409 19.281 1.00 45.92 H new ATOM 831 N ARG A 788 -10.502 -20.047 18.532 1.00 39.40 N ATOM 832 CA ARG A 788 -10.729 -18.603 18.628 1.00 39.28 C ATOM 833 C ARG A 788 -9.540 -17.752 18.188 1.00 39.00 C ATOM 834 O ARG A 788 -9.503 -16.547 18.439 1.00 38.89 O ATOM 835 CB ARG A 788 -11.156 -18.240 20.049 1.00 38.21 C ATOM 836 CG ARG A 788 -12.383 -19.027 20.488 1.00 38.79 C ATOM 837 CD ARG A 788 -12.793 -18.685 21.915 1.00 38.96 C ATOM 838 NE ARG A 788 -13.324 -17.328 22.029 1.00 40.09 N ATOM 839 CZ ARG A 788 -13.700 -16.778 23.183 1.00 40.30 C ATOM 840 NH1 ARG A 788 -13.597 -17.470 24.326 1.00 40.42 N ATOM 841 NH2 ARG A 788 -14.189 -15.546 23.210 1.00 41.08 N ATOM 0 H ARG A 788 -10.270 -20.427 19.268 1.00 39.40 H new ATOM 0 HA ARG A 788 -11.440 -18.396 18.001 1.00 39.28 H new ATOM 0 HB2 ARG A 788 -10.424 -18.414 20.661 1.00 38.21 H new ATOM 0 HB3 ARG A 788 -11.347 -17.290 20.097 1.00 38.21 H new ATOM 0 HG2 ARG A 788 -13.120 -18.840 19.886 1.00 38.79 H new ATOM 0 HG3 ARG A 788 -12.198 -19.977 20.423 1.00 38.79 H new ATOM 0 HD2 ARG A 788 -13.462 -19.319 22.218 1.00 38.96 H new ATOM 0 HD3 ARG A 788 -12.026 -18.780 22.501 1.00 38.96 H new ATOM 0 HE ARG A 788 -13.398 -16.859 21.312 1.00 40.09 H new ATOM 0 HH11 ARG A 788 -13.287 -18.272 24.317 1.00 40.42 H new ATOM 0 HH12 ARG A 788 -13.841 -17.112 25.069 1.00 40.42 H new ATOM 0 HH21 ARG A 788 -14.265 -15.097 22.480 1.00 41.08 H new ATOM 0 HH22 ARG A 788 -14.430 -15.195 23.957 1.00 41.08 H new ATOM 842 N MET A 789 -8.607 -18.373 17.475 1.00 39.41 N ATOM 843 CA MET A 789 -7.415 -17.693 16.975 1.00 40.34 C ATOM 844 C MET A 789 -7.343 -17.931 15.480 1.00 41.83 C ATOM 845 O MET A 789 -6.502 -18.693 15.008 1.00 42.26 O ATOM 846 CB MET A 789 -6.179 -18.252 17.675 1.00 38.87 C ATOM 847 CG MET A 789 -6.284 -18.217 19.185 1.00 37.52 C ATOM 848 SD MET A 789 -4.925 -18.998 20.057 1.00 36.55 S ATOM 849 CE MET A 789 -5.619 -19.102 21.677 1.00 34.92 C ATOM 0 H MET A 789 -8.647 -19.206 17.266 1.00 39.41 H new ATOM 0 HA MET A 789 -7.455 -16.740 17.154 1.00 40.34 H new ATOM 0 HB2 MET A 789 -6.037 -19.167 17.387 1.00 38.87 H new ATOM 0 HB3 MET A 789 -5.400 -17.744 17.399 1.00 38.87 H new ATOM 0 HG2 MET A 789 -6.345 -17.292 19.470 1.00 37.52 H new ATOM 0 HG3 MET A 789 -7.111 -18.650 19.448 1.00 37.52 H new ATOM 0 HE1 MET A 789 -5.434 -19.977 22.053 1.00 34.92 H new ATOM 0 HE2 MET A 789 -5.227 -18.418 22.242 1.00 34.92 H new ATOM 0 HE3 MET A 789 -6.578 -18.968 21.627 1.00 34.92 H new ATOM 850 N LYS A 790 -8.240 -17.271 14.754 1.00 43.43 N ATOM 851 CA LYS A 790 -8.345 -17.423 13.307 1.00 44.01 C ATOM 852 C LYS A 790 -7.247 -16.723 12.515 1.00 45.09 C ATOM 853 O LYS A 790 -6.746 -17.250 11.523 1.00 46.54 O ATOM 854 CB LYS A 790 -9.711 -16.909 12.853 1.00 43.26 C ATOM 855 CG LYS A 790 -10.862 -17.557 13.600 1.00 42.17 C ATOM 856 CD LYS A 790 -12.142 -16.757 13.444 1.00 43.50 C ATOM 857 CE LYS A 790 -13.235 -17.310 14.346 1.00 42.15 C ATOM 858 NZ LYS A 790 -14.472 -16.479 14.269 1.00 44.02 N ATOM 0 H LYS A 790 -8.808 -16.719 15.089 1.00 43.43 H new ATOM 0 HA LYS A 790 -8.238 -18.369 13.123 1.00 44.01 H new ATOM 0 HB2 LYS A 790 -9.749 -15.948 12.980 1.00 43.26 H new ATOM 0 HB3 LYS A 790 -9.814 -17.074 11.903 1.00 43.26 H new ATOM 0 HG2 LYS A 790 -10.999 -18.458 13.268 1.00 42.17 H new ATOM 0 HG3 LYS A 790 -10.638 -17.632 14.541 1.00 42.17 H new ATOM 0 HD2 LYS A 790 -11.976 -15.827 13.662 1.00 43.50 H new ATOM 0 HD3 LYS A 790 -12.435 -16.784 12.520 1.00 43.50 H new ATOM 0 HE2 LYS A 790 -13.439 -18.223 14.088 1.00 42.15 H new ATOM 0 HE3 LYS A 790 -12.918 -17.338 15.262 1.00 42.15 H new ATOM 0 HZ1 LYS A 790 -15.095 -16.823 14.804 1.00 44.02 H new ATOM 0 HZ2 LYS A 790 -14.287 -15.647 14.525 1.00 44.02 H new ATOM 0 HZ3 LYS A 790 -14.773 -16.471 13.431 1.00 44.02 H new ATOM 859 N GLU A 791 -6.889 -15.528 12.948 1.00 45.80 N ATOM 860 CA GLU A 791 -5.870 -14.728 12.282 1.00 46.24 C ATOM 861 C GLU A 791 -4.413 -15.153 12.523 1.00 46.03 C ATOM 862 O GLU A 791 -3.940 -15.234 13.665 1.00 45.78 O ATOM 863 CB GLU A 791 -6.065 -13.289 12.717 1.00 48.02 C ATOM 864 CG GLU A 791 -4.843 -12.404 12.655 1.00 50.27 C ATOM 865 CD GLU A 791 -4.574 -11.870 11.268 1.00 52.00 C ATOM 866 OE1 GLU A 791 -5.553 -11.477 10.595 1.00 53.26 O ATOM 867 OE2 GLU A 791 -3.388 -11.832 10.872 1.00 51.19 O ATOM 0 H GLU A 791 -7.231 -15.152 13.642 1.00 45.80 H new ATOM 0 HA GLU A 791 -5.997 -14.859 11.329 1.00 46.24 H new ATOM 0 HB2 GLU A 791 -6.756 -12.894 12.163 1.00 48.02 H new ATOM 0 HB3 GLU A 791 -6.397 -13.288 13.629 1.00 48.02 H new ATOM 0 HG2 GLU A 791 -4.957 -11.660 13.267 1.00 50.27 H new ATOM 0 HG3 GLU A 791 -4.070 -12.905 12.959 1.00 50.27 H new ATOM 868 N SER A 792 -3.703 -15.392 11.429 1.00 44.47 N ATOM 869 CA SER A 792 -2.307 -15.805 11.472 1.00 45.24 C ATOM 870 C SER A 792 -1.423 -14.898 12.322 1.00 44.37 C ATOM 871 O SER A 792 -0.496 -15.386 12.974 1.00 45.58 O ATOM 872 CB SER A 792 -1.741 -15.878 10.049 1.00 46.68 C ATOM 873 OG SER A 792 -2.119 -14.739 9.285 1.00 48.38 O ATOM 0 H SER A 792 -4.020 -15.318 10.633 1.00 44.47 H new ATOM 0 HA SER A 792 -2.297 -16.679 11.893 1.00 45.24 H new ATOM 0 HB2 SER A 792 -0.774 -15.939 10.086 1.00 46.68 H new ATOM 0 HB3 SER A 792 -2.060 -16.683 9.613 1.00 46.68 H new ATOM 0 HG SER A 792 -1.797 -14.801 8.512 1.00 48.38 H new ATOM 874 N SER A 793 -1.703 -13.597 12.323 1.00 42.06 N ATOM 875 CA SER A 793 -0.909 -12.653 13.093 1.00 39.24 C ATOM 876 C SER A 793 -1.196 -12.838 14.573 1.00 37.35 C ATOM 877 O SER A 793 -0.277 -12.880 15.382 1.00 37.01 O ATOM 878 CB SER A 793 -1.235 -11.221 12.674 1.00 40.07 C ATOM 879 OG SER A 793 -0.354 -10.303 13.303 1.00 40.61 O ATOM 0 H SER A 793 -2.351 -13.243 11.882 1.00 42.06 H new ATOM 0 HA SER A 793 0.032 -12.818 12.924 1.00 39.24 H new ATOM 0 HB2 SER A 793 -1.164 -11.137 11.710 1.00 40.07 H new ATOM 0 HB3 SER A 793 -2.152 -11.010 12.910 1.00 40.07 H new ATOM 0 HG SER A 793 -0.545 -9.521 13.062 1.00 40.61 H new ATOM 880 N PHE A 794 -2.472 -12.952 14.916 1.00 35.92 N ATOM 881 CA PHE A 794 -2.877 -13.128 16.295 1.00 34.57 C ATOM 882 C PHE A 794 -2.504 -14.507 16.818 1.00 33.52 C ATOM 883 O PHE A 794 -2.119 -14.659 17.972 1.00 32.94 O ATOM 884 CB PHE A 794 -4.381 -12.931 16.435 1.00 36.05 C ATOM 885 CG PHE A 794 -4.839 -12.934 17.850 1.00 36.61 C ATOM 886 CD1 PHE A 794 -4.349 -11.994 18.737 1.00 36.54 C ATOM 887 CD2 PHE A 794 -5.716 -13.891 18.317 1.00 37.30 C ATOM 888 CE1 PHE A 794 -4.718 -12.015 20.053 1.00 35.99 C ATOM 889 CE2 PHE A 794 -6.087 -13.911 19.645 1.00 37.94 C ATOM 890 CZ PHE A 794 -5.586 -12.968 20.510 1.00 35.99 C ATOM 0 H PHE A 794 -3.123 -12.929 14.355 1.00 35.92 H new ATOM 0 HA PHE A 794 -2.407 -12.462 16.820 1.00 34.57 H new ATOM 0 HB2 PHE A 794 -4.632 -12.090 16.021 1.00 36.05 H new ATOM 0 HB3 PHE A 794 -4.841 -13.634 15.950 1.00 36.05 H new ATOM 0 HD1 PHE A 794 -3.761 -11.340 18.435 1.00 36.54 H new ATOM 0 HD2 PHE A 794 -6.059 -14.527 17.732 1.00 37.30 H new ATOM 0 HE1 PHE A 794 -4.378 -11.379 20.640 1.00 35.99 H new ATOM 0 HE2 PHE A 794 -6.675 -14.561 19.955 1.00 37.94 H new ATOM 0 HZ PHE A 794 -5.837 -12.978 21.405 1.00 35.99 H new ATOM 891 N TYR A 795 -2.642 -15.511 15.962 1.00 32.40 N ATOM 892 CA TYR A 795 -2.329 -16.882 16.329 1.00 32.54 C ATOM 893 C TYR A 795 -0.847 -17.049 16.641 1.00 31.12 C ATOM 894 O TYR A 795 -0.480 -17.743 17.589 1.00 30.52 O ATOM 895 CB TYR A 795 -2.730 -17.836 15.204 1.00 34.95 C ATOM 896 CG TYR A 795 -2.495 -19.288 15.539 1.00 36.59 C ATOM 897 CD1 TYR A 795 -3.044 -19.853 16.682 1.00 37.48 C ATOM 898 CD2 TYR A 795 -1.706 -20.088 14.725 1.00 38.31 C ATOM 899 CE1 TYR A 795 -2.812 -21.171 17.009 1.00 38.98 C ATOM 900 CE2 TYR A 795 -1.467 -21.410 15.042 1.00 39.93 C ATOM 901 CZ TYR A 795 -2.021 -21.946 16.186 1.00 39.35 C ATOM 902 OH TYR A 795 -1.777 -23.259 16.511 1.00 40.24 O ATOM 0 H TYR A 795 -2.919 -15.416 15.154 1.00 32.40 H new ATOM 0 HA TYR A 795 -2.834 -17.096 17.129 1.00 32.54 H new ATOM 0 HB2 TYR A 795 -3.669 -17.706 14.998 1.00 34.95 H new ATOM 0 HB3 TYR A 795 -2.230 -17.610 14.404 1.00 34.95 H new ATOM 0 HD1 TYR A 795 -3.578 -19.332 17.237 1.00 37.48 H new ATOM 0 HD2 TYR A 795 -1.332 -19.728 13.953 1.00 38.31 H new ATOM 0 HE1 TYR A 795 -3.186 -21.536 17.779 1.00 38.98 H new ATOM 0 HE2 TYR A 795 -0.936 -21.936 14.488 1.00 39.93 H new ATOM 0 HH TYR A 795 -1.285 -23.606 15.925 1.00 40.24 H new ATOM 903 N SER A 796 0.007 -16.417 15.840 1.00 30.46 N ATOM 904 CA SER A 796 1.446 -16.505 16.056 1.00 29.36 C ATOM 905 C SER A 796 1.787 -15.880 17.398 1.00 27.95 C ATOM 906 O SER A 796 2.584 -16.417 18.167 1.00 27.38 O ATOM 907 CB SER A 796 2.204 -15.774 14.946 1.00 31.66 C ATOM 908 OG SER A 796 1.984 -16.386 13.688 1.00 33.33 O ATOM 0 H SER A 796 -0.227 -15.934 15.168 1.00 30.46 H new ATOM 0 HA SER A 796 1.709 -17.439 16.046 1.00 29.36 H new ATOM 0 HB2 SER A 796 1.919 -14.847 14.912 1.00 31.66 H new ATOM 0 HB3 SER A 796 3.153 -15.772 15.146 1.00 31.66 H new ATOM 0 HG SER A 796 1.240 -16.141 13.383 1.00 33.33 H new ATOM 909 N LEU A 797 1.181 -14.734 17.670 1.00 26.89 N ATOM 910 CA LEU A 797 1.410 -14.033 18.924 1.00 27.26 C ATOM 911 C LEU A 797 1.031 -14.933 20.102 1.00 26.19 C ATOM 912 O LEU A 797 1.757 -15.020 21.092 1.00 25.13 O ATOM 913 CB LEU A 797 0.575 -12.756 18.969 1.00 26.86 C ATOM 914 CG LEU A 797 0.850 -11.811 20.136 1.00 28.42 C ATOM 915 CD1 LEU A 797 2.226 -11.194 19.958 1.00 30.12 C ATOM 916 CD2 LEU A 797 -0.216 -10.734 20.186 1.00 28.10 C ATOM 0 H LEU A 797 0.630 -14.343 17.138 1.00 26.89 H new ATOM 0 HA LEU A 797 2.350 -13.802 18.986 1.00 27.26 H new ATOM 0 HB2 LEU A 797 0.718 -12.269 18.142 1.00 26.86 H new ATOM 0 HB3 LEU A 797 -0.362 -13.005 18.993 1.00 26.86 H new ATOM 0 HG LEU A 797 0.827 -12.302 20.973 1.00 28.42 H new ATOM 0 HD11 LEU A 797 2.409 -10.592 20.696 1.00 30.12 H new ATOM 0 HD12 LEU A 797 2.896 -11.896 19.940 1.00 30.12 H new ATOM 0 HD13 LEU A 797 2.254 -10.700 19.124 1.00 30.12 H new ATOM 0 HD21 LEU A 797 -0.038 -10.136 20.929 1.00 28.10 H new ATOM 0 HD22 LEU A 797 -0.207 -10.231 19.357 1.00 28.10 H new ATOM 0 HD23 LEU A 797 -1.086 -11.145 20.305 1.00 28.10 H new ATOM 917 N CYS A 798 -0.111 -15.604 19.990 1.00 25.14 N ATOM 918 CA CYS A 798 -0.568 -16.486 21.056 1.00 24.34 C ATOM 919 C CYS A 798 0.387 -17.657 21.269 1.00 24.19 C ATOM 920 O CYS A 798 0.626 -18.064 22.404 1.00 23.48 O ATOM 921 CB CYS A 798 -1.984 -16.994 20.757 1.00 23.29 C ATOM 922 SG CYS A 798 -3.274 -15.730 20.962 1.00 23.43 S ATOM 0 H CYS A 798 -0.633 -15.562 19.308 1.00 25.14 H new ATOM 0 HA CYS A 798 -0.585 -15.971 21.878 1.00 24.34 H new ATOM 0 HB2 CYS A 798 -2.013 -17.329 19.847 1.00 23.29 H new ATOM 0 HB3 CYS A 798 -2.180 -17.743 21.342 1.00 23.29 H new ATOM 0 HG CYS A 798 -3.266 -14.992 20.015 1.00 23.43 H new ATOM 923 N LEU A 799 0.937 -18.195 20.184 1.00 24.26 N ATOM 924 CA LEU A 799 1.879 -19.305 20.294 1.00 26.38 C ATOM 925 C LEU A 799 3.097 -18.854 21.098 1.00 27.36 C ATOM 926 O LEU A 799 3.680 -19.626 21.865 1.00 28.34 O ATOM 927 CB LEU A 799 2.321 -19.775 18.907 1.00 28.04 C ATOM 928 CG LEU A 799 1.267 -20.520 18.084 1.00 28.15 C ATOM 929 CD1 LEU A 799 1.848 -20.889 16.719 1.00 32.32 C ATOM 930 CD2 LEU A 799 0.830 -21.773 18.832 1.00 27.63 C ATOM 0 H LEU A 799 0.779 -17.934 19.380 1.00 24.26 H new ATOM 0 HA LEU A 799 1.443 -20.045 20.745 1.00 26.38 H new ATOM 0 HB2 LEU A 799 2.613 -19.001 18.401 1.00 28.04 H new ATOM 0 HB3 LEU A 799 3.092 -20.354 19.012 1.00 28.04 H new ATOM 0 HG LEU A 799 0.494 -19.949 17.950 1.00 28.15 H new ATOM 0 HD11 LEU A 799 1.179 -21.361 16.199 1.00 32.32 H new ATOM 0 HD12 LEU A 799 2.111 -20.082 16.250 1.00 32.32 H new ATOM 0 HD13 LEU A 799 2.623 -21.459 16.841 1.00 32.32 H new ATOM 0 HD21 LEU A 799 0.162 -22.245 18.310 1.00 27.63 H new ATOM 0 HD22 LEU A 799 1.597 -22.350 18.973 1.00 27.63 H new ATOM 0 HD23 LEU A 799 0.452 -21.523 19.690 1.00 27.63 H new ATOM 931 N THR A 800 3.475 -17.595 20.916 1.00 26.80 N ATOM 932 CA THR A 800 4.606 -17.022 21.627 1.00 27.05 C ATOM 933 C THR A 800 4.284 -16.912 23.117 1.00 25.67 C ATOM 934 O THR A 800 5.109 -17.250 23.965 1.00 26.01 O ATOM 935 CB THR A 800 4.943 -15.621 21.078 1.00 28.33 C ATOM 936 OG1 THR A 800 5.456 -15.742 19.744 1.00 29.06 O ATOM 937 CG2 THR A 800 5.971 -14.927 21.968 1.00 29.38 C ATOM 0 H THR A 800 3.083 -17.051 20.378 1.00 26.80 H new ATOM 0 HA THR A 800 5.371 -17.604 21.498 1.00 27.05 H new ATOM 0 HB THR A 800 4.134 -15.085 21.069 1.00 28.33 H new ATOM 0 HG1 THR A 800 5.887 -15.049 19.546 1.00 29.06 H new ATOM 0 HG21 THR A 800 6.171 -14.049 21.608 1.00 29.38 H new ATOM 0 HG22 THR A 800 5.613 -14.835 22.865 1.00 29.38 H new ATOM 0 HG23 THR A 800 6.783 -15.456 21.997 1.00 29.38 H new ATOM 938 N MET A 801 3.083 -16.442 23.433 1.00 24.17 N ATOM 939 CA MET A 801 2.678 -16.302 24.826 1.00 23.11 C ATOM 940 C MET A 801 2.584 -17.665 25.486 1.00 23.58 C ATOM 941 O MET A 801 2.909 -17.817 26.663 1.00 22.68 O ATOM 942 CB MET A 801 1.317 -15.621 24.925 1.00 22.48 C ATOM 943 CG MET A 801 1.236 -14.287 24.215 1.00 24.13 C ATOM 944 SD MET A 801 -0.360 -13.508 24.468 1.00 27.30 S ATOM 945 CE MET A 801 -1.427 -14.632 23.646 1.00 26.41 C ATOM 0 H MET A 801 2.490 -16.200 22.859 1.00 24.17 H new ATOM 0 HA MET A 801 3.346 -15.761 25.276 1.00 23.11 H new ATOM 0 HB2 MET A 801 0.643 -16.213 24.556 1.00 22.48 H new ATOM 0 HB3 MET A 801 1.099 -15.491 25.861 1.00 22.48 H new ATOM 0 HG2 MET A 801 1.938 -13.702 24.540 1.00 24.13 H new ATOM 0 HG3 MET A 801 1.389 -14.414 23.266 1.00 24.13 H new ATOM 0 HE1 MET A 801 -2.319 -14.564 24.020 1.00 26.41 H new ATOM 0 HE2 MET A 801 -1.456 -14.418 22.700 1.00 26.41 H new ATOM 0 HE3 MET A 801 -1.096 -15.536 23.762 1.00 26.41 H new ATOM 946 N TRP A 802 2.132 -18.648 24.709 1.00 24.48 N ATOM 947 CA TRP A 802 1.949 -20.011 25.187 1.00 25.12 C ATOM 948 C TRP A 802 3.218 -20.624 25.763 1.00 25.65 C ATOM 949 O TRP A 802 3.156 -21.586 26.528 1.00 25.70 O ATOM 950 CB TRP A 802 1.429 -20.895 24.051 1.00 26.75 C ATOM 951 CG TRP A 802 0.187 -21.655 24.411 1.00 25.54 C ATOM 952 CD1 TRP A 802 -0.008 -22.432 25.519 1.00 26.70 C ATOM 953 CD2 TRP A 802 -1.032 -21.710 23.662 1.00 25.81 C ATOM 954 NE1 TRP A 802 -1.277 -22.961 25.506 1.00 27.93 N ATOM 955 CE2 TRP A 802 -1.927 -22.527 24.380 1.00 26.39 C ATOM 956 CE3 TRP A 802 -1.460 -21.131 22.463 1.00 25.79 C ATOM 957 CZ2 TRP A 802 -3.214 -22.796 23.929 1.00 28.20 C ATOM 958 CZ3 TRP A 802 -2.738 -21.396 22.020 1.00 26.11 C ATOM 959 CH2 TRP A 802 -3.604 -22.215 22.754 1.00 26.09 C ATOM 0 H TRP A 802 1.922 -18.538 23.882 1.00 24.48 H new ATOM 0 HA TRP A 802 1.303 -19.965 25.909 1.00 25.12 H new ATOM 0 HB2 TRP A 802 1.248 -20.341 23.276 1.00 26.75 H new ATOM 0 HB3 TRP A 802 2.122 -21.523 23.795 1.00 26.75 H new ATOM 0 HD1 TRP A 802 0.625 -22.581 26.184 1.00 26.70 H new ATOM 0 HE1 TRP A 802 -1.609 -23.480 26.106 1.00 27.93 H new ATOM 0 HE3 TRP A 802 -0.894 -20.578 21.974 1.00 25.79 H new ATOM 0 HZ2 TRP A 802 -3.788 -23.350 24.408 1.00 28.20 H new ATOM 0 HZ3 TRP A 802 -3.030 -21.024 21.219 1.00 26.11 H new ATOM 0 HH2 TRP A 802 -4.464 -22.368 22.435 1.00 26.09 H new ATOM 960 N GLN A 803 4.365 -20.066 25.398 1.00 25.73 N ATOM 961 CA GLN A 803 5.647 -20.570 25.878 1.00 26.35 C ATOM 962 C GLN A 803 5.774 -20.516 27.394 1.00 25.64 C ATOM 963 O GLN A 803 6.387 -21.396 27.995 1.00 25.10 O ATOM 964 CB GLN A 803 6.796 -19.770 25.269 1.00 27.95 C ATOM 965 CG GLN A 803 6.821 -19.761 23.761 1.00 32.79 C ATOM 966 CD GLN A 803 7.851 -18.797 23.226 1.00 34.61 C ATOM 967 OE1 GLN A 803 7.388 -17.766 22.531 1.00 37.38 O flip ATOM 968 NE2 GLN A 803 9.050 -18.970 23.441 1.00 37.39 N flip ATOM 0 H GLN A 803 4.424 -19.390 24.870 1.00 25.73 H new ATOM 0 HA GLN A 803 5.691 -21.499 25.603 1.00 26.35 H new ATOM 0 HB2 GLN A 803 6.742 -18.855 25.586 1.00 27.95 H new ATOM 0 HB3 GLN A 803 7.635 -20.133 25.593 1.00 27.95 H new ATOM 0 HG2 GLN A 803 7.013 -20.654 23.435 1.00 32.79 H new ATOM 0 HG3 GLN A 803 5.944 -19.518 23.424 1.00 32.79 H new ATOM 0 HE21 GLN A 803 9.311 -19.651 23.896 1.00 37.39 H new ATOM 0 HE22 GLN A 803 9.627 -18.410 23.136 1.00 37.39 H new ATOM 969 N ILE A 804 5.213 -19.475 28.006 1.00 23.10 N ATOM 970 CA ILE A 804 5.291 -19.321 29.454 1.00 22.41 C ATOM 971 C ILE A 804 4.512 -20.421 30.185 1.00 22.52 C ATOM 972 O ILE A 804 5.066 -21.109 31.040 1.00 22.43 O ATOM 973 CB ILE A 804 4.791 -17.923 29.895 1.00 21.48 C ATOM 974 CG1 ILE A 804 5.662 -16.831 29.266 1.00 22.48 C ATOM 975 CG2 ILE A 804 4.852 -17.801 31.410 1.00 21.34 C ATOM 976 CD1 ILE A 804 5.210 -15.409 29.604 1.00 25.00 C ATOM 0 H ILE A 804 4.784 -18.849 27.601 1.00 23.10 H new ATOM 0 HA ILE A 804 6.226 -19.405 29.699 1.00 22.41 H new ATOM 0 HB ILE A 804 3.874 -17.815 29.599 1.00 21.48 H new ATOM 0 HG12 ILE A 804 6.578 -16.949 29.562 1.00 22.48 H new ATOM 0 HG13 ILE A 804 5.659 -16.942 28.302 1.00 22.48 H new ATOM 0 HG21 ILE A 804 4.537 -16.923 31.677 1.00 21.34 H new ATOM 0 HG22 ILE A 804 4.290 -18.482 31.813 1.00 21.34 H new ATOM 0 HG23 ILE A 804 5.767 -17.920 31.708 1.00 21.34 H new ATOM 0 HD11 ILE A 804 5.802 -14.771 29.176 1.00 25.00 H new ATOM 0 HD12 ILE A 804 4.304 -15.273 29.286 1.00 25.00 H new ATOM 0 HD13 ILE A 804 5.237 -15.280 30.565 1.00 25.00 H new ATOM 977 N PRO A 805 3.219 -20.597 29.865 1.00 22.54 N ATOM 978 CA PRO A 805 2.437 -21.645 30.533 1.00 23.40 C ATOM 979 C PRO A 805 3.133 -23.000 30.375 1.00 24.43 C ATOM 980 O PRO A 805 3.233 -23.784 31.322 1.00 24.27 O ATOM 981 CB PRO A 805 1.106 -21.617 29.787 1.00 23.10 C ATOM 982 CG PRO A 805 0.997 -20.199 29.323 1.00 23.73 C ATOM 983 CD PRO A 805 2.395 -19.851 28.898 1.00 22.34 C ATOM 0 HA PRO A 805 2.332 -21.506 31.487 1.00 23.40 H new ATOM 0 HB2 PRO A 805 1.101 -22.238 29.042 1.00 23.10 H new ATOM 0 HB3 PRO A 805 0.367 -21.862 30.366 1.00 23.10 H new ATOM 0 HG2 PRO A 805 0.370 -20.112 28.588 1.00 23.73 H new ATOM 0 HG3 PRO A 805 0.685 -19.616 30.032 1.00 23.73 H new ATOM 0 HD2 PRO A 805 2.573 -20.125 27.985 1.00 22.34 H new ATOM 0 HD3 PRO A 805 2.559 -18.896 28.945 1.00 22.34 H new ATOM 984 N GLN A 806 3.625 -23.264 29.170 1.00 24.96 N ATOM 985 CA GLN A 806 4.295 -24.528 28.891 1.00 26.36 C ATOM 986 C GLN A 806 5.506 -24.746 29.791 1.00 26.13 C ATOM 987 O GLN A 806 5.706 -25.848 30.309 1.00 25.49 O ATOM 988 CB GLN A 806 4.686 -24.598 27.412 1.00 29.61 C ATOM 989 CG GLN A 806 3.471 -24.486 26.491 1.00 34.26 C ATOM 990 CD GLN A 806 3.808 -24.613 25.016 1.00 36.93 C ATOM 991 OE1 GLN A 806 4.643 -23.873 24.484 1.00 36.67 O ATOM 992 NE2 GLN A 806 3.148 -25.553 24.342 1.00 38.10 N ATOM 0 H GLN A 806 3.581 -22.725 28.501 1.00 24.96 H new ATOM 0 HA GLN A 806 3.671 -25.245 29.085 1.00 26.36 H new ATOM 0 HB2 GLN A 806 5.311 -23.884 27.210 1.00 29.61 H new ATOM 0 HB3 GLN A 806 5.145 -25.435 27.239 1.00 29.61 H new ATOM 0 HG2 GLN A 806 2.831 -25.175 26.729 1.00 34.26 H new ATOM 0 HG3 GLN A 806 3.038 -23.632 26.643 1.00 34.26 H new ATOM 0 HE21 GLN A 806 2.574 -26.049 24.747 1.00 38.10 H new ATOM 0 HE22 GLN A 806 3.296 -25.664 23.502 1.00 38.10 H new ATOM 993 N GLU A 807 6.306 -23.702 29.993 1.00 24.82 N ATOM 994 CA GLU A 807 7.472 -23.817 30.863 1.00 24.71 C ATOM 995 C GLU A 807 7.012 -23.964 32.307 1.00 22.93 C ATOM 996 O GLU A 807 7.681 -24.614 33.119 1.00 22.93 O ATOM 997 CB GLU A 807 8.381 -22.594 30.719 1.00 28.10 C ATOM 998 CG GLU A 807 9.199 -22.602 29.437 1.00 34.39 C ATOM 999 CD GLU A 807 10.199 -23.746 29.398 1.00 36.59 C ATOM 1000 OE1 GLU A 807 10.560 -24.193 28.291 1.00 40.08 O ATOM 1001 OE2 GLU A 807 10.636 -24.192 30.479 1.00 38.53 O ATOM 0 H GLU A 807 6.193 -22.926 29.640 1.00 24.82 H new ATOM 0 HA GLU A 807 7.981 -24.601 30.604 1.00 24.71 H new ATOM 0 HB2 GLU A 807 7.838 -21.790 30.744 1.00 28.10 H new ATOM 0 HB3 GLU A 807 8.982 -22.554 31.479 1.00 28.10 H new ATOM 0 HG2 GLU A 807 8.602 -22.671 28.675 1.00 34.39 H new ATOM 0 HG3 GLU A 807 9.671 -21.759 29.352 1.00 34.39 H new ATOM 1002 N PHE A 808 5.868 -23.366 32.630 1.00 19.88 N ATOM 1003 CA PHE A 808 5.337 -23.477 33.984 1.00 20.70 C ATOM 1004 C PHE A 808 4.988 -24.937 34.258 1.00 20.15 C ATOM 1005 O PHE A 808 5.238 -25.448 35.348 1.00 20.54 O ATOM 1006 CB PHE A 808 4.093 -22.602 34.162 1.00 19.63 C ATOM 1007 CG PHE A 808 4.403 -21.159 34.478 1.00 22.20 C ATOM 1008 CD1 PHE A 808 5.714 -20.721 34.572 1.00 22.16 C ATOM 1009 CD2 PHE A 808 3.385 -20.242 34.667 1.00 23.43 C ATOM 1010 CE1 PHE A 808 6.002 -19.393 34.847 1.00 23.31 C ATOM 1011 CE2 PHE A 808 3.669 -18.913 34.944 1.00 21.78 C ATOM 1012 CZ PHE A 808 4.983 -18.493 35.033 1.00 20.98 C ATOM 0 H PHE A 808 5.391 -22.898 32.089 1.00 19.88 H new ATOM 0 HA PHE A 808 6.009 -23.170 34.612 1.00 20.70 H new ATOM 0 HB2 PHE A 808 3.563 -22.640 33.351 1.00 19.63 H new ATOM 0 HB3 PHE A 808 3.548 -22.971 34.875 1.00 19.63 H new ATOM 0 HD1 PHE A 808 6.410 -21.326 34.449 1.00 22.16 H new ATOM 0 HD2 PHE A 808 2.499 -20.520 34.608 1.00 23.43 H new ATOM 0 HE1 PHE A 808 6.887 -19.112 34.905 1.00 23.31 H new ATOM 0 HE2 PHE A 808 2.976 -18.305 35.070 1.00 21.78 H new ATOM 0 HZ PHE A 808 5.176 -17.602 35.219 1.00 20.98 H new ATOM 1013 N VAL A 809 4.410 -25.601 33.261 1.00 21.01 N ATOM 1014 CA VAL A 809 4.039 -27.008 33.386 1.00 20.50 C ATOM 1015 C VAL A 809 5.293 -27.892 33.453 1.00 22.21 C ATOM 1016 O VAL A 809 5.394 -28.791 34.290 1.00 21.87 O ATOM 1017 CB VAL A 809 3.166 -27.456 32.191 1.00 20.98 C ATOM 1018 CG1 VAL A 809 3.030 -28.963 32.179 1.00 21.08 C ATOM 1019 CG2 VAL A 809 1.783 -26.812 32.281 1.00 18.70 C ATOM 0 H VAL A 809 4.223 -25.252 32.498 1.00 21.01 H new ATOM 0 HA VAL A 809 3.530 -27.107 34.206 1.00 20.50 H new ATOM 0 HB VAL A 809 3.595 -27.172 31.369 1.00 20.98 H new ATOM 0 HG11 VAL A 809 2.481 -29.233 31.426 1.00 21.08 H new ATOM 0 HG12 VAL A 809 3.908 -29.367 32.099 1.00 21.08 H new ATOM 0 HG13 VAL A 809 2.613 -29.257 33.004 1.00 21.08 H new ATOM 0 HG21 VAL A 809 1.243 -27.098 31.528 1.00 18.70 H new ATOM 0 HG22 VAL A 809 1.353 -27.082 33.108 1.00 18.70 H new ATOM 0 HG23 VAL A 809 1.874 -25.846 32.264 1.00 18.70 H new ATOM 1020 N LYS A 810 6.250 -27.618 32.574 1.00 22.03 N ATOM 1021 CA LYS A 810 7.494 -28.376 32.511 1.00 23.55 C ATOM 1022 C LYS A 810 8.290 -28.311 33.818 1.00 24.70 C ATOM 1023 O LYS A 810 8.704 -29.334 34.367 1.00 24.73 O ATOM 1024 CB LYS A 810 8.348 -27.833 31.361 1.00 27.56 C ATOM 1025 CG LYS A 810 9.535 -28.694 30.955 1.00 32.06 C ATOM 1026 CD LYS A 810 10.319 -28.033 29.814 1.00 36.44 C ATOM 1027 CE LYS A 810 9.415 -27.699 28.628 1.00 39.28 C ATOM 1028 NZ LYS A 810 10.136 -26.972 27.533 1.00 40.22 N ATOM 0 H LYS A 810 6.196 -26.985 31.995 1.00 22.03 H new ATOM 0 HA LYS A 810 7.266 -29.307 32.363 1.00 23.55 H new ATOM 0 HB2 LYS A 810 7.778 -27.712 30.586 1.00 27.56 H new ATOM 0 HB3 LYS A 810 8.677 -26.955 31.611 1.00 27.56 H new ATOM 0 HG2 LYS A 810 10.118 -28.830 31.718 1.00 32.06 H new ATOM 0 HG3 LYS A 810 9.225 -29.570 30.676 1.00 32.06 H new ATOM 0 HD2 LYS A 810 10.741 -27.222 30.138 1.00 36.44 H new ATOM 0 HD3 LYS A 810 11.029 -28.626 29.523 1.00 36.44 H new ATOM 0 HE2 LYS A 810 9.039 -28.519 28.272 1.00 39.28 H new ATOM 0 HE3 LYS A 810 8.672 -27.157 28.936 1.00 39.28 H new ATOM 0 HZ1 LYS A 810 9.652 -27.004 26.787 1.00 40.22 H new ATOM 0 HZ2 LYS A 810 10.259 -26.123 27.771 1.00 40.22 H new ATOM 0 HZ3 LYS A 810 10.926 -27.357 27.391 1.00 40.22 H new ATOM 1029 N LEU A 811 8.499 -27.096 34.312 1.00 25.10 N ATOM 1030 CA LEU A 811 9.267 -26.877 35.528 1.00 24.78 C ATOM 1031 C LEU A 811 8.452 -27.046 36.796 1.00 25.23 C ATOM 1032 O LEU A 811 9.008 -27.106 37.889 1.00 25.53 O ATOM 1033 CB LEU A 811 9.884 -25.477 35.500 1.00 25.51 C ATOM 1034 CG LEU A 811 10.899 -25.229 34.381 1.00 28.14 C ATOM 1035 CD1 LEU A 811 11.350 -23.776 34.402 1.00 28.72 C ATOM 1036 CD2 LEU A 811 12.093 -26.163 34.560 1.00 30.19 C ATOM 0 H LEU A 811 8.199 -26.376 33.950 1.00 25.10 H new ATOM 0 HA LEU A 811 9.957 -27.558 35.547 1.00 24.78 H new ATOM 0 HB2 LEU A 811 9.169 -24.827 35.417 1.00 25.51 H new ATOM 0 HB3 LEU A 811 10.318 -25.314 36.352 1.00 25.51 H new ATOM 0 HG LEU A 811 10.485 -25.409 33.523 1.00 28.14 H new ATOM 0 HD11 LEU A 811 11.993 -23.626 33.691 1.00 28.72 H new ATOM 0 HD12 LEU A 811 10.583 -23.197 34.271 1.00 28.72 H new ATOM 0 HD13 LEU A 811 11.763 -23.577 35.257 1.00 28.72 H new ATOM 0 HD21 LEU A 811 12.736 -26.006 33.851 1.00 30.19 H new ATOM 0 HD22 LEU A 811 12.511 -25.993 35.419 1.00 30.19 H new ATOM 0 HD23 LEU A 811 11.792 -27.084 34.524 1.00 30.19 H new ATOM 1037 N GLN A 812 7.135 -27.131 36.646 1.00 25.05 N ATOM 1038 CA GLN A 812 6.236 -27.278 37.783 1.00 24.46 C ATOM 1039 C GLN A 812 6.460 -26.171 38.810 1.00 23.38 C ATOM 1040 O GLN A 812 6.689 -26.429 39.994 1.00 23.46 O ATOM 1041 CB GLN A 812 6.416 -28.653 38.428 1.00 25.96 C ATOM 1042 CG GLN A 812 6.147 -29.791 37.459 1.00 30.38 C ATOM 1043 CD GLN A 812 5.741 -31.075 38.153 1.00 32.85 C ATOM 1044 OE1 GLN A 812 5.712 -31.051 39.481 1.00 34.90 O flip ATOM 1045 NE2 GLN A 812 5.451 -32.078 37.499 1.00 34.75 N flip ATOM 0 H GLN A 812 6.738 -27.105 35.883 1.00 25.05 H new ATOM 0 HA GLN A 812 5.325 -27.203 37.458 1.00 24.46 H new ATOM 0 HB2 GLN A 812 7.320 -28.730 38.770 1.00 25.96 H new ATOM 0 HB3 GLN A 812 5.818 -28.731 39.188 1.00 25.96 H new ATOM 0 HG2 GLN A 812 5.446 -29.526 36.843 1.00 30.38 H new ATOM 0 HG3 GLN A 812 6.943 -29.953 36.929 1.00 30.38 H new ATOM 0 HE21 GLN A 812 5.482 -32.055 36.640 1.00 34.75 H new ATOM 0 HE22 GLN A 812 5.218 -32.801 37.902 1.00 34.75 H new ATOM 1046 N VAL A 813 6.390 -24.932 38.333 1.00 21.83 N ATOM 1047 CA VAL A 813 6.572 -23.751 39.170 1.00 20.35 C ATOM 1048 C VAL A 813 5.541 -23.692 40.300 1.00 19.94 C ATOM 1049 O VAL A 813 4.354 -23.954 40.092 1.00 19.79 O ATOM 1050 CB VAL A 813 6.459 -22.464 38.313 1.00 21.09 C ATOM 1051 CG1 VAL A 813 6.587 -21.221 39.183 1.00 19.06 C ATOM 1052 CG2 VAL A 813 7.525 -22.476 37.235 1.00 19.74 C ATOM 0 H VAL A 813 6.234 -24.752 37.507 1.00 21.83 H new ATOM 0 HA VAL A 813 7.456 -23.811 39.564 1.00 20.35 H new ATOM 0 HB VAL A 813 5.585 -22.442 37.893 1.00 21.09 H new ATOM 0 HG11 VAL A 813 6.514 -20.429 38.628 1.00 19.06 H new ATOM 0 HG12 VAL A 813 5.880 -21.217 39.847 1.00 19.06 H new ATOM 0 HG13 VAL A 813 7.449 -21.225 39.628 1.00 19.06 H new ATOM 0 HG21 VAL A 813 7.453 -21.670 36.700 1.00 19.74 H new ATOM 0 HG22 VAL A 813 8.402 -22.512 37.647 1.00 19.74 H new ATOM 0 HG23 VAL A 813 7.403 -23.253 36.667 1.00 19.74 H new ATOM 1053 N SER A 814 6.003 -23.353 41.499 1.00 19.35 N ATOM 1054 CA SER A 814 5.121 -23.247 42.658 1.00 18.39 C ATOM 1055 C SER A 814 4.664 -21.802 42.769 1.00 18.16 C ATOM 1056 O SER A 814 5.295 -20.915 42.202 1.00 19.81 O ATOM 1057 CB SER A 814 5.879 -23.630 43.936 1.00 20.11 C ATOM 1058 OG SER A 814 6.969 -22.744 44.172 1.00 18.25 O ATOM 0 H SER A 814 6.829 -23.179 41.664 1.00 19.35 H new ATOM 0 HA SER A 814 4.364 -23.844 42.551 1.00 18.39 H new ATOM 0 HB2 SER A 814 5.273 -23.610 44.693 1.00 20.11 H new ATOM 0 HB3 SER A 814 6.208 -24.539 43.860 1.00 20.11 H new ATOM 0 HG SER A 814 7.640 -23.185 44.421 1.00 18.25 H new ATOM 1059 N GLN A 815 3.586 -21.553 43.505 1.00 17.94 N ATOM 1060 CA GLN A 815 3.122 -20.182 43.666 1.00 19.53 C ATOM 1061 C GLN A 815 4.209 -19.374 44.376 1.00 18.62 C ATOM 1062 O GLN A 815 4.438 -18.210 44.051 1.00 17.80 O ATOM 1063 CB GLN A 815 1.838 -20.115 44.495 1.00 21.54 C ATOM 1064 CG GLN A 815 1.138 -18.768 44.370 1.00 27.11 C ATOM 1065 CD GLN A 815 0.117 -18.510 45.458 1.00 29.16 C ATOM 1066 OE1 GLN A 815 0.179 -19.282 46.533 1.00 34.74 O flip ATOM 1067 NE2 GLN A 815 -0.710 -17.607 45.336 1.00 29.67 N flip ATOM 0 H GLN A 815 3.118 -22.150 43.911 1.00 17.94 H new ATOM 0 HA GLN A 815 2.935 -19.819 42.786 1.00 19.53 H new ATOM 0 HB2 GLN A 815 1.234 -20.818 44.210 1.00 21.54 H new ATOM 0 HB3 GLN A 815 2.048 -20.283 45.427 1.00 21.54 H new ATOM 0 HG2 GLN A 815 1.804 -18.063 44.389 1.00 27.11 H new ATOM 0 HG3 GLN A 815 0.698 -18.720 43.507 1.00 27.11 H new ATOM 0 HE21 GLN A 815 -0.720 -17.126 44.623 1.00 29.67 H new ATOM 0 HE22 GLN A 815 -1.278 -17.457 45.964 1.00 29.67 H new ATOM 1068 N GLU A 816 4.871 -19.992 45.350 1.00 17.64 N ATOM 1069 CA GLU A 816 5.939 -19.311 46.085 1.00 18.41 C ATOM 1070 C GLU A 816 6.977 -18.749 45.106 1.00 17.21 C ATOM 1071 O GLU A 816 7.352 -17.580 45.187 1.00 17.92 O ATOM 1072 CB GLU A 816 6.622 -20.277 47.065 1.00 18.95 C ATOM 1073 CG GLU A 816 5.767 -20.742 48.242 1.00 21.25 C ATOM 1074 CD GLU A 816 4.642 -21.705 47.853 1.00 23.35 C ATOM 1075 OE1 GLU A 816 4.705 -22.331 46.772 1.00 21.18 O ATOM 1076 OE2 GLU A 816 3.696 -21.851 48.652 1.00 24.30 O ATOM 0 H GLU A 816 4.720 -20.801 45.601 1.00 17.64 H new ATOM 0 HA GLU A 816 5.546 -18.581 46.589 1.00 18.41 H new ATOM 0 HB2 GLU A 816 6.915 -21.059 46.571 1.00 18.95 H new ATOM 0 HB3 GLU A 816 7.418 -19.847 47.415 1.00 18.95 H new ATOM 0 HG2 GLU A 816 6.340 -21.175 48.894 1.00 21.25 H new ATOM 0 HG3 GLU A 816 5.380 -19.965 48.675 1.00 21.25 H new ATOM 1077 N GLU A 817 7.430 -19.590 44.179 1.00 17.88 N ATOM 1078 CA GLU A 817 8.418 -19.191 43.171 1.00 17.66 C ATOM 1079 C GLU A 817 7.888 -18.128 42.219 1.00 17.76 C ATOM 1080 O GLU A 817 8.598 -17.183 41.879 1.00 18.14 O ATOM 1081 CB GLU A 817 8.867 -20.405 42.354 1.00 19.57 C ATOM 1082 CG GLU A 817 9.702 -21.425 43.125 1.00 21.87 C ATOM 1083 CD GLU A 817 9.885 -22.728 42.370 1.00 21.18 C ATOM 1084 OE1 GLU A 817 10.866 -23.442 42.655 1.00 24.46 O ATOM 1085 OE2 GLU A 817 9.045 -23.047 41.501 1.00 22.27 O ATOM 0 H GLU A 817 7.175 -20.409 44.115 1.00 17.88 H new ATOM 0 HA GLU A 817 9.168 -18.813 43.657 1.00 17.66 H new ATOM 0 HB2 GLU A 817 8.081 -20.850 42.002 1.00 19.57 H new ATOM 0 HB3 GLU A 817 9.382 -20.094 41.593 1.00 19.57 H new ATOM 0 HG2 GLU A 817 10.573 -21.044 43.319 1.00 21.87 H new ATOM 0 HG3 GLU A 817 9.276 -21.607 43.977 1.00 21.87 H new ATOM 1086 N PHE A 818 6.643 -18.300 41.781 1.00 18.33 N ATOM 1087 CA PHE A 818 5.992 -17.368 40.867 1.00 17.44 C ATOM 1088 C PHE A 818 5.878 -15.963 41.450 1.00 18.73 C ATOM 1089 O PHE A 818 6.112 -14.973 40.755 1.00 17.89 O ATOM 1090 CB PHE A 818 4.585 -17.874 40.517 1.00 17.86 C ATOM 1091 CG PHE A 818 3.729 -16.855 39.807 1.00 16.01 C ATOM 1092 CD1 PHE A 818 3.911 -16.587 38.459 1.00 16.13 C ATOM 1093 CD2 PHE A 818 2.742 -16.164 40.495 1.00 18.32 C ATOM 1094 CE1 PHE A 818 3.122 -15.646 37.809 1.00 18.55 C ATOM 1095 CE2 PHE A 818 1.950 -15.221 39.850 1.00 18.51 C ATOM 1096 CZ PHE A 818 2.142 -14.963 38.506 1.00 15.88 C ATOM 0 H PHE A 818 6.149 -18.967 42.008 1.00 18.33 H new ATOM 0 HA PHE A 818 6.546 -17.320 40.072 1.00 17.44 H new ATOM 0 HB2 PHE A 818 4.664 -18.663 39.958 1.00 17.86 H new ATOM 0 HB3 PHE A 818 4.137 -18.148 41.333 1.00 17.86 H new ATOM 0 HD1 PHE A 818 4.569 -17.042 37.984 1.00 16.13 H new ATOM 0 HD2 PHE A 818 2.609 -16.334 41.400 1.00 18.32 H new ATOM 0 HE1 PHE A 818 3.253 -15.475 36.904 1.00 18.55 H new ATOM 0 HE2 PHE A 818 1.292 -14.764 40.322 1.00 18.51 H new ATOM 0 HZ PHE A 818 1.614 -14.332 38.072 1.00 15.88 H new ATOM 1097 N LEU A 819 5.506 -15.875 42.723 1.00 19.16 N ATOM 1098 CA LEU A 819 5.346 -14.579 43.372 1.00 19.08 C ATOM 1099 C LEU A 819 6.662 -13.804 43.441 1.00 19.02 C ATOM 1100 O LEU A 819 6.686 -12.589 43.219 1.00 18.79 O ATOM 1101 CB LEU A 819 4.756 -14.766 44.773 1.00 17.83 C ATOM 1102 CG LEU A 819 3.332 -15.342 44.799 1.00 19.66 C ATOM 1103 CD1 LEU A 819 2.929 -15.640 46.224 1.00 17.62 C ATOM 1104 CD2 LEU A 819 2.344 -14.353 44.158 1.00 20.64 C ATOM 0 H LEU A 819 5.342 -16.552 43.227 1.00 19.16 H new ATOM 0 HA LEU A 819 4.734 -14.052 42.834 1.00 19.08 H new ATOM 0 HB2 LEU A 819 5.338 -15.353 45.280 1.00 17.83 H new ATOM 0 HB3 LEU A 819 4.753 -13.909 45.226 1.00 17.83 H new ATOM 0 HG LEU A 819 3.314 -16.166 44.287 1.00 19.66 H new ATOM 0 HD11 LEU A 819 2.030 -16.003 46.237 1.00 17.62 H new ATOM 0 HD12 LEU A 819 3.544 -16.286 46.606 1.00 17.62 H new ATOM 0 HD13 LEU A 819 2.954 -14.822 46.745 1.00 17.62 H new ATOM 0 HD21 LEU A 819 1.450 -14.728 44.181 1.00 20.64 H new ATOM 0 HD22 LEU A 819 2.356 -13.518 44.651 1.00 20.64 H new ATOM 0 HD23 LEU A 819 2.602 -14.189 43.237 1.00 20.64 H new ATOM 1105 N CYS A 820 7.752 -14.506 43.739 1.00 18.40 N ATOM 1106 CA CYS A 820 9.064 -13.878 43.827 1.00 17.86 C ATOM 1107 C CYS A 820 9.568 -13.498 42.442 1.00 18.07 C ATOM 1108 O CYS A 820 10.193 -12.448 42.265 1.00 18.13 O ATOM 1109 CB CYS A 820 10.062 -14.824 44.512 1.00 18.08 C ATOM 1110 SG CYS A 820 9.716 -15.116 46.270 1.00 18.81 S ATOM 0 H CYS A 820 7.751 -15.352 43.894 1.00 18.40 H new ATOM 0 HA CYS A 820 8.983 -13.071 44.358 1.00 17.86 H new ATOM 0 HB2 CYS A 820 10.059 -15.675 44.046 1.00 18.08 H new ATOM 0 HB3 CYS A 820 10.955 -14.455 44.425 1.00 18.08 H new ATOM 0 HG CYS A 820 10.412 -16.006 46.673 1.00 18.81 H new ATOM 1111 N MET A 821 9.297 -14.356 41.462 1.00 17.74 N ATOM 1112 CA MET A 821 9.711 -14.096 40.089 1.00 17.93 C ATOM 1113 C MET A 821 8.956 -12.900 39.528 1.00 16.66 C ATOM 1114 O MET A 821 9.502 -12.129 38.750 1.00 18.68 O ATOM 1115 CB MET A 821 9.459 -15.332 39.211 1.00 18.20 C ATOM 1116 CG MET A 821 10.452 -16.466 39.433 1.00 19.85 C ATOM 1117 SD MET A 821 9.844 -18.023 38.762 1.00 23.85 S ATOM 1118 CE MET A 821 10.114 -17.757 36.995 1.00 22.26 C ATOM 0 H MET A 821 8.873 -15.096 41.573 1.00 17.74 H new ATOM 0 HA MET A 821 10.661 -13.898 40.087 1.00 17.93 H new ATOM 0 HB2 MET A 821 8.563 -15.661 39.383 1.00 18.20 H new ATOM 0 HB3 MET A 821 9.490 -15.066 38.279 1.00 18.20 H new ATOM 0 HG2 MET A 821 11.298 -16.242 39.016 1.00 19.85 H new ATOM 0 HG3 MET A 821 10.622 -16.567 40.383 1.00 19.85 H new ATOM 0 HE1 MET A 821 9.822 -18.539 36.501 1.00 22.26 H new ATOM 0 HE2 MET A 821 9.607 -16.983 36.703 1.00 22.26 H new ATOM 0 HE3 MET A 821 11.058 -17.605 36.831 1.00 22.26 H new ATOM 1119 N LYS A 822 7.698 -12.749 39.927 1.00 17.76 N ATOM 1120 CA LYS A 822 6.876 -11.642 39.459 1.00 18.30 C ATOM 1121 C LYS A 822 7.454 -10.308 39.920 1.00 18.50 C ATOM 1122 O LYS A 822 7.473 -9.336 39.164 1.00 18.00 O ATOM 1123 CB LYS A 822 5.434 -11.807 39.961 1.00 20.78 C ATOM 1124 CG LYS A 822 4.443 -10.856 39.305 1.00 25.79 C ATOM 1125 CD LYS A 822 3.029 -11.442 39.284 1.00 26.83 C ATOM 1126 CE LYS A 822 2.333 -11.327 40.628 1.00 28.50 C ATOM 1127 NZ LYS A 822 1.812 -9.955 40.869 1.00 30.75 N ATOM 0 H LYS A 822 7.300 -13.281 40.473 1.00 17.76 H new ATOM 0 HA LYS A 822 6.871 -11.649 38.489 1.00 18.30 H new ATOM 0 HB2 LYS A 822 5.147 -12.720 39.802 1.00 20.78 H new ATOM 0 HB3 LYS A 822 5.417 -11.668 40.921 1.00 20.78 H new ATOM 0 HG2 LYS A 822 4.437 -10.012 39.784 1.00 25.79 H new ATOM 0 HG3 LYS A 822 4.728 -10.665 38.398 1.00 25.79 H new ATOM 0 HD2 LYS A 822 2.502 -10.984 38.610 1.00 26.83 H new ATOM 0 HD3 LYS A 822 3.073 -12.376 39.024 1.00 26.83 H new ATOM 0 HE2 LYS A 822 1.601 -11.962 40.668 1.00 28.50 H new ATOM 0 HE3 LYS A 822 2.954 -11.565 41.334 1.00 28.50 H new ATOM 0 HZ1 LYS A 822 1.256 -9.966 41.563 1.00 30.75 H new ATOM 0 HZ2 LYS A 822 2.491 -9.406 41.042 1.00 30.75 H new ATOM 0 HZ3 LYS A 822 1.378 -9.671 40.146 1.00 30.75 H new ATOM 1128 N VAL A 823 7.928 -10.257 41.161 1.00 18.85 N ATOM 1129 CA VAL A 823 8.523 -9.029 41.677 1.00 18.10 C ATOM 1130 C VAL A 823 9.814 -8.729 40.915 1.00 18.31 C ATOM 1131 O VAL A 823 10.102 -7.580 40.597 1.00 18.54 O ATOM 1132 CB VAL A 823 8.866 -9.140 43.181 1.00 17.70 C ATOM 1133 CG1 VAL A 823 9.478 -7.834 43.657 1.00 15.68 C ATOM 1134 CG2 VAL A 823 7.611 -9.459 43.985 1.00 12.91 C ATOM 0 H VAL A 823 7.915 -10.915 41.715 1.00 18.85 H new ATOM 0 HA VAL A 823 7.872 -8.320 41.558 1.00 18.10 H new ATOM 0 HB VAL A 823 9.505 -9.858 43.312 1.00 17.70 H new ATOM 0 HG11 VAL A 823 9.694 -7.902 44.600 1.00 15.68 H new ATOM 0 HG12 VAL A 823 10.287 -7.653 43.153 1.00 15.68 H new ATOM 0 HG13 VAL A 823 8.845 -7.112 43.522 1.00 15.68 H new ATOM 0 HG21 VAL A 823 7.838 -9.526 44.926 1.00 12.91 H new ATOM 0 HG22 VAL A 823 6.958 -8.753 43.860 1.00 12.91 H new ATOM 0 HG23 VAL A 823 7.238 -10.301 43.682 1.00 12.91 H new ATOM 1135 N LEU A 824 10.592 -9.763 40.618 1.00 17.69 N ATOM 1136 CA LEU A 824 11.838 -9.559 39.892 1.00 18.32 C ATOM 1137 C LEU A 824 11.544 -9.032 38.488 1.00 18.71 C ATOM 1138 O LEU A 824 12.303 -8.218 37.948 1.00 19.31 O ATOM 1139 CB LEU A 824 12.643 -10.865 39.850 1.00 18.39 C ATOM 1140 CG LEU A 824 13.134 -11.292 41.243 1.00 20.14 C ATOM 1141 CD1 LEU A 824 13.728 -12.692 41.205 1.00 20.68 C ATOM 1142 CD2 LEU A 824 14.154 -10.284 41.748 1.00 20.75 C ATOM 0 H LEU A 824 10.420 -10.580 40.824 1.00 17.69 H new ATOM 0 HA LEU A 824 12.376 -8.895 40.352 1.00 18.32 H new ATOM 0 HB2 LEU A 824 12.093 -11.570 39.473 1.00 18.39 H new ATOM 0 HB3 LEU A 824 13.405 -10.754 39.261 1.00 18.39 H new ATOM 0 HG LEU A 824 12.379 -11.313 41.852 1.00 20.14 H new ATOM 0 HD11 LEU A 824 14.030 -12.940 42.093 1.00 20.68 H new ATOM 0 HD12 LEU A 824 13.054 -13.322 40.906 1.00 20.68 H new ATOM 0 HD13 LEU A 824 14.479 -12.708 40.592 1.00 20.68 H new ATOM 0 HD21 LEU A 824 14.465 -10.551 42.627 1.00 20.75 H new ATOM 0 HD22 LEU A 824 14.906 -10.249 41.136 1.00 20.75 H new ATOM 0 HD23 LEU A 824 13.743 -9.407 41.804 1.00 20.75 H new ATOM 1143 N LEU A 825 10.435 -9.482 37.903 1.00 19.17 N ATOM 1144 CA LEU A 825 10.030 -9.007 36.581 1.00 19.83 C ATOM 1145 C LEU A 825 9.769 -7.506 36.654 1.00 19.25 C ATOM 1146 O LEU A 825 10.203 -6.746 35.794 1.00 20.14 O ATOM 1147 CB LEU A 825 8.748 -9.692 36.123 1.00 20.49 C ATOM 1148 CG LEU A 825 8.880 -10.728 35.021 1.00 24.31 C ATOM 1149 CD1 LEU A 825 7.489 -11.034 34.486 1.00 22.31 C ATOM 1150 CD2 LEU A 825 9.785 -10.200 33.912 1.00 21.70 C ATOM 0 H LEU A 825 9.905 -10.061 38.254 1.00 19.17 H new ATOM 0 HA LEU A 825 10.740 -9.209 35.952 1.00 19.83 H new ATOM 0 HB2 LEU A 825 8.343 -10.120 36.893 1.00 20.49 H new ATOM 0 HB3 LEU A 825 8.131 -9.007 35.821 1.00 20.49 H new ATOM 0 HG LEU A 825 9.281 -11.541 35.367 1.00 24.31 H new ATOM 0 HD11 LEU A 825 7.552 -11.695 33.779 1.00 22.31 H new ATOM 0 HD12 LEU A 825 6.935 -11.380 35.203 1.00 22.31 H new ATOM 0 HD13 LEU A 825 7.092 -10.222 34.134 1.00 22.31 H new ATOM 0 HD21 LEU A 825 9.864 -10.868 33.213 1.00 21.70 H new ATOM 0 HD22 LEU A 825 9.404 -9.388 33.542 1.00 21.70 H new ATOM 0 HD23 LEU A 825 10.664 -10.008 34.275 1.00 21.70 H new ATOM 1151 N LEU A 826 9.029 -7.092 37.677 1.00 17.82 N ATOM 1152 CA LEU A 826 8.726 -5.679 37.870 1.00 19.62 C ATOM 1153 C LEU A 826 10.022 -4.871 37.851 1.00 20.71 C ATOM 1154 O LEU A 826 10.079 -3.772 37.299 1.00 21.73 O ATOM 1155 CB LEU A 826 8.019 -5.474 39.215 1.00 18.66 C ATOM 1156 CG LEU A 826 7.828 -4.029 39.678 1.00 19.15 C ATOM 1157 CD1 LEU A 826 6.856 -3.323 38.744 1.00 20.08 C ATOM 1158 CD2 LEU A 826 7.300 -4.007 41.119 1.00 17.56 C ATOM 0 H LEU A 826 8.692 -7.614 38.271 1.00 17.82 H new ATOM 0 HA LEU A 826 8.144 -5.379 37.154 1.00 19.62 H new ATOM 0 HB2 LEU A 826 7.146 -5.894 39.165 1.00 18.66 H new ATOM 0 HB3 LEU A 826 8.522 -5.946 39.897 1.00 18.66 H new ATOM 0 HG LEU A 826 8.680 -3.566 39.656 1.00 19.15 H new ATOM 0 HD11 LEU A 826 6.734 -2.406 39.037 1.00 20.08 H new ATOM 0 HD12 LEU A 826 7.212 -3.329 37.842 1.00 20.08 H new ATOM 0 HD13 LEU A 826 6.002 -3.783 38.758 1.00 20.08 H new ATOM 0 HD21 LEU A 826 7.181 -3.088 41.406 1.00 17.56 H new ATOM 0 HD22 LEU A 826 6.449 -4.471 41.159 1.00 17.56 H new ATOM 0 HD23 LEU A 826 7.936 -4.448 41.704 1.00 17.56 H new ATOM 1159 N LEU A 827 11.060 -5.446 38.450 1.00 20.31 N ATOM 1160 CA LEU A 827 12.375 -4.817 38.565 1.00 20.89 C ATOM 1161 C LEU A 827 13.386 -5.296 37.519 1.00 21.86 C ATOM 1162 O LEU A 827 14.596 -5.239 37.764 1.00 21.40 O ATOM 1163 CB LEU A 827 12.943 -5.123 39.954 1.00 19.82 C ATOM 1164 CG LEU A 827 12.038 -4.889 41.168 1.00 18.79 C ATOM 1165 CD1 LEU A 827 12.727 -5.388 42.441 1.00 18.64 C ATOM 1166 CD2 LEU A 827 11.717 -3.406 41.281 1.00 15.77 C ATOM 0 H LEU A 827 11.020 -6.227 38.808 1.00 20.31 H new ATOM 0 HA LEU A 827 12.242 -3.867 38.419 1.00 20.89 H new ATOM 0 HB2 LEU A 827 13.219 -6.053 39.964 1.00 19.82 H new ATOM 0 HB3 LEU A 827 13.743 -4.588 40.072 1.00 19.82 H new ATOM 0 HG LEU A 827 11.211 -5.383 41.055 1.00 18.79 H new ATOM 0 HD11 LEU A 827 12.147 -5.236 43.204 1.00 18.64 H new ATOM 0 HD12 LEU A 827 12.911 -6.337 42.359 1.00 18.64 H new ATOM 0 HD13 LEU A 827 13.560 -4.908 42.568 1.00 18.64 H new ATOM 0 HD21 LEU A 827 11.144 -3.256 42.049 1.00 15.77 H new ATOM 0 HD22 LEU A 827 12.540 -2.904 41.389 1.00 15.77 H new ATOM 0 HD23 LEU A 827 11.262 -3.111 40.477 1.00 15.77 H new ATOM 1167 N ASN A 828 12.913 -5.736 36.355 1.00 20.70 N ATOM 1168 CA ASN A 828 13.821 -6.281 35.348 1.00 21.69 C ATOM 1169 C ASN A 828 14.351 -5.375 34.236 1.00 21.12 C ATOM 1170 O ASN A 828 15.131 -5.821 33.394 1.00 21.81 O ATOM 1171 CB ASN A 828 13.189 -7.537 34.739 1.00 23.87 C ATOM 1172 CG ASN A 828 14.168 -8.697 34.661 1.00 27.62 C ATOM 1173 OD1 ASN A 828 15.137 -8.756 35.425 1.00 28.27 O ATOM 1174 ND2 ASN A 828 13.913 -9.635 33.750 1.00 25.17 N ATOM 0 H ASN A 828 12.083 -5.729 36.131 1.00 20.70 H new ATOM 0 HA ASN A 828 14.627 -6.452 35.859 1.00 21.69 H new ATOM 0 HB2 ASN A 828 12.421 -7.800 35.270 1.00 23.87 H new ATOM 0 HB3 ASN A 828 12.862 -7.333 33.849 1.00 23.87 H new ATOM 0 HD21 ASN A 828 14.433 -10.316 33.677 1.00 25.17 H new ATOM 0 HD22 ASN A 828 13.228 -9.560 33.235 1.00 25.17 H new ATOM 1175 N THR A 829 13.944 -4.113 34.231 1.00 19.52 N ATOM 1176 CA THR A 829 14.417 -3.168 33.226 1.00 20.34 C ATOM 1177 C THR A 829 14.526 -1.789 33.872 1.00 21.37 C ATOM 1178 O THR A 829 13.688 -1.418 34.699 1.00 19.24 O ATOM 1179 CB THR A 829 13.451 -3.067 32.015 1.00 23.26 C ATOM 1180 OG1 THR A 829 13.231 -4.367 31.448 1.00 23.24 O ATOM 1181 CG2 THR A 829 14.048 -2.158 30.944 1.00 23.84 C ATOM 0 H THR A 829 13.393 -3.782 34.802 1.00 19.52 H new ATOM 0 HA THR A 829 15.275 -3.482 32.900 1.00 20.34 H new ATOM 0 HB THR A 829 12.609 -2.699 32.325 1.00 23.26 H new ATOM 0 HG1 THR A 829 13.960 -4.784 31.411 1.00 23.24 H new ATOM 0 HG21 THR A 829 13.439 -2.101 30.192 1.00 23.84 H new ATOM 0 HG22 THR A 829 14.190 -1.272 31.313 1.00 23.84 H new ATOM 0 HG23 THR A 829 14.896 -2.523 30.646 1.00 23.84 H new ATOM 1182 N ILE A 830 15.562 -1.038 33.510 1.00 20.19 N ATOM 1183 CA ILE A 830 15.761 0.299 34.056 1.00 22.30 C ATOM 1184 C ILE A 830 16.205 1.230 32.933 1.00 23.00 C ATOM 1185 O ILE A 830 16.700 0.769 31.901 1.00 24.66 O ATOM 1186 CB ILE A 830 16.835 0.296 35.166 1.00 23.76 C ATOM 1187 CG1 ILE A 830 18.164 -0.210 34.605 1.00 24.87 C ATOM 1188 CG2 ILE A 830 16.387 -0.583 36.324 1.00 23.00 C ATOM 1189 CD1 ILE A 830 19.276 -0.273 35.649 1.00 26.75 C ATOM 0 H ILE A 830 16.163 -1.286 32.947 1.00 20.19 H new ATOM 0 HA ILE A 830 14.925 0.603 34.442 1.00 22.30 H new ATOM 0 HB ILE A 830 16.955 1.202 35.490 1.00 23.76 H new ATOM 0 HG12 ILE A 830 18.033 -1.094 34.228 1.00 24.87 H new ATOM 0 HG13 ILE A 830 18.443 0.370 33.879 1.00 24.87 H new ATOM 0 HG21 ILE A 830 17.067 -0.579 37.016 1.00 23.00 H new ATOM 0 HG22 ILE A 830 15.555 -0.241 36.687 1.00 23.00 H new ATOM 0 HG23 ILE A 830 16.253 -1.490 36.009 1.00 23.00 H new ATOM 0 HD11 ILE A 830 20.090 -0.600 35.235 1.00 26.75 H new ATOM 0 HD12 ILE A 830 19.431 0.613 36.011 1.00 26.75 H new ATOM 0 HD13 ILE A 830 19.014 -0.873 36.365 1.00 26.75 H new ATOM 1190 N PRO A 831 16.024 2.551 33.111 1.00 22.94 N ATOM 1191 CA PRO A 831 16.412 3.540 32.100 1.00 23.07 C ATOM 1192 C PRO A 831 17.904 3.449 31.836 1.00 25.20 C ATOM 1193 O PRO A 831 18.650 2.919 32.661 1.00 25.96 O ATOM 1194 CB PRO A 831 16.024 4.870 32.743 1.00 23.19 C ATOM 1195 CG PRO A 831 14.901 4.485 33.686 1.00 22.55 C ATOM 1196 CD PRO A 831 15.422 3.210 34.284 1.00 22.36 C ATOM 0 HA PRO A 831 15.985 3.414 31.238 1.00 23.07 H new ATOM 0 HB2 PRO A 831 16.770 5.269 33.218 1.00 23.19 H new ATOM 0 HB3 PRO A 831 15.731 5.516 32.081 1.00 23.19 H new ATOM 0 HG2 PRO A 831 14.743 5.165 34.360 1.00 22.55 H new ATOM 0 HG3 PRO A 831 14.063 4.351 33.217 1.00 22.55 H new ATOM 0 HD2 PRO A 831 16.074 3.376 34.983 1.00 22.36 H new ATOM 0 HD3 PRO A 831 14.714 2.677 34.677 1.00 22.36 H new ATOM 1197 N LEU A 832 18.341 3.957 30.688 1.00 27.08 N ATOM 1198 CA LEU A 832 19.755 3.913 30.333 1.00 28.09 C ATOM 1199 C LEU A 832 20.609 4.645 31.361 1.00 29.34 C ATOM 1200 O LEU A 832 21.700 4.192 31.717 1.00 30.83 O ATOM 1201 CB LEU A 832 19.973 4.525 28.946 1.00 29.23 C ATOM 1202 CG LEU A 832 19.460 3.697 27.764 1.00 29.31 C ATOM 1203 CD1 LEU A 832 19.614 4.483 26.468 1.00 29.47 C ATOM 1204 CD2 LEU A 832 20.235 2.392 27.698 1.00 27.62 C ATOM 0 H LEU A 832 17.835 4.331 30.101 1.00 27.08 H new ATOM 0 HA LEU A 832 20.028 2.982 30.320 1.00 28.09 H new ATOM 0 HB2 LEU A 832 19.541 5.393 28.923 1.00 29.23 H new ATOM 0 HB3 LEU A 832 20.923 4.678 28.824 1.00 29.23 H new ATOM 0 HG LEU A 832 18.518 3.500 27.886 1.00 29.31 H new ATOM 0 HD11 LEU A 832 19.287 3.951 25.726 1.00 29.47 H new ATOM 0 HD12 LEU A 832 19.103 5.306 26.526 1.00 29.47 H new ATOM 0 HD13 LEU A 832 20.550 4.694 26.326 1.00 29.47 H new ATOM 0 HD21 LEU A 832 19.915 1.863 26.951 1.00 27.62 H new ATOM 0 HD22 LEU A 832 21.179 2.582 27.578 1.00 27.62 H new ATOM 0 HD23 LEU A 832 20.107 1.897 28.523 1.00 27.62 H new ATOM 1205 N GLU A 833 20.111 5.774 31.846 1.00 29.97 N ATOM 1206 CA GLU A 833 20.850 6.546 32.832 1.00 32.08 C ATOM 1207 C GLU A 833 20.660 5.977 34.231 1.00 31.78 C ATOM 1208 O GLU A 833 21.235 6.476 35.198 1.00 32.54 O ATOM 1209 CB GLU A 833 20.411 8.014 32.801 1.00 33.52 C ATOM 1210 CG GLU A 833 18.927 8.259 33.038 1.00 37.25 C ATOM 1211 CD GLU A 833 18.066 7.950 31.824 1.00 39.09 C ATOM 1212 OE1 GLU A 833 16.865 8.290 31.847 1.00 41.64 O ATOM 1213 OE2 GLU A 833 18.579 7.366 30.850 1.00 40.82 O ATOM 0 H GLU A 833 19.352 6.108 31.619 1.00 29.97 H new ATOM 0 HA GLU A 833 21.792 6.492 32.606 1.00 32.08 H new ATOM 0 HB2 GLU A 833 20.914 8.500 33.473 1.00 33.52 H new ATOM 0 HB3 GLU A 833 20.651 8.389 31.939 1.00 33.52 H new ATOM 0 HG2 GLU A 833 18.631 7.714 33.784 1.00 37.25 H new ATOM 0 HG3 GLU A 833 18.795 9.186 33.293 1.00 37.25 H new ATOM 1214 N GLY A 834 19.857 4.923 34.332 1.00 30.38 N ATOM 1215 CA GLY A 834 19.609 4.310 35.621 1.00 27.48 C ATOM 1216 C GLY A 834 18.444 4.962 36.339 1.00 27.58 C ATOM 1217 O GLY A 834 17.835 5.899 35.829 1.00 27.05 O ATOM 0 H GLY A 834 19.451 4.553 33.670 1.00 30.38 H new ATOM 0 HA2 GLY A 834 19.427 3.365 35.500 1.00 27.48 H new ATOM 0 HA3 GLY A 834 20.406 4.377 36.170 1.00 27.48 H new ATOM 1218 N LEU A 835 18.133 4.462 37.528 1.00 26.88 N ATOM 1219 CA LEU A 835 17.034 4.997 38.317 1.00 27.65 C ATOM 1220 C LEU A 835 17.532 6.079 39.264 1.00 27.79 C ATOM 1221 O LEU A 835 18.726 6.178 39.535 1.00 27.86 O ATOM 1222 CB LEU A 835 16.380 3.883 39.131 1.00 24.90 C ATOM 1223 CG LEU A 835 15.661 2.780 38.352 1.00 25.38 C ATOM 1224 CD1 LEU A 835 15.368 1.620 39.278 1.00 22.69 C ATOM 1225 CD2 LEU A 835 14.382 3.322 37.746 1.00 22.79 C ATOM 0 H LEU A 835 18.550 3.807 37.898 1.00 26.88 H new ATOM 0 HA LEU A 835 16.384 5.381 37.708 1.00 27.65 H new ATOM 0 HB2 LEU A 835 17.065 3.468 39.678 1.00 24.90 H new ATOM 0 HB3 LEU A 835 15.741 4.289 39.737 1.00 24.90 H new ATOM 0 HG LEU A 835 16.229 2.468 37.630 1.00 25.38 H new ATOM 0 HD11 LEU A 835 14.912 0.920 38.785 1.00 22.69 H new ATOM 0 HD12 LEU A 835 16.200 1.274 39.636 1.00 22.69 H new ATOM 0 HD13 LEU A 835 14.804 1.922 40.007 1.00 22.69 H new ATOM 0 HD21 LEU A 835 13.933 2.617 37.254 1.00 22.79 H new ATOM 0 HD22 LEU A 835 13.800 3.644 38.452 1.00 22.79 H new ATOM 0 HD23 LEU A 835 14.593 4.052 37.143 1.00 22.79 H new ATOM 1226 N ARG A 836 16.606 6.889 39.762 1.00 29.76 N ATOM 1227 CA ARG A 836 16.954 7.948 40.695 1.00 31.17 C ATOM 1228 C ARG A 836 17.324 7.273 42.029 1.00 30.11 C ATOM 1229 O ARG A 836 18.295 7.651 42.687 1.00 29.46 O ATOM 1230 CB ARG A 836 15.759 8.913 40.877 1.00 33.48 C ATOM 1231 CG ARG A 836 15.181 9.600 39.584 1.00 37.35 C ATOM 1232 CD ARG A 836 14.103 10.541 40.004 1.00 41.31 C ATOM 1233 NE ARG A 836 14.801 11.274 41.036 1.00 46.87 N ATOM 1234 CZ ARG A 836 15.143 12.556 41.016 1.00 48.15 C ATOM 1235 NH1 ARG A 836 14.819 13.325 40.010 1.00 48.97 N ATOM 1236 NH2 ARG A 836 15.961 12.998 41.978 1.00 49.70 N ATOM 0 H ARG A 836 15.769 6.841 39.571 1.00 29.76 H new ATOM 0 HA ARG A 836 17.700 8.473 40.364 1.00 31.17 H new ATOM 0 HB2 ARG A 836 15.039 8.422 41.303 1.00 33.48 H new ATOM 0 HB3 ARG A 836 16.029 9.612 41.493 1.00 33.48 H new ATOM 0 HG2 ARG A 836 15.881 10.076 39.111 1.00 37.35 H new ATOM 0 HG3 ARG A 836 14.830 8.933 38.974 1.00 37.35 H new ATOM 0 HD2 ARG A 836 13.806 11.113 39.279 1.00 41.31 H new ATOM 0 HD3 ARG A 836 13.319 10.080 40.341 1.00 41.31 H new ATOM 0 HE ARG A 836 15.018 10.831 41.740 1.00 46.87 H new ATOM 0 HH11 ARG A 836 14.377 13.002 39.347 1.00 48.97 H new ATOM 0 HH12 ARG A 836 15.048 14.154 40.011 1.00 48.97 H new ATOM 0 HH21 ARG A 836 16.247 12.456 42.582 1.00 49.70 H new ATOM 0 HH22 ARG A 836 16.201 13.824 41.992 1.00 49.70 H new ATOM 1237 N SER A 837 16.548 6.261 42.408 1.00 28.26 N ATOM 1238 CA SER A 837 16.781 5.521 43.644 1.00 27.21 C ATOM 1239 C SER A 837 17.508 4.218 43.329 1.00 26.11 C ATOM 1240 O SER A 837 17.099 3.149 43.781 1.00 26.12 O ATOM 1241 CB SER A 837 15.450 5.201 44.328 1.00 27.34 C ATOM 1242 OG SER A 837 14.734 6.385 44.633 1.00 29.92 O ATOM 0 H SER A 837 15.871 5.984 41.955 1.00 28.26 H new ATOM 0 HA SER A 837 17.322 6.065 44.237 1.00 27.21 H new ATOM 0 HB2 SER A 837 14.914 4.636 43.750 1.00 27.34 H new ATOM 0 HB3 SER A 837 15.614 4.700 45.142 1.00 27.34 H new ATOM 0 HG SER A 837 14.947 6.651 45.401 1.00 29.92 H new ATOM 1243 N GLN A 838 18.590 4.319 42.562 1.00 24.76 N ATOM 1244 CA GLN A 838 19.375 3.156 42.154 1.00 24.95 C ATOM 1245 C GLN A 838 19.836 2.272 43.316 1.00 25.96 C ATOM 1246 O GLN A 838 19.689 1.047 43.265 1.00 26.38 O ATOM 1247 CB GLN A 838 20.583 3.617 41.330 1.00 25.50 C ATOM 1248 CG GLN A 838 21.289 2.518 40.530 1.00 27.36 C ATOM 1249 CD GLN A 838 20.366 1.792 39.556 1.00 27.76 C ATOM 1250 OE1 GLN A 838 19.600 2.416 38.818 1.00 28.42 O ATOM 1251 NE2 GLN A 838 20.448 0.466 39.543 1.00 28.28 N ATOM 0 H GLN A 838 18.891 5.067 42.262 1.00 24.76 H new ATOM 0 HA GLN A 838 18.786 2.601 41.619 1.00 24.95 H new ATOM 0 HB2 GLN A 838 20.291 4.308 40.714 1.00 25.50 H new ATOM 0 HB3 GLN A 838 21.228 4.025 41.929 1.00 25.50 H new ATOM 0 HG2 GLN A 838 22.026 2.909 40.036 1.00 27.36 H new ATOM 0 HG3 GLN A 838 21.671 1.873 41.146 1.00 27.36 H new ATOM 0 HE21 GLN A 838 20.994 0.064 40.072 1.00 28.28 H new ATOM 0 HE22 GLN A 838 19.955 0.010 39.006 1.00 28.28 H new ATOM 1252 N THR A 839 20.384 2.880 44.366 1.00 25.91 N ATOM 1253 CA THR A 839 20.850 2.108 45.515 1.00 26.61 C ATOM 1254 C THR A 839 19.714 1.302 46.138 1.00 25.12 C ATOM 1255 O THR A 839 19.835 0.091 46.334 1.00 25.74 O ATOM 1256 CB THR A 839 21.472 3.024 46.596 1.00 26.56 C ATOM 1257 OG1 THR A 839 22.625 3.679 46.057 1.00 26.19 O ATOM 1258 CG2 THR A 839 21.900 2.217 47.806 1.00 26.55 C ATOM 0 H THR A 839 20.494 3.730 44.433 1.00 25.91 H new ATOM 0 HA THR A 839 21.530 1.499 45.186 1.00 26.61 H new ATOM 0 HB THR A 839 20.804 3.673 46.866 1.00 26.56 H new ATOM 0 HG1 THR A 839 22.385 4.357 45.623 1.00 26.19 H new ATOM 0 HG21 THR A 839 22.286 2.809 48.470 1.00 26.55 H new ATOM 0 HG22 THR A 839 21.129 1.767 48.185 1.00 26.55 H new ATOM 0 HG23 THR A 839 22.559 1.558 47.539 1.00 26.55 H new ATOM 1259 N GLN A 840 18.608 1.970 46.439 1.00 24.67 N ATOM 1260 CA GLN A 840 17.456 1.311 47.040 1.00 25.39 C ATOM 1261 C GLN A 840 16.895 0.239 46.112 1.00 23.62 C ATOM 1262 O GLN A 840 16.380 -0.783 46.565 1.00 23.20 O ATOM 1263 CB GLN A 840 16.369 2.339 47.343 1.00 30.05 C ATOM 1264 CG GLN A 840 15.197 1.774 48.130 1.00 38.18 C ATOM 1265 CD GLN A 840 15.638 1.161 49.436 1.00 43.19 C ATOM 1266 OE1 GLN A 840 16.475 1.725 50.143 1.00 48.69 O ATOM 1267 NE2 GLN A 840 15.076 0.004 49.773 1.00 45.46 N ATOM 0 H GLN A 840 18.504 2.813 46.302 1.00 24.67 H new ATOM 0 HA GLN A 840 17.746 0.888 47.863 1.00 25.39 H new ATOM 0 HB2 GLN A 840 16.759 3.074 47.842 1.00 30.05 H new ATOM 0 HB3 GLN A 840 16.040 2.707 46.508 1.00 30.05 H new ATOM 0 HG2 GLN A 840 14.555 2.480 48.305 1.00 38.18 H new ATOM 0 HG3 GLN A 840 14.743 1.104 47.596 1.00 38.18 H new ATOM 0 HE21 GLN A 840 14.495 -0.359 49.253 1.00 45.46 H new ATOM 0 HE22 GLN A 840 15.293 -0.381 50.511 1.00 45.46 H new ATOM 1268 N PHE A 841 17.000 0.487 44.812 1.00 19.08 N ATOM 1269 CA PHE A 841 16.511 -0.446 43.810 1.00 21.03 C ATOM 1270 C PHE A 841 17.289 -1.751 43.856 1.00 19.40 C ATOM 1271 O PHE A 841 16.714 -2.833 43.831 1.00 18.27 O ATOM 1272 CB PHE A 841 16.644 0.167 42.413 1.00 18.71 C ATOM 1273 CG PHE A 841 16.366 -0.801 41.290 1.00 20.64 C ATOM 1274 CD1 PHE A 841 15.061 -1.153 40.959 1.00 20.62 C ATOM 1275 CD2 PHE A 841 17.408 -1.343 40.553 1.00 18.72 C ATOM 1276 CE1 PHE A 841 14.799 -2.031 39.908 1.00 19.47 C ATOM 1277 CE2 PHE A 841 17.156 -2.224 39.501 1.00 20.44 C ATOM 1278 CZ PHE A 841 15.844 -2.565 39.181 1.00 18.29 C ATOM 0 H PHE A 841 17.356 1.200 44.488 1.00 19.08 H new ATOM 0 HA PHE A 841 15.578 -0.629 44.002 1.00 21.03 H new ATOM 0 HB2 PHE A 841 16.034 0.917 42.340 1.00 18.71 H new ATOM 0 HB3 PHE A 841 17.541 0.520 42.309 1.00 18.71 H new ATOM 0 HD1 PHE A 841 14.353 -0.797 41.446 1.00 20.62 H new ATOM 0 HD2 PHE A 841 18.285 -1.117 40.762 1.00 18.72 H new ATOM 0 HE1 PHE A 841 13.922 -2.256 39.697 1.00 19.47 H new ATOM 0 HE2 PHE A 841 17.863 -2.583 39.014 1.00 20.44 H new ATOM 0 HZ PHE A 841 15.672 -3.151 38.479 1.00 18.29 H new ATOM 1279 N GLU A 842 18.607 -1.641 43.928 1.00 21.79 N ATOM 1280 CA GLU A 842 19.456 -2.822 43.949 1.00 23.37 C ATOM 1281 C GLU A 842 19.315 -3.628 45.233 1.00 22.13 C ATOM 1282 O GLU A 842 19.375 -4.859 45.206 1.00 21.23 O ATOM 1283 CB GLU A 842 20.905 -2.402 43.700 1.00 25.88 C ATOM 1284 CG GLU A 842 21.025 -1.544 42.440 1.00 32.24 C ATOM 1285 CD GLU A 842 22.449 -1.188 42.072 1.00 37.53 C ATOM 1286 OE1 GLU A 842 23.298 -1.070 42.984 1.00 40.09 O ATOM 1287 OE2 GLU A 842 22.715 -1.003 40.862 1.00 40.46 O ATOM 0 H GLU A 842 19.030 -0.893 43.966 1.00 21.79 H new ATOM 0 HA GLU A 842 19.167 -3.416 43.239 1.00 23.37 H new ATOM 0 HB2 GLU A 842 21.236 -1.906 44.465 1.00 25.88 H new ATOM 0 HB3 GLU A 842 21.462 -3.191 43.611 1.00 25.88 H new ATOM 0 HG2 GLU A 842 20.617 -2.017 41.698 1.00 32.24 H new ATOM 0 HG3 GLU A 842 20.519 -0.726 42.567 1.00 32.24 H new ATOM 1288 N GLU A 843 19.122 -2.945 46.356 1.00 22.42 N ATOM 1289 CA GLU A 843 18.946 -3.647 47.624 1.00 23.43 C ATOM 1290 C GLU A 843 17.626 -4.424 47.568 1.00 23.72 C ATOM 1291 O GLU A 843 17.535 -5.555 48.052 1.00 22.69 O ATOM 1292 CB GLU A 843 18.912 -2.655 48.791 1.00 23.88 C ATOM 1293 CG GLU A 843 20.243 -1.979 49.093 1.00 27.81 C ATOM 1294 CD GLU A 843 20.122 -0.936 50.191 1.00 31.49 C ATOM 1295 OE1 GLU A 843 19.070 -0.905 50.869 1.00 31.88 O ATOM 1296 OE2 GLU A 843 21.078 -0.155 50.384 1.00 31.57 O ATOM 0 H GLU A 843 19.090 -2.087 46.407 1.00 22.42 H new ATOM 0 HA GLU A 843 19.690 -4.253 47.764 1.00 23.43 H new ATOM 0 HB2 GLU A 843 18.252 -1.971 48.598 1.00 23.88 H new ATOM 0 HB3 GLU A 843 18.612 -3.121 49.587 1.00 23.88 H new ATOM 0 HG2 GLU A 843 20.892 -2.650 49.357 1.00 27.81 H new ATOM 0 HG3 GLU A 843 20.581 -1.559 48.286 1.00 27.81 H new ATOM 1297 N MET A 844 16.610 -3.809 46.966 1.00 22.28 N ATOM 1298 CA MET A 844 15.302 -4.441 46.837 1.00 23.75 C ATOM 1299 C MET A 844 15.391 -5.664 45.926 1.00 23.62 C ATOM 1300 O MET A 844 14.875 -6.735 46.249 1.00 23.13 O ATOM 1301 CB MET A 844 14.284 -3.452 46.268 1.00 23.48 C ATOM 1302 CG MET A 844 12.897 -4.053 46.061 1.00 22.03 C ATOM 1303 SD MET A 844 11.674 -2.853 45.484 1.00 21.97 S ATOM 1304 CE MET A 844 10.190 -3.913 45.332 1.00 19.26 C ATOM 0 H MET A 844 16.660 -3.021 46.624 1.00 22.28 H new ATOM 0 HA MET A 844 15.012 -4.721 47.719 1.00 23.75 H new ATOM 0 HB2 MET A 844 14.213 -2.692 46.867 1.00 23.48 H new ATOM 0 HB3 MET A 844 14.612 -3.114 45.420 1.00 23.48 H new ATOM 0 HG2 MET A 844 12.958 -4.777 45.418 1.00 22.03 H new ATOM 0 HG3 MET A 844 12.592 -4.440 46.896 1.00 22.03 H new ATOM 0 HE1 MET A 844 9.498 -3.435 44.849 1.00 19.26 H new ATOM 0 HE2 MET A 844 10.419 -4.723 44.850 1.00 19.26 H new ATOM 0 HE3 MET A 844 9.865 -4.144 46.216 1.00 19.26 H new ATOM 1305 N ARG A 845 16.050 -5.501 44.785 1.00 24.83 N ATOM 1306 CA ARG A 845 16.199 -6.601 43.843 1.00 25.29 C ATOM 1307 C ARG A 845 16.936 -7.768 44.508 1.00 25.80 C ATOM 1308 O ARG A 845 16.599 -8.929 44.289 1.00 24.55 O ATOM 1309 CB ARG A 845 16.954 -6.118 42.602 1.00 26.49 C ATOM 1310 CG ARG A 845 16.949 -7.083 41.437 1.00 29.97 C ATOM 1311 CD ARG A 845 17.529 -6.423 40.192 1.00 31.56 C ATOM 1312 NE ARG A 845 17.929 -7.408 39.196 1.00 33.17 N ATOM 1313 CZ ARG A 845 17.089 -8.089 38.429 1.00 35.99 C ATOM 1314 NH1 ARG A 845 15.778 -7.896 38.528 1.00 38.35 N ATOM 1315 NH2 ARG A 845 17.564 -8.976 37.567 1.00 38.71 N ATOM 0 H ARG A 845 16.417 -4.764 44.538 1.00 24.83 H new ATOM 0 HA ARG A 845 15.322 -6.912 43.571 1.00 25.29 H new ATOM 0 HB2 ARG A 845 16.567 -5.278 42.311 1.00 26.49 H new ATOM 0 HB3 ARG A 845 17.874 -5.936 42.850 1.00 26.49 H new ATOM 0 HG2 ARG A 845 17.466 -7.872 41.662 1.00 29.97 H new ATOM 0 HG3 ARG A 845 16.043 -7.379 41.260 1.00 29.97 H new ATOM 0 HD2 ARG A 845 16.871 -5.823 39.808 1.00 31.56 H new ATOM 0 HD3 ARG A 845 18.296 -5.883 40.439 1.00 31.56 H new ATOM 0 HE ARG A 845 18.770 -7.558 39.099 1.00 33.17 H new ATOM 0 HH11 ARG A 845 15.469 -7.326 39.093 1.00 38.35 H new ATOM 0 HH12 ARG A 845 15.239 -8.341 38.027 1.00 38.35 H new ATOM 0 HH21 ARG A 845 18.412 -9.107 37.508 1.00 38.71 H new ATOM 0 HH22 ARG A 845 17.024 -9.421 37.067 1.00 38.71 H new ATOM 1316 N SER A 846 17.932 -7.454 45.334 1.00 26.07 N ATOM 1317 CA SER A 846 18.699 -8.484 46.028 1.00 25.65 C ATOM 1318 C SER A 846 17.864 -9.228 47.071 1.00 24.40 C ATOM 1319 O SER A 846 17.981 -10.443 47.212 1.00 25.51 O ATOM 1320 CB SER A 846 19.916 -7.868 46.723 1.00 24.91 C ATOM 1321 OG SER A 846 20.802 -7.291 45.789 1.00 27.13 O ATOM 0 H SER A 846 18.179 -6.648 45.506 1.00 26.07 H new ATOM 0 HA SER A 846 18.982 -9.120 45.352 1.00 25.65 H new ATOM 0 HB2 SER A 846 19.623 -7.192 47.354 1.00 24.91 H new ATOM 0 HB3 SER A 846 20.380 -8.550 47.233 1.00 24.91 H new ATOM 0 HG SER A 846 20.494 -6.554 45.529 1.00 27.13 H new ATOM 1322 N SER A 847 17.032 -8.507 47.814 1.00 23.71 N ATOM 1323 CA SER A 847 16.221 -9.165 48.832 1.00 24.86 C ATOM 1324 C SER A 847 15.176 -10.071 48.185 1.00 23.36 C ATOM 1325 O SER A 847 14.807 -11.103 48.747 1.00 23.46 O ATOM 1326 CB SER A 847 15.542 -8.136 49.743 1.00 27.15 C ATOM 1327 OG SER A 847 14.618 -7.345 49.025 1.00 33.80 O ATOM 0 H SER A 847 16.923 -7.656 47.748 1.00 23.71 H new ATOM 0 HA SER A 847 16.810 -9.711 49.376 1.00 24.86 H new ATOM 0 HB2 SER A 847 15.086 -8.593 50.467 1.00 27.15 H new ATOM 0 HB3 SER A 847 16.214 -7.565 50.147 1.00 27.15 H new ATOM 0 HG SER A 847 14.867 -7.279 48.225 1.00 33.80 H new ATOM 1328 N TYR A 848 14.693 -9.703 47.004 1.00 21.60 N ATOM 1329 CA TYR A 848 13.715 -10.561 46.359 1.00 20.42 C ATOM 1330 C TYR A 848 14.417 -11.719 45.663 1.00 19.90 C ATOM 1331 O TYR A 848 13.810 -12.757 45.419 1.00 19.96 O ATOM 1332 CB TYR A 848 12.823 -9.769 45.398 1.00 20.78 C ATOM 1333 CG TYR A 848 11.721 -9.032 46.131 1.00 20.16 C ATOM 1334 CD1 TYR A 848 11.866 -7.701 46.500 1.00 18.53 C ATOM 1335 CD2 TYR A 848 10.554 -9.689 46.496 1.00 18.58 C ATOM 1336 CE1 TYR A 848 10.882 -7.048 47.209 1.00 17.44 C ATOM 1337 CE2 TYR A 848 9.564 -9.049 47.209 1.00 18.34 C ATOM 1338 CZ TYR A 848 9.728 -7.728 47.563 1.00 19.98 C ATOM 1339 OH TYR A 848 8.725 -7.089 48.255 1.00 18.41 O ATOM 0 H TYR A 848 14.909 -8.989 46.575 1.00 21.60 H new ATOM 0 HA TYR A 848 13.129 -10.930 47.038 1.00 20.42 H new ATOM 0 HB2 TYR A 848 13.364 -9.133 44.904 1.00 20.78 H new ATOM 0 HB3 TYR A 848 12.431 -10.373 44.748 1.00 20.78 H new ATOM 0 HD1 TYR A 848 12.640 -7.243 46.264 1.00 18.53 H new ATOM 0 HD2 TYR A 848 10.438 -10.580 46.254 1.00 18.58 H new ATOM 0 HE1 TYR A 848 10.992 -6.156 47.449 1.00 17.44 H new ATOM 0 HE2 TYR A 848 8.790 -9.506 47.450 1.00 18.34 H new ATOM 0 HH TYR A 848 8.934 -6.284 48.371 1.00 18.41 H new ATOM 1340 N ILE A 849 15.703 -11.556 45.368 1.00 19.66 N ATOM 1341 CA ILE A 849 16.454 -12.652 44.765 1.00 21.44 C ATOM 1342 C ILE A 849 16.676 -13.669 45.883 1.00 20.56 C ATOM 1343 O ILE A 849 16.600 -14.871 45.664 1.00 21.20 O ATOM 1344 CB ILE A 849 17.824 -12.196 44.221 1.00 22.43 C ATOM 1345 CG1 ILE A 849 17.638 -11.405 42.921 1.00 20.53 C ATOM 1346 CG2 ILE A 849 18.723 -13.419 43.992 1.00 23.22 C ATOM 1347 CD1 ILE A 849 18.940 -10.838 42.356 1.00 22.48 C ATOM 0 H ILE A 849 16.152 -10.835 45.505 1.00 19.66 H new ATOM 0 HA ILE A 849 15.961 -13.014 44.012 1.00 21.44 H new ATOM 0 HB ILE A 849 18.251 -11.615 44.870 1.00 22.43 H new ATOM 0 HG12 ILE A 849 17.230 -11.982 42.256 1.00 20.53 H new ATOM 0 HG13 ILE A 849 17.019 -10.675 43.081 1.00 20.53 H new ATOM 0 HG21 ILE A 849 19.583 -13.129 43.650 1.00 23.22 H new ATOM 0 HG22 ILE A 849 18.851 -13.889 44.831 1.00 23.22 H new ATOM 0 HG23 ILE A 849 18.304 -14.013 43.350 1.00 23.22 H new ATOM 0 HD11 ILE A 849 18.753 -10.351 41.538 1.00 22.48 H new ATOM 0 HD12 ILE A 849 19.340 -10.238 43.004 1.00 22.48 H new ATOM 0 HD13 ILE A 849 19.554 -11.564 42.167 1.00 22.48 H new ATOM 1348 N ARG A 850 16.936 -13.177 47.091 1.00 21.73 N ATOM 1349 CA ARG A 850 17.137 -14.064 48.230 1.00 22.13 C ATOM 1350 C ARG A 850 15.830 -14.766 48.563 1.00 22.31 C ATOM 1351 O ARG A 850 15.829 -15.918 48.998 1.00 22.77 O ATOM 1352 CB ARG A 850 17.629 -13.291 49.462 1.00 22.22 C ATOM 1353 CG ARG A 850 19.082 -12.827 49.368 1.00 22.81 C ATOM 1354 CD ARG A 850 19.619 -12.364 50.727 1.00 26.06 C ATOM 1355 NE ARG A 850 19.022 -11.111 51.196 1.00 23.97 N ATOM 1356 CZ ARG A 850 19.370 -9.903 50.759 1.00 27.13 C ATOM 1357 NH1 ARG A 850 20.319 -9.769 49.839 1.00 27.04 N ATOM 1358 NH2 ARG A 850 18.765 -8.822 51.237 1.00 27.69 N ATOM 0 H ARG A 850 17.000 -12.338 47.271 1.00 21.73 H new ATOM 0 HA ARG A 850 17.815 -14.715 47.990 1.00 22.13 H new ATOM 0 HB2 ARG A 850 17.060 -12.517 49.594 1.00 22.22 H new ATOM 0 HB3 ARG A 850 17.529 -13.854 50.246 1.00 22.22 H new ATOM 0 HG2 ARG A 850 19.632 -13.552 49.032 1.00 22.81 H new ATOM 0 HG3 ARG A 850 19.149 -12.101 48.729 1.00 22.81 H new ATOM 0 HD2 ARG A 850 19.455 -13.058 51.385 1.00 26.06 H new ATOM 0 HD3 ARG A 850 20.581 -12.253 50.666 1.00 26.06 H new ATOM 0 HE ARG A 850 18.405 -11.159 51.794 1.00 23.97 H new ATOM 0 HH11 ARG A 850 20.712 -10.465 49.522 1.00 27.04 H new ATOM 0 HH12 ARG A 850 20.540 -8.986 49.560 1.00 27.04 H new ATOM 0 HH21 ARG A 850 18.147 -8.902 51.830 1.00 27.69 H new ATOM 0 HH22 ARG A 850 18.991 -8.042 50.954 1.00 27.69 H new ATOM 1359 N GLU A 851 14.713 -14.081 48.341 1.00 22.47 N ATOM 1360 CA GLU A 851 13.418 -14.676 48.636 1.00 21.11 C ATOM 1361 C GLU A 851 13.073 -15.761 47.613 1.00 21.76 C ATOM 1362 O GLU A 851 12.425 -16.750 47.951 1.00 20.51 O ATOM 1363 CB GLU A 851 12.328 -13.599 48.676 1.00 20.90 C ATOM 1364 CG GLU A 851 11.097 -14.022 49.465 1.00 22.71 C ATOM 1365 CD GLU A 851 11.355 -14.147 50.970 1.00 24.02 C ATOM 1366 OE1 GLU A 851 10.490 -14.713 51.678 1.00 26.09 O ATOM 1367 OE2 GLU A 851 12.408 -13.672 51.454 1.00 24.00 O ATOM 0 H GLU A 851 14.684 -13.282 48.025 1.00 22.47 H new ATOM 0 HA GLU A 851 13.466 -15.093 49.511 1.00 21.11 H new ATOM 0 HB2 GLU A 851 12.694 -12.791 49.068 1.00 20.90 H new ATOM 0 HB3 GLU A 851 12.064 -13.380 47.769 1.00 20.90 H new ATOM 0 HG2 GLU A 851 10.388 -13.376 49.317 1.00 22.71 H new ATOM 0 HG3 GLU A 851 10.780 -14.874 49.126 1.00 22.71 H new ATOM 1368 N LEU A 852 13.502 -15.579 46.365 1.00 22.04 N ATOM 1369 CA LEU A 852 13.244 -16.579 45.338 1.00 21.53 C ATOM 1370 C LEU A 852 14.009 -17.843 45.734 1.00 22.80 C ATOM 1371 O LEU A 852 13.514 -18.955 45.575 1.00 21.46 O ATOM 1372 CB LEU A 852 13.710 -16.087 43.960 1.00 20.88 C ATOM 1373 CG LEU A 852 13.797 -17.130 42.832 1.00 20.12 C ATOM 1374 CD1 LEU A 852 12.483 -17.885 42.718 1.00 20.70 C ATOM 1375 CD2 LEU A 852 14.143 -16.447 41.506 1.00 18.94 C ATOM 0 H LEU A 852 13.940 -14.889 46.097 1.00 22.04 H new ATOM 0 HA LEU A 852 12.292 -16.754 45.273 1.00 21.53 H new ATOM 0 HB2 LEU A 852 13.107 -15.383 43.673 1.00 20.88 H new ATOM 0 HB3 LEU A 852 14.586 -15.685 44.065 1.00 20.88 H new ATOM 0 HG LEU A 852 14.500 -17.764 43.042 1.00 20.12 H new ATOM 0 HD11 LEU A 852 12.547 -18.540 42.005 1.00 20.70 H new ATOM 0 HD12 LEU A 852 12.295 -18.337 43.556 1.00 20.70 H new ATOM 0 HD13 LEU A 852 11.767 -17.261 42.520 1.00 20.70 H new ATOM 0 HD21 LEU A 852 14.195 -17.113 40.803 1.00 18.94 H new ATOM 0 HD22 LEU A 852 13.455 -15.799 41.287 1.00 18.94 H new ATOM 0 HD23 LEU A 852 14.998 -15.996 41.588 1.00 18.94 H new ATOM 1376 N ILE A 853 15.220 -17.660 46.256 1.00 23.94 N ATOM 1377 CA ILE A 853 16.031 -18.791 46.689 1.00 24.72 C ATOM 1378 C ILE A 853 15.305 -19.524 47.820 1.00 24.44 C ATOM 1379 O ILE A 853 15.206 -20.749 47.805 1.00 26.09 O ATOM 1380 CB ILE A 853 17.426 -18.326 47.158 1.00 25.61 C ATOM 1381 CG1 ILE A 853 18.199 -17.746 45.969 1.00 26.65 C ATOM 1382 CG2 ILE A 853 18.189 -19.488 47.768 1.00 25.64 C ATOM 1383 CD1 ILE A 853 19.554 -17.172 46.334 1.00 27.65 C ATOM 0 H ILE A 853 15.588 -16.891 46.367 1.00 23.94 H new ATOM 0 HA ILE A 853 16.159 -19.393 45.939 1.00 24.72 H new ATOM 0 HB ILE A 853 17.323 -17.639 47.835 1.00 25.61 H new ATOM 0 HG12 ILE A 853 18.321 -18.442 45.304 1.00 26.65 H new ATOM 0 HG13 ILE A 853 17.664 -17.050 45.556 1.00 26.65 H new ATOM 0 HG21 ILE A 853 19.063 -19.184 48.059 1.00 25.64 H new ATOM 0 HG22 ILE A 853 17.698 -19.834 48.529 1.00 25.64 H new ATOM 0 HG23 ILE A 853 18.295 -20.189 47.106 1.00 25.64 H new ATOM 0 HD11 ILE A 853 19.984 -16.825 45.537 1.00 27.65 H new ATOM 0 HD12 ILE A 853 19.439 -16.455 46.977 1.00 27.65 H new ATOM 0 HD13 ILE A 853 20.107 -17.868 46.722 1.00 27.65 H new ATOM 1384 N LYS A 854 14.778 -18.779 48.788 1.00 23.36 N ATOM 1385 CA LYS A 854 14.043 -19.394 49.889 1.00 23.85 C ATOM 1386 C LYS A 854 12.852 -20.173 49.327 1.00 24.05 C ATOM 1387 O LYS A 854 12.561 -21.287 49.770 1.00 22.84 O ATOM 1388 CB LYS A 854 13.505 -18.341 50.862 1.00 24.82 C ATOM 1389 CG LYS A 854 14.526 -17.458 51.553 1.00 27.39 C ATOM 1390 CD LYS A 854 13.790 -16.555 52.540 1.00 28.13 C ATOM 1391 CE LYS A 854 14.668 -15.461 53.113 1.00 28.85 C ATOM 1392 NZ LYS A 854 13.838 -14.527 53.934 1.00 27.82 N ATOM 0 H LYS A 854 14.834 -17.922 48.826 1.00 23.36 H new ATOM 0 HA LYS A 854 14.654 -19.979 50.363 1.00 23.85 H new ATOM 0 HB2 LYS A 854 12.890 -17.769 50.377 1.00 24.82 H new ATOM 0 HB3 LYS A 854 12.989 -18.797 51.545 1.00 24.82 H new ATOM 0 HG2 LYS A 854 15.183 -18.000 52.017 1.00 27.39 H new ATOM 0 HG3 LYS A 854 15.007 -16.925 50.901 1.00 27.39 H new ATOM 0 HD2 LYS A 854 13.029 -16.151 52.095 1.00 28.13 H new ATOM 0 HD3 LYS A 854 13.441 -17.095 53.266 1.00 28.13 H new ATOM 0 HE2 LYS A 854 15.369 -15.850 53.659 1.00 28.85 H new ATOM 0 HE3 LYS A 854 15.104 -14.975 52.396 1.00 28.85 H new ATOM 0 HZ1 LYS A 854 14.366 -13.928 54.328 1.00 27.82 H new ATOM 0 HZ2 LYS A 854 13.255 -14.108 53.408 1.00 27.82 H new ATOM 0 HZ3 LYS A 854 13.398 -14.988 54.555 1.00 27.82 H new ATOM 1393 N ALA A 855 12.156 -19.574 48.360 1.00 22.81 N ATOM 1394 CA ALA A 855 11.001 -20.218 47.741 1.00 22.60 C ATOM 1395 C ALA A 855 11.440 -21.547 47.141 1.00 23.40 C ATOM 1396 O ALA A 855 10.770 -22.568 47.294 1.00 24.07 O ATOM 1397 CB ALA A 855 10.413 -19.323 46.652 1.00 22.38 C ATOM 0 H ALA A 855 12.338 -18.793 48.049 1.00 22.81 H new ATOM 0 HA ALA A 855 10.318 -20.370 48.413 1.00 22.60 H new ATOM 0 HB1 ALA A 855 9.648 -19.763 46.250 1.00 22.38 H new ATOM 0 HB2 ALA A 855 10.133 -18.480 47.042 1.00 22.38 H new ATOM 0 HB3 ALA A 855 11.084 -19.157 45.972 1.00 22.38 H new ATOM 1398 N ILE A 856 12.576 -21.530 46.458 1.00 24.93 N ATOM 1399 CA ILE A 856 13.104 -22.740 45.847 1.00 25.29 C ATOM 1400 C ILE A 856 13.467 -23.761 46.930 1.00 27.69 C ATOM 1401 O ILE A 856 13.219 -24.959 46.779 1.00 27.54 O ATOM 1402 CB ILE A 856 14.340 -22.412 44.992 1.00 24.74 C ATOM 1403 CG1 ILE A 856 13.902 -21.607 43.766 1.00 25.24 C ATOM 1404 CG2 ILE A 856 15.061 -23.684 44.602 1.00 24.29 C ATOM 1405 CD1 ILE A 856 15.042 -21.046 42.935 1.00 26.69 C ATOM 0 H ILE A 856 13.057 -20.827 46.337 1.00 24.93 H new ATOM 0 HA ILE A 856 12.422 -23.121 45.272 1.00 25.29 H new ATOM 0 HB ILE A 856 14.964 -21.874 45.504 1.00 24.74 H new ATOM 0 HG12 ILE A 856 13.354 -22.174 43.201 1.00 25.24 H new ATOM 0 HG13 ILE A 856 13.341 -20.873 44.060 1.00 25.24 H new ATOM 0 HG21 ILE A 856 15.837 -23.464 44.064 1.00 24.29 H new ATOM 0 HG22 ILE A 856 15.345 -24.153 45.402 1.00 24.29 H new ATOM 0 HG23 ILE A 856 14.463 -24.251 44.090 1.00 24.29 H new ATOM 0 HD11 ILE A 856 14.681 -20.552 42.182 1.00 26.69 H new ATOM 0 HD12 ILE A 856 15.580 -20.453 43.482 1.00 26.69 H new ATOM 0 HD13 ILE A 856 15.594 -21.774 42.609 1.00 26.69 H new ATOM 1406 N GLY A 857 14.033 -23.273 48.031 1.00 28.33 N ATOM 1407 CA GLY A 857 14.419 -24.148 49.122 1.00 29.69 C ATOM 1408 C GLY A 857 13.260 -24.913 49.732 1.00 30.67 C ATOM 1409 O GLY A 857 13.457 -25.971 50.334 1.00 30.31 O ATOM 0 H GLY A 857 14.200 -22.440 48.162 1.00 28.33 H new ATOM 0 HA2 GLY A 857 15.080 -24.781 48.800 1.00 29.69 H new ATOM 0 HA3 GLY A 857 14.847 -23.619 49.814 1.00 29.69 H new ATOM 1410 N LEU A 858 12.050 -24.384 49.576 1.00 31.79 N ATOM 1411 CA LEU A 858 10.865 -25.024 50.127 1.00 34.16 C ATOM 1412 C LEU A 858 10.694 -26.438 49.581 1.00 35.41 C ATOM 1413 O LEU A 858 10.321 -27.341 50.324 1.00 35.91 O ATOM 1414 CB LEU A 858 9.618 -24.188 49.818 1.00 32.67 C ATOM 1415 CG LEU A 858 9.598 -22.792 50.425 1.00 31.77 C ATOM 1416 CD1 LEU A 858 8.353 -22.043 49.983 1.00 31.32 C ATOM 1417 CD2 LEU A 858 9.652 -22.919 51.940 1.00 31.99 C ATOM 0 H LEU A 858 11.896 -23.652 49.152 1.00 31.79 H new ATOM 0 HA LEU A 858 10.979 -25.084 51.088 1.00 34.16 H new ATOM 0 HB2 LEU A 858 9.533 -24.106 48.855 1.00 32.67 H new ATOM 0 HB3 LEU A 858 8.838 -24.671 50.132 1.00 32.67 H new ATOM 0 HG LEU A 858 10.367 -22.286 50.120 1.00 31.77 H new ATOM 0 HD11 LEU A 858 8.352 -21.156 50.376 1.00 31.32 H new ATOM 0 HD12 LEU A 858 8.347 -21.968 49.016 1.00 31.32 H new ATOM 0 HD13 LEU A 858 7.564 -22.526 50.274 1.00 31.32 H new ATOM 0 HD21 LEU A 858 9.640 -22.035 52.340 1.00 31.99 H new ATOM 0 HD22 LEU A 858 8.884 -23.424 52.250 1.00 31.99 H new ATOM 0 HD23 LEU A 858 10.466 -23.379 52.198 1.00 31.99 H new ATOM 1418 N ARG A 859 10.989 -26.630 48.299 1.00 38.21 N ATOM 1419 CA ARG A 859 10.848 -27.933 47.659 1.00 41.77 C ATOM 1420 C ARG A 859 12.201 -28.532 47.304 1.00 44.33 C ATOM 1421 O ARG A 859 12.553 -29.604 47.802 1.00 45.46 O ATOM 1422 CB ARG A 859 9.985 -27.804 46.407 1.00 41.49 C ATOM 0 H ARG A 859 11.276 -26.010 47.777 1.00 38.21 H new ATOM 0 HA ARG A 859 10.417 -28.532 48.289 1.00 41.77 H new ATOM 1423 N GLN A 860 12.947 -27.840 46.447 1.00 45.86 N ATOM 1424 CA GLN A 860 14.272 -28.297 46.022 1.00 47.36 C ATOM 1425 C GLN A 860 15.258 -28.256 47.178 1.00 48.41 C ATOM 1426 O GLN A 860 15.967 -27.260 47.357 1.00 48.94 O ATOM 1427 CB GLN A 860 14.784 -27.435 44.864 1.00 46.58 C ATOM 0 H GLN A 860 12.702 -27.094 46.095 1.00 45.86 H new ATOM 0 HA GLN A 860 14.192 -29.216 45.722 1.00 47.36 H new ATOM 1428 N LYS A 861 15.298 -29.338 47.952 1.00 49.30 N ATOM 1429 CA LYS A 861 16.170 -29.442 49.119 1.00 49.77 C ATOM 1430 C LYS A 861 17.665 -29.550 48.796 1.00 49.73 C ATOM 1431 O LYS A 861 18.494 -28.981 49.510 1.00 49.96 O ATOM 1432 CB LYS A 861 15.744 -30.628 49.969 1.00 50.29 C ATOM 0 H LYS A 861 14.817 -30.037 47.814 1.00 49.30 H new ATOM 0 HA LYS A 861 16.065 -28.607 49.602 1.00 49.77 H new ATOM 1433 N GLY A 862 18.013 -30.274 47.735 1.00 49.40 N ATOM 1434 CA GLY A 862 19.415 -30.427 47.375 1.00 49.53 C ATOM 1435 C GLY A 862 20.088 -29.128 46.962 1.00 48.66 C ATOM 1436 O GLY A 862 19.455 -28.244 46.379 1.00 48.98 O ATOM 0 H GLY A 862 17.459 -30.679 47.217 1.00 49.40 H new ATOM 0 HA2 GLY A 862 19.894 -30.804 48.129 1.00 49.53 H new ATOM 0 HA3 GLY A 862 19.486 -31.064 46.647 1.00 49.53 H new ATOM 1437 N VAL A 863 21.377 -29.011 47.255 1.00 47.49 N ATOM 1438 CA VAL A 863 22.123 -27.814 46.906 1.00 46.77 C ATOM 1439 C VAL A 863 22.363 -27.761 45.402 1.00 45.50 C ATOM 1440 O VAL A 863 22.235 -26.706 44.786 1.00 44.96 O ATOM 1441 CB VAL A 863 23.480 -27.759 47.639 1.00 47.22 C ATOM 1442 CG1 VAL A 863 23.287 -28.105 49.105 1.00 48.23 C ATOM 1443 CG2 VAL A 863 24.477 -28.697 46.985 1.00 47.40 C ATOM 0 H VAL A 863 21.838 -29.616 47.657 1.00 47.49 H new ATOM 0 HA VAL A 863 21.592 -27.050 47.182 1.00 46.77 H new ATOM 0 HB VAL A 863 23.836 -26.859 47.578 1.00 47.22 H new ATOM 0 HG11 VAL A 863 24.142 -28.069 49.561 1.00 48.23 H new ATOM 0 HG12 VAL A 863 22.678 -27.468 49.510 1.00 48.23 H new ATOM 0 HG13 VAL A 863 22.918 -28.999 49.181 1.00 48.23 H new ATOM 0 HG21 VAL A 863 25.323 -28.650 47.457 1.00 47.40 H new ATOM 0 HG22 VAL A 863 24.138 -29.605 47.019 1.00 47.40 H new ATOM 0 HG23 VAL A 863 24.608 -28.436 46.060 1.00 47.40 H new ATOM 1444 N VAL A 864 22.698 -28.907 44.815 1.00 44.07 N ATOM 1445 CA VAL A 864 22.951 -28.987 43.380 1.00 42.71 C ATOM 1446 C VAL A 864 21.645 -28.765 42.624 1.00 41.74 C ATOM 1447 O VAL A 864 21.589 -27.975 41.680 1.00 41.78 O ATOM 1448 CB VAL A 864 23.538 -30.363 42.982 1.00 42.02 C ATOM 1449 CG1 VAL A 864 23.883 -30.368 41.505 1.00 42.96 C ATOM 1450 CG2 VAL A 864 24.774 -30.663 43.814 1.00 42.05 C ATOM 0 H VAL A 864 22.784 -29.653 45.233 1.00 44.07 H new ATOM 0 HA VAL A 864 23.598 -28.302 43.151 1.00 42.71 H new ATOM 0 HB VAL A 864 22.876 -31.052 43.151 1.00 42.02 H new ATOM 0 HG11 VAL A 864 24.250 -31.232 41.261 1.00 42.96 H new ATOM 0 HG12 VAL A 864 23.082 -30.199 40.985 1.00 42.96 H new ATOM 0 HG13 VAL A 864 24.538 -29.676 41.323 1.00 42.96 H new ATOM 0 HG21 VAL A 864 25.135 -31.526 43.558 1.00 42.05 H new ATOM 0 HG22 VAL A 864 25.442 -29.976 43.662 1.00 42.05 H new ATOM 0 HG23 VAL A 864 24.536 -30.679 44.754 1.00 42.05 H new ATOM 1451 N SER A 865 20.592 -29.453 43.055 1.00 39.91 N ATOM 1452 CA SER A 865 19.283 -29.325 42.425 1.00 38.95 C ATOM 1453 C SER A 865 18.701 -27.921 42.615 1.00 36.93 C ATOM 1454 O SER A 865 18.178 -27.328 41.670 1.00 36.94 O ATOM 1455 CB SER A 865 18.311 -30.366 42.997 1.00 40.17 C ATOM 1456 OG SER A 865 18.099 -30.170 44.388 1.00 42.77 O ATOM 0 H SER A 865 20.616 -30.003 43.716 1.00 39.91 H new ATOM 0 HA SER A 865 19.401 -29.479 41.475 1.00 38.95 H new ATOM 0 HB2 SER A 865 17.464 -30.311 42.528 1.00 40.17 H new ATOM 0 HB3 SER A 865 18.662 -31.257 42.844 1.00 40.17 H new ATOM 0 HG SER A 865 17.564 -30.751 44.675 1.00 42.77 H new ATOM 1457 N SER A 866 18.793 -27.393 43.831 1.00 34.38 N ATOM 1458 CA SER A 866 18.268 -26.059 44.116 1.00 32.62 C ATOM 1459 C SER A 866 19.055 -25.000 43.346 1.00 31.42 C ATOM 1460 O SER A 866 18.513 -23.964 42.964 1.00 30.02 O ATOM 1461 CB SER A 866 18.341 -25.759 45.615 1.00 32.80 C ATOM 1462 OG SER A 866 19.680 -25.533 46.020 1.00 37.25 O ATOM 0 H SER A 866 19.154 -27.788 44.504 1.00 34.38 H new ATOM 0 HA SER A 866 17.340 -26.035 43.834 1.00 32.62 H new ATOM 0 HB2 SER A 866 17.801 -24.979 45.819 1.00 32.80 H new ATOM 0 HB3 SER A 866 17.968 -26.501 46.116 1.00 32.80 H new ATOM 0 HG SER A 866 19.700 -25.369 46.844 1.00 37.25 H new ATOM 1463 N SER A 867 20.337 -25.263 43.119 1.00 28.99 N ATOM 1464 CA SER A 867 21.173 -24.330 42.383 1.00 29.85 C ATOM 1465 C SER A 867 20.793 -24.383 40.907 1.00 28.70 C ATOM 1466 O SER A 867 20.719 -23.354 40.231 1.00 27.39 O ATOM 1467 CB SER A 867 22.644 -24.692 42.556 1.00 30.49 C ATOM 1468 OG SER A 867 23.463 -23.712 41.957 1.00 35.61 O ATOM 0 H SER A 867 20.740 -25.976 43.383 1.00 28.99 H new ATOM 0 HA SER A 867 21.035 -23.433 42.724 1.00 29.85 H new ATOM 0 HB2 SER A 867 22.856 -24.767 43.500 1.00 30.49 H new ATOM 0 HB3 SER A 867 22.820 -25.558 42.156 1.00 30.49 H new ATOM 0 HG SER A 867 24.270 -23.921 42.059 1.00 35.61 H new ATOM 1469 N GLN A 868 20.546 -25.591 40.412 1.00 27.92 N ATOM 1470 CA GLN A 868 20.154 -25.782 39.020 1.00 28.51 C ATOM 1471 C GLN A 868 18.770 -25.182 38.781 1.00 28.44 C ATOM 1472 O GLN A 868 18.500 -24.636 37.712 1.00 28.65 O ATOM 1473 CB GLN A 868 20.141 -27.278 38.669 1.00 28.48 C ATOM 0 H GLN A 868 20.600 -26.318 40.869 1.00 27.92 H new ATOM 0 HA GLN A 868 20.799 -25.333 38.451 1.00 28.51 H new ATOM 1474 N ARG A 869 17.892 -25.283 39.775 1.00 28.64 N ATOM 1475 CA ARG A 869 16.553 -24.738 39.616 1.00 28.93 C ATOM 1476 C ARG A 869 16.587 -23.215 39.595 1.00 28.41 C ATOM 1477 O ARG A 869 15.779 -22.586 38.918 1.00 28.95 O ATOM 1478 CB ARG A 869 15.621 -25.215 40.726 1.00 29.51 C ATOM 1479 CG ARG A 869 14.168 -24.886 40.416 1.00 29.62 C ATOM 1480 CD ARG A 869 13.203 -25.439 41.433 1.00 31.04 C ATOM 1481 NE ARG A 869 11.820 -25.138 41.068 1.00 31.76 N ATOM 1482 CZ ARG A 869 11.159 -25.704 40.060 1.00 31.59 C ATOM 1483 NH1 ARG A 869 11.740 -26.620 39.294 1.00 29.41 N ATOM 1484 NH2 ARG A 869 9.910 -25.345 39.814 1.00 28.58 N ATOM 0 H ARG A 869 18.049 -25.656 40.534 1.00 28.64 H new ATOM 0 HA ARG A 869 16.211 -25.060 38.768 1.00 28.93 H new ATOM 0 HB2 ARG A 869 15.719 -26.173 40.843 1.00 29.51 H new ATOM 0 HB3 ARG A 869 15.876 -24.800 41.565 1.00 29.51 H new ATOM 0 HG2 ARG A 869 14.063 -23.923 40.370 1.00 29.62 H new ATOM 0 HG3 ARG A 869 13.943 -25.238 39.541 1.00 29.62 H new ATOM 0 HD2 ARG A 869 13.320 -26.399 41.504 1.00 31.04 H new ATOM 0 HD3 ARG A 869 13.399 -25.064 42.306 1.00 31.04 H new ATOM 0 HE ARG A 869 11.402 -24.552 41.539 1.00 31.76 H new ATOM 0 HH11 ARG A 869 12.553 -26.855 39.446 1.00 29.41 H new ATOM 0 HH12 ARG A 869 11.303 -26.979 38.646 1.00 29.41 H new ATOM 0 HH21 ARG A 869 9.529 -24.749 40.304 1.00 28.58 H new ATOM 0 HH22 ARG A 869 9.478 -25.707 39.164 1.00 28.58 H new ATOM 1485 N PHE A 870 17.524 -22.625 40.331 1.00 27.65 N ATOM 1486 CA PHE A 870 17.653 -21.175 40.361 1.00 28.10 C ATOM 1487 C PHE A 870 18.053 -20.729 38.962 1.00 28.02 C ATOM 1488 O PHE A 870 17.553 -19.732 38.439 1.00 27.72 O ATOM 1489 CB PHE A 870 18.731 -20.747 41.359 1.00 28.53 C ATOM 1490 CG PHE A 870 18.925 -19.255 41.439 1.00 30.71 C ATOM 1491 CD1 PHE A 870 18.097 -18.475 42.231 1.00 31.67 C ATOM 1492 CD2 PHE A 870 19.922 -18.633 40.705 1.00 30.68 C ATOM 1493 CE1 PHE A 870 18.257 -17.099 42.289 1.00 30.98 C ATOM 1494 CE2 PHE A 870 20.089 -17.258 40.757 1.00 32.53 C ATOM 1495 CZ PHE A 870 19.255 -16.492 41.550 1.00 31.16 C ATOM 0 H PHE A 870 18.093 -23.047 40.819 1.00 27.65 H new ATOM 0 HA PHE A 870 16.815 -20.771 40.635 1.00 28.10 H new ATOM 0 HB2 PHE A 870 18.497 -21.082 42.239 1.00 28.53 H new ATOM 0 HB3 PHE A 870 19.572 -21.162 41.112 1.00 28.53 H new ATOM 0 HD1 PHE A 870 17.425 -18.880 42.730 1.00 31.67 H new ATOM 0 HD2 PHE A 870 20.486 -19.144 40.171 1.00 30.68 H new ATOM 0 HE1 PHE A 870 17.695 -16.586 42.823 1.00 30.98 H new ATOM 0 HE2 PHE A 870 20.761 -16.851 40.259 1.00 32.53 H new ATOM 0 HZ PHE A 870 19.365 -15.569 41.586 1.00 31.16 H new ATOM 1496 N TYR A 871 18.965 -21.477 38.355 1.00 27.14 N ATOM 1497 CA TYR A 871 19.411 -21.152 37.013 1.00 28.05 C ATOM 1498 C TYR A 871 18.248 -21.204 36.032 1.00 26.18 C ATOM 1499 O TYR A 871 18.092 -20.318 35.197 1.00 27.12 O ATOM 1500 CB TYR A 871 20.488 -22.131 36.540 1.00 29.90 C ATOM 1501 CG TYR A 871 20.862 -21.895 35.098 1.00 33.13 C ATOM 1502 CD1 TYR A 871 21.702 -20.849 34.742 1.00 34.70 C ATOM 1503 CD2 TYR A 871 20.300 -22.658 34.083 1.00 35.15 C ATOM 1504 CE1 TYR A 871 21.967 -20.564 33.415 1.00 37.78 C ATOM 1505 CE2 TYR A 871 20.559 -22.378 32.751 1.00 38.27 C ATOM 1506 CZ TYR A 871 21.390 -21.328 32.423 1.00 38.89 C ATOM 1507 OH TYR A 871 21.629 -21.027 31.098 1.00 39.99 O ATOM 0 H TYR A 871 19.335 -22.172 38.702 1.00 27.14 H new ATOM 0 HA TYR A 871 19.778 -20.255 37.042 1.00 28.05 H new ATOM 0 HB2 TYR A 871 21.276 -22.040 37.098 1.00 29.90 H new ATOM 0 HB3 TYR A 871 20.168 -23.041 36.647 1.00 29.90 H new ATOM 0 HD1 TYR A 871 22.094 -20.331 35.408 1.00 34.70 H new ATOM 0 HD2 TYR A 871 19.741 -23.368 34.301 1.00 35.15 H new ATOM 0 HE1 TYR A 871 22.532 -19.860 33.193 1.00 37.78 H new ATOM 0 HE2 TYR A 871 20.174 -22.896 32.081 1.00 38.27 H new ATOM 0 HH TYR A 871 21.218 -21.571 30.608 1.00 39.99 H new ATOM 1508 N GLN A 872 17.436 -22.251 36.135 1.00 27.31 N ATOM 1509 CA GLN A 872 16.299 -22.430 35.236 1.00 26.99 C ATOM 1510 C GLN A 872 15.243 -21.344 35.355 1.00 26.46 C ATOM 1511 O GLN A 872 14.709 -20.878 34.346 1.00 25.94 O ATOM 1512 CB GLN A 872 15.627 -23.779 35.483 1.00 29.67 C ATOM 1513 CG GLN A 872 16.492 -24.987 35.218 1.00 31.95 C ATOM 1514 CD GLN A 872 15.777 -26.278 35.567 1.00 34.34 C ATOM 1515 OE1 GLN A 872 15.347 -26.474 36.706 1.00 35.31 O ATOM 1516 NE2 GLN A 872 15.642 -27.166 34.588 1.00 35.34 N ATOM 0 H GLN A 872 17.526 -22.873 36.722 1.00 27.31 H new ATOM 0 HA GLN A 872 16.672 -22.382 34.342 1.00 26.99 H new ATOM 0 HB2 GLN A 872 15.327 -23.810 36.405 1.00 29.67 H new ATOM 0 HB3 GLN A 872 14.836 -23.837 34.925 1.00 29.67 H new ATOM 0 HG2 GLN A 872 16.749 -25.002 34.283 1.00 31.95 H new ATOM 0 HG3 GLN A 872 17.309 -24.920 35.736 1.00 31.95 H new ATOM 0 HE21 GLN A 872 15.955 -26.994 33.806 1.00 35.34 H new ATOM 0 HE22 GLN A 872 15.242 -27.912 34.737 1.00 35.34 H new ATOM 1517 N LEU A 873 14.921 -20.954 36.583 1.00 24.46 N ATOM 1518 CA LEU A 873 13.906 -19.930 36.779 1.00 23.18 C ATOM 1519 C LEU A 873 14.393 -18.547 36.366 1.00 22.84 C ATOM 1520 O LEU A 873 13.646 -17.783 35.757 1.00 22.49 O ATOM 1521 CB LEU A 873 13.437 -19.920 38.233 1.00 22.22 C ATOM 1522 CG LEU A 873 12.749 -21.216 38.673 1.00 21.40 C ATOM 1523 CD1 LEU A 873 12.407 -21.152 40.145 1.00 21.09 C ATOM 1524 CD2 LEU A 873 11.506 -21.439 37.837 1.00 21.52 C ATOM 0 H LEU A 873 15.272 -21.264 37.304 1.00 24.46 H new ATOM 0 HA LEU A 873 13.157 -20.152 36.204 1.00 23.18 H new ATOM 0 HB2 LEU A 873 14.201 -19.758 38.809 1.00 22.22 H new ATOM 0 HB3 LEU A 873 12.824 -19.179 38.361 1.00 22.22 H new ATOM 0 HG LEU A 873 13.352 -21.964 38.538 1.00 21.40 H new ATOM 0 HD11 LEU A 873 11.972 -21.977 40.413 1.00 21.09 H new ATOM 0 HD12 LEU A 873 13.220 -21.033 40.661 1.00 21.09 H new ATOM 0 HD13 LEU A 873 11.810 -20.405 40.306 1.00 21.09 H new ATOM 0 HD21 LEU A 873 11.071 -22.260 38.116 1.00 21.52 H new ATOM 0 HD22 LEU A 873 10.897 -20.694 37.957 1.00 21.52 H new ATOM 0 HD23 LEU A 873 11.753 -21.507 36.901 1.00 21.52 H new ATOM 1525 N THR A 874 15.641 -18.221 36.688 1.00 24.56 N ATOM 1526 CA THR A 874 16.174 -16.920 36.314 1.00 25.42 C ATOM 1527 C THR A 874 16.401 -16.852 34.807 1.00 26.81 C ATOM 1528 O THR A 874 16.330 -15.775 34.212 1.00 28.46 O ATOM 1529 CB THR A 874 17.490 -16.592 37.065 1.00 25.44 C ATOM 1530 OG1 THR A 874 18.419 -17.671 36.926 1.00 27.17 O ATOM 1531 CG2 THR A 874 17.205 -16.356 38.546 1.00 25.75 C ATOM 0 H THR A 874 16.186 -18.730 37.116 1.00 24.56 H new ATOM 0 HA THR A 874 15.516 -16.255 36.571 1.00 25.42 H new ATOM 0 HB THR A 874 17.873 -15.788 36.680 1.00 25.44 H new ATOM 0 HG1 THR A 874 18.828 -17.597 36.196 1.00 27.17 H new ATOM 0 HG21 THR A 874 18.034 -16.152 39.007 1.00 25.75 H new ATOM 0 HG22 THR A 874 16.590 -15.612 38.643 1.00 25.75 H new ATOM 0 HG23 THR A 874 16.810 -17.154 38.931 1.00 25.75 H new ATOM 1532 N LYS A 875 16.662 -17.996 34.184 1.00 25.10 N ATOM 1533 CA LYS A 875 16.863 -18.019 32.739 1.00 24.09 C ATOM 1534 C LYS A 875 15.509 -17.796 32.076 1.00 21.96 C ATOM 1535 O LYS A 875 15.415 -17.199 31.010 1.00 20.96 O ATOM 1536 CB LYS A 875 17.436 -19.364 32.287 1.00 25.61 C ATOM 1537 CG LYS A 875 17.738 -19.428 30.800 1.00 27.79 C ATOM 1538 CD LYS A 875 18.823 -18.428 30.433 1.00 30.79 C ATOM 1539 CE LYS A 875 19.096 -18.415 28.941 1.00 32.91 C ATOM 1540 NZ LYS A 875 20.230 -17.496 28.610 1.00 33.31 N ATOM 0 H LYS A 875 16.726 -18.760 34.573 1.00 25.10 H new ATOM 0 HA LYS A 875 17.493 -17.326 32.488 1.00 24.09 H new ATOM 0 HB2 LYS A 875 18.250 -19.543 32.783 1.00 25.61 H new ATOM 0 HB3 LYS A 875 16.807 -20.067 32.512 1.00 25.61 H new ATOM 0 HG2 LYS A 875 18.022 -20.324 30.560 1.00 27.79 H new ATOM 0 HG3 LYS A 875 16.933 -19.241 30.293 1.00 27.79 H new ATOM 0 HD2 LYS A 875 18.556 -17.541 30.721 1.00 30.79 H new ATOM 0 HD3 LYS A 875 19.639 -18.647 30.909 1.00 30.79 H new ATOM 0 HE2 LYS A 875 19.305 -19.313 28.639 1.00 32.91 H new ATOM 0 HE3 LYS A 875 18.299 -18.134 28.466 1.00 32.91 H new ATOM 0 HZ1 LYS A 875 20.226 -17.322 27.737 1.00 33.31 H new ATOM 0 HZ2 LYS A 875 20.139 -16.736 29.064 1.00 33.31 H new ATOM 0 HZ3 LYS A 875 21.000 -17.883 28.832 1.00 33.31 H new ATOM 1541 N LEU A 876 14.458 -18.289 32.714 1.00 21.65 N ATOM 1542 CA LEU A 876 13.117 -18.117 32.177 1.00 23.52 C ATOM 1543 C LEU A 876 12.824 -16.619 32.166 1.00 22.76 C ATOM 1544 O LEU A 876 12.230 -16.099 31.223 1.00 21.69 O ATOM 1545 CB LEU A 876 12.100 -18.868 33.046 1.00 22.83 C ATOM 1546 CG LEU A 876 10.632 -18.891 32.597 1.00 24.65 C ATOM 1547 CD1 LEU A 876 9.910 -20.041 33.299 1.00 26.02 C ATOM 1548 CD2 LEU A 876 9.959 -17.560 32.911 1.00 25.39 C ATOM 0 H LEU A 876 14.498 -18.724 33.455 1.00 21.65 H new ATOM 0 HA LEU A 876 13.052 -18.478 31.279 1.00 23.52 H new ATOM 0 HB2 LEU A 876 12.400 -19.787 33.124 1.00 22.83 H new ATOM 0 HB3 LEU A 876 12.131 -18.483 33.936 1.00 22.83 H new ATOM 0 HG LEU A 876 10.590 -19.027 31.638 1.00 24.65 H new ATOM 0 HD11 LEU A 876 8.982 -20.060 33.018 1.00 26.02 H new ATOM 0 HD12 LEU A 876 10.335 -20.881 33.065 1.00 26.02 H new ATOM 0 HD13 LEU A 876 9.955 -19.913 34.259 1.00 26.02 H new ATOM 0 HD21 LEU A 876 9.033 -17.589 32.622 1.00 25.39 H new ATOM 0 HD22 LEU A 876 9.994 -17.397 33.867 1.00 25.39 H new ATOM 0 HD23 LEU A 876 10.421 -16.846 32.444 1.00 25.39 H new ATOM 1549 N LEU A 877 13.263 -15.929 33.214 1.00 23.52 N ATOM 1550 CA LEU A 877 13.058 -14.485 33.321 1.00 24.06 C ATOM 1551 C LEU A 877 13.857 -13.749 32.240 1.00 22.69 C ATOM 1552 O LEU A 877 13.346 -12.817 31.615 1.00 22.14 O ATOM 1553 CB LEU A 877 13.463 -13.991 34.713 1.00 22.61 C ATOM 1554 CG LEU A 877 12.577 -14.425 35.887 1.00 24.87 C ATOM 1555 CD1 LEU A 877 13.136 -13.880 37.192 1.00 26.05 C ATOM 1556 CD2 LEU A 877 11.166 -13.914 35.679 1.00 21.49 C ATOM 0 H LEU A 877 13.684 -16.279 33.877 1.00 23.52 H new ATOM 0 HA LEU A 877 12.116 -14.297 33.188 1.00 24.06 H new ATOM 0 HB2 LEU A 877 14.368 -14.293 34.889 1.00 22.61 H new ATOM 0 HB3 LEU A 877 13.486 -13.021 34.694 1.00 22.61 H new ATOM 0 HG LEU A 877 12.563 -15.394 35.931 1.00 24.87 H new ATOM 0 HD11 LEU A 877 12.570 -14.159 37.928 1.00 26.05 H new ATOM 0 HD12 LEU A 877 14.034 -14.222 37.327 1.00 26.05 H new ATOM 0 HD13 LEU A 877 13.162 -12.911 37.154 1.00 26.05 H new ATOM 0 HD21 LEU A 877 10.609 -14.190 36.423 1.00 21.49 H new ATOM 0 HD22 LEU A 877 11.177 -12.946 35.626 1.00 21.49 H new ATOM 0 HD23 LEU A 877 10.808 -14.279 34.855 1.00 21.49 H new ATOM 1557 N ASP A 878 15.105 -14.163 32.023 1.00 22.61 N ATOM 1558 CA ASP A 878 15.941 -13.552 30.984 1.00 22.98 C ATOM 1559 C ASP A 878 15.237 -13.658 29.628 1.00 23.15 C ATOM 1560 O ASP A 878 15.131 -12.677 28.890 1.00 23.07 O ATOM 1561 CB ASP A 878 17.293 -14.266 30.877 1.00 25.04 C ATOM 1562 CG ASP A 878 18.286 -13.829 31.943 1.00 27.33 C ATOM 1563 OD1 ASP A 878 17.899 -13.118 32.891 1.00 27.86 O ATOM 1564 OD2 ASP A 878 19.470 -14.211 31.830 1.00 30.00 O ATOM 0 H ASP A 878 15.487 -14.794 32.464 1.00 22.61 H new ATOM 0 HA ASP A 878 16.085 -12.623 31.225 1.00 22.98 H new ATOM 0 HB2 ASP A 878 17.153 -15.223 30.946 1.00 25.04 H new ATOM 0 HB3 ASP A 878 17.673 -14.098 30.001 1.00 25.04 H new ATOM 1565 N ASN A 879 14.752 -14.855 29.309 1.00 22.62 N ATOM 1566 CA ASN A 879 14.076 -15.093 28.036 1.00 24.36 C ATOM 1567 C ASN A 879 12.788 -14.292 27.841 1.00 24.76 C ATOM 1568 O ASN A 879 12.323 -14.128 26.712 1.00 23.64 O ATOM 1569 CB ASN A 879 13.783 -16.589 27.861 1.00 24.93 C ATOM 1570 CG ASN A 879 15.048 -17.424 27.791 1.00 29.38 C ATOM 1571 OD1 ASN A 879 16.139 -16.900 27.555 1.00 30.16 O ATOM 1572 ND2 ASN A 879 14.908 -18.730 27.983 1.00 28.80 N ATOM 0 H ASN A 879 14.804 -15.546 29.818 1.00 22.62 H new ATOM 0 HA ASN A 879 14.693 -14.781 27.355 1.00 24.36 H new ATOM 0 HB2 ASN A 879 13.236 -16.897 28.600 1.00 24.93 H new ATOM 0 HB3 ASN A 879 13.266 -16.722 27.051 1.00 24.93 H new ATOM 0 HD21 ASN A 879 15.595 -19.246 27.945 1.00 28.80 H new ATOM 0 HD22 ASN A 879 14.131 -19.060 28.146 1.00 28.80 H new ATOM 1573 N LEU A 880 12.205 -13.788 28.924 1.00 23.87 N ATOM 1574 CA LEU A 880 10.981 -13.009 28.786 1.00 25.35 C ATOM 1575 C LEU A 880 11.201 -11.717 28.009 1.00 24.59 C ATOM 1576 O LEU A 880 10.300 -11.249 27.323 1.00 25.58 O ATOM 1577 CB LEU A 880 10.378 -12.692 30.155 1.00 26.82 C ATOM 1578 CG LEU A 880 9.655 -13.886 30.785 1.00 30.67 C ATOM 1579 CD1 LEU A 880 8.920 -13.444 32.036 1.00 31.27 C ATOM 1580 CD2 LEU A 880 8.674 -14.469 29.783 1.00 31.31 C ATOM 0 H LEU A 880 12.493 -13.882 29.729 1.00 23.87 H new ATOM 0 HA LEU A 880 10.360 -13.557 28.281 1.00 25.35 H new ATOM 0 HB2 LEU A 880 11.083 -12.396 30.752 1.00 26.82 H new ATOM 0 HB3 LEU A 880 9.755 -11.954 30.065 1.00 26.82 H new ATOM 0 HG LEU A 880 10.305 -14.564 31.028 1.00 30.67 H new ATOM 0 HD11 LEU A 880 8.465 -14.205 32.430 1.00 31.27 H new ATOM 0 HD12 LEU A 880 9.555 -13.082 32.674 1.00 31.27 H new ATOM 0 HD13 LEU A 880 8.270 -12.762 31.806 1.00 31.27 H new ATOM 0 HD21 LEU A 880 8.216 -15.225 30.181 1.00 31.31 H new ATOM 0 HD22 LEU A 880 8.025 -13.793 29.534 1.00 31.31 H new ATOM 0 HD23 LEU A 880 9.154 -14.762 28.993 1.00 31.31 H new ATOM 1581 N HIS A 881 12.397 -11.143 28.102 1.00 25.30 N ATOM 1582 CA HIS A 881 12.684 -9.905 27.379 1.00 25.12 C ATOM 1583 C HIS A 881 12.421 -10.107 25.887 1.00 26.24 C ATOM 1584 O HIS A 881 11.735 -9.304 25.249 1.00 25.37 O ATOM 1585 CB HIS A 881 14.145 -9.480 27.581 1.00 24.22 C ATOM 1586 CG HIS A 881 14.439 -8.913 28.938 1.00 24.34 C ATOM 1587 ND1 HIS A 881 13.790 -7.805 29.439 1.00 22.51 N ATOM 1588 CD2 HIS A 881 15.336 -9.285 29.883 1.00 22.21 C ATOM 1589 CE1 HIS A 881 14.275 -7.518 30.636 1.00 22.61 C ATOM 1590 NE2 HIS A 881 15.213 -8.401 30.928 1.00 23.00 N ATOM 0 H HIS A 881 13.049 -11.449 28.572 1.00 25.30 H new ATOM 0 HA HIS A 881 12.105 -9.208 27.726 1.00 25.12 H new ATOM 0 HB2 HIS A 881 14.718 -10.248 27.432 1.00 24.22 H new ATOM 0 HB3 HIS A 881 14.375 -8.819 26.909 1.00 24.22 H new ATOM 0 HD2 HIS A 881 15.924 -10.004 29.834 1.00 22.21 H new ATOM 0 HE1 HIS A 881 14.002 -6.814 31.179 1.00 22.61 H new ATOM 0 HE2 HIS A 881 15.673 -8.420 31.655 1.00 23.00 H new ATOM 1591 N ASP A 882 12.973 -11.185 25.338 1.00 26.38 N ATOM 1592 CA ASP A 882 12.807 -11.495 23.925 1.00 28.14 C ATOM 1593 C ASP A 882 11.344 -11.724 23.595 1.00 26.12 C ATOM 1594 O ASP A 882 10.837 -11.210 22.595 1.00 26.39 O ATOM 1595 CB ASP A 882 13.606 -12.744 23.554 1.00 31.97 C ATOM 1596 CG ASP A 882 15.089 -12.480 23.480 1.00 37.19 C ATOM 1597 OD1 ASP A 882 15.486 -11.568 22.718 1.00 38.84 O ATOM 1598 OD2 ASP A 882 15.856 -13.178 24.181 1.00 41.02 O ATOM 0 H ASP A 882 13.451 -11.753 25.772 1.00 26.38 H new ATOM 0 HA ASP A 882 13.135 -10.739 23.414 1.00 28.14 H new ATOM 0 HB2 ASP A 882 13.437 -13.439 24.209 1.00 31.97 H new ATOM 0 HB3 ASP A 882 13.297 -13.080 22.698 1.00 31.97 H new ATOM 1599 N LEU A 883 10.670 -12.495 24.447 1.00 23.89 N ATOM 1600 CA LEU A 883 9.259 -12.813 24.249 1.00 21.76 C ATOM 1601 C LEU A 883 8.371 -11.573 24.235 1.00 21.52 C ATOM 1602 O LEU A 883 7.569 -11.382 23.312 1.00 20.08 O ATOM 1603 CB LEU A 883 8.790 -13.775 25.347 1.00 22.08 C ATOM 1604 CG LEU A 883 7.417 -14.411 25.175 1.00 24.28 C ATOM 1605 CD1 LEU A 883 7.330 -15.648 26.046 1.00 26.19 C ATOM 1606 CD2 LEU A 883 6.333 -13.412 25.526 1.00 23.50 C ATOM 0 H LEU A 883 11.016 -12.846 25.152 1.00 23.89 H new ATOM 0 HA LEU A 883 9.178 -13.230 23.377 1.00 21.76 H new ATOM 0 HB2 LEU A 883 9.444 -14.487 25.422 1.00 22.08 H new ATOM 0 HB3 LEU A 883 8.796 -13.295 26.190 1.00 22.08 H new ATOM 0 HG LEU A 883 7.287 -14.673 24.250 1.00 24.28 H new ATOM 0 HD11 LEU A 883 6.457 -16.058 25.940 1.00 26.19 H new ATOM 0 HD12 LEU A 883 8.017 -16.279 25.781 1.00 26.19 H new ATOM 0 HD13 LEU A 883 7.460 -15.400 26.975 1.00 26.19 H new ATOM 0 HD21 LEU A 883 5.463 -13.826 25.414 1.00 23.50 H new ATOM 0 HD22 LEU A 883 6.439 -13.129 26.448 1.00 23.50 H new ATOM 0 HD23 LEU A 883 6.402 -12.641 24.942 1.00 23.50 H new ATOM 1607 N VAL A 884 8.504 -10.744 25.265 1.00 20.07 N ATOM 1608 CA VAL A 884 7.698 -9.542 25.394 1.00 21.05 C ATOM 1609 C VAL A 884 7.897 -8.543 24.259 1.00 21.78 C ATOM 1610 O VAL A 884 6.982 -7.786 23.948 1.00 22.58 O ATOM 1611 CB VAL A 884 7.966 -8.865 26.738 1.00 21.56 C ATOM 1612 CG1 VAL A 884 7.119 -7.618 26.874 1.00 23.99 C ATOM 1613 CG2 VAL A 884 7.640 -9.834 27.854 1.00 22.19 C ATOM 0 H VAL A 884 9.064 -10.864 25.907 1.00 20.07 H new ATOM 0 HA VAL A 884 6.774 -9.833 25.344 1.00 21.05 H new ATOM 0 HB VAL A 884 8.900 -8.610 26.789 1.00 21.56 H new ATOM 0 HG11 VAL A 884 7.297 -7.197 27.730 1.00 23.99 H new ATOM 0 HG12 VAL A 884 7.336 -7.000 26.159 1.00 23.99 H new ATOM 0 HG13 VAL A 884 6.180 -7.857 26.821 1.00 23.99 H new ATOM 0 HG21 VAL A 884 7.808 -9.410 28.710 1.00 22.19 H new ATOM 0 HG22 VAL A 884 6.706 -10.090 27.798 1.00 22.19 H new ATOM 0 HG23 VAL A 884 8.197 -10.624 27.770 1.00 22.19 H new ATOM 1614 N LYS A 885 9.071 -8.546 23.633 1.00 22.48 N ATOM 1615 CA LYS A 885 9.335 -7.624 22.537 1.00 23.90 C ATOM 1616 C LYS A 885 8.318 -7.811 21.423 1.00 23.97 C ATOM 1617 O LYS A 885 7.912 -6.842 20.775 1.00 19.10 O ATOM 1618 CB LYS A 885 10.736 -7.834 21.982 1.00 26.81 C ATOM 1619 CG LYS A 885 11.005 -6.979 20.755 1.00 31.48 C ATOM 1620 CD LYS A 885 12.428 -7.151 20.265 1.00 37.26 C ATOM 1621 CE LYS A 885 12.686 -6.308 19.026 1.00 37.33 C ATOM 1622 NZ LYS A 885 14.105 -6.436 18.572 1.00 43.32 N ATOM 0 H LYS A 885 9.723 -9.071 23.827 1.00 22.48 H new ATOM 0 HA LYS A 885 9.264 -6.722 22.885 1.00 23.90 H new ATOM 0 HB2 LYS A 885 11.388 -7.625 22.669 1.00 26.81 H new ATOM 0 HB3 LYS A 885 10.854 -8.769 21.754 1.00 26.81 H new ATOM 0 HG2 LYS A 885 10.386 -7.220 20.048 1.00 31.48 H new ATOM 0 HG3 LYS A 885 10.844 -6.046 20.967 1.00 31.48 H new ATOM 0 HD2 LYS A 885 13.048 -6.898 20.967 1.00 37.26 H new ATOM 0 HD3 LYS A 885 12.593 -8.085 20.064 1.00 37.26 H new ATOM 0 HE2 LYS A 885 12.089 -6.585 18.313 1.00 37.33 H new ATOM 0 HE3 LYS A 885 12.487 -5.378 19.217 1.00 37.33 H new ATOM 0 HZ1 LYS A 885 14.259 -5.860 17.911 1.00 43.32 H new ATOM 0 HZ2 LYS A 885 14.652 -6.260 19.252 1.00 43.32 H new ATOM 0 HZ3 LYS A 885 14.251 -7.265 18.282 1.00 43.32 H new ATOM 1623 N GLN A 886 7.905 -9.059 21.218 1.00 23.65 N ATOM 1624 CA GLN A 886 6.930 -9.394 20.193 1.00 23.26 C ATOM 1625 C GLN A 886 5.566 -8.849 20.582 1.00 23.47 C ATOM 1626 O GLN A 886 4.811 -8.405 19.717 1.00 21.07 O ATOM 1627 CB GLN A 886 6.854 -10.909 20.005 1.00 27.97 C ATOM 1628 CG GLN A 886 8.133 -11.521 19.461 1.00 33.13 C ATOM 1629 CD GLN A 886 8.009 -13.017 19.276 1.00 37.34 C ATOM 1630 OE1 GLN A 886 7.010 -13.502 18.743 1.00 38.82 O ATOM 1631 NE2 GLN A 886 9.024 -13.761 19.706 1.00 38.85 N ATOM 0 H GLN A 886 8.184 -9.734 21.672 1.00 23.65 H new ATOM 0 HA GLN A 886 7.207 -8.992 19.355 1.00 23.26 H new ATOM 0 HB2 GLN A 886 6.644 -11.323 20.857 1.00 27.97 H new ATOM 0 HB3 GLN A 886 6.124 -11.116 19.401 1.00 27.97 H new ATOM 0 HG2 GLN A 886 8.353 -11.108 18.611 1.00 33.13 H new ATOM 0 HG3 GLN A 886 8.866 -11.330 20.067 1.00 33.13 H new ATOM 0 HE21 GLN A 886 9.706 -13.387 20.074 1.00 38.85 H new ATOM 0 HE22 GLN A 886 8.999 -14.616 19.616 1.00 38.85 H new ATOM 1632 N LEU A 887 5.252 -8.873 21.877 1.00 21.30 N ATOM 1633 CA LEU A 887 3.965 -8.374 22.349 1.00 21.31 C ATOM 1634 C LEU A 887 3.940 -6.852 22.224 1.00 20.12 C ATOM 1635 O LEU A 887 2.931 -6.264 21.831 1.00 21.22 O ATOM 1636 CB LEU A 887 3.728 -8.794 23.807 1.00 22.36 C ATOM 1637 CG LEU A 887 3.544 -10.289 24.007 1.00 25.07 C ATOM 1638 CD1 LEU A 887 3.162 -10.591 25.443 1.00 24.63 C ATOM 1639 CD2 LEU A 887 2.463 -10.750 23.074 1.00 28.99 C ATOM 0 H LEU A 887 5.769 -9.173 22.495 1.00 21.30 H new ATOM 0 HA LEU A 887 3.256 -8.754 21.807 1.00 21.31 H new ATOM 0 HB2 LEU A 887 4.479 -8.497 24.344 1.00 22.36 H new ATOM 0 HB3 LEU A 887 2.941 -8.335 24.141 1.00 22.36 H new ATOM 0 HG LEU A 887 4.374 -10.754 23.818 1.00 25.07 H new ATOM 0 HD11 LEU A 887 3.049 -11.548 25.553 1.00 24.63 H new ATOM 0 HD12 LEU A 887 3.862 -10.278 26.037 1.00 24.63 H new ATOM 0 HD13 LEU A 887 2.331 -10.140 25.658 1.00 24.63 H new ATOM 0 HD21 LEU A 887 2.326 -11.704 23.183 1.00 28.99 H new ATOM 0 HD22 LEU A 887 1.639 -10.281 23.276 1.00 28.99 H new ATOM 0 HD23 LEU A 887 2.724 -10.564 22.159 1.00 28.99 H new ATOM 1640 N HIS A 888 5.066 -6.222 22.534 1.00 17.48 N ATOM 1641 CA HIS A 888 5.188 -4.770 22.452 1.00 18.99 C ATOM 1642 C HIS A 888 4.940 -4.291 21.034 1.00 18.76 C ATOM 1643 O HIS A 888 4.178 -3.342 20.804 1.00 20.27 O ATOM 1644 CB HIS A 888 6.573 -4.342 22.928 1.00 18.19 C ATOM 1645 CG HIS A 888 6.666 -4.202 24.414 1.00 18.09 C ATOM 1646 ND1 HIS A 888 7.859 -4.226 25.087 1.00 18.38 N ATOM 1647 CD2 HIS A 888 5.699 -4.031 25.345 1.00 19.43 C ATOM 1648 CE1 HIS A 888 7.630 -4.071 26.386 1.00 16.77 C ATOM 1649 NE2 HIS A 888 6.335 -3.952 26.564 1.00 19.87 N ATOM 0 H HIS A 888 5.780 -6.622 22.797 1.00 17.48 H new ATOM 0 HA HIS A 888 4.519 -4.366 23.026 1.00 18.99 H new ATOM 0 HB2 HIS A 888 7.227 -4.992 22.628 1.00 18.19 H new ATOM 0 HB3 HIS A 888 6.804 -3.496 22.514 1.00 18.19 H new ATOM 0 HD1 HIS A 888 8.633 -4.326 24.726 1.00 18.38 H new ATOM 0 HD2 HIS A 888 4.783 -3.977 25.192 1.00 19.43 H new ATOM 0 HE1 HIS A 888 8.276 -4.050 27.055 1.00 16.77 H new ATOM 1650 N LEU A 889 5.591 -4.944 20.081 1.00 17.85 N ATOM 1651 CA LEU A 889 5.441 -4.568 18.685 1.00 17.51 C ATOM 1652 C LEU A 889 4.007 -4.775 18.213 1.00 18.27 C ATOM 1653 O LEU A 889 3.436 -3.887 17.587 1.00 18.16 O ATOM 1654 CB LEU A 889 6.395 -5.374 17.815 1.00 19.06 C ATOM 1655 CG LEU A 889 6.312 -5.082 16.327 1.00 20.11 C ATOM 1656 CD1 LEU A 889 6.416 -3.576 16.106 1.00 21.37 C ATOM 1657 CD2 LEU A 889 7.414 -5.837 15.612 1.00 21.33 C ATOM 0 H LEU A 889 6.122 -5.605 20.221 1.00 17.85 H new ATOM 0 HA LEU A 889 5.656 -3.626 18.604 1.00 17.51 H new ATOM 0 HB2 LEU A 889 7.303 -5.206 18.113 1.00 19.06 H new ATOM 0 HB3 LEU A 889 6.220 -6.318 17.956 1.00 19.06 H new ATOM 0 HG LEU A 889 5.463 -5.378 15.964 1.00 20.11 H new ATOM 0 HD11 LEU A 889 6.364 -3.384 15.157 1.00 21.37 H new ATOM 0 HD12 LEU A 889 5.688 -3.130 16.567 1.00 21.37 H new ATOM 0 HD13 LEU A 889 7.263 -3.255 16.454 1.00 21.37 H new ATOM 0 HD21 LEU A 889 7.367 -5.655 14.660 1.00 21.33 H new ATOM 0 HD22 LEU A 889 8.276 -5.551 15.953 1.00 21.33 H new ATOM 0 HD23 LEU A 889 7.306 -6.789 15.764 1.00 21.33 H new ATOM 1658 N TYR A 890 3.421 -5.935 18.506 1.00 18.89 N ATOM 1659 CA TYR A 890 2.048 -6.203 18.082 1.00 19.51 C ATOM 1660 C TYR A 890 1.127 -5.138 18.664 1.00 19.38 C ATOM 1661 O TYR A 890 0.219 -4.645 17.992 1.00 19.97 O ATOM 1662 CB TYR A 890 1.589 -7.585 18.553 1.00 21.85 C ATOM 1663 CG TYR A 890 0.220 -7.954 18.042 1.00 23.63 C ATOM 1664 CD1 TYR A 890 0.063 -8.583 16.813 1.00 27.49 C ATOM 1665 CD2 TYR A 890 -0.917 -7.654 18.773 1.00 24.74 C ATOM 1666 CE1 TYR A 890 -1.190 -8.905 16.330 1.00 28.21 C ATOM 1667 CE2 TYR A 890 -2.175 -7.967 18.298 1.00 27.38 C ATOM 1668 CZ TYR A 890 -2.305 -8.593 17.074 1.00 28.76 C ATOM 1669 OH TYR A 890 -3.557 -8.905 16.593 1.00 29.31 O ATOM 0 H TYR A 890 3.796 -6.573 18.944 1.00 18.89 H new ATOM 0 HA TYR A 890 2.014 -6.183 17.113 1.00 19.51 H new ATOM 0 HB2 TYR A 890 2.230 -8.251 18.258 1.00 21.85 H new ATOM 0 HB3 TYR A 890 1.584 -7.606 19.523 1.00 21.85 H new ATOM 0 HD1 TYR A 890 0.815 -8.791 16.307 1.00 27.49 H new ATOM 0 HD2 TYR A 890 -0.832 -7.234 19.599 1.00 24.74 H new ATOM 0 HE1 TYR A 890 -1.280 -9.330 15.508 1.00 28.21 H new ATOM 0 HE2 TYR A 890 -2.930 -7.758 18.799 1.00 27.38 H new ATOM 0 HH TYR A 890 -3.509 -9.589 16.108 1.00 29.31 H new ATOM 1670 N CYS A 891 1.371 -4.784 19.921 1.00 18.27 N ATOM 1671 CA CYS A 891 0.565 -3.771 20.592 1.00 17.99 C ATOM 1672 C CYS A 891 0.678 -2.416 19.906 1.00 18.31 C ATOM 1673 O CYS A 891 -0.331 -1.824 19.532 1.00 17.58 O ATOM 1674 CB CYS A 891 0.991 -3.644 22.063 1.00 17.65 C ATOM 1675 SG CYS A 891 0.262 -2.259 22.968 1.00 18.93 S ATOM 0 H CYS A 891 1.999 -5.119 20.403 1.00 18.27 H new ATOM 0 HA CYS A 891 -0.361 -4.055 20.544 1.00 17.99 H new ATOM 0 HB2 CYS A 891 0.761 -4.467 22.522 1.00 17.65 H new ATOM 0 HB3 CYS A 891 1.957 -3.560 22.098 1.00 17.65 H new ATOM 0 HG CYS A 891 -0.903 -2.475 23.160 1.00 18.93 H new ATOM 1676 N LEU A 892 1.903 -1.920 19.745 1.00 16.97 N ATOM 1677 CA LEU A 892 2.096 -0.620 19.114 1.00 19.62 C ATOM 1678 C LEU A 892 1.492 -0.563 17.711 1.00 20.87 C ATOM 1679 O LEU A 892 0.868 0.436 17.343 1.00 22.37 O ATOM 1680 CB LEU A 892 3.587 -0.257 19.070 1.00 18.87 C ATOM 1681 CG LEU A 892 3.935 1.180 18.668 1.00 20.15 C ATOM 1682 CD1 LEU A 892 3.155 2.181 19.542 1.00 17.95 C ATOM 1683 CD2 LEU A 892 5.437 1.396 18.821 1.00 21.25 C ATOM 0 H LEU A 892 2.626 -2.315 19.991 1.00 16.97 H new ATOM 0 HA LEU A 892 1.627 0.033 19.657 1.00 19.62 H new ATOM 0 HB2 LEU A 892 3.966 -0.426 19.947 1.00 18.87 H new ATOM 0 HB3 LEU A 892 4.027 -0.860 18.450 1.00 18.87 H new ATOM 0 HG LEU A 892 3.685 1.326 17.742 1.00 20.15 H new ATOM 0 HD11 LEU A 892 3.383 3.086 19.279 1.00 17.95 H new ATOM 0 HD12 LEU A 892 2.203 2.040 19.424 1.00 17.95 H new ATOM 0 HD13 LEU A 892 3.388 2.047 20.474 1.00 17.95 H new ATOM 0 HD21 LEU A 892 5.661 2.305 18.567 1.00 21.25 H new ATOM 0 HD22 LEU A 892 5.693 1.246 19.744 1.00 21.25 H new ATOM 0 HD23 LEU A 892 5.913 0.774 18.249 1.00 21.25 H new ATOM 1684 N ASN A 893 1.665 -1.625 16.927 1.00 22.46 N ATOM 1685 CA ASN A 893 1.104 -1.648 15.578 1.00 23.56 C ATOM 1686 C ASN A 893 -0.408 -1.514 15.634 1.00 24.07 C ATOM 1687 O ASN A 893 -0.990 -0.709 14.906 1.00 25.82 O ATOM 1688 CB ASN A 893 1.470 -2.942 14.838 1.00 23.96 C ATOM 1689 CG ASN A 893 2.889 -2.928 14.314 1.00 23.94 C ATOM 1690 OD1 ASN A 893 3.410 -1.876 13.954 1.00 24.68 O ATOM 1691 ND2 ASN A 893 3.514 -4.102 14.244 1.00 22.55 N ATOM 0 H ASN A 893 2.098 -2.333 17.153 1.00 22.46 H new ATOM 0 HA ASN A 893 1.483 -0.898 15.093 1.00 23.56 H new ATOM 0 HB2 ASN A 893 1.357 -3.697 15.437 1.00 23.96 H new ATOM 0 HB3 ASN A 893 0.856 -3.073 14.098 1.00 23.96 H new ATOM 0 HD21 ASN A 893 4.316 -4.144 13.937 1.00 22.55 H new ATOM 0 HD22 ASN A 893 3.115 -4.818 14.506 1.00 22.55 H new ATOM 1692 N THR A 894 -1.048 -2.292 16.504 1.00 22.91 N ATOM 1693 CA THR A 894 -2.500 -2.223 16.630 1.00 22.70 C ATOM 1694 C THR A 894 -2.921 -0.861 17.173 1.00 23.13 C ATOM 1695 O THR A 894 -3.991 -0.346 16.831 1.00 22.46 O ATOM 1696 CB THR A 894 -3.043 -3.320 17.572 1.00 23.08 C ATOM 1697 OG1 THR A 894 -2.537 -4.597 17.162 1.00 22.84 O ATOM 1698 CG2 THR A 894 -4.565 -3.356 17.523 1.00 20.80 C ATOM 0 H THR A 894 -0.665 -2.860 17.024 1.00 22.91 H new ATOM 0 HA THR A 894 -2.870 -2.359 15.744 1.00 22.70 H new ATOM 0 HB THR A 894 -2.756 -3.121 18.477 1.00 23.08 H new ATOM 0 HG1 THR A 894 -1.729 -4.662 17.381 1.00 22.84 H new ATOM 0 HG21 THR A 894 -4.892 -4.048 18.118 1.00 20.80 H new ATOM 0 HG22 THR A 894 -4.918 -2.497 17.802 1.00 20.80 H new ATOM 0 HG23 THR A 894 -4.855 -3.546 16.617 1.00 20.80 H new ATOM 1699 N PHE A 895 -2.080 -0.281 18.024 1.00 21.45 N ATOM 1700 CA PHE A 895 -2.373 1.023 18.615 1.00 23.26 C ATOM 1701 C PHE A 895 -2.441 2.081 17.513 1.00 24.42 C ATOM 1702 O PHE A 895 -3.384 2.866 17.441 1.00 24.64 O ATOM 1703 CB PHE A 895 -1.286 1.394 19.628 1.00 22.73 C ATOM 1704 CG PHE A 895 -1.563 2.659 20.375 1.00 25.06 C ATOM 1705 CD1 PHE A 895 -2.658 2.753 21.220 1.00 24.79 C ATOM 1706 CD2 PHE A 895 -0.732 3.761 20.233 1.00 24.42 C ATOM 1707 CE1 PHE A 895 -2.922 3.922 21.912 1.00 25.03 C ATOM 1708 CE2 PHE A 895 -0.991 4.934 20.924 1.00 25.30 C ATOM 1709 CZ PHE A 895 -2.087 5.015 21.763 1.00 24.53 C ATOM 0 H PHE A 895 -1.333 -0.626 18.273 1.00 21.45 H new ATOM 0 HA PHE A 895 -3.227 0.982 19.072 1.00 23.26 H new ATOM 0 HB2 PHE A 895 -1.187 0.668 20.264 1.00 22.73 H new ATOM 0 HB3 PHE A 895 -0.439 1.482 19.163 1.00 22.73 H new ATOM 0 HD1 PHE A 895 -3.222 2.021 21.323 1.00 24.79 H new ATOM 0 HD2 PHE A 895 0.006 3.712 19.669 1.00 24.42 H new ATOM 0 HE1 PHE A 895 -3.660 3.973 22.476 1.00 25.03 H new ATOM 0 HE2 PHE A 895 -0.427 5.667 20.823 1.00 25.30 H new ATOM 0 HZ PHE A 895 -2.262 5.802 22.226 1.00 24.53 H new ATOM 1710 N ILE A 896 -1.435 2.080 16.647 1.00 27.51 N ATOM 1711 CA ILE A 896 -1.358 3.022 15.536 1.00 31.46 C ATOM 1712 C ILE A 896 -2.502 2.883 14.522 1.00 33.29 C ATOM 1713 O ILE A 896 -2.909 3.863 13.903 1.00 35.33 O ATOM 1714 CB ILE A 896 -0.017 2.863 14.799 1.00 32.20 C ATOM 1715 CG1 ILE A 896 1.111 3.410 15.668 1.00 33.42 C ATOM 1716 CG2 ILE A 896 -0.063 3.574 13.460 1.00 36.58 C ATOM 1717 CD1 ILE A 896 2.477 3.239 15.057 1.00 35.49 C ATOM 0 H ILE A 896 -0.774 1.531 16.687 1.00 27.51 H new ATOM 0 HA ILE A 896 -1.435 3.904 15.933 1.00 31.46 H new ATOM 0 HB ILE A 896 0.147 1.922 14.631 1.00 32.20 H new ATOM 0 HG12 ILE A 896 0.954 4.353 15.833 1.00 33.42 H new ATOM 0 HG13 ILE A 896 1.092 2.964 16.529 1.00 33.42 H new ATOM 0 HG21 ILE A 896 0.788 3.466 13.007 1.00 36.58 H new ATOM 0 HG22 ILE A 896 -0.770 3.194 12.915 1.00 36.58 H new ATOM 0 HG23 ILE A 896 -0.236 4.518 13.600 1.00 36.58 H new ATOM 0 HD11 ILE A 896 3.147 3.605 15.655 1.00 35.49 H new ATOM 0 HD12 ILE A 896 2.652 2.296 14.914 1.00 35.49 H new ATOM 0 HD13 ILE A 896 2.513 3.706 14.208 1.00 35.49 H new ATOM 1718 N GLN A 897 -3.021 1.670 14.355 1.00 34.70 N ATOM 1719 CA GLN A 897 -4.105 1.428 13.401 1.00 35.61 C ATOM 1720 C GLN A 897 -5.442 1.215 14.110 1.00 35.98 C ATOM 1721 O GLN A 897 -6.387 0.693 13.514 1.00 36.48 O ATOM 1722 CB GLN A 897 -3.781 0.186 12.563 1.00 35.26 C ATOM 1723 CG GLN A 897 -2.321 0.096 12.141 1.00 35.59 C ATOM 1724 CD GLN A 897 -1.923 -1.295 11.668 1.00 36.96 C ATOM 1725 OE1 GLN A 897 -2.910 -2.104 11.284 1.00 36.76 O flip ATOM 1726 NE2 GLN A 897 -0.739 -1.636 11.644 1.00 34.43 N flip ATOM 0 H GLN A 897 -2.761 0.972 14.784 1.00 34.70 H new ATOM 0 HA GLN A 897 -4.182 2.211 12.833 1.00 35.61 H new ATOM 0 HB2 GLN A 897 -4.012 -0.607 13.072 1.00 35.26 H new ATOM 0 HB3 GLN A 897 -4.339 0.186 11.770 1.00 35.26 H new ATOM 0 HG2 GLN A 897 -2.155 0.734 11.429 1.00 35.59 H new ATOM 0 HG3 GLN A 897 -1.757 0.352 12.888 1.00 35.59 H new ATOM 0 HE21 GLN A 897 -0.128 -1.087 11.899 1.00 34.43 H new ATOM 0 HE22 GLN A 897 -0.524 -2.423 11.372 1.00 34.43 H new ATOM 1727 N SER A 898 -5.524 1.630 15.373 1.00 35.50 N ATOM 1728 CA SER A 898 -6.739 1.440 16.159 1.00 35.08 C ATOM 1729 C SER A 898 -8.031 1.891 15.476 1.00 36.17 C ATOM 1730 O SER A 898 -8.990 1.125 15.406 1.00 35.05 O ATOM 1731 CB SER A 898 -6.611 2.132 17.520 1.00 33.55 C ATOM 1732 OG SER A 898 -6.588 3.538 17.385 1.00 34.06 O ATOM 0 H SER A 898 -4.885 2.024 15.793 1.00 35.50 H new ATOM 0 HA SER A 898 -6.817 0.479 16.265 1.00 35.08 H new ATOM 0 HB2 SER A 898 -7.353 1.872 18.088 1.00 33.55 H new ATOM 0 HB3 SER A 898 -5.800 1.835 17.961 1.00 33.55 H new ATOM 0 HG SER A 898 -6.519 3.891 18.144 1.00 34.06 H new ATOM 1733 N ARG A 899 -8.066 3.124 14.980 1.00 37.38 N ATOM 1734 CA ARG A 899 -9.267 3.630 14.317 1.00 38.28 C ATOM 1735 C ARG A 899 -9.606 2.795 13.088 1.00 38.80 C ATOM 1736 O ARG A 899 -10.758 2.423 12.886 1.00 39.02 O ATOM 1737 CB ARG A 899 -9.082 5.094 13.922 1.00 38.29 C ATOM 0 H ARG A 899 -7.411 3.681 15.016 1.00 37.38 H new ATOM 0 HA ARG A 899 -10.005 3.564 14.943 1.00 38.28 H new ATOM 1738 N ALA A 900 -8.598 2.494 12.274 1.00 39.19 N ATOM 1739 CA ALA A 900 -8.803 1.699 11.067 1.00 39.32 C ATOM 1740 C ALA A 900 -9.175 0.248 11.376 1.00 39.15 C ATOM 1741 O ALA A 900 -9.900 -0.392 10.615 1.00 39.22 O ATOM 1742 CB ALA A 900 -7.547 1.739 10.199 1.00 39.93 C ATOM 0 H ALA A 900 -7.785 2.742 12.404 1.00 39.19 H new ATOM 0 HA ALA A 900 -9.550 2.091 10.589 1.00 39.32 H new ATOM 0 HB1 ALA A 900 -7.689 1.209 9.399 1.00 39.93 H new ATOM 0 HB2 ALA A 900 -7.355 2.656 9.949 1.00 39.93 H new ATOM 0 HB3 ALA A 900 -6.798 1.377 10.697 1.00 39.93 H new ATOM 1743 N LEU A 901 -8.668 -0.271 12.489 1.00 38.40 N ATOM 1744 CA LEU A 901 -8.951 -1.644 12.882 1.00 37.03 C ATOM 1745 C LEU A 901 -10.183 -1.701 13.776 1.00 36.48 C ATOM 1746 O LEU A 901 -10.650 -2.777 14.122 1.00 36.28 O ATOM 1747 CB LEU A 901 -7.748 -2.243 13.620 1.00 37.15 C ATOM 1748 CG LEU A 901 -6.446 -2.326 12.821 1.00 37.28 C ATOM 1749 CD1 LEU A 901 -5.309 -2.783 13.726 1.00 37.50 C ATOM 1750 CD2 LEU A 901 -6.630 -3.282 11.651 1.00 36.76 C ATOM 0 H LEU A 901 -8.156 0.158 13.031 1.00 38.40 H new ATOM 0 HA LEU A 901 -9.122 -2.162 12.080 1.00 37.03 H new ATOM 0 HB2 LEU A 901 -7.585 -1.715 14.417 1.00 37.15 H new ATOM 0 HB3 LEU A 901 -7.984 -3.137 13.915 1.00 37.15 H new ATOM 0 HG LEU A 901 -6.220 -1.450 12.472 1.00 37.28 H new ATOM 0 HD11 LEU A 901 -4.487 -2.833 13.213 1.00 37.50 H new ATOM 0 HD12 LEU A 901 -5.198 -2.149 14.452 1.00 37.50 H new ATOM 0 HD13 LEU A 901 -5.517 -3.658 14.090 1.00 37.50 H new ATOM 0 HD21 LEU A 901 -5.805 -3.335 11.144 1.00 36.76 H new ATOM 0 HD22 LEU A 901 -6.861 -4.163 11.986 1.00 36.76 H new ATOM 0 HD23 LEU A 901 -7.342 -2.958 11.077 1.00 36.76 H new ATOM 1751 N SER A 902 -10.706 -0.537 14.142 1.00 35.95 N ATOM 1752 CA SER A 902 -11.881 -0.456 15.005 1.00 36.06 C ATOM 1753 C SER A 902 -11.611 -1.059 16.386 1.00 33.67 C ATOM 1754 O SER A 902 -12.505 -1.644 16.996 1.00 34.28 O ATOM 1755 CB SER A 902 -13.068 -1.182 14.361 1.00 37.82 C ATOM 1756 OG SER A 902 -13.349 -0.666 13.071 1.00 41.85 O ATOM 0 H SER A 902 -10.392 0.226 13.899 1.00 35.95 H new ATOM 0 HA SER A 902 -12.092 0.484 15.116 1.00 36.06 H new ATOM 0 HB2 SER A 902 -12.874 -2.130 14.297 1.00 37.82 H new ATOM 0 HB3 SER A 902 -13.851 -1.090 14.926 1.00 37.82 H new ATOM 0 HG SER A 902 -14.000 -1.080 12.739 1.00 41.85 H new ATOM 1757 N VAL A 903 -10.381 -0.918 16.871 1.00 31.51 N ATOM 1758 CA VAL A 903 -10.012 -1.454 18.180 1.00 28.90 C ATOM 1759 C VAL A 903 -9.822 -0.349 19.211 1.00 27.98 C ATOM 1760 O VAL A 903 -9.012 0.564 19.027 1.00 28.09 O ATOM 1761 CB VAL A 903 -8.714 -2.289 18.109 1.00 27.91 C ATOM 1762 CG1 VAL A 903 -8.250 -2.645 19.515 1.00 26.46 C ATOM 1763 CG2 VAL A 903 -8.958 -3.559 17.307 1.00 27.81 C ATOM 0 H VAL A 903 -9.744 -0.515 16.458 1.00 31.51 H new ATOM 0 HA VAL A 903 -10.748 -2.024 18.453 1.00 28.90 H new ATOM 0 HB VAL A 903 -8.025 -1.766 17.671 1.00 27.91 H new ATOM 0 HG11 VAL A 903 -7.435 -3.169 19.464 1.00 26.46 H new ATOM 0 HG12 VAL A 903 -8.080 -1.832 20.016 1.00 26.46 H new ATOM 0 HG13 VAL A 903 -8.939 -3.162 19.962 1.00 26.46 H new ATOM 0 HG21 VAL A 903 -8.140 -4.078 17.266 1.00 27.81 H new ATOM 0 HG22 VAL A 903 -9.653 -4.084 17.735 1.00 27.81 H new ATOM 0 HG23 VAL A 903 -9.237 -3.326 16.408 1.00 27.81 H new ATOM 1764 N GLU A 904 -10.572 -0.443 20.302 1.00 25.15 N ATOM 1765 CA GLU A 904 -10.504 0.547 21.360 1.00 24.61 C ATOM 1766 C GLU A 904 -9.370 0.275 22.344 1.00 23.95 C ATOM 1767 O GLU A 904 -9.141 -0.865 22.744 1.00 22.88 O ATOM 1768 CB GLU A 904 -11.837 0.598 22.101 1.00 22.66 C ATOM 0 H GLU A 904 -11.131 -1.080 20.447 1.00 25.15 H new ATOM 0 HA GLU A 904 -10.320 1.404 20.944 1.00 24.61 H new ATOM 1769 N PHE A 905 -8.653 1.335 22.708 1.00 22.49 N ATOM 1770 CA PHE A 905 -7.558 1.255 23.674 1.00 22.66 C ATOM 1771 C PHE A 905 -7.889 2.227 24.802 1.00 21.98 C ATOM 1772 O PHE A 905 -7.870 3.442 24.598 1.00 22.84 O ATOM 1773 CB PHE A 905 -6.225 1.670 23.040 1.00 21.70 C ATOM 1774 CG PHE A 905 -5.622 0.635 22.132 1.00 21.82 C ATOM 1775 CD1 PHE A 905 -6.188 0.351 20.900 1.00 20.59 C ATOM 1776 CD2 PHE A 905 -4.476 -0.044 22.510 1.00 20.86 C ATOM 1777 CE1 PHE A 905 -5.618 -0.589 20.060 1.00 21.05 C ATOM 1778 CE2 PHE A 905 -3.904 -0.981 21.675 1.00 22.47 C ATOM 1779 CZ PHE A 905 -4.478 -1.255 20.443 1.00 21.22 C ATOM 0 H PHE A 905 -8.788 2.126 22.400 1.00 22.49 H new ATOM 0 HA PHE A 905 -7.467 0.343 23.991 1.00 22.66 H new ATOM 0 HB2 PHE A 905 -6.359 2.488 22.536 1.00 21.70 H new ATOM 0 HB3 PHE A 905 -5.592 1.873 23.747 1.00 21.70 H new ATOM 0 HD1 PHE A 905 -6.960 0.797 20.635 1.00 20.59 H new ATOM 0 HD2 PHE A 905 -4.088 0.134 23.336 1.00 20.86 H new ATOM 0 HE1 PHE A 905 -6.007 -0.771 19.235 1.00 21.05 H new ATOM 0 HE2 PHE A 905 -3.133 -1.429 21.938 1.00 22.47 H new ATOM 0 HZ PHE A 905 -4.094 -1.886 19.878 1.00 21.22 H new ATOM 1780 N PRO A 906 -8.217 1.709 25.996 1.00 22.36 N ATOM 1781 CA PRO A 906 -8.552 2.564 27.142 1.00 22.96 C ATOM 1782 C PRO A 906 -7.448 3.564 27.452 1.00 21.33 C ATOM 1783 O PRO A 906 -6.290 3.356 27.088 1.00 21.72 O ATOM 1784 CB PRO A 906 -8.774 1.561 28.267 1.00 22.14 C ATOM 1785 CG PRO A 906 -9.345 0.380 27.533 1.00 25.12 C ATOM 1786 CD PRO A 906 -8.429 0.290 26.328 1.00 23.41 C ATOM 0 HA PRO A 906 -9.328 3.124 26.987 1.00 22.96 H new ATOM 0 HB2 PRO A 906 -7.947 1.339 28.723 1.00 22.14 H new ATOM 0 HB3 PRO A 906 -9.386 1.900 28.939 1.00 22.14 H new ATOM 0 HG2 PRO A 906 -9.321 -0.428 28.069 1.00 25.12 H new ATOM 0 HG3 PRO A 906 -10.270 0.523 27.277 1.00 25.12 H new ATOM 0 HD2 PRO A 906 -7.597 -0.162 26.538 1.00 23.41 H new ATOM 0 HD3 PRO A 906 -8.839 -0.197 25.596 1.00 23.41 H new ATOM 1787 N GLU A 907 -7.826 4.635 28.143 1.00 22.60 N ATOM 1788 CA GLU A 907 -6.929 5.734 28.495 1.00 20.52 C ATOM 1789 C GLU A 907 -5.659 5.432 29.293 1.00 20.03 C ATOM 1790 O GLU A 907 -4.572 5.856 28.906 1.00 17.82 O ATOM 1791 CB GLU A 907 -7.726 6.812 29.234 1.00 22.65 C ATOM 1792 CG GLU A 907 -8.860 7.435 28.422 1.00 21.71 C ATOM 1793 CD GLU A 907 -8.378 8.123 27.150 1.00 23.96 C ATOM 1794 OE1 GLU A 907 -7.236 8.632 27.132 1.00 25.22 O ATOM 1795 OE2 GLU A 907 -9.152 8.172 26.169 1.00 23.01 O ATOM 0 H GLU A 907 -8.630 4.746 28.427 1.00 22.60 H new ATOM 0 HA GLU A 907 -6.585 6.011 27.632 1.00 20.52 H new ATOM 0 HB2 GLU A 907 -8.098 6.425 30.042 1.00 22.65 H new ATOM 0 HB3 GLU A 907 -7.117 7.515 29.510 1.00 22.65 H new ATOM 0 HG2 GLU A 907 -9.499 6.744 28.187 1.00 21.71 H new ATOM 0 HG3 GLU A 907 -9.329 8.080 28.974 1.00 21.71 H new ATOM 1796 N MET A 908 -5.775 4.725 30.414 1.00 19.07 N ATOM 1797 CA MET A 908 -4.584 4.462 31.213 1.00 18.41 C ATOM 1798 C MET A 908 -3.535 3.667 30.436 1.00 18.49 C ATOM 1799 O MET A 908 -2.354 4.022 30.412 1.00 17.68 O ATOM 1800 CB MET A 908 -4.970 3.753 32.510 1.00 16.72 C ATOM 1801 CG MET A 908 -5.994 4.536 33.326 1.00 17.24 C ATOM 1802 SD MET A 908 -6.315 3.813 34.930 1.00 18.89 S ATOM 1803 CE MET A 908 -7.237 2.342 34.459 1.00 19.01 C ATOM 0 H MET A 908 -6.509 4.398 30.721 1.00 19.07 H new ATOM 0 HA MET A 908 -4.178 5.315 31.433 1.00 18.41 H new ATOM 0 HB2 MET A 908 -5.330 2.877 32.301 1.00 16.72 H new ATOM 0 HB3 MET A 908 -4.174 3.612 33.046 1.00 16.72 H new ATOM 0 HG2 MET A 908 -5.678 5.445 33.445 1.00 17.24 H new ATOM 0 HG3 MET A 908 -6.825 4.587 32.828 1.00 17.24 H new ATOM 0 HE1 MET A 908 -7.535 1.877 35.257 1.00 19.01 H new ATOM 0 HE2 MET A 908 -8.007 2.599 33.928 1.00 19.01 H new ATOM 0 HE3 MET A 908 -6.667 1.756 33.938 1.00 19.01 H new ATOM 1804 N MET A 909 -3.966 2.598 29.786 1.00 17.66 N ATOM 1805 CA MET A 909 -3.040 1.797 29.009 1.00 19.24 C ATOM 1806 C MET A 909 -2.540 2.588 27.797 1.00 18.71 C ATOM 1807 O MET A 909 -1.382 2.464 27.401 1.00 17.64 O ATOM 1808 CB MET A 909 -3.725 0.541 28.517 1.00 21.41 C ATOM 1809 CG MET A 909 -3.473 0.358 27.053 1.00 27.69 C ATOM 1810 SD MET A 909 -4.906 -0.209 26.236 1.00 30.27 S ATOM 1811 CE MET A 909 -4.421 -1.941 26.048 1.00 26.96 C ATOM 0 H MET A 909 -4.781 2.322 29.782 1.00 17.66 H new ATOM 0 HA MET A 909 -2.290 1.563 29.578 1.00 19.24 H new ATOM 0 HB2 MET A 909 -3.397 -0.229 29.008 1.00 21.41 H new ATOM 0 HB3 MET A 909 -4.679 0.598 28.684 1.00 21.41 H new ATOM 0 HG2 MET A 909 -3.186 1.199 26.663 1.00 27.69 H new ATOM 0 HG3 MET A 909 -2.751 -0.276 26.923 1.00 27.69 H new ATOM 0 HE1 MET A 909 -5.204 -2.508 26.134 1.00 26.96 H new ATOM 0 HE2 MET A 909 -4.022 -2.072 25.174 1.00 26.96 H new ATOM 0 HE3 MET A 909 -3.777 -2.173 26.735 1.00 26.96 H new ATOM 1812 N SER A 910 -3.420 3.385 27.193 1.00 18.12 N ATOM 1813 CA SER A 910 -3.026 4.179 26.037 1.00 18.94 C ATOM 1814 C SER A 910 -1.831 5.053 26.393 1.00 20.03 C ATOM 1815 O SER A 910 -0.897 5.176 25.604 1.00 20.10 O ATOM 1816 CB SER A 910 -4.183 5.064 25.552 1.00 20.36 C ATOM 1817 OG SER A 910 -5.188 4.305 24.900 1.00 19.73 O ATOM 0 H SER A 910 -4.240 3.478 27.435 1.00 18.12 H new ATOM 0 HA SER A 910 -2.785 3.570 25.321 1.00 18.94 H new ATOM 0 HB2 SER A 910 -4.571 5.533 26.308 1.00 20.36 H new ATOM 0 HB3 SER A 910 -3.842 5.739 24.944 1.00 20.36 H new ATOM 0 HG SER A 910 -5.732 4.013 25.469 1.00 19.73 H new ATOM 1818 N GLU A 911 -1.862 5.654 27.582 1.00 21.11 N ATOM 1819 CA GLU A 911 -0.768 6.514 28.039 1.00 19.90 C ATOM 1820 C GLU A 911 0.542 5.742 28.214 1.00 19.44 C ATOM 1821 O GLU A 911 1.619 6.270 27.940 1.00 18.66 O ATOM 1822 CB GLU A 911 -1.140 7.200 29.355 1.00 22.93 C ATOM 1823 CG GLU A 911 -0.017 8.020 29.964 1.00 25.92 C ATOM 1824 CD GLU A 911 0.442 9.156 29.064 1.00 29.70 C ATOM 1825 OE1 GLU A 911 1.587 9.624 29.239 1.00 31.68 O ATOM 1826 OE2 GLU A 911 -0.338 9.584 28.188 1.00 31.79 O ATOM 0 H GLU A 911 -2.510 5.577 28.142 1.00 21.11 H new ATOM 0 HA GLU A 911 -0.628 7.183 27.350 1.00 19.90 H new ATOM 0 HB2 GLU A 911 -1.904 7.778 29.203 1.00 22.93 H new ATOM 0 HB3 GLU A 911 -1.418 6.525 29.994 1.00 22.93 H new ATOM 0 HG2 GLU A 911 -0.313 8.385 30.812 1.00 25.92 H new ATOM 0 HG3 GLU A 911 0.736 7.439 30.153 1.00 25.92 H new ATOM 1827 N VAL A 912 0.458 4.496 28.669 1.00 18.84 N ATOM 1828 CA VAL A 912 1.661 3.678 28.852 1.00 18.85 C ATOM 1829 C VAL A 912 2.261 3.354 27.483 1.00 18.94 C ATOM 1830 O VAL A 912 3.471 3.451 27.277 1.00 18.04 O ATOM 1831 CB VAL A 912 1.346 2.338 29.582 1.00 18.02 C ATOM 1832 CG1 VAL A 912 2.587 1.438 29.584 1.00 16.67 C ATOM 1833 CG2 VAL A 912 0.897 2.613 31.015 1.00 15.70 C ATOM 0 H VAL A 912 -0.279 4.104 28.877 1.00 18.84 H new ATOM 0 HA VAL A 912 2.283 4.185 29.396 1.00 18.85 H new ATOM 0 HB VAL A 912 0.629 1.885 29.111 1.00 18.02 H new ATOM 0 HG11 VAL A 912 2.383 0.606 30.040 1.00 16.67 H new ATOM 0 HG12 VAL A 912 2.851 1.249 28.670 1.00 16.67 H new ATOM 0 HG13 VAL A 912 3.313 1.888 30.043 1.00 16.67 H new ATOM 0 HG21 VAL A 912 0.703 1.773 31.460 1.00 15.70 H new ATOM 0 HG22 VAL A 912 1.603 3.077 31.492 1.00 15.70 H new ATOM 0 HG23 VAL A 912 0.099 3.164 31.004 1.00 15.70 H new ATOM 1834 N ILE A 913 1.394 2.992 26.545 1.00 18.10 N ATOM 1835 CA ILE A 913 1.818 2.652 25.190 1.00 19.63 C ATOM 1836 C ILE A 913 2.429 3.848 24.474 1.00 21.60 C ATOM 1837 O ILE A 913 3.491 3.740 23.856 1.00 22.52 O ATOM 1838 CB ILE A 913 0.632 2.159 24.353 1.00 19.82 C ATOM 1839 CG1 ILE A 913 0.086 0.855 24.939 1.00 19.52 C ATOM 1840 CG2 ILE A 913 1.064 1.968 22.913 1.00 21.70 C ATOM 1841 CD1 ILE A 913 -1.254 0.460 24.365 1.00 19.38 C ATOM 0 H ILE A 913 0.546 2.936 26.674 1.00 18.10 H new ATOM 0 HA ILE A 913 2.483 1.952 25.279 1.00 19.63 H new ATOM 0 HB ILE A 913 -0.076 2.821 24.374 1.00 19.82 H new ATOM 0 HG12 ILE A 913 0.724 0.142 24.777 1.00 19.52 H new ATOM 0 HG13 ILE A 913 0.004 0.949 25.901 1.00 19.52 H new ATOM 0 HG21 ILE A 913 0.311 1.656 22.388 1.00 21.70 H new ATOM 0 HG22 ILE A 913 1.380 2.812 22.555 1.00 21.70 H new ATOM 0 HG23 ILE A 913 1.778 1.313 22.873 1.00 21.70 H new ATOM 0 HD11 ILE A 913 -1.549 -0.370 24.772 1.00 19.38 H new ATOM 0 HD12 ILE A 913 -1.903 1.157 24.548 1.00 19.38 H new ATOM 0 HD13 ILE A 913 -1.172 0.338 23.406 1.00 19.38 H new ATOM 1842 N ALA A 914 1.760 4.992 24.559 1.00 20.70 N ATOM 1843 CA ALA A 914 2.246 6.197 23.899 1.00 22.32 C ATOM 1844 C ALA A 914 3.549 6.700 24.504 1.00 23.16 C ATOM 1845 O ALA A 914 4.455 7.111 23.786 1.00 24.37 O ATOM 1846 CB ALA A 914 1.185 7.298 23.968 1.00 19.24 C ATOM 0 H ALA A 914 1.024 5.092 24.993 1.00 20.70 H new ATOM 0 HA ALA A 914 2.422 5.967 22.973 1.00 22.32 H new ATOM 0 HB1 ALA A 914 1.517 8.096 23.527 1.00 19.24 H new ATOM 0 HB2 ALA A 914 0.376 6.997 23.525 1.00 19.24 H new ATOM 0 HB3 ALA A 914 0.989 7.501 24.896 1.00 19.24 H new ATOM 1847 N ALA A 915 3.650 6.639 25.827 1.00 24.48 N ATOM 1848 CA ALA A 915 4.826 7.138 26.534 1.00 24.52 C ATOM 1849 C ALA A 915 6.094 6.284 26.561 1.00 25.84 C ATOM 1850 O ALA A 915 7.202 6.827 26.651 1.00 25.16 O ATOM 1851 CB ALA A 915 4.433 7.489 27.966 1.00 24.95 C ATOM 0 H ALA A 915 3.043 6.309 26.339 1.00 24.48 H new ATOM 0 HA ALA A 915 5.092 7.901 25.997 1.00 24.52 H new ATOM 0 HB1 ALA A 915 5.210 7.822 28.443 1.00 24.95 H new ATOM 0 HB2 ALA A 915 3.744 8.172 27.955 1.00 24.95 H new ATOM 0 HB3 ALA A 915 4.095 6.697 28.412 1.00 24.95 H new ATOM 1852 N GLN A 916 5.964 4.965 26.488 1.00 24.15 N ATOM 1853 CA GLN A 916 7.158 4.134 26.573 1.00 24.92 C ATOM 1854 C GLN A 916 7.417 3.096 25.484 1.00 24.12 C ATOM 1855 O GLN A 916 8.575 2.778 25.222 1.00 26.49 O ATOM 1856 CB GLN A 916 7.202 3.403 27.929 1.00 26.80 C ATOM 1857 CG GLN A 916 7.171 4.275 29.191 1.00 28.25 C ATOM 1858 CD GLN A 916 8.346 5.234 29.301 1.00 30.01 C ATOM 1859 OE1 GLN A 916 9.440 4.966 28.800 1.00 29.08 O ATOM 1860 NE2 GLN A 916 8.126 6.356 29.980 1.00 32.52 N ATOM 0 H GLN A 916 5.221 4.542 26.393 1.00 24.15 H new ATOM 0 HA GLN A 916 7.859 4.793 26.451 1.00 24.92 H new ATOM 0 HB2 GLN A 916 6.450 2.791 27.966 1.00 26.80 H new ATOM 0 HB3 GLN A 916 8.008 2.864 27.955 1.00 26.80 H new ATOM 0 HG2 GLN A 916 6.346 4.785 29.202 1.00 28.25 H new ATOM 0 HG3 GLN A 916 7.159 3.700 29.972 1.00 28.25 H new ATOM 0 HE21 GLN A 916 7.349 6.510 30.316 1.00 32.52 H new ATOM 0 HE22 GLN A 916 8.760 6.928 30.083 1.00 32.52 H new ATOM 1861 N LEU A 917 6.375 2.552 24.863 1.00 23.32 N ATOM 1862 CA LEU A 917 6.593 1.514 23.852 1.00 22.64 C ATOM 1863 C LEU A 917 7.545 1.878 22.718 1.00 22.68 C ATOM 1864 O LEU A 917 8.440 1.102 22.393 1.00 22.38 O ATOM 1865 CB LEU A 917 5.266 1.012 23.277 1.00 23.52 C ATOM 1866 CG LEU A 917 4.441 0.095 24.187 1.00 28.40 C ATOM 1867 CD1 LEU A 917 3.627 -0.864 23.327 1.00 26.92 C ATOM 1868 CD2 LEU A 917 5.361 -0.698 25.110 1.00 26.68 C ATOM 0 H LEU A 917 5.553 2.761 25.005 1.00 23.32 H new ATOM 0 HA LEU A 917 7.040 0.807 24.343 1.00 22.64 H new ATOM 0 HB2 LEU A 917 4.723 1.782 23.046 1.00 23.52 H new ATOM 0 HB3 LEU A 917 5.451 0.537 22.452 1.00 23.52 H new ATOM 0 HG LEU A 917 3.846 0.635 24.729 1.00 28.40 H new ATOM 0 HD11 LEU A 917 3.103 -1.447 23.899 1.00 26.92 H new ATOM 0 HD12 LEU A 917 3.033 -0.358 22.751 1.00 26.92 H new ATOM 0 HD13 LEU A 917 4.226 -1.399 22.783 1.00 26.92 H new ATOM 0 HD21 LEU A 917 4.829 -1.274 25.681 1.00 26.68 H new ATOM 0 HD22 LEU A 917 5.965 -1.239 24.578 1.00 26.68 H new ATOM 0 HD23 LEU A 917 5.875 -0.085 25.659 1.00 26.68 H new ATOM 1869 N PRO A 918 7.373 3.055 22.093 1.00 23.81 N ATOM 1870 CA PRO A 918 8.311 3.375 21.010 1.00 24.01 C ATOM 1871 C PRO A 918 9.764 3.347 21.503 1.00 23.60 C ATOM 1872 O PRO A 918 10.654 2.826 20.827 1.00 23.22 O ATOM 1873 CB PRO A 918 7.866 4.768 20.574 1.00 22.07 C ATOM 1874 CG PRO A 918 6.390 4.729 20.823 1.00 23.33 C ATOM 1875 CD PRO A 918 6.308 4.069 22.182 1.00 22.71 C ATOM 0 HA PRO A 918 8.296 2.736 20.280 1.00 24.01 H new ATOM 0 HB2 PRO A 918 8.301 5.464 21.090 1.00 22.07 H new ATOM 0 HB3 PRO A 918 8.071 4.937 19.641 1.00 22.07 H new ATOM 0 HG2 PRO A 918 6.001 5.617 20.828 1.00 23.33 H new ATOM 0 HG3 PRO A 918 5.922 4.218 20.144 1.00 23.33 H new ATOM 0 HD2 PRO A 918 6.466 4.699 22.902 1.00 22.71 H new ATOM 0 HD3 PRO A 918 5.438 3.670 22.340 1.00 22.71 H new ATOM 1876 N LYS A 919 9.988 3.907 22.686 1.00 23.89 N ATOM 1877 CA LYS A 919 11.313 3.960 23.298 1.00 25.54 C ATOM 1878 C LYS A 919 11.837 2.554 23.616 1.00 25.29 C ATOM 1879 O LYS A 919 13.000 2.230 23.357 1.00 24.88 O ATOM 1880 CB LYS A 919 11.244 4.790 24.583 1.00 29.54 C ATOM 1881 CG LYS A 919 12.519 4.794 25.406 1.00 33.18 C ATOM 1882 CD LYS A 919 12.313 5.415 26.788 1.00 35.96 C ATOM 1883 CE LYS A 919 11.874 6.872 26.707 1.00 37.96 C ATOM 1884 NZ LYS A 919 10.460 7.033 26.266 1.00 37.48 N ATOM 0 H LYS A 919 9.370 4.271 23.161 1.00 23.89 H new ATOM 0 HA LYS A 919 11.925 4.372 22.669 1.00 25.54 H new ATOM 0 HB2 LYS A 919 11.021 5.705 24.351 1.00 29.54 H new ATOM 0 HB3 LYS A 919 10.520 4.452 25.133 1.00 29.54 H new ATOM 0 HG2 LYS A 919 12.840 3.884 25.507 1.00 33.18 H new ATOM 0 HG3 LYS A 919 13.207 5.286 24.931 1.00 33.18 H new ATOM 0 HD2 LYS A 919 11.646 4.905 27.273 1.00 35.96 H new ATOM 0 HD3 LYS A 919 13.139 5.356 27.293 1.00 35.96 H new ATOM 0 HE2 LYS A 919 11.985 7.286 27.577 1.00 37.96 H new ATOM 0 HE3 LYS A 919 12.455 7.345 26.091 1.00 37.96 H new ATOM 0 HZ1 LYS A 919 10.441 7.255 25.404 1.00 37.48 H new ATOM 0 HZ2 LYS A 919 10.023 6.267 26.384 1.00 37.48 H new ATOM 0 HZ3 LYS A 919 10.070 7.673 26.746 1.00 37.48 H new ATOM 1885 N ILE A 920 10.970 1.722 24.180 1.00 23.77 N ATOM 1886 CA ILE A 920 11.348 0.363 24.532 1.00 22.43 C ATOM 1887 C ILE A 920 11.678 -0.488 23.308 1.00 22.21 C ATOM 1888 O ILE A 920 12.663 -1.222 23.308 1.00 23.40 O ATOM 1889 CB ILE A 920 10.237 -0.319 25.337 1.00 20.65 C ATOM 1890 CG1 ILE A 920 10.001 0.454 26.636 1.00 21.19 C ATOM 1891 CG2 ILE A 920 10.615 -1.761 25.622 1.00 21.12 C ATOM 1892 CD1 ILE A 920 8.921 -0.126 27.508 1.00 20.05 C ATOM 0 H ILE A 920 10.156 1.927 24.367 1.00 23.77 H new ATOM 0 HA ILE A 920 12.150 0.434 25.073 1.00 22.43 H new ATOM 0 HB ILE A 920 9.414 -0.319 24.824 1.00 20.65 H new ATOM 0 HG12 ILE A 920 10.830 0.482 27.139 1.00 21.19 H new ATOM 0 HG13 ILE A 920 9.770 1.371 26.418 1.00 21.19 H new ATOM 0 HG21 ILE A 920 9.908 -2.186 26.132 1.00 21.12 H new ATOM 0 HG22 ILE A 920 10.740 -2.235 24.785 1.00 21.12 H new ATOM 0 HG23 ILE A 920 11.440 -1.785 26.132 1.00 21.12 H new ATOM 0 HD11 ILE A 920 8.828 0.413 28.309 1.00 20.05 H new ATOM 0 HD12 ILE A 920 8.081 -0.132 27.023 1.00 20.05 H new ATOM 0 HD13 ILE A 920 9.157 -1.034 27.755 1.00 20.05 H new ATOM 1893 N LEU A 921 10.863 -0.395 22.263 1.00 23.12 N ATOM 1894 CA LEU A 921 11.117 -1.179 21.055 1.00 23.16 C ATOM 1895 C LEU A 921 12.418 -0.747 20.384 1.00 24.02 C ATOM 1896 O LEU A 921 13.125 -1.569 19.794 1.00 23.45 O ATOM 1897 CB LEU A 921 9.944 -1.049 20.076 1.00 23.33 C ATOM 1898 CG LEU A 921 8.699 -1.852 20.468 1.00 25.33 C ATOM 1899 CD1 LEU A 921 7.510 -1.456 19.610 1.00 23.47 C ATOM 1900 CD2 LEU A 921 8.999 -3.342 20.326 1.00 26.20 C ATOM 0 H LEU A 921 10.166 0.108 22.230 1.00 23.12 H new ATOM 0 HA LEU A 921 11.206 -2.109 21.314 1.00 23.16 H new ATOM 0 HB2 LEU A 921 9.701 -0.113 20.002 1.00 23.33 H new ATOM 0 HB3 LEU A 921 10.237 -1.336 19.197 1.00 23.33 H new ATOM 0 HG LEU A 921 8.471 -1.659 21.391 1.00 25.33 H new ATOM 0 HD11 LEU A 921 6.734 -1.975 19.873 1.00 23.47 H new ATOM 0 HD12 LEU A 921 7.324 -0.512 19.731 1.00 23.47 H new ATOM 0 HD13 LEU A 921 7.712 -1.628 18.677 1.00 23.47 H new ATOM 0 HD21 LEU A 921 8.214 -3.855 20.573 1.00 26.20 H new ATOM 0 HD22 LEU A 921 9.237 -3.538 19.406 1.00 26.20 H new ATOM 0 HD23 LEU A 921 9.737 -3.581 20.908 1.00 26.20 H new ATOM 1901 N ALA A 922 12.735 0.543 20.482 1.00 24.44 N ATOM 1902 CA ALA A 922 13.955 1.078 19.885 1.00 26.17 C ATOM 1903 C ALA A 922 15.193 0.674 20.692 1.00 26.77 C ATOM 1904 O ALA A 922 16.322 0.974 20.306 1.00 26.56 O ATOM 1905 CB ALA A 922 13.863 2.600 19.782 1.00 26.41 C ATOM 0 H ALA A 922 12.254 1.126 20.892 1.00 24.44 H new ATOM 0 HA ALA A 922 14.045 0.703 18.995 1.00 26.17 H new ATOM 0 HB1 ALA A 922 14.677 2.947 19.385 1.00 26.41 H new ATOM 0 HB2 ALA A 922 13.104 2.842 19.228 1.00 26.41 H new ATOM 0 HB3 ALA A 922 13.749 2.978 20.668 1.00 26.41 H new ATOM 1906 N GLY A 923 14.972 -0.014 21.808 1.00 26.12 N ATOM 1907 CA GLY A 923 16.079 -0.446 22.640 1.00 27.46 C ATOM 1908 C GLY A 923 16.705 0.672 23.454 1.00 27.80 C ATOM 1909 O GLY A 923 17.885 0.613 23.785 1.00 29.24 O ATOM 0 H GLY A 923 14.193 -0.238 22.096 1.00 26.12 H new ATOM 0 HA2 GLY A 923 15.768 -1.139 23.243 1.00 27.46 H new ATOM 0 HA3 GLY A 923 16.760 -0.845 22.076 1.00 27.46 H new ATOM 1910 N MET A 924 15.919 1.691 23.778 1.00 28.36 N ATOM 1911 CA MET A 924 16.416 2.823 24.555 1.00 30.18 C ATOM 1912 C MET A 924 16.244 2.616 26.066 1.00 28.49 C ATOM 1913 O MET A 924 15.978 3.563 26.803 1.00 29.18 O ATOM 1914 CB MET A 924 15.692 4.101 24.129 1.00 33.60 C ATOM 1915 CG MET A 924 15.708 4.354 22.628 1.00 38.70 C ATOM 1916 SD MET A 924 17.366 4.592 21.980 1.00 46.18 S ATOM 1917 CE MET A 924 17.560 6.350 22.226 1.00 41.07 C ATOM 0 H MET A 924 15.090 1.748 23.557 1.00 28.36 H new ATOM 0 HA MET A 924 17.366 2.899 24.377 1.00 30.18 H new ATOM 0 HB2 MET A 924 14.771 4.055 24.430 1.00 33.60 H new ATOM 0 HB3 MET A 924 16.100 4.857 24.579 1.00 33.60 H new ATOM 0 HG2 MET A 924 15.292 3.605 22.173 1.00 38.70 H new ATOM 0 HG3 MET A 924 15.172 5.138 22.431 1.00 38.70 H new ATOM 0 HE1 MET A 924 18.435 6.626 21.912 1.00 41.07 H new ATOM 0 HE2 MET A 924 16.874 6.824 21.730 1.00 41.07 H new ATOM 0 HE3 MET A 924 17.476 6.556 23.170 1.00 41.07 H new ATOM 1918 N VAL A 925 16.391 1.376 26.516 1.00 26.63 N ATOM 1919 CA VAL A 925 16.276 1.043 27.934 1.00 24.93 C ATOM 1920 C VAL A 925 17.310 -0.037 28.230 1.00 25.60 C ATOM 1921 O VAL A 925 17.895 -0.605 27.304 1.00 24.69 O ATOM 1922 CB VAL A 925 14.868 0.499 28.285 1.00 24.72 C ATOM 1923 CG1 VAL A 925 13.808 1.558 27.991 1.00 23.73 C ATOM 1924 CG2 VAL A 925 14.587 -0.768 27.493 1.00 23.94 C ATOM 0 H VAL A 925 16.560 0.702 26.009 1.00 26.63 H new ATOM 0 HA VAL A 925 16.422 1.843 28.463 1.00 24.93 H new ATOM 0 HB VAL A 925 14.838 0.286 29.231 1.00 24.72 H new ATOM 0 HG11 VAL A 925 12.931 1.209 28.214 1.00 23.73 H new ATOM 0 HG12 VAL A 925 13.985 2.350 28.523 1.00 23.73 H new ATOM 0 HG13 VAL A 925 13.834 1.789 27.049 1.00 23.73 H new ATOM 0 HG21 VAL A 925 13.705 -1.102 27.718 1.00 23.94 H new ATOM 0 HG22 VAL A 925 14.625 -0.572 26.544 1.00 23.94 H new ATOM 0 HG23 VAL A 925 15.252 -1.440 27.711 1.00 23.94 H new ATOM 1925 N LYS A 926 17.543 -0.313 29.510 1.00 23.96 N ATOM 1926 CA LYS A 926 18.513 -1.327 29.898 1.00 23.59 C ATOM 1927 C LYS A 926 17.891 -2.569 30.523 1.00 24.02 C ATOM 1928 O LYS A 926 17.555 -2.587 31.710 1.00 22.44 O ATOM 1929 CB LYS A 926 19.539 -0.756 30.876 1.00 24.94 C ATOM 1930 CG LYS A 926 20.463 -1.827 31.456 1.00 26.26 C ATOM 1931 CD LYS A 926 21.562 -1.237 32.319 1.00 29.81 C ATOM 1932 CE LYS A 926 22.432 -2.329 32.920 1.00 31.81 C ATOM 1933 NZ LYS A 926 22.993 -3.218 31.862 1.00 37.63 N ATOM 0 H LYS A 926 17.149 0.077 30.168 1.00 23.96 H new ATOM 0 HA LYS A 926 18.939 -1.596 29.069 1.00 23.59 H new ATOM 0 HB2 LYS A 926 20.073 -0.085 30.423 1.00 24.94 H new ATOM 0 HB3 LYS A 926 19.075 -0.308 31.600 1.00 24.94 H new ATOM 0 HG2 LYS A 926 19.940 -2.450 31.984 1.00 26.26 H new ATOM 0 HG3 LYS A 926 20.861 -2.334 30.731 1.00 26.26 H new ATOM 0 HD2 LYS A 926 22.110 -0.639 31.786 1.00 29.81 H new ATOM 0 HD3 LYS A 926 21.169 -0.705 33.029 1.00 29.81 H new ATOM 0 HE2 LYS A 926 23.156 -1.927 33.425 1.00 31.81 H new ATOM 0 HE3 LYS A 926 21.909 -2.856 33.544 1.00 31.81 H new ATOM 0 HZ1 LYS A 926 23.817 -3.467 32.089 1.00 37.63 H new ATOM 0 HZ2 LYS A 926 22.478 -3.939 31.776 1.00 37.63 H new ATOM 0 HZ3 LYS A 926 23.019 -2.779 31.088 1.00 37.63 H new ATOM 1934 N PRO A 927 17.733 -3.633 29.725 1.00 24.75 N ATOM 1935 CA PRO A 927 17.154 -4.886 30.221 1.00 25.06 C ATOM 1936 C PRO A 927 18.153 -5.517 31.192 1.00 25.91 C ATOM 1937 O PRO A 927 19.348 -5.549 30.906 1.00 27.10 O ATOM 1938 CB PRO A 927 17.005 -5.729 28.955 1.00 25.14 C ATOM 1939 CG PRO A 927 16.953 -4.699 27.835 1.00 25.20 C ATOM 1940 CD PRO A 927 17.981 -3.696 28.276 1.00 23.36 C ATOM 0 HA PRO A 927 16.312 -4.789 30.692 1.00 25.06 H new ATOM 0 HB2 PRO A 927 17.751 -6.338 28.844 1.00 25.14 H new ATOM 0 HB3 PRO A 927 16.199 -6.269 28.980 1.00 25.14 H new ATOM 0 HG2 PRO A 927 17.173 -5.089 26.974 1.00 25.20 H new ATOM 0 HG3 PRO A 927 16.072 -4.301 27.749 1.00 25.20 H new ATOM 0 HD2 PRO A 927 18.884 -3.987 28.073 1.00 23.36 H new ATOM 0 HD3 PRO A 927 17.857 -2.835 27.847 1.00 23.36 H new ATOM 1941 N LEU A 928 17.683 -6.000 32.339 1.00 25.02 N ATOM 1942 CA LEU A 928 18.585 -6.633 33.293 1.00 23.92 C ATOM 1943 C LEU A 928 18.588 -8.138 33.046 1.00 24.69 C ATOM 1944 O LEU A 928 17.539 -8.742 32.826 1.00 24.23 O ATOM 1945 CB LEU A 928 18.154 -6.337 34.733 1.00 23.57 C ATOM 1946 CG LEU A 928 18.194 -4.876 35.185 1.00 24.55 C ATOM 1947 CD1 LEU A 928 17.919 -4.803 36.691 1.00 22.66 C ATOM 1948 CD2 LEU A 928 19.559 -4.274 34.869 1.00 23.29 C ATOM 0 H LEU A 928 16.858 -5.972 32.580 1.00 25.02 H new ATOM 0 HA LEU A 928 19.478 -6.276 33.170 1.00 23.92 H new ATOM 0 HB2 LEU A 928 17.248 -6.664 34.849 1.00 23.57 H new ATOM 0 HB3 LEU A 928 18.720 -6.852 35.329 1.00 23.57 H new ATOM 0 HG LEU A 928 17.514 -4.371 34.712 1.00 24.55 H new ATOM 0 HD11 LEU A 928 17.944 -3.877 36.980 1.00 22.66 H new ATOM 0 HD12 LEU A 928 17.044 -5.177 36.879 1.00 22.66 H new ATOM 0 HD13 LEU A 928 18.595 -5.309 37.168 1.00 22.66 H new ATOM 0 HD21 LEU A 928 19.579 -3.348 35.157 1.00 23.29 H new ATOM 0 HD22 LEU A 928 20.248 -4.772 35.335 1.00 23.29 H new ATOM 0 HD23 LEU A 928 19.719 -4.318 33.913 1.00 23.29 H new ATOM 1949 N LEU A 929 19.767 -8.745 33.073 1.00 24.79 N ATOM 1950 CA LEU A 929 19.874 -10.178 32.835 1.00 26.02 C ATOM 1951 C LEU A 929 20.586 -10.895 33.969 1.00 26.36 C ATOM 1952 O LEU A 929 21.506 -10.349 34.580 1.00 26.64 O ATOM 1953 CB LEU A 929 20.630 -10.443 31.529 1.00 25.76 C ATOM 1954 CG LEU A 929 20.017 -9.882 30.246 1.00 26.15 C ATOM 1955 CD1 LEU A 929 20.974 -10.128 29.096 1.00 27.63 C ATOM 1956 CD2 LEU A 929 18.662 -10.539 29.980 1.00 27.32 C ATOM 0 H LEU A 929 20.514 -8.348 33.227 1.00 24.79 H new ATOM 0 HA LEU A 929 18.969 -10.523 32.776 1.00 26.02 H new ATOM 0 HB2 LEU A 929 21.525 -10.079 31.620 1.00 25.76 H new ATOM 0 HB3 LEU A 929 20.723 -11.403 31.424 1.00 25.76 H new ATOM 0 HG LEU A 929 19.872 -8.927 30.339 1.00 26.15 H new ATOM 0 HD11 LEU A 929 20.593 -9.775 28.277 1.00 27.63 H new ATOM 0 HD12 LEU A 929 21.818 -9.685 29.277 1.00 27.63 H new ATOM 0 HD13 LEU A 929 21.124 -11.081 28.998 1.00 27.63 H new ATOM 0 HD21 LEU A 929 18.281 -10.177 29.165 1.00 27.32 H new ATOM 0 HD22 LEU A 929 18.780 -11.497 29.884 1.00 27.32 H new ATOM 0 HD23 LEU A 929 18.064 -10.360 30.723 1.00 27.32 H new ATOM 1957 N PHE A 930 20.157 -12.121 34.246 1.00 27.58 N ATOM 1958 CA PHE A 930 20.780 -12.919 35.294 1.00 30.43 C ATOM 1959 C PHE A 930 21.972 -13.678 34.709 1.00 32.21 C ATOM 1960 O PHE A 930 22.937 -13.972 35.411 1.00 32.26 O ATOM 1961 CB PHE A 930 19.777 -13.905 35.896 1.00 30.59 C ATOM 1962 CG PHE A 930 18.736 -13.255 36.767 1.00 28.98 C ATOM 1963 CD1 PHE A 930 17.548 -12.793 36.230 1.00 29.43 C ATOM 1964 CD2 PHE A 930 18.957 -13.097 38.126 1.00 29.94 C ATOM 1965 CE1 PHE A 930 16.595 -12.184 37.032 1.00 29.41 C ATOM 1966 CE2 PHE A 930 18.011 -12.488 38.935 1.00 29.58 C ATOM 1967 CZ PHE A 930 16.828 -12.032 38.385 1.00 29.72 C ATOM 0 H PHE A 930 19.507 -12.509 33.839 1.00 27.58 H new ATOM 0 HA PHE A 930 21.083 -12.327 36.000 1.00 30.43 H new ATOM 0 HB2 PHE A 930 19.333 -14.382 35.177 1.00 30.59 H new ATOM 0 HB3 PHE A 930 20.259 -14.565 36.419 1.00 30.59 H new ATOM 0 HD1 PHE A 930 17.386 -12.892 35.320 1.00 29.43 H new ATOM 0 HD2 PHE A 930 19.751 -13.404 38.500 1.00 29.94 H new ATOM 0 HE1 PHE A 930 15.800 -11.878 36.659 1.00 29.41 H new ATOM 0 HE2 PHE A 930 18.172 -12.386 39.845 1.00 29.58 H new ATOM 0 HZ PHE A 930 16.190 -11.624 38.925 1.00 29.72 H new ATOM 1968 N HIS A 931 21.897 -13.983 33.418 1.00 33.72 N ATOM 1969 CA HIS A 931 22.970 -14.691 32.731 1.00 36.46 C ATOM 1970 C HIS A 931 23.389 -13.920 31.486 1.00 37.68 C ATOM 1971 O HIS A 931 22.550 -13.468 30.706 1.00 36.86 O ATOM 1972 CB HIS A 931 22.511 -16.095 32.352 1.00 37.26 C ATOM 1973 CG HIS A 931 21.820 -16.812 33.467 1.00 39.59 C ATOM 1974 ND1 HIS A 931 22.312 -17.480 34.536 1.00 40.57 N flip ATOM 1975 CD2 HIS A 931 20.449 -16.825 33.603 1.00 40.46 C flip ATOM 1976 CE1 HIS A 931 21.237 -17.877 35.294 1.00 41.56 C flip ATOM 1977 NE2 HIS A 931 20.125 -17.471 34.708 1.00 42.93 N flip ATOM 0 H HIS A 931 21.226 -13.786 32.918 1.00 33.72 H new ATOM 0 HA HIS A 931 23.733 -14.762 33.326 1.00 36.46 H new ATOM 0 HB2 HIS A 931 21.911 -16.038 31.592 1.00 37.26 H new ATOM 0 HB3 HIS A 931 23.280 -16.614 32.069 1.00 37.26 H new ATOM 0 HD1 HIS A 931 23.141 -17.628 34.708 1.00 40.57 H new ATOM 0 HD2 HIS A 931 19.846 -16.439 33.009 1.00 40.46 H new ATOM 0 HE1 HIS A 931 21.285 -18.354 36.091 1.00 41.56 H new ATOM 1978 N LYS A 932 24.695 -13.761 31.313 1.00 41.32 N ATOM 1979 CA LYS A 932 25.230 -13.032 30.172 1.00 43.66 C ATOM 1980 C LYS A 932 25.016 -13.817 28.885 1.00 44.23 C ATOM 1981 O LYS A 932 24.700 -15.022 28.978 1.00 44.95 O ATOM 1982 CB LYS A 932 26.715 -12.764 30.382 1.00 44.79 C ATOM 0 H LYS A 932 25.292 -14.070 31.849 1.00 41.32 H new ATOM 0 HA LYS A 932 24.761 -12.187 30.095 1.00 43.66 H new TER 1983 LYS A 932 ATOM 1984 N LEU B 683 32.827 10.933 -20.675 1.00 38.12 N ATOM 1985 CA LEU B 683 33.568 10.657 -19.410 1.00 37.06 C ATOM 1986 C LEU B 683 32.635 10.055 -18.363 1.00 35.93 C ATOM 1987 O LEU B 683 32.942 9.019 -17.772 1.00 35.09 O ATOM 1988 CB LEU B 683 34.191 11.942 -18.879 1.00 37.57 C ATOM 0 HA LEU B 683 34.273 10.018 -19.598 1.00 37.06 H new ATOM 1989 N ILE B 684 31.495 10.705 -18.139 1.00 34.36 N ATOM 1990 CA ILE B 684 30.524 10.214 -17.163 1.00 32.54 C ATOM 1991 C ILE B 684 29.790 9.000 -17.711 1.00 30.52 C ATOM 1992 O ILE B 684 29.165 9.072 -18.767 1.00 28.84 O ATOM 1993 CB ILE B 684 29.463 11.276 -16.819 1.00 34.57 C ATOM 1994 CG1 ILE B 684 30.135 12.571 -16.359 1.00 34.84 C ATOM 1995 CG2 ILE B 684 28.564 10.755 -15.706 1.00 33.23 C ATOM 1996 CD1 ILE B 684 30.933 12.409 -15.089 1.00 37.77 C ATOM 0 H ILE B 684 31.265 11.430 -18.540 1.00 34.36 H new ATOM 0 HA ILE B 684 31.027 9.989 -16.365 1.00 32.54 H new ATOM 0 HB ILE B 684 28.935 11.458 -17.612 1.00 34.57 H new ATOM 0 HG12 ILE B 684 30.720 12.892 -17.063 1.00 34.84 H new ATOM 0 HG13 ILE B 684 29.456 13.250 -16.223 1.00 34.84 H new ATOM 0 HG21 ILE B 684 27.896 11.424 -15.490 1.00 33.23 H new ATOM 0 HG22 ILE B 684 28.124 9.942 -15.999 1.00 33.23 H new ATOM 0 HG23 ILE B 684 29.099 10.567 -14.919 1.00 33.23 H new ATOM 0 HD11 ILE B 684 31.334 13.259 -14.848 1.00 37.77 H new ATOM 0 HD12 ILE B 684 30.348 12.114 -14.374 1.00 37.77 H new ATOM 0 HD13 ILE B 684 31.632 11.750 -15.227 1.00 37.77 H new ATOM 1997 N PRO B 685 29.856 7.866 -16.993 1.00 28.89 N ATOM 1998 CA PRO B 685 29.208 6.604 -17.370 1.00 27.27 C ATOM 1999 C PRO B 685 27.718 6.825 -17.640 1.00 26.33 C ATOM 2000 O PRO B 685 27.066 7.616 -16.958 1.00 25.21 O ATOM 2001 CB PRO B 685 29.439 5.721 -16.147 1.00 26.74 C ATOM 2002 CG PRO B 685 30.733 6.222 -15.611 1.00 28.54 C ATOM 2003 CD PRO B 685 30.568 7.722 -15.712 1.00 28.77 C ATOM 0 HA PRO B 685 29.560 6.211 -18.184 1.00 27.27 H new ATOM 0 HB2 PRO B 685 28.723 5.811 -15.499 1.00 26.74 H new ATOM 0 HB3 PRO B 685 29.489 4.782 -16.386 1.00 26.74 H new ATOM 0 HG2 PRO B 685 30.880 5.935 -14.696 1.00 28.54 H new ATOM 0 HG3 PRO B 685 31.487 5.905 -16.133 1.00 28.54 H new ATOM 0 HD2 PRO B 685 30.057 8.082 -14.970 1.00 28.77 H new ATOM 0 HD3 PRO B 685 31.422 8.182 -15.718 1.00 28.77 H new ATOM 2004 N PRO B 686 27.163 6.118 -18.633 1.00 25.65 N ATOM 2005 CA PRO B 686 25.747 6.233 -19.002 1.00 24.90 C ATOM 2006 C PRO B 686 24.723 6.090 -17.868 1.00 23.07 C ATOM 2007 O PRO B 686 23.796 6.898 -17.776 1.00 24.44 O ATOM 2008 CB PRO B 686 25.581 5.165 -20.092 1.00 23.95 C ATOM 2009 CG PRO B 686 26.696 4.179 -19.797 1.00 26.04 C ATOM 2010 CD PRO B 686 27.837 5.101 -19.458 1.00 25.67 C ATOM 0 HA PRO B 686 25.550 7.137 -19.294 1.00 24.90 H new ATOM 0 HB2 PRO B 686 24.709 4.742 -20.047 1.00 23.95 H new ATOM 0 HB3 PRO B 686 25.667 5.545 -20.980 1.00 23.95 H new ATOM 0 HG2 PRO B 686 26.474 3.588 -19.061 1.00 26.04 H new ATOM 0 HG3 PRO B 686 26.897 3.617 -20.561 1.00 26.04 H new ATOM 0 HD2 PRO B 686 28.541 4.645 -18.971 1.00 25.67 H new ATOM 0 HD3 PRO B 686 28.243 5.485 -20.251 1.00 25.67 H new ATOM 2011 N LEU B 687 24.876 5.080 -17.013 1.00 21.06 N ATOM 2012 CA LEU B 687 23.928 4.890 -15.915 1.00 20.13 C ATOM 2013 C LEU B 687 23.887 6.115 -15.007 1.00 20.57 C ATOM 2014 O LEU B 687 22.825 6.509 -14.530 1.00 20.17 O ATOM 2015 CB LEU B 687 24.285 3.653 -15.078 1.00 19.06 C ATOM 2016 CG LEU B 687 23.328 3.339 -13.914 1.00 20.00 C ATOM 2017 CD1 LEU B 687 21.897 3.308 -14.437 1.00 18.93 C ATOM 2018 CD2 LEU B 687 23.683 1.999 -13.264 1.00 20.12 C ATOM 0 H LEU B 687 25.511 4.502 -17.049 1.00 21.06 H new ATOM 0 HA LEU B 687 23.054 4.759 -16.314 1.00 20.13 H new ATOM 0 HB2 LEU B 687 24.317 2.882 -15.666 1.00 19.06 H new ATOM 0 HB3 LEU B 687 25.178 3.772 -14.718 1.00 19.06 H new ATOM 0 HG LEU B 687 23.413 4.031 -13.239 1.00 20.00 H new ATOM 0 HD11 LEU B 687 21.290 3.110 -13.707 1.00 18.93 H new ATOM 0 HD12 LEU B 687 21.673 4.171 -14.819 1.00 18.93 H new ATOM 0 HD13 LEU B 687 21.816 2.623 -15.119 1.00 18.93 H new ATOM 0 HD21 LEU B 687 23.069 1.820 -12.534 1.00 20.12 H new ATOM 0 HD22 LEU B 687 23.615 1.291 -13.924 1.00 20.12 H new ATOM 0 HD23 LEU B 687 24.590 2.035 -12.922 1.00 20.12 H new ATOM 2019 N ILE B 688 25.045 6.716 -14.766 1.00 20.33 N ATOM 2020 CA ILE B 688 25.114 7.892 -13.908 1.00 20.13 C ATOM 2021 C ILE B 688 24.421 9.064 -14.597 1.00 20.57 C ATOM 2022 O ILE B 688 23.704 9.832 -13.959 1.00 19.76 O ATOM 2023 CB ILE B 688 26.589 8.235 -13.557 1.00 19.99 C ATOM 2024 CG1 ILE B 688 27.189 7.083 -12.737 1.00 19.09 C ATOM 2025 CG2 ILE B 688 26.659 9.538 -12.767 1.00 20.68 C ATOM 2026 CD1 ILE B 688 28.608 7.300 -12.256 1.00 19.56 C ATOM 0 H ILE B 688 25.800 6.460 -15.088 1.00 20.33 H new ATOM 0 HA ILE B 688 24.656 7.706 -13.074 1.00 20.13 H new ATOM 0 HB ILE B 688 27.097 8.350 -14.375 1.00 19.99 H new ATOM 0 HG12 ILE B 688 26.622 6.926 -11.966 1.00 19.09 H new ATOM 0 HG13 ILE B 688 27.166 6.276 -13.275 1.00 19.09 H new ATOM 0 HG21 ILE B 688 27.584 9.739 -12.555 1.00 20.68 H new ATOM 0 HG22 ILE B 688 26.285 10.259 -13.298 1.00 20.68 H new ATOM 0 HG23 ILE B 688 26.152 9.446 -11.945 1.00 20.68 H new ATOM 0 HD11 ILE B 688 28.901 6.525 -11.751 1.00 19.56 H new ATOM 0 HD12 ILE B 688 29.193 7.427 -13.019 1.00 19.56 H new ATOM 0 HD13 ILE B 688 28.641 8.087 -11.689 1.00 19.56 H new ATOM 2027 N ASN B 689 24.623 9.189 -15.904 1.00 21.95 N ATOM 2028 CA ASN B 689 23.980 10.253 -16.669 1.00 23.19 C ATOM 2029 C ASN B 689 22.473 10.080 -16.566 1.00 21.71 C ATOM 2030 O ASN B 689 21.739 11.048 -16.383 1.00 21.63 O ATOM 2031 CB ASN B 689 24.396 10.184 -18.136 1.00 26.74 C ATOM 2032 CG ASN B 689 25.224 11.370 -18.553 1.00 31.51 C ATOM 2033 OD1 ASN B 689 26.258 11.666 -17.949 1.00 35.08 O ATOM 2034 ND2 ASN B 689 24.776 12.064 -19.592 1.00 35.14 N ATOM 0 H ASN B 689 25.128 8.669 -16.367 1.00 21.95 H new ATOM 0 HA ASN B 689 24.250 11.113 -16.311 1.00 23.19 H new ATOM 0 HB2 ASN B 689 24.901 9.370 -18.289 1.00 26.74 H new ATOM 0 HB3 ASN B 689 23.603 10.134 -18.693 1.00 26.74 H new ATOM 0 HD21 ASN B 689 25.211 12.752 -19.870 1.00 35.14 H new ATOM 0 HD22 ASN B 689 24.050 11.826 -19.987 1.00 35.14 H new ATOM 2035 N LEU B 690 22.017 8.838 -16.684 1.00 19.76 N ATOM 2036 CA LEU B 690 20.591 8.548 -16.586 1.00 20.72 C ATOM 2037 C LEU B 690 20.088 8.898 -15.182 1.00 20.55 C ATOM 2038 O LEU B 690 19.034 9.515 -15.031 1.00 19.75 O ATOM 2039 CB LEU B 690 20.336 7.073 -16.888 1.00 19.82 C ATOM 2040 CG LEU B 690 18.887 6.586 -16.944 1.00 20.96 C ATOM 2041 CD1 LEU B 690 18.878 5.242 -17.639 1.00 22.61 C ATOM 2042 CD2 LEU B 690 18.281 6.472 -15.558 1.00 21.52 C ATOM 0 H LEU B 690 22.515 8.150 -16.821 1.00 19.76 H new ATOM 0 HA LEU B 690 20.110 9.085 -17.235 1.00 20.72 H new ATOM 0 HB2 LEU B 690 20.750 6.870 -17.741 1.00 19.82 H new ATOM 0 HB3 LEU B 690 20.799 6.549 -16.216 1.00 19.82 H new ATOM 0 HG LEU B 690 18.348 7.228 -17.432 1.00 20.96 H new ATOM 0 HD11 LEU B 690 17.968 4.909 -17.688 1.00 22.61 H new ATOM 0 HD12 LEU B 690 19.235 5.339 -18.536 1.00 22.61 H new ATOM 0 HD13 LEU B 690 19.425 4.615 -17.139 1.00 22.61 H new ATOM 0 HD21 LEU B 690 17.365 6.162 -15.630 1.00 21.52 H new ATOM 0 HD22 LEU B 690 18.795 5.841 -15.031 1.00 21.52 H new ATOM 0 HD23 LEU B 690 18.295 7.340 -15.126 1.00 21.52 H new ATOM 2043 N LEU B 691 20.839 8.514 -14.153 1.00 19.93 N ATOM 2044 CA LEU B 691 20.415 8.835 -12.794 1.00 20.52 C ATOM 2045 C LEU B 691 20.259 10.346 -12.620 1.00 21.77 C ATOM 2046 O LEU B 691 19.372 10.804 -11.907 1.00 21.48 O ATOM 2047 CB LEU B 691 21.409 8.295 -11.759 1.00 18.13 C ATOM 2048 CG LEU B 691 21.431 6.778 -11.511 1.00 14.73 C ATOM 2049 CD1 LEU B 691 22.433 6.456 -10.399 1.00 10.09 C ATOM 2050 CD2 LEU B 691 20.040 6.296 -11.118 1.00 15.37 C ATOM 0 H LEU B 691 21.578 8.078 -14.216 1.00 19.93 H new ATOM 0 HA LEU B 691 19.556 8.408 -12.648 1.00 20.52 H new ATOM 0 HB2 LEU B 691 22.300 8.566 -12.032 1.00 18.13 H new ATOM 0 HB3 LEU B 691 21.226 8.733 -10.913 1.00 18.13 H new ATOM 0 HG LEU B 691 21.701 6.323 -12.324 1.00 14.73 H new ATOM 0 HD11 LEU B 691 22.447 5.499 -10.243 1.00 10.09 H new ATOM 0 HD12 LEU B 691 23.318 6.753 -10.664 1.00 10.09 H new ATOM 0 HD13 LEU B 691 22.170 6.912 -9.584 1.00 10.09 H new ATOM 0 HD21 LEU B 691 20.061 5.339 -10.963 1.00 15.37 H new ATOM 0 HD22 LEU B 691 19.758 6.748 -10.308 1.00 15.37 H new ATOM 0 HD23 LEU B 691 19.415 6.494 -11.833 1.00 15.37 H new ATOM 2051 N MET B 692 21.107 11.128 -13.277 1.00 23.38 N ATOM 2052 CA MET B 692 21.005 12.576 -13.141 1.00 26.48 C ATOM 2053 C MET B 692 19.780 13.110 -13.872 1.00 26.21 C ATOM 2054 O MET B 692 19.129 14.045 -13.404 1.00 26.39 O ATOM 2055 CB MET B 692 22.268 13.263 -13.680 1.00 29.22 C ATOM 2056 CG MET B 692 22.250 14.795 -13.576 1.00 34.07 C ATOM 2057 SD MET B 692 22.205 15.447 -11.865 1.00 43.06 S ATOM 2058 CE MET B 692 20.538 16.120 -11.758 1.00 38.65 C ATOM 0 H MET B 692 21.735 10.850 -13.795 1.00 23.38 H new ATOM 0 HA MET B 692 20.915 12.776 -12.196 1.00 26.48 H new ATOM 0 HB2 MET B 692 23.038 12.926 -13.196 1.00 29.22 H new ATOM 0 HB3 MET B 692 22.386 13.014 -14.610 1.00 29.22 H new ATOM 0 HG2 MET B 692 23.036 15.146 -14.022 1.00 34.07 H new ATOM 0 HG3 MET B 692 21.477 15.130 -14.057 1.00 34.07 H new ATOM 0 HE1 MET B 692 20.542 16.907 -11.192 1.00 38.65 H new ATOM 0 HE2 MET B 692 20.229 16.362 -12.645 1.00 38.65 H new ATOM 0 HE3 MET B 692 19.943 15.454 -11.380 1.00 38.65 H new ATOM 2059 N SER B 693 19.454 12.508 -15.013 1.00 25.29 N ATOM 2060 CA SER B 693 18.308 12.957 -15.799 1.00 24.76 C ATOM 2061 C SER B 693 16.965 12.668 -15.139 1.00 23.25 C ATOM 2062 O SER B 693 15.987 13.353 -15.414 1.00 22.35 O ATOM 2063 CB SER B 693 18.318 12.309 -17.185 1.00 24.14 C ATOM 2064 OG SER B 693 17.936 10.948 -17.101 1.00 25.64 O ATOM 0 H SER B 693 19.881 11.841 -15.348 1.00 25.29 H new ATOM 0 HA SER B 693 18.402 13.920 -15.867 1.00 24.76 H new ATOM 0 HB2 SER B 693 17.712 12.785 -17.774 1.00 24.14 H new ATOM 0 HB3 SER B 693 19.204 12.378 -17.574 1.00 24.14 H new ATOM 0 HG SER B 693 18.307 10.593 -16.436 1.00 25.64 H new ATOM 2065 N ILE B 694 16.908 11.658 -14.276 1.00 22.18 N ATOM 2066 CA ILE B 694 15.648 11.331 -13.628 1.00 20.89 C ATOM 2067 C ILE B 694 15.474 11.908 -12.223 1.00 22.08 C ATOM 2068 O ILE B 694 14.544 11.536 -11.505 1.00 22.00 O ATOM 2069 CB ILE B 694 15.414 9.800 -13.580 1.00 20.12 C ATOM 2070 CG1 ILE B 694 16.484 9.122 -12.722 1.00 17.65 C ATOM 2071 CG2 ILE B 694 15.421 9.239 -14.999 1.00 17.04 C ATOM 2072 CD1 ILE B 694 16.223 7.648 -12.465 1.00 18.83 C ATOM 0 H ILE B 694 17.574 11.160 -14.057 1.00 22.18 H new ATOM 0 HA ILE B 694 14.981 11.759 -14.187 1.00 20.89 H new ATOM 0 HB ILE B 694 14.551 9.621 -13.176 1.00 20.12 H new ATOM 0 HG12 ILE B 694 17.345 9.218 -13.159 1.00 17.65 H new ATOM 0 HG13 ILE B 694 16.545 9.584 -11.871 1.00 17.65 H new ATOM 0 HG21 ILE B 694 15.275 8.281 -14.969 1.00 17.04 H new ATOM 0 HG22 ILE B 694 14.715 9.658 -15.516 1.00 17.04 H new ATOM 0 HG23 ILE B 694 16.278 9.422 -15.415 1.00 17.04 H new ATOM 0 HD11 ILE B 694 16.936 7.283 -11.918 1.00 18.83 H new ATOM 0 HD12 ILE B 694 15.377 7.545 -12.003 1.00 18.83 H new ATOM 0 HD13 ILE B 694 16.189 7.173 -13.310 1.00 18.83 H new ATOM 2073 N GLU B 695 16.366 12.804 -11.817 1.00 21.77 N ATOM 2074 CA GLU B 695 16.224 13.430 -10.507 1.00 22.63 C ATOM 2075 C GLU B 695 14.971 14.294 -10.576 1.00 24.41 C ATOM 2076 O GLU B 695 14.673 14.879 -11.615 1.00 24.58 O ATOM 2077 CB GLU B 695 17.434 14.310 -10.188 1.00 22.80 C ATOM 2078 CG GLU B 695 18.594 13.554 -9.572 1.00 22.42 C ATOM 2079 CD GLU B 695 18.257 13.014 -8.192 1.00 22.90 C ATOM 2080 OE1 GLU B 695 18.255 13.806 -7.225 1.00 25.27 O ATOM 2081 OE2 GLU B 695 17.985 11.800 -8.073 1.00 21.91 O ATOM 0 H GLU B 695 17.048 13.060 -12.274 1.00 21.77 H new ATOM 0 HA GLU B 695 16.162 12.756 -9.812 1.00 22.63 H new ATOM 0 HB2 GLU B 695 17.735 14.739 -11.004 1.00 22.80 H new ATOM 0 HB3 GLU B 695 17.160 15.015 -9.581 1.00 22.80 H new ATOM 0 HG2 GLU B 695 18.844 12.819 -10.153 1.00 22.42 H new ATOM 0 HG3 GLU B 695 19.364 14.141 -9.509 1.00 22.42 H new ATOM 2082 N PRO B 696 14.210 14.376 -9.476 1.00 25.65 N ATOM 2083 CA PRO B 696 12.994 15.192 -9.483 1.00 25.78 C ATOM 2084 C PRO B 696 13.295 16.680 -9.568 1.00 26.12 C ATOM 2085 O PRO B 696 14.431 17.108 -9.370 1.00 25.12 O ATOM 2086 CB PRO B 696 12.322 14.813 -8.167 1.00 26.83 C ATOM 2087 CG PRO B 696 13.483 14.519 -7.277 1.00 28.18 C ATOM 2088 CD PRO B 696 14.374 13.693 -8.181 1.00 26.20 C ATOM 0 HA PRO B 696 12.433 15.027 -10.257 1.00 25.78 H new ATOM 0 HB2 PRO B 696 11.776 15.536 -7.820 1.00 26.83 H new ATOM 0 HB3 PRO B 696 11.741 14.043 -8.268 1.00 26.83 H new ATOM 0 HG2 PRO B 696 13.923 15.329 -6.976 1.00 28.18 H new ATOM 0 HG3 PRO B 696 13.217 14.029 -6.484 1.00 28.18 H new ATOM 0 HD2 PRO B 696 15.297 13.696 -7.883 1.00 26.20 H new ATOM 0 HD3 PRO B 696 14.092 12.766 -8.221 1.00 26.20 H new ATOM 2089 N ASP B 697 12.278 17.470 -9.882 1.00 26.58 N ATOM 2090 CA ASP B 697 12.464 18.911 -9.956 1.00 28.83 C ATOM 2091 C ASP B 697 12.451 19.456 -8.529 1.00 26.80 C ATOM 2092 O ASP B 697 12.429 18.688 -7.570 1.00 23.17 O ATOM 2093 CB ASP B 697 11.344 19.553 -10.784 1.00 32.46 C ATOM 2094 CG ASP B 697 11.422 19.183 -12.258 1.00 36.93 C ATOM 2095 OD1 ASP B 697 12.507 19.365 -12.855 1.00 38.45 O ATOM 2096 OD2 ASP B 697 10.401 18.721 -12.818 1.00 38.02 O ATOM 0 H ASP B 697 11.481 17.196 -10.054 1.00 26.58 H new ATOM 0 HA ASP B 697 13.307 19.120 -10.389 1.00 28.83 H new ATOM 0 HB2 ASP B 697 10.485 19.276 -10.429 1.00 32.46 H new ATOM 0 HB3 ASP B 697 11.391 20.518 -10.693 1.00 32.46 H new ATOM 2097 N VAL B 698 12.458 20.777 -8.389 1.00 27.46 N ATOM 2098 CA VAL B 698 12.452 21.394 -7.070 1.00 27.96 C ATOM 2099 C VAL B 698 11.119 21.122 -6.372 1.00 27.30 C ATOM 2100 O VAL B 698 10.061 21.136 -7.002 1.00 27.82 O ATOM 2101 CB VAL B 698 12.687 22.924 -7.173 1.00 30.43 C ATOM 2102 CG1 VAL B 698 11.556 23.577 -7.953 1.00 31.60 C ATOM 2103 CG2 VAL B 698 12.801 23.535 -5.784 1.00 31.45 C ATOM 0 H VAL B 698 12.466 21.333 -9.045 1.00 27.46 H new ATOM 0 HA VAL B 698 13.174 21.006 -6.550 1.00 27.96 H new ATOM 0 HB VAL B 698 13.519 23.082 -7.646 1.00 30.43 H new ATOM 0 HG11 VAL B 698 11.713 24.533 -8.011 1.00 31.60 H new ATOM 0 HG12 VAL B 698 11.519 23.201 -8.846 1.00 31.60 H new ATOM 0 HG13 VAL B 698 10.714 23.415 -7.499 1.00 31.60 H new ATOM 0 HG21 VAL B 698 12.948 24.491 -5.862 1.00 31.45 H new ATOM 0 HG22 VAL B 698 11.982 23.373 -5.291 1.00 31.45 H new ATOM 0 HG23 VAL B 698 13.547 23.131 -5.313 1.00 31.45 H new ATOM 2104 N ILE B 699 11.178 20.866 -5.070 1.00 25.98 N ATOM 2105 CA ILE B 699 9.981 20.585 -4.283 1.00 24.48 C ATOM 2106 C ILE B 699 9.826 21.615 -3.175 1.00 23.52 C ATOM 2107 O ILE B 699 10.739 21.801 -2.375 1.00 23.04 O ATOM 2108 CB ILE B 699 10.066 19.209 -3.604 1.00 23.92 C ATOM 2109 CG1 ILE B 699 10.268 18.111 -4.650 1.00 25.96 C ATOM 2110 CG2 ILE B 699 8.818 18.973 -2.779 1.00 22.49 C ATOM 2111 CD1 ILE B 699 9.155 18.024 -5.654 1.00 32.18 C ATOM 0 H ILE B 699 11.910 20.850 -4.618 1.00 25.98 H new ATOM 0 HA ILE B 699 9.230 20.610 -4.896 1.00 24.48 H new ATOM 0 HB ILE B 699 10.832 19.187 -3.009 1.00 23.92 H new ATOM 0 HG12 ILE B 699 11.103 18.270 -5.117 1.00 25.96 H new ATOM 0 HG13 ILE B 699 10.354 17.257 -4.199 1.00 25.96 H new ATOM 0 HG21 ILE B 699 8.872 18.104 -2.351 1.00 22.49 H new ATOM 0 HG22 ILE B 699 8.743 19.663 -2.101 1.00 22.49 H new ATOM 0 HG23 ILE B 699 8.039 19.000 -3.356 1.00 22.49 H new ATOM 0 HD11 ILE B 699 9.343 17.312 -6.285 1.00 32.18 H new ATOM 0 HD12 ILE B 699 8.320 17.837 -5.197 1.00 32.18 H new ATOM 0 HD13 ILE B 699 9.081 18.866 -6.130 1.00 32.18 H new ATOM 2112 N TYR B 700 8.671 22.273 -3.124 1.00 24.11 N ATOM 2113 CA TYR B 700 8.407 23.278 -2.097 1.00 23.70 C ATOM 2114 C TYR B 700 7.641 22.668 -0.932 1.00 23.88 C ATOM 2115 O TYR B 700 6.933 21.673 -1.100 1.00 24.14 O ATOM 2116 CB TYR B 700 7.592 24.441 -2.672 1.00 26.54 C ATOM 2117 CG TYR B 700 8.306 25.208 -3.758 1.00 29.38 C ATOM 2118 CD1 TYR B 700 8.187 24.839 -5.091 1.00 30.80 C ATOM 2119 CD2 TYR B 700 9.138 26.278 -3.444 1.00 30.43 C ATOM 2120 CE1 TYR B 700 8.876 25.515 -6.080 1.00 32.01 C ATOM 2121 CE2 TYR B 700 9.833 26.956 -4.427 1.00 31.78 C ATOM 2122 CZ TYR B 700 9.698 26.569 -5.740 1.00 32.29 C ATOM 2123 OH TYR B 700 10.398 27.232 -6.721 1.00 36.80 O ATOM 0 H TYR B 700 8.024 22.152 -3.677 1.00 24.11 H new ATOM 0 HA TYR B 700 9.263 23.608 -1.784 1.00 23.70 H new ATOM 0 HB2 TYR B 700 6.758 24.096 -3.027 1.00 26.54 H new ATOM 0 HB3 TYR B 700 7.364 25.051 -1.953 1.00 26.54 H new ATOM 0 HD1 TYR B 700 7.636 24.127 -5.322 1.00 30.80 H new ATOM 0 HD2 TYR B 700 9.228 26.542 -2.557 1.00 30.43 H new ATOM 0 HE1 TYR B 700 8.786 25.261 -6.970 1.00 32.01 H new ATOM 0 HE2 TYR B 700 10.388 27.668 -4.203 1.00 31.78 H new ATOM 0 HH TYR B 700 10.853 27.847 -6.374 1.00 36.80 H new ATOM 2124 N ALA B 701 7.789 23.259 0.249 1.00 22.29 N ATOM 2125 CA ALA B 701 7.088 22.764 1.428 1.00 23.69 C ATOM 2126 C ALA B 701 5.732 23.456 1.539 1.00 23.33 C ATOM 2127 O ALA B 701 4.797 22.932 2.155 1.00 23.39 O ATOM 2128 CB ALA B 701 7.912 23.030 2.681 1.00 23.25 C ATOM 0 H ALA B 701 8.288 23.945 0.389 1.00 22.29 H new ATOM 0 HA ALA B 701 6.956 21.807 1.342 1.00 23.69 H new ATOM 0 HB1 ALA B 701 7.436 22.697 3.458 1.00 23.25 H new ATOM 0 HB2 ALA B 701 8.767 22.579 2.608 1.00 23.25 H new ATOM 0 HB3 ALA B 701 8.058 23.984 2.776 1.00 23.25 H new ATOM 2129 N GLY B 702 5.635 24.635 0.936 1.00 23.01 N ATOM 2130 CA GLY B 702 4.401 25.397 0.985 1.00 23.73 C ATOM 2131 C GLY B 702 4.232 26.113 2.314 1.00 24.29 C ATOM 2132 O GLY B 702 3.121 26.477 2.693 1.00 25.25 O ATOM 0 H GLY B 702 6.272 25.008 0.495 1.00 23.01 H new ATOM 0 HA2 GLY B 702 4.393 26.046 0.265 1.00 23.73 H new ATOM 0 HA3 GLY B 702 3.648 24.803 0.840 1.00 23.73 H new ATOM 2133 N HIS B 703 5.337 26.321 3.026 1.00 23.14 N ATOM 2134 CA HIS B 703 5.295 26.994 4.319 1.00 22.00 C ATOM 2135 C HIS B 703 5.038 28.494 4.196 1.00 22.59 C ATOM 2136 O HIS B 703 5.545 29.150 3.287 1.00 21.52 O ATOM 2137 CB HIS B 703 6.609 26.778 5.066 1.00 22.16 C ATOM 2138 CG HIS B 703 6.599 27.312 6.464 1.00 22.02 C ATOM 2139 ND1 HIS B 703 6.006 26.642 7.510 1.00 21.97 N ATOM 2140 CD2 HIS B 703 7.106 28.456 6.985 1.00 22.30 C ATOM 2141 CE1 HIS B 703 6.151 27.348 8.621 1.00 22.61 C ATOM 2142 NE2 HIS B 703 6.814 28.452 8.329 1.00 22.55 N ATOM 0 H HIS B 703 6.123 26.079 2.776 1.00 23.14 H new ATOM 0 HA HIS B 703 4.555 26.604 4.810 1.00 22.00 H new ATOM 0 HB2 HIS B 703 6.805 25.828 5.092 1.00 22.16 H new ATOM 0 HB3 HIS B 703 7.327 27.202 4.571 1.00 22.16 H new ATOM 0 HD2 HIS B 703 7.565 29.119 6.521 1.00 22.30 H new ATOM 0 HE1 HIS B 703 5.839 27.107 9.463 1.00 22.61 H new ATOM 0 HE2 HIS B 703 7.029 29.069 8.889 1.00 22.55 H new ATOM 2143 N ASP B 704 4.249 29.034 5.120 1.00 23.24 N ATOM 2144 CA ASP B 704 3.937 30.460 5.124 1.00 23.88 C ATOM 2145 C ASP B 704 4.979 31.172 5.980 1.00 23.30 C ATOM 2146 O ASP B 704 4.840 31.251 7.199 1.00 23.11 O ATOM 2147 CB ASP B 704 2.539 30.697 5.709 1.00 23.85 C ATOM 2148 CG ASP B 704 2.171 32.171 5.764 1.00 25.07 C ATOM 2149 OD1 ASP B 704 3.034 33.022 5.453 1.00 25.81 O ATOM 2150 OD2 ASP B 704 1.019 32.479 6.126 1.00 24.54 O ATOM 0 H ASP B 704 3.882 28.588 5.757 1.00 23.24 H new ATOM 0 HA ASP B 704 3.951 30.803 4.217 1.00 23.88 H new ATOM 0 HB2 ASP B 704 1.883 30.223 5.174 1.00 23.85 H new ATOM 0 HB3 ASP B 704 2.499 30.323 6.603 1.00 23.85 H new ATOM 2151 N ASN B 705 6.022 31.685 5.337 1.00 25.49 N ATOM 2152 CA ASN B 705 7.093 32.376 6.043 1.00 27.58 C ATOM 2153 C ASN B 705 6.703 33.783 6.486 1.00 29.12 C ATOM 2154 O ASN B 705 7.521 34.528 7.024 1.00 29.13 O ATOM 2155 CB ASN B 705 8.341 32.426 5.164 1.00 25.84 C ATOM 2156 CG ASN B 705 8.930 31.049 4.921 1.00 25.42 C ATOM 2157 OD1 ASN B 705 9.392 30.391 5.850 1.00 26.57 O ATOM 2158 ND2 ASN B 705 8.910 30.604 3.669 1.00 24.60 N ATOM 0 H ASN B 705 6.128 31.643 4.485 1.00 25.49 H new ATOM 0 HA ASN B 705 7.275 31.871 6.851 1.00 27.58 H new ATOM 0 HB2 ASN B 705 8.118 32.835 4.313 1.00 25.84 H new ATOM 0 HB3 ASN B 705 9.008 32.991 5.585 1.00 25.84 H new ATOM 0 HD21 ASN B 705 9.229 29.827 3.484 1.00 24.60 H new ATOM 0 HD22 ASN B 705 8.578 31.093 3.044 1.00 24.60 H new ATOM 2159 N THR B 706 5.441 34.129 6.265 1.00 31.47 N ATOM 2160 CA THR B 706 4.901 35.429 6.646 1.00 33.16 C ATOM 2161 C THR B 706 4.617 35.492 8.144 1.00 33.23 C ATOM 2162 O THR B 706 4.504 36.575 8.723 1.00 33.96 O ATOM 2163 CB THR B 706 3.594 35.707 5.880 1.00 34.44 C ATOM 2164 OG1 THR B 706 3.907 36.278 4.603 1.00 36.87 O ATOM 2165 CG2 THR B 706 2.687 36.629 6.664 1.00 37.54 C ATOM 0 H THR B 706 4.868 33.612 5.886 1.00 31.47 H new ATOM 0 HA THR B 706 5.566 36.099 6.423 1.00 33.16 H new ATOM 0 HB THR B 706 3.121 34.870 5.754 1.00 34.44 H new ATOM 0 HG1 THR B 706 3.196 36.430 4.182 1.00 36.87 H new ATOM 0 HG21 THR B 706 1.873 36.788 6.161 1.00 37.54 H new ATOM 0 HG22 THR B 706 2.466 36.219 7.515 1.00 37.54 H new ATOM 0 HG23 THR B 706 3.140 37.473 6.820 1.00 37.54 H new ATOM 2166 N LYS B 707 4.519 34.326 8.776 1.00 32.71 N ATOM 2167 CA LYS B 707 4.230 34.257 10.206 1.00 31.39 C ATOM 2168 C LYS B 707 5.382 33.670 11.004 1.00 29.45 C ATOM 2169 O LYS B 707 6.174 32.901 10.481 1.00 28.83 O ATOM 2170 CB LYS B 707 2.970 33.419 10.434 1.00 33.55 C ATOM 2171 CG LYS B 707 1.784 33.899 9.617 1.00 34.88 C ATOM 2172 CD LYS B 707 0.507 33.157 9.974 1.00 38.62 C ATOM 2173 CE LYS B 707 -0.684 33.772 9.249 1.00 39.67 C ATOM 2174 NZ LYS B 707 -1.978 33.182 9.675 1.00 42.66 N ATOM 0 H LYS B 707 4.617 33.562 8.394 1.00 32.71 H new ATOM 0 HA LYS B 707 4.094 35.165 10.518 1.00 31.39 H new ATOM 0 HB2 LYS B 707 3.158 32.494 10.210 1.00 33.55 H new ATOM 0 HB3 LYS B 707 2.738 33.442 11.376 1.00 33.55 H new ATOM 0 HG2 LYS B 707 1.656 34.849 9.762 1.00 34.88 H new ATOM 0 HG3 LYS B 707 1.973 33.779 8.673 1.00 34.88 H new ATOM 0 HD2 LYS B 707 0.592 32.221 9.734 1.00 38.62 H new ATOM 0 HD3 LYS B 707 0.363 33.192 10.933 1.00 38.62 H new ATOM 0 HE2 LYS B 707 -0.699 34.728 9.412 1.00 39.67 H new ATOM 0 HE3 LYS B 707 -0.575 33.649 8.293 1.00 39.67 H new ATOM 0 HZ1 LYS B 707 -2.643 33.569 9.228 1.00 42.66 H new ATOM 0 HZ2 LYS B 707 -1.976 32.308 9.505 1.00 42.66 H new ATOM 0 HZ3 LYS B 707 -2.092 33.314 10.548 1.00 42.66 H new ATOM 2175 N PRO B 708 5.489 34.036 12.287 1.00 29.10 N ATOM 2176 CA PRO B 708 6.558 33.530 13.156 1.00 28.33 C ATOM 2177 C PRO B 708 6.439 32.011 13.267 1.00 27.22 C ATOM 2178 O PRO B 708 5.332 31.476 13.290 1.00 25.48 O ATOM 2179 CB PRO B 708 6.280 34.223 14.490 1.00 29.17 C ATOM 2180 CG PRO B 708 5.600 35.508 14.076 1.00 31.71 C ATOM 2181 CD PRO B 708 4.662 35.032 12.990 1.00 30.69 C ATOM 0 HA PRO B 708 7.456 33.708 12.835 1.00 28.33 H new ATOM 0 HB2 PRO B 708 5.711 33.684 15.062 1.00 29.17 H new ATOM 0 HB3 PRO B 708 7.098 34.393 14.983 1.00 29.17 H new ATOM 0 HG2 PRO B 708 5.123 35.920 14.813 1.00 31.71 H new ATOM 0 HG3 PRO B 708 6.234 36.164 13.746 1.00 31.71 H new ATOM 0 HD2 PRO B 708 3.853 34.640 13.355 1.00 30.69 H new ATOM 0 HD3 PRO B 708 4.388 35.755 12.404 1.00 30.69 H new ATOM 2182 N ASP B 709 7.570 31.317 13.328 1.00 25.22 N ATOM 2183 CA ASP B 709 7.540 29.862 13.441 1.00 24.79 C ATOM 2184 C ASP B 709 6.844 29.411 14.716 1.00 24.95 C ATOM 2185 O ASP B 709 6.838 30.117 15.719 1.00 23.05 O ATOM 2186 CB ASP B 709 8.951 29.263 13.482 1.00 23.60 C ATOM 2187 CG ASP B 709 9.714 29.440 12.194 1.00 23.93 C ATOM 2188 OD1 ASP B 709 9.110 29.807 11.166 1.00 24.93 O ATOM 2189 OD2 ASP B 709 10.938 29.191 12.217 1.00 23.44 O ATOM 0 H ASP B 709 8.357 31.663 13.306 1.00 25.22 H new ATOM 0 HA ASP B 709 7.059 29.554 12.657 1.00 24.79 H new ATOM 0 HB2 ASP B 709 9.449 29.676 14.205 1.00 23.60 H new ATOM 0 HB3 ASP B 709 8.888 28.317 13.685 1.00 23.60 H new ATOM 2190 N THR B 710 6.269 28.217 14.657 1.00 24.53 N ATOM 2191 CA THR B 710 5.626 27.597 15.806 1.00 25.02 C ATOM 2192 C THR B 710 5.956 26.124 15.634 1.00 24.06 C ATOM 2193 O THR B 710 6.194 25.658 14.515 1.00 23.50 O ATOM 2194 CB THR B 710 4.092 27.771 15.801 1.00 25.69 C ATOM 2195 OG1 THR B 710 3.525 27.023 14.718 1.00 23.86 O ATOM 2196 CG2 THR B 710 3.725 29.246 15.658 1.00 26.00 C ATOM 0 H THR B 710 6.241 27.740 13.942 1.00 24.53 H new ATOM 0 HA THR B 710 5.933 27.992 16.637 1.00 25.02 H new ATOM 0 HB THR B 710 3.737 27.442 16.641 1.00 25.69 H new ATOM 0 HG1 THR B 710 3.984 27.142 14.024 1.00 23.86 H new ATOM 0 HG21 THR B 710 2.760 29.341 15.656 1.00 26.00 H new ATOM 0 HG22 THR B 710 4.097 29.746 16.401 1.00 26.00 H new ATOM 0 HG23 THR B 710 4.085 29.590 14.825 1.00 26.00 H new ATOM 2197 N SER B 711 5.994 25.397 16.737 1.00 24.34 N ATOM 2198 CA SER B 711 6.299 23.984 16.677 1.00 26.01 C ATOM 2199 C SER B 711 5.340 23.297 15.704 1.00 24.84 C ATOM 2200 O SER B 711 5.759 22.511 14.854 1.00 24.50 O ATOM 2201 CB SER B 711 6.176 23.367 18.074 1.00 26.05 C ATOM 2202 OG SER B 711 6.530 21.999 18.051 1.00 31.48 O ATOM 0 H SER B 711 5.847 25.703 17.527 1.00 24.34 H new ATOM 0 HA SER B 711 7.208 23.861 16.363 1.00 26.01 H new ATOM 0 HB2 SER B 711 6.750 23.844 18.694 1.00 26.05 H new ATOM 0 HB3 SER B 711 5.266 23.465 18.396 1.00 26.05 H new ATOM 0 HG SER B 711 7.352 21.919 18.205 1.00 31.48 H new ATOM 2203 N SER B 712 4.054 23.615 15.808 1.00 24.68 N ATOM 2204 CA SER B 712 3.065 22.994 14.935 1.00 25.47 C ATOM 2205 C SER B 712 3.187 23.360 13.458 1.00 24.00 C ATOM 2206 O SER B 712 3.033 22.494 12.600 1.00 23.69 O ATOM 2207 CB SER B 712 1.649 23.305 15.426 1.00 26.84 C ATOM 2208 OG SER B 712 1.440 24.702 15.540 1.00 34.08 O ATOM 0 H SER B 712 3.736 24.182 16.371 1.00 24.68 H new ATOM 0 HA SER B 712 3.248 22.043 14.988 1.00 25.47 H new ATOM 0 HB2 SER B 712 1.001 22.928 14.811 1.00 26.84 H new ATOM 0 HB3 SER B 712 1.503 22.882 16.287 1.00 26.84 H new ATOM 0 HG SER B 712 1.802 24.983 16.244 1.00 34.08 H new ATOM 2209 N SER B 713 3.465 24.626 13.151 1.00 23.82 N ATOM 2210 CA SER B 713 3.578 25.038 11.751 1.00 22.93 C ATOM 2211 C SER B 713 4.831 24.486 11.066 1.00 21.82 C ATOM 2212 O SER B 713 4.772 24.068 9.909 1.00 23.07 O ATOM 2213 CB SER B 713 3.535 26.568 11.621 1.00 22.10 C ATOM 2214 OG SER B 713 4.667 27.183 12.217 1.00 26.49 O ATOM 0 H SER B 713 3.590 25.253 13.726 1.00 23.82 H new ATOM 0 HA SER B 713 2.811 24.657 11.295 1.00 22.93 H new ATOM 0 HB2 SER B 713 3.492 26.811 10.683 1.00 22.10 H new ATOM 0 HB3 SER B 713 2.727 26.905 12.039 1.00 22.10 H new ATOM 0 HG SER B 713 4.562 28.016 12.223 1.00 26.49 H new ATOM 2215 N LEU B 714 5.962 24.486 11.765 1.00 21.52 N ATOM 2216 CA LEU B 714 7.194 23.954 11.179 1.00 20.59 C ATOM 2217 C LEU B 714 7.080 22.453 10.933 1.00 18.74 C ATOM 2218 O LEU B 714 7.418 21.961 9.854 1.00 20.10 O ATOM 2219 CB LEU B 714 8.401 24.224 12.089 1.00 20.16 C ATOM 2220 CG LEU B 714 8.904 25.670 12.130 1.00 20.75 C ATOM 2221 CD1 LEU B 714 10.130 25.766 13.029 1.00 19.54 C ATOM 2222 CD2 LEU B 714 9.240 26.130 10.717 1.00 20.22 C ATOM 0 H LEU B 714 6.040 24.784 12.568 1.00 21.52 H new ATOM 0 HA LEU B 714 7.326 24.407 10.332 1.00 20.59 H new ATOM 0 HB2 LEU B 714 8.169 23.956 12.992 1.00 20.16 H new ATOM 0 HB3 LEU B 714 9.132 23.654 11.803 1.00 20.16 H new ATOM 0 HG LEU B 714 8.212 26.245 12.492 1.00 20.75 H new ATOM 0 HD11 LEU B 714 10.444 26.683 13.051 1.00 19.54 H new ATOM 0 HD12 LEU B 714 9.896 25.483 13.927 1.00 19.54 H new ATOM 0 HD13 LEU B 714 10.832 25.193 12.682 1.00 19.54 H new ATOM 0 HD21 LEU B 714 9.559 27.046 10.742 1.00 20.22 H new ATOM 0 HD22 LEU B 714 9.930 25.558 10.346 1.00 20.22 H new ATOM 0 HD23 LEU B 714 8.446 26.079 10.163 1.00 20.22 H new ATOM 2223 N LEU B 715 6.603 21.720 11.932 1.00 18.32 N ATOM 2224 CA LEU B 715 6.471 20.278 11.790 1.00 18.77 C ATOM 2225 C LEU B 715 5.441 19.910 10.726 1.00 19.29 C ATOM 2226 O LEU B 715 5.618 18.939 9.988 1.00 17.86 O ATOM 2227 CB LEU B 715 6.104 19.650 13.136 1.00 18.69 C ATOM 2228 CG LEU B 715 7.174 19.850 14.214 1.00 19.22 C ATOM 2229 CD1 LEU B 715 6.703 19.260 15.544 1.00 19.52 C ATOM 2230 CD2 LEU B 715 8.471 19.198 13.754 1.00 18.70 C ATOM 0 H LEU B 715 6.353 22.035 12.692 1.00 18.32 H new ATOM 0 HA LEU B 715 7.327 19.926 11.499 1.00 18.77 H new ATOM 0 HB2 LEU B 715 5.268 20.031 13.446 1.00 18.69 H new ATOM 0 HB3 LEU B 715 5.954 18.700 13.012 1.00 18.69 H new ATOM 0 HG LEU B 715 7.329 20.798 14.351 1.00 19.22 H new ATOM 0 HD11 LEU B 715 7.388 19.393 16.218 1.00 19.52 H new ATOM 0 HD12 LEU B 715 5.886 19.702 15.823 1.00 19.52 H new ATOM 0 HD13 LEU B 715 6.536 18.311 15.436 1.00 19.52 H new ATOM 0 HD21 LEU B 715 9.153 19.321 14.432 1.00 18.70 H new ATOM 0 HD22 LEU B 715 8.324 18.250 13.612 1.00 18.70 H new ATOM 0 HD23 LEU B 715 8.763 19.607 12.924 1.00 18.70 H new ATOM 2231 N THR B 716 4.370 20.693 10.638 1.00 18.96 N ATOM 2232 CA THR B 716 3.325 20.431 9.650 1.00 19.03 C ATOM 2233 C THR B 716 3.835 20.669 8.231 1.00 18.88 C ATOM 2234 O THR B 716 3.494 19.927 7.302 1.00 17.25 O ATOM 2235 CB THR B 716 2.093 21.326 9.905 1.00 19.93 C ATOM 2236 OG1 THR B 716 1.466 20.920 11.123 1.00 21.16 O ATOM 2237 CG2 THR B 716 1.092 21.232 8.751 1.00 17.86 C ATOM 0 H THR B 716 4.229 21.378 11.138 1.00 18.96 H new ATOM 0 HA THR B 716 3.069 19.500 9.740 1.00 19.03 H new ATOM 0 HB THR B 716 2.387 22.248 9.971 1.00 19.93 H new ATOM 0 HG1 THR B 716 1.817 21.328 11.768 1.00 21.16 H new ATOM 0 HG21 THR B 716 0.330 21.802 8.936 1.00 17.86 H new ATOM 0 HG22 THR B 716 1.518 21.520 7.928 1.00 17.86 H new ATOM 0 HG23 THR B 716 0.793 20.314 8.656 1.00 17.86 H new ATOM 2238 N SER B 717 4.647 21.707 8.058 1.00 18.57 N ATOM 2239 CA SER B 717 5.192 22.009 6.743 1.00 19.35 C ATOM 2240 C SER B 717 6.223 20.943 6.377 1.00 19.15 C ATOM 2241 O SER B 717 6.378 20.599 5.207 1.00 20.68 O ATOM 2242 CB SER B 717 5.835 23.402 6.730 1.00 19.08 C ATOM 2243 OG SER B 717 4.852 24.423 6.802 1.00 20.79 O ATOM 0 H SER B 717 4.892 22.243 8.684 1.00 18.57 H new ATOM 0 HA SER B 717 4.475 22.007 6.090 1.00 19.35 H new ATOM 0 HB2 SER B 717 6.447 23.485 7.478 1.00 19.08 H new ATOM 0 HB3 SER B 717 6.359 23.511 5.921 1.00 19.08 H new ATOM 0 HG SER B 717 5.229 25.173 6.841 1.00 20.79 H new ATOM 2244 N LEU B 718 6.930 20.423 7.377 1.00 18.57 N ATOM 2245 CA LEU B 718 7.912 19.374 7.123 1.00 19.26 C ATOM 2246 C LEU B 718 7.189 18.100 6.677 1.00 19.41 C ATOM 2247 O LEU B 718 7.686 17.375 5.820 1.00 18.81 O ATOM 2248 CB LEU B 718 8.766 19.102 8.368 1.00 17.61 C ATOM 2249 CG LEU B 718 9.866 20.139 8.626 1.00 18.71 C ATOM 2250 CD1 LEU B 718 10.523 19.893 9.996 1.00 19.64 C ATOM 2251 CD2 LEU B 718 10.902 20.068 7.512 1.00 18.85 C ATOM 0 H LEU B 718 6.858 20.660 8.200 1.00 18.57 H new ATOM 0 HA LEU B 718 8.509 19.669 6.418 1.00 19.26 H new ATOM 0 HB2 LEU B 718 8.184 19.065 9.143 1.00 17.61 H new ATOM 0 HB3 LEU B 718 9.176 18.228 8.280 1.00 17.61 H new ATOM 0 HG LEU B 718 9.474 21.026 8.636 1.00 18.71 H new ATOM 0 HD11 LEU B 718 11.216 20.555 10.146 1.00 19.64 H new ATOM 0 HD12 LEU B 718 9.853 19.963 10.694 1.00 19.64 H new ATOM 0 HD13 LEU B 718 10.915 19.006 10.013 1.00 19.64 H new ATOM 0 HD21 LEU B 718 11.598 20.724 7.675 1.00 18.85 H new ATOM 0 HD22 LEU B 718 11.293 19.181 7.490 1.00 18.85 H new ATOM 0 HD23 LEU B 718 10.476 20.254 6.661 1.00 18.85 H new ATOM 2252 N ASN B 719 6.013 17.835 7.244 1.00 19.54 N ATOM 2253 CA ASN B 719 5.243 16.657 6.843 1.00 19.84 C ATOM 2254 C ASN B 719 4.629 16.855 5.460 1.00 19.74 C ATOM 2255 O ASN B 719 4.488 15.903 4.698 1.00 20.24 O ATOM 2256 CB ASN B 719 4.138 16.336 7.857 1.00 18.64 C ATOM 2257 CG ASN B 719 4.660 15.562 9.051 1.00 22.23 C ATOM 2258 OD1 ASN B 719 5.706 14.925 8.968 1.00 22.00 O ATOM 2259 ND2 ASN B 719 3.928 15.597 10.161 1.00 20.10 N ATOM 0 H ASN B 719 5.647 18.317 7.855 1.00 19.54 H new ATOM 0 HA ASN B 719 5.859 15.908 6.813 1.00 19.84 H new ATOM 0 HB2 ASN B 719 3.732 17.162 8.162 1.00 18.64 H new ATOM 0 HB3 ASN B 719 3.441 15.822 7.421 1.00 18.64 H new ATOM 0 HD21 ASN B 719 4.183 15.162 10.858 1.00 20.10 H new ATOM 0 HD22 ASN B 719 3.200 16.055 10.182 1.00 20.10 H new ATOM 2260 N GLN B 720 4.270 18.093 5.135 1.00 18.20 N ATOM 2261 CA GLN B 720 3.702 18.382 3.823 1.00 19.95 C ATOM 2262 C GLN B 720 4.803 18.193 2.776 1.00 19.86 C ATOM 2263 O GLN B 720 4.571 17.642 1.697 1.00 18.49 O ATOM 2264 CB GLN B 720 3.164 19.813 3.795 1.00 20.15 C ATOM 2265 CG GLN B 720 2.536 20.234 2.474 1.00 25.86 C ATOM 2266 CD GLN B 720 1.571 21.401 2.650 1.00 30.07 C ATOM 2267 OE1 GLN B 720 1.681 22.424 1.977 1.00 31.51 O ATOM 2268 NE2 GLN B 720 0.618 21.245 3.563 1.00 33.27 N ATOM 0 H GLN B 720 4.346 18.774 5.655 1.00 18.20 H new ATOM 0 HA GLN B 720 2.964 17.783 3.631 1.00 19.95 H new ATOM 0 HB2 GLN B 720 2.503 19.910 4.498 1.00 20.15 H new ATOM 0 HB3 GLN B 720 3.890 20.422 4.002 1.00 20.15 H new ATOM 0 HG2 GLN B 720 3.235 20.484 1.849 1.00 25.86 H new ATOM 0 HG3 GLN B 720 2.064 19.480 2.086 1.00 25.86 H new ATOM 0 HE21 GLN B 720 0.571 20.515 4.016 1.00 33.27 H new ATOM 0 HE22 GLN B 720 0.048 21.874 3.701 1.00 33.27 H new ATOM 2269 N LEU B 721 6.002 18.661 3.112 1.00 19.32 N ATOM 2270 CA LEU B 721 7.164 18.522 2.246 1.00 19.50 C ATOM 2271 C LEU B 721 7.433 17.024 2.133 1.00 19.96 C ATOM 2272 O LEU B 721 7.767 16.513 1.063 1.00 20.78 O ATOM 2273 CB LEU B 721 8.377 19.216 2.881 1.00 16.41 C ATOM 2274 CG LEU B 721 9.735 19.080 2.186 1.00 18.06 C ATOM 2275 CD1 LEU B 721 9.647 19.657 0.770 1.00 17.21 C ATOM 2276 CD2 LEU B 721 10.807 19.816 2.992 1.00 16.27 C ATOM 0 H LEU B 721 6.163 19.069 3.852 1.00 19.32 H new ATOM 0 HA LEU B 721 7.008 18.925 1.378 1.00 19.50 H new ATOM 0 HB2 LEU B 721 8.174 20.162 2.952 1.00 16.41 H new ATOM 0 HB3 LEU B 721 8.472 18.878 3.785 1.00 16.41 H new ATOM 0 HG LEU B 721 9.976 18.142 2.130 1.00 18.06 H new ATOM 0 HD11 LEU B 721 10.508 19.570 0.331 1.00 17.21 H new ATOM 0 HD12 LEU B 721 8.976 19.172 0.264 1.00 17.21 H new ATOM 0 HD13 LEU B 721 9.401 20.594 0.817 1.00 17.21 H new ATOM 0 HD21 LEU B 721 11.665 19.727 2.548 1.00 16.27 H new ATOM 0 HD22 LEU B 721 10.574 20.755 3.059 1.00 16.27 H new ATOM 0 HD23 LEU B 721 10.863 19.433 3.882 1.00 16.27 H new ATOM 2277 N GLY B 722 7.283 16.331 3.258 1.00 19.45 N ATOM 2278 CA GLY B 722 7.503 14.899 3.294 1.00 19.13 C ATOM 2279 C GLY B 722 6.572 14.168 2.351 1.00 19.66 C ATOM 2280 O GLY B 722 7.004 13.287 1.609 1.00 21.38 O ATOM 0 H GLY B 722 7.053 16.677 4.011 1.00 19.45 H new ATOM 0 HA2 GLY B 722 8.423 14.706 3.055 1.00 19.13 H new ATOM 0 HA3 GLY B 722 7.370 14.573 4.198 1.00 19.13 H new ATOM 2281 N GLU B 723 5.293 14.533 2.374 1.00 19.05 N ATOM 2282 CA GLU B 723 4.300 13.908 1.503 1.00 18.29 C ATOM 2283 C GLU B 723 4.724 14.078 0.042 1.00 18.06 C ATOM 2284 O GLU B 723 4.675 13.131 -0.752 1.00 18.38 O ATOM 2285 CB GLU B 723 2.928 14.559 1.727 1.00 18.66 C ATOM 2286 CG GLU B 723 1.798 13.953 0.922 1.00 18.75 C ATOM 2287 CD GLU B 723 1.377 12.594 1.447 1.00 22.11 C ATOM 2288 OE1 GLU B 723 0.333 12.078 0.991 1.00 22.08 O ATOM 2289 OE2 GLU B 723 2.086 12.043 2.317 1.00 22.44 O ATOM 0 H GLU B 723 4.978 15.145 2.890 1.00 19.05 H new ATOM 0 HA GLU B 723 4.238 12.963 1.712 1.00 18.29 H new ATOM 0 HB2 GLU B 723 2.706 14.499 2.669 1.00 18.66 H new ATOM 0 HB3 GLU B 723 2.993 15.502 1.511 1.00 18.66 H new ATOM 0 HG2 GLU B 723 1.036 14.553 0.937 1.00 18.75 H new ATOM 0 HG3 GLU B 723 2.074 13.868 -0.004 1.00 18.75 H new ATOM 2290 N ARG B 724 5.147 15.291 -0.303 1.00 19.24 N ATOM 2291 CA ARG B 724 5.581 15.603 -1.665 1.00 19.93 C ATOM 2292 C ARG B 724 6.880 14.876 -2.032 1.00 20.69 C ATOM 2293 O ARG B 724 7.039 14.414 -3.162 1.00 20.03 O ATOM 2294 CB ARG B 724 5.737 17.119 -1.818 1.00 19.37 C ATOM 2295 CG ARG B 724 4.419 17.875 -1.632 1.00 19.63 C ATOM 2296 CD ARG B 724 4.605 19.389 -1.545 1.00 20.89 C ATOM 2297 NE ARG B 724 3.317 20.067 -1.396 1.00 21.05 N ATOM 2298 CZ ARG B 724 3.156 21.385 -1.309 1.00 22.73 C ATOM 2299 NH1 ARG B 724 4.204 22.202 -1.346 1.00 22.19 N ATOM 2300 NH2 ARG B 724 1.936 21.891 -1.212 1.00 21.87 N ATOM 0 H ARG B 724 5.191 15.955 0.242 1.00 19.24 H new ATOM 0 HA ARG B 724 4.901 15.288 -2.281 1.00 19.93 H new ATOM 0 HB2 ARG B 724 6.383 17.440 -1.170 1.00 19.37 H new ATOM 0 HB3 ARG B 724 6.096 17.316 -2.697 1.00 19.37 H new ATOM 0 HG2 ARG B 724 3.827 17.669 -2.372 1.00 19.63 H new ATOM 0 HG3 ARG B 724 3.983 17.561 -0.824 1.00 19.63 H new ATOM 0 HD2 ARG B 724 5.177 19.605 -0.792 1.00 20.89 H new ATOM 0 HD3 ARG B 724 5.053 19.710 -2.343 1.00 20.89 H new ATOM 0 HE ARG B 724 2.611 19.577 -1.362 1.00 21.05 H new ATOM 0 HH11 ARG B 724 4.997 21.880 -1.427 1.00 22.19 H new ATOM 0 HH12 ARG B 724 4.089 23.052 -1.289 1.00 22.19 H new ATOM 0 HH21 ARG B 724 1.253 21.368 -1.205 1.00 21.87 H new ATOM 0 HH22 ARG B 724 1.827 22.742 -1.156 1.00 21.87 H new ATOM 2301 N GLN B 725 7.807 14.774 -1.080 1.00 21.29 N ATOM 2302 CA GLN B 725 9.064 14.065 -1.319 1.00 21.02 C ATOM 2303 C GLN B 725 8.736 12.594 -1.594 1.00 21.99 C ATOM 2304 O GLN B 725 9.276 11.988 -2.524 1.00 21.38 O ATOM 2305 CB GLN B 725 9.986 14.153 -0.093 1.00 22.77 C ATOM 2306 CG GLN B 725 10.589 15.529 0.167 1.00 26.53 C ATOM 2307 CD GLN B 725 11.694 15.875 -0.811 1.00 30.39 C ATOM 2308 OE1 GLN B 725 12.128 14.885 -1.583 1.00 33.46 O flip ATOM 2309 NE2 GLN B 725 12.161 17.016 -0.868 1.00 30.39 N flip ATOM 0 H GLN B 725 7.728 15.107 -0.291 1.00 21.29 H new ATOM 0 HA GLN B 725 9.521 14.469 -2.074 1.00 21.02 H new ATOM 0 HB2 GLN B 725 9.484 13.882 0.692 1.00 22.77 H new ATOM 0 HB3 GLN B 725 10.708 13.515 -0.202 1.00 22.77 H new ATOM 0 HG2 GLN B 725 9.891 16.200 0.112 1.00 26.53 H new ATOM 0 HG3 GLN B 725 10.940 15.559 1.071 1.00 26.53 H new ATOM 0 HE21 GLN B 725 11.855 17.632 -0.352 1.00 30.39 H new ATOM 0 HE22 GLN B 725 12.793 17.195 -1.424 1.00 30.39 H new ATOM 2310 N LEU B 726 7.848 12.024 -0.782 1.00 20.06 N ATOM 2311 CA LEU B 726 7.454 10.626 -0.942 1.00 20.56 C ATOM 2312 C LEU B 726 6.903 10.366 -2.344 1.00 20.73 C ATOM 2313 O LEU B 726 7.291 9.390 -3.006 1.00 20.22 O ATOM 2314 CB LEU B 726 6.403 10.248 0.107 1.00 20.85 C ATOM 2315 CG LEU B 726 6.011 8.770 0.100 1.00 24.01 C ATOM 2316 CD1 LEU B 726 7.250 7.921 0.310 1.00 23.94 C ATOM 2317 CD2 LEU B 726 4.990 8.489 1.190 1.00 25.94 C ATOM 0 H LEU B 726 7.461 12.431 -0.131 1.00 20.06 H new ATOM 0 HA LEU B 726 8.244 10.077 -0.817 1.00 20.56 H new ATOM 0 HB2 LEU B 726 6.742 10.478 0.986 1.00 20.85 H new ATOM 0 HB3 LEU B 726 5.608 10.784 -0.040 1.00 20.85 H new ATOM 0 HG LEU B 726 5.612 8.549 -0.756 1.00 24.01 H new ATOM 0 HD11 LEU B 726 7.004 6.983 0.306 1.00 23.94 H new ATOM 0 HD12 LEU B 726 7.884 8.092 -0.404 1.00 23.94 H new ATOM 0 HD13 LEU B 726 7.655 8.145 1.162 1.00 23.94 H new ATOM 0 HD21 LEU B 726 4.750 7.549 1.175 1.00 25.94 H new ATOM 0 HD22 LEU B 726 5.370 8.711 2.054 1.00 25.94 H new ATOM 0 HD23 LEU B 726 4.197 9.027 1.038 1.00 25.94 H new ATOM 2318 N LEU B 727 5.998 11.235 -2.795 1.00 19.93 N ATOM 2319 CA LEU B 727 5.404 11.094 -4.124 1.00 20.86 C ATOM 2320 C LEU B 727 6.486 11.200 -5.204 1.00 20.19 C ATOM 2321 O LEU B 727 6.428 10.513 -6.229 1.00 17.94 O ATOM 2322 CB LEU B 727 4.321 12.157 -4.345 1.00 23.19 C ATOM 2323 CG LEU B 727 2.918 11.770 -3.886 1.00 29.31 C ATOM 2324 CD1 LEU B 727 2.942 11.391 -2.404 1.00 31.84 C ATOM 2325 CD2 LEU B 727 1.970 12.930 -4.151 1.00 32.40 C ATOM 0 H LEU B 727 5.715 11.912 -2.347 1.00 19.93 H new ATOM 0 HA LEU B 727 4.990 10.219 -4.185 1.00 20.86 H new ATOM 0 HB2 LEU B 727 4.585 12.967 -3.880 1.00 23.19 H new ATOM 0 HB3 LEU B 727 4.288 12.371 -5.291 1.00 23.19 H new ATOM 0 HG LEU B 727 2.604 10.998 -4.382 1.00 29.31 H new ATOM 0 HD11 LEU B 727 2.048 11.146 -2.118 1.00 31.84 H new ATOM 0 HD12 LEU B 727 3.541 10.639 -2.272 1.00 31.84 H new ATOM 0 HD13 LEU B 727 3.252 12.147 -1.881 1.00 31.84 H new ATOM 0 HD21 LEU B 727 1.076 12.690 -3.861 1.00 32.40 H new ATOM 0 HD22 LEU B 727 2.270 13.711 -3.661 1.00 32.40 H new ATOM 0 HD23 LEU B 727 1.959 13.129 -5.100 1.00 32.40 H new ATOM 2326 N SER B 728 7.485 12.039 -4.954 1.00 20.78 N ATOM 2327 CA SER B 728 8.578 12.230 -5.889 1.00 20.75 C ATOM 2328 C SER B 728 9.418 10.961 -5.966 1.00 19.85 C ATOM 2329 O SER B 728 9.871 10.580 -7.038 1.00 19.08 O ATOM 2330 CB SER B 728 9.442 13.401 -5.435 1.00 22.02 C ATOM 2331 OG SER B 728 10.434 13.678 -6.404 1.00 29.12 O ATOM 0 H SER B 728 7.545 12.511 -4.238 1.00 20.78 H new ATOM 0 HA SER B 728 8.218 12.424 -6.769 1.00 20.75 H new ATOM 0 HB2 SER B 728 8.889 14.185 -5.295 1.00 22.02 H new ATOM 0 HB3 SER B 728 9.860 13.193 -4.585 1.00 22.02 H new ATOM 0 HG SER B 728 10.291 13.217 -7.091 1.00 29.12 H new ATOM 2332 N VAL B 729 9.626 10.317 -4.822 1.00 19.82 N ATOM 2333 CA VAL B 729 10.406 9.085 -4.763 1.00 19.07 C ATOM 2334 C VAL B 729 9.718 7.967 -5.549 1.00 17.74 C ATOM 2335 O VAL B 729 10.375 7.204 -6.266 1.00 17.17 O ATOM 2336 CB VAL B 729 10.615 8.642 -3.304 1.00 20.20 C ATOM 2337 CG1 VAL B 729 11.173 7.242 -3.260 1.00 18.52 C ATOM 2338 CG2 VAL B 729 11.555 9.625 -2.592 1.00 20.23 C ATOM 0 H VAL B 729 9.321 10.580 -4.062 1.00 19.82 H new ATOM 0 HA VAL B 729 11.271 9.263 -5.165 1.00 19.07 H new ATOM 0 HB VAL B 729 9.761 8.642 -2.845 1.00 20.20 H new ATOM 0 HG11 VAL B 729 11.301 6.973 -2.337 1.00 18.52 H new ATOM 0 HG12 VAL B 729 10.553 6.633 -3.691 1.00 18.52 H new ATOM 0 HG13 VAL B 729 12.025 7.218 -3.724 1.00 18.52 H new ATOM 0 HG21 VAL B 729 11.684 9.342 -1.673 1.00 20.23 H new ATOM 0 HG22 VAL B 729 12.411 9.642 -3.048 1.00 20.23 H new ATOM 0 HG23 VAL B 729 11.165 10.513 -2.605 1.00 20.23 H new ATOM 2339 N VAL B 730 8.399 7.880 -5.425 1.00 16.95 N ATOM 2340 CA VAL B 730 7.639 6.862 -6.131 1.00 17.52 C ATOM 2341 C VAL B 730 7.797 7.045 -7.641 1.00 18.27 C ATOM 2342 O VAL B 730 8.076 6.085 -8.366 1.00 19.44 O ATOM 2343 CB VAL B 730 6.154 6.936 -5.747 1.00 19.58 C ATOM 2344 CG1 VAL B 730 5.342 6.041 -6.647 1.00 19.26 C ATOM 2345 CG2 VAL B 730 5.978 6.513 -4.297 1.00 20.42 C ATOM 0 H VAL B 730 7.925 8.404 -4.935 1.00 16.95 H new ATOM 0 HA VAL B 730 7.981 5.990 -5.878 1.00 17.52 H new ATOM 0 HB VAL B 730 5.844 7.849 -5.852 1.00 19.58 H new ATOM 0 HG11 VAL B 730 4.406 6.094 -6.397 1.00 19.26 H new ATOM 0 HG12 VAL B 730 5.447 6.327 -7.568 1.00 19.26 H new ATOM 0 HG13 VAL B 730 5.649 5.125 -6.556 1.00 19.26 H new ATOM 0 HG21 VAL B 730 5.039 6.561 -4.057 1.00 20.42 H new ATOM 0 HG22 VAL B 730 6.294 5.603 -4.185 1.00 20.42 H new ATOM 0 HG23 VAL B 730 6.488 7.105 -3.723 1.00 20.42 H new ATOM 2346 N LYS B 731 7.649 8.280 -8.102 1.00 17.86 N ATOM 2347 CA LYS B 731 7.780 8.595 -9.519 1.00 19.70 C ATOM 2348 C LYS B 731 9.187 8.272 -10.002 1.00 20.22 C ATOM 2349 O LYS B 731 9.368 7.684 -11.067 1.00 19.06 O ATOM 2350 CB LYS B 731 7.486 10.077 -9.747 1.00 23.83 C ATOM 2351 CG LYS B 731 7.919 10.609 -11.103 1.00 26.15 C ATOM 2352 CD LYS B 731 6.784 10.571 -12.084 1.00 30.96 C ATOM 2353 CE LYS B 731 7.206 11.150 -13.425 1.00 32.62 C ATOM 2354 NZ LYS B 731 6.073 11.117 -14.389 1.00 34.60 N ATOM 0 H LYS B 731 7.470 8.958 -7.604 1.00 17.86 H new ATOM 0 HA LYS B 731 7.145 8.059 -10.019 1.00 19.70 H new ATOM 0 HB2 LYS B 731 6.533 10.225 -9.645 1.00 23.83 H new ATOM 0 HB3 LYS B 731 7.929 10.592 -9.055 1.00 23.83 H new ATOM 0 HG2 LYS B 731 8.239 11.520 -11.009 1.00 26.15 H new ATOM 0 HG3 LYS B 731 8.660 10.081 -11.440 1.00 26.15 H new ATOM 0 HD2 LYS B 731 6.484 9.656 -12.202 1.00 30.96 H new ATOM 0 HD3 LYS B 731 6.032 11.073 -11.733 1.00 30.96 H new ATOM 0 HE2 LYS B 731 7.511 12.063 -13.307 1.00 32.62 H new ATOM 0 HE3 LYS B 731 7.954 10.645 -13.780 1.00 32.62 H new ATOM 0 HZ1 LYS B 731 6.335 11.459 -15.168 1.00 34.60 H new ATOM 0 HZ2 LYS B 731 5.809 10.275 -14.509 1.00 34.60 H new ATOM 0 HZ3 LYS B 731 5.396 11.597 -14.068 1.00 34.60 H new ATOM 2355 N TRP B 732 10.179 8.674 -9.219 1.00 18.69 N ATOM 2356 CA TRP B 732 11.574 8.423 -9.549 1.00 18.16 C ATOM 2357 C TRP B 732 11.875 6.930 -9.645 1.00 18.79 C ATOM 2358 O TRP B 732 12.569 6.492 -10.569 1.00 17.94 O ATOM 2359 CB TRP B 732 12.452 9.066 -8.478 1.00 19.74 C ATOM 2360 CG TRP B 732 13.857 8.590 -8.425 1.00 18.51 C ATOM 2361 CD1 TRP B 732 14.865 8.951 -9.267 1.00 20.50 C ATOM 2362 CD2 TRP B 732 14.441 7.733 -7.451 1.00 18.78 C ATOM 2363 NE1 TRP B 732 16.048 8.393 -8.869 1.00 20.17 N ATOM 2364 CE2 TRP B 732 15.817 7.649 -7.756 1.00 19.29 C ATOM 2365 CE3 TRP B 732 13.949 7.054 -6.334 1.00 16.18 C ATOM 2366 CZ2 TRP B 732 16.693 6.880 -6.997 1.00 17.78 C ATOM 2367 CZ3 TRP B 732 14.822 6.306 -5.591 1.00 19.30 C ATOM 2368 CH2 TRP B 732 16.180 6.232 -5.914 1.00 16.80 C ATOM 0 H TRP B 732 10.062 9.100 -8.481 1.00 18.69 H new ATOM 0 HA TRP B 732 11.761 8.810 -10.419 1.00 18.16 H new ATOM 0 HB2 TRP B 732 12.458 10.025 -8.622 1.00 19.74 H new ATOM 0 HB3 TRP B 732 12.043 8.911 -7.612 1.00 19.74 H new ATOM 0 HD1 TRP B 732 14.763 9.501 -10.010 1.00 20.50 H new ATOM 0 HE1 TRP B 732 16.809 8.495 -9.257 1.00 20.17 H new ATOM 0 HE3 TRP B 732 13.050 7.109 -6.101 1.00 16.18 H new ATOM 0 HZ2 TRP B 732 17.593 6.811 -7.220 1.00 17.78 H new ATOM 0 HZ3 TRP B 732 14.504 5.836 -4.854 1.00 19.30 H new ATOM 0 HH2 TRP B 732 16.747 5.728 -5.376 1.00 16.80 H new ATOM 2369 N SER B 733 11.360 6.157 -8.693 1.00 18.06 N ATOM 2370 CA SER B 733 11.587 4.712 -8.674 1.00 18.43 C ATOM 2371 C SER B 733 11.037 4.051 -9.939 1.00 19.47 C ATOM 2372 O SER B 733 11.524 2.992 -10.367 1.00 17.46 O ATOM 2373 CB SER B 733 10.927 4.086 -7.435 1.00 18.34 C ATOM 2374 OG SER B 733 9.510 4.077 -7.551 1.00 17.78 O ATOM 0 H SER B 733 10.874 6.450 -8.046 1.00 18.06 H new ATOM 0 HA SER B 733 12.545 4.561 -8.640 1.00 18.43 H new ATOM 0 HB2 SER B 733 11.249 3.179 -7.318 1.00 18.34 H new ATOM 0 HB3 SER B 733 11.185 4.583 -6.643 1.00 18.34 H new ATOM 0 HG SER B 733 9.248 4.820 -7.843 1.00 17.78 H new ATOM 2375 N LYS B 734 10.015 4.672 -10.523 1.00 19.52 N ATOM 2376 CA LYS B 734 9.396 4.150 -11.738 1.00 22.41 C ATOM 2377 C LYS B 734 10.321 4.268 -12.938 1.00 21.79 C ATOM 2378 O LYS B 734 10.170 3.530 -13.910 1.00 21.66 O ATOM 2379 CB LYS B 734 8.083 4.878 -12.033 1.00 26.05 C ATOM 2380 CG LYS B 734 6.941 4.459 -11.132 1.00 29.24 C ATOM 2381 CD LYS B 734 5.682 5.230 -11.474 1.00 32.90 C ATOM 2382 CE LYS B 734 4.510 4.756 -10.626 1.00 37.33 C ATOM 2383 NZ LYS B 734 3.261 5.516 -10.944 1.00 41.72 N ATOM 0 H LYS B 734 9.664 5.400 -10.230 1.00 19.52 H new ATOM 0 HA LYS B 734 9.216 3.210 -11.583 1.00 22.41 H new ATOM 0 HB2 LYS B 734 8.224 5.833 -11.941 1.00 26.05 H new ATOM 0 HB3 LYS B 734 7.833 4.716 -12.956 1.00 26.05 H new ATOM 0 HG2 LYS B 734 6.779 3.507 -11.227 1.00 29.24 H new ATOM 0 HG3 LYS B 734 7.180 4.615 -10.205 1.00 29.24 H new ATOM 0 HD2 LYS B 734 5.829 6.178 -11.329 1.00 32.90 H new ATOM 0 HD3 LYS B 734 5.473 5.116 -12.414 1.00 32.90 H new ATOM 0 HE2 LYS B 734 4.362 3.809 -10.777 1.00 37.33 H new ATOM 0 HE3 LYS B 734 4.725 4.863 -9.686 1.00 37.33 H new ATOM 0 HZ1 LYS B 734 2.574 5.153 -10.511 1.00 41.72 H new ATOM 0 HZ2 LYS B 734 3.356 6.364 -10.691 1.00 41.72 H new ATOM 0 HZ3 LYS B 734 3.109 5.484 -11.820 1.00 41.72 H new ATOM 2384 N SER B 735 11.279 5.186 -12.869 1.00 21.03 N ATOM 2385 CA SER B 735 12.222 5.376 -13.966 1.00 21.52 C ATOM 2386 C SER B 735 13.610 4.826 -13.646 1.00 20.10 C ATOM 2387 O SER B 735 14.484 4.792 -14.505 1.00 19.85 O ATOM 2388 CB SER B 735 12.321 6.860 -14.303 1.00 22.77 C ATOM 2389 OG SER B 735 11.045 7.369 -14.663 1.00 25.59 O ATOM 0 H SER B 735 11.400 5.709 -12.197 1.00 21.03 H new ATOM 0 HA SER B 735 11.885 4.879 -14.728 1.00 21.52 H new ATOM 0 HB2 SER B 735 12.668 7.349 -13.540 1.00 22.77 H new ATOM 0 HB3 SER B 735 12.946 6.991 -15.033 1.00 22.77 H new ATOM 0 HG SER B 735 11.005 8.186 -14.472 1.00 25.59 H new ATOM 2390 N LEU B 736 13.806 4.393 -12.406 1.00 17.09 N ATOM 2391 CA LEU B 736 15.088 3.856 -11.957 1.00 16.51 C ATOM 2392 C LEU B 736 15.361 2.472 -12.561 1.00 16.18 C ATOM 2393 O LEU B 736 14.635 1.509 -12.294 1.00 17.02 O ATOM 2394 CB LEU B 736 15.073 3.775 -10.430 1.00 14.74 C ATOM 2395 CG LEU B 736 16.310 3.247 -9.706 1.00 15.62 C ATOM 2396 CD1 LEU B 736 17.510 4.149 -9.984 1.00 14.77 C ATOM 2397 CD2 LEU B 736 16.005 3.196 -8.222 1.00 12.37 C ATOM 0 H LEU B 736 13.198 4.402 -11.798 1.00 17.09 H new ATOM 0 HA LEU B 736 15.799 4.444 -12.255 1.00 16.51 H new ATOM 0 HB2 LEU B 736 14.893 4.666 -10.091 1.00 14.74 H new ATOM 0 HB3 LEU B 736 14.322 3.217 -10.173 1.00 14.74 H new ATOM 0 HG LEU B 736 16.532 2.358 -10.024 1.00 15.62 H new ATOM 0 HD11 LEU B 736 18.289 3.804 -9.520 1.00 14.77 H new ATOM 0 HD12 LEU B 736 17.686 4.169 -10.938 1.00 14.77 H new ATOM 0 HD13 LEU B 736 17.319 5.047 -9.671 1.00 14.77 H new ATOM 0 HD21 LEU B 736 16.780 2.862 -7.743 1.00 12.37 H new ATOM 0 HD22 LEU B 736 15.789 4.087 -7.905 1.00 12.37 H new ATOM 0 HD23 LEU B 736 15.251 2.606 -8.067 1.00 12.37 H new ATOM 2398 N PRO B 737 16.415 2.352 -13.383 1.00 16.13 N ATOM 2399 CA PRO B 737 16.743 1.063 -14.008 1.00 18.70 C ATOM 2400 C PRO B 737 16.817 -0.104 -13.021 1.00 19.32 C ATOM 2401 O PRO B 737 17.518 -0.031 -12.008 1.00 19.00 O ATOM 2402 CB PRO B 737 18.088 1.341 -14.682 1.00 17.94 C ATOM 2403 CG PRO B 737 17.967 2.783 -15.062 1.00 16.39 C ATOM 2404 CD PRO B 737 17.364 3.394 -13.811 1.00 15.32 C ATOM 0 HA PRO B 737 16.053 0.773 -14.625 1.00 18.70 H new ATOM 0 HB2 PRO B 737 18.833 1.187 -14.080 1.00 17.94 H new ATOM 0 HB3 PRO B 737 18.228 0.774 -15.456 1.00 17.94 H new ATOM 0 HG2 PRO B 737 18.828 3.174 -15.278 1.00 16.39 H new ATOM 0 HG3 PRO B 737 17.397 2.907 -15.837 1.00 16.39 H new ATOM 0 HD2 PRO B 737 18.036 3.572 -13.135 1.00 15.32 H new ATOM 0 HD3 PRO B 737 16.919 4.235 -13.997 1.00 15.32 H new ATOM 2405 N GLY B 738 16.086 -1.173 -13.332 1.00 20.27 N ATOM 2406 CA GLY B 738 16.061 -2.353 -12.481 1.00 19.03 C ATOM 2407 C GLY B 738 14.919 -2.445 -11.478 1.00 21.01 C ATOM 2408 O GLY B 738 14.402 -3.534 -11.212 1.00 20.46 O ATOM 0 H GLY B 738 15.596 -1.232 -14.036 1.00 20.27 H new ATOM 0 HA2 GLY B 738 16.028 -3.137 -13.051 1.00 19.03 H new ATOM 0 HA3 GLY B 738 16.898 -2.392 -11.992 1.00 19.03 H new ATOM 2409 N PHE B 739 14.503 -1.310 -10.928 1.00 20.22 N ATOM 2410 CA PHE B 739 13.457 -1.303 -9.908 1.00 21.31 C ATOM 2411 C PHE B 739 12.105 -1.899 -10.306 1.00 21.45 C ATOM 2412 O PHE B 739 11.571 -2.749 -9.599 1.00 20.93 O ATOM 2413 CB PHE B 739 13.230 0.117 -9.386 1.00 18.42 C ATOM 2414 CG PHE B 739 12.591 0.158 -8.025 1.00 19.36 C ATOM 2415 CD1 PHE B 739 13.264 -0.339 -6.919 1.00 19.20 C ATOM 2416 CD2 PHE B 739 11.320 0.679 -7.851 1.00 18.50 C ATOM 2417 CE1 PHE B 739 12.683 -0.315 -5.661 1.00 19.93 C ATOM 2418 CE2 PHE B 739 10.731 0.708 -6.596 1.00 19.24 C ATOM 2419 CZ PHE B 739 11.415 0.208 -5.498 1.00 19.76 C ATOM 0 H PHE B 739 14.812 -0.533 -11.130 1.00 20.22 H new ATOM 0 HA PHE B 739 13.807 -1.895 -9.224 1.00 21.31 H new ATOM 0 HB2 PHE B 739 14.081 0.581 -9.351 1.00 18.42 H new ATOM 0 HB3 PHE B 739 12.670 0.599 -10.014 1.00 18.42 H new ATOM 0 HD1 PHE B 739 14.117 -0.693 -7.023 1.00 19.20 H new ATOM 0 HD2 PHE B 739 10.856 1.013 -8.584 1.00 18.50 H new ATOM 0 HE1 PHE B 739 13.146 -0.651 -4.928 1.00 19.93 H new ATOM 0 HE2 PHE B 739 9.878 1.063 -6.491 1.00 19.24 H new ATOM 0 HZ PHE B 739 11.022 0.225 -4.655 1.00 19.76 H new ATOM 2420 N ARG B 740 11.552 -1.448 -11.427 1.00 22.24 N ATOM 2421 CA ARG B 740 10.252 -1.934 -11.885 1.00 22.39 C ATOM 2422 C ARG B 740 10.218 -3.435 -12.154 1.00 22.95 C ATOM 2423 O ARG B 740 9.142 -4.020 -12.269 1.00 22.90 O ATOM 2424 CB ARG B 740 9.825 -1.194 -13.157 1.00 21.86 C ATOM 2425 CG ARG B 740 10.741 -1.468 -14.339 1.00 22.96 C ATOM 2426 CD ARG B 740 10.235 -0.844 -15.627 1.00 20.92 C ATOM 2427 NE ARG B 740 11.154 -1.136 -16.720 1.00 18.88 N ATOM 2428 CZ ARG B 740 10.906 -0.889 -18.001 1.00 20.33 C ATOM 2429 NH1 ARG B 740 9.755 -0.338 -18.369 1.00 17.18 N ATOM 2430 NH2 ARG B 740 11.812 -1.201 -18.918 1.00 17.84 N ATOM 0 H ARG B 740 11.913 -0.859 -11.939 1.00 22.24 H new ATOM 0 HA ARG B 740 9.635 -1.757 -11.158 1.00 22.39 H new ATOM 0 HB2 ARG B 740 8.920 -1.455 -13.388 1.00 21.86 H new ATOM 0 HB3 ARG B 740 9.809 -0.240 -12.981 1.00 21.86 H new ATOM 0 HG2 ARG B 740 11.627 -1.125 -14.144 1.00 22.96 H new ATOM 0 HG3 ARG B 740 10.829 -2.426 -14.461 1.00 22.96 H new ATOM 0 HD2 ARG B 740 9.353 -1.188 -15.836 1.00 20.92 H new ATOM 0 HD3 ARG B 740 10.147 0.116 -15.517 1.00 20.92 H new ATOM 0 HE ARG B 740 11.910 -1.494 -16.521 1.00 18.88 H new ATOM 0 HH11 ARG B 740 9.165 -0.139 -17.776 1.00 17.18 H new ATOM 0 HH12 ARG B 740 9.600 -0.180 -19.200 1.00 17.18 H new ATOM 0 HH21 ARG B 740 12.556 -1.562 -18.682 1.00 17.84 H new ATOM 0 HH22 ARG B 740 11.655 -1.043 -19.749 1.00 17.84 H new ATOM 2431 N ASN B 741 11.387 -4.060 -12.253 1.00 22.27 N ATOM 2432 CA ASN B 741 11.436 -5.488 -12.526 1.00 22.82 C ATOM 2433 C ASN B 741 11.378 -6.344 -11.262 1.00 22.45 C ATOM 2434 O ASN B 741 11.275 -7.568 -11.332 1.00 22.18 O ATOM 2435 CB ASN B 741 12.678 -5.816 -13.360 1.00 24.29 C ATOM 2436 CG ASN B 741 12.695 -5.067 -14.682 1.00 24.06 C ATOM 2437 OD1 ASN B 741 11.667 -4.947 -15.346 1.00 23.84 O ATOM 2438 ND2 ASN B 741 13.861 -4.561 -15.071 1.00 23.03 N ATOM 0 H ASN B 741 12.153 -3.680 -12.166 1.00 22.27 H new ATOM 0 HA ASN B 741 10.640 -5.711 -13.033 1.00 22.82 H new ATOM 0 HB2 ASN B 741 13.474 -5.593 -12.853 1.00 24.29 H new ATOM 0 HB3 ASN B 741 12.709 -6.770 -13.530 1.00 24.29 H new ATOM 0 HD21 ASN B 741 13.917 -4.130 -15.813 1.00 23.03 H new ATOM 0 HD22 ASN B 741 14.560 -4.665 -14.581 1.00 23.03 H new ATOM 2439 N LEU B 742 11.435 -5.698 -10.104 1.00 20.98 N ATOM 2440 CA LEU B 742 11.350 -6.414 -8.839 1.00 21.57 C ATOM 2441 C LEU B 742 9.864 -6.618 -8.602 1.00 20.56 C ATOM 2442 O LEU B 742 9.059 -5.844 -9.102 1.00 19.72 O ATOM 2443 CB LEU B 742 11.934 -5.568 -7.702 1.00 21.47 C ATOM 2444 CG LEU B 742 13.410 -5.177 -7.826 1.00 22.96 C ATOM 2445 CD1 LEU B 742 13.809 -4.268 -6.662 1.00 22.83 C ATOM 2446 CD2 LEU B 742 14.268 -6.440 -7.849 1.00 20.93 C ATOM 0 H LEU B 742 11.523 -4.846 -10.029 1.00 20.98 H new ATOM 0 HA LEU B 742 11.845 -7.248 -8.866 1.00 21.57 H new ATOM 0 HB2 LEU B 742 11.410 -4.755 -7.629 1.00 21.47 H new ATOM 0 HB3 LEU B 742 11.818 -6.055 -6.871 1.00 21.47 H new ATOM 0 HG LEU B 742 13.551 -4.689 -8.652 1.00 22.96 H new ATOM 0 HD11 LEU B 742 14.744 -4.025 -6.747 1.00 22.83 H new ATOM 0 HD12 LEU B 742 13.264 -3.466 -6.676 1.00 22.83 H new ATOM 0 HD13 LEU B 742 13.672 -4.736 -5.824 1.00 22.83 H new ATOM 0 HD21 LEU B 742 15.203 -6.195 -7.928 1.00 20.93 H new ATOM 0 HD22 LEU B 742 14.133 -6.938 -7.028 1.00 20.93 H new ATOM 0 HD23 LEU B 742 14.014 -6.990 -8.606 1.00 20.93 H new ATOM 2447 N HIS B 743 9.497 -7.653 -7.852 1.00 21.67 N ATOM 2448 CA HIS B 743 8.089 -7.904 -7.565 1.00 21.92 C ATOM 2449 C HIS B 743 7.471 -6.625 -6.998 1.00 21.97 C ATOM 2450 O HIS B 743 8.124 -5.884 -6.266 1.00 21.13 O ATOM 2451 CB HIS B 743 7.952 -9.039 -6.551 1.00 23.43 C ATOM 2452 CG HIS B 743 6.536 -9.419 -6.262 1.00 23.47 C ATOM 2453 ND1 HIS B 743 5.566 -8.777 -5.570 1.00 24.46 N flip ATOM 2454 CD2 HIS B 743 5.965 -10.579 -6.736 1.00 23.91 C flip ATOM 2455 CE1 HIS B 743 4.437 -9.554 -5.639 1.00 24.26 C flip ATOM 2456 NE2 HIS B 743 4.703 -10.636 -6.347 1.00 23.17 N flip ATOM 0 H HIS B 743 10.043 -8.218 -7.502 1.00 21.67 H new ATOM 0 HA HIS B 743 7.630 -8.162 -8.380 1.00 21.92 H new ATOM 0 HB2 HIS B 743 8.426 -9.817 -6.883 1.00 23.43 H new ATOM 0 HB3 HIS B 743 8.383 -8.776 -5.723 1.00 23.43 H new ATOM 0 HD2 HIS B 743 6.399 -11.222 -7.249 1.00 23.91 H new ATOM 0 HE1 HIS B 743 3.617 -9.351 -5.250 1.00 24.26 H new ATOM 0 HE2 HIS B 743 4.150 -11.270 -6.525 1.00 23.17 H new ATOM 2457 N ILE B 744 6.211 -6.365 -7.330 1.00 22.15 N ATOM 2458 CA ILE B 744 5.538 -5.157 -6.858 1.00 23.26 C ATOM 2459 C ILE B 744 5.558 -5.005 -5.336 1.00 24.05 C ATOM 2460 O ILE B 744 5.679 -3.886 -4.814 1.00 23.62 O ATOM 2461 CB ILE B 744 4.071 -5.110 -7.346 1.00 22.83 C ATOM 2462 CG1 ILE B 744 3.431 -3.780 -6.940 1.00 24.95 C ATOM 2463 CG2 ILE B 744 3.287 -6.275 -6.750 1.00 24.03 C ATOM 2464 CD1 ILE B 744 4.152 -2.543 -7.476 1.00 26.15 C ATOM 0 H ILE B 744 5.727 -6.874 -7.827 1.00 22.15 H new ATOM 0 HA ILE B 744 6.041 -4.419 -7.236 1.00 23.26 H new ATOM 0 HB ILE B 744 4.055 -5.184 -8.313 1.00 22.83 H new ATOM 0 HG12 ILE B 744 2.513 -3.767 -7.253 1.00 24.95 H new ATOM 0 HG13 ILE B 744 3.402 -3.730 -5.972 1.00 24.95 H new ATOM 0 HG21 ILE B 744 2.369 -6.239 -7.060 1.00 24.03 H new ATOM 0 HG22 ILE B 744 3.690 -7.112 -7.029 1.00 24.03 H new ATOM 0 HG23 ILE B 744 3.304 -6.215 -5.782 1.00 24.03 H new ATOM 0 HD11 ILE B 744 3.690 -1.744 -7.178 1.00 26.15 H new ATOM 0 HD12 ILE B 744 5.064 -2.531 -7.145 1.00 26.15 H new ATOM 0 HD13 ILE B 744 4.161 -2.568 -8.446 1.00 26.15 H new ATOM 2465 N ASP B 745 5.431 -6.119 -4.621 1.00 22.95 N ATOM 2466 CA ASP B 745 5.454 -6.070 -3.165 1.00 23.41 C ATOM 2467 C ASP B 745 6.824 -5.617 -2.672 1.00 21.02 C ATOM 2468 O ASP B 745 6.921 -4.886 -1.687 1.00 19.56 O ATOM 2469 CB ASP B 745 5.150 -7.438 -2.551 1.00 27.75 C ATOM 2470 CG ASP B 745 3.744 -7.918 -2.842 1.00 31.32 C ATOM 2471 OD1 ASP B 745 2.848 -7.076 -3.079 1.00 33.37 O ATOM 2472 OD2 ASP B 745 3.540 -9.149 -2.814 1.00 35.15 O ATOM 0 H ASP B 745 5.332 -6.905 -4.956 1.00 22.95 H new ATOM 0 HA ASP B 745 4.770 -5.439 -2.890 1.00 23.41 H new ATOM 0 HB2 ASP B 745 5.785 -8.088 -2.891 1.00 27.75 H new ATOM 0 HB3 ASP B 745 5.278 -7.392 -1.591 1.00 27.75 H new ATOM 2473 N ASP B 746 7.879 -6.070 -3.347 1.00 19.67 N ATOM 2474 CA ASP B 746 9.237 -5.698 -2.963 1.00 19.04 C ATOM 2475 C ASP B 746 9.463 -4.200 -3.168 1.00 18.04 C ATOM 2476 O ASP B 746 10.089 -3.534 -2.343 1.00 18.39 O ATOM 2477 CB ASP B 746 10.276 -6.470 -3.783 1.00 18.57 C ATOM 2478 CG ASP B 746 10.305 -7.955 -3.466 1.00 19.62 C ATOM 2479 OD1 ASP B 746 9.842 -8.365 -2.377 1.00 18.87 O ATOM 2480 OD2 ASP B 746 10.817 -8.717 -4.310 1.00 17.20 O ATOM 0 H ASP B 746 7.829 -6.592 -4.028 1.00 19.67 H new ATOM 0 HA ASP B 746 9.342 -5.921 -2.025 1.00 19.04 H new ATOM 0 HB2 ASP B 746 10.088 -6.350 -4.727 1.00 18.57 H new ATOM 0 HB3 ASP B 746 11.154 -6.093 -3.619 1.00 18.57 H new ATOM 2481 N GLN B 747 8.960 -3.670 -4.276 1.00 17.39 N ATOM 2482 CA GLN B 747 9.124 -2.250 -4.564 1.00 17.05 C ATOM 2483 C GLN B 747 8.497 -1.415 -3.459 1.00 16.37 C ATOM 2484 O GLN B 747 9.048 -0.390 -3.037 1.00 13.23 O ATOM 2485 CB GLN B 747 8.462 -1.898 -5.894 1.00 19.35 C ATOM 2486 CG GLN B 747 9.056 -2.622 -7.088 1.00 19.48 C ATOM 2487 CD GLN B 747 8.365 -2.239 -8.373 1.00 21.96 C ATOM 2488 OE1 GLN B 747 8.206 -1.054 -8.668 1.00 22.32 O ATOM 2489 NE2 GLN B 747 7.946 -3.235 -9.147 1.00 19.66 N ATOM 0 H GLN B 747 8.523 -4.111 -4.871 1.00 17.39 H new ATOM 0 HA GLN B 747 10.073 -2.058 -4.617 1.00 17.05 H new ATOM 0 HB2 GLN B 747 7.516 -2.106 -5.839 1.00 19.35 H new ATOM 0 HB3 GLN B 747 8.535 -0.942 -6.038 1.00 19.35 H new ATOM 0 HG2 GLN B 747 10.001 -2.415 -7.155 1.00 19.48 H new ATOM 0 HG3 GLN B 747 8.984 -3.580 -6.955 1.00 19.48 H new ATOM 0 HE21 GLN B 747 8.076 -4.050 -8.906 1.00 19.66 H new ATOM 0 HE22 GLN B 747 7.545 -3.064 -9.888 1.00 19.66 H new ATOM 2490 N ILE B 748 7.339 -1.863 -2.992 1.00 16.82 N ATOM 2491 CA ILE B 748 6.623 -1.163 -1.936 1.00 19.74 C ATOM 2492 C ILE B 748 7.407 -1.230 -0.635 1.00 18.88 C ATOM 2493 O ILE B 748 7.624 -0.213 0.024 1.00 20.04 O ATOM 2494 CB ILE B 748 5.219 -1.771 -1.733 1.00 20.60 C ATOM 2495 CG1 ILE B 748 4.347 -1.432 -2.939 1.00 24.24 C ATOM 2496 CG2 ILE B 748 4.595 -1.255 -0.431 1.00 21.45 C ATOM 2497 CD1 ILE B 748 2.975 -2.071 -2.909 1.00 26.17 C ATOM 0 H ILE B 748 6.949 -2.575 -3.275 1.00 16.82 H new ATOM 0 HA ILE B 748 6.524 -0.235 -2.200 1.00 19.74 H new ATOM 0 HB ILE B 748 5.288 -2.736 -1.660 1.00 20.60 H new ATOM 0 HG12 ILE B 748 4.244 -0.469 -2.991 1.00 24.24 H new ATOM 0 HG13 ILE B 748 4.806 -1.712 -3.747 1.00 24.24 H new ATOM 0 HG21 ILE B 748 3.714 -1.645 -0.317 1.00 21.45 H new ATOM 0 HG22 ILE B 748 5.158 -1.504 0.319 1.00 21.45 H new ATOM 0 HG23 ILE B 748 4.518 -0.289 -0.470 1.00 21.45 H new ATOM 0 HD11 ILE B 748 2.480 -1.813 -3.702 1.00 26.17 H new ATOM 0 HD12 ILE B 748 3.068 -3.036 -2.887 1.00 26.17 H new ATOM 0 HD13 ILE B 748 2.497 -1.774 -2.119 1.00 26.17 H new ATOM 2498 N THR B 749 7.842 -2.433 -0.275 1.00 19.77 N ATOM 2499 CA THR B 749 8.605 -2.629 0.946 1.00 19.16 C ATOM 2500 C THR B 749 9.860 -1.747 0.980 1.00 18.45 C ATOM 2501 O THR B 749 10.122 -1.082 1.977 1.00 17.44 O ATOM 2502 CB THR B 749 9.017 -4.105 1.104 1.00 19.60 C ATOM 2503 OG1 THR B 749 7.842 -4.913 1.232 1.00 20.04 O ATOM 2504 CG2 THR B 749 9.892 -4.289 2.339 1.00 19.79 C ATOM 0 H THR B 749 7.704 -3.151 -0.728 1.00 19.77 H new ATOM 0 HA THR B 749 8.028 -2.373 1.683 1.00 19.16 H new ATOM 0 HB THR B 749 9.522 -4.373 0.321 1.00 19.60 H new ATOM 0 HG1 THR B 749 7.511 -5.049 0.472 1.00 20.04 H new ATOM 0 HG21 THR B 749 10.142 -5.223 2.423 1.00 19.79 H new ATOM 0 HG22 THR B 749 10.692 -3.747 2.253 1.00 19.79 H new ATOM 0 HG23 THR B 749 9.400 -4.014 3.128 1.00 19.79 H new ATOM 2505 N LEU B 750 10.617 -1.741 -0.117 1.00 16.58 N ATOM 2506 CA LEU B 750 11.845 -0.950 -0.220 1.00 17.08 C ATOM 2507 C LEU B 750 11.604 0.550 -0.087 1.00 17.08 C ATOM 2508 O LEU B 750 12.409 1.260 0.518 1.00 14.30 O ATOM 2509 CB LEU B 750 12.559 -1.250 -1.545 1.00 15.96 C ATOM 2510 CG LEU B 750 13.049 -2.696 -1.657 1.00 16.70 C ATOM 2511 CD1 LEU B 750 13.580 -2.985 -3.062 1.00 15.25 C ATOM 2512 CD2 LEU B 750 14.123 -2.921 -0.611 1.00 13.95 C ATOM 0 H LEU B 750 10.433 -2.196 -0.823 1.00 16.58 H new ATOM 0 HA LEU B 750 12.407 -1.212 0.526 1.00 17.08 H new ATOM 0 HB2 LEU B 750 11.955 -1.062 -2.280 1.00 15.96 H new ATOM 0 HB3 LEU B 750 13.316 -0.651 -1.640 1.00 15.96 H new ATOM 0 HG LEU B 750 12.311 -3.305 -1.501 1.00 16.70 H new ATOM 0 HD11 LEU B 750 13.884 -3.905 -3.110 1.00 15.25 H new ATOM 0 HD12 LEU B 750 12.873 -2.845 -3.711 1.00 15.25 H new ATOM 0 HD13 LEU B 750 14.320 -2.389 -3.257 1.00 15.25 H new ATOM 0 HD21 LEU B 750 14.445 -3.834 -0.669 1.00 13.95 H new ATOM 0 HD22 LEU B 750 14.859 -2.309 -0.766 1.00 13.95 H new ATOM 0 HD23 LEU B 750 13.753 -2.764 0.272 1.00 13.95 H new ATOM 2513 N ILE B 751 10.510 1.040 -0.662 1.00 16.80 N ATOM 2514 CA ILE B 751 10.197 2.457 -0.559 1.00 17.53 C ATOM 2515 C ILE B 751 9.784 2.791 0.877 1.00 17.74 C ATOM 2516 O ILE B 751 10.207 3.804 1.430 1.00 17.12 O ATOM 2517 CB ILE B 751 9.066 2.857 -1.545 1.00 18.17 C ATOM 2518 CG1 ILE B 751 9.602 2.807 -2.979 1.00 17.80 C ATOM 2519 CG2 ILE B 751 8.554 4.254 -1.219 1.00 17.45 C ATOM 2520 CD1 ILE B 751 8.545 2.989 -4.074 1.00 18.67 C ATOM 0 H ILE B 751 9.943 0.574 -1.111 1.00 16.80 H new ATOM 0 HA ILE B 751 10.991 2.962 -0.794 1.00 17.53 H new ATOM 0 HB ILE B 751 8.328 2.234 -1.458 1.00 18.17 H new ATOM 0 HG12 ILE B 751 10.276 3.497 -3.082 1.00 17.80 H new ATOM 0 HG13 ILE B 751 10.045 1.955 -3.115 1.00 17.80 H new ATOM 0 HG21 ILE B 751 7.849 4.493 -1.840 1.00 17.45 H new ATOM 0 HG22 ILE B 751 8.206 4.268 -0.314 1.00 17.45 H new ATOM 0 HG23 ILE B 751 9.281 4.891 -1.295 1.00 17.45 H new ATOM 0 HD11 ILE B 751 8.970 2.944 -4.945 1.00 18.67 H new ATOM 0 HD12 ILE B 751 7.880 2.286 -4.002 1.00 18.67 H new ATOM 0 HD13 ILE B 751 8.115 3.852 -3.969 1.00 18.67 H new ATOM 2521 N GLN B 752 8.984 1.925 1.488 1.00 18.95 N ATOM 2522 CA GLN B 752 8.535 2.149 2.860 1.00 20.05 C ATOM 2523 C GLN B 752 9.673 2.051 3.879 1.00 19.77 C ATOM 2524 O GLN B 752 9.665 2.747 4.882 1.00 21.50 O ATOM 2525 CB GLN B 752 7.430 1.152 3.219 1.00 21.36 C ATOM 2526 CG GLN B 752 6.223 1.223 2.278 1.00 24.44 C ATOM 2527 CD GLN B 752 5.066 0.354 2.725 1.00 24.97 C ATOM 2528 OE1 GLN B 752 5.256 -0.776 3.176 1.00 25.85 O ATOM 2529 NE2 GLN B 752 3.851 0.874 2.584 1.00 26.95 N ATOM 0 H GLN B 752 8.689 1.202 1.128 1.00 18.95 H new ATOM 0 HA GLN B 752 8.192 3.055 2.901 1.00 20.05 H new ATOM 0 HB2 GLN B 752 7.795 0.253 3.200 1.00 21.36 H new ATOM 0 HB3 GLN B 752 7.134 1.319 4.128 1.00 21.36 H new ATOM 0 HG2 GLN B 752 5.923 2.143 2.215 1.00 24.44 H new ATOM 0 HG3 GLN B 752 6.498 0.953 1.388 1.00 24.44 H new ATOM 0 HE21 GLN B 752 3.757 1.667 2.265 1.00 26.95 H new ATOM 0 HE22 GLN B 752 3.159 0.417 2.812 1.00 26.95 H new ATOM 2530 N TYR B 753 10.644 1.180 3.628 1.00 19.25 N ATOM 2531 CA TYR B 753 11.779 1.016 4.538 1.00 18.49 C ATOM 2532 C TYR B 753 12.772 2.175 4.455 1.00 20.69 C ATOM 2533 O TYR B 753 13.298 2.628 5.474 1.00 23.43 O ATOM 2534 CB TYR B 753 12.566 -0.249 4.202 1.00 18.62 C ATOM 2535 CG TYR B 753 12.006 -1.563 4.692 1.00 21.04 C ATOM 2536 CD1 TYR B 753 10.876 -1.624 5.499 1.00 18.31 C ATOM 2537 CD2 TYR B 753 12.639 -2.754 4.358 1.00 21.32 C ATOM 2538 CE1 TYR B 753 10.401 -2.841 5.959 1.00 19.74 C ATOM 2539 CE2 TYR B 753 12.177 -3.960 4.807 1.00 22.92 C ATOM 2540 CZ TYR B 753 11.063 -4.006 5.606 1.00 22.16 C ATOM 2541 OH TYR B 753 10.632 -5.232 6.048 1.00 24.76 O ATOM 0 H TYR B 753 10.667 0.672 2.935 1.00 19.25 H new ATOM 0 HA TYR B 753 11.392 0.974 5.427 1.00 18.49 H new ATOM 0 HB2 TYR B 753 12.653 -0.301 3.237 1.00 18.62 H new ATOM 0 HB3 TYR B 753 13.461 -0.151 4.563 1.00 18.62 H new ATOM 0 HD1 TYR B 753 10.434 -0.840 5.732 1.00 18.31 H new ATOM 0 HD2 TYR B 753 13.395 -2.730 3.816 1.00 21.32 H new ATOM 0 HE1 TYR B 753 9.645 -2.876 6.500 1.00 19.74 H new ATOM 0 HE2 TYR B 753 12.616 -4.745 4.572 1.00 22.92 H new ATOM 0 HH TYR B 753 9.833 -5.174 6.300 1.00 24.76 H new ATOM 2542 N SER B 754 13.020 2.649 3.236 1.00 17.64 N ATOM 2543 CA SER B 754 14.006 3.692 2.993 1.00 18.25 C ATOM 2544 C SER B 754 13.567 5.151 2.858 1.00 17.53 C ATOM 2545 O SER B 754 14.424 6.025 2.739 1.00 16.19 O ATOM 2546 CB SER B 754 14.795 3.334 1.732 1.00 18.00 C ATOM 2547 OG SER B 754 13.966 3.480 0.583 1.00 17.57 O ATOM 0 H SER B 754 12.619 2.373 2.527 1.00 17.64 H new ATOM 0 HA SER B 754 14.506 3.688 3.824 1.00 18.25 H new ATOM 0 HB2 SER B 754 15.573 3.908 1.654 1.00 18.00 H new ATOM 0 HB3 SER B 754 15.120 2.422 1.792 1.00 18.00 H new ATOM 0 HG SER B 754 13.460 2.813 0.515 1.00 17.57 H new ATOM 2548 N TRP B 755 12.270 5.439 2.879 1.00 17.40 N ATOM 2549 CA TRP B 755 11.862 6.827 2.684 1.00 17.90 C ATOM 2550 C TRP B 755 12.568 7.862 3.570 1.00 17.73 C ATOM 2551 O TRP B 755 13.027 8.881 3.062 1.00 16.64 O ATOM 2552 CB TRP B 755 10.343 6.986 2.798 1.00 19.32 C ATOM 2553 CG TRP B 755 9.772 6.750 4.150 1.00 24.24 C ATOM 2554 CD1 TRP B 755 9.567 5.549 4.758 1.00 26.46 C ATOM 2555 CD2 TRP B 755 9.330 7.750 5.074 1.00 25.73 C ATOM 2556 NE1 TRP B 755 9.025 5.737 6.013 1.00 28.07 N ATOM 2557 CE2 TRP B 755 8.879 7.082 6.231 1.00 25.99 C ATOM 2558 CE3 TRP B 755 9.286 9.146 5.040 1.00 27.03 C ATOM 2559 CZ2 TRP B 755 8.376 7.760 7.334 1.00 27.45 C ATOM 2560 CZ3 TRP B 755 8.786 9.817 6.140 1.00 29.01 C ATOM 2561 CH2 TRP B 755 8.345 9.124 7.272 1.00 26.96 C ATOM 0 H TRP B 755 11.634 4.873 2.999 1.00 17.40 H new ATOM 0 HA TRP B 755 12.152 7.026 1.780 1.00 17.90 H new ATOM 0 HB2 TRP B 755 10.106 7.883 2.517 1.00 19.32 H new ATOM 0 HB3 TRP B 755 9.922 6.373 2.175 1.00 19.32 H new ATOM 0 HD1 TRP B 755 9.764 4.722 4.382 1.00 26.46 H new ATOM 0 HE1 TRP B 755 8.814 5.114 6.566 1.00 28.07 H new ATOM 0 HE3 TRP B 755 9.586 9.613 4.294 1.00 27.03 H new ATOM 0 HZ2 TRP B 755 8.072 7.303 8.085 1.00 27.45 H new ATOM 0 HZ3 TRP B 755 8.742 10.746 6.127 1.00 29.01 H new ATOM 0 HH2 TRP B 755 8.023 9.604 8.001 1.00 26.96 H new ATOM 2562 N MET B 756 12.669 7.609 4.876 1.00 15.42 N ATOM 2563 CA MET B 756 13.330 8.564 5.766 1.00 17.05 C ATOM 2564 C MET B 756 14.803 8.746 5.384 1.00 17.22 C ATOM 2565 O MET B 756 15.309 9.875 5.361 1.00 16.64 O ATOM 2566 CB MET B 756 13.226 8.107 7.224 1.00 15.25 C ATOM 2567 CG MET B 756 13.703 9.151 8.220 1.00 16.74 C ATOM 2568 SD MET B 756 12.583 10.578 8.343 1.00 21.70 S ATOM 2569 CE MET B 756 11.319 9.878 9.396 1.00 22.02 C ATOM 0 H MET B 756 12.367 6.902 5.261 1.00 15.42 H new ATOM 0 HA MET B 756 12.878 9.417 5.669 1.00 17.05 H new ATOM 0 HB2 MET B 756 12.303 7.881 7.420 1.00 15.25 H new ATOM 0 HB3 MET B 756 13.747 7.297 7.340 1.00 15.25 H new ATOM 0 HG2 MET B 756 13.792 8.740 9.094 1.00 16.74 H new ATOM 0 HG3 MET B 756 14.585 9.460 7.960 1.00 16.74 H new ATOM 0 HE1 MET B 756 10.456 9.950 8.958 1.00 22.02 H new ATOM 0 HE2 MET B 756 11.519 8.944 9.564 1.00 22.02 H new ATOM 0 HE3 MET B 756 11.295 10.360 10.238 1.00 22.02 H new ATOM 2570 N SER B 757 15.478 7.637 5.085 1.00 16.69 N ATOM 2571 CA SER B 757 16.887 7.664 4.685 1.00 18.20 C ATOM 2572 C SER B 757 17.059 8.520 3.445 1.00 17.51 C ATOM 2573 O SER B 757 17.951 9.357 3.388 1.00 16.83 O ATOM 2574 CB SER B 757 17.402 6.253 4.368 1.00 18.00 C ATOM 2575 OG SER B 757 17.364 5.421 5.512 1.00 24.93 O ATOM 0 H SER B 757 15.134 6.849 5.108 1.00 16.69 H new ATOM 0 HA SER B 757 17.393 8.032 5.426 1.00 18.20 H new ATOM 0 HB2 SER B 757 16.864 5.861 3.663 1.00 18.00 H new ATOM 0 HB3 SER B 757 18.311 6.306 4.034 1.00 18.00 H new ATOM 0 HG SER B 757 18.148 5.260 5.768 1.00 24.93 H new ATOM 2576 N LEU B 758 16.203 8.299 2.450 1.00 18.79 N ATOM 2577 CA LEU B 758 16.267 9.054 1.201 1.00 18.01 C ATOM 2578 C LEU B 758 15.996 10.537 1.429 1.00 17.08 C ATOM 2579 O LEU B 758 16.633 11.393 0.815 1.00 15.50 O ATOM 2580 CB LEU B 758 15.259 8.502 0.192 1.00 16.25 C ATOM 2581 CG LEU B 758 15.569 7.119 -0.379 1.00 20.31 C ATOM 2582 CD1 LEU B 758 14.500 6.728 -1.389 1.00 21.56 C ATOM 2583 CD2 LEU B 758 16.941 7.138 -1.040 1.00 19.12 C ATOM 0 H LEU B 758 15.574 7.713 2.479 1.00 18.79 H new ATOM 0 HA LEU B 758 17.166 8.957 0.849 1.00 18.01 H new ATOM 0 HB2 LEU B 758 14.388 8.468 0.618 1.00 16.25 H new ATOM 0 HB3 LEU B 758 15.191 9.129 -0.545 1.00 16.25 H new ATOM 0 HG LEU B 758 15.573 6.465 0.338 1.00 20.31 H new ATOM 0 HD11 LEU B 758 14.700 5.850 -1.749 1.00 21.56 H new ATOM 0 HD12 LEU B 758 13.634 6.708 -0.953 1.00 21.56 H new ATOM 0 HD13 LEU B 758 14.483 7.376 -2.110 1.00 21.56 H new ATOM 0 HD21 LEU B 758 17.138 6.260 -1.403 1.00 19.12 H new ATOM 0 HD22 LEU B 758 16.946 7.792 -1.756 1.00 19.12 H new ATOM 0 HD23 LEU B 758 17.614 7.374 -0.383 1.00 19.12 H new ATOM 2584 N MET B 759 15.054 10.844 2.315 1.00 17.87 N ATOM 2585 CA MET B 759 14.734 12.236 2.589 1.00 17.23 C ATOM 2586 C MET B 759 15.867 13.006 3.254 1.00 16.35 C ATOM 2587 O MET B 759 16.231 14.082 2.801 1.00 17.71 O ATOM 2588 CB MET B 759 13.477 12.335 3.445 1.00 20.51 C ATOM 2589 CG MET B 759 12.256 12.715 2.640 1.00 23.14 C ATOM 2590 SD MET B 759 10.786 12.888 3.638 1.00 26.30 S ATOM 2591 CE MET B 759 9.741 11.647 2.844 1.00 24.70 C ATOM 0 H MET B 759 14.596 10.269 2.761 1.00 17.87 H new ATOM 0 HA MET B 759 14.585 12.649 1.724 1.00 17.23 H new ATOM 0 HB2 MET B 759 13.320 11.484 3.883 1.00 20.51 H new ATOM 0 HB3 MET B 759 13.617 12.992 4.145 1.00 20.51 H new ATOM 0 HG2 MET B 759 12.427 13.551 2.178 1.00 23.14 H new ATOM 0 HG3 MET B 759 12.101 12.041 1.960 1.00 23.14 H new ATOM 0 HE1 MET B 759 8.944 11.506 3.378 1.00 24.70 H new ATOM 0 HE2 MET B 759 9.487 11.955 1.960 1.00 24.70 H new ATOM 0 HE3 MET B 759 10.230 10.813 2.767 1.00 24.70 H new ATOM 2592 N VAL B 760 16.423 12.462 4.330 1.00 16.76 N ATOM 2593 CA VAL B 760 17.502 13.144 5.024 1.00 16.58 C ATOM 2594 C VAL B 760 18.751 13.257 4.143 1.00 16.61 C ATOM 2595 O VAL B 760 19.480 14.245 4.219 1.00 16.98 O ATOM 2596 CB VAL B 760 17.844 12.435 6.367 1.00 18.23 C ATOM 2597 CG1 VAL B 760 18.465 11.076 6.112 1.00 17.72 C ATOM 2598 CG2 VAL B 760 18.761 13.315 7.200 1.00 16.92 C ATOM 0 H VAL B 760 16.192 11.707 4.670 1.00 16.76 H new ATOM 0 HA VAL B 760 17.194 14.042 5.224 1.00 16.58 H new ATOM 0 HB VAL B 760 17.024 12.292 6.866 1.00 18.23 H new ATOM 0 HG11 VAL B 760 18.671 10.650 6.959 1.00 17.72 H new ATOM 0 HG12 VAL B 760 17.841 10.523 5.616 1.00 17.72 H new ATOM 0 HG13 VAL B 760 19.281 11.184 5.598 1.00 17.72 H new ATOM 0 HG21 VAL B 760 18.969 12.867 8.035 1.00 16.92 H new ATOM 0 HG22 VAL B 760 19.581 13.483 6.710 1.00 16.92 H new ATOM 0 HG23 VAL B 760 18.319 14.158 7.388 1.00 16.92 H new ATOM 2599 N PHE B 761 18.991 12.252 3.304 1.00 17.25 N ATOM 2600 CA PHE B 761 20.147 12.260 2.406 1.00 15.43 C ATOM 2601 C PHE B 761 19.947 13.392 1.409 1.00 16.27 C ATOM 2602 O PHE B 761 20.876 14.149 1.113 1.00 15.73 O ATOM 2603 CB PHE B 761 20.255 10.927 1.663 1.00 15.06 C ATOM 2604 CG PHE B 761 21.631 10.639 1.109 1.00 17.23 C ATOM 2605 CD1 PHE B 761 22.730 10.551 1.952 1.00 17.09 C ATOM 2606 CD2 PHE B 761 21.815 10.408 -0.244 1.00 16.47 C ATOM 2607 CE1 PHE B 761 23.991 10.232 1.454 1.00 18.39 C ATOM 2608 CE2 PHE B 761 23.076 10.088 -0.751 1.00 18.92 C ATOM 2609 CZ PHE B 761 24.162 10.000 0.104 1.00 19.02 C ATOM 0 H PHE B 761 18.495 11.553 3.238 1.00 17.25 H new ATOM 0 HA PHE B 761 20.964 12.388 2.913 1.00 15.43 H new ATOM 0 HB2 PHE B 761 20.003 10.210 2.266 1.00 15.06 H new ATOM 0 HB3 PHE B 761 19.616 10.922 0.934 1.00 15.06 H new ATOM 0 HD1 PHE B 761 22.623 10.707 2.862 1.00 17.09 H new ATOM 0 HD2 PHE B 761 21.089 10.467 -0.822 1.00 16.47 H new ATOM 0 HE1 PHE B 761 24.718 10.175 2.031 1.00 18.39 H new ATOM 0 HE2 PHE B 761 23.187 9.934 -1.662 1.00 18.92 H new ATOM 0 HZ PHE B 761 25.003 9.785 -0.230 1.00 19.02 H new ATOM 2610 N GLY B 762 18.721 13.507 0.902 1.00 15.52 N ATOM 2611 CA GLY B 762 18.406 14.566 -0.041 1.00 16.37 C ATOM 2612 C GLY B 762 18.609 15.913 0.624 1.00 16.74 C ATOM 2613 O GLY B 762 19.192 16.823 0.032 1.00 16.50 O ATOM 0 H GLY B 762 18.065 12.984 1.092 1.00 15.52 H new ATOM 0 HA2 GLY B 762 18.972 14.493 -0.825 1.00 16.37 H new ATOM 0 HA3 GLY B 762 17.489 14.479 -0.345 1.00 16.37 H new ATOM 2614 N LEU B 763 18.120 16.044 1.856 1.00 15.65 N ATOM 2615 CA LEU B 763 18.278 17.284 2.606 1.00 17.75 C ATOM 2616 C LEU B 763 19.770 17.628 2.671 1.00 18.18 C ATOM 2617 O LEU B 763 20.170 18.785 2.502 1.00 15.24 O ATOM 2618 CB LEU B 763 17.728 17.120 4.027 1.00 18.40 C ATOM 2619 CG LEU B 763 18.147 18.195 5.035 1.00 16.73 C ATOM 2620 CD1 LEU B 763 17.527 19.531 4.643 1.00 17.30 C ATOM 2621 CD2 LEU B 763 17.695 17.786 6.439 1.00 19.90 C ATOM 0 H LEU B 763 17.694 15.425 2.274 1.00 15.65 H new ATOM 0 HA LEU B 763 17.787 17.995 2.165 1.00 17.75 H new ATOM 0 HB2 LEU B 763 16.759 17.105 3.980 1.00 18.40 H new ATOM 0 HB3 LEU B 763 18.009 16.256 4.366 1.00 18.40 H new ATOM 0 HG LEU B 763 19.113 18.286 5.033 1.00 16.73 H new ATOM 0 HD11 LEU B 763 17.793 20.211 5.282 1.00 17.30 H new ATOM 0 HD12 LEU B 763 17.833 19.782 3.757 1.00 17.30 H new ATOM 0 HD13 LEU B 763 16.560 19.451 4.640 1.00 17.30 H new ATOM 0 HD21 LEU B 763 17.961 18.467 7.076 1.00 19.90 H new ATOM 0 HD22 LEU B 763 16.730 17.690 6.453 1.00 19.90 H new ATOM 0 HD23 LEU B 763 18.107 16.941 6.679 1.00 19.90 H new ATOM 2622 N GLY B 764 20.588 16.607 2.907 1.00 18.80 N ATOM 2623 CA GLY B 764 22.022 16.816 2.985 1.00 18.40 C ATOM 2624 C GLY B 764 22.565 17.397 1.692 1.00 19.41 C ATOM 2625 O GLY B 764 23.299 18.396 1.697 1.00 16.67 O ATOM 0 H GLY B 764 20.333 15.794 3.023 1.00 18.80 H new ATOM 0 HA2 GLY B 764 22.224 17.414 3.721 1.00 18.40 H new ATOM 0 HA3 GLY B 764 22.464 15.974 3.174 1.00 18.40 H new ATOM 2626 N TRP B 765 22.199 16.780 0.571 1.00 19.11 N ATOM 2627 CA TRP B 765 22.665 17.252 -0.727 1.00 21.70 C ATOM 2628 C TRP B 765 22.227 18.687 -1.004 1.00 20.57 C ATOM 2629 O TRP B 765 23.040 19.522 -1.396 1.00 20.53 O ATOM 2630 CB TRP B 765 22.145 16.360 -1.844 1.00 21.45 C ATOM 2631 CG TRP B 765 22.757 16.693 -3.153 1.00 23.03 C ATOM 2632 CD1 TRP B 765 22.117 17.189 -4.246 1.00 24.37 C ATOM 2633 CD2 TRP B 765 24.122 16.549 -3.524 1.00 22.56 C ATOM 2634 NE1 TRP B 765 22.995 17.365 -5.280 1.00 23.21 N ATOM 2635 CE2 TRP B 765 24.229 16.985 -4.861 1.00 23.44 C ATOM 2636 CE3 TRP B 765 25.266 16.110 -2.858 1.00 24.66 C ATOM 2637 CZ2 TRP B 765 25.445 16.968 -5.547 1.00 25.06 C ATOM 2638 CZ3 TRP B 765 26.457 16.098 -3.540 1.00 26.90 C ATOM 2639 CH2 TRP B 765 26.542 16.528 -4.865 1.00 26.00 C ATOM 0 H TRP B 765 21.685 16.091 0.541 1.00 19.11 H new ATOM 0 HA TRP B 765 23.634 17.221 -0.701 1.00 21.70 H new ATOM 0 HB2 TRP B 765 22.330 15.432 -1.628 1.00 21.45 H new ATOM 0 HB3 TRP B 765 21.181 16.450 -1.906 1.00 21.45 H new ATOM 0 HD1 TRP B 765 21.208 17.382 -4.285 1.00 24.37 H new ATOM 0 HE1 TRP B 765 22.799 17.665 -6.062 1.00 23.21 H new ATOM 0 HE3 TRP B 765 25.223 15.832 -1.972 1.00 24.66 H new ATOM 0 HZ2 TRP B 765 25.505 17.245 -6.433 1.00 25.06 H new ATOM 0 HZ3 TRP B 765 27.224 15.797 -3.110 1.00 26.90 H new ATOM 0 HH2 TRP B 765 27.367 16.514 -5.294 1.00 26.00 H new ATOM 2640 N ARG B 766 20.939 18.962 -0.822 1.00 21.23 N ATOM 2641 CA ARG B 766 20.403 20.300 -1.066 1.00 20.57 C ATOM 2642 C ARG B 766 21.104 21.377 -0.231 1.00 20.25 C ATOM 2643 O ARG B 766 21.428 22.461 -0.737 1.00 19.02 O ATOM 2644 CB ARG B 766 18.902 20.322 -0.772 1.00 20.30 C ATOM 2645 CG ARG B 766 18.097 19.458 -1.713 1.00 20.98 C ATOM 2646 CD ARG B 766 16.651 19.920 -1.726 1.00 20.09 C ATOM 2647 NE ARG B 766 15.982 19.707 -0.440 1.00 19.70 N ATOM 2648 CZ ARG B 766 15.589 18.518 0.027 1.00 16.52 C ATOM 2649 NH1 ARG B 766 15.785 17.397 -0.681 1.00 15.37 N ATOM 2650 NH2 ARG B 766 15.010 18.434 1.217 1.00 17.17 N ATOM 0 H ARG B 766 20.357 18.387 -0.557 1.00 21.23 H new ATOM 0 HA ARG B 766 20.565 20.505 -2.000 1.00 20.57 H new ATOM 0 HB2 ARG B 766 18.753 20.024 0.139 1.00 20.30 H new ATOM 0 HB3 ARG B 766 18.581 21.236 -0.827 1.00 20.30 H new ATOM 0 HG2 ARG B 766 18.469 19.506 -2.608 1.00 20.98 H new ATOM 0 HG3 ARG B 766 18.146 18.530 -1.435 1.00 20.98 H new ATOM 0 HD2 ARG B 766 16.618 20.863 -1.952 1.00 20.09 H new ATOM 0 HD3 ARG B 766 16.169 19.445 -2.421 1.00 20.09 H new ATOM 0 HE ARG B 766 15.831 20.397 0.050 1.00 19.70 H new ATOM 0 HH11 ARG B 766 16.169 17.435 -1.449 1.00 15.37 H new ATOM 0 HH12 ARG B 766 15.526 16.639 -0.367 1.00 15.37 H new ATOM 0 HH21 ARG B 766 14.888 19.144 1.687 1.00 17.17 H new ATOM 0 HH22 ARG B 766 14.757 17.670 1.519 1.00 17.17 H new ATOM 2651 N SER B 767 21.343 21.084 1.041 1.00 19.18 N ATOM 2652 CA SER B 767 21.984 22.049 1.926 1.00 21.82 C ATOM 2653 C SER B 767 23.417 22.300 1.476 1.00 22.73 C ATOM 2654 O SER B 767 23.907 23.431 1.494 1.00 22.93 O ATOM 2655 CB SER B 767 21.976 21.522 3.361 1.00 21.64 C ATOM 2656 OG SER B 767 20.651 21.238 3.790 1.00 20.37 O ATOM 0 H SER B 767 21.143 20.334 1.411 1.00 19.18 H new ATOM 0 HA SER B 767 21.492 22.884 1.890 1.00 21.82 H new ATOM 0 HB2 SER B 767 22.517 20.719 3.418 1.00 21.64 H new ATOM 0 HB3 SER B 767 22.378 22.177 3.952 1.00 21.64 H new ATOM 0 HG SER B 767 20.398 20.510 3.456 1.00 20.37 H new ATOM 2657 N TYR B 768 24.083 21.235 1.066 1.00 21.99 N ATOM 2658 CA TYR B 768 25.464 21.310 0.626 1.00 21.82 C ATOM 2659 C TYR B 768 25.617 22.119 -0.647 1.00 22.10 C ATOM 2660 O TYR B 768 26.567 22.894 -0.789 1.00 20.27 O ATOM 2661 CB TYR B 768 25.965 19.893 0.398 1.00 24.16 C ATOM 2662 CG TYR B 768 27.299 19.777 -0.279 1.00 26.84 C ATOM 2663 CD1 TYR B 768 28.409 20.489 0.179 1.00 27.36 C ATOM 2664 CD2 TYR B 768 27.478 18.881 -1.320 1.00 28.42 C ATOM 2665 CE1 TYR B 768 29.651 20.291 -0.378 1.00 28.27 C ATOM 2666 CE2 TYR B 768 28.716 18.680 -1.879 1.00 29.27 C ATOM 2667 CZ TYR B 768 29.797 19.378 -1.400 1.00 30.59 C ATOM 2668 OH TYR B 768 31.047 19.106 -1.900 1.00 31.06 O ATOM 0 H TYR B 768 23.746 20.444 1.035 1.00 21.99 H new ATOM 0 HA TYR B 768 25.984 21.759 1.311 1.00 21.82 H new ATOM 0 HB2 TYR B 768 26.016 19.443 1.256 1.00 24.16 H new ATOM 0 HB3 TYR B 768 25.308 19.417 -0.134 1.00 24.16 H new ATOM 0 HD1 TYR B 768 28.308 21.104 0.869 1.00 27.36 H new ATOM 0 HD2 TYR B 768 26.747 18.407 -1.646 1.00 28.42 H new ATOM 0 HE1 TYR B 768 30.386 20.769 -0.068 1.00 28.27 H new ATOM 0 HE2 TYR B 768 28.822 18.075 -2.577 1.00 29.27 H new ATOM 0 HH TYR B 768 31.063 18.323 -2.203 1.00 31.06 H new ATOM 2669 N LYS B 769 24.686 21.927 -1.569 1.00 21.14 N ATOM 2670 CA LYS B 769 24.752 22.592 -2.859 1.00 23.26 C ATOM 2671 C LYS B 769 24.250 24.027 -2.918 1.00 22.18 C ATOM 2672 O LYS B 769 24.841 24.863 -3.608 1.00 22.62 O ATOM 2673 CB LYS B 769 23.996 21.754 -3.895 1.00 24.28 C ATOM 2674 CG ALYS B 769 24.565 20.365 -4.100 0.50 22.26 C ATOM 2675 CG BLYS B 769 23.890 22.400 -5.268 0.50 26.35 C ATOM 2676 CD ALYS B 769 25.732 20.343 -5.083 0.50 22.40 C ATOM 2677 CD BLYS B 769 23.326 21.427 -6.315 0.50 27.43 C ATOM 2678 CE ALYS B 769 27.047 20.793 -4.469 0.50 21.89 C ATOM 2679 CE BLYS B 769 22.170 22.052 -7.104 0.50 29.12 C ATOM 2680 NZ ALYS B 769 28.159 20.621 -5.451 0.50 20.11 N ATOM 2681 NZ BLYS B 769 21.645 21.134 -8.162 0.50 30.53 N ATOM 0 H LYS B 769 24.004 21.413 -1.466 1.00 21.14 H new ATOM 0 HA LYS B 769 25.701 22.659 -3.048 1.00 23.26 H new ATOM 0 HB2ALYS B 769 23.069 21.676 -3.620 0.50 24.28 H new ATOM 0 HB2BLYS B 769 24.439 20.896 -3.987 0.50 24.28 H new ATOM 0 HB3ALYS B 769 24.002 22.224 -4.744 0.50 24.28 H new ATOM 0 HB3BLYS B 769 23.102 21.578 -3.562 0.50 24.28 H new ATOM 0 HG2ALYS B 769 24.860 20.012 -3.246 0.50 26.35 H new ATOM 0 HG2BLYS B 769 23.320 23.183 -5.214 0.50 26.35 H new ATOM 0 HG3ALYS B 769 23.864 19.777 -4.423 0.50 26.35 H new ATOM 0 HG3BLYS B 769 24.766 22.706 -5.550 0.50 26.35 H new ATOM 0 HD2ALYS B 769 25.836 19.444 -5.431 0.50 27.43 H new ATOM 0 HD2BLYS B 769 24.032 21.165 -6.927 0.50 27.43 H new ATOM 0 HD3ALYS B 769 25.522 20.916 -5.837 0.50 27.43 H new ATOM 0 HD3BLYS B 769 23.018 20.620 -5.874 0.50 27.43 H new ATOM 0 HE2ALYS B 769 26.985 21.723 -4.200 0.50 29.12 H new ATOM 0 HE2BLYS B 769 21.452 22.283 -6.494 0.50 29.12 H new ATOM 0 HE3ALYS B 769 27.231 20.278 -3.668 0.50 29.12 H new ATOM 0 HE3BLYS B 769 22.470 22.878 -7.515 0.50 29.12 H new ATOM 0 HZ1ALYS B 769 28.924 20.887 -5.083 0.50 30.53 H new ATOM 0 HZ1BLYS B 769 20.978 21.532 -8.596 0.50 30.53 H new ATOM 0 HZ2ALYS B 769 28.223 19.763 -5.680 0.50 30.53 H new ATOM 0 HZ2BLYS B 769 22.297 20.938 -8.736 0.50 30.53 H new ATOM 0 HZ3ALYS B 769 27.993 21.110 -6.176 0.50 30.53 H new ATOM 0 HZ3BLYS B 769 21.348 20.385 -7.785 0.50 30.53 H new ATOM 2682 N HIS B 770 23.167 24.320 -2.210 1.00 20.52 N ATOM 2683 CA HIS B 770 22.589 25.658 -2.251 1.00 21.13 C ATOM 2684 C HIS B 770 23.105 26.659 -1.221 1.00 22.01 C ATOM 2685 O HIS B 770 23.230 27.852 -1.519 1.00 20.92 O ATOM 2686 CB HIS B 770 21.067 25.543 -2.168 1.00 22.60 C ATOM 2687 CG HIS B 770 20.473 24.802 -3.324 1.00 26.07 C ATOM 2688 ND1 HIS B 770 20.037 23.502 -3.226 1.00 28.41 N ATOM 2689 CD2 HIS B 770 20.299 25.174 -4.609 1.00 26.39 C ATOM 2690 CE1 HIS B 770 19.601 23.102 -4.414 1.00 27.82 C ATOM 2691 NE2 HIS B 770 19.749 24.093 -5.263 1.00 29.33 N ATOM 0 H HIS B 770 22.753 23.763 -1.702 1.00 20.52 H new ATOM 0 HA HIS B 770 22.881 26.034 -3.096 1.00 21.13 H new ATOM 0 HB2 HIS B 770 20.826 25.093 -1.343 1.00 22.60 H new ATOM 0 HB3 HIS B 770 20.682 26.432 -2.128 1.00 22.60 H new ATOM 0 HD1 HIS B 770 20.045 23.025 -2.510 1.00 28.41 H new ATOM 0 HD2 HIS B 770 20.509 26.000 -4.981 1.00 26.39 H new ATOM 0 HE1 HIS B 770 19.251 22.263 -4.611 1.00 27.82 H new ATOM 2692 N VAL B 771 23.380 26.195 -0.007 1.00 21.17 N ATOM 2693 CA VAL B 771 23.854 27.089 1.033 1.00 20.62 C ATOM 2694 C VAL B 771 25.128 26.616 1.715 1.00 21.05 C ATOM 2695 O VAL B 771 25.274 26.712 2.930 1.00 21.54 O ATOM 2696 CB VAL B 771 22.736 27.358 2.071 1.00 21.30 C ATOM 2697 CG1 VAL B 771 21.660 28.229 1.430 1.00 18.82 C ATOM 2698 CG2 VAL B 771 22.135 26.059 2.559 1.00 17.57 C ATOM 0 H VAL B 771 23.299 25.372 0.231 1.00 21.17 H new ATOM 0 HA VAL B 771 24.086 27.920 0.590 1.00 20.62 H new ATOM 0 HB VAL B 771 23.116 27.818 2.836 1.00 21.30 H new ATOM 0 HG11 VAL B 771 20.956 28.401 2.075 1.00 18.82 H new ATOM 0 HG12 VAL B 771 22.051 29.070 1.146 1.00 18.82 H new ATOM 0 HG13 VAL B 771 21.288 27.770 0.661 1.00 18.82 H new ATOM 0 HG21 VAL B 771 21.438 26.248 3.207 1.00 17.57 H new ATOM 0 HG22 VAL B 771 21.756 25.576 1.808 1.00 17.57 H new ATOM 0 HG23 VAL B 771 22.825 25.519 2.975 1.00 17.57 H new ATOM 2699 N SER B 772 26.055 26.109 0.907 1.00 20.69 N ATOM 2700 CA SER B 772 27.355 25.671 1.393 1.00 20.92 C ATOM 2701 C SER B 772 27.283 24.761 2.603 1.00 19.87 C ATOM 2702 O SER B 772 28.234 24.682 3.372 1.00 20.56 O ATOM 2703 CB SER B 772 28.198 26.905 1.735 1.00 22.46 C ATOM 2704 OG SER B 772 28.239 27.792 0.633 1.00 20.38 O ATOM 0 H SER B 772 25.945 26.010 0.060 1.00 20.69 H new ATOM 0 HA SER B 772 27.759 25.149 0.683 1.00 20.92 H new ATOM 0 HB2 SER B 772 27.824 27.356 2.508 1.00 22.46 H new ATOM 0 HB3 SER B 772 29.098 26.634 1.974 1.00 22.46 H new ATOM 0 HG SER B 772 28.702 28.464 0.831 1.00 20.38 H new ATOM 2705 N GLY B 773 26.154 24.082 2.772 1.00 19.82 N ATOM 2706 CA GLY B 773 25.989 23.185 3.904 1.00 19.19 C ATOM 2707 C GLY B 773 25.821 23.879 5.249 1.00 19.46 C ATOM 2708 O GLY B 773 25.725 23.216 6.282 1.00 20.37 O ATOM 0 H GLY B 773 25.476 24.127 2.245 1.00 19.82 H new ATOM 0 HA2 GLY B 773 25.214 22.623 3.745 1.00 19.19 H new ATOM 0 HA3 GLY B 773 26.760 22.598 3.951 1.00 19.19 H new ATOM 2709 N GLN B 774 25.746 25.206 5.252 1.00 20.43 N ATOM 2710 CA GLN B 774 25.626 25.934 6.512 1.00 20.08 C ATOM 2711 C GLN B 774 24.213 26.315 6.963 1.00 20.05 C ATOM 2712 O GLN B 774 24.038 27.123 7.880 1.00 19.49 O ATOM 2713 CB GLN B 774 26.531 27.168 6.468 1.00 19.50 C ATOM 2714 CG GLN B 774 27.973 26.790 6.189 1.00 19.30 C ATOM 2715 CD GLN B 774 28.360 25.518 6.920 1.00 19.68 C ATOM 2716 OE1 GLN B 774 28.356 25.473 8.152 1.00 19.84 O ATOM 2717 NE2 GLN B 774 28.672 24.471 6.166 1.00 17.48 N ATOM 0 H GLN B 774 25.762 25.698 4.547 1.00 20.43 H new ATOM 0 HA GLN B 774 25.909 25.302 7.191 1.00 20.08 H new ATOM 0 HB2 GLN B 774 26.216 27.777 5.782 1.00 19.50 H new ATOM 0 HB3 GLN B 774 26.477 27.641 7.313 1.00 19.50 H new ATOM 0 HG2 GLN B 774 28.099 26.668 5.235 1.00 19.30 H new ATOM 0 HG3 GLN B 774 28.558 27.514 6.463 1.00 19.30 H new ATOM 0 HE21 GLN B 774 28.664 24.541 5.309 1.00 17.48 H new ATOM 0 HE22 GLN B 774 28.882 23.723 6.535 1.00 17.48 H new ATOM 2718 N MET B 775 23.214 25.732 6.315 1.00 20.22 N ATOM 2719 CA MET B 775 21.813 25.958 6.662 1.00 20.90 C ATOM 2720 C MET B 775 21.098 24.676 6.275 1.00 19.37 C ATOM 2721 O MET B 775 21.600 23.921 5.455 1.00 20.75 O ATOM 2722 CB MET B 775 21.201 27.104 5.853 1.00 22.28 C ATOM 2723 CG MET B 775 21.767 28.482 6.099 1.00 24.85 C ATOM 2724 SD MET B 775 20.862 29.682 5.096 1.00 26.10 S ATOM 2725 CE MET B 775 19.608 30.132 6.231 1.00 31.43 C ATOM 0 H MET B 775 23.328 25.190 5.657 1.00 20.22 H new ATOM 0 HA MET B 775 21.732 26.188 7.601 1.00 20.90 H new ATOM 0 HB2 MET B 775 21.303 26.898 4.911 1.00 22.28 H new ATOM 0 HB3 MET B 775 20.249 27.130 6.036 1.00 22.28 H new ATOM 0 HG2 MET B 775 21.695 28.710 7.039 1.00 24.85 H new ATOM 0 HG3 MET B 775 22.710 28.501 5.874 1.00 24.85 H new ATOM 0 HE1 MET B 775 18.832 30.454 5.746 1.00 31.43 H new ATOM 0 HE2 MET B 775 19.359 29.359 6.762 1.00 31.43 H new ATOM 0 HE3 MET B 775 19.937 30.833 6.815 1.00 31.43 H new ATOM 2726 N LEU B 776 19.937 24.420 6.863 1.00 19.65 N ATOM 2727 CA LEU B 776 19.182 23.231 6.505 1.00 18.74 C ATOM 2728 C LEU B 776 18.233 23.671 5.396 1.00 19.70 C ATOM 2729 O LEU B 776 17.281 24.420 5.632 1.00 20.44 O ATOM 2730 CB LEU B 776 18.414 22.683 7.716 1.00 19.17 C ATOM 2731 CG LEU B 776 19.260 21.964 8.780 1.00 20.49 C ATOM 2732 CD1 LEU B 776 18.360 21.464 9.917 1.00 19.25 C ATOM 2733 CD2 LEU B 776 20.013 20.794 8.136 1.00 17.84 C ATOM 0 H LEU B 776 19.573 24.916 7.464 1.00 19.65 H new ATOM 0 HA LEU B 776 19.761 22.511 6.210 1.00 18.74 H new ATOM 0 HB2 LEU B 776 17.948 23.420 8.142 1.00 19.17 H new ATOM 0 HB3 LEU B 776 17.737 22.067 7.396 1.00 19.17 H new ATOM 0 HG LEU B 776 19.906 22.586 9.151 1.00 20.49 H new ATOM 0 HD11 LEU B 776 18.901 21.012 10.583 1.00 19.25 H new ATOM 0 HD12 LEU B 776 17.907 22.218 10.326 1.00 19.25 H new ATOM 0 HD13 LEU B 776 17.703 20.846 9.561 1.00 19.25 H new ATOM 0 HD21 LEU B 776 20.546 20.342 8.809 1.00 17.84 H new ATOM 0 HD22 LEU B 776 19.376 20.169 7.755 1.00 17.84 H new ATOM 0 HD23 LEU B 776 20.594 21.129 7.436 1.00 17.84 H new ATOM 2734 N TYR B 777 18.521 23.224 4.179 1.00 17.08 N ATOM 2735 CA TYR B 777 17.721 23.583 3.014 1.00 18.90 C ATOM 2736 C TYR B 777 16.655 22.518 2.742 1.00 19.05 C ATOM 2737 O TYR B 777 16.804 21.703 1.835 1.00 19.07 O ATOM 2738 CB TYR B 777 18.644 23.717 1.799 1.00 20.06 C ATOM 2739 CG TYR B 777 18.060 24.450 0.607 1.00 20.13 C ATOM 2740 CD1 TYR B 777 18.408 25.769 0.343 1.00 22.14 C ATOM 2741 CD2 TYR B 777 17.215 23.805 -0.286 1.00 21.76 C ATOM 2742 CE1 TYR B 777 17.940 26.420 -0.782 1.00 23.46 C ATOM 2743 CE2 TYR B 777 16.740 24.450 -1.417 1.00 21.94 C ATOM 2744 CZ TYR B 777 17.108 25.754 -1.660 1.00 23.89 C ATOM 2745 OH TYR B 777 16.661 26.388 -2.799 1.00 24.25 O ATOM 0 H TYR B 777 19.184 22.705 4.005 1.00 17.08 H new ATOM 0 HA TYR B 777 17.272 24.426 3.184 1.00 18.90 H new ATOM 0 HB2 TYR B 777 19.452 24.177 2.076 1.00 20.06 H new ATOM 0 HB3 TYR B 777 18.907 22.828 1.514 1.00 20.06 H new ATOM 0 HD1 TYR B 777 18.966 26.221 0.934 1.00 22.14 H new ATOM 0 HD2 TYR B 777 16.963 22.925 -0.122 1.00 21.76 H new ATOM 0 HE1 TYR B 777 18.184 27.302 -0.947 1.00 23.46 H new ATOM 0 HE2 TYR B 777 16.176 24.005 -2.008 1.00 21.94 H new ATOM 0 HH TYR B 777 17.234 26.948 -3.052 1.00 24.25 H new ATOM 2746 N PHE B 778 15.588 22.515 3.539 1.00 19.33 N ATOM 2747 CA PHE B 778 14.508 21.545 3.354 1.00 18.20 C ATOM 2748 C PHE B 778 13.862 21.764 1.991 1.00 18.99 C ATOM 2749 O PHE B 778 13.645 20.815 1.235 1.00 19.54 O ATOM 2750 CB PHE B 778 13.459 21.679 4.472 1.00 17.02 C ATOM 2751 CG PHE B 778 13.970 21.294 5.836 1.00 17.26 C ATOM 2752 CD1 PHE B 778 14.420 22.259 6.729 1.00 18.85 C ATOM 2753 CD2 PHE B 778 13.995 19.964 6.229 1.00 16.98 C ATOM 2754 CE1 PHE B 778 14.883 21.902 7.991 1.00 18.60 C ATOM 2755 CE2 PHE B 778 14.456 19.597 7.486 1.00 18.52 C ATOM 2756 CZ PHE B 778 14.901 20.562 8.370 1.00 19.51 C ATOM 0 H PHE B 778 15.470 23.064 4.191 1.00 19.33 H new ATOM 0 HA PHE B 778 14.877 20.649 3.395 1.00 18.20 H new ATOM 0 HB2 PHE B 778 13.145 22.596 4.501 1.00 17.02 H new ATOM 0 HB3 PHE B 778 12.694 21.124 4.254 1.00 17.02 H new ATOM 0 HD1 PHE B 778 14.411 23.155 6.480 1.00 18.85 H new ATOM 0 HD2 PHE B 778 13.698 19.308 5.641 1.00 16.98 H new ATOM 0 HE1 PHE B 778 15.180 22.557 8.581 1.00 18.60 H new ATOM 0 HE2 PHE B 778 14.465 18.701 7.734 1.00 18.52 H new ATOM 0 HZ PHE B 778 15.210 20.318 9.212 1.00 19.51 H new ATOM 2757 N ALA B 779 13.568 23.026 1.688 1.00 18.29 N ATOM 2758 CA ALA B 779 12.970 23.430 0.414 1.00 18.09 C ATOM 2759 C ALA B 779 13.276 24.915 0.211 1.00 19.64 C ATOM 2760 O ALA B 779 13.682 25.600 1.146 1.00 20.54 O ATOM 2761 CB ALA B 779 11.441 23.198 0.433 1.00 15.76 C ATOM 0 H ALA B 779 13.712 23.683 2.224 1.00 18.29 H new ATOM 0 HA ALA B 779 13.338 22.902 -0.312 1.00 18.09 H new ATOM 0 HB1 ALA B 779 11.062 23.470 -0.417 1.00 15.76 H new ATOM 0 HB2 ALA B 779 11.258 22.257 0.582 1.00 15.76 H new ATOM 0 HB3 ALA B 779 11.043 23.721 1.147 1.00 15.76 H new ATOM 2762 N PRO B 780 13.092 25.433 -1.014 1.00 21.17 N ATOM 2763 CA PRO B 780 13.369 26.853 -1.260 1.00 22.36 C ATOM 2764 C PRO B 780 12.567 27.780 -0.342 1.00 23.11 C ATOM 2765 O PRO B 780 13.045 28.849 0.036 1.00 22.54 O ATOM 2766 CB PRO B 780 12.995 27.023 -2.727 1.00 22.77 C ATOM 2767 CG PRO B 780 13.328 25.679 -3.302 1.00 23.61 C ATOM 2768 CD PRO B 780 12.758 24.739 -2.267 1.00 19.90 C ATOM 0 HA PRO B 780 14.290 27.094 -1.072 1.00 22.36 H new ATOM 0 HB2 PRO B 780 12.056 27.241 -2.838 1.00 22.77 H new ATOM 0 HB3 PRO B 780 13.503 27.733 -3.150 1.00 22.77 H new ATOM 0 HG2 PRO B 780 12.923 25.547 -4.173 1.00 23.61 H new ATOM 0 HG3 PRO B 780 14.284 25.559 -3.413 1.00 23.61 H new ATOM 0 HD2 PRO B 780 11.801 24.619 -2.372 1.00 19.90 H new ATOM 0 HD3 PRO B 780 13.162 23.858 -2.314 1.00 19.90 H new ATOM 2769 N ASP B 781 11.358 27.356 0.023 1.00 23.08 N ATOM 2770 CA ASP B 781 10.498 28.149 0.894 1.00 20.92 C ATOM 2771 C ASP B 781 10.552 27.693 2.356 1.00 21.49 C ATOM 2772 O ASP B 781 9.723 28.092 3.173 1.00 19.68 O ATOM 2773 CB ASP B 781 9.054 28.118 0.379 1.00 20.91 C ATOM 2774 CG ASP B 781 8.462 26.717 0.360 1.00 24.13 C ATOM 2775 OD1 ASP B 781 9.227 25.730 0.437 1.00 21.83 O ATOM 2776 OD2 ASP B 781 7.222 26.603 0.253 1.00 26.21 O ATOM 0 H ASP B 781 11.017 26.607 -0.226 1.00 23.08 H new ATOM 0 HA ASP B 781 10.833 29.059 0.872 1.00 20.92 H new ATOM 0 HB2 ASP B 781 8.504 28.689 0.938 1.00 20.91 H new ATOM 0 HB3 ASP B 781 9.027 28.488 -0.517 1.00 20.91 H new ATOM 2777 N LEU B 782 11.525 26.849 2.683 1.00 20.14 N ATOM 2778 CA LEU B 782 11.689 26.380 4.057 1.00 20.55 C ATOM 2779 C LEU B 782 13.164 26.119 4.306 1.00 20.82 C ATOM 2780 O LEU B 782 13.640 24.984 4.187 1.00 18.34 O ATOM 2781 CB LEU B 782 10.885 25.097 4.314 1.00 18.88 C ATOM 2782 CG LEU B 782 10.891 24.612 5.770 1.00 20.36 C ATOM 2783 CD1 LEU B 782 10.363 25.720 6.670 1.00 21.37 C ATOM 2784 CD2 LEU B 782 10.036 23.356 5.921 1.00 21.04 C ATOM 0 H LEU B 782 12.101 26.536 2.126 1.00 20.14 H new ATOM 0 HA LEU B 782 11.356 27.061 4.662 1.00 20.55 H new ATOM 0 HB2 LEU B 782 9.966 25.246 4.040 1.00 18.88 H new ATOM 0 HB3 LEU B 782 11.238 24.391 3.750 1.00 18.88 H new ATOM 0 HG LEU B 782 11.800 24.391 6.028 1.00 20.36 H new ATOM 0 HD11 LEU B 782 10.365 25.417 7.592 1.00 21.37 H new ATOM 0 HD12 LEU B 782 10.929 26.503 6.586 1.00 21.37 H new ATOM 0 HD13 LEU B 782 9.457 25.947 6.407 1.00 21.37 H new ATOM 0 HD21 LEU B 782 10.051 23.063 6.846 1.00 21.04 H new ATOM 0 HD22 LEU B 782 9.123 23.552 5.659 1.00 21.04 H new ATOM 0 HD23 LEU B 782 10.390 22.653 5.354 1.00 21.04 H new ATOM 2785 N ILE B 783 13.880 27.189 4.640 1.00 20.02 N ATOM 2786 CA ILE B 783 15.310 27.124 4.914 1.00 20.06 C ATOM 2787 C ILE B 783 15.567 27.576 6.346 1.00 20.08 C ATOM 2788 O ILE B 783 15.091 28.630 6.761 1.00 17.32 O ATOM 2789 CB ILE B 783 16.100 28.053 3.975 1.00 20.14 C ATOM 2790 CG1 ILE B 783 15.913 27.621 2.521 1.00 21.29 C ATOM 2791 CG2 ILE B 783 17.573 28.024 4.336 1.00 21.90 C ATOM 2792 CD1 ILE B 783 16.456 28.627 1.511 1.00 23.38 C ATOM 0 H ILE B 783 13.546 27.978 4.714 1.00 20.02 H new ATOM 0 HA ILE B 783 15.600 26.209 4.777 1.00 20.06 H new ATOM 0 HB ILE B 783 15.765 28.957 4.078 1.00 20.14 H new ATOM 0 HG12 ILE B 783 16.354 26.768 2.386 1.00 21.29 H new ATOM 0 HG13 ILE B 783 14.968 27.482 2.352 1.00 21.29 H new ATOM 0 HG21 ILE B 783 18.064 28.611 3.740 1.00 21.90 H new ATOM 0 HG22 ILE B 783 17.688 28.323 5.252 1.00 21.90 H new ATOM 0 HG23 ILE B 783 17.910 27.119 4.247 1.00 21.90 H new ATOM 0 HD11 ILE B 783 16.307 28.295 0.612 1.00 23.38 H new ATOM 0 HD12 ILE B 783 16.000 29.476 1.622 1.00 23.38 H new ATOM 0 HD13 ILE B 783 17.407 28.751 1.656 1.00 23.38 H new ATOM 2793 N LEU B 784 16.311 26.778 7.103 1.00 20.37 N ATOM 2794 CA LEU B 784 16.605 27.139 8.481 1.00 21.19 C ATOM 2795 C LEU B 784 18.085 27.370 8.737 1.00 21.64 C ATOM 2796 O LEU B 784 18.879 26.432 8.624 1.00 20.93 O ATOM 2797 CB LEU B 784 16.148 26.043 9.451 1.00 22.00 C ATOM 2798 CG LEU B 784 14.744 25.438 9.399 1.00 24.31 C ATOM 2799 CD1 LEU B 784 14.462 24.771 10.745 1.00 23.78 C ATOM 2800 CD2 LEU B 784 13.712 26.506 9.129 1.00 24.45 C ATOM 0 H LEU B 784 16.651 26.033 6.841 1.00 20.37 H new ATOM 0 HA LEU B 784 16.122 27.967 8.630 1.00 21.19 H new ATOM 0 HB2 LEU B 784 16.772 25.307 9.353 1.00 22.00 H new ATOM 0 HB3 LEU B 784 16.265 26.397 10.346 1.00 22.00 H new ATOM 0 HG LEU B 784 14.696 24.788 8.681 1.00 24.31 H new ATOM 0 HD11 LEU B 784 13.574 24.380 10.733 1.00 23.78 H new ATOM 0 HD12 LEU B 784 15.119 24.076 10.906 1.00 23.78 H new ATOM 0 HD13 LEU B 784 14.514 25.433 11.452 1.00 23.78 H new ATOM 0 HD21 LEU B 784 12.830 26.104 9.100 1.00 24.45 H new ATOM 0 HD22 LEU B 784 13.741 27.170 9.835 1.00 24.45 H new ATOM 0 HD23 LEU B 784 13.901 26.931 8.278 1.00 24.45 H new ATOM 2801 N ASN B 785 18.463 28.606 9.063 1.00 21.16 N ATOM 2802 CA ASN B 785 19.855 28.867 9.421 1.00 21.44 C ATOM 2803 C ASN B 785 19.894 28.436 10.885 1.00 20.52 C ATOM 2804 O ASN B 785 18.852 28.103 11.454 1.00 21.52 O ATOM 2805 CB ASN B 785 20.244 30.356 9.271 1.00 20.06 C ATOM 2806 CG ASN B 785 19.305 31.301 10.007 1.00 21.63 C ATOM 2807 OD1 ASN B 785 18.710 30.950 11.024 1.00 20.43 O ATOM 2808 ND2 ASN B 785 19.189 32.524 9.497 1.00 21.89 N ATOM 0 H ASN B 785 17.943 29.291 9.083 1.00 21.16 H new ATOM 0 HA ASN B 785 20.483 28.400 8.848 1.00 21.44 H new ATOM 0 HB2 ASN B 785 21.146 30.483 9.603 1.00 20.06 H new ATOM 0 HB3 ASN B 785 20.253 30.588 8.329 1.00 20.06 H new ATOM 0 HD21 ASN B 785 18.683 33.104 9.881 1.00 21.89 H new ATOM 0 HD22 ASN B 785 19.620 32.735 8.784 1.00 21.89 H new ATOM 2809 N GLU B 786 21.067 28.441 11.503 1.00 21.82 N ATOM 2810 CA GLU B 786 21.164 27.987 12.882 1.00 21.99 C ATOM 2811 C GLU B 786 20.331 28.742 13.902 1.00 22.08 C ATOM 2812 O GLU B 786 19.860 28.152 14.866 1.00 21.52 O ATOM 2813 CB GLU B 786 22.620 27.963 13.347 1.00 20.84 C ATOM 2814 CG GLU B 786 22.752 27.300 14.694 1.00 21.69 C ATOM 2815 CD GLU B 786 24.160 26.874 15.019 1.00 20.25 C ATOM 2816 OE1 GLU B 786 24.302 25.994 15.889 1.00 21.59 O ATOM 2817 OE2 GLU B 786 25.115 27.415 14.424 1.00 20.91 O ATOM 0 H GLU B 786 21.807 28.699 11.149 1.00 21.82 H new ATOM 0 HA GLU B 786 20.785 27.095 12.850 1.00 21.99 H new ATOM 0 HB2 GLU B 786 23.162 27.490 12.696 1.00 20.84 H new ATOM 0 HB3 GLU B 786 22.962 28.870 13.395 1.00 20.84 H new ATOM 0 HG2 GLU B 786 22.440 27.912 15.379 1.00 21.69 H new ATOM 0 HG3 GLU B 786 22.172 26.523 14.722 1.00 21.69 H new ATOM 2818 N GLN B 787 20.156 30.043 13.715 1.00 23.48 N ATOM 2819 CA GLN B 787 19.357 30.807 14.661 1.00 23.54 C ATOM 2820 C GLN B 787 17.915 30.311 14.620 1.00 23.48 C ATOM 2821 O GLN B 787 17.258 30.187 15.656 1.00 21.92 O ATOM 2822 CB GLN B 787 19.405 32.302 14.328 1.00 24.96 C ATOM 2823 CG GLN B 787 18.719 33.185 15.369 1.00 29.19 C ATOM 2824 CD GLN B 787 19.264 32.971 16.781 1.00 32.20 C ATOM 2825 OE1 GLN B 787 20.476 32.935 16.994 1.00 33.83 O ATOM 2826 NE2 GLN B 787 18.365 32.838 17.750 1.00 34.18 N ATOM 0 H GLN B 787 20.484 30.495 13.061 1.00 23.48 H new ATOM 0 HA GLN B 787 19.720 30.682 15.552 1.00 23.54 H new ATOM 0 HB2 GLN B 787 20.331 32.577 14.242 1.00 24.96 H new ATOM 0 HB3 GLN B 787 18.985 32.447 13.466 1.00 24.96 H new ATOM 0 HG2 GLN B 787 18.831 34.116 15.121 1.00 29.19 H new ATOM 0 HG3 GLN B 787 17.766 33.003 15.364 1.00 29.19 H new ATOM 0 HE21 GLN B 787 17.526 32.868 17.565 1.00 34.18 H new ATOM 0 HE22 GLN B 787 18.622 32.722 18.562 1.00 34.18 H new ATOM 2827 N ARG B 788 17.425 30.014 13.419 1.00 22.83 N ATOM 2828 CA ARG B 788 16.061 29.529 13.276 1.00 22.04 C ATOM 2829 C ARG B 788 15.960 28.127 13.873 1.00 23.53 C ATOM 2830 O ARG B 788 14.915 27.734 14.398 1.00 23.12 O ATOM 2831 CB ARG B 788 15.654 29.508 11.803 1.00 22.42 C ATOM 2832 CG ARG B 788 14.157 29.384 11.601 1.00 21.26 C ATOM 2833 CD ARG B 788 13.779 29.563 10.141 1.00 22.15 C ATOM 2834 NE ARG B 788 12.334 29.493 9.946 1.00 21.03 N ATOM 2835 CZ ARG B 788 11.739 29.555 8.758 1.00 21.87 C ATOM 2836 NH1 ARG B 788 12.467 29.682 7.655 1.00 22.61 N ATOM 2837 NH2 ARG B 788 10.418 29.507 8.672 1.00 24.92 N ATOM 0 H ARG B 788 17.863 30.086 12.683 1.00 22.83 H new ATOM 0 HA ARG B 788 15.459 30.125 13.748 1.00 22.04 H new ATOM 0 HB2 ARG B 788 15.966 30.321 11.375 1.00 22.42 H new ATOM 0 HB3 ARG B 788 16.097 28.767 11.361 1.00 22.42 H new ATOM 0 HG2 ARG B 788 13.858 28.515 11.910 1.00 21.26 H new ATOM 0 HG3 ARG B 788 13.700 30.049 12.139 1.00 21.26 H new ATOM 0 HD2 ARG B 788 14.108 30.419 9.824 1.00 22.15 H new ATOM 0 HD3 ARG B 788 14.211 28.878 9.608 1.00 22.15 H new ATOM 0 HE ARG B 788 11.837 29.406 10.642 1.00 21.03 H new ATOM 0 HH11 ARG B 788 13.324 29.724 7.708 1.00 22.61 H new ATOM 0 HH12 ARG B 788 12.081 29.722 6.887 1.00 22.61 H new ATOM 0 HH21 ARG B 788 9.943 29.436 9.385 1.00 24.92 H new ATOM 0 HH22 ARG B 788 10.035 29.547 7.903 1.00 24.92 H new ATOM 2838 N MET B 789 17.059 27.381 13.795 1.00 23.60 N ATOM 2839 CA MET B 789 17.109 26.031 14.344 1.00 24.23 C ATOM 2840 C MET B 789 17.029 26.103 15.867 1.00 26.01 C ATOM 2841 O MET B 789 16.280 25.355 16.501 1.00 26.67 O ATOM 2842 CB MET B 789 18.422 25.338 13.970 1.00 23.89 C ATOM 2843 CG MET B 789 18.596 24.966 12.510 1.00 19.07 C ATOM 2844 SD MET B 789 20.195 24.127 12.304 1.00 23.02 S ATOM 2845 CE MET B 789 20.909 25.025 10.924 1.00 18.40 C ATOM 0 H MET B 789 17.791 27.641 13.425 1.00 23.60 H new ATOM 0 HA MET B 789 16.364 25.528 13.980 1.00 24.23 H new ATOM 0 HB2 MET B 789 19.156 25.919 14.225 1.00 23.89 H new ATOM 0 HB3 MET B 789 18.502 24.530 14.501 1.00 23.89 H new ATOM 0 HG2 MET B 789 17.873 24.386 12.223 1.00 19.07 H new ATOM 0 HG3 MET B 789 18.560 25.760 11.955 1.00 19.07 H new ATOM 0 HE1 MET B 789 21.208 24.396 10.248 1.00 18.40 H new ATOM 0 HE2 MET B 789 20.241 25.616 10.542 1.00 18.40 H new ATOM 0 HE3 MET B 789 21.664 25.549 11.234 1.00 18.40 H new ATOM 2846 N LYS B 790 17.820 27.002 16.446 1.00 24.90 N ATOM 2847 CA LYS B 790 17.865 27.173 17.892 1.00 25.38 C ATOM 2848 C LYS B 790 16.522 27.618 18.447 1.00 25.33 C ATOM 2849 O LYS B 790 16.141 27.223 19.552 1.00 25.28 O ATOM 2850 CB LYS B 790 18.946 28.185 18.268 1.00 22.92 C ATOM 0 H LYS B 790 18.344 27.528 16.012 1.00 24.90 H new ATOM 0 HA LYS B 790 18.078 26.312 18.284 1.00 25.38 H new ATOM 2851 N GLU B 791 15.809 28.437 17.680 1.00 25.53 N ATOM 2852 CA GLU B 791 14.508 28.937 18.107 1.00 27.35 C ATOM 2853 C GLU B 791 13.365 27.950 17.867 1.00 28.48 C ATOM 2854 O GLU B 791 12.253 28.166 18.338 1.00 30.12 O ATOM 2855 CB GLU B 791 14.202 30.268 17.417 1.00 26.93 C ATOM 2856 CG GLU B 791 15.193 31.360 17.774 1.00 29.03 C ATOM 2857 CD GLU B 791 14.939 32.662 17.039 1.00 32.13 C ATOM 2858 OE1 GLU B 791 15.810 33.556 17.107 1.00 33.26 O ATOM 2859 OE2 GLU B 791 13.873 32.800 16.399 1.00 32.37 O ATOM 0 H GLU B 791 16.062 28.715 16.907 1.00 25.53 H new ATOM 0 HA GLU B 791 14.567 29.063 19.067 1.00 27.35 H new ATOM 0 HB2 GLU B 791 14.205 30.137 16.456 1.00 26.93 H new ATOM 0 HB3 GLU B 791 13.309 30.556 17.662 1.00 26.93 H new ATOM 0 HG2 GLU B 791 15.156 31.522 18.730 1.00 29.03 H new ATOM 0 HG3 GLU B 791 16.091 31.052 17.573 1.00 29.03 H new ATOM 2860 N SER B 792 13.620 26.875 17.129 1.00 29.17 N ATOM 2861 CA SER B 792 12.565 25.893 16.909 1.00 29.87 C ATOM 2862 C SER B 792 12.474 25.080 18.196 1.00 31.43 C ATOM 2863 O SER B 792 13.302 25.232 19.100 1.00 33.22 O ATOM 2864 CB SER B 792 12.897 24.970 15.731 1.00 29.66 C ATOM 2865 OG SER B 792 13.866 23.998 16.087 1.00 27.43 O ATOM 0 H SER B 792 14.375 26.698 16.756 1.00 29.17 H new ATOM 0 HA SER B 792 11.727 26.332 16.694 1.00 29.87 H new ATOM 0 HB2 SER B 792 12.089 24.527 15.428 1.00 29.66 H new ATOM 0 HB3 SER B 792 13.226 25.499 14.987 1.00 29.66 H new ATOM 0 HG SER B 792 14.606 24.374 16.218 1.00 27.43 H new ATOM 2866 N SER B 793 11.471 24.225 18.293 1.00 31.13 N ATOM 2867 CA SER B 793 11.321 23.410 19.487 1.00 31.40 C ATOM 2868 C SER B 793 12.105 22.114 19.319 1.00 29.45 C ATOM 2869 O SER B 793 12.070 21.240 20.184 1.00 29.68 O ATOM 2870 CB SER B 793 9.845 23.096 19.724 1.00 31.27 C ATOM 2871 OG SER B 793 9.312 22.385 18.622 1.00 33.26 O ATOM 0 H SER B 793 10.872 24.101 17.688 1.00 31.13 H new ATOM 0 HA SER B 793 11.664 23.898 20.252 1.00 31.40 H new ATOM 0 HB2 SER B 793 9.745 22.572 20.534 1.00 31.27 H new ATOM 0 HB3 SER B 793 9.350 23.919 19.856 1.00 31.27 H new ATOM 0 HG SER B 793 9.882 22.355 18.006 1.00 33.26 H new ATOM 2872 N PHE B 794 12.819 21.989 18.205 1.00 27.27 N ATOM 2873 CA PHE B 794 13.587 20.777 17.955 1.00 26.11 C ATOM 2874 C PHE B 794 15.025 21.023 17.502 1.00 25.90 C ATOM 2875 O PHE B 794 15.509 20.412 16.543 1.00 24.26 O ATOM 2876 CB PHE B 794 12.837 19.895 16.947 1.00 24.57 C ATOM 2877 CG PHE B 794 12.423 20.609 15.687 1.00 23.10 C ATOM 2878 CD1 PHE B 794 13.205 20.539 14.544 1.00 24.11 C ATOM 2879 CD2 PHE B 794 11.235 21.323 15.639 1.00 24.07 C ATOM 2880 CE1 PHE B 794 12.809 21.168 13.375 1.00 23.34 C ATOM 2881 CE2 PHE B 794 10.829 21.955 14.476 1.00 23.48 C ATOM 2882 CZ PHE B 794 11.618 21.876 13.339 1.00 24.55 C ATOM 0 H PHE B 794 12.872 22.587 17.589 1.00 27.27 H new ATOM 0 HA PHE B 794 13.668 20.321 18.807 1.00 26.11 H new ATOM 0 HB2 PHE B 794 13.401 19.142 16.709 1.00 24.57 H new ATOM 0 HB3 PHE B 794 12.046 19.533 17.376 1.00 24.57 H new ATOM 0 HD1 PHE B 794 14.005 20.064 14.562 1.00 24.11 H new ATOM 0 HD2 PHE B 794 10.703 21.378 16.400 1.00 24.07 H new ATOM 0 HE1 PHE B 794 13.342 21.115 12.615 1.00 23.34 H new ATOM 0 HE2 PHE B 794 10.030 22.431 14.458 1.00 23.48 H new ATOM 0 HZ PHE B 794 11.349 22.297 12.554 1.00 24.55 H new ATOM 2883 N TYR B 795 15.708 21.909 18.221 1.00 25.58 N ATOM 2884 CA TYR B 795 17.095 22.255 17.923 1.00 24.75 C ATOM 2885 C TYR B 795 17.967 21.008 17.834 1.00 24.44 C ATOM 2886 O TYR B 795 18.738 20.840 16.885 1.00 23.22 O ATOM 2887 CB TYR B 795 17.636 23.199 19.003 1.00 25.26 C ATOM 2888 CG TYR B 795 19.019 23.733 18.718 1.00 26.78 C ATOM 2889 CD1 TYR B 795 19.407 24.049 17.425 1.00 27.05 C ATOM 2890 CD2 TYR B 795 19.930 23.946 19.749 1.00 28.41 C ATOM 2891 CE1 TYR B 795 20.666 24.563 17.161 1.00 28.25 C ATOM 2892 CE2 TYR B 795 21.189 24.460 19.496 1.00 29.32 C ATOM 2893 CZ TYR B 795 21.552 24.767 18.200 1.00 29.14 C ATOM 2894 OH TYR B 795 22.802 25.284 17.948 1.00 29.72 O ATOM 0 H TYR B 795 15.380 22.327 18.897 1.00 25.58 H new ATOM 0 HA TYR B 795 17.120 22.700 17.062 1.00 24.75 H new ATOM 0 HB2 TYR B 795 17.025 23.946 19.101 1.00 25.26 H new ATOM 0 HB3 TYR B 795 17.649 22.730 19.852 1.00 25.26 H new ATOM 0 HD1 TYR B 795 18.812 23.914 16.723 1.00 27.05 H new ATOM 0 HD2 TYR B 795 19.688 23.739 20.623 1.00 28.41 H new ATOM 0 HE1 TYR B 795 20.913 24.770 16.289 1.00 28.25 H new ATOM 0 HE2 TYR B 795 21.787 24.598 20.195 1.00 29.32 H new ATOM 0 HH TYR B 795 22.910 25.366 17.119 1.00 29.72 H new ATOM 2895 N SER B 796 17.829 20.124 18.816 1.00 23.31 N ATOM 2896 CA SER B 796 18.611 18.896 18.849 1.00 23.02 C ATOM 2897 C SER B 796 18.450 18.069 17.577 1.00 22.75 C ATOM 2898 O SER B 796 19.436 17.571 17.023 1.00 21.28 O ATOM 2899 CB SER B 796 18.213 18.049 20.057 1.00 24.76 C ATOM 2900 OG SER B 796 19.078 16.935 20.169 1.00 30.58 O ATOM 0 H SER B 796 17.285 20.218 19.475 1.00 23.31 H new ATOM 0 HA SER B 796 19.543 19.157 18.917 1.00 23.02 H new ATOM 0 HB2 SER B 796 18.255 18.584 20.865 1.00 24.76 H new ATOM 0 HB3 SER B 796 17.296 17.748 19.963 1.00 24.76 H new ATOM 0 HG SER B 796 19.791 17.091 19.754 1.00 30.58 H new ATOM 2901 N LEU B 797 17.209 17.911 17.119 1.00 21.77 N ATOM 2902 CA LEU B 797 16.950 17.144 15.902 1.00 21.34 C ATOM 2903 C LEU B 797 17.639 17.833 14.721 1.00 20.62 C ATOM 2904 O LEU B 797 18.276 17.179 13.888 1.00 21.40 O ATOM 2905 CB LEU B 797 15.445 17.052 15.633 1.00 23.26 C ATOM 2906 CG LEU B 797 15.030 16.026 14.575 1.00 24.79 C ATOM 2907 CD1 LEU B 797 15.262 14.628 15.122 1.00 24.18 C ATOM 2908 CD2 LEU B 797 13.563 16.216 14.211 1.00 23.48 C ATOM 0 H LEU B 797 16.508 18.237 17.495 1.00 21.77 H new ATOM 0 HA LEU B 797 17.299 16.246 16.014 1.00 21.34 H new ATOM 0 HB2 LEU B 797 14.995 16.836 16.465 1.00 23.26 H new ATOM 0 HB3 LEU B 797 15.127 17.926 15.357 1.00 23.26 H new ATOM 0 HG LEU B 797 15.562 16.150 13.774 1.00 24.79 H new ATOM 0 HD11 LEU B 797 15.001 13.972 14.456 1.00 24.18 H new ATOM 0 HD12 LEU B 797 16.202 14.515 15.335 1.00 24.18 H new ATOM 0 HD13 LEU B 797 14.732 14.502 15.924 1.00 24.18 H new ATOM 0 HD21 LEU B 797 13.308 15.563 13.541 1.00 23.48 H new ATOM 0 HD22 LEU B 797 13.015 16.097 15.002 1.00 23.48 H new ATOM 0 HD23 LEU B 797 13.430 17.110 13.858 1.00 23.48 H new ATOM 2909 N CYS B 798 17.504 19.154 14.647 1.00 19.26 N ATOM 2910 CA CYS B 798 18.131 19.911 13.566 1.00 19.85 C ATOM 2911 C CYS B 798 19.629 19.636 13.524 1.00 20.24 C ATOM 2912 O CYS B 798 20.196 19.404 12.453 1.00 20.40 O ATOM 2913 CB CYS B 798 17.897 21.415 13.743 1.00 20.95 C ATOM 2914 SG CYS B 798 16.228 21.972 13.337 1.00 23.29 S ATOM 0 H CYS B 798 17.057 19.629 15.208 1.00 19.26 H new ATOM 0 HA CYS B 798 17.727 19.626 12.732 1.00 19.85 H new ATOM 0 HB2 CYS B 798 18.090 21.654 14.663 1.00 20.95 H new ATOM 0 HB3 CYS B 798 18.530 21.896 13.187 1.00 20.95 H new ATOM 0 HG CYS B 798 15.426 21.245 13.855 1.00 23.29 H new ATOM 2915 N LEU B 799 20.268 19.666 14.688 1.00 19.69 N ATOM 2916 CA LEU B 799 21.703 19.410 14.763 1.00 21.87 C ATOM 2917 C LEU B 799 22.033 18.009 14.256 1.00 22.54 C ATOM 2918 O LEU B 799 23.062 17.800 13.615 1.00 23.57 O ATOM 2919 CB LEU B 799 22.201 19.577 16.203 1.00 23.16 C ATOM 2920 CG LEU B 799 22.195 21.008 16.750 1.00 24.28 C ATOM 2921 CD1 LEU B 799 22.516 20.993 18.237 1.00 24.68 C ATOM 2922 CD2 LEU B 799 23.214 21.852 15.982 1.00 24.25 C ATOM 0 H LEU B 799 19.892 19.832 15.443 1.00 19.69 H new ATOM 0 HA LEU B 799 22.153 20.056 14.197 1.00 21.87 H new ATOM 0 HB2 LEU B 799 21.653 19.025 16.783 1.00 23.16 H new ATOM 0 HB3 LEU B 799 23.106 19.232 16.256 1.00 23.16 H new ATOM 0 HG LEU B 799 21.315 21.400 16.632 1.00 24.28 H new ATOM 0 HD11 LEU B 799 22.511 21.901 18.578 1.00 24.68 H new ATOM 0 HD12 LEU B 799 21.850 20.468 18.707 1.00 24.68 H new ATOM 0 HD13 LEU B 799 23.392 20.601 18.375 1.00 24.68 H new ATOM 0 HD21 LEU B 799 23.210 22.758 16.328 1.00 24.25 H new ATOM 0 HD22 LEU B 799 24.099 21.469 16.089 1.00 24.25 H new ATOM 0 HD23 LEU B 799 22.980 21.865 15.041 1.00 24.25 H new ATOM 2923 N THR B 800 21.162 17.045 14.543 1.00 21.89 N ATOM 2924 CA THR B 800 21.389 15.682 14.084 1.00 22.42 C ATOM 2925 C THR B 800 21.350 15.635 12.552 1.00 21.90 C ATOM 2926 O THR B 800 22.235 15.062 11.913 1.00 22.80 O ATOM 2927 CB THR B 800 20.326 14.713 14.661 1.00 22.93 C ATOM 2928 OG1 THR B 800 20.525 14.568 16.070 1.00 23.60 O ATOM 2929 CG2 THR B 800 20.429 13.346 14.004 1.00 22.93 C ATOM 0 H THR B 800 20.441 17.159 14.998 1.00 21.89 H new ATOM 0 HA THR B 800 22.262 15.400 14.398 1.00 22.42 H new ATOM 0 HB THR B 800 19.447 15.083 14.483 1.00 22.93 H new ATOM 0 HG1 THR B 800 21.240 14.150 16.211 1.00 23.60 H new ATOM 0 HG21 THR B 800 19.757 12.755 14.378 1.00 22.93 H new ATOM 0 HG22 THR B 800 20.286 13.434 13.049 1.00 22.93 H new ATOM 0 HG23 THR B 800 21.311 12.975 14.165 1.00 22.93 H new ATOM 2930 N MET B 801 20.327 16.247 11.967 1.00 22.70 N ATOM 2931 CA MET B 801 20.175 16.275 10.515 1.00 22.01 C ATOM 2932 C MET B 801 21.318 17.046 9.847 1.00 22.90 C ATOM 2933 O MET B 801 21.800 16.671 8.775 1.00 22.34 O ATOM 2934 CB MET B 801 18.848 16.940 10.134 1.00 23.00 C ATOM 2935 CG MET B 801 17.601 16.259 10.674 1.00 25.85 C ATOM 2936 SD MET B 801 16.070 17.130 10.203 1.00 31.71 S ATOM 2937 CE MET B 801 16.155 18.547 11.252 1.00 30.35 C ATOM 0 H MET B 801 19.704 16.656 12.396 1.00 22.70 H new ATOM 0 HA MET B 801 20.191 15.356 10.205 1.00 22.01 H new ATOM 0 HB2 MET B 801 18.860 17.857 10.450 1.00 23.00 H new ATOM 0 HB3 MET B 801 18.787 16.974 9.167 1.00 23.00 H new ATOM 0 HG2 MET B 801 17.565 15.347 10.344 1.00 25.85 H new ATOM 0 HG3 MET B 801 17.657 16.209 11.641 1.00 25.85 H new ATOM 0 HE1 MET B 801 15.324 19.044 11.193 1.00 30.35 H new ATOM 0 HE2 MET B 801 16.297 18.263 12.169 1.00 30.35 H new ATOM 0 HE3 MET B 801 16.891 19.114 10.972 1.00 30.35 H new ATOM 2938 N TRP B 802 21.738 18.130 10.492 1.00 22.89 N ATOM 2939 CA TRP B 802 22.799 18.997 9.985 1.00 23.07 C ATOM 2940 C TRP B 802 24.134 18.267 9.802 1.00 23.32 C ATOM 2941 O TRP B 802 24.999 18.721 9.046 1.00 22.44 O ATOM 2942 CB TRP B 802 22.971 20.178 10.945 1.00 21.12 C ATOM 2943 CG TRP B 802 23.599 21.403 10.344 1.00 20.61 C ATOM 2944 CD1 TRP B 802 23.951 21.598 9.039 1.00 21.41 C ATOM 2945 CD2 TRP B 802 23.918 22.616 11.031 1.00 20.09 C ATOM 2946 NE1 TRP B 802 24.469 22.861 8.873 1.00 21.91 N ATOM 2947 CE2 TRP B 802 24.462 23.505 10.082 1.00 20.83 C ATOM 2948 CE3 TRP B 802 23.796 23.038 12.362 1.00 17.44 C ATOM 2949 CZ2 TRP B 802 24.884 24.792 10.419 1.00 21.20 C ATOM 2950 CZ3 TRP B 802 24.215 24.318 12.695 1.00 19.22 C ATOM 2951 CH2 TRP B 802 24.752 25.179 11.729 1.00 20.65 C ATOM 0 H TRP B 802 21.412 18.386 11.245 1.00 22.89 H new ATOM 0 HA TRP B 802 22.534 19.305 9.104 1.00 23.07 H new ATOM 0 HB2 TRP B 802 22.100 20.419 11.299 1.00 21.12 H new ATOM 0 HB3 TRP B 802 23.513 19.890 11.696 1.00 21.12 H new ATOM 0 HD1 TRP B 802 23.854 20.968 8.361 1.00 21.41 H new ATOM 0 HE1 TRP B 802 24.751 23.192 8.131 1.00 21.91 H new ATOM 0 HE3 TRP B 802 23.441 22.472 13.009 1.00 17.44 H new ATOM 0 HZ2 TRP B 802 25.241 25.366 9.780 1.00 21.20 H new ATOM 0 HZ3 TRP B 802 24.138 24.610 13.575 1.00 19.22 H new ATOM 0 HH2 TRP B 802 25.025 26.032 11.981 1.00 20.65 H new ATOM 2952 N GLN B 803 24.296 17.138 10.492 1.00 23.58 N ATOM 2953 CA GLN B 803 25.523 16.342 10.408 1.00 22.87 C ATOM 2954 C GLN B 803 25.818 15.873 8.986 1.00 22.52 C ATOM 2955 O GLN B 803 26.968 15.862 8.554 1.00 22.62 O ATOM 2956 CB GLN B 803 25.428 15.105 11.312 1.00 25.17 C ATOM 2957 CG GLN B 803 25.292 15.395 12.799 1.00 25.45 C ATOM 2958 CD GLN B 803 25.016 14.139 13.615 1.00 29.56 C ATOM 2959 OE1 GLN B 803 24.890 13.004 12.936 1.00 32.19 O flip ATOM 2960 NE2 GLN B 803 24.910 14.194 14.841 1.00 27.40 N flip ATOM 0 H GLN B 803 23.701 16.812 11.020 1.00 23.58 H new ATOM 0 HA GLN B 803 26.243 16.923 10.699 1.00 22.87 H new ATOM 0 HB2 GLN B 803 24.666 14.574 11.030 1.00 25.17 H new ATOM 0 HB3 GLN B 803 26.219 14.561 11.175 1.00 25.17 H new ATOM 0 HG2 GLN B 803 26.106 15.813 13.120 1.00 25.45 H new ATOM 0 HG3 GLN B 803 24.573 16.031 12.937 1.00 25.45 H new ATOM 0 HE21 GLN B 803 24.998 14.947 15.247 1.00 27.40 H new ATOM 0 HE22 GLN B 803 24.748 13.479 15.291 1.00 27.40 H new ATOM 2961 N ILE B 804 24.776 15.484 8.263 1.00 21.22 N ATOM 2962 CA ILE B 804 24.938 14.984 6.903 1.00 20.66 C ATOM 2963 C ILE B 804 25.590 16.007 5.982 1.00 20.18 C ATOM 2964 O ILE B 804 26.654 15.750 5.413 1.00 20.72 O ATOM 2965 CB ILE B 804 23.572 14.547 6.308 1.00 20.38 C ATOM 2966 CG1 ILE B 804 22.928 13.503 7.217 1.00 22.91 C ATOM 2967 CG2 ILE B 804 23.758 13.968 4.914 1.00 20.79 C ATOM 2968 CD1 ILE B 804 23.826 12.312 7.477 1.00 28.09 C ATOM 0 H ILE B 804 23.963 15.501 8.542 1.00 21.22 H new ATOM 0 HA ILE B 804 25.528 14.216 6.961 1.00 20.66 H new ATOM 0 HB ILE B 804 22.996 15.325 6.246 1.00 20.38 H new ATOM 0 HG12 ILE B 804 22.695 13.917 8.063 1.00 22.91 H new ATOM 0 HG13 ILE B 804 22.101 13.196 6.814 1.00 22.91 H new ATOM 0 HG21 ILE B 804 22.897 13.700 4.557 1.00 20.79 H new ATOM 0 HG22 ILE B 804 24.153 14.638 4.335 1.00 20.79 H new ATOM 0 HG23 ILE B 804 24.343 13.195 4.960 1.00 20.79 H new ATOM 0 HD11 ILE B 804 23.370 11.683 8.057 1.00 28.09 H new ATOM 0 HD12 ILE B 804 24.041 11.879 6.636 1.00 28.09 H new ATOM 0 HD13 ILE B 804 24.644 12.610 7.904 1.00 28.09 H new ATOM 2969 N PRO B 805 24.963 17.181 5.818 1.00 19.07 N ATOM 2970 CA PRO B 805 25.537 18.207 4.945 1.00 19.62 C ATOM 2971 C PRO B 805 26.984 18.509 5.317 1.00 20.27 C ATOM 2972 O PRO B 805 27.835 18.670 4.444 1.00 19.99 O ATOM 2973 CB PRO B 805 24.628 19.412 5.182 1.00 18.89 C ATOM 2974 CG PRO B 805 23.308 18.777 5.488 1.00 22.87 C ATOM 2975 CD PRO B 805 23.688 17.639 6.402 1.00 19.51 C ATOM 0 HA PRO B 805 25.572 17.939 4.013 1.00 19.62 H new ATOM 0 HB2 PRO B 805 24.942 19.961 5.917 1.00 18.89 H new ATOM 0 HB3 PRO B 805 24.579 19.985 4.401 1.00 18.89 H new ATOM 0 HG2 PRO B 805 22.701 19.398 5.920 1.00 22.87 H new ATOM 0 HG3 PRO B 805 22.866 18.461 4.685 1.00 22.87 H new ATOM 0 HD2 PRO B 805 23.795 17.932 7.320 1.00 19.51 H new ATOM 0 HD3 PRO B 805 23.018 16.937 6.405 1.00 19.51 H new ATOM 2976 N GLN B 806 27.260 18.582 6.615 1.00 20.32 N ATOM 2977 CA GLN B 806 28.614 18.885 7.063 1.00 22.66 C ATOM 2978 C GLN B 806 29.573 17.794 6.607 1.00 22.98 C ATOM 2979 O GLN B 806 30.732 18.070 6.289 1.00 23.57 O ATOM 2980 CB GLN B 806 28.657 19.044 8.589 1.00 22.70 C ATOM 2981 CG GLN B 806 27.790 20.191 9.114 1.00 21.54 C ATOM 2982 CD GLN B 806 28.299 21.570 8.712 1.00 23.25 C ATOM 2983 OE1 GLN B 806 28.905 21.742 7.653 1.00 22.81 O ATOM 2984 NE2 GLN B 806 28.030 22.568 9.555 1.00 22.91 N ATOM 0 H GLN B 806 26.687 18.461 7.244 1.00 20.32 H new ATOM 0 HA GLN B 806 28.891 19.726 6.666 1.00 22.66 H new ATOM 0 HB2 GLN B 806 28.366 18.215 9.001 1.00 22.70 H new ATOM 0 HB3 GLN B 806 29.575 19.191 8.865 1.00 22.70 H new ATOM 0 HG2 GLN B 806 26.884 20.080 8.785 1.00 21.54 H new ATOM 0 HG3 GLN B 806 27.748 20.139 10.082 1.00 21.54 H new ATOM 0 HE21 GLN B 806 27.605 22.411 10.286 1.00 22.91 H new ATOM 0 HE22 GLN B 806 28.282 23.369 9.368 1.00 22.91 H new ATOM 2985 N GLU B 807 29.086 16.559 6.565 1.00 21.88 N ATOM 2986 CA GLU B 807 29.904 15.432 6.134 1.00 23.02 C ATOM 2987 C GLU B 807 30.164 15.540 4.630 1.00 23.17 C ATOM 2988 O GLU B 807 31.237 15.169 4.142 1.00 22.07 O ATOM 2989 CB GLU B 807 29.192 14.112 6.438 1.00 24.79 C ATOM 2990 CG GLU B 807 29.949 12.883 5.962 1.00 31.24 C ATOM 2991 CD GLU B 807 31.034 12.442 6.929 1.00 33.86 C ATOM 2992 OE1 GLU B 807 31.719 13.322 7.493 1.00 36.55 O ATOM 2993 OE2 GLU B 807 31.207 11.216 7.116 1.00 34.53 O ATOM 0 H GLU B 807 28.280 16.352 6.783 1.00 21.88 H new ATOM 0 HA GLU B 807 30.746 15.451 6.615 1.00 23.02 H new ATOM 0 HB2 GLU B 807 29.050 14.044 7.395 1.00 24.79 H new ATOM 0 HB3 GLU B 807 28.316 14.123 6.022 1.00 24.79 H new ATOM 0 HG2 GLU B 807 29.323 12.154 5.832 1.00 31.24 H new ATOM 0 HG3 GLU B 807 30.349 13.070 5.098 1.00 31.24 H new ATOM 2994 N PHE B 808 29.171 16.037 3.899 1.00 21.52 N ATOM 2995 CA PHE B 808 29.303 16.205 2.459 1.00 22.40 C ATOM 2996 C PHE B 808 30.378 17.243 2.186 1.00 23.45 C ATOM 2997 O PHE B 808 31.212 17.066 1.298 1.00 22.04 O ATOM 2998 CB PHE B 808 27.979 16.659 1.848 1.00 22.59 C ATOM 2999 CG PHE B 808 26.969 15.562 1.712 1.00 23.58 C ATOM 3000 CD1 PHE B 808 27.302 14.257 2.029 1.00 25.55 C ATOM 3001 CD2 PHE B 808 25.697 15.828 1.236 1.00 23.74 C ATOM 3002 CE1 PHE B 808 26.383 13.230 1.875 1.00 26.54 C ATOM 3003 CE2 PHE B 808 24.769 14.807 1.077 1.00 25.96 C ATOM 3004 CZ PHE B 808 25.112 13.505 1.396 1.00 25.52 C ATOM 0 H PHE B 808 28.412 16.283 4.220 1.00 21.52 H new ATOM 0 HA PHE B 808 29.548 15.357 2.058 1.00 22.40 H new ATOM 0 HB2 PHE B 808 27.605 17.366 2.397 1.00 22.59 H new ATOM 0 HB3 PHE B 808 28.150 17.040 0.973 1.00 22.59 H new ATOM 0 HD1 PHE B 808 28.154 14.066 2.350 1.00 25.55 H new ATOM 0 HD2 PHE B 808 25.461 16.701 1.020 1.00 23.74 H new ATOM 0 HE1 PHE B 808 26.619 12.357 2.093 1.00 26.54 H new ATOM 0 HE2 PHE B 808 23.917 14.998 0.756 1.00 25.96 H new ATOM 0 HZ PHE B 808 24.493 12.819 1.290 1.00 25.52 H new ATOM 3005 N VAL B 809 30.352 18.326 2.960 1.00 23.87 N ATOM 3006 CA VAL B 809 31.337 19.395 2.818 1.00 24.53 C ATOM 3007 C VAL B 809 32.726 18.819 3.082 1.00 24.73 C ATOM 3008 O VAL B 809 33.675 19.041 2.321 1.00 23.92 O ATOM 3009 CB VAL B 809 31.086 20.534 3.834 1.00 23.83 C ATOM 3010 CG1 VAL B 809 32.176 21.587 3.705 1.00 26.09 C ATOM 3011 CG2 VAL B 809 29.718 21.159 3.603 1.00 22.85 C ATOM 0 H VAL B 809 29.768 18.461 3.577 1.00 23.87 H new ATOM 0 HA VAL B 809 31.266 19.756 1.920 1.00 24.53 H new ATOM 0 HB VAL B 809 31.106 20.166 4.731 1.00 23.83 H new ATOM 0 HG11 VAL B 809 32.015 22.299 4.343 1.00 26.09 H new ATOM 0 HG12 VAL B 809 33.040 21.183 3.883 1.00 26.09 H new ATOM 0 HG13 VAL B 809 32.169 21.952 2.806 1.00 26.09 H new ATOM 0 HG21 VAL B 809 29.574 21.871 4.246 1.00 22.85 H new ATOM 0 HG22 VAL B 809 29.676 21.522 2.705 1.00 22.85 H new ATOM 0 HG23 VAL B 809 29.031 20.483 3.711 1.00 22.85 H new ATOM 3012 N LYS B 810 32.832 18.057 4.161 1.00 25.05 N ATOM 3013 CA LYS B 810 34.099 17.454 4.542 1.00 26.24 C ATOM 3014 C LYS B 810 34.663 16.483 3.504 1.00 26.08 C ATOM 3015 O LYS B 810 35.864 16.480 3.237 1.00 26.53 O ATOM 3016 CB LYS B 810 33.946 16.735 5.883 1.00 27.85 C ATOM 3017 CG LYS B 810 35.217 16.037 6.339 1.00 29.92 C ATOM 3018 CD LYS B 810 34.992 15.276 7.631 1.00 32.39 C ATOM 3019 CE LYS B 810 36.235 14.503 8.034 1.00 33.65 C ATOM 3020 NZ LYS B 810 36.010 13.737 9.290 1.00 36.43 N ATOM 0 H LYS B 810 32.178 17.876 4.689 1.00 25.05 H new ATOM 0 HA LYS B 810 34.735 18.183 4.610 1.00 26.24 H new ATOM 0 HB2 LYS B 810 33.677 17.377 6.558 1.00 27.85 H new ATOM 0 HB3 LYS B 810 33.233 16.081 5.813 1.00 27.85 H new ATOM 0 HG2 LYS B 810 35.518 15.426 5.649 1.00 29.92 H new ATOM 0 HG3 LYS B 810 35.921 16.692 6.465 1.00 29.92 H new ATOM 0 HD2 LYS B 810 34.750 15.896 8.337 1.00 32.39 H new ATOM 0 HD3 LYS B 810 34.247 14.664 7.524 1.00 32.39 H new ATOM 0 HE2 LYS B 810 36.485 13.894 7.322 1.00 33.65 H new ATOM 0 HE3 LYS B 810 36.976 15.117 8.155 1.00 33.65 H new ATOM 0 HZ1 LYS B 810 36.751 13.294 9.504 1.00 36.43 H new ATOM 0 HZ2 LYS B 810 35.800 14.299 9.947 1.00 36.43 H new ATOM 0 HZ3 LYS B 810 35.344 13.159 9.170 1.00 36.43 H new ATOM 3021 N LEU B 811 33.801 15.658 2.920 1.00 25.06 N ATOM 3022 CA LEU B 811 34.252 14.688 1.930 1.00 25.40 C ATOM 3023 C LEU B 811 34.182 15.209 0.503 1.00 25.03 C ATOM 3024 O LEU B 811 34.713 14.585 -0.412 1.00 23.73 O ATOM 3025 CB LEU B 811 33.420 13.413 2.025 1.00 24.96 C ATOM 3026 CG LEU B 811 33.648 12.530 3.248 1.00 27.59 C ATOM 3027 CD1 LEU B 811 32.621 11.403 3.279 1.00 24.89 C ATOM 3028 CD2 LEU B 811 35.060 11.973 3.200 1.00 26.53 C ATOM 0 H LEU B 811 32.956 15.643 3.081 1.00 25.06 H new ATOM 0 HA LEU B 811 35.184 14.510 2.134 1.00 25.40 H new ATOM 0 HB2 LEU B 811 32.483 13.662 2.003 1.00 24.96 H new ATOM 0 HB3 LEU B 811 33.591 12.881 1.232 1.00 24.96 H new ATOM 0 HG LEU B 811 33.542 13.054 4.057 1.00 27.59 H new ATOM 0 HD11 LEU B 811 32.774 10.847 4.059 1.00 24.89 H new ATOM 0 HD12 LEU B 811 31.728 11.780 3.320 1.00 24.89 H new ATOM 0 HD13 LEU B 811 32.707 10.864 2.477 1.00 24.89 H new ATOM 0 HD21 LEU B 811 35.213 11.410 3.975 1.00 26.53 H new ATOM 0 HD22 LEU B 811 35.174 11.448 2.392 1.00 26.53 H new ATOM 0 HD23 LEU B 811 35.697 12.705 3.202 1.00 26.53 H new ATOM 3029 N GLN B 812 33.526 16.351 0.319 1.00 25.79 N ATOM 3030 CA GLN B 812 33.372 16.925 -1.011 1.00 24.59 C ATOM 3031 C GLN B 812 32.724 15.878 -1.932 1.00 24.23 C ATOM 3032 O GLN B 812 33.243 15.566 -3.005 1.00 24.81 O ATOM 3033 CB GLN B 812 34.741 17.348 -1.557 1.00 24.36 C ATOM 0 H GLN B 812 33.163 16.808 0.951 1.00 25.79 H new ATOM 0 HA GLN B 812 32.805 17.711 -0.970 1.00 24.59 H new ATOM 3034 N VAL B 813 31.596 15.327 -1.498 1.00 23.96 N ATOM 3035 CA VAL B 813 30.883 14.333 -2.293 1.00 23.41 C ATOM 3036 C VAL B 813 30.498 14.920 -3.650 1.00 22.08 C ATOM 3037 O VAL B 813 29.991 16.043 -3.734 1.00 21.02 O ATOM 3038 CB VAL B 813 29.602 13.866 -1.575 1.00 24.15 C ATOM 3039 CG1 VAL B 813 28.766 12.997 -2.505 1.00 26.41 C ATOM 3040 CG2 VAL B 813 29.972 13.099 -0.327 1.00 23.76 C ATOM 0 H VAL B 813 31.226 15.515 -0.745 1.00 23.96 H new ATOM 0 HA VAL B 813 31.475 13.574 -2.415 1.00 23.41 H new ATOM 0 HB VAL B 813 29.075 14.641 -1.324 1.00 24.15 H new ATOM 0 HG11 VAL B 813 27.963 12.709 -2.044 1.00 26.41 H new ATOM 0 HG12 VAL B 813 28.521 13.508 -3.292 1.00 26.41 H new ATOM 0 HG13 VAL B 813 29.281 12.220 -2.772 1.00 26.41 H new ATOM 0 HG21 VAL B 813 29.165 12.806 0.124 1.00 23.76 H new ATOM 0 HG22 VAL B 813 30.506 12.326 -0.568 1.00 23.76 H new ATOM 0 HG23 VAL B 813 30.483 13.672 0.266 1.00 23.76 H new ATOM 3041 N SER B 814 30.742 14.166 -4.715 1.00 19.56 N ATOM 3042 CA SER B 814 30.407 14.649 -6.046 1.00 21.17 C ATOM 3043 C SER B 814 28.962 14.302 -6.368 1.00 22.07 C ATOM 3044 O SER B 814 28.350 13.474 -5.695 1.00 22.63 O ATOM 3045 CB SER B 814 31.315 14.014 -7.097 1.00 19.02 C ATOM 3046 OG SER B 814 31.021 12.638 -7.251 1.00 19.31 O ATOM 0 H SER B 814 31.096 13.383 -4.690 1.00 19.56 H new ATOM 0 HA SER B 814 30.531 15.611 -6.061 1.00 21.17 H new ATOM 0 HB2 SER B 814 31.202 14.470 -7.946 1.00 19.02 H new ATOM 0 HB3 SER B 814 32.243 14.124 -6.837 1.00 19.02 H new ATOM 0 HG SER B 814 31.686 12.244 -7.581 1.00 19.31 H new ATOM 3047 N GLN B 815 28.419 14.938 -7.398 1.00 21.22 N ATOM 3048 CA GLN B 815 27.049 14.663 -7.802 1.00 23.51 C ATOM 3049 C GLN B 815 26.929 13.221 -8.306 1.00 23.32 C ATOM 3050 O GLN B 815 25.902 12.569 -8.108 1.00 25.09 O ATOM 3051 CB GLN B 815 26.621 15.647 -8.895 1.00 25.24 C ATOM 3052 CG GLN B 815 25.263 15.359 -9.506 1.00 28.38 C ATOM 3053 CD GLN B 815 24.814 16.466 -10.445 1.00 31.72 C ATOM 3054 OE1 GLN B 815 25.048 16.278 -11.735 1.00 35.52 O flip ATOM 3055 NE2 GLN B 815 24.280 17.485 -10.010 1.00 30.89 N flip ATOM 0 H GLN B 815 28.824 15.529 -7.873 1.00 21.22 H new ATOM 0 HA GLN B 815 26.464 14.773 -7.036 1.00 23.51 H new ATOM 0 HB2 GLN B 815 26.612 16.542 -8.522 1.00 25.24 H new ATOM 0 HB3 GLN B 815 27.288 15.640 -9.599 1.00 25.24 H new ATOM 0 HG2 GLN B 815 25.299 14.520 -9.991 1.00 28.38 H new ATOM 0 HG3 GLN B 815 24.608 15.250 -8.799 1.00 28.38 H new ATOM 0 HE21 GLN B 815 24.144 17.572 -9.165 1.00 30.89 H new ATOM 0 HE22 GLN B 815 24.043 18.110 -10.551 1.00 30.89 H new ATOM 3056 N GLU B 816 27.986 12.719 -8.940 1.00 21.79 N ATOM 3057 CA GLU B 816 27.973 11.355 -9.456 1.00 20.28 C ATOM 3058 C GLU B 816 27.955 10.345 -8.315 1.00 20.18 C ATOM 3059 O GLU B 816 27.252 9.335 -8.378 1.00 18.78 O ATOM 3060 CB GLU B 816 29.193 11.100 -10.343 1.00 22.87 C ATOM 3061 CG GLU B 816 29.222 11.906 -11.635 1.00 22.61 C ATOM 3062 CD GLU B 816 29.393 13.397 -11.399 1.00 25.90 C ATOM 3063 OE1 GLU B 816 30.181 13.772 -10.509 1.00 24.02 O ATOM 3064 OE2 GLU B 816 28.748 14.196 -12.110 1.00 28.40 O ATOM 0 H GLU B 816 28.717 13.150 -9.081 1.00 21.79 H new ATOM 0 HA GLU B 816 27.168 11.248 -9.986 1.00 20.28 H new ATOM 0 HB2 GLU B 816 29.994 11.299 -9.834 1.00 22.87 H new ATOM 0 HB3 GLU B 816 29.225 10.156 -10.564 1.00 22.87 H new ATOM 0 HG2 GLU B 816 29.948 11.586 -12.194 1.00 22.61 H new ATOM 0 HG3 GLU B 816 28.399 11.753 -12.125 1.00 22.61 H new ATOM 3065 N GLU B 817 28.744 10.613 -7.279 1.00 19.28 N ATOM 3066 CA GLU B 817 28.804 9.734 -6.116 1.00 19.23 C ATOM 3067 C GLU B 817 27.466 9.788 -5.385 1.00 18.96 C ATOM 3068 O GLU B 817 26.906 8.758 -5.018 1.00 19.11 O ATOM 3069 CB GLU B 817 29.928 10.177 -5.178 1.00 20.42 C ATOM 3070 CG GLU B 817 31.336 9.857 -5.674 1.00 21.89 C ATOM 3071 CD GLU B 817 32.406 10.498 -4.811 1.00 23.38 C ATOM 3072 OE1 GLU B 817 33.528 9.959 -4.748 1.00 23.83 O ATOM 3073 OE2 GLU B 817 32.126 11.552 -4.201 1.00 26.54 O ATOM 0 H GLU B 817 29.255 11.303 -7.230 1.00 19.28 H new ATOM 0 HA GLU B 817 28.983 8.826 -6.405 1.00 19.23 H new ATOM 0 HB2 GLU B 817 29.857 11.134 -5.038 1.00 20.42 H new ATOM 0 HB3 GLU B 817 29.798 9.754 -4.315 1.00 20.42 H new ATOM 0 HG2 GLU B 817 31.463 8.895 -5.683 1.00 21.89 H new ATOM 0 HG3 GLU B 817 31.433 10.165 -6.589 1.00 21.89 H new ATOM 3074 N PHE B 818 26.962 11.000 -5.181 1.00 19.33 N ATOM 3075 CA PHE B 818 25.685 11.207 -4.509 1.00 18.37 C ATOM 3076 C PHE B 818 24.551 10.427 -5.175 1.00 18.10 C ATOM 3077 O PHE B 818 23.737 9.804 -4.498 1.00 18.72 O ATOM 3078 CB PHE B 818 25.326 12.697 -4.512 1.00 19.66 C ATOM 3079 CG PHE B 818 23.896 12.975 -4.127 1.00 20.20 C ATOM 3080 CD1 PHE B 818 23.471 12.825 -2.816 1.00 20.79 C ATOM 3081 CD2 PHE B 818 22.971 13.363 -5.083 1.00 19.48 C ATOM 3082 CE1 PHE B 818 22.152 13.055 -2.469 1.00 20.42 C ATOM 3083 CE2 PHE B 818 21.654 13.596 -4.746 1.00 19.55 C ATOM 3084 CZ PHE B 818 21.242 13.440 -3.433 1.00 20.59 C ATOM 0 H PHE B 818 27.351 11.726 -5.428 1.00 19.33 H new ATOM 0 HA PHE B 818 25.786 10.883 -3.600 1.00 18.37 H new ATOM 0 HB2 PHE B 818 25.915 13.165 -3.899 1.00 19.66 H new ATOM 0 HB3 PHE B 818 25.491 13.060 -5.396 1.00 19.66 H new ATOM 0 HD1 PHE B 818 24.080 12.567 -2.162 1.00 20.79 H new ATOM 0 HD2 PHE B 818 23.243 13.468 -5.966 1.00 19.48 H new ATOM 0 HE1 PHE B 818 21.878 12.950 -1.586 1.00 20.42 H new ATOM 0 HE2 PHE B 818 21.045 13.857 -5.398 1.00 19.55 H new ATOM 0 HZ PHE B 818 20.355 13.594 -3.201 1.00 20.59 H new ATOM 3085 N LEU B 819 24.494 10.467 -6.500 1.00 16.85 N ATOM 3086 CA LEU B 819 23.434 9.772 -7.224 1.00 16.65 C ATOM 3087 C LEU B 819 23.447 8.260 -7.023 1.00 16.14 C ATOM 3088 O LEU B 819 22.394 7.656 -6.815 1.00 15.79 O ATOM 3089 CB LEU B 819 23.509 10.114 -8.712 1.00 16.32 C ATOM 3090 CG LEU B 819 23.145 11.574 -8.984 1.00 16.70 C ATOM 3091 CD1 LEU B 819 23.482 11.945 -10.418 1.00 17.16 C ATOM 3092 CD2 LEU B 819 21.662 11.773 -8.705 1.00 17.60 C ATOM 0 H LEU B 819 25.055 10.888 -6.998 1.00 16.85 H new ATOM 0 HA LEU B 819 22.594 10.084 -6.853 1.00 16.65 H new ATOM 0 HB2 LEU B 819 24.406 9.939 -9.038 1.00 16.32 H new ATOM 0 HB3 LEU B 819 22.909 9.534 -9.207 1.00 16.32 H new ATOM 0 HG LEU B 819 23.660 12.154 -8.401 1.00 16.70 H new ATOM 0 HD11 LEU B 819 23.246 12.872 -10.576 1.00 17.16 H new ATOM 0 HD12 LEU B 819 24.432 11.823 -10.569 1.00 17.16 H new ATOM 0 HD13 LEU B 819 22.983 11.377 -11.025 1.00 17.16 H new ATOM 0 HD21 LEU B 819 21.422 12.697 -8.875 1.00 17.60 H new ATOM 0 HD22 LEU B 819 21.143 11.193 -9.284 1.00 17.60 H new ATOM 0 HD23 LEU B 819 21.475 11.556 -7.778 1.00 17.60 H new ATOM 3093 N CYS B 820 24.631 7.653 -7.074 1.00 15.85 N ATOM 3094 CA CYS B 820 24.768 6.213 -6.876 1.00 16.15 C ATOM 3095 C CYS B 820 24.489 5.845 -5.414 1.00 19.00 C ATOM 3096 O CYS B 820 23.850 4.824 -5.126 1.00 17.33 O ATOM 3097 CB CYS B 820 26.184 5.751 -7.263 1.00 17.60 C ATOM 3098 SG CYS B 820 26.579 5.876 -9.031 1.00 18.14 S ATOM 0 H CYS B 820 25.373 8.062 -7.223 1.00 15.85 H new ATOM 0 HA CYS B 820 24.122 5.766 -7.444 1.00 16.15 H new ATOM 0 HB2 CYS B 820 26.828 6.277 -6.764 1.00 17.60 H new ATOM 0 HB3 CYS B 820 26.295 4.828 -6.985 1.00 17.60 H new ATOM 0 HG CYS B 820 27.752 5.683 -9.194 1.00 18.14 H new ATOM 3099 N MET B 821 24.970 6.674 -4.490 1.00 17.05 N ATOM 3100 CA MET B 821 24.754 6.426 -3.069 1.00 17.95 C ATOM 3101 C MET B 821 23.264 6.455 -2.722 1.00 17.94 C ATOM 3102 O MET B 821 22.780 5.637 -1.931 1.00 17.14 O ATOM 3103 CB MET B 821 25.506 7.468 -2.232 1.00 18.51 C ATOM 3104 CG MET B 821 27.020 7.316 -2.268 1.00 18.64 C ATOM 3105 SD MET B 821 27.889 8.700 -1.482 1.00 22.49 S ATOM 3106 CE MET B 821 27.684 8.305 0.231 1.00 19.09 C ATOM 0 H MET B 821 25.423 7.384 -4.666 1.00 17.05 H new ATOM 0 HA MET B 821 25.095 5.542 -2.864 1.00 17.95 H new ATOM 0 HB2 MET B 821 25.272 8.354 -2.549 1.00 18.51 H new ATOM 0 HB3 MET B 821 25.206 7.408 -1.312 1.00 18.51 H new ATOM 0 HG2 MET B 821 27.268 6.490 -1.823 1.00 18.64 H new ATOM 0 HG3 MET B 821 27.311 7.240 -3.190 1.00 18.64 H new ATOM 0 HE1 MET B 821 28.114 8.984 0.774 1.00 19.09 H new ATOM 0 HE2 MET B 821 26.738 8.272 0.445 1.00 19.09 H new ATOM 0 HE3 MET B 821 28.087 7.442 0.415 1.00 19.09 H new ATOM 3107 N LYS B 822 22.538 7.394 -3.318 1.00 17.04 N ATOM 3108 CA LYS B 822 21.111 7.508 -3.064 1.00 18.81 C ATOM 3109 C LYS B 822 20.368 6.222 -3.471 1.00 18.33 C ATOM 3110 O LYS B 822 19.487 5.764 -2.746 1.00 17.16 O ATOM 3111 CB LYS B 822 20.537 8.727 -3.798 1.00 20.47 C ATOM 3112 CG LYS B 822 19.090 9.042 -3.435 1.00 19.04 C ATOM 3113 CD LYS B 822 18.774 10.535 -3.546 1.00 22.53 C ATOM 3114 CE LYS B 822 18.822 11.050 -4.978 1.00 20.49 C ATOM 3115 NZ LYS B 822 17.794 10.379 -5.819 1.00 22.33 N ATOM 0 H LYS B 822 22.853 7.973 -3.871 1.00 17.04 H new ATOM 0 HA LYS B 822 20.981 7.632 -2.111 1.00 18.81 H new ATOM 0 HB2 LYS B 822 21.087 9.501 -3.600 1.00 20.47 H new ATOM 0 HB3 LYS B 822 20.596 8.575 -4.754 1.00 20.47 H new ATOM 0 HG2 LYS B 822 18.497 8.544 -4.019 1.00 19.04 H new ATOM 0 HG3 LYS B 822 18.914 8.743 -2.529 1.00 19.04 H new ATOM 0 HD2 LYS B 822 17.892 10.702 -3.177 1.00 22.53 H new ATOM 0 HD3 LYS B 822 19.406 11.035 -3.007 1.00 22.53 H new ATOM 0 HE2 LYS B 822 18.676 12.009 -4.986 1.00 20.49 H new ATOM 0 HE3 LYS B 822 19.703 10.894 -5.352 1.00 20.49 H new ATOM 0 HZ1 LYS B 822 17.666 10.849 -6.564 1.00 22.33 H new ATOM 0 HZ2 LYS B 822 18.071 9.560 -6.030 1.00 22.33 H new ATOM 0 HZ3 LYS B 822 17.029 10.326 -5.367 1.00 22.33 H new ATOM 3116 N VAL B 823 20.729 5.632 -4.610 1.00 17.01 N ATOM 3117 CA VAL B 823 20.075 4.400 -5.039 1.00 16.70 C ATOM 3118 C VAL B 823 20.353 3.285 -4.043 1.00 16.75 C ATOM 3119 O VAL B 823 19.462 2.508 -3.709 1.00 17.27 O ATOM 3120 CB VAL B 823 20.556 3.922 -6.431 1.00 16.34 C ATOM 3121 CG1 VAL B 823 19.883 2.586 -6.778 1.00 14.10 C ATOM 3122 CG2 VAL B 823 20.242 4.969 -7.482 1.00 14.17 C ATOM 0 H VAL B 823 21.340 5.924 -5.140 1.00 17.01 H new ATOM 0 HA VAL B 823 19.127 4.599 -5.089 1.00 16.70 H new ATOM 0 HB VAL B 823 21.517 3.792 -6.411 1.00 16.34 H new ATOM 0 HG11 VAL B 823 20.185 2.288 -7.650 1.00 14.10 H new ATOM 0 HG12 VAL B 823 20.118 1.922 -6.111 1.00 14.10 H new ATOM 0 HG13 VAL B 823 18.920 2.703 -6.793 1.00 14.10 H new ATOM 0 HG21 VAL B 823 20.547 4.659 -8.349 1.00 14.17 H new ATOM 0 HG22 VAL B 823 19.284 5.120 -7.512 1.00 14.17 H new ATOM 0 HG23 VAL B 823 20.693 5.798 -7.258 1.00 14.17 H new ATOM 3123 N LEU B 824 21.593 3.198 -3.573 1.00 16.88 N ATOM 3124 CA LEU B 824 21.947 2.162 -2.614 1.00 16.80 C ATOM 3125 C LEU B 824 21.123 2.309 -1.332 1.00 15.32 C ATOM 3126 O LEU B 824 20.758 1.308 -0.709 1.00 14.71 O ATOM 3127 CB LEU B 824 23.457 2.206 -2.305 1.00 15.72 C ATOM 3128 CG LEU B 824 24.356 1.861 -3.505 1.00 19.07 C ATOM 3129 CD1 LEU B 824 25.821 2.005 -3.144 1.00 17.91 C ATOM 3130 CD2 LEU B 824 24.065 0.441 -3.960 1.00 17.68 C ATOM 0 H LEU B 824 22.237 3.723 -3.794 1.00 16.88 H new ATOM 0 HA LEU B 824 21.743 1.298 -3.005 1.00 16.80 H new ATOM 0 HB2 LEU B 824 23.686 3.093 -1.986 1.00 15.72 H new ATOM 0 HB3 LEU B 824 23.647 1.587 -1.583 1.00 15.72 H new ATOM 0 HG LEU B 824 24.164 2.480 -4.227 1.00 19.07 H new ATOM 0 HD11 LEU B 824 26.368 1.783 -3.914 1.00 17.91 H new ATOM 0 HD12 LEU B 824 26.000 2.919 -2.874 1.00 17.91 H new ATOM 0 HD13 LEU B 824 26.035 1.405 -2.412 1.00 17.91 H new ATOM 0 HD21 LEU B 824 24.631 0.221 -4.717 1.00 17.68 H new ATOM 0 HD22 LEU B 824 24.245 -0.175 -3.233 1.00 17.68 H new ATOM 0 HD23 LEU B 824 23.134 0.369 -4.222 1.00 17.68 H new ATOM 3131 N LEU B 825 20.820 3.548 -0.942 1.00 15.06 N ATOM 3132 CA LEU B 825 20.021 3.773 0.261 1.00 15.82 C ATOM 3133 C LEU B 825 18.631 3.166 0.081 1.00 16.73 C ATOM 3134 O LEU B 825 18.076 2.593 1.016 1.00 17.69 O ATOM 3135 CB LEU B 825 19.910 5.269 0.584 1.00 17.25 C ATOM 3136 CG LEU B 825 21.148 5.891 1.235 1.00 16.68 C ATOM 3137 CD1 LEU B 825 20.892 7.358 1.579 1.00 18.87 C ATOM 3138 CD2 LEU B 825 21.471 5.118 2.500 1.00 20.85 C ATOM 0 H LEU B 825 21.064 4.262 -1.354 1.00 15.06 H new ATOM 0 HA LEU B 825 20.466 3.341 1.007 1.00 15.82 H new ATOM 0 HB2 LEU B 825 19.719 5.749 -0.237 1.00 17.25 H new ATOM 0 HB3 LEU B 825 19.151 5.402 1.174 1.00 17.25 H new ATOM 0 HG LEU B 825 21.894 5.848 0.616 1.00 16.68 H new ATOM 0 HD11 LEU B 825 21.685 7.737 1.990 1.00 18.87 H new ATOM 0 HD12 LEU B 825 20.682 7.849 0.769 1.00 18.87 H new ATOM 0 HD13 LEU B 825 20.147 7.420 2.197 1.00 18.87 H new ATOM 0 HD21 LEU B 825 22.255 5.502 2.923 1.00 20.85 H new ATOM 0 HD22 LEU B 825 20.718 5.166 3.110 1.00 20.85 H new ATOM 0 HD23 LEU B 825 21.647 4.191 2.277 1.00 20.85 H new ATOM 3139 N LEU B 826 18.078 3.278 -1.124 1.00 16.38 N ATOM 3140 CA LEU B 826 16.766 2.706 -1.423 1.00 15.89 C ATOM 3141 C LEU B 826 16.814 1.185 -1.274 1.00 18.19 C ATOM 3142 O LEU B 826 15.809 0.549 -0.945 1.00 18.63 O ATOM 3143 CB LEU B 826 16.354 3.039 -2.859 1.00 16.63 C ATOM 3144 CG LEU B 826 15.163 2.232 -3.399 1.00 17.82 C ATOM 3145 CD1 LEU B 826 13.878 2.678 -2.686 1.00 17.44 C ATOM 3146 CD2 LEU B 826 15.030 2.427 -4.901 1.00 16.73 C ATOM 0 H LEU B 826 18.448 3.684 -1.786 1.00 16.38 H new ATOM 0 HA LEU B 826 16.123 3.083 -0.802 1.00 15.89 H new ATOM 0 HB2 LEU B 826 16.136 3.983 -2.908 1.00 16.63 H new ATOM 0 HB3 LEU B 826 17.116 2.894 -3.441 1.00 16.63 H new ATOM 0 HG LEU B 826 15.312 1.289 -3.227 1.00 17.82 H new ATOM 0 HD11 LEU B 826 13.126 2.169 -3.026 1.00 17.44 H new ATOM 0 HD12 LEU B 826 13.967 2.524 -1.732 1.00 17.44 H new ATOM 0 HD13 LEU B 826 13.729 3.623 -2.848 1.00 17.44 H new ATOM 0 HD21 LEU B 826 14.276 1.913 -5.229 1.00 16.73 H new ATOM 0 HD22 LEU B 826 14.889 3.367 -5.094 1.00 16.73 H new ATOM 0 HD23 LEU B 826 15.841 2.126 -5.340 1.00 16.73 H new ATOM 3147 N LEU B 827 17.995 0.615 -1.514 1.00 16.74 N ATOM 3148 CA LEU B 827 18.210 -0.826 -1.449 1.00 17.81 C ATOM 3149 C LEU B 827 19.067 -1.230 -0.244 1.00 18.95 C ATOM 3150 O LEU B 827 19.752 -2.255 -0.286 1.00 18.51 O ATOM 3151 CB LEU B 827 18.916 -1.284 -2.737 1.00 19.27 C ATOM 3152 CG LEU B 827 18.358 -0.797 -4.082 1.00 18.44 C ATOM 3153 CD1 LEU B 827 19.317 -1.187 -5.212 1.00 17.66 C ATOM 3154 CD2 LEU B 827 16.970 -1.395 -4.321 1.00 18.94 C ATOM 0 H LEU B 827 18.700 1.061 -1.721 1.00 16.74 H new ATOM 0 HA LEU B 827 17.343 -1.251 -1.354 1.00 17.81 H new ATOM 0 HB2 LEU B 827 19.843 -1.005 -2.682 1.00 19.27 H new ATOM 0 HB3 LEU B 827 18.912 -2.254 -2.748 1.00 19.27 H new ATOM 0 HG LEU B 827 18.276 0.169 -4.064 1.00 18.44 H new ATOM 0 HD11 LEU B 827 18.961 -0.878 -6.060 1.00 17.66 H new ATOM 0 HD12 LEU B 827 20.183 -0.779 -5.057 1.00 17.66 H new ATOM 0 HD13 LEU B 827 19.414 -2.152 -5.235 1.00 17.66 H new ATOM 0 HD21 LEU B 827 16.625 -1.083 -5.172 1.00 18.94 H new ATOM 0 HD22 LEU B 827 17.032 -2.363 -4.334 1.00 18.94 H new ATOM 0 HD23 LEU B 827 16.372 -1.119 -3.609 1.00 18.94 H new ATOM 3155 N ASN B 828 19.012 -0.451 0.834 1.00 18.93 N ATOM 3156 CA ASN B 828 19.843 -0.729 2.000 1.00 18.90 C ATOM 3157 C ASN B 828 19.192 -1.467 3.174 1.00 18.22 C ATOM 3158 O ASN B 828 19.829 -1.661 4.201 1.00 19.02 O ATOM 3159 CB ASN B 828 20.486 0.580 2.486 1.00 18.45 C ATOM 3160 CG ASN B 828 21.940 0.394 2.912 1.00 22.65 C ATOM 3161 OD1 ASN B 828 22.647 -0.465 2.380 1.00 21.32 O ATOM 3162 ND2 ASN B 828 22.395 1.209 3.860 1.00 19.08 N ATOM 0 H ASN B 828 18.504 0.238 0.909 1.00 18.93 H new ATOM 0 HA ASN B 828 20.499 -1.367 1.678 1.00 18.90 H new ATOM 0 HB2 ASN B 828 20.442 1.241 1.778 1.00 18.45 H new ATOM 0 HB3 ASN B 828 19.975 0.930 3.233 1.00 18.45 H new ATOM 0 HD21 ASN B 828 23.211 1.148 4.124 1.00 19.08 H new ATOM 0 HD22 ASN B 828 21.873 1.797 4.209 1.00 19.08 H new ATOM 3163 N THR B 829 17.937 -1.879 3.022 1.00 18.93 N ATOM 3164 CA THR B 829 17.235 -2.629 4.070 1.00 18.82 C ATOM 3165 C THR B 829 16.264 -3.628 3.441 1.00 19.24 C ATOM 3166 O THR B 829 15.499 -3.275 2.539 1.00 20.02 O ATOM 3167 CB THR B 829 16.397 -1.712 5.000 1.00 17.68 C ATOM 3168 OG1 THR B 829 17.229 -0.705 5.590 1.00 19.35 O ATOM 3169 CG2 THR B 829 15.766 -2.541 6.114 1.00 19.99 C ATOM 0 H THR B 829 17.468 -1.735 2.316 1.00 18.93 H new ATOM 0 HA THR B 829 17.924 -3.072 4.590 1.00 18.82 H new ATOM 0 HB THR B 829 15.705 -1.289 4.468 1.00 17.68 H new ATOM 0 HG1 THR B 829 17.109 0.026 5.194 1.00 19.35 H new ATOM 0 HG21 THR B 829 15.244 -1.963 6.692 1.00 19.99 H new ATOM 0 HG22 THR B 829 15.189 -3.217 5.727 1.00 19.99 H new ATOM 0 HG23 THR B 829 16.464 -2.971 6.633 1.00 19.99 H new ATOM 3170 N ILE B 830 16.298 -4.877 3.895 1.00 19.98 N ATOM 3171 CA ILE B 830 15.369 -5.872 3.378 1.00 17.79 C ATOM 3172 C ILE B 830 14.698 -6.570 4.549 1.00 18.42 C ATOM 3173 O ILE B 830 15.137 -6.441 5.694 1.00 18.73 O ATOM 3174 CB ILE B 830 16.066 -6.921 2.481 1.00 18.02 C ATOM 3175 CG1 ILE B 830 17.030 -7.780 3.305 1.00 19.60 C ATOM 3176 CG2 ILE B 830 16.788 -6.219 1.341 1.00 18.75 C ATOM 3177 CD1 ILE B 830 17.744 -8.852 2.476 1.00 16.84 C ATOM 0 H ILE B 830 16.844 -5.165 4.494 1.00 19.98 H new ATOM 0 HA ILE B 830 14.716 -5.413 2.827 1.00 17.79 H new ATOM 0 HB ILE B 830 15.397 -7.514 2.104 1.00 18.02 H new ATOM 0 HG12 ILE B 830 17.693 -7.205 3.719 1.00 19.60 H new ATOM 0 HG13 ILE B 830 16.538 -8.209 4.023 1.00 19.60 H new ATOM 0 HG21 ILE B 830 17.225 -6.878 0.779 1.00 18.75 H new ATOM 0 HG22 ILE B 830 16.148 -5.718 0.812 1.00 18.75 H new ATOM 0 HG23 ILE B 830 17.453 -5.613 1.703 1.00 18.75 H new ATOM 0 HD11 ILE B 830 18.338 -9.362 3.049 1.00 16.84 H new ATOM 0 HD12 ILE B 830 17.087 -9.447 2.081 1.00 16.84 H new ATOM 0 HD13 ILE B 830 18.259 -8.427 1.772 1.00 16.84 H new ATOM 3178 N PRO B 831 13.610 -7.302 4.285 1.00 17.15 N ATOM 3179 CA PRO B 831 12.910 -8.002 5.363 1.00 19.33 C ATOM 3180 C PRO B 831 13.785 -9.121 5.906 1.00 21.53 C ATOM 3181 O PRO B 831 14.697 -9.587 5.228 1.00 22.49 O ATOM 3182 CB PRO B 831 11.653 -8.541 4.677 1.00 18.88 C ATOM 3183 CG PRO B 831 11.473 -7.624 3.486 1.00 19.28 C ATOM 3184 CD PRO B 831 12.886 -7.436 3.011 1.00 16.82 C ATOM 0 HA PRO B 831 12.696 -7.441 6.125 1.00 19.33 H new ATOM 0 HB2 PRO B 831 11.765 -9.464 4.402 1.00 18.88 H new ATOM 0 HB3 PRO B 831 10.884 -8.512 5.268 1.00 18.88 H new ATOM 0 HG2 PRO B 831 10.912 -8.023 2.803 1.00 19.28 H new ATOM 0 HG3 PRO B 831 11.060 -6.783 3.736 1.00 19.28 H new ATOM 0 HD2 PRO B 831 13.200 -8.192 2.491 1.00 16.82 H new ATOM 0 HD3 PRO B 831 12.981 -6.649 2.453 1.00 16.82 H new ATOM 3185 N LEU B 832 13.512 -9.545 7.133 1.00 22.83 N ATOM 3186 CA LEU B 832 14.284 -10.616 7.741 1.00 25.22 C ATOM 3187 C LEU B 832 14.190 -11.878 6.891 1.00 25.68 C ATOM 3188 O LEU B 832 15.160 -12.622 6.768 1.00 25.59 O ATOM 3189 CB LEU B 832 13.775 -10.896 9.160 1.00 25.51 C ATOM 3190 CG LEU B 832 13.998 -9.758 10.159 1.00 27.00 C ATOM 3191 CD1 LEU B 832 13.260 -10.047 11.459 1.00 26.97 C ATOM 3192 CD2 LEU B 832 15.490 -9.592 10.406 1.00 27.59 C ATOM 0 H LEU B 832 12.885 -9.226 7.628 1.00 22.83 H new ATOM 0 HA LEU B 832 15.213 -10.341 7.792 1.00 25.22 H new ATOM 0 HB2 LEU B 832 12.826 -11.090 9.117 1.00 25.51 H new ATOM 0 HB3 LEU B 832 14.213 -11.694 9.495 1.00 25.51 H new ATOM 0 HG LEU B 832 13.646 -8.931 9.794 1.00 27.00 H new ATOM 0 HD11 LEU B 832 13.408 -9.320 12.084 1.00 26.97 H new ATOM 0 HD12 LEU B 832 12.310 -10.131 11.280 1.00 26.97 H new ATOM 0 HD13 LEU B 832 13.591 -10.875 11.842 1.00 26.97 H new ATOM 0 HD21 LEU B 832 15.635 -8.871 11.039 1.00 27.59 H new ATOM 0 HD22 LEU B 832 15.852 -10.416 10.767 1.00 27.59 H new ATOM 0 HD23 LEU B 832 15.935 -9.382 9.570 1.00 27.59 H new ATOM 3193 N GLU B 833 13.021 -12.111 6.302 1.00 26.76 N ATOM 3194 CA GLU B 833 12.812 -13.288 5.469 1.00 28.44 C ATOM 3195 C GLU B 833 13.233 -13.051 4.016 1.00 28.28 C ATOM 3196 O GLU B 833 13.152 -13.951 3.178 1.00 27.88 O ATOM 3197 CB GLU B 833 11.341 -13.729 5.522 1.00 31.44 C ATOM 3198 CG GLU B 833 10.330 -12.761 4.902 1.00 35.30 C ATOM 3199 CD GLU B 833 10.005 -11.558 5.781 1.00 38.13 C ATOM 3200 OE1 GLU B 833 9.129 -10.758 5.382 1.00 39.86 O ATOM 3201 OE2 GLU B 833 10.614 -11.405 6.863 1.00 38.51 O ATOM 0 H GLU B 833 12.335 -11.597 6.373 1.00 26.76 H new ATOM 0 HA GLU B 833 13.374 -13.993 5.827 1.00 28.44 H new ATOM 0 HB2 GLU B 833 11.261 -14.585 5.072 1.00 31.44 H new ATOM 0 HB3 GLU B 833 11.098 -13.873 6.450 1.00 31.44 H new ATOM 0 HG2 GLU B 833 10.677 -12.445 4.053 1.00 35.30 H new ATOM 0 HG3 GLU B 833 9.510 -13.242 4.712 1.00 35.30 H new ATOM 3202 N GLY B 834 13.685 -11.837 3.719 1.00 27.14 N ATOM 3203 CA GLY B 834 14.109 -11.526 2.369 1.00 26.44 C ATOM 3204 C GLY B 834 12.984 -11.060 1.466 1.00 26.25 C ATOM 3205 O GLY B 834 11.816 -11.042 1.862 1.00 27.56 O ATOM 0 H GLY B 834 13.752 -11.189 4.280 1.00 27.14 H new ATOM 0 HA2 GLY B 834 14.791 -10.837 2.404 1.00 26.44 H new ATOM 0 HA3 GLY B 834 14.521 -12.313 1.979 1.00 26.44 H new ATOM 3206 N LEU B 835 13.347 -10.686 0.243 1.00 25.80 N ATOM 3207 CA LEU B 835 12.395 -10.204 -0.751 1.00 25.78 C ATOM 3208 C LEU B 835 11.945 -11.321 -1.682 1.00 26.41 C ATOM 3209 O LEU B 835 12.614 -12.348 -1.821 1.00 26.53 O ATOM 3210 CB LEU B 835 13.028 -9.094 -1.587 1.00 23.83 C ATOM 3211 CG LEU B 835 13.494 -7.831 -0.854 1.00 26.19 C ATOM 3212 CD1 LEU B 835 14.374 -6.997 -1.775 1.00 23.46 C ATOM 3213 CD2 LEU B 835 12.283 -7.030 -0.388 1.00 23.00 C ATOM 0 H LEU B 835 14.161 -10.705 -0.035 1.00 25.80 H new ATOM 0 HA LEU B 835 11.622 -9.866 -0.273 1.00 25.78 H new ATOM 0 HB2 LEU B 835 13.792 -9.469 -2.052 1.00 23.83 H new ATOM 0 HB3 LEU B 835 12.387 -8.827 -2.264 1.00 23.83 H new ATOM 0 HG LEU B 835 14.015 -8.081 -0.075 1.00 26.19 H new ATOM 0 HD11 LEU B 835 14.667 -6.199 -1.308 1.00 23.46 H new ATOM 0 HD12 LEU B 835 15.148 -7.517 -2.042 1.00 23.46 H new ATOM 0 HD13 LEU B 835 13.869 -6.743 -2.563 1.00 23.46 H new ATOM 0 HD21 LEU B 835 12.582 -6.232 0.075 1.00 23.00 H new ATOM 0 HD22 LEU B 835 11.747 -6.776 -1.156 1.00 23.00 H new ATOM 0 HD23 LEU B 835 11.749 -7.572 0.214 1.00 23.00 H new ATOM 3214 N ARG B 836 10.811 -11.109 -2.333 1.00 26.72 N ATOM 3215 CA ARG B 836 10.291 -12.096 -3.257 1.00 28.66 C ATOM 3216 C ARG B 836 11.219 -12.230 -4.459 1.00 27.93 C ATOM 3217 O ARG B 836 11.477 -13.335 -4.927 1.00 28.29 O ATOM 3218 CB ARG B 836 8.885 -11.699 -3.698 1.00 29.23 C ATOM 3219 CG ARG B 836 7.962 -11.464 -2.520 1.00 33.23 C ATOM 3220 CD ARG B 836 6.513 -11.451 -2.939 1.00 35.71 C ATOM 3221 NE ARG B 836 6.152 -12.708 -3.580 1.00 39.42 N ATOM 3222 CZ ARG B 836 4.902 -13.100 -3.799 1.00 40.01 C ATOM 3223 NH1 ARG B 836 3.886 -12.332 -3.425 1.00 39.24 N ATOM 3224 NH2 ARG B 836 4.669 -14.262 -4.391 1.00 41.50 N ATOM 0 H ARG B 836 10.330 -10.401 -2.253 1.00 26.72 H new ATOM 0 HA ARG B 836 10.244 -12.957 -2.813 1.00 28.66 H new ATOM 0 HB2 ARG B 836 8.932 -10.893 -4.236 1.00 29.23 H new ATOM 0 HB3 ARG B 836 8.516 -12.396 -4.262 1.00 29.23 H new ATOM 0 HG2 ARG B 836 8.101 -12.158 -1.857 1.00 33.23 H new ATOM 0 HG3 ARG B 836 8.184 -10.619 -2.098 1.00 33.23 H new ATOM 0 HD2 ARG B 836 5.949 -11.304 -2.164 1.00 35.71 H new ATOM 0 HD3 ARG B 836 6.354 -10.714 -3.549 1.00 35.71 H new ATOM 0 HE ARG B 836 6.788 -13.229 -3.832 1.00 39.42 H new ATOM 0 HH11 ARG B 836 4.036 -11.578 -3.040 1.00 39.24 H new ATOM 0 HH12 ARG B 836 3.078 -12.588 -3.568 1.00 39.24 H new ATOM 0 HH21 ARG B 836 5.326 -14.761 -4.633 1.00 41.50 H new ATOM 0 HH22 ARG B 836 3.860 -14.517 -4.534 1.00 41.50 H new ATOM 3225 N SER B 837 11.721 -11.099 -4.950 1.00 27.29 N ATOM 3226 CA SER B 837 12.634 -11.078 -6.095 1.00 26.79 C ATOM 3227 C SER B 837 14.057 -10.888 -5.581 1.00 25.94 C ATOM 3228 O SER B 837 14.811 -10.054 -6.097 1.00 24.75 O ATOM 3229 CB SER B 837 12.283 -9.918 -7.032 1.00 27.47 C ATOM 3230 OG SER B 837 10.926 -9.966 -7.436 1.00 29.40 O ATOM 0 H SER B 837 11.543 -10.321 -4.630 1.00 27.29 H new ATOM 0 HA SER B 837 12.556 -11.913 -6.583 1.00 26.79 H new ATOM 0 HB2 SER B 837 12.459 -9.075 -6.585 1.00 27.47 H new ATOM 0 HB3 SER B 837 12.856 -9.949 -7.814 1.00 27.47 H new ATOM 0 HG SER B 837 10.872 -10.316 -8.198 1.00 29.40 H new ATOM 3231 N GLN B 838 14.416 -11.670 -4.567 1.00 25.47 N ATOM 3232 CA GLN B 838 15.732 -11.585 -3.940 1.00 26.19 C ATOM 3233 C GLN B 838 16.898 -11.652 -4.913 1.00 25.24 C ATOM 3234 O GLN B 838 17.823 -10.851 -4.829 1.00 24.69 O ATOM 3235 CB GLN B 838 15.894 -12.688 -2.886 1.00 25.16 C ATOM 3236 CG GLN B 838 17.122 -12.530 -1.995 1.00 26.22 C ATOM 3237 CD GLN B 838 17.109 -11.231 -1.197 1.00 28.43 C ATOM 3238 OE1 GLN B 838 16.054 -10.767 -0.766 1.00 31.32 O ATOM 3239 NE2 GLN B 838 18.286 -10.651 -0.982 1.00 24.48 N ATOM 0 H GLN B 838 13.902 -12.267 -4.222 1.00 25.47 H new ATOM 0 HA GLN B 838 15.763 -10.706 -3.531 1.00 26.19 H new ATOM 0 HB2 GLN B 838 15.102 -12.705 -2.327 1.00 25.16 H new ATOM 0 HB3 GLN B 838 15.942 -13.546 -3.336 1.00 25.16 H new ATOM 0 HG2 GLN B 838 17.171 -13.281 -1.383 1.00 26.22 H new ATOM 0 HG3 GLN B 838 17.921 -12.559 -2.544 1.00 26.22 H new ATOM 0 HE21 GLN B 838 19.003 -11.004 -1.299 1.00 24.48 H new ATOM 0 HE22 GLN B 838 18.330 -9.923 -0.526 1.00 24.48 H new ATOM 3240 N THR B 839 16.864 -12.611 -5.827 1.00 26.12 N ATOM 3241 CA THR B 839 17.947 -12.747 -6.792 1.00 26.93 C ATOM 3242 C THR B 839 18.081 -11.477 -7.627 1.00 25.88 C ATOM 3243 O THR B 839 19.175 -10.938 -7.799 1.00 25.08 O ATOM 3244 CB THR B 839 17.707 -13.941 -7.725 1.00 27.14 C ATOM 3245 OG1 THR B 839 17.547 -15.129 -6.937 1.00 30.04 O ATOM 3246 CG2 THR B 839 18.891 -14.122 -8.668 1.00 27.55 C ATOM 0 H THR B 839 16.231 -13.188 -5.907 1.00 26.12 H new ATOM 0 HA THR B 839 18.766 -12.896 -6.295 1.00 26.93 H new ATOM 0 HB THR B 839 16.908 -13.777 -8.249 1.00 27.14 H new ATOM 0 HG1 THR B 839 17.414 -15.786 -7.444 1.00 30.04 H new ATOM 0 HG21 THR B 839 18.727 -14.879 -9.252 1.00 27.55 H new ATOM 0 HG22 THR B 839 19.005 -13.321 -9.203 1.00 27.55 H new ATOM 0 HG23 THR B 839 19.696 -14.282 -8.150 1.00 27.55 H new ATOM 3247 N GLN B 840 16.952 -10.998 -8.133 1.00 25.49 N ATOM 3248 CA GLN B 840 16.924 -9.796 -8.950 1.00 24.95 C ATOM 3249 C GLN B 840 17.353 -8.581 -8.126 1.00 24.13 C ATOM 3250 O GLN B 840 18.044 -7.695 -8.619 1.00 23.77 O ATOM 3251 CB GLN B 840 15.518 -9.622 -9.504 1.00 28.25 C ATOM 3252 CG GLN B 840 14.983 -10.925 -10.095 1.00 34.44 C ATOM 3253 CD GLN B 840 13.558 -10.818 -10.584 1.00 35.80 C ATOM 3254 OE1 GLN B 840 12.632 -11.320 -9.949 1.00 40.52 O ATOM 3255 NE2 GLN B 840 13.372 -10.153 -11.718 1.00 36.98 N ATOM 0 H GLN B 840 16.182 -11.361 -8.012 1.00 25.49 H new ATOM 0 HA GLN B 840 17.549 -9.878 -9.687 1.00 24.95 H new ATOM 0 HB2 GLN B 840 14.926 -9.319 -8.798 1.00 28.25 H new ATOM 0 HB3 GLN B 840 15.521 -8.933 -10.187 1.00 28.25 H new ATOM 0 HG2 GLN B 840 15.552 -11.196 -10.832 1.00 34.44 H new ATOM 0 HG3 GLN B 840 15.037 -11.623 -9.424 1.00 34.44 H new ATOM 0 HE21 GLN B 840 14.045 -9.816 -12.134 1.00 36.98 H new ATOM 0 HE22 GLN B 840 12.579 -10.059 -12.036 1.00 36.98 H new ATOM 3256 N PHE B 841 16.947 -8.551 -6.861 1.00 23.05 N ATOM 3257 CA PHE B 841 17.313 -7.453 -5.979 1.00 21.59 C ATOM 3258 C PHE B 841 18.828 -7.427 -5.834 1.00 21.33 C ATOM 3259 O PHE B 841 19.466 -6.395 -6.006 1.00 17.91 O ATOM 3260 CB PHE B 841 16.696 -7.646 -4.594 1.00 19.98 C ATOM 3261 CG PHE B 841 17.288 -6.750 -3.547 1.00 20.07 C ATOM 3262 CD1 PHE B 841 16.874 -5.436 -3.427 1.00 19.41 C ATOM 3263 CD2 PHE B 841 18.286 -7.216 -2.699 1.00 20.33 C ATOM 3264 CE1 PHE B 841 17.436 -4.599 -2.486 1.00 19.48 C ATOM 3265 CE2 PHE B 841 18.855 -6.383 -1.754 1.00 18.54 C ATOM 3266 CZ PHE B 841 18.429 -5.072 -1.648 1.00 20.10 C ATOM 0 H PHE B 841 16.459 -9.157 -6.495 1.00 23.05 H new ATOM 0 HA PHE B 841 16.986 -6.623 -6.359 1.00 21.59 H new ATOM 0 HB2 PHE B 841 15.741 -7.483 -4.647 1.00 19.98 H new ATOM 0 HB3 PHE B 841 16.811 -8.570 -4.322 1.00 19.98 H new ATOM 0 HD1 PHE B 841 16.207 -5.112 -3.989 1.00 19.41 H new ATOM 0 HD2 PHE B 841 18.574 -8.098 -2.768 1.00 20.33 H new ATOM 0 HE1 PHE B 841 17.148 -3.718 -2.415 1.00 19.48 H new ATOM 0 HE2 PHE B 841 19.522 -6.703 -1.191 1.00 18.54 H new ATOM 0 HZ PHE B 841 18.810 -4.509 -1.014 1.00 20.10 H new ATOM 3267 N GLU B 842 19.385 -8.585 -5.499 1.00 21.61 N ATOM 3268 CA GLU B 842 20.814 -8.731 -5.308 1.00 22.71 C ATOM 3269 C GLU B 842 21.582 -8.262 -6.547 1.00 22.67 C ATOM 3270 O GLU B 842 22.606 -7.598 -6.434 1.00 21.51 O ATOM 3271 CB GLU B 842 21.133 -10.196 -5.001 1.00 25.72 C ATOM 3272 CG GLU B 842 22.268 -10.389 -4.031 1.00 28.86 C ATOM 3273 CD GLU B 842 21.936 -9.922 -2.626 1.00 27.25 C ATOM 3274 OE1 GLU B 842 21.117 -10.574 -1.951 1.00 32.50 O ATOM 3275 OE2 GLU B 842 22.496 -8.899 -2.192 1.00 28.44 O ATOM 0 H GLU B 842 18.939 -9.310 -5.376 1.00 21.61 H new ATOM 0 HA GLU B 842 21.092 -8.177 -4.562 1.00 22.71 H new ATOM 0 HB2 GLU B 842 20.338 -10.622 -4.643 1.00 25.72 H new ATOM 0 HB3 GLU B 842 21.349 -10.650 -5.830 1.00 25.72 H new ATOM 0 HG2 GLU B 842 22.508 -11.328 -4.005 1.00 28.86 H new ATOM 0 HG3 GLU B 842 23.046 -9.906 -4.351 1.00 28.86 H new ATOM 3276 N GLU B 843 21.084 -8.596 -7.732 1.00 22.50 N ATOM 3277 CA GLU B 843 21.757 -8.178 -8.959 1.00 23.80 C ATOM 3278 C GLU B 843 21.688 -6.664 -9.185 1.00 21.96 C ATOM 3279 O GLU B 843 22.666 -6.049 -9.607 1.00 22.52 O ATOM 3280 CB GLU B 843 21.179 -8.923 -10.163 1.00 24.35 C ATOM 3281 CG GLU B 843 21.728 -10.339 -10.304 1.00 28.82 C ATOM 3282 CD GLU B 843 21.154 -11.093 -11.495 1.00 28.96 C ATOM 3283 OE1 GLU B 843 20.838 -10.460 -12.523 1.00 33.46 O ATOM 3284 OE2 GLU B 843 21.041 -12.328 -11.408 1.00 33.34 O ATOM 0 H GLU B 843 20.368 -9.058 -7.849 1.00 22.50 H new ATOM 0 HA GLU B 843 22.695 -8.406 -8.859 1.00 23.80 H new ATOM 0 HB2 GLU B 843 20.213 -8.962 -10.080 1.00 24.35 H new ATOM 0 HB3 GLU B 843 21.374 -8.423 -10.971 1.00 24.35 H new ATOM 0 HG2 GLU B 843 22.693 -10.298 -10.390 1.00 28.82 H new ATOM 0 HG3 GLU B 843 21.537 -10.835 -9.493 1.00 28.82 H new ATOM 3285 N MET B 844 20.539 -6.064 -8.900 1.00 20.12 N ATOM 3286 CA MET B 844 20.385 -4.622 -9.064 1.00 19.56 C ATOM 3287 C MET B 844 21.306 -3.872 -8.096 1.00 20.21 C ATOM 3288 O MET B 844 22.013 -2.944 -8.492 1.00 18.51 O ATOM 3289 CB MET B 844 18.938 -4.214 -8.804 1.00 20.06 C ATOM 3290 CG MET B 844 18.704 -2.707 -8.830 1.00 18.22 C ATOM 3291 SD MET B 844 16.975 -2.310 -8.491 1.00 18.94 S ATOM 3292 CE MET B 844 17.036 -0.519 -8.531 1.00 13.40 C ATOM 0 H MET B 844 19.838 -6.470 -8.611 1.00 20.12 H new ATOM 0 HA MET B 844 20.626 -4.392 -9.975 1.00 19.56 H new ATOM 0 HB2 MET B 844 18.369 -4.632 -9.470 1.00 20.06 H new ATOM 0 HB3 MET B 844 18.664 -4.560 -7.940 1.00 20.06 H new ATOM 0 HG2 MET B 844 19.272 -2.277 -8.172 1.00 18.22 H new ATOM 0 HG3 MET B 844 18.956 -2.353 -9.697 1.00 18.22 H new ATOM 0 HE1 MET B 844 16.292 -0.158 -8.024 1.00 13.40 H new ATOM 0 HE2 MET B 844 17.870 -0.215 -8.141 1.00 13.40 H new ATOM 0 HE3 MET B 844 16.978 -0.214 -9.450 1.00 13.40 H new ATOM 3293 N ARG B 845 21.294 -4.283 -6.829 1.00 19.61 N ATOM 3294 CA ARG B 845 22.128 -3.652 -5.810 1.00 19.19 C ATOM 3295 C ARG B 845 23.608 -3.737 -6.182 1.00 19.23 C ATOM 3296 O ARG B 845 24.347 -2.752 -6.083 1.00 16.48 O ATOM 3297 CB ARG B 845 21.884 -4.322 -4.457 1.00 22.10 C ATOM 3298 CG ARG B 845 22.772 -3.848 -3.320 1.00 22.71 C ATOM 3299 CD ARG B 845 22.321 -4.502 -2.013 1.00 27.46 C ATOM 3300 NE ARG B 845 23.399 -4.598 -1.033 1.00 29.50 N ATOM 3301 CZ ARG B 845 23.798 -3.604 -0.254 1.00 30.08 C ATOM 3302 NH1 ARG B 845 23.203 -2.417 -0.328 1.00 33.83 N ATOM 3303 NH2 ARG B 845 24.800 -3.798 0.592 1.00 29.76 N ATOM 0 H ARG B 845 20.807 -4.929 -6.539 1.00 19.61 H new ATOM 0 HA ARG B 845 21.887 -2.714 -5.753 1.00 19.19 H new ATOM 0 HB2 ARG B 845 20.959 -4.178 -4.205 1.00 22.10 H new ATOM 0 HB3 ARG B 845 22.003 -5.279 -4.562 1.00 22.10 H new ATOM 0 HG2 ARG B 845 23.697 -4.074 -3.504 1.00 22.71 H new ATOM 0 HG3 ARG B 845 22.726 -2.882 -3.242 1.00 22.71 H new ATOM 0 HD2 ARG B 845 21.589 -3.990 -1.635 1.00 27.46 H new ATOM 0 HD3 ARG B 845 21.979 -5.390 -2.201 1.00 27.46 H new ATOM 0 HE ARG B 845 23.803 -5.353 -0.956 1.00 29.50 H new ATOM 0 HH11 ARG B 845 22.557 -2.293 -0.883 1.00 33.83 H new ATOM 0 HH12 ARG B 845 23.464 -1.773 0.179 1.00 33.83 H new ATOM 0 HH21 ARG B 845 25.186 -4.565 0.632 1.00 29.76 H new ATOM 0 HH22 ARG B 845 25.064 -3.157 1.100 1.00 29.76 H new ATOM 3304 N SER B 846 24.042 -4.915 -6.615 1.00 19.23 N ATOM 3305 CA SER B 846 25.435 -5.096 -7.003 1.00 20.31 C ATOM 3306 C SER B 846 25.771 -4.197 -8.190 1.00 20.22 C ATOM 3307 O SER B 846 26.883 -3.684 -8.289 1.00 18.65 O ATOM 3308 CB SER B 846 25.704 -6.565 -7.357 1.00 20.78 C ATOM 3309 OG SER B 846 25.561 -7.396 -6.215 1.00 20.64 O ATOM 0 H SER B 846 23.551 -5.617 -6.691 1.00 19.23 H new ATOM 0 HA SER B 846 26.001 -4.850 -6.254 1.00 20.31 H new ATOM 0 HB2 SER B 846 25.089 -6.852 -8.050 1.00 20.78 H new ATOM 0 HB3 SER B 846 26.600 -6.656 -7.718 1.00 20.78 H new ATOM 0 HG SER B 846 26.006 -8.100 -6.323 1.00 20.64 H new ATOM 3310 N SER B 847 24.802 -4.004 -9.085 1.00 21.05 N ATOM 3311 CA SER B 847 25.000 -3.150 -10.258 1.00 20.69 C ATOM 3312 C SER B 847 25.276 -1.711 -9.836 1.00 21.06 C ATOM 3313 O SER B 847 26.173 -1.055 -10.374 1.00 22.34 O ATOM 3314 CB SER B 847 23.762 -3.176 -11.163 1.00 21.29 C ATOM 3315 OG ASER B 847 23.524 -4.470 -11.687 0.50 24.80 O ATOM 3316 OG BSER B 847 23.946 -2.332 -12.287 0.50 19.11 O ATOM 0 H SER B 847 24.021 -4.359 -9.031 1.00 21.05 H new ATOM 0 HA SER B 847 25.764 -3.495 -10.747 1.00 20.69 H new ATOM 0 HB2ASER B 847 22.986 -2.883 -10.660 0.50 21.29 H new ATOM 0 HB2BSER B 847 23.591 -4.084 -11.459 0.50 21.29 H new ATOM 0 HB3ASER B 847 23.881 -2.548 -11.893 0.50 21.29 H new ATOM 0 HB3BSER B 847 22.983 -2.889 -10.661 0.50 21.29 H new ATOM 0 HG ASER B 847 23.184 -4.955 -11.092 0.50 19.11 H new ATOM 0 HG BSER B 847 24.650 -2.551 -12.690 0.50 19.11 H new ATOM 3317 N TYR B 848 24.503 -1.211 -8.874 1.00 17.78 N ATOM 3318 CA TYR B 848 24.708 0.153 -8.413 1.00 17.22 C ATOM 3319 C TYR B 848 25.963 0.313 -7.557 1.00 17.65 C ATOM 3320 O TYR B 848 26.546 1.396 -7.487 1.00 16.36 O ATOM 3321 CB TYR B 848 23.460 0.645 -7.685 1.00 16.47 C ATOM 3322 CG TYR B 848 22.368 0.991 -8.663 1.00 14.83 C ATOM 3323 CD1 TYR B 848 22.373 2.208 -9.329 1.00 15.80 C ATOM 3324 CD2 TYR B 848 21.366 0.074 -8.970 1.00 15.37 C ATOM 3325 CE1 TYR B 848 21.414 2.509 -10.278 1.00 17.06 C ATOM 3326 CE2 TYR B 848 20.403 0.361 -9.912 1.00 16.75 C ATOM 3327 CZ TYR B 848 20.429 1.578 -10.566 1.00 17.96 C ATOM 3328 OH TYR B 848 19.482 1.861 -11.523 1.00 17.21 O ATOM 0 H TYR B 848 23.867 -1.638 -8.483 1.00 17.78 H new ATOM 0 HA TYR B 848 24.857 0.707 -9.195 1.00 17.22 H new ATOM 0 HB2 TYR B 848 23.147 -0.040 -7.074 1.00 16.47 H new ATOM 0 HB3 TYR B 848 23.679 1.424 -7.150 1.00 16.47 H new ATOM 0 HD1 TYR B 848 23.034 2.833 -9.133 1.00 15.80 H new ATOM 0 HD2 TYR B 848 21.347 -0.746 -8.532 1.00 15.37 H new ATOM 0 HE1 TYR B 848 21.430 3.328 -10.719 1.00 17.06 H new ATOM 0 HE2 TYR B 848 19.739 -0.261 -10.107 1.00 16.75 H new ATOM 0 HH TYR B 848 18.944 1.218 -11.584 1.00 17.21 H new ATOM 3329 N ILE B 849 26.390 -0.766 -6.913 1.00 17.87 N ATOM 3330 CA ILE B 849 27.606 -0.701 -6.123 1.00 18.33 C ATOM 3331 C ILE B 849 28.745 -0.574 -7.144 1.00 17.96 C ATOM 3332 O ILE B 849 29.692 0.195 -6.958 1.00 17.55 O ATOM 3333 CB ILE B 849 27.781 -1.976 -5.267 1.00 19.54 C ATOM 3334 CG1 ILE B 849 26.671 -2.039 -4.209 1.00 17.81 C ATOM 3335 CG2 ILE B 849 29.162 -1.993 -4.643 1.00 13.93 C ATOM 3336 CD1 ILE B 849 26.744 -3.244 -3.296 1.00 18.33 C ATOM 0 H ILE B 849 25.997 -1.531 -6.921 1.00 17.87 H new ATOM 0 HA ILE B 849 27.589 0.044 -5.502 1.00 18.33 H new ATOM 0 HB ILE B 849 27.705 -2.765 -5.826 1.00 19.54 H new ATOM 0 HG12 ILE B 849 26.709 -1.235 -3.668 1.00 17.81 H new ATOM 0 HG13 ILE B 849 25.811 -2.039 -4.658 1.00 17.81 H new ATOM 0 HG21 ILE B 849 29.265 -2.795 -4.107 1.00 13.93 H new ATOM 0 HG22 ILE B 849 29.834 -1.983 -5.343 1.00 13.93 H new ATOM 0 HG23 ILE B 849 29.272 -1.212 -4.079 1.00 13.93 H new ATOM 0 HD11 ILE B 849 26.013 -3.212 -2.659 1.00 18.33 H new ATOM 0 HD12 ILE B 849 26.677 -4.055 -3.824 1.00 18.33 H new ATOM 0 HD13 ILE B 849 27.589 -3.238 -2.819 1.00 18.33 H new ATOM 3337 N ARG B 850 28.642 -1.320 -8.238 1.00 18.27 N ATOM 3338 CA ARG B 850 29.661 -1.240 -9.278 1.00 19.53 C ATOM 3339 C ARG B 850 29.663 0.160 -9.889 1.00 19.61 C ATOM 3340 O ARG B 850 30.718 0.673 -10.286 1.00 18.82 O ATOM 3341 CB ARG B 850 29.412 -2.267 -10.390 1.00 18.85 C ATOM 3342 CG ARG B 850 29.611 -3.719 -9.972 1.00 19.81 C ATOM 3343 CD ARG B 850 29.758 -4.633 -11.188 1.00 19.83 C ATOM 3344 NE ARG B 850 28.519 -4.774 -11.948 1.00 22.07 N ATOM 3345 CZ ARG B 850 27.499 -5.548 -11.582 1.00 24.87 C ATOM 3346 NH1 ARG B 850 27.567 -6.260 -10.460 1.00 24.21 N ATOM 3347 NH2 ARG B 850 26.411 -5.617 -12.339 1.00 24.82 N ATOM 0 H ARG B 850 28.001 -1.871 -8.397 1.00 18.27 H new ATOM 0 HA ARG B 850 30.519 -1.432 -8.867 1.00 19.53 H new ATOM 0 HB2 ARG B 850 28.505 -2.159 -10.716 1.00 18.85 H new ATOM 0 HB3 ARG B 850 30.006 -2.073 -11.132 1.00 18.85 H new ATOM 0 HG2 ARG B 850 30.401 -3.791 -9.413 1.00 19.81 H new ATOM 0 HG3 ARG B 850 28.857 -4.010 -9.436 1.00 19.81 H new ATOM 0 HD2 ARG B 850 30.450 -4.281 -11.769 1.00 19.83 H new ATOM 0 HD3 ARG B 850 30.053 -5.509 -10.894 1.00 19.83 H new ATOM 0 HE ARG B 850 28.443 -4.328 -12.680 1.00 22.07 H new ATOM 0 HH11 ARG B 850 28.271 -6.221 -9.968 1.00 24.21 H new ATOM 0 HH12 ARG B 850 26.906 -6.759 -10.227 1.00 24.21 H new ATOM 0 HH21 ARG B 850 26.364 -5.162 -13.067 1.00 24.82 H new ATOM 0 HH22 ARG B 850 25.753 -6.117 -12.102 1.00 24.82 H new ATOM 3348 N GLU B 851 28.485 0.777 -9.964 1.00 17.98 N ATOM 3349 CA GLU B 851 28.372 2.113 -10.542 1.00 17.52 C ATOM 3350 C GLU B 851 28.965 3.171 -9.607 1.00 18.52 C ATOM 3351 O GLU B 851 29.562 4.147 -10.068 1.00 18.57 O ATOM 3352 CB GLU B 851 26.910 2.439 -10.858 1.00 16.96 C ATOM 3353 CG GLU B 851 26.747 3.498 -11.940 1.00 18.87 C ATOM 3354 CD GLU B 851 27.304 3.045 -13.289 1.00 22.42 C ATOM 3355 OE1 GLU B 851 27.424 3.896 -14.200 1.00 20.67 O ATOM 3356 OE2 GLU B 851 27.617 1.837 -13.436 1.00 19.65 O ATOM 0 H GLU B 851 27.743 0.441 -9.687 1.00 17.98 H new ATOM 0 HA GLU B 851 28.879 2.125 -11.369 1.00 17.52 H new ATOM 0 HB2 GLU B 851 26.458 1.628 -11.138 1.00 16.96 H new ATOM 0 HB3 GLU B 851 26.471 2.743 -10.048 1.00 16.96 H new ATOM 0 HG2 GLU B 851 25.807 3.714 -12.038 1.00 18.87 H new ATOM 0 HG3 GLU B 851 27.198 4.311 -11.664 1.00 18.87 H new ATOM 3357 N LEU B 852 28.801 2.979 -8.299 1.00 16.18 N ATOM 3358 CA LEU B 852 29.357 3.911 -7.329 1.00 18.49 C ATOM 3359 C LEU B 852 30.874 3.911 -7.524 1.00 19.66 C ATOM 3360 O LEU B 852 31.521 4.968 -7.501 1.00 17.98 O ATOM 3361 CB LEU B 852 29.010 3.468 -5.902 1.00 17.18 C ATOM 3362 CG LEU B 852 29.679 4.225 -4.750 1.00 17.37 C ATOM 3363 CD1 LEU B 852 29.410 5.716 -4.889 1.00 15.22 C ATOM 3364 CD2 LEU B 852 29.156 3.700 -3.411 1.00 17.82 C ATOM 0 H LEU B 852 28.372 2.317 -7.957 1.00 16.18 H new ATOM 0 HA LEU B 852 28.990 4.799 -7.459 1.00 18.49 H new ATOM 0 HB2 LEU B 852 28.049 3.540 -5.791 1.00 17.18 H new ATOM 0 HB3 LEU B 852 29.236 2.529 -5.816 1.00 17.18 H new ATOM 0 HG LEU B 852 30.638 4.082 -4.782 1.00 17.37 H new ATOM 0 HD11 LEU B 852 29.835 6.191 -4.158 1.00 15.22 H new ATOM 0 HD12 LEU B 852 29.770 6.033 -5.732 1.00 15.22 H new ATOM 0 HD13 LEU B 852 28.454 5.876 -4.865 1.00 15.22 H new ATOM 0 HD21 LEU B 852 29.582 4.182 -2.685 1.00 17.82 H new ATOM 0 HD22 LEU B 852 28.196 3.830 -3.365 1.00 17.82 H new ATOM 0 HD23 LEU B 852 29.358 2.754 -3.333 1.00 17.82 H new ATOM 3365 N ILE B 853 31.426 2.712 -7.718 1.00 20.96 N ATOM 3366 CA ILE B 853 32.854 2.526 -7.936 1.00 21.15 C ATOM 3367 C ILE B 853 33.307 3.325 -9.149 1.00 22.21 C ATOM 3368 O ILE B 853 34.380 3.930 -9.129 1.00 22.96 O ATOM 3369 CB ILE B 853 33.182 1.032 -8.147 1.00 21.05 C ATOM 3370 CG1 ILE B 853 32.930 0.269 -6.842 1.00 21.67 C ATOM 3371 CG2 ILE B 853 34.624 0.865 -8.609 1.00 20.11 C ATOM 3372 CD1 ILE B 853 32.949 -1.230 -6.990 1.00 21.75 C ATOM 0 H ILE B 853 30.975 1.980 -7.726 1.00 20.96 H new ATOM 0 HA ILE B 853 33.326 2.842 -7.149 1.00 21.15 H new ATOM 0 HB ILE B 853 32.607 0.669 -8.838 1.00 21.05 H new ATOM 0 HG12 ILE B 853 33.602 0.528 -6.192 1.00 21.67 H new ATOM 0 HG13 ILE B 853 32.070 0.538 -6.483 1.00 21.67 H new ATOM 0 HG21 ILE B 853 34.816 -0.077 -8.737 1.00 20.11 H new ATOM 0 HG22 ILE B 853 34.753 1.338 -9.446 1.00 20.11 H new ATOM 0 HG23 ILE B 853 35.223 1.228 -7.938 1.00 20.11 H new ATOM 0 HD11 ILE B 853 32.783 -1.643 -6.128 1.00 21.75 H new ATOM 0 HD12 ILE B 853 32.260 -1.502 -7.616 1.00 21.75 H new ATOM 0 HD13 ILE B 853 33.816 -1.512 -7.321 1.00 21.75 H new ATOM 3373 N LYS B 854 32.488 3.338 -10.198 1.00 22.54 N ATOM 3374 CA LYS B 854 32.830 4.081 -11.408 1.00 22.29 C ATOM 3375 C LYS B 854 32.811 5.580 -11.132 1.00 22.28 C ATOM 3376 O LYS B 854 33.684 6.314 -11.612 1.00 20.01 O ATOM 3377 CB LYS B 854 31.861 3.748 -12.554 1.00 23.92 C ATOM 3378 CG LYS B 854 31.962 2.316 -13.064 1.00 26.24 C ATOM 3379 CD LYS B 854 31.148 2.138 -14.331 1.00 30.00 C ATOM 3380 CE LYS B 854 31.028 0.680 -14.683 1.00 33.40 C ATOM 3381 NZ LYS B 854 30.175 -0.040 -13.698 1.00 39.14 N ATOM 0 H LYS B 854 31.734 2.926 -10.230 1.00 22.54 H new ATOM 0 HA LYS B 854 33.724 3.818 -11.677 1.00 22.29 H new ATOM 0 HB2 LYS B 854 30.953 3.910 -12.253 1.00 23.92 H new ATOM 0 HB3 LYS B 854 32.028 4.355 -13.292 1.00 23.92 H new ATOM 0 HG2 LYS B 854 32.890 2.094 -13.237 1.00 26.24 H new ATOM 0 HG3 LYS B 854 31.646 1.702 -12.382 1.00 26.24 H new ATOM 0 HD2 LYS B 854 30.265 2.520 -14.210 1.00 30.00 H new ATOM 0 HD3 LYS B 854 31.568 2.619 -15.061 1.00 30.00 H new ATOM 0 HE2 LYS B 854 30.649 0.589 -15.571 1.00 33.40 H new ATOM 0 HE3 LYS B 854 31.910 0.276 -14.708 1.00 33.40 H new ATOM 0 HZ1 LYS B 854 30.679 -0.597 -13.220 1.00 39.14 H new ATOM 0 HZ2 LYS B 854 29.786 0.549 -13.155 1.00 39.14 H new ATOM 0 HZ3 LYS B 854 29.549 -0.503 -14.129 1.00 39.14 H new ATOM 3382 N ALA B 855 31.822 6.032 -10.360 1.00 20.94 N ATOM 3383 CA ALA B 855 31.691 7.450 -10.021 1.00 20.89 C ATOM 3384 C ALA B 855 32.935 7.915 -9.280 1.00 20.55 C ATOM 3385 O ALA B 855 33.449 9.000 -9.548 1.00 20.40 O ATOM 3386 CB ALA B 855 30.446 7.684 -9.153 1.00 17.73 C ATOM 0 H ALA B 855 31.212 5.529 -10.020 1.00 20.94 H new ATOM 0 HA ALA B 855 31.594 7.960 -10.841 1.00 20.89 H new ATOM 0 HB1 ALA B 855 30.374 8.627 -8.938 1.00 17.73 H new ATOM 0 HB2 ALA B 855 29.655 7.402 -9.639 1.00 17.73 H new ATOM 0 HB3 ALA B 855 30.521 7.170 -8.334 1.00 17.73 H new ATOM 3387 N ILE B 856 33.405 7.094 -8.349 1.00 21.12 N ATOM 3388 CA ILE B 856 34.595 7.410 -7.570 1.00 24.17 C ATOM 3389 C ILE B 856 35.805 7.522 -8.493 1.00 25.58 C ATOM 3390 O ILE B 856 36.652 8.395 -8.314 1.00 25.34 O ATOM 3391 CB ILE B 856 34.859 6.321 -6.510 1.00 23.07 C ATOM 3392 CG1 ILE B 856 33.775 6.384 -5.422 1.00 22.64 C ATOM 3393 CG2 ILE B 856 36.255 6.495 -5.922 1.00 24.72 C ATOM 3394 CD1 ILE B 856 33.788 5.195 -4.476 1.00 22.62 C ATOM 0 H ILE B 856 33.044 6.339 -8.151 1.00 21.12 H new ATOM 0 HA ILE B 856 34.448 8.256 -7.119 1.00 24.17 H new ATOM 0 HB ILE B 856 34.819 5.444 -6.924 1.00 23.07 H new ATOM 0 HG12 ILE B 856 33.892 7.198 -4.907 1.00 22.64 H new ATOM 0 HG13 ILE B 856 32.905 6.440 -5.847 1.00 22.64 H new ATOM 0 HG21 ILE B 856 36.414 5.807 -5.257 1.00 24.72 H new ATOM 0 HG22 ILE B 856 36.916 6.420 -6.628 1.00 24.72 H new ATOM 0 HG23 ILE B 856 36.325 7.369 -5.506 1.00 24.72 H new ATOM 0 HD11 ILE B 856 33.083 5.297 -3.818 1.00 22.62 H new ATOM 0 HD12 ILE B 856 33.644 4.379 -4.980 1.00 22.62 H new ATOM 0 HD13 ILE B 856 34.646 5.149 -4.026 1.00 22.62 H new ATOM 3395 N GLY B 857 35.871 6.635 -9.481 1.00 26.73 N ATOM 3396 CA GLY B 857 36.985 6.638 -10.413 1.00 29.06 C ATOM 3397 C GLY B 857 37.003 7.875 -11.288 1.00 30.56 C ATOM 3398 O GLY B 857 38.036 8.192 -11.886 1.00 30.67 O ATOM 0 H GLY B 857 35.281 6.026 -9.626 1.00 26.73 H new ATOM 0 HA2 GLY B 857 37.817 6.583 -9.918 1.00 29.06 H new ATOM 0 HA3 GLY B 857 36.936 5.849 -10.974 1.00 29.06 H new ATOM 3399 N LEU B 858 35.870 8.569 -11.376 1.00 30.75 N ATOM 3400 CA LEU B 858 35.779 9.771 -12.196 1.00 31.88 C ATOM 3401 C LEU B 858 36.672 10.882 -11.655 1.00 33.55 C ATOM 3402 O LEU B 858 37.046 11.798 -12.393 1.00 32.34 O ATOM 3403 CB LEU B 858 34.333 10.258 -12.265 1.00 31.19 C ATOM 3404 CG LEU B 858 33.384 9.387 -13.061 1.00 30.56 C ATOM 3405 CD1 LEU B 858 31.965 9.939 -12.964 1.00 30.22 C ATOM 3406 CD2 LEU B 858 33.887 9.339 -14.489 1.00 29.51 C ATOM 0 H LEU B 858 35.143 8.359 -10.968 1.00 30.75 H new ATOM 0 HA LEU B 858 36.084 9.543 -13.088 1.00 31.88 H new ATOM 0 HB2 LEU B 858 33.992 10.336 -11.360 1.00 31.19 H new ATOM 0 HB3 LEU B 858 34.327 11.149 -12.649 1.00 31.19 H new ATOM 0 HG LEU B 858 33.355 8.484 -12.708 1.00 30.56 H new ATOM 0 HD11 LEU B 858 31.363 9.376 -13.476 1.00 30.22 H new ATOM 0 HD12 LEU B 858 31.685 9.951 -12.035 1.00 30.22 H new ATOM 0 HD13 LEU B 858 31.944 10.841 -13.319 1.00 30.22 H new ATOM 0 HD21 LEU B 858 33.295 8.786 -15.022 1.00 29.51 H new ATOM 0 HD22 LEU B 858 33.907 10.237 -14.856 1.00 29.51 H new ATOM 0 HD23 LEU B 858 34.781 8.964 -14.505 1.00 29.51 H new ATOM 3407 N ARG B 859 37.041 10.791 -10.382 1.00 35.21 N ATOM 3408 CA ARG B 859 37.869 11.822 -9.767 1.00 39.88 C ATOM 3409 C ARG B 859 39.051 11.238 -9.020 1.00 42.71 C ATOM 3410 O ARG B 859 40.163 11.767 -9.096 1.00 43.97 O ATOM 3411 CB ARG B 859 37.028 12.653 -8.817 1.00 39.32 C ATOM 0 H ARG B 859 36.824 10.144 -9.859 1.00 35.21 H new ATOM 0 HA ARG B 859 38.219 12.379 -10.480 1.00 39.88 H new ATOM 3412 N GLN B 860 38.809 10.157 -8.292 1.00 45.68 N ATOM 3413 CA GLN B 860 39.859 9.507 -7.527 1.00 47.95 C ATOM 3414 C GLN B 860 40.840 8.812 -8.454 1.00 49.53 C ATOM 3415 O GLN B 860 40.449 8.054 -9.340 1.00 50.41 O ATOM 3416 CB GLN B 860 39.264 8.505 -6.536 1.00 20.00 C ATOM 3417 CG GLN B 860 38.429 9.140 -5.436 1.00 20.00 C ATOM 3418 CD GLN B 860 39.221 10.115 -4.590 1.00 20.00 C ATOM 3419 OE1 GLN B 860 40.382 9.863 -4.265 1.00 20.00 O ATOM 3420 NE2 GLN B 860 38.597 11.233 -4.231 1.00 20.00 N ATOM 0 H GLN B 860 38.037 9.783 -8.228 1.00 45.68 H new ATOM 0 HA GLN B 860 40.335 10.188 -7.026 1.00 47.95 H new ATOM 0 HB2 GLN B 860 38.713 7.872 -7.023 1.00 20.00 H new ATOM 0 HB3 GLN B 860 39.985 7.999 -6.130 1.00 20.00 H new ATOM 0 HG2 GLN B 860 37.674 9.602 -5.834 1.00 20.00 H new ATOM 0 HG3 GLN B 860 38.067 8.443 -4.866 1.00 20.00 H new ATOM 0 HE21 GLN B 860 37.785 11.371 -4.479 1.00 20.00 H new ATOM 0 HE22 GLN B 860 39.005 11.818 -3.751 1.00 20.00 H new ATOM 3421 N LYS B 861 42.119 9.087 -8.262 1.00 49.27 N ATOM 3422 CA LYS B 861 43.150 8.466 -9.075 1.00 49.33 C ATOM 3423 C LYS B 861 44.161 7.811 -8.141 1.00 48.58 C ATOM 3424 O LYS B 861 44.564 8.394 -7.134 1.00 49.62 O ATOM 3425 CB LYS B 861 43.828 9.522 -9.964 1.00 50.38 C ATOM 0 H LYS B 861 42.412 9.632 -7.665 1.00 49.27 H new ATOM 0 HA LYS B 861 42.763 7.794 -9.658 1.00 49.33 H new ATOM 3426 N GLY B 862 44.554 6.595 -8.483 1.00 46.92 N ATOM 3427 CA GLY B 862 45.493 5.864 -7.666 1.00 44.87 C ATOM 3428 C GLY B 862 44.613 4.838 -7.018 1.00 43.59 C ATOM 3429 O GLY B 862 43.609 5.193 -6.409 1.00 42.07 O ATOM 0 H GLY B 862 44.286 6.178 -9.186 1.00 46.92 H new ATOM 0 HA2 GLY B 862 46.195 5.456 -8.197 1.00 44.87 H new ATOM 0 HA3 GLY B 862 45.926 6.435 -7.013 1.00 44.87 H new ATOM 3430 N VAL B 863 44.953 3.573 -7.201 1.00 41.88 N ATOM 3431 CA VAL B 863 44.169 2.472 -6.664 1.00 40.76 C ATOM 3432 C VAL B 863 43.864 2.597 -5.168 1.00 39.65 C ATOM 3433 O VAL B 863 42.783 2.212 -4.707 1.00 38.74 O ATOM 3434 CB VAL B 863 44.902 1.152 -6.913 1.00 42.18 C ATOM 3435 CG1 VAL B 863 45.502 1.182 -8.313 1.00 43.38 C ATOM 3436 CG2 VAL B 863 45.981 0.936 -5.861 1.00 41.97 C ATOM 0 H VAL B 863 45.649 3.326 -7.642 1.00 41.88 H new ATOM 0 HA VAL B 863 43.317 2.497 -7.127 1.00 40.76 H new ATOM 0 HB VAL B 863 44.279 0.412 -6.848 1.00 42.18 H new ATOM 0 HG11 VAL B 863 45.970 0.349 -8.483 1.00 43.38 H new ATOM 0 HG12 VAL B 863 44.794 1.293 -8.966 1.00 43.38 H new ATOM 0 HG13 VAL B 863 46.125 1.922 -8.383 1.00 43.38 H new ATOM 0 HG21 VAL B 863 46.436 0.097 -6.032 1.00 41.97 H new ATOM 0 HG22 VAL B 863 46.621 1.664 -5.899 1.00 41.97 H new ATOM 0 HG23 VAL B 863 45.574 0.910 -4.981 1.00 41.97 H new ATOM 3437 N VAL B 864 44.821 3.137 -4.420 1.00 36.97 N ATOM 3438 CA VAL B 864 44.691 3.286 -2.978 1.00 36.02 C ATOM 3439 C VAL B 864 43.651 4.322 -2.560 1.00 34.24 C ATOM 3440 O VAL B 864 42.756 4.017 -1.771 1.00 32.93 O ATOM 3441 CB VAL B 864 46.050 3.647 -2.355 1.00 37.19 C ATOM 3442 CG1 VAL B 864 45.892 3.872 -0.865 1.00 36.85 C ATOM 3443 CG2 VAL B 864 47.050 2.525 -2.622 1.00 36.89 C ATOM 0 H VAL B 864 45.566 3.428 -4.737 1.00 36.97 H new ATOM 0 HA VAL B 864 44.382 2.428 -2.648 1.00 36.02 H new ATOM 0 HB VAL B 864 46.382 4.465 -2.757 1.00 37.19 H new ATOM 0 HG11 VAL B 864 46.752 4.099 -0.479 1.00 36.85 H new ATOM 0 HG12 VAL B 864 45.267 4.598 -0.712 1.00 36.85 H new ATOM 0 HG13 VAL B 864 45.555 3.063 -0.449 1.00 36.85 H new ATOM 0 HG21 VAL B 864 47.906 2.754 -2.229 1.00 36.89 H new ATOM 0 HG22 VAL B 864 46.724 1.700 -2.229 1.00 36.89 H new ATOM 0 HG23 VAL B 864 47.156 2.406 -3.579 1.00 36.89 H new ATOM 3444 N SER B 865 43.766 5.537 -3.087 1.00 31.58 N ATOM 3445 CA SER B 865 42.840 6.602 -2.740 1.00 31.93 C ATOM 3446 C SER B 865 41.419 6.280 -3.190 1.00 30.77 C ATOM 3447 O SER B 865 40.466 6.620 -2.494 1.00 28.22 O ATOM 3448 CB SER B 865 43.286 7.922 -3.368 1.00 33.08 C ATOM 3449 OG SER B 865 42.906 7.987 -4.739 1.00 38.38 O ATOM 0 H SER B 865 44.376 5.763 -3.649 1.00 31.58 H new ATOM 0 HA SER B 865 42.843 6.684 -1.773 1.00 31.93 H new ATOM 0 HB2 SER B 865 42.892 8.664 -2.884 1.00 33.08 H new ATOM 0 HB3 SER B 865 44.249 8.012 -3.291 1.00 33.08 H new ATOM 0 HG SER B 865 43.586 8.127 -5.212 1.00 38.38 H new ATOM 3450 N SER B 866 41.275 5.630 -4.341 1.00 29.47 N ATOM 3451 CA SER B 866 39.950 5.296 -4.850 1.00 28.86 C ATOM 3452 C SER B 866 39.396 4.162 -4.008 1.00 29.17 C ATOM 3453 O SER B 866 38.190 4.070 -3.795 1.00 26.30 O ATOM 3454 CB SER B 866 40.024 4.873 -6.316 1.00 29.99 C ATOM 3455 OG SER B 866 40.461 3.527 -6.414 1.00 34.88 O ATOM 0 H SER B 866 41.928 5.375 -4.839 1.00 29.47 H new ATOM 0 HA SER B 866 39.372 6.073 -4.796 1.00 28.86 H new ATOM 0 HB2 SER B 866 39.153 4.969 -6.732 1.00 29.99 H new ATOM 0 HB3 SER B 866 40.634 5.454 -6.797 1.00 29.99 H new ATOM 0 HG SER B 866 40.498 3.302 -7.223 1.00 34.88 H new ATOM 3456 N SER B 867 40.290 3.311 -3.519 1.00 28.37 N ATOM 3457 CA SER B 867 39.908 2.185 -2.679 1.00 29.35 C ATOM 3458 C SER B 867 39.453 2.714 -1.324 1.00 28.49 C ATOM 3459 O SER B 867 38.470 2.232 -0.753 1.00 27.65 O ATOM 3460 CB SER B 867 41.096 1.235 -2.493 1.00 30.12 C ATOM 3461 OG SER B 867 40.767 0.190 -1.588 1.00 37.41 O ATOM 0 H SER B 867 41.135 3.371 -3.665 1.00 28.37 H new ATOM 0 HA SER B 867 39.186 1.696 -3.103 1.00 29.35 H new ATOM 0 HB2 SER B 867 41.352 0.859 -3.350 1.00 30.12 H new ATOM 0 HB3 SER B 867 41.862 1.729 -2.160 1.00 30.12 H new ATOM 0 HG SER B 867 41.427 -0.322 -1.498 1.00 37.41 H new ATOM 3462 N GLN B 868 40.166 3.717 -0.827 1.00 26.56 N ATOM 3463 CA GLN B 868 39.851 4.321 0.457 1.00 26.90 C ATOM 3464 C GLN B 868 38.555 5.108 0.364 1.00 25.06 C ATOM 3465 O GLN B 868 37.784 5.156 1.320 1.00 23.57 O ATOM 3466 CB GLN B 868 40.995 5.234 0.906 1.00 25.98 C ATOM 0 H GLN B 868 40.844 4.065 -1.225 1.00 26.56 H new ATOM 0 HA GLN B 868 39.739 3.616 1.114 1.00 26.90 H new ATOM 3467 N ARG B 869 38.318 5.709 -0.796 1.00 23.81 N ATOM 3468 CA ARG B 869 37.120 6.504 -1.028 1.00 22.90 C ATOM 3469 C ARG B 869 35.874 5.627 -0.961 1.00 23.49 C ATOM 3470 O ARG B 869 34.865 6.021 -0.386 1.00 20.84 O ATOM 3471 CB ARG B 869 37.196 7.174 -2.402 1.00 24.68 C ATOM 3472 CG ARG B 869 36.017 8.059 -2.752 1.00 24.92 C ATOM 3473 CD ARG B 869 36.081 9.334 -1.944 1.00 28.20 C ATOM 3474 NE ARG B 869 35.147 10.340 -2.432 1.00 26.71 N ATOM 3475 CZ ARG B 869 35.021 11.544 -1.884 1.00 26.72 C ATOM 3476 NH1 ARG B 869 35.774 11.878 -0.833 1.00 28.52 N ATOM 3477 NH2 ARG B 869 34.152 12.421 -2.365 1.00 25.28 N ATOM 0 H ARG B 869 38.848 5.667 -1.472 1.00 23.81 H new ATOM 0 HA ARG B 869 37.065 7.183 -0.338 1.00 22.90 H new ATOM 0 HB2 ARG B 869 38.006 7.707 -2.442 1.00 24.68 H new ATOM 0 HB3 ARG B 869 37.277 6.484 -3.079 1.00 24.68 H new ATOM 0 HG2 ARG B 869 36.026 8.265 -3.700 1.00 24.92 H new ATOM 0 HG3 ARG B 869 35.186 7.592 -2.571 1.00 24.92 H new ATOM 0 HD2 ARG B 869 35.885 9.137 -1.015 1.00 28.20 H new ATOM 0 HD3 ARG B 869 36.983 9.690 -1.975 1.00 28.20 H new ATOM 0 HE ARG B 869 34.653 10.145 -3.108 1.00 26.71 H new ATOM 0 HH11 ARG B 869 36.339 11.314 -0.512 1.00 28.52 H new ATOM 0 HH12 ARG B 869 35.694 12.657 -0.477 1.00 28.52 H new ATOM 0 HH21 ARG B 869 33.661 12.214 -3.040 1.00 25.28 H new ATOM 0 HH22 ARG B 869 34.079 13.197 -2.002 1.00 25.28 H new ATOM 3478 N PHE B 870 35.946 4.442 -1.554 1.00 22.87 N ATOM 3479 CA PHE B 870 34.817 3.533 -1.563 1.00 24.71 C ATOM 3480 C PHE B 870 34.494 3.176 -0.124 1.00 25.50 C ATOM 3481 O PHE B 870 33.337 3.051 0.263 1.00 26.24 O ATOM 3482 CB PHE B 870 35.168 2.268 -2.340 1.00 23.28 C ATOM 3483 CG PHE B 870 34.072 1.252 -2.353 1.00 23.23 C ATOM 3484 CD1 PHE B 870 32.971 1.414 -3.176 1.00 25.21 C ATOM 3485 CD2 PHE B 870 34.131 0.140 -1.534 1.00 22.21 C ATOM 3486 CE1 PHE B 870 31.956 0.486 -3.175 1.00 23.73 C ATOM 3487 CE2 PHE B 870 33.116 -0.783 -1.534 1.00 22.35 C ATOM 3488 CZ PHE B 870 32.031 -0.614 -2.357 1.00 22.63 C ATOM 0 H PHE B 870 36.645 4.147 -1.958 1.00 22.87 H new ATOM 0 HA PHE B 870 34.054 3.952 -1.990 1.00 24.71 H new ATOM 0 HB2 PHE B 870 35.387 2.509 -3.254 1.00 23.28 H new ATOM 0 HB3 PHE B 870 35.964 1.870 -1.953 1.00 23.28 H new ATOM 0 HD1 PHE B 870 32.917 2.156 -3.734 1.00 25.21 H new ATOM 0 HD2 PHE B 870 34.866 0.016 -0.978 1.00 22.21 H new ATOM 0 HE1 PHE B 870 31.218 0.604 -3.729 1.00 23.73 H new ATOM 0 HE2 PHE B 870 33.163 -1.525 -0.975 1.00 22.35 H new ATOM 0 HZ PHE B 870 31.347 -1.244 -2.361 1.00 22.63 H new ATOM 3489 N TYR B 871 35.540 3.001 0.663 1.00 26.32 N ATOM 3490 CA TYR B 871 35.395 2.652 2.059 1.00 28.75 C ATOM 3491 C TYR B 871 34.665 3.752 2.817 1.00 27.79 C ATOM 3492 O TYR B 871 33.731 3.487 3.575 1.00 27.10 O ATOM 3493 CB TYR B 871 36.776 2.448 2.675 1.00 33.06 C ATOM 3494 CG TYR B 871 36.752 2.389 4.172 1.00 39.61 C ATOM 3495 CD1 TYR B 871 36.587 1.183 4.829 1.00 42.03 C ATOM 3496 CD2 TYR B 871 36.840 3.548 4.937 1.00 42.37 C ATOM 3497 CE1 TYR B 871 36.504 1.127 6.203 1.00 44.97 C ATOM 3498 CE2 TYR B 871 36.753 3.498 6.313 1.00 45.08 C ATOM 3499 CZ TYR B 871 36.589 2.288 6.940 1.00 45.74 C ATOM 3500 OH TYR B 871 36.520 2.230 8.315 1.00 48.51 O ATOM 0 H TYR B 871 36.355 3.082 0.401 1.00 26.32 H new ATOM 0 HA TYR B 871 34.877 1.834 2.122 1.00 28.75 H new ATOM 0 HB2 TYR B 871 37.159 1.626 2.331 1.00 33.06 H new ATOM 0 HB3 TYR B 871 37.359 3.171 2.395 1.00 33.06 H new ATOM 0 HD1 TYR B 871 36.531 0.397 4.335 1.00 42.03 H new ATOM 0 HD2 TYR B 871 36.959 4.368 4.515 1.00 42.37 H new ATOM 0 HE1 TYR B 871 36.391 0.309 6.631 1.00 44.97 H new ATOM 0 HE2 TYR B 871 36.805 4.280 6.813 1.00 45.08 H new ATOM 0 HH TYR B 871 36.586 3.005 8.632 1.00 48.51 H new ATOM 3501 N GLN B 872 35.123 4.984 2.630 1.00 26.32 N ATOM 3502 CA GLN B 872 34.544 6.139 3.305 1.00 25.22 C ATOM 3503 C GLN B 872 33.066 6.327 2.991 1.00 25.14 C ATOM 3504 O GLN B 872 32.246 6.429 3.904 1.00 23.71 O ATOM 3505 CB GLN B 872 35.287 7.410 2.911 1.00 26.53 C ATOM 3506 CG GLN B 872 36.710 7.468 3.411 1.00 29.47 C ATOM 3507 CD GLN B 872 37.387 8.747 2.980 1.00 31.84 C ATOM 3508 OE1 GLN B 872 37.695 8.929 1.802 1.00 34.51 O ATOM 3509 NE2 GLN B 872 37.615 9.651 3.929 1.00 34.81 N ATOM 0 H GLN B 872 35.779 5.174 2.108 1.00 26.32 H new ATOM 0 HA GLN B 872 34.632 5.970 4.256 1.00 25.22 H new ATOM 0 HB2 GLN B 872 35.290 7.485 1.944 1.00 26.53 H new ATOM 0 HB3 GLN B 872 34.802 8.177 3.254 1.00 26.53 H new ATOM 0 HG2 GLN B 872 36.718 7.405 4.379 1.00 29.47 H new ATOM 0 HG3 GLN B 872 37.206 6.706 3.072 1.00 29.47 H new ATOM 0 HE21 GLN B 872 37.386 9.488 4.742 1.00 34.81 H new ATOM 0 HE22 GLN B 872 37.992 10.398 3.730 1.00 34.81 H new ATOM 3510 N LEU B 873 32.736 6.389 1.705 1.00 23.55 N ATOM 3511 CA LEU B 873 31.361 6.599 1.272 1.00 23.48 C ATOM 3512 C LEU B 873 30.425 5.477 1.729 1.00 22.10 C ATOM 3513 O LEU B 873 29.281 5.741 2.097 1.00 22.12 O ATOM 3514 CB LEU B 873 31.320 6.758 -0.250 1.00 22.73 C ATOM 3515 CG LEU B 873 32.126 7.945 -0.761 1.00 22.39 C ATOM 3516 CD1 LEU B 873 31.966 8.085 -2.273 1.00 21.00 C ATOM 3517 CD2 LEU B 873 31.657 9.199 -0.038 1.00 22.99 C ATOM 0 H LEU B 873 33.301 6.311 1.062 1.00 23.55 H new ATOM 0 HA LEU B 873 31.039 7.412 1.691 1.00 23.48 H new ATOM 0 HB2 LEU B 873 31.657 5.947 -0.662 1.00 22.73 H new ATOM 0 HB3 LEU B 873 30.397 6.857 -0.533 1.00 22.73 H new ATOM 0 HG LEU B 873 33.069 7.808 -0.581 1.00 22.39 H new ATOM 0 HD11 LEU B 873 32.484 8.844 -2.585 1.00 21.00 H new ATOM 0 HD12 LEU B 873 32.282 7.278 -2.708 1.00 21.00 H new ATOM 0 HD13 LEU B 873 31.030 8.223 -2.488 1.00 21.00 H new ATOM 0 HD21 LEU B 873 32.163 9.964 -0.355 1.00 22.99 H new ATOM 0 HD22 LEU B 873 30.714 9.341 -0.214 1.00 22.99 H new ATOM 0 HD23 LEU B 873 31.795 9.093 0.916 1.00 22.99 H new ATOM 3518 N THR B 874 30.909 4.240 1.737 1.00 21.20 N ATOM 3519 CA THR B 874 30.096 3.115 2.156 1.00 21.49 C ATOM 3520 C THR B 874 29.990 3.107 3.675 1.00 22.20 C ATOM 3521 O THR B 874 29.011 2.620 4.234 1.00 21.85 O ATOM 3522 CB THR B 874 30.706 1.793 1.645 1.00 22.49 C ATOM 3523 OG1 THR B 874 32.083 1.715 2.036 1.00 24.71 O ATOM 3524 CG2 THR B 874 30.622 1.735 0.123 1.00 23.08 C ATOM 0 H THR B 874 31.710 4.034 1.502 1.00 21.20 H new ATOM 0 HA THR B 874 29.207 3.201 1.778 1.00 21.49 H new ATOM 0 HB THR B 874 30.211 1.051 2.027 1.00 22.49 H new ATOM 0 HG1 THR B 874 32.570 1.967 1.400 1.00 24.71 H new ATOM 0 HG21 THR B 874 31.007 0.902 -0.191 1.00 23.08 H new ATOM 0 HG22 THR B 874 29.693 1.785 -0.152 1.00 23.08 H new ATOM 0 HG23 THR B 874 31.112 2.481 -0.257 1.00 23.08 H new ATOM 3525 N LYS B 875 30.992 3.666 4.338 1.00 22.27 N ATOM 3526 CA LYS B 875 30.984 3.725 5.791 1.00 23.80 C ATOM 3527 C LYS B 875 29.992 4.810 6.176 1.00 23.58 C ATOM 3528 O LYS B 875 29.330 4.715 7.210 1.00 22.81 O ATOM 3529 CB LYS B 875 32.380 4.056 6.327 1.00 24.17 C ATOM 3530 CG LYS B 875 32.465 4.061 7.845 1.00 30.21 C ATOM 3531 CD LYS B 875 32.031 2.711 8.381 1.00 31.94 C ATOM 3532 CE LYS B 875 32.113 2.660 9.891 1.00 34.82 C ATOM 3533 NZ LYS B 875 31.919 1.267 10.405 1.00 36.14 N ATOM 0 H LYS B 875 31.684 4.016 3.967 1.00 22.27 H new ATOM 0 HA LYS B 875 30.730 2.870 6.172 1.00 23.80 H new ATOM 0 HB2 LYS B 875 33.014 3.410 5.977 1.00 24.17 H new ATOM 0 HB3 LYS B 875 32.648 4.926 5.993 1.00 24.17 H new ATOM 0 HG2 LYS B 875 33.373 4.255 8.127 1.00 30.21 H new ATOM 0 HG3 LYS B 875 31.900 4.761 8.208 1.00 30.21 H new ATOM 0 HD2 LYS B 875 31.121 2.527 8.099 1.00 31.94 H new ATOM 0 HD3 LYS B 875 32.591 2.016 8.002 1.00 31.94 H new ATOM 0 HE2 LYS B 875 32.976 2.996 10.181 1.00 34.82 H new ATOM 0 HE3 LYS B 875 31.439 3.244 10.273 1.00 34.82 H new ATOM 0 HZ1 LYS B 875 31.885 1.280 11.294 1.00 36.14 H new ATOM 0 HZ2 LYS B 875 31.158 0.935 10.085 1.00 36.14 H new ATOM 0 HZ3 LYS B 875 32.599 0.756 10.142 1.00 36.14 H new ATOM 3534 N LEU B 876 29.897 5.838 5.334 1.00 22.25 N ATOM 3535 CA LEU B 876 28.966 6.936 5.577 1.00 22.16 C ATOM 3536 C LEU B 876 27.553 6.369 5.516 1.00 22.73 C ATOM 3537 O LEU B 876 26.725 6.642 6.381 1.00 22.70 O ATOM 3538 CB LEU B 876 29.140 8.048 4.531 1.00 20.75 C ATOM 3539 CG LEU B 876 28.321 9.317 4.769 1.00 21.15 C ATOM 3540 CD1 LEU B 876 28.921 10.466 3.983 1.00 19.96 C ATOM 3541 CD2 LEU B 876 26.868 9.083 4.378 1.00 21.48 C ATOM 0 H LEU B 876 30.364 5.918 4.616 1.00 22.25 H new ATOM 0 HA LEU B 876 29.139 7.329 6.447 1.00 22.16 H new ATOM 0 HB2 LEU B 876 30.078 8.291 4.494 1.00 20.75 H new ATOM 0 HB3 LEU B 876 28.905 7.690 3.661 1.00 20.75 H new ATOM 0 HG LEU B 876 28.344 9.545 5.711 1.00 21.15 H new ATOM 0 HD11 LEU B 876 28.400 11.270 4.136 1.00 19.96 H new ATOM 0 HD12 LEU B 876 29.835 10.614 4.272 1.00 19.96 H new ATOM 0 HD13 LEU B 876 28.913 10.251 3.037 1.00 19.96 H new ATOM 0 HD21 LEU B 876 26.357 9.893 4.532 1.00 21.48 H new ATOM 0 HD22 LEU B 876 26.820 8.845 3.439 1.00 21.48 H new ATOM 0 HD23 LEU B 876 26.501 8.362 4.913 1.00 21.48 H new ATOM 3542 N LEU B 877 27.297 5.561 4.493 1.00 21.22 N ATOM 3543 CA LEU B 877 25.992 4.935 4.319 1.00 20.34 C ATOM 3544 C LEU B 877 25.656 4.021 5.498 1.00 20.66 C ATOM 3545 O LEU B 877 24.520 4.020 5.977 1.00 20.50 O ATOM 3546 CB LEU B 877 25.940 4.150 2.999 1.00 18.65 C ATOM 3547 CG LEU B 877 25.959 5.022 1.737 1.00 18.79 C ATOM 3548 CD1 LEU B 877 26.074 4.156 0.496 1.00 17.66 C ATOM 3549 CD2 LEU B 877 24.693 5.876 1.687 1.00 17.82 C ATOM 0 H LEU B 877 27.871 5.361 3.884 1.00 21.22 H new ATOM 0 HA LEU B 877 25.326 5.640 4.286 1.00 20.34 H new ATOM 0 HB2 LEU B 877 26.694 3.541 2.969 1.00 18.65 H new ATOM 0 HB3 LEU B 877 25.136 3.607 2.991 1.00 18.65 H new ATOM 0 HG LEU B 877 26.732 5.608 1.765 1.00 18.79 H new ATOM 0 HD11 LEU B 877 26.085 4.720 -0.293 1.00 17.66 H new ATOM 0 HD12 LEU B 877 26.895 3.641 0.536 1.00 17.66 H new ATOM 0 HD13 LEU B 877 25.316 3.553 0.451 1.00 17.66 H new ATOM 0 HD21 LEU B 877 24.706 6.427 0.889 1.00 17.82 H new ATOM 0 HD22 LEU B 877 23.914 5.299 1.669 1.00 17.82 H new ATOM 0 HD23 LEU B 877 24.655 6.445 2.472 1.00 17.82 H new ATOM 3550 N ASP B 878 26.635 3.248 5.969 1.00 19.73 N ATOM 3551 CA ASP B 878 26.403 2.371 7.120 1.00 19.56 C ATOM 3552 C ASP B 878 25.982 3.202 8.332 1.00 18.60 C ATOM 3553 O ASP B 878 25.069 2.820 9.066 1.00 19.58 O ATOM 3554 CB ASP B 878 27.668 1.581 7.492 1.00 20.17 C ATOM 3555 CG ASP B 878 27.965 0.443 6.525 1.00 23.19 C ATOM 3556 OD1 ASP B 878 27.127 0.158 5.647 1.00 21.43 O ATOM 3557 OD2 ASP B 878 29.040 -0.181 6.656 1.00 23.34 O ATOM 0 H ASP B 878 27.430 3.215 5.643 1.00 19.73 H new ATOM 0 HA ASP B 878 25.702 1.748 6.872 1.00 19.56 H new ATOM 0 HB2 ASP B 878 28.426 2.186 7.514 1.00 20.17 H new ATOM 0 HB3 ASP B 878 27.566 1.220 8.387 1.00 20.17 H new ATOM 3558 N ASN B 879 26.648 4.338 8.530 1.00 17.44 N ATOM 3559 CA ASN B 879 26.369 5.222 9.662 1.00 20.88 C ATOM 3560 C ASN B 879 24.987 5.857 9.617 1.00 21.38 C ATOM 3561 O ASN B 879 24.395 6.152 10.662 1.00 20.23 O ATOM 3562 CB ASN B 879 27.423 6.334 9.758 1.00 20.07 C ATOM 3563 CG ASN B 879 28.795 5.808 10.143 1.00 24.24 C ATOM 3564 OD1 ASN B 879 28.912 4.752 10.755 1.00 24.56 O ATOM 3565 ND2 ASN B 879 29.838 6.556 9.799 1.00 23.98 N ATOM 0 H ASN B 879 27.275 4.619 8.012 1.00 17.44 H new ATOM 0 HA ASN B 879 26.402 4.653 10.447 1.00 20.88 H new ATOM 0 HB2 ASN B 879 27.484 6.792 8.905 1.00 20.07 H new ATOM 0 HB3 ASN B 879 27.137 6.990 10.412 1.00 20.07 H new ATOM 0 HD21 ASN B 879 30.634 6.305 10.006 1.00 23.98 H new ATOM 0 HD22 ASN B 879 29.717 7.291 9.370 1.00 23.98 H new ATOM 3566 N LEU B 880 24.475 6.074 8.410 1.00 21.70 N ATOM 3567 CA LEU B 880 23.157 6.675 8.264 1.00 23.31 C ATOM 3568 C LEU B 880 22.098 5.891 9.026 1.00 23.02 C ATOM 3569 O LEU B 880 21.150 6.483 9.539 1.00 22.30 O ATOM 3570 CB LEU B 880 22.761 6.774 6.786 1.00 23.98 C ATOM 3571 CG LEU B 880 23.247 8.025 6.051 1.00 27.69 C ATOM 3572 CD1 LEU B 880 22.725 8.019 4.613 1.00 27.57 C ATOM 3573 CD2 LEU B 880 22.755 9.265 6.791 1.00 28.07 C ATOM 0 H LEU B 880 24.871 5.882 7.671 1.00 21.70 H new ATOM 0 HA LEU B 880 23.207 7.568 8.639 1.00 23.31 H new ATOM 0 HB2 LEU B 880 23.104 5.993 6.323 1.00 23.98 H new ATOM 0 HB3 LEU B 880 21.794 6.738 6.724 1.00 23.98 H new ATOM 0 HG LEU B 880 24.217 8.034 6.026 1.00 27.69 H new ATOM 0 HD11 LEU B 880 23.036 8.814 4.152 1.00 27.57 H new ATOM 0 HD12 LEU B 880 23.052 7.230 4.153 1.00 27.57 H new ATOM 0 HD13 LEU B 880 21.755 8.009 4.621 1.00 27.57 H new ATOM 0 HD21 LEU B 880 23.061 10.061 6.328 1.00 28.07 H new ATOM 0 HD22 LEU B 880 21.785 9.261 6.820 1.00 28.07 H new ATOM 0 HD23 LEU B 880 23.105 9.263 7.696 1.00 28.07 H new ATOM 3574 N HIS B 881 22.253 4.567 9.100 1.00 23.78 N ATOM 3575 CA HIS B 881 21.281 3.738 9.818 1.00 23.66 C ATOM 3576 C HIS B 881 21.064 4.278 11.231 1.00 24.56 C ATOM 3577 O HIS B 881 19.929 4.410 11.690 1.00 24.54 O ATOM 3578 CB HIS B 881 21.750 2.281 9.909 1.00 23.84 C ATOM 3579 CG HIS B 881 21.577 1.501 8.643 1.00 25.57 C ATOM 3580 ND1 HIS B 881 20.376 1.426 7.970 1.00 25.92 N ATOM 3581 CD2 HIS B 881 22.441 0.716 7.956 1.00 26.06 C ATOM 3582 CE1 HIS B 881 20.506 0.628 6.926 1.00 26.43 C ATOM 3583 NE2 HIS B 881 21.750 0.183 6.894 1.00 26.46 N ATOM 0 H HIS B 881 22.906 4.133 8.746 1.00 23.78 H new ATOM 0 HA HIS B 881 20.449 3.769 9.321 1.00 23.66 H new ATOM 0 HB2 HIS B 881 22.687 2.268 10.159 1.00 23.84 H new ATOM 0 HB3 HIS B 881 21.260 1.838 10.620 1.00 23.84 H new ATOM 0 HD2 HIS B 881 23.335 0.566 8.164 1.00 26.06 H new ATOM 0 HE1 HIS B 881 19.836 0.415 6.317 1.00 26.43 H new ATOM 0 HE2 HIS B 881 22.074 -0.353 6.305 1.00 26.46 H new ATOM 3584 N ASP B 882 22.160 4.595 11.914 1.00 24.24 N ATOM 3585 CA ASP B 882 22.097 5.115 13.277 1.00 24.14 C ATOM 3586 C ASP B 882 21.366 6.457 13.340 1.00 24.36 C ATOM 3587 O ASP B 882 20.481 6.653 14.176 1.00 23.58 O ATOM 3588 CB ASP B 882 23.508 5.261 13.843 1.00 26.03 C ATOM 0 H ASP B 882 22.958 4.515 11.602 1.00 24.24 H new ATOM 0 HA ASP B 882 21.595 4.481 13.813 1.00 24.14 H new ATOM 3589 N LEU B 883 21.733 7.373 12.450 1.00 22.89 N ATOM 3590 CA LEU B 883 21.121 8.696 12.409 1.00 23.22 C ATOM 3591 C LEU B 883 19.633 8.617 12.061 1.00 21.86 C ATOM 3592 O LEU B 883 18.802 9.307 12.655 1.00 20.23 O ATOM 3593 CB LEU B 883 21.864 9.573 11.392 1.00 23.23 C ATOM 3594 CG LEU B 883 21.526 11.066 11.309 1.00 26.80 C ATOM 3595 CD1 LEU B 883 22.694 11.808 10.667 1.00 27.48 C ATOM 3596 CD2 LEU B 883 20.256 11.289 10.511 1.00 27.58 C ATOM 0 H LEU B 883 22.341 7.246 11.855 1.00 22.89 H new ATOM 0 HA LEU B 883 21.191 9.093 13.291 1.00 23.22 H new ATOM 0 HB2 LEU B 883 22.813 9.498 11.579 1.00 23.23 H new ATOM 0 HB3 LEU B 883 21.717 9.190 10.513 1.00 23.23 H new ATOM 0 HG LEU B 883 21.377 11.407 12.205 1.00 26.80 H new ATOM 0 HD11 LEU B 883 22.486 12.754 10.612 1.00 27.48 H new ATOM 0 HD12 LEU B 883 23.491 11.684 11.205 1.00 27.48 H new ATOM 0 HD13 LEU B 883 22.849 11.459 9.775 1.00 27.48 H new ATOM 0 HD21 LEU B 883 20.061 12.238 10.471 1.00 27.58 H new ATOM 0 HD22 LEU B 883 20.374 10.946 9.612 1.00 27.58 H new ATOM 0 HD23 LEU B 883 19.519 10.826 10.939 1.00 27.58 H new ATOM 3597 N VAL B 884 19.299 7.774 11.095 1.00 21.26 N ATOM 3598 CA VAL B 884 17.912 7.614 10.683 1.00 19.25 C ATOM 3599 C VAL B 884 17.071 7.051 11.832 1.00 19.83 C ATOM 3600 O VAL B 884 15.891 7.363 11.961 1.00 17.19 O ATOM 3601 CB VAL B 884 17.826 6.707 9.430 1.00 19.39 C ATOM 3602 CG1 VAL B 884 16.386 6.283 9.157 1.00 17.41 C ATOM 3603 CG2 VAL B 884 18.376 7.466 8.230 1.00 19.35 C ATOM 0 H VAL B 884 19.860 7.285 10.665 1.00 21.26 H new ATOM 0 HA VAL B 884 17.553 8.485 10.451 1.00 19.25 H new ATOM 0 HB VAL B 884 18.350 5.906 9.587 1.00 19.39 H new ATOM 0 HG11 VAL B 884 16.359 5.717 8.370 1.00 17.41 H new ATOM 0 HG12 VAL B 884 16.043 5.792 9.920 1.00 17.41 H new ATOM 0 HG13 VAL B 884 15.839 7.070 9.008 1.00 17.41 H new ATOM 0 HG21 VAL B 884 18.326 6.904 7.441 1.00 19.35 H new ATOM 0 HG22 VAL B 884 17.853 8.270 8.088 1.00 19.35 H new ATOM 0 HG23 VAL B 884 19.301 7.708 8.396 1.00 19.35 H new ATOM 3604 N LYS B 885 17.682 6.239 12.683 1.00 19.62 N ATOM 3605 CA LYS B 885 16.953 5.677 13.806 1.00 21.28 C ATOM 3606 C LYS B 885 16.439 6.788 14.728 1.00 20.34 C ATOM 3607 O LYS B 885 15.349 6.684 15.281 1.00 19.79 O ATOM 3608 CB LYS B 885 17.837 4.709 14.592 1.00 22.08 C ATOM 3609 CG LYS B 885 17.116 4.067 15.763 1.00 25.91 C ATOM 3610 CD LYS B 885 17.922 2.933 16.374 1.00 29.81 C ATOM 3611 CE LYS B 885 17.206 2.361 17.599 1.00 30.33 C ATOM 3612 NZ LYS B 885 17.984 1.248 18.205 1.00 33.38 N ATOM 0 H LYS B 885 18.507 6.004 12.629 1.00 19.62 H new ATOM 0 HA LYS B 885 16.192 5.188 13.456 1.00 21.28 H new ATOM 0 HB2 LYS B 885 18.158 4.014 13.996 1.00 22.08 H new ATOM 0 HB3 LYS B 885 18.617 5.184 14.920 1.00 22.08 H new ATOM 0 HG2 LYS B 885 16.939 4.738 16.440 1.00 25.91 H new ATOM 0 HG3 LYS B 885 16.256 3.729 15.467 1.00 25.91 H new ATOM 0 HD2 LYS B 885 18.056 2.233 15.716 1.00 29.81 H new ATOM 0 HD3 LYS B 885 18.801 3.255 16.628 1.00 29.81 H new ATOM 0 HE2 LYS B 885 17.074 3.062 18.256 1.00 30.33 H new ATOM 0 HE3 LYS B 885 16.326 2.042 17.343 1.00 30.33 H new ATOM 0 HZ1 LYS B 885 17.586 0.981 18.955 1.00 33.38 H new ATOM 0 HZ2 LYS B 885 18.025 0.568 17.632 1.00 33.38 H new ATOM 0 HZ3 LYS B 885 18.808 1.528 18.391 1.00 33.38 H new ATOM 3613 N GLN B 886 17.220 7.851 14.896 1.00 20.56 N ATOM 3614 CA GLN B 886 16.779 8.961 15.742 1.00 21.36 C ATOM 3615 C GLN B 886 15.596 9.677 15.091 1.00 20.33 C ATOM 3616 O GLN B 886 14.676 10.124 15.779 1.00 17.02 O ATOM 3617 CB GLN B 886 17.910 9.959 15.966 1.00 23.75 C ATOM 3618 CG GLN B 886 19.020 9.457 16.877 1.00 28.86 C ATOM 3619 CD GLN B 886 20.125 10.482 17.033 1.00 32.84 C ATOM 3620 OE1 GLN B 886 20.857 10.766 16.086 1.00 36.11 O ATOM 3621 NE2 GLN B 886 20.242 11.053 18.225 1.00 36.12 N ATOM 0 H GLN B 886 17.995 7.951 14.537 1.00 20.56 H new ATOM 0 HA GLN B 886 16.510 8.596 16.600 1.00 21.36 H new ATOM 0 HB2 GLN B 886 18.294 10.195 15.107 1.00 23.75 H new ATOM 0 HB3 GLN B 886 17.539 10.772 16.344 1.00 23.75 H new ATOM 0 HG2 GLN B 886 18.652 9.243 17.748 1.00 28.86 H new ATOM 0 HG3 GLN B 886 19.389 8.636 16.516 1.00 28.86 H new ATOM 0 HE21 GLN B 886 19.711 10.828 18.863 1.00 36.12 H new ATOM 0 HE22 GLN B 886 20.848 11.648 18.359 1.00 36.12 H new ATOM 3622 N LEU B 887 15.630 9.797 13.766 1.00 17.58 N ATOM 3623 CA LEU B 887 14.546 10.448 13.037 1.00 18.16 C ATOM 3624 C LEU B 887 13.279 9.588 13.078 1.00 17.28 C ATOM 3625 O LEU B 887 12.165 10.110 13.178 1.00 18.52 O ATOM 3626 CB LEU B 887 14.959 10.719 11.579 1.00 18.12 C ATOM 3627 CG LEU B 887 16.155 11.666 11.378 1.00 19.74 C ATOM 3628 CD1 LEU B 887 16.332 11.997 9.893 1.00 19.89 C ATOM 3629 CD2 LEU B 887 15.935 12.937 12.156 1.00 17.37 C ATOM 0 H LEU B 887 16.271 9.508 13.271 1.00 17.58 H new ATOM 0 HA LEU B 887 14.358 11.297 13.467 1.00 18.16 H new ATOM 0 HB2 LEU B 887 15.168 9.870 11.158 1.00 18.12 H new ATOM 0 HB3 LEU B 887 14.195 11.088 11.109 1.00 18.12 H new ATOM 0 HG LEU B 887 16.957 11.225 11.698 1.00 19.74 H new ATOM 0 HD11 LEU B 887 17.089 12.594 9.782 1.00 19.89 H new ATOM 0 HD12 LEU B 887 16.490 11.179 9.396 1.00 19.89 H new ATOM 0 HD13 LEU B 887 15.529 12.428 9.559 1.00 19.89 H new ATOM 0 HD21 LEU B 887 16.691 13.531 12.027 1.00 17.37 H new ATOM 0 HD22 LEU B 887 15.126 13.372 11.844 1.00 17.37 H new ATOM 0 HD23 LEU B 887 15.846 12.728 13.099 1.00 17.37 H new ATOM 3630 N HIS B 888 13.452 8.271 13.005 1.00 16.22 N ATOM 3631 CA HIS B 888 12.325 7.346 13.049 1.00 17.97 C ATOM 3632 C HIS B 888 11.587 7.433 14.393 1.00 17.34 C ATOM 3633 O HIS B 888 10.358 7.461 14.434 1.00 17.28 O ATOM 3634 CB HIS B 888 12.811 5.910 12.802 1.00 18.85 C ATOM 3635 CG HIS B 888 12.921 5.546 11.351 1.00 21.59 C ATOM 3636 ND1 HIS B 888 13.666 4.475 10.907 1.00 23.30 N ATOM 3637 CD2 HIS B 888 12.347 6.087 10.249 1.00 20.60 C ATOM 3638 CE1 HIS B 888 13.547 4.370 9.594 1.00 22.23 C ATOM 3639 NE2 HIS B 888 12.752 5.335 9.171 1.00 21.81 N ATOM 0 H HIS B 888 14.220 7.891 12.929 1.00 16.22 H new ATOM 0 HA HIS B 888 11.702 7.596 12.349 1.00 17.97 H new ATOM 0 HB2 HIS B 888 13.678 5.795 13.222 1.00 18.85 H new ATOM 0 HB3 HIS B 888 12.201 5.293 13.236 1.00 18.85 H new ATOM 0 HD1 HIS B 888 14.135 3.955 11.406 1.00 23.30 H new ATOM 0 HD2 HIS B 888 11.785 6.828 10.226 1.00 20.60 H new ATOM 0 HE1 HIS B 888 13.954 3.726 9.060 1.00 22.23 H new ATOM 3640 N LEU B 889 12.333 7.486 15.492 1.00 18.46 N ATOM 3641 CA LEU B 889 11.703 7.580 16.810 1.00 18.51 C ATOM 3642 C LEU B 889 10.968 8.912 16.967 1.00 17.65 C ATOM 3643 O LEU B 889 9.821 8.950 17.427 1.00 17.99 O ATOM 3644 CB LEU B 889 12.748 7.441 17.918 1.00 16.92 C ATOM 3645 CG LEU B 889 12.224 7.584 19.356 1.00 21.86 C ATOM 3646 CD1 LEU B 889 11.231 6.478 19.672 1.00 17.30 C ATOM 3647 CD2 LEU B 889 13.389 7.521 20.332 1.00 22.99 C ATOM 0 H LEU B 889 13.193 7.469 15.500 1.00 18.46 H new ATOM 0 HA LEU B 889 11.062 6.856 16.884 1.00 18.51 H new ATOM 0 HB2 LEU B 889 13.172 6.573 17.832 1.00 16.92 H new ATOM 0 HB3 LEU B 889 13.437 8.109 17.775 1.00 16.92 H new ATOM 0 HG LEU B 889 11.774 8.439 19.441 1.00 21.86 H new ATOM 0 HD11 LEU B 889 10.910 6.581 20.581 1.00 17.30 H new ATOM 0 HD12 LEU B 889 10.482 6.530 19.057 1.00 17.30 H new ATOM 0 HD13 LEU B 889 11.666 5.616 19.579 1.00 17.30 H new ATOM 0 HD21 LEU B 889 13.057 7.611 21.239 1.00 22.99 H new ATOM 0 HD22 LEU B 889 13.844 6.670 20.238 1.00 22.99 H new ATOM 0 HD23 LEU B 889 14.010 8.242 20.142 1.00 22.99 H new ATOM 3648 N TYR B 890 11.626 10.003 16.582 1.00 17.83 N ATOM 3649 CA TYR B 890 11.016 11.326 16.696 1.00 18.53 C ATOM 3650 C TYR B 890 9.749 11.372 15.851 1.00 18.24 C ATOM 3651 O TYR B 890 8.733 11.958 16.246 1.00 18.17 O ATOM 3652 CB TYR B 890 11.986 12.415 16.218 1.00 19.91 C ATOM 3653 CG TYR B 890 11.460 13.825 16.436 1.00 19.80 C ATOM 3654 CD1 TYR B 890 11.742 14.526 17.601 1.00 21.48 C ATOM 3655 CD2 TYR B 890 10.639 14.429 15.496 1.00 20.45 C ATOM 3656 CE1 TYR B 890 11.215 15.793 17.821 1.00 21.56 C ATOM 3657 CE2 TYR B 890 10.110 15.686 15.708 1.00 21.59 C ATOM 3658 CZ TYR B 890 10.399 16.363 16.870 1.00 21.96 C ATOM 3659 OH TYR B 890 9.858 17.612 17.082 1.00 25.26 O ATOM 0 H TYR B 890 12.421 10.000 16.254 1.00 17.83 H new ATOM 0 HA TYR B 890 10.801 11.489 17.628 1.00 18.53 H new ATOM 0 HB2 TYR B 890 12.830 12.315 16.685 1.00 19.91 H new ATOM 0 HB3 TYR B 890 12.167 12.286 15.274 1.00 19.91 H new ATOM 0 HD1 TYR B 890 12.292 14.141 18.244 1.00 21.48 H new ATOM 0 HD2 TYR B 890 10.441 13.978 14.707 1.00 20.45 H new ATOM 0 HE1 TYR B 890 11.412 16.253 18.605 1.00 21.56 H new ATOM 0 HE2 TYR B 890 9.560 16.074 15.067 1.00 21.59 H new ATOM 0 HH TYR B 890 9.386 17.829 16.422 1.00 25.26 H new ATOM 3660 N CYS B 891 9.819 10.754 14.677 1.00 17.19 N ATOM 3661 CA CYS B 891 8.683 10.708 13.766 1.00 16.81 C ATOM 3662 C CYS B 891 7.516 9.959 14.398 1.00 17.85 C ATOM 3663 O CYS B 891 6.403 10.478 14.471 1.00 16.14 O ATOM 3664 CB CYS B 891 9.084 10.020 12.458 1.00 15.34 C ATOM 3665 SG CYS B 891 7.717 9.629 11.352 1.00 16.31 S ATOM 0 H CYS B 891 10.522 10.352 14.388 1.00 17.19 H new ATOM 0 HA CYS B 891 8.407 11.619 13.580 1.00 16.81 H new ATOM 0 HB2 CYS B 891 9.710 10.592 11.987 1.00 15.34 H new ATOM 0 HB3 CYS B 891 9.555 9.199 12.671 1.00 15.34 H new ATOM 0 HG CYS B 891 7.261 10.645 10.904 1.00 16.31 H new ATOM 3666 N LEU B 892 7.779 8.742 14.867 1.00 18.15 N ATOM 3667 CA LEU B 892 6.734 7.929 15.475 1.00 16.53 C ATOM 3668 C LEU B 892 6.121 8.588 16.702 1.00 16.65 C ATOM 3669 O LEU B 892 4.902 8.569 16.862 1.00 15.17 O ATOM 3670 CB LEU B 892 7.269 6.544 15.846 1.00 17.76 C ATOM 3671 CG LEU B 892 6.170 5.566 16.273 1.00 17.93 C ATOM 3672 CD1 LEU B 892 5.088 5.540 15.208 1.00 18.43 C ATOM 3673 CD2 LEU B 892 6.754 4.178 16.492 1.00 19.78 C ATOM 0 H LEU B 892 8.554 8.371 14.842 1.00 18.15 H new ATOM 0 HA LEU B 892 6.034 7.838 14.809 1.00 16.53 H new ATOM 0 HB2 LEU B 892 7.746 6.174 15.087 1.00 17.76 H new ATOM 0 HB3 LEU B 892 7.911 6.635 16.567 1.00 17.76 H new ATOM 0 HG LEU B 892 5.780 5.858 17.112 1.00 17.93 H new ATOM 0 HD11 LEU B 892 4.388 4.922 15.472 1.00 18.43 H new ATOM 0 HD12 LEU B 892 4.713 6.429 15.106 1.00 18.43 H new ATOM 0 HD13 LEU B 892 5.471 5.253 14.364 1.00 18.43 H new ATOM 0 HD21 LEU B 892 6.049 3.569 16.762 1.00 19.78 H new ATOM 0 HD22 LEU B 892 7.156 3.862 15.668 1.00 19.78 H new ATOM 0 HD23 LEU B 892 7.430 4.217 17.187 1.00 19.78 H new ATOM 3674 N ASN B 893 6.951 9.162 17.570 1.00 16.46 N ATOM 3675 CA ASN B 893 6.426 9.822 18.763 1.00 17.40 C ATOM 3676 C ASN B 893 5.509 10.965 18.355 1.00 17.32 C ATOM 3677 O ASN B 893 4.409 11.108 18.893 1.00 15.30 O ATOM 3678 CB ASN B 893 7.554 10.374 19.650 1.00 17.77 C ATOM 3679 CG ASN B 893 8.214 9.301 20.495 1.00 21.15 C ATOM 3680 OD1 ASN B 893 7.547 8.402 21.007 1.00 20.95 O ATOM 3681 ND2 ASN B 893 9.528 9.402 20.663 1.00 19.06 N ATOM 0 H ASN B 893 7.807 9.181 17.490 1.00 16.46 H new ATOM 0 HA ASN B 893 5.934 9.160 19.273 1.00 17.40 H new ATOM 0 HB2 ASN B 893 8.224 10.796 19.089 1.00 17.77 H new ATOM 0 HB3 ASN B 893 7.195 11.063 20.231 1.00 17.77 H new ATOM 0 HD21 ASN B 893 9.945 8.825 21.145 1.00 19.06 H new ATOM 0 HD22 ASN B 893 9.961 10.044 20.289 1.00 19.06 H new ATOM 3682 N THR B 894 5.966 11.782 17.405 1.00 15.33 N ATOM 3683 CA THR B 894 5.168 12.908 16.936 1.00 16.31 C ATOM 3684 C THR B 894 3.876 12.409 16.284 1.00 16.99 C ATOM 3685 O THR B 894 2.821 13.025 16.433 1.00 17.10 O ATOM 3686 CB THR B 894 5.947 13.764 15.920 1.00 16.04 C ATOM 3687 OG1 THR B 894 7.108 14.312 16.554 1.00 20.31 O ATOM 3688 CG2 THR B 894 5.078 14.902 15.390 1.00 16.06 C ATOM 0 H THR B 894 6.732 11.700 17.023 1.00 15.33 H new ATOM 0 HA THR B 894 4.957 13.456 17.708 1.00 16.31 H new ATOM 0 HB THR B 894 6.207 13.200 15.175 1.00 16.04 H new ATOM 0 HG1 THR B 894 7.717 13.734 16.572 1.00 20.31 H new ATOM 0 HG21 THR B 894 5.586 15.428 14.753 1.00 16.06 H new ATOM 0 HG22 THR B 894 4.294 14.534 14.953 1.00 16.06 H new ATOM 0 HG23 THR B 894 4.800 15.468 16.127 1.00 16.06 H new ATOM 3689 N PHE B 895 3.965 11.290 15.569 1.00 16.09 N ATOM 3690 CA PHE B 895 2.802 10.704 14.898 1.00 18.19 C ATOM 3691 C PHE B 895 1.746 10.307 15.936 1.00 19.59 C ATOM 3692 O PHE B 895 0.568 10.662 15.818 1.00 20.18 O ATOM 3693 CB PHE B 895 3.227 9.462 14.099 1.00 17.19 C ATOM 3694 CG PHE B 895 2.127 8.869 13.255 1.00 16.96 C ATOM 3695 CD1 PHE B 895 1.661 9.536 12.128 1.00 19.18 C ATOM 3696 CD2 PHE B 895 1.553 7.655 13.595 1.00 17.65 C ATOM 3697 CE1 PHE B 895 0.636 8.997 11.351 1.00 19.24 C ATOM 3698 CE2 PHE B 895 0.528 7.107 12.827 1.00 19.64 C ATOM 3699 CZ PHE B 895 0.068 7.776 11.704 1.00 20.17 C ATOM 0 H PHE B 895 4.696 10.850 15.458 1.00 16.09 H new ATOM 0 HA PHE B 895 2.426 11.361 14.292 1.00 18.19 H new ATOM 0 HB2 PHE B 895 3.972 9.698 13.524 1.00 17.19 H new ATOM 0 HB3 PHE B 895 3.548 8.786 14.716 1.00 17.19 H new ATOM 0 HD1 PHE B 895 2.038 10.352 11.889 1.00 19.18 H new ATOM 0 HD2 PHE B 895 1.856 7.199 14.347 1.00 17.65 H new ATOM 0 HE1 PHE B 895 0.333 9.452 10.599 1.00 19.24 H new ATOM 0 HE2 PHE B 895 0.152 6.291 13.068 1.00 19.64 H new ATOM 0 HZ PHE B 895 -0.616 7.412 11.189 1.00 20.17 H new ATOM 3700 N ILE B 896 2.182 9.562 16.945 1.00 19.69 N ATOM 3701 CA ILE B 896 1.305 9.107 18.018 1.00 21.58 C ATOM 3702 C ILE B 896 0.602 10.280 18.690 1.00 22.26 C ATOM 3703 O ILE B 896 -0.584 10.207 19.004 1.00 24.71 O ATOM 3704 CB ILE B 896 2.111 8.333 19.088 1.00 22.28 C ATOM 3705 CG1 ILE B 896 2.592 7.003 18.508 1.00 22.10 C ATOM 3706 CG2 ILE B 896 1.259 8.114 20.341 1.00 22.34 C ATOM 3707 CD1 ILE B 896 3.688 6.337 19.326 1.00 20.32 C ATOM 0 H ILE B 896 2.998 9.305 17.027 1.00 19.69 H new ATOM 0 HA ILE B 896 0.641 8.523 17.619 1.00 21.58 H new ATOM 0 HB ILE B 896 2.887 8.855 19.345 1.00 22.28 H new ATOM 0 HG12 ILE B 896 1.837 6.397 18.440 1.00 22.10 H new ATOM 0 HG13 ILE B 896 2.918 7.152 17.607 1.00 22.10 H new ATOM 0 HG21 ILE B 896 1.776 7.628 21.003 1.00 22.34 H new ATOM 0 HG22 ILE B 896 0.993 8.973 20.706 1.00 22.34 H new ATOM 0 HG23 ILE B 896 0.468 7.602 20.109 1.00 22.34 H new ATOM 0 HD11 ILE B 896 3.945 5.502 18.904 1.00 20.32 H new ATOM 0 HD12 ILE B 896 4.458 6.925 19.375 1.00 20.32 H new ATOM 0 HD13 ILE B 896 3.361 6.159 20.222 1.00 20.32 H new ATOM 3708 N GLN B 897 1.335 11.368 18.894 1.00 22.29 N ATOM 3709 CA GLN B 897 0.783 12.551 19.553 1.00 22.37 C ATOM 3710 C GLN B 897 0.340 13.648 18.580 1.00 20.92 C ATOM 3711 O GLN B 897 0.157 14.802 18.981 1.00 22.26 O ATOM 3712 CB GLN B 897 1.832 13.114 20.513 1.00 24.38 C ATOM 3713 CG GLN B 897 2.522 12.037 21.335 1.00 27.28 C ATOM 3714 CD GLN B 897 3.719 12.557 22.106 1.00 29.75 C ATOM 3715 OE1 GLN B 897 4.694 11.833 22.318 1.00 33.10 O ATOM 3716 NE2 GLN B 897 3.650 13.809 22.539 1.00 28.75 N ATOM 0 H GLN B 897 2.158 11.444 18.658 1.00 22.29 H new ATOM 0 HA GLN B 897 -0.015 12.267 20.025 1.00 22.37 H new ATOM 0 HB2 GLN B 897 2.498 13.603 20.006 1.00 24.38 H new ATOM 0 HB3 GLN B 897 1.408 13.749 21.111 1.00 24.38 H new ATOM 0 HG2 GLN B 897 1.884 11.654 21.957 1.00 27.28 H new ATOM 0 HG3 GLN B 897 2.809 11.322 20.746 1.00 27.28 H new ATOM 0 HE21 GLN B 897 2.953 14.284 22.372 1.00 28.75 H new ATOM 0 HE22 GLN B 897 4.302 14.146 22.987 1.00 28.75 H new ATOM 3717 N SER B 898 0.152 13.288 17.315 1.00 18.35 N ATOM 3718 CA SER B 898 -0.232 14.252 16.286 1.00 20.80 C ATOM 3719 C SER B 898 -1.391 15.189 16.617 1.00 21.25 C ATOM 3720 O SER B 898 -1.305 16.388 16.360 1.00 20.66 O ATOM 3721 CB SER B 898 -0.535 13.528 14.973 1.00 19.80 C ATOM 3722 OG SER B 898 -1.544 12.556 15.157 1.00 22.25 O ATOM 0 H SER B 898 0.243 12.482 17.028 1.00 18.35 H new ATOM 0 HA SER B 898 0.543 14.831 16.216 1.00 20.80 H new ATOM 0 HB2 SER B 898 -0.817 14.170 14.302 1.00 19.80 H new ATOM 0 HB3 SER B 898 0.271 13.104 14.639 1.00 19.80 H new ATOM 0 HG SER B 898 -1.200 11.845 15.443 1.00 22.25 H new ATOM 3723 N ARG B 899 -2.476 14.653 17.166 1.00 21.37 N ATOM 3724 CA ARG B 899 -3.634 15.479 17.497 1.00 22.07 C ATOM 3725 C ARG B 899 -3.327 16.511 18.581 1.00 22.50 C ATOM 3726 O ARG B 899 -3.673 17.686 18.446 1.00 20.79 O ATOM 3727 CB ARG B 899 -4.808 14.599 17.932 1.00 24.06 C ATOM 3728 CG ARG B 899 -5.357 13.703 16.822 1.00 31.02 C ATOM 3729 CD ARG B 899 -6.399 12.740 17.361 1.00 37.29 C ATOM 3730 NE ARG B 899 -7.663 12.819 16.632 1.00 43.43 N ATOM 3731 CZ ARG B 899 -7.856 12.349 15.403 1.00 45.23 C ATOM 3732 NH1 ARG B 899 -6.864 11.756 14.755 1.00 47.17 N ATOM 3733 NH2 ARG B 899 -9.042 12.476 14.822 1.00 46.27 N ATOM 0 H ARG B 899 -2.563 13.818 17.354 1.00 21.37 H new ATOM 0 HA ARG B 899 -3.872 15.967 16.693 1.00 22.07 H new ATOM 0 HB2 ARG B 899 -4.525 14.042 18.674 1.00 24.06 H new ATOM 0 HB3 ARG B 899 -5.523 15.167 18.259 1.00 24.06 H new ATOM 0 HG2 ARG B 899 -5.749 14.251 16.124 1.00 31.02 H new ATOM 0 HG3 ARG B 899 -4.631 13.204 16.416 1.00 31.02 H new ATOM 0 HD2 ARG B 899 -6.055 11.834 17.310 1.00 37.29 H new ATOM 0 HD3 ARG B 899 -6.557 12.931 18.299 1.00 37.29 H new ATOM 0 HE ARG B 899 -8.329 13.196 17.025 1.00 43.43 H new ATOM 0 HH11 ARG B 899 -6.094 11.675 15.129 1.00 47.17 H new ATOM 0 HH12 ARG B 899 -6.990 11.453 13.960 1.00 47.17 H new ATOM 0 HH21 ARG B 899 -9.686 12.862 15.240 1.00 46.27 H new ATOM 0 HH22 ARG B 899 -9.166 12.172 14.027 1.00 46.27 H new ATOM 3734 N ALA B 900 -2.674 16.076 19.652 1.00 22.78 N ATOM 3735 CA ALA B 900 -2.329 16.982 20.742 1.00 26.09 C ATOM 3736 C ALA B 900 -1.427 18.123 20.264 1.00 27.01 C ATOM 3737 O ALA B 900 -1.700 19.292 20.536 1.00 28.27 O ATOM 3738 CB ALA B 900 -1.641 16.214 21.869 1.00 23.46 C ATOM 0 H ALA B 900 -2.422 15.262 19.768 1.00 22.78 H new ATOM 0 HA ALA B 900 -3.154 17.371 21.072 1.00 26.09 H new ATOM 0 HB1 ALA B 900 -1.416 16.826 22.588 1.00 23.46 H new ATOM 0 HB2 ALA B 900 -2.238 15.527 22.204 1.00 23.46 H new ATOM 0 HB3 ALA B 900 -0.831 15.801 21.532 1.00 23.46 H new ATOM 3739 N LEU B 901 -0.368 17.776 19.536 1.00 26.57 N ATOM 3740 CA LEU B 901 0.601 18.753 19.035 1.00 25.90 C ATOM 3741 C LEU B 901 0.163 19.556 17.804 1.00 26.60 C ATOM 3742 O LEU B 901 0.876 20.467 17.370 1.00 25.52 O ATOM 3743 CB LEU B 901 1.914 18.038 18.702 1.00 26.74 C ATOM 3744 CG LEU B 901 2.417 17.011 19.719 1.00 26.20 C ATOM 3745 CD1 LEU B 901 3.644 16.305 19.161 1.00 28.21 C ATOM 3746 CD2 LEU B 901 2.730 17.696 21.037 1.00 27.23 C ATOM 0 H LEU B 901 -0.189 16.964 19.317 1.00 26.57 H new ATOM 0 HA LEU B 901 0.696 19.399 19.752 1.00 25.90 H new ATOM 0 HB2 LEU B 901 1.806 17.590 17.848 1.00 26.74 H new ATOM 0 HB3 LEU B 901 2.603 18.710 18.585 1.00 26.74 H new ATOM 0 HG LEU B 901 1.728 16.348 19.883 1.00 26.20 H new ATOM 0 HD11 LEU B 901 3.964 15.654 19.805 1.00 28.21 H new ATOM 0 HD12 LEU B 901 3.410 15.854 18.335 1.00 28.21 H new ATOM 0 HD13 LEU B 901 4.341 16.956 18.987 1.00 28.21 H new ATOM 0 HD21 LEU B 901 3.048 17.039 21.676 1.00 27.23 H new ATOM 0 HD22 LEU B 901 3.415 18.369 20.898 1.00 27.23 H new ATOM 0 HD23 LEU B 901 1.927 18.119 21.381 1.00 27.23 H new ATOM 3747 N SER B 902 -0.992 19.229 17.236 1.00 25.02 N ATOM 3748 CA SER B 902 -1.457 19.929 16.043 1.00 27.08 C ATOM 3749 C SER B 902 -0.441 19.758 14.911 1.00 27.18 C ATOM 3750 O SER B 902 -0.090 20.715 14.217 1.00 26.63 O ATOM 3751 CB SER B 902 -1.653 21.421 16.322 1.00 27.76 C ATOM 3752 OG SER B 902 -2.630 21.629 17.321 1.00 33.45 O ATOM 0 H SER B 902 -1.518 18.611 17.522 1.00 25.02 H new ATOM 0 HA SER B 902 -2.310 19.546 15.783 1.00 27.08 H new ATOM 0 HB2 SER B 902 -0.811 21.814 16.602 1.00 27.76 H new ATOM 0 HB3 SER B 902 -1.919 21.873 15.506 1.00 27.76 H new ATOM 0 HG SER B 902 -2.720 22.453 17.458 1.00 33.45 H new ATOM 3753 N VAL B 903 0.048 18.536 14.746 1.00 26.37 N ATOM 3754 CA VAL B 903 0.993 18.241 13.682 1.00 26.60 C ATOM 3755 C VAL B 903 0.313 17.254 12.747 1.00 27.33 C ATOM 3756 O VAL B 903 0.139 16.079 13.078 1.00 27.28 O ATOM 3757 CB VAL B 903 2.291 17.625 14.228 1.00 26.95 C ATOM 3758 CG1 VAL B 903 3.195 17.209 13.069 1.00 26.20 C ATOM 3759 CG2 VAL B 903 3.005 18.631 15.118 1.00 24.87 C ATOM 0 H VAL B 903 -0.156 17.863 15.241 1.00 26.37 H new ATOM 0 HA VAL B 903 1.238 19.061 13.225 1.00 26.60 H new ATOM 0 HB VAL B 903 2.075 16.839 14.754 1.00 26.95 H new ATOM 0 HG11 VAL B 903 4.012 16.821 13.419 1.00 26.20 H new ATOM 0 HG12 VAL B 903 2.736 16.554 12.519 1.00 26.20 H new ATOM 0 HG13 VAL B 903 3.411 17.987 12.532 1.00 26.20 H new ATOM 0 HG21 VAL B 903 3.823 18.238 15.460 1.00 24.87 H new ATOM 0 HG22 VAL B 903 3.219 19.424 14.603 1.00 24.87 H new ATOM 0 HG23 VAL B 903 2.429 18.873 15.860 1.00 24.87 H new ATOM 3760 N GLU B 904 -0.083 17.743 11.581 1.00 27.62 N ATOM 3761 CA GLU B 904 -0.769 16.918 10.599 1.00 28.78 C ATOM 3762 C GLU B 904 0.176 16.052 9.779 1.00 27.31 C ATOM 3763 O GLU B 904 1.238 16.504 9.350 1.00 28.11 O ATOM 3764 CB GLU B 904 -1.588 17.802 9.656 1.00 32.76 C ATOM 3765 CG GLU B 904 -2.364 17.024 8.610 1.00 39.96 C ATOM 3766 CD GLU B 904 -3.194 17.917 7.700 1.00 44.16 C ATOM 3767 OE1 GLU B 904 -3.938 17.366 6.859 1.00 46.01 O ATOM 3768 OE2 GLU B 904 -3.102 19.161 7.821 1.00 45.00 O ATOM 0 H GLU B 904 0.038 18.559 11.337 1.00 27.62 H new ATOM 0 HA GLU B 904 -1.348 16.320 11.097 1.00 28.78 H new ATOM 0 HB2 GLU B 904 -2.209 18.332 10.180 1.00 32.76 H new ATOM 0 HB3 GLU B 904 -0.992 18.423 9.209 1.00 32.76 H new ATOM 0 HG2 GLU B 904 -1.744 16.509 8.071 1.00 39.96 H new ATOM 0 HG3 GLU B 904 -2.949 16.390 9.054 1.00 39.96 H new ATOM 3769 N PHE B 905 -0.228 14.802 9.574 1.00 23.71 N ATOM 3770 CA PHE B 905 0.535 13.845 8.786 1.00 22.62 C ATOM 3771 C PHE B 905 -0.315 13.465 7.578 1.00 22.43 C ATOM 3772 O PHE B 905 -1.353 12.819 7.727 1.00 19.94 O ATOM 3773 CB PHE B 905 0.837 12.578 9.599 1.00 22.01 C ATOM 3774 CG PHE B 905 1.948 12.737 10.604 1.00 22.09 C ATOM 3775 CD1 PHE B 905 1.732 13.383 11.812 1.00 20.61 C ATOM 3776 CD2 PHE B 905 3.210 12.220 10.341 1.00 20.75 C ATOM 3777 CE1 PHE B 905 2.758 13.506 12.744 1.00 19.50 C ATOM 3778 CE2 PHE B 905 4.236 12.340 11.265 1.00 18.67 C ATOM 3779 CZ PHE B 905 4.009 12.984 12.467 1.00 20.35 C ATOM 0 H PHE B 905 -0.961 14.484 9.893 1.00 23.71 H new ATOM 0 HA PHE B 905 1.379 14.243 8.520 1.00 22.62 H new ATOM 0 HB2 PHE B 905 0.031 12.305 10.064 1.00 22.01 H new ATOM 0 HB3 PHE B 905 1.068 11.861 8.988 1.00 22.01 H new ATOM 0 HD1 PHE B 905 0.893 13.737 12.001 1.00 20.61 H new ATOM 0 HD2 PHE B 905 3.369 11.787 9.533 1.00 20.75 H new ATOM 0 HE1 PHE B 905 2.603 13.939 13.552 1.00 19.50 H new ATOM 0 HE2 PHE B 905 5.076 11.988 11.077 1.00 18.67 H new ATOM 0 HZ PHE B 905 4.696 13.066 13.088 1.00 20.35 H new ATOM 3780 N PRO B 906 0.108 13.876 6.370 1.00 21.35 N ATOM 3781 CA PRO B 906 -0.621 13.574 5.139 1.00 22.00 C ATOM 3782 C PRO B 906 -0.884 12.083 4.936 1.00 22.70 C ATOM 3783 O PRO B 906 -0.329 11.234 5.634 1.00 22.86 O ATOM 3784 CB PRO B 906 0.271 14.178 4.059 1.00 22.81 C ATOM 3785 CG PRO B 906 0.821 15.394 4.752 1.00 21.56 C ATOM 3786 CD PRO B 906 1.209 14.821 6.106 1.00 22.23 C ATOM 0 HA PRO B 906 -1.518 13.942 5.138 1.00 22.00 H new ATOM 0 HB2 PRO B 906 0.973 13.568 3.785 1.00 22.81 H new ATOM 0 HB3 PRO B 906 -0.230 14.410 3.262 1.00 22.81 H new ATOM 0 HG2 PRO B 906 1.582 15.769 4.282 1.00 21.56 H new ATOM 0 HG3 PRO B 906 0.160 16.100 4.830 1.00 21.56 H new ATOM 0 HD2 PRO B 906 2.070 14.376 6.078 1.00 22.23 H new ATOM 0 HD3 PRO B 906 1.268 15.509 6.787 1.00 22.23 H new ATOM 3787 N GLU B 907 -1.726 11.783 3.958 1.00 21.88 N ATOM 3788 CA GLU B 907 -2.137 10.421 3.650 1.00 24.11 C ATOM 3789 C GLU B 907 -1.060 9.359 3.402 1.00 22.39 C ATOM 3790 O GLU B 907 -0.892 8.444 4.207 1.00 19.94 O ATOM 3791 CB GLU B 907 -3.110 10.451 2.463 1.00 25.77 C ATOM 3792 CG GLU B 907 -3.408 9.085 1.878 1.00 31.10 C ATOM 3793 CD GLU B 907 -4.593 9.097 0.932 1.00 33.06 C ATOM 3794 OE1 GLU B 907 -4.709 10.042 0.120 1.00 33.85 O ATOM 3795 OE2 GLU B 907 -5.403 8.147 0.998 1.00 35.79 O ATOM 0 H GLU B 907 -2.081 12.375 3.445 1.00 21.88 H new ATOM 0 HA GLU B 907 -2.540 10.120 4.480 1.00 24.11 H new ATOM 0 HB2 GLU B 907 -3.942 10.859 2.749 1.00 25.77 H new ATOM 0 HB3 GLU B 907 -2.740 11.017 1.768 1.00 25.77 H new ATOM 0 HG2 GLU B 907 -2.625 8.763 1.405 1.00 31.10 H new ATOM 0 HG3 GLU B 907 -3.581 8.460 2.599 1.00 31.10 H new ATOM 3796 N MET B 908 -0.348 9.464 2.288 1.00 21.50 N ATOM 3797 CA MET B 908 0.671 8.472 1.960 1.00 23.91 C ATOM 3798 C MET B 908 1.737 8.390 3.044 1.00 23.34 C ATOM 3799 O MET B 908 2.289 7.323 3.323 1.00 22.19 O ATOM 3800 CB MET B 908 1.296 8.803 0.606 1.00 24.93 C ATOM 3801 CG MET B 908 0.249 9.062 -0.475 1.00 30.16 C ATOM 3802 SD MET B 908 -1.083 7.822 -0.482 1.00 35.18 S ATOM 3803 CE MET B 908 -0.314 6.504 -1.424 1.00 34.93 C ATOM 0 H MET B 908 -0.437 10.096 1.712 1.00 21.50 H new ATOM 0 HA MET B 908 0.246 7.601 1.908 1.00 23.91 H new ATOM 0 HB2 MET B 908 1.862 9.585 0.697 1.00 24.93 H new ATOM 0 HB3 MET B 908 1.868 8.070 0.329 1.00 24.93 H new ATOM 0 HG2 MET B 908 -0.136 9.942 -0.342 1.00 30.16 H new ATOM 0 HG3 MET B 908 0.682 9.070 -1.343 1.00 30.16 H new ATOM 0 HE1 MET B 908 -0.847 5.697 -1.346 1.00 34.93 H new ATOM 0 HE2 MET B 908 -0.256 6.764 -2.357 1.00 34.93 H new ATOM 0 HE3 MET B 908 0.577 6.337 -1.079 1.00 34.93 H new ATOM 3804 N MET B 909 2.004 9.532 3.660 1.00 24.12 N ATOM 3805 CA MET B 909 2.975 9.637 4.739 1.00 24.49 C ATOM 3806 C MET B 909 2.523 8.740 5.899 1.00 23.03 C ATOM 3807 O MET B 909 3.290 7.935 6.429 1.00 21.26 O ATOM 3808 CB MET B 909 3.024 11.085 5.214 1.00 28.11 C ATOM 3809 CG MET B 909 4.402 11.652 5.367 1.00 34.52 C ATOM 3810 SD MET B 909 4.511 12.545 6.918 1.00 38.60 S ATOM 3811 CE MET B 909 5.673 11.538 7.783 1.00 40.33 C ATOM 0 H MET B 909 1.623 10.277 3.462 1.00 24.12 H new ATOM 0 HA MET B 909 3.852 9.361 4.431 1.00 24.49 H new ATOM 0 HB2 MET B 909 2.530 11.635 4.586 1.00 28.11 H new ATOM 0 HB3 MET B 909 2.566 11.148 6.067 1.00 28.11 H new ATOM 0 HG2 MET B 909 5.060 10.939 5.346 1.00 34.52 H new ATOM 0 HG3 MET B 909 4.602 12.245 4.626 1.00 34.52 H new ATOM 0 HE1 MET B 909 5.668 11.774 8.724 1.00 40.33 H new ATOM 0 HE2 MET B 909 5.430 10.604 7.683 1.00 40.33 H new ATOM 0 HE3 MET B 909 6.560 11.682 7.419 1.00 40.33 H new ATOM 3812 N SER B 910 1.264 8.895 6.293 1.00 21.69 N ATOM 3813 CA SER B 910 0.712 8.105 7.384 1.00 22.81 C ATOM 3814 C SER B 910 0.704 6.624 7.025 1.00 23.73 C ATOM 3815 O SER B 910 0.871 5.763 7.886 1.00 23.35 O ATOM 3816 CB SER B 910 -0.710 8.565 7.693 1.00 22.10 C ATOM 3817 OG SER B 910 -0.725 9.921 8.114 1.00 20.16 O ATOM 0 H SER B 910 0.713 9.453 5.941 1.00 21.69 H new ATOM 0 HA SER B 910 1.270 8.233 8.167 1.00 22.81 H new ATOM 0 HB2 SER B 910 -1.266 8.461 6.905 1.00 22.10 H new ATOM 0 HB3 SER B 910 -1.092 8.003 8.385 1.00 22.10 H new ATOM 0 HG SER B 910 -0.626 10.423 7.447 1.00 20.16 H new ATOM 3818 N GLU B 911 0.511 6.337 5.745 1.00 24.62 N ATOM 3819 CA GLU B 911 0.470 4.965 5.260 1.00 27.21 C ATOM 3820 C GLU B 911 1.793 4.224 5.467 1.00 26.57 C ATOM 3821 O GLU B 911 1.800 3.079 5.927 1.00 25.99 O ATOM 3822 CB GLU B 911 0.096 4.966 3.778 1.00 31.56 C ATOM 3823 CG GLU B 911 0.314 3.649 3.058 1.00 38.48 C ATOM 3824 CD GLU B 911 0.100 3.779 1.558 1.00 42.55 C ATOM 3825 OE1 GLU B 911 0.743 4.660 0.938 1.00 43.69 O ATOM 3826 OE2 GLU B 911 -0.708 3.004 1.003 1.00 45.08 O ATOM 0 H GLU B 911 0.400 6.931 5.133 1.00 24.62 H new ATOM 0 HA GLU B 911 -0.199 4.491 5.778 1.00 27.21 H new ATOM 0 HB2 GLU B 911 -0.838 5.213 3.695 1.00 31.56 H new ATOM 0 HB3 GLU B 911 0.612 5.653 3.329 1.00 31.56 H new ATOM 0 HG2 GLU B 911 1.215 3.333 3.229 1.00 38.48 H new ATOM 0 HG3 GLU B 911 -0.293 2.982 3.414 1.00 38.48 H new ATOM 3827 N VAL B 912 2.908 4.874 5.135 1.00 23.10 N ATOM 3828 CA VAL B 912 4.219 4.250 5.284 1.00 22.75 C ATOM 3829 C VAL B 912 4.618 4.147 6.747 1.00 21.50 C ATOM 3830 O VAL B 912 5.251 3.171 7.159 1.00 21.76 O ATOM 3831 CB VAL B 912 5.329 5.028 4.524 1.00 23.09 C ATOM 3832 CG1 VAL B 912 4.970 5.133 3.047 1.00 23.04 C ATOM 3833 CG2 VAL B 912 5.521 6.405 5.138 1.00 23.77 C ATOM 0 H VAL B 912 2.926 5.675 4.823 1.00 23.10 H new ATOM 0 HA VAL B 912 4.138 3.363 4.901 1.00 22.75 H new ATOM 0 HB VAL B 912 6.167 4.545 4.602 1.00 23.09 H new ATOM 0 HG11 VAL B 912 5.666 5.619 2.578 1.00 23.04 H new ATOM 0 HG12 VAL B 912 4.888 4.243 2.670 1.00 23.04 H new ATOM 0 HG13 VAL B 912 4.127 5.603 2.951 1.00 23.04 H new ATOM 0 HG21 VAL B 912 6.215 6.881 4.656 1.00 23.77 H new ATOM 0 HG22 VAL B 912 4.690 6.903 5.082 1.00 23.77 H new ATOM 0 HG23 VAL B 912 5.780 6.312 6.068 1.00 23.77 H new ATOM 3834 N ILE B 913 4.241 5.148 7.532 1.00 19.59 N ATOM 3835 CA ILE B 913 4.557 5.152 8.953 1.00 20.70 C ATOM 3836 C ILE B 913 3.869 3.991 9.677 1.00 22.53 C ATOM 3837 O ILE B 913 4.513 3.227 10.400 1.00 22.29 O ATOM 3838 CB ILE B 913 4.139 6.486 9.603 1.00 19.99 C ATOM 3839 CG1 ILE B 913 5.116 7.590 9.181 1.00 17.65 C ATOM 3840 CG2 ILE B 913 4.101 6.341 11.111 1.00 20.85 C ATOM 3841 CD1 ILE B 913 4.698 8.973 9.605 1.00 21.56 C ATOM 0 H ILE B 913 3.801 5.835 7.261 1.00 19.59 H new ATOM 0 HA ILE B 913 5.517 5.045 9.037 1.00 20.70 H new ATOM 0 HB ILE B 913 3.249 6.729 9.303 1.00 19.99 H new ATOM 0 HG12 ILE B 913 5.989 7.397 9.556 1.00 17.65 H new ATOM 0 HG13 ILE B 913 5.212 7.573 8.216 1.00 17.65 H new ATOM 0 HG21 ILE B 913 3.837 7.184 11.511 1.00 20.85 H new ATOM 0 HG22 ILE B 913 3.461 5.654 11.354 1.00 20.85 H new ATOM 0 HG23 ILE B 913 4.981 6.091 11.435 1.00 20.85 H new ATOM 0 HD11 ILE B 913 5.359 9.617 9.306 1.00 21.56 H new ATOM 0 HD12 ILE B 913 3.838 9.186 9.211 1.00 21.56 H new ATOM 0 HD13 ILE B 913 4.628 9.008 10.572 1.00 21.56 H new ATOM 3842 N ALA B 914 2.565 3.851 9.468 1.00 22.03 N ATOM 3843 CA ALA B 914 1.805 2.780 10.104 1.00 23.97 C ATOM 3844 C ALA B 914 2.209 1.421 9.550 1.00 23.02 C ATOM 3845 O ALA B 914 2.143 0.414 10.246 1.00 25.51 O ATOM 3846 CB ALA B 914 0.303 3.000 9.890 1.00 22.59 C ATOM 0 H ALA B 914 2.100 4.366 8.960 1.00 22.03 H new ATOM 0 HA ALA B 914 2.001 2.795 11.054 1.00 23.97 H new ATOM 0 HB1 ALA B 914 -0.193 2.284 10.316 1.00 22.59 H new ATOM 0 HB2 ALA B 914 0.042 3.849 10.279 1.00 22.59 H new ATOM 0 HB3 ALA B 914 0.109 3.006 8.940 1.00 22.59 H new ATOM 3847 N ALA B 915 2.633 1.399 8.294 1.00 24.07 N ATOM 3848 CA ALA B 915 3.026 0.153 7.647 1.00 24.03 C ATOM 3849 C ALA B 915 4.314 -0.483 8.160 1.00 25.23 C ATOM 3850 O ALA B 915 4.370 -1.701 8.323 1.00 26.13 O ATOM 3851 CB ALA B 915 3.137 0.364 6.136 1.00 23.53 C ATOM 0 H ALA B 915 2.701 2.097 7.796 1.00 24.07 H new ATOM 0 HA ALA B 915 2.321 -0.474 7.873 1.00 24.03 H new ATOM 0 HB1 ALA B 915 3.399 -0.468 5.711 1.00 23.53 H new ATOM 0 HB2 ALA B 915 2.279 0.650 5.785 1.00 23.53 H new ATOM 0 HB3 ALA B 915 3.804 1.044 5.952 1.00 23.53 H new ATOM 3852 N GLN B 916 5.342 0.320 8.427 1.00 23.49 N ATOM 3853 CA GLN B 916 6.618 -0.255 8.844 1.00 23.31 C ATOM 3854 C GLN B 916 7.399 0.373 9.995 1.00 21.86 C ATOM 3855 O GLN B 916 8.297 -0.274 10.540 1.00 21.49 O ATOM 3856 CB GLN B 916 7.564 -0.303 7.639 1.00 24.76 C ATOM 3857 CG GLN B 916 6.972 -0.836 6.349 1.00 26.25 C ATOM 3858 CD GLN B 916 6.659 -2.314 6.408 1.00 29.07 C ATOM 3859 OE1 GLN B 916 7.013 -3.001 7.366 1.00 29.78 O ATOM 3860 NE2 GLN B 916 5.994 -2.817 5.373 1.00 28.53 N ATOM 0 H GLN B 916 5.324 1.178 8.375 1.00 23.49 H new ATOM 0 HA GLN B 916 6.335 -1.113 9.196 1.00 23.31 H new ATOM 0 HB2 GLN B 916 7.896 0.594 7.475 1.00 24.76 H new ATOM 0 HB3 GLN B 916 8.330 -0.851 7.873 1.00 24.76 H new ATOM 0 HG2 GLN B 916 6.160 -0.347 6.145 1.00 26.25 H new ATOM 0 HG3 GLN B 916 7.592 -0.671 5.622 1.00 26.25 H new ATOM 0 HE21 GLN B 916 5.763 -2.306 4.721 1.00 28.53 H new ATOM 0 HE22 GLN B 916 5.795 -3.653 5.355 1.00 28.53 H new ATOM 3861 N LEU B 917 7.095 1.612 10.368 1.00 21.71 N ATOM 3862 CA LEU B 917 7.876 2.270 11.417 1.00 21.56 C ATOM 3863 C LEU B 917 8.106 1.515 12.721 1.00 20.77 C ATOM 3864 O LEU B 917 9.241 1.431 13.200 1.00 19.62 O ATOM 3865 CB LEU B 917 7.320 3.665 11.723 1.00 23.73 C ATOM 3866 CG LEU B 917 8.202 4.740 11.093 1.00 25.79 C ATOM 3867 CD1 LEU B 917 7.880 6.111 11.664 1.00 26.11 C ATOM 3868 CD2 LEU B 917 9.655 4.389 11.364 1.00 23.99 C ATOM 0 H LEU B 917 6.456 2.082 10.037 1.00 21.71 H new ATOM 0 HA LEU B 917 8.758 2.311 11.016 1.00 21.56 H new ATOM 0 HB2 LEU B 917 6.415 3.741 11.382 1.00 23.73 H new ATOM 0 HB3 LEU B 917 7.274 3.798 12.683 1.00 23.73 H new ATOM 0 HG LEU B 917 8.037 4.773 10.138 1.00 25.79 H new ATOM 0 HD11 LEU B 917 8.451 6.777 11.250 1.00 26.11 H new ATOM 0 HD12 LEU B 917 6.951 6.326 11.485 1.00 26.11 H new ATOM 0 HD13 LEU B 917 8.032 6.106 12.622 1.00 26.11 H new ATOM 0 HD21 LEU B 917 10.230 5.063 10.970 1.00 23.99 H new ATOM 0 HD22 LEU B 917 9.807 4.355 12.321 1.00 23.99 H new ATOM 0 HD23 LEU B 917 9.857 3.524 10.974 1.00 23.99 H new ATOM 3869 N PRO B 918 7.043 0.975 13.329 1.00 20.11 N ATOM 3870 CA PRO B 918 7.248 0.240 14.585 1.00 20.96 C ATOM 3871 C PRO B 918 8.155 -0.981 14.377 1.00 20.62 C ATOM 3872 O PRO B 918 9.074 -1.234 15.169 1.00 19.63 O ATOM 3873 CB PRO B 918 5.829 -0.149 14.990 1.00 20.59 C ATOM 3874 CG PRO B 918 4.994 0.995 14.433 1.00 21.97 C ATOM 3875 CD PRO B 918 5.608 1.173 13.053 1.00 22.24 C ATOM 0 HA PRO B 918 7.699 0.759 15.269 1.00 20.96 H new ATOM 0 HB2 PRO B 918 5.568 -1.003 14.611 1.00 20.59 H new ATOM 0 HB3 PRO B 918 5.738 -0.226 15.953 1.00 20.59 H new ATOM 0 HG2 PRO B 918 4.051 0.771 14.387 1.00 21.97 H new ATOM 0 HG3 PRO B 918 5.069 1.798 14.972 1.00 21.97 H new ATOM 0 HD2 PRO B 918 5.267 0.524 12.417 1.00 22.24 H new ATOM 0 HD3 PRO B 918 5.427 2.052 12.685 1.00 22.24 H new ATOM 3876 N LYS B 919 7.894 -1.726 13.305 1.00 20.96 N ATOM 3877 CA LYS B 919 8.681 -2.915 12.974 1.00 22.30 C ATOM 3878 C LYS B 919 10.140 -2.541 12.734 1.00 21.75 C ATOM 3879 O LYS B 919 11.053 -3.238 13.182 1.00 21.74 O ATOM 3880 CB LYS B 919 8.119 -3.591 11.722 1.00 23.60 C ATOM 3881 CG LYS B 919 8.858 -4.858 11.297 1.00 26.38 C ATOM 3882 CD LYS B 919 8.193 -5.490 10.079 1.00 29.52 C ATOM 3883 CE LYS B 919 8.839 -6.827 9.723 1.00 35.17 C ATOM 3884 NZ LYS B 919 8.197 -7.473 8.542 1.00 34.76 N ATOM 0 H LYS B 919 7.259 -1.558 12.750 1.00 20.96 H new ATOM 0 HA LYS B 919 8.629 -3.530 13.723 1.00 22.30 H new ATOM 0 HB2 LYS B 919 7.187 -3.811 11.878 1.00 23.60 H new ATOM 0 HB3 LYS B 919 8.141 -2.956 10.989 1.00 23.60 H new ATOM 0 HG2 LYS B 919 9.782 -4.645 11.092 1.00 26.38 H new ATOM 0 HG3 LYS B 919 8.869 -5.493 12.031 1.00 26.38 H new ATOM 0 HD2 LYS B 919 7.249 -5.622 10.256 1.00 29.52 H new ATOM 0 HD3 LYS B 919 8.258 -4.886 9.323 1.00 29.52 H new ATOM 0 HE2 LYS B 919 9.782 -6.689 9.540 1.00 35.17 H new ATOM 0 HE3 LYS B 919 8.782 -7.424 10.485 1.00 35.17 H new ATOM 0 HZ1 LYS B 919 8.688 -8.168 8.280 1.00 34.76 H new ATOM 0 HZ2 LYS B 919 7.381 -7.752 8.763 1.00 34.76 H new ATOM 0 HZ3 LYS B 919 8.138 -6.885 7.877 1.00 34.76 H new ATOM 3885 N ILE B 920 10.353 -1.439 12.020 1.00 22.01 N ATOM 3886 CA ILE B 920 11.702 -0.972 11.726 1.00 21.84 C ATOM 3887 C ILE B 920 12.419 -0.568 13.013 1.00 22.43 C ATOM 3888 O ILE B 920 13.560 -0.967 13.247 1.00 21.31 O ATOM 3889 CB ILE B 920 11.679 0.232 10.763 1.00 22.03 C ATOM 3890 CG1 ILE B 920 11.222 -0.224 9.374 1.00 20.67 C ATOM 3891 CG2 ILE B 920 13.056 0.870 10.707 1.00 21.99 C ATOM 3892 CD1 ILE B 920 10.916 0.914 8.412 1.00 21.61 C ATOM 0 H ILE B 920 9.727 -0.947 11.696 1.00 22.01 H new ATOM 0 HA ILE B 920 12.178 -1.704 11.302 1.00 21.84 H new ATOM 0 HB ILE B 920 11.050 0.896 11.085 1.00 22.03 H new ATOM 0 HG12 ILE B 920 11.912 -0.785 8.986 1.00 20.67 H new ATOM 0 HG13 ILE B 920 10.429 -0.774 9.470 1.00 20.67 H new ATOM 0 HG21 ILE B 920 13.038 1.627 10.100 1.00 21.99 H new ATOM 0 HG22 ILE B 920 13.309 1.172 11.593 1.00 21.99 H new ATOM 0 HG23 ILE B 920 13.702 0.219 10.391 1.00 21.99 H new ATOM 0 HD11 ILE B 920 10.635 0.549 7.558 1.00 21.61 H new ATOM 0 HD12 ILE B 920 10.206 1.465 8.778 1.00 21.61 H new ATOM 0 HD13 ILE B 920 11.712 1.454 8.286 1.00 21.61 H new ATOM 3893 N LEU B 921 11.742 0.214 13.849 1.00 22.46 N ATOM 3894 CA LEU B 921 12.319 0.661 15.113 1.00 24.16 C ATOM 3895 C LEU B 921 12.686 -0.506 16.017 1.00 24.49 C ATOM 3896 O LEU B 921 13.696 -0.460 16.716 1.00 25.11 O ATOM 3897 CB LEU B 921 11.344 1.578 15.853 1.00 25.03 C ATOM 3898 CG LEU B 921 11.405 3.057 15.496 1.00 26.98 C ATOM 3899 CD1 LEU B 921 10.431 3.826 16.375 1.00 28.07 C ATOM 3900 CD2 LEU B 921 12.832 3.568 15.702 1.00 28.11 C ATOM 0 H LEU B 921 10.944 0.498 13.702 1.00 22.46 H new ATOM 0 HA LEU B 921 13.130 1.147 14.896 1.00 24.16 H new ATOM 0 HB2 LEU B 921 10.442 1.262 15.686 1.00 25.03 H new ATOM 0 HB3 LEU B 921 11.505 1.488 16.805 1.00 25.03 H new ATOM 0 HG LEU B 921 11.157 3.186 14.567 1.00 26.98 H new ATOM 0 HD11 LEU B 921 10.467 4.769 16.150 1.00 28.07 H new ATOM 0 HD12 LEU B 921 9.531 3.494 16.229 1.00 28.07 H new ATOM 0 HD13 LEU B 921 10.672 3.707 17.307 1.00 28.07 H new ATOM 0 HD21 LEU B 921 12.874 4.510 15.475 1.00 28.11 H new ATOM 0 HD22 LEU B 921 13.088 3.447 16.630 1.00 28.11 H new ATOM 0 HD23 LEU B 921 13.439 3.071 15.132 1.00 28.11 H new ATOM 3901 N ALA B 922 11.855 -1.545 16.005 1.00 23.17 N ATOM 3902 CA ALA B 922 12.080 -2.732 16.817 1.00 23.14 C ATOM 3903 C ALA B 922 13.168 -3.612 16.235 1.00 23.79 C ATOM 3904 O ALA B 922 13.452 -4.684 16.765 1.00 23.80 O ATOM 3905 CB ALA B 922 10.794 -3.536 16.938 1.00 22.81 C ATOM 0 H ALA B 922 11.143 -1.579 15.523 1.00 23.17 H new ATOM 0 HA ALA B 922 12.367 -2.433 17.694 1.00 23.14 H new ATOM 0 HB1 ALA B 922 10.955 -4.324 17.480 1.00 22.81 H new ATOM 0 HB2 ALA B 922 10.109 -2.991 17.356 1.00 22.81 H new ATOM 0 HB3 ALA B 922 10.497 -3.807 16.055 1.00 22.81 H new ATOM 3906 N GLY B 923 13.758 -3.173 15.131 1.00 23.08 N ATOM 3907 CA GLY B 923 14.811 -3.949 14.503 1.00 22.40 C ATOM 3908 C GLY B 923 14.350 -5.260 13.889 1.00 21.78 C ATOM 3909 O GLY B 923 15.136 -6.203 13.773 1.00 21.77 O ATOM 0 H GLY B 923 13.564 -2.435 14.734 1.00 23.08 H new ATOM 0 HA2 GLY B 923 15.226 -3.410 13.811 1.00 22.40 H new ATOM 0 HA3 GLY B 923 15.495 -4.138 15.164 1.00 22.40 H new ATOM 3910 N MET B 924 13.087 -5.330 13.481 1.00 20.74 N ATOM 3911 CA MET B 924 12.569 -6.552 12.882 1.00 21.12 C ATOM 3912 C MET B 924 12.636 -6.534 11.357 1.00 20.85 C ATOM 3913 O MET B 924 11.699 -6.935 10.659 1.00 19.91 O ATOM 3914 CB MET B 924 11.142 -6.809 13.362 1.00 20.69 C ATOM 3915 CG MET B 924 11.069 -7.134 14.845 1.00 23.69 C ATOM 3916 SD MET B 924 12.139 -8.521 15.305 1.00 26.91 S ATOM 3917 CE MET B 924 11.175 -9.899 14.724 1.00 27.35 C ATOM 0 H MET B 924 12.519 -4.687 13.542 1.00 20.74 H new ATOM 0 HA MET B 924 13.139 -7.280 13.174 1.00 21.12 H new ATOM 0 HB2 MET B 924 10.598 -6.027 13.179 1.00 20.69 H new ATOM 0 HB3 MET B 924 10.762 -7.544 12.855 1.00 20.69 H new ATOM 0 HG2 MET B 924 11.322 -6.350 15.358 1.00 23.69 H new ATOM 0 HG3 MET B 924 10.152 -7.344 15.082 1.00 23.69 H new ATOM 0 HE1 MET B 924 11.646 -10.726 14.913 1.00 27.35 H new ATOM 0 HE2 MET B 924 10.316 -9.906 15.175 1.00 27.35 H new ATOM 0 HE3 MET B 924 11.037 -9.817 13.767 1.00 27.35 H new ATOM 3918 N VAL B 925 13.771 -6.055 10.862 1.00 20.88 N ATOM 3919 CA VAL B 925 14.076 -5.974 9.440 1.00 20.92 C ATOM 3920 C VAL B 925 15.586 -6.170 9.382 1.00 20.94 C ATOM 3921 O VAL B 925 16.245 -6.200 10.424 1.00 19.50 O ATOM 3922 CB VAL B 925 13.722 -4.589 8.845 1.00 20.39 C ATOM 3923 CG1 VAL B 925 12.224 -4.341 8.955 1.00 18.22 C ATOM 3924 CG2 VAL B 925 14.512 -3.494 9.561 1.00 21.68 C ATOM 0 H VAL B 925 14.405 -5.759 11.361 1.00 20.88 H new ATOM 0 HA VAL B 925 13.569 -6.626 8.932 1.00 20.92 H new ATOM 0 HB VAL B 925 13.964 -4.574 7.906 1.00 20.39 H new ATOM 0 HG11 VAL B 925 12.011 -3.472 8.580 1.00 18.22 H new ATOM 0 HG12 VAL B 925 11.745 -5.029 8.467 1.00 18.22 H new ATOM 0 HG13 VAL B 925 11.960 -4.364 9.888 1.00 18.22 H new ATOM 0 HG21 VAL B 925 14.284 -2.630 9.182 1.00 21.68 H new ATOM 0 HG22 VAL B 925 14.292 -3.501 10.506 1.00 21.68 H new ATOM 0 HG23 VAL B 925 15.462 -3.655 9.450 1.00 21.68 H new ATOM 3925 N LYS B 926 16.143 -6.300 8.183 1.00 20.80 N ATOM 3926 CA LYS B 926 17.578 -6.505 8.058 1.00 22.07 C ATOM 3927 C LYS B 926 18.324 -5.328 7.422 1.00 22.77 C ATOM 3928 O LYS B 926 18.344 -5.170 6.203 1.00 23.13 O ATOM 3929 CB LYS B 926 17.843 -7.795 7.265 1.00 23.16 C ATOM 3930 CG LYS B 926 19.318 -8.142 7.042 1.00 26.57 C ATOM 3931 CD LYS B 926 19.440 -9.458 6.261 1.00 29.78 C ATOM 3932 CE LYS B 926 20.854 -9.712 5.753 1.00 32.87 C ATOM 3933 NZ LYS B 926 21.867 -9.854 6.841 1.00 35.84 N ATOM 0 H LYS B 926 15.713 -6.273 7.439 1.00 20.80 H new ATOM 0 HA LYS B 926 17.927 -6.580 8.960 1.00 22.07 H new ATOM 0 HB2 LYS B 926 17.420 -8.534 7.729 1.00 23.16 H new ATOM 0 HB3 LYS B 926 17.411 -7.719 6.400 1.00 23.16 H new ATOM 0 HG2 LYS B 926 19.755 -7.427 6.554 1.00 26.57 H new ATOM 0 HG3 LYS B 926 19.771 -8.222 7.896 1.00 26.57 H new ATOM 0 HD2 LYS B 926 19.168 -10.194 6.831 1.00 29.78 H new ATOM 0 HD3 LYS B 926 18.828 -9.441 5.508 1.00 29.78 H new ATOM 0 HE2 LYS B 926 20.855 -10.518 5.214 1.00 32.87 H new ATOM 0 HE3 LYS B 926 21.116 -8.981 5.171 1.00 32.87 H new ATOM 0 HZ1 LYS B 926 22.669 -10.000 6.483 1.00 35.84 H new ATOM 0 HZ2 LYS B 926 21.890 -9.107 7.325 1.00 35.84 H new ATOM 0 HZ3 LYS B 926 21.647 -10.539 7.364 1.00 35.84 H new ATOM 3934 N PRO B 927 18.940 -4.475 8.249 1.00 23.97 N ATOM 3935 CA PRO B 927 19.669 -3.346 7.665 1.00 24.06 C ATOM 3936 C PRO B 927 20.879 -3.939 6.950 1.00 24.74 C ATOM 3937 O PRO B 927 21.547 -4.809 7.497 1.00 23.80 O ATOM 3938 CB PRO B 927 20.079 -2.524 8.890 1.00 25.93 C ATOM 3939 CG PRO B 927 19.031 -2.886 9.928 1.00 26.16 C ATOM 3940 CD PRO B 927 18.877 -4.371 9.716 1.00 23.73 C ATOM 0 HA PRO B 927 19.178 -2.803 7.029 1.00 24.06 H new ATOM 0 HB2 PRO B 927 20.973 -2.752 9.190 1.00 25.93 H new ATOM 0 HB3 PRO B 927 20.078 -1.573 8.698 1.00 25.93 H new ATOM 0 HG2 PRO B 927 19.325 -2.677 10.828 1.00 26.16 H new ATOM 0 HG3 PRO B 927 18.198 -2.411 9.784 1.00 26.16 H new ATOM 0 HD2 PRO B 927 19.585 -4.875 10.147 1.00 23.73 H new ATOM 0 HD3 PRO B 927 18.037 -4.703 10.068 1.00 23.73 H new ATOM 3941 N LEU B 928 21.152 -3.508 5.724 1.00 22.60 N ATOM 3942 CA LEU B 928 22.310 -4.038 5.019 1.00 22.90 C ATOM 3943 C LEU B 928 23.521 -3.167 5.343 1.00 24.19 C ATOM 3944 O LEU B 928 23.406 -1.943 5.451 1.00 23.68 O ATOM 3945 CB LEU B 928 22.052 -4.070 3.511 1.00 22.87 C ATOM 3946 CG LEU B 928 20.820 -4.879 3.090 1.00 24.41 C ATOM 3947 CD1 LEU B 928 20.769 -4.975 1.573 1.00 24.44 C ATOM 3948 CD2 LEU B 928 20.876 -6.272 3.703 1.00 24.74 C ATOM 0 H LEU B 928 20.692 -2.924 5.292 1.00 22.60 H new ATOM 0 HA LEU B 928 22.480 -4.949 5.307 1.00 22.90 H new ATOM 0 HB2 LEU B 928 21.950 -3.159 3.193 1.00 22.87 H new ATOM 0 HB3 LEU B 928 22.833 -4.439 3.069 1.00 22.87 H new ATOM 0 HG LEU B 928 20.020 -4.433 3.408 1.00 24.41 H new ATOM 0 HD11 LEU B 928 19.989 -5.487 1.307 1.00 24.44 H new ATOM 0 HD12 LEU B 928 20.715 -4.084 1.194 1.00 24.44 H new ATOM 0 HD13 LEU B 928 21.570 -5.415 1.249 1.00 24.44 H new ATOM 0 HD21 LEU B 928 20.093 -6.777 3.432 1.00 24.74 H new ATOM 0 HD22 LEU B 928 21.676 -6.728 3.398 1.00 24.74 H new ATOM 0 HD23 LEU B 928 20.894 -6.200 4.670 1.00 24.74 H new ATOM 3949 N LEU B 929 24.674 -3.807 5.509 1.00 24.37 N ATOM 3950 CA LEU B 929 25.911 -3.110 5.844 1.00 25.20 C ATOM 3951 C LEU B 929 27.040 -3.414 4.865 1.00 25.67 C ATOM 3952 O LEU B 929 27.179 -4.543 4.392 1.00 22.90 O ATOM 3953 CB LEU B 929 26.371 -3.506 7.254 1.00 24.41 C ATOM 3954 CG LEU B 929 25.534 -3.048 8.449 1.00 24.92 C ATOM 3955 CD1 LEU B 929 26.080 -3.664 9.726 1.00 24.09 C ATOM 3956 CD2 LEU B 929 25.556 -1.531 8.537 1.00 25.29 C ATOM 0 H LEU B 929 24.761 -4.659 5.430 1.00 24.37 H new ATOM 0 HA LEU B 929 25.716 -2.161 5.796 1.00 25.20 H new ATOM 0 HB2 LEU B 929 26.426 -4.474 7.286 1.00 24.41 H new ATOM 0 HB3 LEU B 929 27.271 -3.167 7.377 1.00 24.41 H new ATOM 0 HG LEU B 929 24.616 -3.340 8.333 1.00 24.92 H new ATOM 0 HD11 LEU B 929 25.546 -3.371 10.481 1.00 24.09 H new ATOM 0 HD12 LEU B 929 26.043 -4.631 9.661 1.00 24.09 H new ATOM 0 HD13 LEU B 929 27.000 -3.384 9.853 1.00 24.09 H new ATOM 0 HD21 LEU B 929 25.025 -1.243 9.296 1.00 25.29 H new ATOM 0 HD22 LEU B 929 26.470 -1.226 8.649 1.00 25.29 H new ATOM 0 HD23 LEU B 929 25.187 -1.154 7.723 1.00 25.29 H new ATOM 3957 N PHE B 930 27.848 -2.401 4.567 1.00 27.56 N ATOM 3958 CA PHE B 930 28.982 -2.586 3.674 1.00 28.76 C ATOM 3959 C PHE B 930 30.196 -3.022 4.498 1.00 31.91 C ATOM 3960 O PHE B 930 31.106 -3.668 3.981 1.00 31.63 O ATOM 3961 CB PHE B 930 29.287 -1.290 2.914 1.00 26.82 C ATOM 3962 CG PHE B 930 28.183 -0.861 1.979 1.00 25.83 C ATOM 3963 CD1 PHE B 930 27.256 0.097 2.364 1.00 23.11 C ATOM 3964 CD2 PHE B 930 28.052 -1.445 0.725 1.00 24.92 C ATOM 3965 CE1 PHE B 930 26.221 0.465 1.520 1.00 22.46 C ATOM 3966 CE2 PHE B 930 27.014 -1.079 -0.125 1.00 23.64 C ATOM 3967 CZ PHE B 930 26.099 -0.123 0.276 1.00 22.89 C ATOM 0 H PHE B 930 27.756 -1.602 4.871 1.00 27.56 H new ATOM 0 HA PHE B 930 28.770 -3.271 3.020 1.00 28.76 H new ATOM 0 HB2 PHE B 930 29.452 -0.580 3.554 1.00 26.82 H new ATOM 0 HB3 PHE B 930 30.104 -1.408 2.405 1.00 26.82 H new ATOM 0 HD1 PHE B 930 27.331 0.497 3.200 1.00 23.11 H new ATOM 0 HD2 PHE B 930 28.666 -2.088 0.451 1.00 24.92 H new ATOM 0 HE1 PHE B 930 25.607 1.109 1.791 1.00 22.46 H new ATOM 0 HE2 PHE B 930 26.935 -1.477 -0.962 1.00 23.64 H new ATOM 0 HZ PHE B 930 25.404 0.123 -0.290 1.00 22.89 H new ATOM 3968 N HIS B 931 30.187 -2.683 5.786 1.00 34.60 N ATOM 3969 CA HIS B 931 31.276 -3.025 6.702 1.00 39.30 C ATOM 3970 C HIS B 931 30.806 -3.900 7.861 1.00 41.89 C ATOM 3971 O HIS B 931 29.737 -3.675 8.428 1.00 41.32 O ATOM 3972 CB HIS B 931 31.887 -1.753 7.286 1.00 39.61 C ATOM 3973 CG HIS B 931 32.412 -0.807 6.256 1.00 42.15 C ATOM 3974 ND1 HIS B 931 31.815 0.216 5.601 1.00 43.91 N flip ATOM 3975 CD2 HIS B 931 33.698 -0.877 5.769 1.00 43.05 C flip ATOM 3976 CE1 HIS B 931 32.743 0.741 4.737 1.00 44.30 C flip ATOM 3977 NE2 HIS B 931 33.869 0.064 4.857 1.00 43.56 N flip ATOM 0 H HIS B 931 29.545 -2.246 6.156 1.00 34.60 H new ATOM 0 HA HIS B 931 31.930 -3.520 6.184 1.00 39.30 H new ATOM 0 HB2 HIS B 931 31.217 -1.298 7.819 1.00 39.61 H new ATOM 0 HB3 HIS B 931 32.609 -1.997 7.886 1.00 39.61 H new ATOM 0 HD2 HIS B 931 34.344 -1.489 6.039 1.00 43.05 H new ATOM 0 HE1 HIS B 931 32.601 1.457 4.161 1.00 44.30 H new ATOM 0 HE2 HIS B 931 34.593 0.210 4.416 1.00 43.56 H new ATOM 3978 N LYS B 932 31.623 -4.884 8.223 1.00 45.31 N ATOM 3979 CA LYS B 932 31.300 -5.778 9.329 1.00 48.42 C ATOM 3980 C LYS B 932 31.746 -5.147 10.649 1.00 50.44 C ATOM 3981 O LYS B 932 32.305 -4.028 10.606 1.00 51.23 O ATOM 3982 CB LYS B 932 31.989 -7.124 9.133 1.00 48.51 C ATOM 0 H LYS B 932 32.374 -5.051 7.838 1.00 45.31 H new ATOM 0 HA LYS B 932 30.341 -5.920 9.353 1.00 48.42 H new TER 3983 LYS B 932 HETATM 3984 C10 30X A 1 -3.995 -7.415 26.457 1.00 21.73 C HETATM 3985 C13 30X A 1 -3.748 -9.824 29.357 1.00 25.40 C HETATM 3986 C15 30X A 1 -2.188 -9.480 27.346 1.00 25.94 C HETATM 3987 C16 30X A 1 -1.940 -8.752 26.150 1.00 23.03 C HETATM 3988 C17 30X A 1 -1.154 -10.580 27.741 1.00 27.62 C HETATM 3989 C24 30X A 1 -3.797 -5.259 20.620 1.00 21.89 C HETATM 3990 C25 30X A 1 -4.877 -6.673 22.447 1.00 20.43 C HETATM 3991 C1 30X A 1 -2.008 -4.693 25.274 1.00 24.44 C HETATM 3992 C2 30X A 1 -2.984 -5.560 24.439 1.00 24.88 C HETATM 3993 N3 30X A 1 -2.531 -6.998 24.415 1.00 23.11 N HETATM 3994 C4 30X A 1 -1.075 -7.103 24.060 1.00 22.51 C HETATM 3995 C5 30X A 1 -0.869 -8.027 22.841 1.00 23.29 C HETATM 3996 F6 30X A 1 -1.698 -7.683 21.871 1.00 21.86 F HETATM 3997 F7 30X A 1 0.386 -7.907 22.410 1.00 20.75 F HETATM 3998 F8 30X A 1 -1.109 -9.293 23.174 1.00 22.20 F HETATM 3999 C9 30X A 1 -2.825 -7.715 25.683 1.00 23.50 C HETATM 4000 C11 30X A 1 -4.265 -8.124 27.657 1.00 23.24 C HETATM 4001 C12 30X A 1 -3.390 -9.151 28.119 1.00 24.82 C HETATM 4002 N14 30X A 1 -4.037 -10.359 30.337 1.00 25.77 N HETATM 4003 F18 30X A 1 -0.714 -11.189 26.651 1.00 26.19 F HETATM 4004 F19 30X A 1 -1.675 -11.523 28.517 1.00 31.61 F HETATM 4005 F20 30X A 1 -0.121 -10.017 28.350 1.00 30.78 F HETATM 4006 C21 30X A 1 -3.046 -5.062 22.974 1.00 22.17 C HETATM 4007 O22 30X A 1 -2.333 -4.113 22.629 1.00 24.56 O HETATM 4008 N23 30X A 1 -3.877 -5.647 22.051 1.00 23.76 N HETATM 0 H25B 30X A 1 -5.768 -6.361 22.223 1.00 20.43 H new HETATM 0 H25A 30X A 1 -4.697 -7.500 21.974 1.00 20.43 H new HETATM 0 H24B 30X A 1 -3.580 -6.038 20.085 1.00 21.89 H new HETATM 0 H24A 30X A 1 -4.651 -4.898 20.334 1.00 21.89 H new HETATM 0 H4A 30X A 1 -0.722 -6.221 23.865 1.00 22.51 H new HETATM 0 H4 30X A 1 -0.578 -7.447 24.818 1.00 22.51 H new HETATM 0 H25 30X A 1 -4.820 -6.829 23.403 1.00 20.43 H new HETATM 0 H24 30X A 1 -3.108 -4.586 20.505 1.00 21.89 H new HETATM 0 H2 30X A 1 -3.858 -5.489 24.854 1.00 24.88 H new HETATM 0 H1B 30X A 1 -1.976 -5.027 26.184 1.00 24.44 H new HETATM 0 H1A 30X A 1 -1.121 -4.736 24.883 1.00 24.44 H new HETATM 0 H16 30X A 1 -1.148 -8.961 25.631 1.00 23.03 H new HETATM 0 H11 30X A 1 -5.058 -7.906 28.171 1.00 23.24 H new HETATM 0 H10 30X A 1 -4.606 -6.723 26.158 1.00 21.73 H new HETATM 0 H1 30X A 1 -2.315 -3.773 25.278 1.00 24.44 H new HETATM 4009 C10 30X B 2 10.022 15.601 7.281 1.00 24.01 C HETATM 4010 C13 30X B 2 12.621 16.437 4.652 1.00 26.24 C HETATM 4011 C15 30X B 2 12.847 15.236 6.896 1.00 25.69 C HETATM 4012 C16 30X B 2 12.210 14.772 8.079 1.00 24.64 C HETATM 4013 C17 30X B 2 14.376 15.030 6.748 1.00 26.82 C HETATM 4014 C24 30X B 2 7.341 15.158 12.734 1.00 15.24 C HETATM 4015 C25 30X B 2 8.119 16.482 10.726 1.00 19.86 C HETATM 4016 C1 30X B 2 8.799 12.511 8.739 1.00 26.22 C HETATM 4017 C2 30X B 2 8.764 13.942 9.314 1.00 24.31 C HETATM 4018 N3 30X B 2 10.158 14.465 9.542 1.00 23.99 N HETATM 4019 C4 30X B 2 11.025 13.476 10.258 1.00 24.31 C HETATM 4020 C5 30X B 2 11.640 14.115 11.514 1.00 24.73 C HETATM 4021 F6 30X B 2 10.704 14.717 12.227 1.00 23.87 F HETATM 4022 F7 30X B 2 12.212 13.166 12.247 1.00 25.37 F HETATM 4023 F8 30X B 2 12.547 15.012 11.161 1.00 24.99 F HETATM 4024 C9 30X B 2 10.793 14.935 8.290 1.00 24.37 C HETATM 4025 C11 30X B 2 10.645 16.073 6.090 1.00 24.69 C HETATM 4026 C12 30X B 2 12.044 15.917 5.888 1.00 24.36 C HETATM 4027 N14 30X B 2 13.079 16.866 3.683 1.00 25.45 N HETATM 4028 F18 30X B 2 14.881 14.434 7.823 1.00 27.58 F HETATM 4029 F19 30X B 2 14.979 16.198 6.613 1.00 28.54 F HETATM 4030 F20 30X B 2 14.631 14.264 5.697 1.00 28.69 F HETATM 4031 C21 30X B 2 8.013 13.985 10.666 1.00 22.23 C HETATM 4032 O22 30X B 2 7.566 12.937 11.141 1.00 24.69 O HETATM 4033 N23 30X B 2 7.834 15.168 11.351 1.00 21.84 N HETATM 0 H25B 30X B 2 7.309 17.015 10.709 1.00 19.86 H new HETATM 0 H25A 30X B 2 8.799 16.944 11.240 1.00 19.86 H new HETATM 0 H24B 30X B 2 7.996 15.577 13.314 1.00 15.24 H new HETATM 0 H24A 30X B 2 6.505 15.648 12.783 1.00 15.24 H new HETATM 0 H4A 30X B 2 10.501 12.698 10.507 1.00 24.31 H new HETATM 0 H4 30X B 2 11.729 13.167 9.667 1.00 24.31 H new HETATM 0 H25 30X B 2 8.436 16.347 9.819 1.00 19.86 H new HETATM 0 H24 30X B 2 7.196 14.242 13.019 1.00 15.24 H new HETATM 0 H2 30X B 2 8.302 14.493 8.663 1.00 24.31 H new HETATM 0 H1B 30X B 2 9.273 12.514 7.893 1.00 26.22 H new HETATM 0 H1A 30X B 2 9.254 11.923 9.362 1.00 26.22 H new HETATM 0 H16 30X B 2 12.742 14.335 8.762 1.00 24.64 H new HETATM 0 H11 30X B 2 10.108 16.506 5.408 1.00 24.69 H new HETATM 0 H10 30X B 2 9.069 15.731 7.410 1.00 24.01 H new HETATM 0 H1 30X B 2 7.892 12.195 8.601 1.00 26.22 H new HETATM 4034 S SO4 B 1 14.939 -1.511 -16.903 1.00 30.65 S HETATM 4035 O1 SO4 B 1 16.244 -2.167 -16.721 1.00 30.90 O HETATM 4036 O2 SO4 B 1 14.639 -0.669 -15.734 1.00 32.34 O HETATM 4037 O3 SO4 B 1 14.978 -0.684 -18.120 1.00 31.11 O HETATM 4038 O4 SO4 B 1 13.880 -2.527 -17.051 1.00 32.35 O HETATM 4039 O HOH A 3 1.958 -10.787 45.222 1.00 13.64 O HETATM 4040 O HOH A 4 -8.649 -3.645 38.168 1.00 26.37 O HETATM 4041 O HOH A 6 -3.154 -13.742 37.637 1.00 25.60 O HETATM 4042 O HOH A 7 -2.136 -10.817 33.535 1.00 21.93 O HETATM 4043 O HOH A 8 5.210 -2.777 29.016 1.00 25.32 O HETATM 4044 O HOH A 11 11.128 -2.798 34.972 1.00 16.80 O HETATM 4045 O HOH A 13 9.529 10.506 45.449 1.00 27.59 O HETATM 4046 O HOH A 16 -13.041 -0.978 26.397 1.00 38.37 O HETATM 4047 O HOH A 17 4.816 9.014 21.713 1.00 32.01 O HETATM 4048 O HOH A 18 10.297 -13.814 54.369 1.00 24.68 O HETATM 4049 O HOH A 20 5.192 -0.466 48.306 1.00 15.78 O HETATM 4050 O HOH A 21 16.134 -11.085 33.485 1.00 24.76 O HETATM 4051 O HOH A 22 -10.852 -1.978 24.785 1.00 30.05 O HETATM 4052 O HOH A 23 4.828 -9.148 17.118 1.00 20.12 O HETATM 4053 O HOH A 25 10.344 -4.922 24.174 1.00 28.53 O HETATM 4054 O HOH A 27 18.096 4.861 46.340 1.00 23.81 O HETATM 4055 O HOH A 33 11.416 -6.642 26.002 1.00 23.75 O HETATM 4056 O HOH A 35 10.389 -3.235 28.784 1.00 24.27 O HETATM 4057 O HOH A 40 -7.929 -12.945 36.923 1.00 25.18 O HETATM 4058 O HOH A 47 8.592 -23.813 45.843 1.00 25.54 O HETATM 4059 O HOH A 48 17.063 -22.679 47.129 1.00 26.58 O HETATM 4060 O HOH A 49 6.919 -5.102 29.606 1.00 19.15 O HETATM 4061 O HOH A 50 4.235 -22.147 21.651 1.00 27.32 O HETATM 4062 O HOH A 51 12.582 -4.425 28.659 1.00 24.18 O HETATM 4063 O HOH A 52 -13.115 -7.378 36.854 1.00 30.68 O HETATM 4064 O HOH A 54 -10.731 -17.231 37.766 1.00 31.49 O HETATM 4065 O HOH A 55 -12.732 -7.522 12.847 1.00 47.01 O HETATM 4066 O HOH A 56 10.590 -8.456 30.606 1.00 21.96 O HETATM 4067 O HOH A 58 10.015 -15.657 22.506 1.00 34.38 O HETATM 4068 O HOH A 63 -14.183 -17.510 27.170 1.00 28.75 O HETATM 4069 O HOH A 64 -9.671 8.522 23.417 1.00 40.87 O HETATM 4070 O HOH A 65 1.878 10.977 25.796 1.00 34.37 O HETATM 4071 O HOH A 67 -15.866 -1.379 31.316 1.00 49.47 O HETATM 4072 O HOH A 69 -16.897 -7.083 34.196 1.00 40.65 O HETATM 4073 O HOH A 70 14.384 -11.621 51.360 1.00 30.50 O HETATM 4074 O HOH A 72 20.118 -15.041 29.422 1.00 30.77 O HETATM 4075 O HOH A 73 -7.943 -3.112 40.716 1.00 30.54 O HETATM 4076 O HOH A 76 -6.940 -28.229 34.525 1.00 34.41 O HETATM 4077 O HOH A 77 5.338 -1.626 11.856 1.00 25.21 O HETATM 4078 O HOH A 78 -15.561 -6.281 22.898 1.00 27.55 O HETATM 4079 O HOH A 82 13.508 -22.176 52.019 1.00 32.94 O HETATM 4080 O HOH A 86 -3.446 -18.776 42.170 1.00 47.32 O HETATM 4081 O HOH A 87 1.605 -16.527 29.143 1.00 27.91 O HETATM 4082 O HOH A 88 14.160 -22.018 31.642 1.00 37.03 O HETATM 4083 O HOH A 89 -3.938 -5.372 43.002 1.00 30.00 O HETATM 4084 O HOH A 94 2.377 -4.366 52.583 1.00 25.37 O HETATM 4085 O HOH A 98 12.977 -4.039 23.085 1.00 33.12 O HETATM 4086 O HOH A 101 13.125 7.504 36.874 1.00 37.67 O HETATM 4087 O HOH A 108 -10.988 4.603 28.947 1.00 34.28 O HETATM 4088 O HOH A 110 -6.022 -13.380 45.179 1.00 41.92 O HETATM 4089 O HOH A 111 8.868 6.672 23.607 1.00 45.20 O HETATM 4090 O HOH A 113 -11.410 -7.228 40.348 1.00 45.93 O HETATM 4091 O HOH A 115 -6.668 -5.185 42.350 1.00 46.29 O HETATM 4092 O HOH A 116 -1.062 -12.895 38.924 1.00 45.77 O HETATM 4093 O HOH A 123 -14.733 -6.622 27.133 1.00 35.20 O HETATM 4094 O HOH A 124 5.449 -28.161 28.871 1.00 29.40 O HETATM 4095 O HOH A 125 3.119 2.931 42.401 1.00 33.90 O HETATM 4096 O HOH A 131 7.970 7.670 33.000 1.00 35.25 O HETATM 4097 O HOH A 132 6.308 -24.850 47.167 1.00 45.21 O HETATM 4098 O HOH A 134 -3.297 8.957 25.160 1.00 44.42 O HETATM 4099 O HOH A 137 7.965 13.878 40.317 1.00 33.91 O HETATM 4100 O HOH A 138 8.429 8.762 35.635 1.00 27.08 O HETATM 4101 O HOH A 139 -8.479 -15.542 37.257 1.00 24.47 O HETATM 4102 O HOH A 141 -5.921 5.217 14.748 1.00 40.29 O HETATM 4103 O HOH A 142 -6.085 4.107 12.297 1.00 35.03 O HETATM 4104 O HOH A 148 11.216 -6.606 28.667 1.00 21.70 O HETATM 4105 O HOH A 155 21.951 -6.927 33.064 1.00 32.57 O HETATM 4106 O HOH A 156 7.317 12.890 36.673 1.00 36.00 O HETATM 4107 O HOH A 157 4.471 -11.111 43.396 1.00 21.67 O HETATM 4108 O HOH A 159 -3.071 -5.782 45.639 1.00 37.97 O HETATM 4109 O HOH A 163 -17.574 -8.024 23.953 1.00 41.30 O HETATM 4110 O HOH A 165 16.345 5.086 29.184 1.00 27.62 O HETATM 4111 O HOH A 166 1.059 4.400 43.837 1.00 44.33 O HETATM 4112 O HOH A 170 14.270 -27.668 38.642 1.00 28.30 O HETATM 4113 O HOH A 181 -14.571 -27.361 17.211 1.00 22.52 O HETATM 4114 O HOH A 183 17.828 -14.789 27.628 1.00 50.49 O HETATM 4115 O HOH A 184 21.231 5.613 44.831 1.00 38.16 O HETATM 4116 O HOH A 185 3.665 -11.951 56.435 1.00 27.24 O HETATM 4117 O HOH A 188 3.394 -29.777 35.756 1.00 30.53 O HETATM 4118 O HOH A 191 1.313 -6.259 14.274 1.00 35.30 O HETATM 4119 O HOH A 193 -6.267 -26.900 37.484 1.00 15.85 O HETATM 4120 O HOH A 195 -9.666 -0.133 35.078 1.00 25.93 O HETATM 4121 O HOH A 196 -6.360 -16.953 39.134 1.00 38.21 O HETATM 4122 O HOH A 199 -9.448 -14.798 16.370 1.00 42.02 O HETATM 4123 O HOH A 200 17.832 -16.596 50.693 1.00 31.91 O HETATM 4124 O HOH A 202 -0.393 -16.165 42.193 1.00 26.13 O HETATM 4125 O HOH A 207 1.968 3.993 51.767 1.00 28.37 O HETATM 4126 O HOH A 209 10.452 -4.448 32.832 1.00 39.21 O HETATM 4127 O HOH A 210 22.757 -32.130 46.020 1.00 58.94 O HETATM 4128 O HOH A 213 2.425 -29.169 28.387 1.00 35.85 O HETATM 4129 O HOH A 214 21.298 -20.968 44.618 1.00 50.55 O HETATM 4130 O HOH A 217 7.371 -9.725 15.833 1.00 34.66 O HETATM 4131 O HOH A 218 -3.044 -5.620 14.413 1.00 48.92 O HETATM 4132 O HOH A 221 -8.826 3.897 21.326 1.00 25.43 O HETATM 4133 O HOH A 223 11.443 -26.147 44.266 1.00 52.56 O HETATM 4134 O HOH A 225 16.878 -7.383 25.798 1.00 31.80 O HETATM 4135 O HOH A 226 -3.020 -8.239 38.050 1.00 38.34 O HETATM 4136 O HOH A 227 10.461 -30.357 37.825 1.00 46.15 O HETATM 4137 O HOH A 233 2.693 -28.675 38.389 1.00 34.02 O HETATM 4138 O HOH A 234 -5.453 -7.204 13.284 1.00 45.98 O HETATM 4139 O HOH A 235 15.997 6.615 47.304 1.00 35.04 O HETATM 4140 O HOH A 237 -17.366 -5.574 32.276 1.00 54.11 O HETATM 4141 O HOH A 240 11.551 -6.545 52.236 1.00 50.29 O HETATM 4142 O HOH A 242 23.061 -19.240 43.658 1.00 55.07 O HETATM 4143 O HOH A 244 3.706 -21.353 57.139 1.00 44.47 O HETATM 4144 O HOH A 253 -8.393 -14.253 45.886 1.00 42.79 O HETATM 4145 O HOH A 258 18.198 -21.964 44.688 1.00 25.40 O HETATM 4146 O HOH A 264 20.572 -16.543 49.482 1.00 43.10 O HETATM 4147 O HOH A 270 20.804 -1.675 26.917 1.00 37.44 O HETATM 4148 O HOH A 273 -17.994 -11.052 31.671 1.00 38.68 O HETATM 4149 O HOH A 274 17.712 -19.524 51.566 1.00 42.35 O HETATM 4150 O HOH A 275 9.610 7.894 47.309 1.00 38.64 O HETATM 4151 O HOH A 277 14.075 -4.043 20.648 1.00 47.89 O HETATM 4152 O HOH A 279 12.038 6.143 30.428 1.00 43.02 O HETATM 4153 O HOH A 280 20.424 -8.878 37.326 1.00 45.22 O HETATM 4154 O HOH A 285 -15.337 -5.489 25.090 1.00 41.46 O HETATM 4155 O HOH A 291 4.843 -13.348 17.167 1.00 41.07 O HETATM 4156 O HOH A 292 20.473 -33.519 42.894 1.00 61.39 O HETATM 4157 O HOH A 294 5.134 -17.714 17.212 1.00 33.59 O HETATM 4158 O HOH A 295 16.153 7.943 36.025 1.00 37.26 O HETATM 4159 O HOH A 306 8.074 -26.325 42.988 1.00 40.17 O HETATM 4160 O HOH A 307 12.817 -4.418 50.165 1.00 36.71 O HETATM 4161 O HOH A 310 6.570 -19.211 18.854 1.00 44.10 O HETATM 4162 O HOH A 311 0.187 -25.680 21.656 1.00 51.77 O HETATM 4163 O HOH A 312 10.197 -19.128 26.408 1.00 41.87 O HETATM 4164 O HOH A 314 -2.545 -15.544 46.522 1.00 20.44 O HETATM 4165 O HOH A 319 16.850 -9.319 53.577 1.00 37.62 O HETATM 4166 O HOH A 320 -4.068 -10.877 37.279 1.00 27.07 O HETATM 4167 O HOH A 322 -6.383 -11.763 38.804 1.00 32.14 O HETATM 4168 O HOH A 323 17.394 8.988 48.322 1.00 37.69 O HETATM 4169 O HOH A 326 -9.037 -27.780 33.158 1.00 35.36 O HETATM 4170 O HOH A 327 21.797 1.855 52.069 1.00 23.66 O HETATM 4171 O HOH A 329 0.090 5.716 41.474 1.00 31.59 O HETATM 4172 O HOH A 331 16.920 -12.417 53.466 1.00 39.10 O HETATM 4173 O HOH A 332 19.926 -8.350 55.117 1.00 31.88 O HETATM 4174 O HOH A 337 -2.959 -14.916 42.017 1.00 33.27 O HETATM 4175 O HOH A 340 23.341 -0.997 49.154 1.00 31.18 O HETATM 4176 O HOH A 343 19.147 -5.823 50.434 1.00 30.07 O HETATM 4177 O HOH A 345 21.090 -11.667 46.165 1.00 35.81 O HETATM 4178 O HOH A 347 12.338 -10.092 31.763 1.00 30.84 O HETATM 4179 O HOH A 348 12.598 -21.013 54.274 1.00 51.79 O HETATM 4180 O HOH A 351 3.895 -25.018 54.348 1.00 43.77 O HETATM 4181 O HOH A 354 -1.163 -25.384 19.578 1.00 47.90 O HETATM 4182 O HOH A 359 20.729 -11.448 54.368 1.00 43.02 O HETATM 4183 O HOH A 360 -7.072 -24.156 15.220 1.00 36.30 O HETATM 4184 O HOH A 363 11.808 -11.920 54.876 1.00 34.96 O HETATM 4185 O HOH A 365 -4.297 -15.334 44.814 1.00 36.65 O HETATM 4186 O HOH A 366 -8.939 -16.648 46.604 1.00 38.46 O HETATM 4187 O HOH A 368 5.123 -5.982 12.853 1.00 34.91 O HETATM 4188 O HOH A 369 -3.769 -15.650 39.741 1.00 36.59 O HETATM 4189 O HOH A 370 -15.595 -15.612 25.857 1.00 41.32 O HETATM 4190 O HOH A 372 15.555 -2.565 18.872 1.00 46.49 O HETATM 4191 O HOH A 373 -8.852 -26.760 36.759 1.00 48.94 O HETATM 4192 O HOH A 379 14.073 4.999 49.735 1.00 34.96 O HETATM 4193 O HOH A 382 25.434 -31.370 38.428 1.00 43.26 O HETATM 4194 O HOH A 383 15.137 8.116 49.947 1.00 41.60 O HETATM 4195 O HOH A 384 -21.881 -14.340 16.905 1.00 47.88 O HETATM 4196 O HOH A 388 12.176 11.100 46.251 1.00 43.37 O HETATM 4197 O HOH A 389 18.211 -15.141 52.697 1.00 46.59 O HETATM 4198 O HOH A 390 9.189 -9.386 17.690 1.00 52.71 O HETATM 4199 O HOH A 392 23.985 -8.600 47.419 1.00 47.17 O HETATM 4200 O HOH A 397 18.207 1.136 52.591 1.00 35.23 O HETATM 4201 O HOH A 402 21.159 -5.808 28.923 1.00 43.83 O HETATM 4202 O HOH A 403 10.727 -17.567 29.390 1.00 46.24 O HETATM 4203 O HOH A 404 9.523 -6.884 32.772 1.00 48.20 O HETATM 4204 O HOH A 407 13.504 -9.806 52.929 1.00 45.68 O HETATM 4205 O HOH A 934 -7.470 -11.886 34.409 1.00 23.67 O HETATM 4206 O HOH B 9 14.686 5.140 6.071 1.00 20.05 O HETATM 4207 O HOH B 12 11.884 5.132 6.476 1.00 24.78 O HETATM 4208 O HOH B 15 32.701 -1.239 -11.059 1.00 17.58 O HETATM 4209 O HOH B 26 7.751 3.319 7.136 1.00 24.40 O HETATM 4210 O HOH B 28 23.166 29.094 9.712 1.00 22.39 O HETATM 4211 O HOH B 30 11.106 10.435 -13.874 1.00 25.42 O HETATM 4212 O HOH B 31 15.568 2.967 12.346 1.00 20.54 O HETATM 4213 O HOH B 32 3.174 24.572 18.410 1.00 28.96 O HETATM 4214 O HOH B 34 18.659 9.818 -9.567 1.00 16.67 O HETATM 4215 O HOH B 36 14.518 -14.785 -5.582 1.00 46.08 O HETATM 4216 O HOH B 37 -3.484 13.627 2.672 1.00 35.40 O HETATM 4217 O HOH B 38 24.154 -7.103 -11.671 1.00 29.47 O HETATM 4218 O HOH B 39 11.760 11.495 -11.534 1.00 32.55 O HETATM 4219 O HOH B 41 10.319 12.310 -9.462 1.00 29.13 O HETATM 4220 O HOH B 42 16.894 0.331 8.439 1.00 32.54 O HETATM 4221 O HOH B 43 15.569 -0.474 1.842 1.00 14.04 O HETATM 4222 O HOH B 46 31.746 -2.270 -13.510 1.00 23.02 O HETATM 4223 O HOH B 53 12.923 20.041 -1.151 1.00 20.81 O HETATM 4224 O HOH B 57 1.439 18.232 7.041 1.00 25.76 O HETATM 4225 O HOH B 59 -2.753 13.846 10.855 1.00 28.92 O HETATM 4226 O HOH B 60 33.307 11.450 -8.348 1.00 20.71 O HETATM 4227 O HOH B 61 13.641 20.498 -3.846 1.00 27.71 O HETATM 4228 O HOH B 62 24.630 0.307 4.895 1.00 18.05 O HETATM 4229 O HOH B 66 36.833 3.467 -8.245 1.00 24.95 O HETATM 4230 O HOH B 68 27.082 3.297 -16.790 1.00 16.42 O HETATM 4231 O HOH B 71 17.442 -4.022 -15.472 1.00 34.10 O HETATM 4232 O HOH B 75 26.812 -0.694 -13.102 1.00 17.57 O HETATM 4233 O HOH B 80 -2.642 10.557 10.063 1.00 35.37 O HETATM 4234 O HOH B 81 14.934 1.681 7.562 1.00 37.30 O HETATM 4235 O HOH B 84 12.357 13.694 -4.118 1.00 38.94 O HETATM 4236 O HOH B 85 19.866 8.689 -7.429 1.00 21.59 O HETATM 4237 O HOH B 90 3.578 3.277 0.435 1.00 32.75 O HETATM 4238 O HOH B 91 -2.203 8.354 19.366 1.00 30.67 O HETATM 4239 O HOH B 92 17.839 3.055 10.746 1.00 26.33 O HETATM 4240 O HOH B 93 16.702 30.685 8.332 1.00 19.21 O HETATM 4241 O HOH B 95 8.414 -7.789 -0.350 1.00 35.57 O HETATM 4242 O HOH B 96 17.224 16.591 -3.169 1.00 28.26 O HETATM 4243 O HOH B 97 -2.827 11.856 18.173 1.00 27.99 O HETATM 4244 O HOH B 99 -2.561 13.251 20.581 1.00 22.73 O HETATM 4245 O HOH B 100 16.776 13.877 -4.912 1.00 40.02 O HETATM 4246 O HOH B 103 5.607 15.646 -5.353 1.00 35.19 O HETATM 4247 O HOH B 104 6.693 -2.578 -11.931 1.00 37.58 O HETATM 4248 O HOH B 105 29.645 17.321 -8.294 1.00 30.34 O HETATM 4249 O HOH B 107 7.485 0.685 -16.783 1.00 23.97 O HETATM 4250 O HOH B 109 5.922 28.917 0.687 1.00 24.77 O HETATM 4251 O HOH B 112 21.443 30.437 -1.398 1.00 40.03 O HETATM 4252 O HOH B 117 15.152 18.411 19.327 1.00 29.77 O HETATM 4253 O HOH B 118 22.221 31.784 12.258 1.00 24.92 O HETATM 4254 O HOH B 119 4.918 -7.975 -9.447 1.00 31.53 O HETATM 4255 O HOH B 120 4.402 9.368 -7.631 1.00 28.03 O HETATM 4256 O HOH B 122 25.226 13.689 -14.831 1.00 34.53 O HETATM 4257 O HOH B 126 16.296 1.199 3.859 1.00 28.99 O HETATM 4258 O HOH B 128 1.167 29.667 12.715 1.00 26.27 O HETATM 4259 O HOH B 129 3.516 29.844 9.090 1.00 28.37 O HETATM 4260 O HOH B 130 12.315 28.754 14.572 1.00 16.24 O HETATM 4261 O HOH B 135 25.738 -9.552 -7.350 1.00 24.21 O HETATM 4262 O HOH B 136 21.674 -1.442 -14.274 1.00 43.87 O HETATM 4263 O HOH B 144 -2.845 5.643 9.365 1.00 51.19 O HETATM 4264 O HOH B 145 -1.787 6.677 16.690 1.00 38.33 O HETATM 4265 O HOH B 146 -1.597 10.666 13.219 1.00 35.70 O HETATM 4266 O HOH B 153 8.087 -5.473 6.585 1.00 31.65 O HETATM 4267 O HOH B 154 4.453 3.554 -2.097 1.00 39.29 O HETATM 4268 O HOH B 158 3.618 24.697 -2.508 1.00 38.39 O HETATM 4269 O HOH B 160 4.101 8.114 -9.895 1.00 32.49 O HETATM 4270 O HOH B 162 0.857 27.484 14.427 1.00 35.33 O HETATM 4271 O HOH B 164 7.982 1.833 -14.390 1.00 24.11 O HETATM 4272 O HOH B 167 33.843 -0.872 -14.973 1.00 31.81 O HETATM 4273 O HOH B 168 19.851 31.654 -0.004 1.00 37.52 O HETATM 4274 O HOH B 169 13.674 -14.444 -0.086 1.00 45.17 O HETATM 4275 O HOH B 171 1.627 0.055 12.515 1.00 39.29 O HETATM 4276 O HOH B 172 47.563 3.901 -5.506 1.00 38.69 O HETATM 4277 O HOH B 173 36.525 2.461 -5.749 1.00 30.28 O HETATM 4278 O HOH B 174 16.325 0.905 14.043 1.00 42.69 O HETATM 4279 O HOH B 176 14.824 11.111 18.438 1.00 30.88 O HETATM 4280 O HOH B 177 28.747 -2.328 -13.845 1.00 25.03 O HETATM 4281 O HOH B 178 8.478 14.168 -9.472 1.00 38.20 O HETATM 4282 O HOH B 180 -0.568 1.505 5.902 1.00 24.46 O HETATM 4283 O HOH B 186 19.575 4.447 6.552 1.00 32.85 O HETATM 4284 O HOH B 187 1.092 18.240 -0.895 1.00 44.96 O HETATM 4285 O HOH B 189 26.325 24.071 16.661 1.00 27.12 O HETATM 4286 O HOH B 190 11.770 29.588 4.522 1.00 26.96 O HETATM 4287 O HOH B 194 12.951 31.052 1.293 1.00 43.87 O HETATM 4288 O HOH B 198 11.463 -8.065 8.282 1.00 26.99 O HETATM 4289 O HOH B 201 7.095 30.812 9.732 1.00 31.37 O HETATM 4290 O HOH B 203 21.713 16.540 18.463 1.00 27.98 O HETATM 4291 O HOH B 204 10.008 32.701 13.451 1.00 32.89 O HETATM 4292 O HOH B 205 18.716 18.033 -5.210 1.00 36.22 O HETATM 4293 O HOH B 206 17.254 25.644 21.760 1.00 32.70 O HETATM 4294 O HOH B 211 33.566 8.323 6.325 1.00 54.97 O HETATM 4295 O HOH B 212 3.900 29.670 11.709 1.00 29.78 O HETATM 4296 O HOH B 215 16.073 20.383 21.233 1.00 50.55 O HETATM 4297 O HOH B 216 21.751 34.416 12.113 1.00 34.24 O HETATM 4298 O HOH B 219 18.958 -1.779 -17.599 1.00 47.38 O HETATM 4299 O HOH B 220 15.811 12.802 -1.382 1.00 30.26 O HETATM 4300 O HOH B 224 22.496 12.871 16.616 1.00 38.97 O HETATM 4301 O HOH B 228 25.317 19.186 14.009 1.00 29.34 O HETATM 4302 O HOH B 229 8.592 27.508 -8.933 1.00 47.20 O HETATM 4303 O HOH B 230 14.522 15.333 0.705 1.00 27.76 O HETATM 4304 O HOH B 231 17.670 2.849 7.754 1.00 33.92 O HETATM 4305 O HOH B 232 19.515 32.751 6.233 1.00 33.74 O HETATM 4306 O HOH B 236 20.008 -2.728 -12.957 1.00 36.09 O HETATM 4307 O HOH B 239 9.458 -14.262 0.552 1.00 49.10 O HETATM 4308 O HOH B 241 7.085 18.103 19.715 1.00 45.47 O HETATM 4309 O HOH B 245 15.488 9.646 -4.884 1.00 28.60 O HETATM 4310 O HOH B 246 15.549 22.321 -4.079 1.00 27.74 O HETATM 4311 O HOH B 247 29.003 22.886 -4.528 1.00 49.81 O HETATM 4312 O HOH B 248 -3.722 17.324 14.046 1.00 46.68 O HETATM 4313 O HOH B 249 29.573 0.039 9.489 1.00 37.13 O HETATM 4314 O HOH B 250 18.062 -6.896 -11.257 1.00 21.70 O HETATM 4315 O HOH B 251 21.718 3.167 5.690 1.00 28.10 O HETATM 4316 O HOH B 252 2.480 27.480 6.886 1.00 44.36 O HETATM 4317 O HOH B 254 9.002 -10.265 1.224 1.00 38.33 O HETATM 4318 O HOH B 257 24.436 16.680 16.990 1.00 43.44 O HETATM 4319 O HOH B 259 14.224 18.323 -5.431 1.00 32.36 O HETATM 4320 O HOH B 262 33.502 20.458 -0.039 1.00 26.51 O HETATM 4321 O HOH B 267 30.447 18.358 -5.103 1.00 43.24 O HETATM 4322 O HOH B 268 18.574 16.590 -7.807 1.00 38.21 O HETATM 4323 O HOH B 269 3.320 23.808 4.484 1.00 46.68 O HETATM 4324 O HOH B 271 -3.164 7.161 5.193 1.00 29.84 O HETATM 4325 O HOH B 276 23.593 -8.223 0.239 1.00 42.70 O HETATM 4326 O HOH B 281 9.604 16.854 -9.385 1.00 36.24 O HETATM 4327 O HOH B 283 7.044 0.356 -12.364 1.00 45.23 O HETATM 4328 O HOH B 284 6.528 21.550 -4.902 1.00 24.31 O HETATM 4329 O HOH B 287 40.668 18.890 -2.165 1.00 43.71 O HETATM 4330 O HOH B 288 31.028 25.219 3.506 1.00 44.77 O HETATM 4331 O HOH B 289 18.057 14.364 17.990 1.00 40.64 O HETATM 4332 O HOH B 293 14.833 23.130 20.698 1.00 22.25 O HETATM 4333 O HOH B 296 2.519 24.926 8.482 1.00 24.96 O HETATM 4334 O HOH B 301 -2.073 24.900 16.114 1.00 51.46 O HETATM 4335 O HOH B 308 34.087 14.889 -9.494 1.00 54.46 O HETATM 4336 O HOH B 309 45.833 6.558 -4.928 1.00 37.66 O HETATM 4337 O HOH B 315 14.744 12.035 -3.646 1.00 28.05 O HETATM 4338 O HOH B 316 33.698 25.067 3.796 1.00 27.93 O HETATM 4339 O HOH B 317 21.137 -9.060 0.514 1.00 30.13 O HETATM 4340 O HOH B 318 0.780 25.363 1.805 1.00 26.81 O HETATM 4341 O HOH B 321 31.640 -3.405 0.694 1.00 24.37 O HETATM 4342 O HOH B 324 17.945 3.176 3.597 1.00 26.96 O HETATM 4343 O HOH B 325 15.858 -5.881 -14.316 1.00 33.38 O HETATM 4344 O HOH B 328 14.162 16.266 -3.464 1.00 24.79 O HETATM 4345 O HOH B 330 24.862 -1.910 2.826 1.00 28.60 O HETATM 4346 O HOH B 333 17.484 20.953 -5.451 1.00 34.85 O HETATM 4347 O HOH B 334 27.697 21.697 12.656 1.00 33.81 O HETATM 4348 O HOH B 335 27.694 26.207 14.754 1.00 36.78 O HETATM 4349 O HOH B 336 33.810 -3.023 3.893 1.00 35.10 O HETATM 4350 O HOH B 338 27.718 18.997 12.513 1.00 39.80 O HETATM 4351 O HOH B 339 25.613 22.945 18.918 1.00 28.84 O HETATM 4352 O HOH B 341 31.286 3.382 -18.892 1.00 40.47 O HETATM 4353 O HOH B 342 31.229 -5.858 1.861 1.00 29.22 O HETATM 4354 O HOH B 344 15.445 -5.916 -11.657 1.00 36.11 O HETATM 4355 O HOH B 346 29.271 23.559 -1.415 1.00 34.70 O HETATM 4356 O HOH B 349 -3.347 14.724 13.483 1.00 35.90 O HETATM 4357 O HOH B 350 -0.773 30.518 6.763 1.00 30.64 O HETATM 4358 O HOH B 352 29.021 9.173 8.666 1.00 34.93 O HETATM 4359 O HOH B 353 5.903 32.624 2.564 1.00 41.12 O HETATM 4360 O HOH B 355 4.712 -5.065 0.278 1.00 34.25 O HETATM 4361 O HOH B 356 29.415 15.716 10.424 1.00 27.47 O HETATM 4362 O HOH B 357 31.715 23.187 10.301 1.00 27.35 O HETATM 4363 O HOH B 358 4.413 -3.509 2.744 1.00 36.76 O HETATM 4364 O HOH B 361 -6.572 8.807 15.280 1.00 46.02 O HETATM 4365 O HOH B 362 34.996 5.921 -13.872 1.00 27.75 O HETATM 4366 O HOH B 364 26.738 8.882 7.936 1.00 40.69 O HETATM 4367 O HOH B 367 3.331 8.312 -1.921 1.00 38.44 O HETATM 4368 O HOH B 371 7.204 16.478 18.007 1.00 37.11 O HETATM 4369 O HOH B 374 5.521 18.786 -5.251 1.00 43.30 O HETATM 4370 O HOH B 375 10.693 19.113 19.693 1.00 43.81 O HETATM 4371 O HOH B 376 32.626 18.509 9.187 1.00 39.43 O HETATM 4372 O HOH B 377 27.023 11.583 11.335 1.00 43.37 O HETATM 4373 O HOH B 378 32.553 13.478 -22.412 1.00 50.72 O HETATM 4374 O HOH B 380 27.373 -5.214 0.309 1.00 39.62 O HETATM 4375 O HOH B 381 32.623 -1.223 2.213 1.00 42.88 O HETATM 4376 O HOH B 385 20.386 -0.361 12.026 1.00 41.17 O HETATM 4377 O HOH B 386 -1.903 23.248 8.980 1.00 36.23 O HETATM 4378 O HOH B 387 15.974 24.951 -5.232 1.00 37.81 O HETATM 4379 O HOH B 391 30.984 23.379 0.593 1.00 41.71 O HETATM 4380 O HOH B 393 14.223 26.912 -6.655 1.00 40.12 O HETATM 4381 O HOH B 394 22.201 2.781 -18.438 1.00 40.98 O HETATM 4382 O HOH B 395 24.152 -8.862 2.771 1.00 39.57 O HETATM 4383 O HOH B 396 7.241 -6.285 -11.697 1.00 36.23 O HETATM 4384 O HOH B 398 4.133 20.855 18.499 1.00 53.29 O HETATM 4385 O HOH B 399 14.339 15.725 20.089 1.00 42.62 O HETATM 4386 O HOH B 400 31.359 15.934 8.760 1.00 43.80 O HETATM 4387 O HOH B 401 -0.177 25.223 10.275 1.00 42.01 O HETATM 4388 O HOH B 405 34.677 13.753 -5.291 1.00 44.15 O HETATM 4389 O HOH B 408 3.536 12.226 -8.922 1.00 37.31 O HETATM 4390 O HOH B 934 12.154 1.109 -12.516 1.00 14.03 O CONECT 3984 3999 4000 CONECT 3985 4001 4002 CONECT 3986 3987 3988 4001 CONECT 3987 3986 3999 CONECT 3988 3986 4003 4004 4005 CONECT 3989 4008 CONECT 3990 4008 CONECT 3991 3992 CONECT 3992 3991 3993 4006 CONECT 3993 3992 3994 3999 CONECT 3994 3993 3995 CONECT 3995 3994 3996 3997 3998 CONECT 3996 3995 CONECT 3997 3995 CONECT 3998 3995 CONECT 3999 3984 3987 3993 CONECT 4000 3984 4001 CONECT 4001 3985 3986 4000 CONECT 4002 3985 CONECT 4003 3988 CONECT 4004 3988 CONECT 4005 3988 CONECT 4006 3992 4007 4008 CONECT 4007 4006 CONECT 4008 3989 3990 4006 CONECT 4009 4024 4025 CONECT 4010 4026 4027 CONECT 4011 4012 4013 4026 CONECT 4012 4011 4024 CONECT 4013 4011 4028 4029 4030 CONECT 4014 4033 CONECT 4015 4033 CONECT 4016 4017 CONECT 4017 4016 4018 4031 CONECT 4018 4017 4019 4024 CONECT 4019 4018 4020 CONECT 4020 4019 4021 4022 4023 CONECT 4021 4020 CONECT 4022 4020 CONECT 4023 4020 CONECT 4024 4009 4012 4018 CONECT 4025 4009 4026 CONECT 4026 4010 4011 4025 CONECT 4027 4010 CONECT 4028 4013 CONECT 4029 4013 CONECT 4030 4013 CONECT 4031 4017 4032 4033 CONECT 4032 4031 CONECT 4033 4014 4015 4031 CONECT 4034 4035 4036 4037 4038 CONECT 4035 4034 CONECT 4036 4034 CONECT 4037 4034 CONECT 4038 4034 END