USER MOD reduce.3.24.130724 H: found=0, std=0, add=2156, rem=0, adj=65 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER HORMONE/GROWTH FACTOR RECEPTOR 07-MAY-04 1T74 TITLE CRYSTAL STRUCTURE OF THE ANDROGEN RECEPTOR LIGAND BINDING TITLE 2 DOMAIN IN COMPLEX WITH A WXXLF MOTIF COMPND MOL_ID: 1; COMPND 2 MOLECULE: ANDROGEN RECEPTOR; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: LIGAND BINDING DOMAIN; COMPND 5 SYNONYM: DIHYDROTESTOSTERONE RECEPTOR; COMPND 6 ENGINEERED: YES; COMPND 7 MOL_ID: 2; COMPND 8 MOLECULE: WXXLF MOTIF PEPTIDE; COMPND 9 CHAIN: B; COMPND 0 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: PAN TROGLODYTES; SOURCE 3 ORGANISM_COMMON: CHIMPANZEE; SOURCE 4 ORGANISM_TAXID: 9598; SOURCE 5 GENE: AR, NR3C4; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 MOL_ID: 2; SOURCE 9 SYNTHETIC: YES; SOURCE 0 OTHER_DETAILS: DERIVED FROM PHAGE DISPLAY SELECTIONS KEYWDS NUCLEAR RECEPTOR, TRANSCRIPTION FACTOR, LIGAND BINDING KEYWDS 2 DOMAIN, AF-2, ANDROGEN, TESTOSTERONE, DHT, ALPHA-HELICAL KEYWDS 3 SANDWICH, HORMONE/GROWTH FACTOR RECEPTOR COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR E.HUR,S.J.PFAFF,E.S.PAYNE,H.GRON,B.M.BUEHRER,R.J.FLETTERICK REVDAT 3 24-FEB-09 1T74 1 VERSN REVDAT 2 28-SEP-04 1T74 1 JRNL REVDAT 1 31-AUG-04 1T74 0 JRNL AUTH E.HUR,S.J.PFAFF,E.S.PAYNE,H.GRON,B.M.BUEHRER, JRNL AUTH 2 R.J.FLETTERICK JRNL TITL RECOGNITION AND ACCOMMODATION AT THE ANDROGEN JRNL TITL 2 RECEPTOR COACTIVATOR BINDING INTERFACE. JRNL REF PLOS BIOL. V. 2 E274 2004 JRNL REFN ISSN 1544-9173 JRNL PMID 15328534 JRNL DOI 10.1371/JOURNAL.PBIO.0020274 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 2.00 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.1 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) : 2.00 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 20.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 1268513.270 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 99.8 REMARK 3 NUMBER OF REFLECTIONS : 18803 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) : 0.216 REMARK 3 FREE R VALUE : 0.239 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.900 REMARK 3 FREE R VALUE TEST SET COUNT : 915 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.008 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 6 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.00 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.13 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 100.00 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 2940 REMARK 3 BIN R VALUE (WORKING SET) : 0.3220 REMARK 3 BIN FREE R VALUE : 0.3570 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 4.70 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 146 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.030 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2105 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 30 REMARK 3 SOLVENT ATOMS : 86 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 24.40 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 43.60 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 18.70000 REMARK 3 B22 (A**2) : -14.18000 REMARK 3 B33 (A**2) : -4.52000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.26 REMARK 3 ESD FROM SIGMAA (A) : 0.29 REMARK 3 LOW RESOLUTION CUTOFF (A) : 5.00 REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : 0.32 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.30 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.007 REMARK 3 BOND ANGLES (DEGREES) : 1.00 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 18.40 REMARK 3 IMPROPER ANGLES (DEGREES) : 0.77 REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : RESTRAINED REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : 1.410 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 2.230 ; 2.000 REMARK 3 SIDE-CHAIN BOND (A**2) : 2.120 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 3.140 ; 2.500 REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : FLAT MODEL REMARK 3 KSOL : 0.39 REMARK 3 BSOL : 63.36 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 : WATER_REP.PARAM REMARK 3 PARAMETER FILE 3 : ION.PARAM REMARK 3 PARAMETER FILE 4 : DHT_LIGAND.PAR REMARK 3 PARAMETER FILE 5 : NULL REMARK 3 TOPOLOGY FILE 1 : PROTEIN.TOP REMARK 3 TOPOLOGY FILE 2 : WATER.TOP REMARK 3 TOPOLOGY FILE 3 : ION.TOP REMARK 3 TOPOLOGY FILE 4 : DHT_LIGAND.TOP REMARK 3 TOPOLOGY FILE 5 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1T74 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 20-MAY-04. REMARK 100 THE RCSB ID CODE IS RCSB022395. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 12-OCT-03 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ALS REMARK 200 BEAMLINE : 8.3.1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.93221 REMARK 200 MONOCHROMATOR : DOUBLE CRYSTAL SI(111) REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 210 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 19120 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.000 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -3.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.1 REMARK 200 DATA REDUNDANCY : NULL REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : NULL REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.00 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.03 REMARK 200 COMPLETENESS FOR SHELL (%) : 85.3 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL 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: CNS 1.1 REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 40.20 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.10 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: SODIUM CITRATE, HEPES, ETHYLENE REMARK 280 GLYCOL, LITHIUM SULFATE, GLYCEROL, TCEP, N-OCTYL GLUCOSIDE, 5- REMARK 280 ALPHA DIHYDROTESTOSTERONE, PH 7.5, VAPOR DIFFUSION, HANGING REMARK 280 DROP, TEMPERATURE 293K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X+1/2,-Y,Z+1/2 REMARK 290 3555 -X,Y+1/2,-Z+1/2 REMARK 290 4555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 28.21300 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 36.03150 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 33.19150 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 36.03150 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 28.21300 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 33.19150 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 1930 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 11740 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -20.0 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 651 REMARK 465 SER A 652 REMARK 465 PRO A 653 REMARK 465 GLY A 654 REMARK 465 ILE A 655 REMARK 465 SER A 656 REMARK 465 GLY A 657 REMARK 465 GLY A 658 REMARK 465 GLY A 659 REMARK 465 GLY A 660 REMARK 465 GLY A 661 REMARK 465 SER A 662 REMARK 465 HIS A 663 REMARK 465 ILE A 664 REMARK 465 GLU A 665 REMARK 465 GLY A 666 REMARK 465 TYR A 667 REMARK 465 GLU A 668 REMARK 465 CYS A 669 REMARK 465 GLN A 919 REMARK 465 ASP B 107 REMARK 465 GLY B 108 REMARK 465 THR B 109 REMARK 465 ASP B 110 REMARK 465 THR B 111 REMARK 465 SER B 112 REMARK 465 ARG B 113 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS(M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 LYS A 845 CG CD CE NZ REMARK 470 LYS A 847 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 ASN A 756 -63.59 -101.40 REMARK 500 ASN A 823 77.14 -113.62 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 A 300 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE DHT A 200 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A 301 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1T73 RELATED DB: PDB REMARK 900 RELATED ID: 1T76 RELATED DB: PDB REMARK 900 RELATED ID: 1T79 RELATED DB: PDB REMARK 900 RELATED ID: 1T7F RELATED DB: PDB REMARK 900 RELATED ID: 1T7M RELATED DB: PDB REMARK 900 RELATED ID: 1T7R RELATED DB: PDB REMARK 900 RELATED ID: 1T7T RELATED DB: PDB DBREF 1T74 A 662 919 UNP O97775 ANDR_PANTR 654 911 DBREF 1T74 B 99 113 PDB 1T74 1T74 99 113 SEQADV 1T74 GLY A 651 UNP O97775 CLONING ARTIFACT SEQADV 1T74 SER A 652 UNP O97775 CLONING ARTIFACT SEQADV 1T74 PRO A 653 UNP O97775 CLONING ARTIFACT SEQADV 1T74 GLY A 654 UNP O97775 CLONING ARTIFACT SEQADV 1T74 ILE A 655 UNP O97775 CLONING ARTIFACT SEQADV 1T74 SER A 656 UNP O97775 CLONING ARTIFACT SEQADV 1T74 GLY A 657 UNP O97775 CLONING ARTIFACT SEQADV 1T74 GLY A 658 UNP O97775 CLONING ARTIFACT SEQADV 1T74 GLY A 659 UNP O97775 CLONING ARTIFACT SEQADV 1T74 GLY A 660 UNP O97775 CLONING ARTIFACT SEQADV 1T74 GLY A 661 UNP O97775 CLONING ARTIFACT SEQRES 1 A 269 GLY SER PRO GLY ILE SER GLY GLY GLY GLY GLY SER HIS SEQRES 2 A 269 ILE GLU GLY TYR GLU CYS GLN PRO ILE PHE LEU ASN VAL SEQRES 3 A 269 LEU GLU ALA ILE GLU PRO GLY VAL VAL CYS ALA GLY HIS SEQRES 4 A 269 ASP ASN ASN GLN PRO ASP SER PHE ALA ALA LEU LEU SER SEQRES 5 A 269 SER LEU ASN GLU LEU GLY GLU ARG GLN LEU VAL HIS VAL SEQRES 6 A 269 VAL LYS TRP ALA LYS ALA LEU PRO GLY PHE ARG ASN LEU SEQRES 7 A 269 HIS VAL ASP ASP GLN MET ALA VAL ILE GLN TYR SER TRP SEQRES 8 A 269 MET GLY LEU MET VAL PHE ALA MET GLY TRP ARG SER PHE SEQRES 9 A 269 THR ASN VAL ASN SER ARG MET LEU TYR PHE ALA PRO ASP SEQRES 10 A 269 LEU VAL PHE ASN GLU TYR ARG MET HIS LYS SER ARG MET SEQRES 11 A 269 TYR SER GLN CYS VAL ARG MET ARG HIS LEU SER GLN GLU SEQRES 12 A 269 PHE GLY TRP LEU GLN ILE THR PRO GLN GLU PHE LEU CYS SEQRES 13 A 269 MET LYS ALA LEU LEU LEU PHE SER ILE ILE PRO VAL ASP SEQRES 14 A 269 GLY LEU LYS ASN GLN LYS PHE PHE ASP GLU LEU ARG MET SEQRES 15 A 269 ASN TYR ILE LYS GLU LEU ASP ARG ILE ILE ALA CYS LYS SEQRES 16 A 269 ARG LYS ASN PRO THR SER CYS SER ARG ARG PHE TYR GLN SEQRES 17 A 269 LEU THR LYS LEU LEU ASP SER VAL GLN PRO ILE ALA ARG SEQRES 18 A 269 GLU LEU HIS GLN PHE THR PHE ASP LEU LEU ILE LYS SER SEQRES 19 A 269 HIS MET VAL SER VAL ASP PHE PRO GLU MET MET ALA GLU SEQRES 20 A 269 ILE ILE SER VAL GLN VAL PRO LYS ILE LEU SER GLY LYS SEQRES 21 A 269 VAL LYS PRO ILE TYR PHE HIS THR GLN SEQRES 1 B 15 SER ARG TRP GLN ALA LEU PHE ASP ASP GLY THR ASP THR SEQRES 2 B 15 SER ARG HET SO4 A 300 5 HET DHT A 200 21 HET EDO A 301 4 HETNAM SO4 SULFATE ION HETNAM DHT 5-ALPHA-DIHYDROTESTOSTERONE HETNAM EDO 1,2-ETHANEDIOL HETSYN EDO ETHYLENE GLYCOL FORMUL 3 SO4 O4 S 2- FORMUL 4 DHT C19 H30 O2 FORMUL 5 EDO C2 H6 O2 FORMUL 6 HOH *86(H2 O) HELIX 1 1 PRO A 671 GLU A 681 1 11 HELIX 2 2 SER A 696 ALA A 721 1 26 HELIX 3 3 GLY A 724 LEU A 728 5 5 HELIX 4 4 HIS A 729 ASN A 758 1 30 HELIX 5 5 ASN A 771 SER A 778 1 8 HELIX 6 6 MET A 780 GLN A 798 1 19 HELIX 7 7 THR A 800 PHE A 813 1 14 HELIX 8 8 ASN A 823 CYS A 844 1 22 HELIX 9 9 ASN A 848 LYS A 883 1 36 HELIX 10 10 LYS A 883 SER A 888 1 6 HELIX 11 11 PRO A 892 GLN A 902 1 11 HELIX 12 12 GLN A 902 SER A 908 1 7 HELIX 13 13 SER B 99 ASP B 106 1 8 SHEET 1 A 2 LEU A 762 ALA A 765 0 SHEET 2 A 2 LEU A 768 PHE A 770 -1 O PHE A 770 N LEU A 762 SHEET 1 B 2 ILE A 815 PRO A 817 0 SHEET 2 B 2 VAL A 911 PRO A 913 -1 O LYS A 912 N ILE A 816 SITE *** AC1 6 HOH A 34 SER A 696 PHE A 697 LYS A 777 SITE *** AC1 6 ARG A 779 SER A 853 SITE *** AC2 7 LEU A 704 ASN A 705 GLN A 711 MET A 749 SITE *** AC2 7 ARG A 752 PHE A 764 THR A 877 SITE *** AC3 3 ILE A 680 HIS A 714 SER A 908 CRYST1 56.426 66.383 72.063 90.00 90.00 90.00 P 21 21 21 4 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.017722 0.000000 0.000000 0.00000 SCALE2 0.000000 0.015064 0.000000 0.00000 SCALE3 0.000000 0.000000 0.013877 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 860 THR OG1 : rot 110:sc= 1.32 USER MOD Set 1.2: A 917 HIS : no HE2:sc= 1.04 K(o=2.4,f=-3.8!) USER MOD Set 2.1: A 902 GLN : amide:sc= -0.213 X(o=-0.21,f=-0.31) USER MOD Set 2.2: A 905 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 885 HIS : no HD1:sc= -2.37! C(o=-3!,f=-6.9!) USER MOD Set 3.2: A 886 MET CE :methyl -126:sc= -0.662 (180deg=-1.9!) USER MOD Set 4.1: A 742 MET CE :methyl 164:sc=-0.00856 (180deg=-0.0755) USER MOD Set 4.2: A 874 HIS : no HE2:sc= 1.19 K(o=1.2,f=-2.5!) USER MOD Set 5.1: A 833 ASN : amide:sc= -0.0746 X(o=-0.047,f=-0.067) USER MOD Set 5.2: A 836 LYS NZ :NH3+ -145:sc= 0.0281 (180deg=0) USER MOD Set 6.1: A 800 THR OG1 : rot 180:sc= -1.63! USER MOD Set 6.2: A 802 GLN : amide:sc= -1.83! C(o=-3.5!,f=-5.7!) USER MOD Set 7.1: A 780 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 7.2: A 784 CYS SG : rot 76:sc= 0.505 USER MOD Set 8.1: A 782 SER OG : rot 15:sc= 0.116 USER MOD Set 8.2: A 783 GLN : amide:sc= 0.812 K(o=0.93,f=-6.7!) USER MOD Set 9.1: A 759 SER OG : rot -74:sc= -0.152 USER MOD Set 9.2: A 791 SER OG : rot 75:sc= 1.06 USER MOD Set10.1: A 689 HIS : no HD1:sc= 0.973 K(o=2.4,f=-7.3!) USER MOD Set10.2: A 703 SER OG : rot 156:sc= 1.45 USER MOD Set11.1: A 200 DHT O17 : rot -74:sc= 1.11 USER MOD Set11.2: A 705 ASN : amide:sc= 1.12 K(o=2,f=-0.64!) USER MOD Set11.3: A 877 THR OG1 : rot 89:sc= -0.214 USER MOD Single : A 301 EDO O1 : rot -29:sc= 0.0068 USER MOD Single : A 301 EDO O2 : rot 139:sc= 0.224 USER MOD Single : A 670 GLN : amide:sc= -0.0198 K(o=-0.02,f=-1.3) USER MOD Single : A 675 ASN : amide:sc= -0.073 K(o=-0.073,f=-1.5!) USER MOD Single : A 686 CYS SG : rot 180:sc= 0 USER MOD Single : A 691 ASN : amide:sc= 0.296 K(o=0.3,f=-1.5!) USER MOD Single : A 692 ASN : amide:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 693 GLN :FLIP amide:sc= -1.77 F(o=-6.2!,f=-1.8) USER MOD Single : A 696 SER OG : rot 180:sc= 0.112 USER MOD Single : A 702 SER OG : rot 85:sc= 1.09 USER MOD Single : A 711 GLN :FLIP amide:sc= 0.587 F(o=-0.14!,f=0.59) USER MOD Single : A 714 HIS : no HD1:sc= -2.15! C(o=-2.1!,f=-5.9!) USER MOD Single : A 717 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 720 LYS NZ :NH3+ -132:sc= 0.0263 (180deg=0) USER MOD Single : A 727 ASN : amide:sc= -0.015 X(o=-0.015,f=-0.33) USER MOD Single : A 729 HIS :FLIP no HD1:sc= 0.0168 F(o=-8!,f=0.017) USER MOD Single : A 733 GLN : amide:sc= 0.961 K(o=0.96,f=-0.43) USER MOD Single : A 734 MET CE :methyl -114:sc= -6.62! (180deg=-10!) USER MOD Single : A 738 GLN :FLIP amide:sc= -0.245 F(o=-1.6!,f=-0.25) USER MOD Single : A 739 TYR OH : rot 180:sc= 0 USER MOD Single : A 740 SER OG : rot -71:sc= 1.12 USER MOD Single : A 745 MET CE :methyl -153:sc= -0.0823 (180deg=-0.125) USER MOD Single : A 749 MET CE :methyl -147:sc= -0.0711 (180deg=-1.01) USER MOD Single : A 753 SER OG : rot 71:sc= 1.09 USER MOD Single : A 755 THR OG1 : rot -75:sc= 0.0575 USER MOD Single : A 756 ASN : amide:sc= -0.087 X(o=-0.087,f=-0.13) USER MOD Single : A 758 ASN : amide:sc= -0.875! C(o=-0.88!,f=-0.88!) USER MOD Single : A 761 MET CE :methyl -118:sc= -3.19! (180deg=-5.27!) USER MOD Single : A 763 TYR OH : rot 180:sc= -0.0727 USER MOD Single : A 771 ASN : amide:sc= 0.224 K(o=0.22,f=-6!) USER MOD Single : A 773 TYR OH : rot 180:sc= 0 USER MOD Single : A 775 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 776 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 777 LYS NZ :NH3+ -150:sc= -0.179 (180deg=-0.879) USER MOD Single : A 778 SER OG : rot -47:sc= 0.109 USER MOD Single : A 781 TYR OH : rot 170:sc= 0.824 USER MOD Single : A 787 MET CE :methyl -158:sc=-0.00954 (180deg=-0.46) USER MOD Single : A 789 HIS : no HD1:sc= -0.0133 X(o=-0.013,f=0) USER MOD Single : A 792 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 798 GLN : amide:sc=-0.00872 X(o=-0.0087,f=0) USER MOD Single : A 806 CYS SG A: rot 130:sc= -3.2 USER MOD Single : A 806 CYS SG B: rot 79:sc= 0.146 USER MOD Single : A 807 MET CE :methyl 180:sc= -0.208 (180deg=-0.208) USER MOD Single : A 808 LYS NZ :NH3+ 157:sc= 0.578 (180deg=0.0312) USER MOD Single : A 814 SER OG : rot 72:sc= 0.804 USER MOD Single : A 822 LYS NZ :NH3+ -134:sc= -0.623 (180deg=-1.51) USER MOD Single : A 823 ASN :FLIP amide:sc= -0.905 F(o=-1.8,f=-0.9) USER MOD Single : A 824 GLN : amide:sc= 0.823 K(o=0.82,f=-2.9!) USER MOD Single : A 825 LYS NZ :NH3+ -166:sc= -0.0449 (180deg=-0.192) USER MOD Single : A 832 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 834 TYR OH : rot -2:sc= 0.851 USER MOD Single : A 844 CYS SG : rot -29:sc= 0.167 USER MOD Single : A 848 ASN :FLIP amide:sc= -5.54! C(o=-8.2!,f=-5.5!) USER MOD Single : A 850 THR OG1 : rot 180:sc= 0 USER MOD Single : A 851 SER OG : rot 180:sc= -0.0272 USER MOD Single : A 852 CYS SG : rot 80:sc= -0.509 USER MOD Single : A 853 SER OG : rot 180:sc= 0 USER MOD Single : A 857 TYR OH : rot 0:sc= -1.19 USER MOD Single : A 858 GLN : amide:sc= 0 K(o=0,f=-1.3) USER MOD Single : A 861 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 865 SER OG : rot -54:sc= 1.32 USER MOD Single : A 867 GLN : amide:sc= -0.329 K(o=-0.33,f=-1.1) USER MOD Single : A 875 GLN : amide:sc= -0.0374 X(o=-0.037,f=-0.037) USER MOD Single : A 883 LYS NZ :NH3+ -161:sc= -0.211 (180deg=-1.06) USER MOD Single : A 884 SER OG : rot -83:sc= 1.04 USER MOD Single : A 888 SER OG : rot 180:sc= 0 USER MOD Single : A 894 MET CE :methyl -146:sc= -0.0884 (180deg=-1.27) USER MOD Single : A 895 MET CE :methyl -114:sc= -3.06! (180deg=-5.34!) USER MOD Single : A 900 SER OG : rot -83:sc= 0.64 USER MOD Single : A 908 SER OG : rot -85:sc= 0.0677 USER MOD Single : A 910 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 912 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 915 TYR OH : rot 180:sc= 0 USER MOD Single : A 918 THR OG1 : rot 180:sc= 0 USER MOD Single : B 99 SER OG : rot 85:sc= 0.00643 USER MOD Single : B 102 GLN :FLIP amide:sc= -0.0209 F(o=-1.4!,f=-0.021) USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 670 9.562 -4.349 60.161 1.00 70.11 N ATOM 2 CA GLN A 670 10.574 -4.560 59.084 1.00 69.59 C ATOM 3 C GLN A 670 11.063 -6.010 59.078 1.00 67.31 C ATOM 4 O GLN A 670 11.467 -6.546 60.112 1.00 68.63 O ATOM 5 CB GLN A 670 11.760 -3.608 59.287 1.00 70.62 C ATOM 6 CG GLN A 670 12.831 -3.702 58.210 1.00 72.35 C ATOM 7 CD GLN A 670 13.951 -2.691 58.408 1.00 73.55 C ATOM 8 OE1 GLN A 670 14.634 -2.694 59.436 1.00 72.33 O ATOM 9 NE2 GLN A 670 14.143 -1.819 57.421 1.00 73.29 N ATOM 0 HA GLN A 670 10.157 -4.373 58.229 1.00 69.59 H new ATOM 0 HB2 GLN A 670 11.428 -2.697 59.319 1.00 70.62 H new ATOM 0 HB3 GLN A 670 12.166 -3.793 60.149 1.00 70.62 H new ATOM 0 HG2 GLN A 670 13.205 -4.597 58.208 1.00 72.35 H new ATOM 0 HG3 GLN A 670 12.424 -3.562 57.341 1.00 72.35 H new ATOM 0 HE21 GLN A 670 13.647 -1.848 56.719 1.00 73.29 H new ATOM 0 HE22 GLN A 670 14.763 -1.227 57.485 1.00 73.29 H new ATOM 10 N PRO A 671 11.024 -6.666 57.907 1.00 63.86 N ATOM 11 CA PRO A 671 11.465 -8.058 57.778 1.00 60.80 C ATOM 12 C PRO A 671 12.985 -8.163 57.824 1.00 56.81 C ATOM 13 O PRO A 671 13.635 -8.323 56.793 1.00 55.36 O ATOM 14 CB PRO A 671 10.902 -8.461 56.424 1.00 62.27 C ATOM 15 CG PRO A 671 11.069 -7.190 55.632 1.00 63.28 C ATOM 16 CD PRO A 671 10.571 -6.138 56.607 1.00 64.06 C ATOM 0 HA PRO A 671 11.161 -8.632 58.498 1.00 60.80 H new ATOM 0 HB2 PRO A 671 11.391 -9.201 56.032 1.00 62.27 H new ATOM 0 HB3 PRO A 671 9.973 -8.734 56.483 1.00 62.27 H new ATOM 0 HG2 PRO A 671 11.993 -7.040 55.378 1.00 63.28 H new ATOM 0 HG3 PRO A 671 10.548 -7.202 54.814 1.00 63.28 H new ATOM 0 HD2 PRO A 671 10.950 -5.265 56.420 1.00 64.06 H new ATOM 0 HD3 PRO A 671 9.606 -6.042 56.573 1.00 64.06 H new ATOM 17 N ILE A 672 13.546 -8.069 59.022 1.00 53.38 N ATOM 18 CA ILE A 672 14.991 -8.142 59.188 1.00 50.68 C ATOM 19 C ILE A 672 15.579 -9.411 58.580 1.00 48.74 C ATOM 20 O ILE A 672 16.534 -9.350 57.802 1.00 47.54 O ATOM 21 CB ILE A 672 15.383 -8.069 60.681 1.00 50.93 C ATOM 22 CG1 ILE A 672 15.005 -6.698 61.249 1.00 50.48 C ATOM 23 CG2 ILE A 672 16.877 -8.329 60.850 1.00 48.53 C ATOM 24 CD1 ILE A 672 15.621 -5.532 60.500 1.00 49.41 C ATOM 0 H ILE A 672 13.107 -7.962 59.754 1.00 53.38 H new ATOM 0 HA ILE A 672 15.358 -7.378 58.716 1.00 50.68 H new ATOM 0 HB ILE A 672 14.900 -8.753 61.170 1.00 50.93 H new ATOM 0 HG12 ILE A 672 14.039 -6.607 61.234 1.00 50.48 H new ATOM 0 HG13 ILE A 672 15.280 -6.656 62.178 1.00 50.48 H new ATOM 0 HG21 ILE A 672 17.110 -8.280 61.790 1.00 48.53 H new ATOM 0 HG22 ILE A 672 17.093 -9.211 60.509 1.00 48.53 H new ATOM 0 HG23 ILE A 672 17.380 -7.661 60.358 1.00 48.53 H new ATOM 0 HD11 ILE A 672 15.341 -4.699 60.911 1.00 49.41 H new ATOM 0 HD12 ILE A 672 16.588 -5.600 60.534 1.00 49.41 H new ATOM 0 HD13 ILE A 672 15.328 -5.550 59.575 1.00 49.41 H new ATOM 25 N PHE A 673 14.997 -10.556 58.929 1.00 47.06 N ATOM 26 CA PHE A 673 15.464 -11.849 58.437 1.00 45.40 C ATOM 27 C PHE A 673 15.566 -11.909 56.918 1.00 44.79 C ATOM 28 O PHE A 673 16.594 -12.321 56.378 1.00 42.06 O ATOM 29 CB PHE A 673 14.545 -12.970 58.930 1.00 46.54 C ATOM 30 CG PHE A 673 15.000 -14.345 58.531 1.00 47.36 C ATOM 31 CD1 PHE A 673 16.197 -14.865 59.018 1.00 47.93 C ATOM 32 CD2 PHE A 673 14.237 -15.120 57.659 1.00 47.48 C ATOM 33 CE1 PHE A 673 16.628 -16.139 58.641 1.00 48.93 C ATOM 34 CE2 PHE A 673 14.660 -16.394 57.277 1.00 48.16 C ATOM 35 CZ PHE A 673 15.856 -16.904 57.768 1.00 47.51 C ATOM 0 H PHE A 673 14.320 -10.605 59.458 1.00 47.06 H new ATOM 0 HA PHE A 673 16.359 -11.969 58.792 1.00 45.40 H new ATOM 0 HB2 PHE A 673 14.485 -12.926 59.897 1.00 46.54 H new ATOM 0 HB3 PHE A 673 13.651 -12.821 58.583 1.00 46.54 H new ATOM 0 HD1 PHE A 673 16.715 -14.358 59.601 1.00 47.93 H new ATOM 0 HD2 PHE A 673 13.436 -14.784 57.328 1.00 47.48 H new ATOM 0 HE1 PHE A 673 17.429 -16.476 58.972 1.00 48.93 H new ATOM 0 HE2 PHE A 673 14.142 -16.901 56.694 1.00 48.16 H new ATOM 0 HZ PHE A 673 16.140 -17.753 57.515 1.00 47.51 H new ATOM 36 N LEU A 674 14.497 -11.511 56.229 1.00 43.88 N ATOM 37 CA LEU A 674 14.488 -11.514 54.769 1.00 43.25 C ATOM 38 C LEU A 674 15.511 -10.534 54.208 1.00 41.64 C ATOM 39 O LEU A 674 16.160 -10.820 53.204 1.00 41.24 O ATOM 40 CB LEU A 674 13.094 -11.165 54.241 1.00 44.73 C ATOM 41 CG LEU A 674 12.138 -12.342 54.056 1.00 47.47 C ATOM 42 CD1 LEU A 674 12.116 -13.191 55.313 1.00 48.41 C ATOM 43 CD2 LEU A 674 10.748 -11.817 53.726 1.00 47.40 C ATOM 0 H LEU A 674 13.767 -11.235 56.590 1.00 43.88 H new ATOM 0 HA LEU A 674 14.726 -12.407 54.475 1.00 43.25 H new ATOM 0 HB2 LEU A 674 12.685 -10.531 54.851 1.00 44.73 H new ATOM 0 HB3 LEU A 674 13.193 -10.714 53.388 1.00 44.73 H new ATOM 0 HG LEU A 674 12.441 -12.899 53.322 1.00 47.47 H new ATOM 0 HD11 LEU A 674 11.508 -13.936 55.190 1.00 48.41 H new ATOM 0 HD12 LEU A 674 13.008 -13.528 55.492 1.00 48.41 H new ATOM 0 HD13 LEU A 674 11.818 -12.652 56.063 1.00 48.41 H new ATOM 0 HD21 LEU A 674 10.140 -12.563 53.608 1.00 47.40 H new ATOM 0 HD22 LEU A 674 10.433 -11.255 54.452 1.00 47.40 H new ATOM 0 HD23 LEU A 674 10.784 -11.297 52.908 1.00 47.40 H new ATOM 44 N ASN A 675 15.641 -9.376 54.852 1.00 41.25 N ATOM 45 CA ASN A 675 16.614 -8.376 54.425 1.00 40.23 C ATOM 46 C ASN A 675 17.975 -9.060 54.330 1.00 38.01 C ATOM 47 O ASN A 675 18.689 -8.925 53.334 1.00 38.80 O ATOM 48 CB ASN A 675 16.711 -7.230 55.440 1.00 40.95 C ATOM 49 CG ASN A 675 15.618 -6.185 55.263 1.00 44.59 C ATOM 50 OD1 ASN A 675 14.952 -6.133 54.229 1.00 44.43 O ATOM 51 ND2 ASN A 675 15.448 -5.331 56.269 1.00 42.89 N ATOM 0 H ASN A 675 15.175 -9.151 55.539 1.00 41.25 H new ATOM 0 HA ASN A 675 16.338 -8.006 53.572 1.00 40.23 H new ATOM 0 HB2 ASN A 675 16.661 -7.594 56.338 1.00 40.95 H new ATOM 0 HB3 ASN A 675 17.577 -6.802 55.355 1.00 40.95 H new ATOM 0 HD21 ASN A 675 14.854 -4.712 56.212 1.00 42.89 H new ATOM 0 HD22 ASN A 675 15.932 -5.398 56.977 1.00 42.89 H new ATOM 52 N VAL A 676 18.320 -9.805 55.378 1.00 36.92 N ATOM 53 CA VAL A 676 19.598 -10.496 55.427 1.00 36.84 C ATOM 54 C VAL A 676 19.745 -11.549 54.339 1.00 36.21 C ATOM 55 O VAL A 676 20.771 -11.587 53.653 1.00 35.77 O ATOM 56 CB VAL A 676 19.833 -11.166 56.799 1.00 35.47 C ATOM 57 CG1 VAL A 676 21.245 -11.770 56.848 1.00 35.95 C ATOM 58 CG2 VAL A 676 19.662 -10.147 57.908 1.00 35.60 C ATOM 0 H VAL A 676 17.824 -9.921 56.071 1.00 36.92 H new ATOM 0 HA VAL A 676 20.265 -9.807 55.280 1.00 36.84 H new ATOM 0 HB VAL A 676 19.183 -11.875 56.923 1.00 35.47 H new ATOM 0 HG11 VAL A 676 21.388 -12.189 57.711 1.00 35.95 H new ATOM 0 HG12 VAL A 676 21.338 -12.434 56.147 1.00 35.95 H new ATOM 0 HG13 VAL A 676 21.902 -11.068 56.717 1.00 35.95 H new ATOM 0 HG21 VAL A 676 19.811 -10.574 58.766 1.00 35.60 H new ATOM 0 HG22 VAL A 676 20.303 -9.429 57.789 1.00 35.60 H new ATOM 0 HG23 VAL A 676 18.763 -9.785 57.879 1.00 35.60 H new ATOM 59 N LEU A 677 18.727 -12.395 54.176 1.00 35.21 N ATOM 60 CA LEU A 677 18.777 -13.453 53.169 1.00 36.02 C ATOM 61 C LEU A 677 18.948 -12.913 51.760 1.00 36.11 C ATOM 62 O LEU A 677 19.712 -13.460 50.977 1.00 35.66 O ATOM 63 CB LEU A 677 17.519 -14.333 53.233 1.00 36.59 C ATOM 64 CG LEU A 677 17.282 -15.155 54.508 1.00 38.97 C ATOM 65 CD1 LEU A 677 16.186 -16.186 54.238 1.00 40.85 C ATOM 66 CD2 LEU A 677 18.564 -15.867 54.928 1.00 39.57 C ATOM 0 H LEU A 677 18.001 -12.373 54.637 1.00 35.21 H new ATOM 0 HA LEU A 677 19.559 -13.988 53.377 1.00 36.02 H new ATOM 0 HB2 LEU A 677 16.748 -13.760 53.101 1.00 36.59 H new ATOM 0 HB3 LEU A 677 17.547 -14.948 52.483 1.00 36.59 H new ATOM 0 HG LEU A 677 17.010 -14.561 55.225 1.00 38.97 H new ATOM 0 HD11 LEU A 677 16.030 -16.710 55.039 1.00 40.85 H new ATOM 0 HD12 LEU A 677 15.368 -15.730 53.986 1.00 40.85 H new ATOM 0 HD13 LEU A 677 16.464 -16.773 53.517 1.00 40.85 H new ATOM 0 HD21 LEU A 677 18.400 -16.382 55.734 1.00 39.57 H new ATOM 0 HD22 LEU A 677 18.851 -16.462 54.218 1.00 39.57 H new ATOM 0 HD23 LEU A 677 19.257 -15.211 55.100 1.00 39.57 H new ATOM 67 N GLU A 678 18.224 -11.842 51.439 1.00 38.26 N ATOM 68 CA GLU A 678 18.302 -11.222 50.114 1.00 39.78 C ATOM 69 C GLU A 678 19.658 -10.554 49.914 1.00 37.83 C ATOM 70 O GLU A 678 20.226 -10.582 48.824 1.00 37.70 O ATOM 71 CB GLU A 678 17.204 -10.161 49.951 1.00 44.32 C ATOM 72 CG GLU A 678 15.775 -10.701 49.954 1.00 50.99 C ATOM 73 CD GLU A 678 14.718 -9.601 50.101 1.00 54.75 C ATOM 74 OE1 GLU A 678 13.514 -9.916 49.979 1.00 56.43 O ATOM 75 OE2 GLU A 678 15.086 -8.429 50.347 1.00 57.59 O ATOM 0 H GLU A 678 17.677 -11.456 51.978 1.00 38.26 H new ATOM 0 HA GLU A 678 18.182 -11.922 49.453 1.00 39.78 H new ATOM 0 HB2 GLU A 678 17.291 -9.513 50.667 1.00 44.32 H new ATOM 0 HB3 GLU A 678 17.354 -9.686 49.119 1.00 44.32 H new ATOM 0 HG2 GLU A 678 15.617 -11.186 49.129 1.00 50.99 H new ATOM 0 HG3 GLU A 678 15.676 -11.336 50.680 1.00 50.99 H new ATOM 76 N ALA A 679 20.175 -9.957 50.978 1.00 35.93 N ATOM 77 CA ALA A 679 21.447 -9.260 50.908 1.00 34.94 C ATOM 78 C ALA A 679 22.645 -10.178 50.702 1.00 36.02 C ATOM 79 O ALA A 679 23.588 -9.820 50.000 1.00 36.62 O ATOM 80 CB ALA A 679 21.641 -8.428 52.167 1.00 35.57 C ATOM 0 H ALA A 679 19.802 -9.945 51.753 1.00 35.93 H new ATOM 0 HA ALA A 679 21.407 -8.692 50.123 1.00 34.94 H new ATOM 0 HB1 ALA A 679 22.491 -7.963 52.120 1.00 35.57 H new ATOM 0 HB2 ALA A 679 20.922 -7.781 52.241 1.00 35.57 H new ATOM 0 HB3 ALA A 679 21.634 -9.009 52.944 1.00 35.57 H new ATOM 81 N ILE A 680 22.611 -11.361 51.310 1.00 35.52 N ATOM 82 CA ILE A 680 23.724 -12.297 51.206 1.00 34.11 C ATOM 83 C ILE A 680 23.632 -13.325 50.085 1.00 34.98 C ATOM 84 O ILE A 680 24.572 -14.095 49.875 1.00 33.65 O ATOM 85 CB ILE A 680 23.922 -13.051 52.529 1.00 33.60 C ATOM 86 CG1 ILE A 680 22.690 -13.915 52.828 1.00 31.95 C ATOM 87 CG2 ILE A 680 24.148 -12.054 53.654 1.00 30.84 C ATOM 88 CD1 ILE A 680 22.880 -14.854 53.992 1.00 29.05 C ATOM 0 H ILE A 680 21.952 -11.640 51.787 1.00 35.52 H new ATOM 0 HA ILE A 680 24.479 -11.728 50.992 1.00 34.11 H new ATOM 0 HB ILE A 680 24.698 -13.629 52.456 1.00 33.60 H new ATOM 0 HG12 ILE A 680 21.934 -13.335 53.010 1.00 31.95 H new ATOM 0 HG13 ILE A 680 22.467 -14.432 52.038 1.00 31.95 H new ATOM 0 HG21 ILE A 680 24.273 -12.531 54.489 1.00 30.84 H new ATOM 0 HG22 ILE A 680 24.938 -11.524 53.463 1.00 30.84 H new ATOM 0 HG23 ILE A 680 23.377 -11.469 53.728 1.00 30.84 H new ATOM 0 HD11 ILE A 680 22.069 -15.369 54.128 1.00 29.05 H new ATOM 0 HD12 ILE A 680 23.617 -15.456 53.805 1.00 29.05 H new ATOM 0 HD13 ILE A 680 23.076 -14.342 54.792 1.00 29.05 H new ATOM 89 N GLU A 681 22.514 -13.341 49.362 1.00 35.51 N ATOM 90 CA GLU A 681 22.331 -14.302 48.272 1.00 36.98 C ATOM 91 C GLU A 681 23.468 -14.201 47.257 1.00 37.54 C ATOM 92 O GLU A 681 23.743 -13.130 46.726 1.00 37.25 O ATOM 93 CB GLU A 681 20.980 -14.068 47.579 1.00 36.70 C ATOM 94 CG GLU A 681 20.662 -15.060 46.468 1.00 36.79 C ATOM 95 CD GLU A 681 20.586 -16.496 46.958 1.00 36.00 C ATOM 96 OE1 GLU A 681 20.459 -17.400 46.111 1.00 38.23 O ATOM 97 OE2 GLU A 681 20.644 -16.725 48.184 1.00 36.13 O ATOM 0 H GLU A 681 21.851 -12.807 49.484 1.00 35.51 H new ATOM 0 HA GLU A 681 22.341 -15.195 48.651 1.00 36.98 H new ATOM 0 HB2 GLU A 681 20.276 -14.109 48.245 1.00 36.70 H new ATOM 0 HB3 GLU A 681 20.970 -13.171 47.210 1.00 36.70 H new ATOM 0 HG2 GLU A 681 19.817 -14.818 46.058 1.00 36.79 H new ATOM 0 HG3 GLU A 681 21.341 -14.994 45.778 1.00 36.79 H new ATOM 98 N PRO A 682 24.148 -15.325 46.981 1.00 38.05 N ATOM 99 CA PRO A 682 25.265 -15.383 46.033 1.00 37.52 C ATOM 100 C PRO A 682 24.902 -14.974 44.609 1.00 39.06 C ATOM 101 O PRO A 682 23.797 -15.253 44.128 1.00 36.78 O ATOM 102 CB PRO A 682 25.698 -16.844 46.108 1.00 39.07 C ATOM 103 CG PRO A 682 25.355 -17.225 47.505 1.00 38.42 C ATOM 104 CD PRO A 682 23.990 -16.619 47.667 1.00 37.47 C ATOM 0 HA PRO A 682 25.962 -14.750 46.265 1.00 37.52 H new ATOM 0 HB2 PRO A 682 25.227 -17.392 45.461 1.00 39.07 H new ATOM 0 HB3 PRO A 682 26.646 -16.947 45.930 1.00 39.07 H new ATOM 0 HG2 PRO A 682 25.342 -18.187 47.626 1.00 38.42 H new ATOM 0 HG3 PRO A 682 25.990 -16.867 48.145 1.00 38.42 H new ATOM 0 HD2 PRO A 682 23.299 -17.165 47.259 1.00 37.47 H new ATOM 0 HD3 PRO A 682 23.750 -16.509 48.600 1.00 37.47 H new ATOM 105 N GLY A 683 25.848 -14.327 43.936 1.00 38.26 N ATOM 106 CA GLY A 683 25.628 -13.897 42.571 1.00 39.06 C ATOM 107 C GLY A 683 25.942 -14.991 41.566 1.00 39.70 C ATOM 108 O GLY A 683 26.006 -16.167 41.922 1.00 39.56 O ATOM 0 H GLY A 683 26.622 -14.130 44.255 1.00 38.26 H new ATOM 0 HA2 GLY A 683 24.704 -13.619 42.466 1.00 39.06 H new ATOM 0 HA3 GLY A 683 26.180 -13.121 42.385 1.00 39.06 H new ATOM 109 N VAL A 684 26.151 -14.596 40.314 1.00 38.81 N ATOM 110 CA VAL A 684 26.451 -15.525 39.233 1.00 40.58 C ATOM 111 C VAL A 684 27.826 -16.158 39.352 1.00 40.71 C ATOM 112 O VAL A 684 28.806 -15.488 39.667 1.00 41.71 O ATOM 113 CB VAL A 684 26.378 -14.821 37.869 1.00 41.58 C ATOM 114 CG1 VAL A 684 26.751 -15.795 36.764 1.00 43.19 C ATOM 115 CG2 VAL A 684 24.979 -14.262 37.650 1.00 41.69 C ATOM 0 H VAL A 684 26.122 -13.773 40.067 1.00 38.81 H new ATOM 0 HA VAL A 684 25.781 -16.223 39.302 1.00 40.58 H new ATOM 0 HB VAL A 684 27.008 -14.084 37.852 1.00 41.58 H new ATOM 0 HG11 VAL A 684 26.703 -15.345 35.906 1.00 43.19 H new ATOM 0 HG12 VAL A 684 27.654 -16.119 36.909 1.00 43.19 H new ATOM 0 HG13 VAL A 684 26.135 -16.544 36.771 1.00 43.19 H new ATOM 0 HG21 VAL A 684 24.939 -13.819 36.788 1.00 41.69 H new ATOM 0 HG22 VAL A 684 24.334 -14.986 37.671 1.00 41.69 H new ATOM 0 HG23 VAL A 684 24.772 -13.624 38.351 1.00 41.69 H new ATOM 116 N VAL A 685 27.888 -17.458 39.093 1.00 40.02 N ATOM 117 CA VAL A 685 29.142 -18.194 39.157 1.00 39.93 C ATOM 118 C VAL A 685 29.316 -18.968 37.858 1.00 40.03 C ATOM 119 O VAL A 685 28.453 -19.758 37.480 1.00 37.85 O ATOM 120 CB VAL A 685 29.145 -19.202 40.330 1.00 40.57 C ATOM 121 CG1 VAL A 685 30.516 -19.868 40.443 1.00 38.73 C ATOM 122 CG2 VAL A 685 28.760 -18.497 41.627 1.00 39.21 C ATOM 0 H VAL A 685 27.207 -17.936 38.876 1.00 40.02 H new ATOM 0 HA VAL A 685 29.864 -17.560 39.292 1.00 39.93 H new ATOM 0 HB VAL A 685 28.488 -19.895 40.161 1.00 40.57 H new ATOM 0 HG11 VAL A 685 30.510 -20.498 41.180 1.00 38.73 H new ATOM 0 HG12 VAL A 685 30.717 -20.338 39.618 1.00 38.73 H new ATOM 0 HG13 VAL A 685 31.193 -19.191 40.602 1.00 38.73 H new ATOM 0 HG21 VAL A 685 28.764 -19.136 42.357 1.00 39.21 H new ATOM 0 HG22 VAL A 685 29.398 -17.790 41.813 1.00 39.21 H new ATOM 0 HG23 VAL A 685 27.873 -18.116 41.537 1.00 39.21 H new ATOM 123 N CYS A 686 30.425 -18.740 37.167 1.00 39.09 N ATOM 124 CA CYS A 686 30.673 -19.451 35.924 1.00 39.19 C ATOM 125 C CYS A 686 31.486 -20.704 36.196 1.00 37.79 C ATOM 126 O CYS A 686 32.267 -20.760 37.151 1.00 37.73 O ATOM 127 CB CYS A 686 31.403 -18.554 34.920 1.00 41.80 C ATOM 128 SG CYS A 686 30.380 -17.216 34.255 1.00 49.35 S ATOM 0 H CYS A 686 31.039 -18.184 37.398 1.00 39.09 H new ATOM 0 HA CYS A 686 29.819 -19.704 35.540 1.00 39.19 H new ATOM 0 HB2 CYS A 686 32.183 -18.170 35.350 1.00 41.80 H new ATOM 0 HB3 CYS A 686 31.724 -19.100 34.185 1.00 41.80 H new ATOM 0 HG CYS A 686 31.026 -16.564 33.482 1.00 49.35 H new ATOM 129 N ALA A 687 31.286 -21.712 35.355 1.00 37.09 N ATOM 130 CA ALA A 687 31.982 -22.979 35.486 1.00 39.22 C ATOM 131 C ALA A 687 33.336 -22.945 34.783 1.00 40.90 C ATOM 132 O ALA A 687 34.232 -23.713 35.128 1.00 39.83 O ATOM 133 CB ALA A 687 31.124 -24.103 34.914 1.00 38.26 C ATOM 0 H ALA A 687 30.740 -21.678 34.691 1.00 37.09 H new ATOM 0 HA ALA A 687 32.140 -23.140 36.429 1.00 39.22 H new ATOM 0 HB1 ALA A 687 31.594 -24.947 35.004 1.00 38.26 H new ATOM 0 HB2 ALA A 687 30.284 -24.148 35.398 1.00 38.26 H new ATOM 0 HB3 ALA A 687 30.948 -23.930 33.976 1.00 38.26 H new ATOM 134 N GLY A 688 33.475 -22.054 33.799 1.00 42.17 N ATOM 135 CA GLY A 688 34.721 -21.945 33.055 1.00 42.79 C ATOM 136 C GLY A 688 34.815 -23.011 31.980 1.00 43.80 C ATOM 137 O GLY A 688 35.902 -23.348 31.510 1.00 43.65 O ATOM 0 H GLY A 688 32.859 -21.507 33.551 1.00 42.17 H new ATOM 0 HA2 GLY A 688 34.782 -21.066 32.649 1.00 42.79 H new ATOM 0 HA3 GLY A 688 35.472 -22.029 33.663 1.00 42.79 H new ATOM 138 N HIS A 689 33.663 -23.540 31.582 1.00 42.08 N ATOM 139 CA HIS A 689 33.594 -24.588 30.572 1.00 41.65 C ATOM 140 C HIS A 689 33.944 -24.109 29.163 1.00 43.59 C ATOM 141 O HIS A 689 33.511 -23.040 28.735 1.00 43.14 O ATOM 142 CB HIS A 689 32.187 -25.189 30.556 1.00 39.88 C ATOM 143 CG HIS A 689 32.026 -26.318 29.591 1.00 37.70 C ATOM 144 ND1 HIS A 689 32.606 -27.552 29.788 1.00 38.11 N ATOM 145 CD2 HIS A 689 31.359 -26.398 28.415 1.00 37.61 C ATOM 146 CE1 HIS A 689 32.301 -28.345 28.777 1.00 38.80 C ATOM 147 NE2 HIS A 689 31.546 -27.669 27.930 1.00 38.70 N ATOM 0 H HIS A 689 32.897 -23.300 31.891 1.00 42.08 H new ATOM 0 HA HIS A 689 34.259 -25.249 30.819 1.00 41.65 H new ATOM 0 HB2 HIS A 689 31.968 -25.502 31.447 1.00 39.88 H new ATOM 0 HB3 HIS A 689 31.549 -24.492 30.336 1.00 39.88 H new ATOM 0 HD2 HIS A 689 30.867 -25.720 28.012 1.00 37.61 H new ATOM 0 HE1 HIS A 689 32.572 -29.229 28.678 1.00 38.80 H new ATOM 0 HE2 HIS A 689 31.224 -27.975 27.194 1.00 38.70 H new ATOM 148 N ASP A 690 34.722 -24.915 28.445 1.00 44.66 N ATOM 149 CA ASP A 690 35.110 -24.596 27.075 1.00 46.46 C ATOM 150 C ASP A 690 33.985 -25.103 26.180 1.00 45.90 C ATOM 151 O ASP A 690 33.960 -26.276 25.801 1.00 44.16 O ATOM 152 CB ASP A 690 36.412 -25.313 26.707 1.00 47.84 C ATOM 153 CG ASP A 690 36.980 -24.850 25.377 1.00 49.52 C ATOM 154 OD1 ASP A 690 36.196 -24.433 24.497 1.00 49.49 O ATOM 155 OD2 ASP A 690 38.218 -24.915 25.210 1.00 52.64 O ATOM 0 H ASP A 690 35.038 -25.659 28.737 1.00 44.66 H new ATOM 0 HA ASP A 690 35.254 -23.642 26.971 1.00 46.46 H new ATOM 0 HB2 ASP A 690 37.068 -25.162 27.405 1.00 47.84 H new ATOM 0 HB3 ASP A 690 36.251 -26.269 26.671 1.00 47.84 H new ATOM 156 N ASN A 691 33.051 -24.225 25.846 1.00 46.99 N ATOM 157 CA ASN A 691 31.924 -24.623 25.018 1.00 49.33 C ATOM 158 C ASN A 691 32.315 -24.932 23.568 1.00 52.20 C ATOM 159 O ASN A 691 31.477 -25.349 22.764 1.00 50.95 O ATOM 160 CB ASN A 691 30.836 -23.545 25.090 1.00 48.16 C ATOM 161 CG ASN A 691 30.135 -23.509 26.453 1.00 49.64 C ATOM 162 OD1 ASN A 691 29.224 -24.300 26.722 1.00 46.58 O ATOM 163 ND2 ASN A 691 30.570 -22.601 27.320 1.00 47.84 N ATOM 0 H ASN A 691 33.050 -23.399 26.086 1.00 46.99 H new ATOM 0 HA ASN A 691 31.579 -25.457 25.372 1.00 49.33 H new ATOM 0 HB2 ASN A 691 31.232 -22.678 24.910 1.00 48.16 H new ATOM 0 HB3 ASN A 691 30.178 -23.706 24.395 1.00 48.16 H new ATOM 0 HD21 ASN A 691 30.215 -22.548 28.102 1.00 47.84 H new ATOM 0 HD22 ASN A 691 31.206 -22.066 27.099 1.00 47.84 H new ATOM 164 N ASN A 692 33.596 -24.751 23.247 1.00 54.86 N ATOM 165 CA ASN A 692 34.090 -25.023 21.899 1.00 58.83 C ATOM 166 C ASN A 692 34.405 -26.491 21.675 1.00 59.01 C ATOM 167 O ASN A 692 34.251 -26.996 20.565 1.00 59.81 O ATOM 168 CB ASN A 692 35.345 -24.198 21.599 1.00 61.78 C ATOM 169 CG ASN A 692 35.032 -22.745 21.334 1.00 64.95 C ATOM 170 OD1 ASN A 692 34.245 -22.420 20.441 1.00 67.17 O ATOM 171 ND2 ASN A 692 35.645 -21.856 22.108 1.00 66.58 N ATOM 0 H ASN A 692 34.195 -24.471 23.797 1.00 54.86 H new ATOM 0 HA ASN A 692 33.373 -24.771 21.296 1.00 58.83 H new ATOM 0 HB2 ASN A 692 35.958 -24.262 22.348 1.00 61.78 H new ATOM 0 HB3 ASN A 692 35.799 -24.574 20.829 1.00 61.78 H new ATOM 0 HD21 ASN A 692 35.499 -21.016 21.996 1.00 66.58 H new ATOM 0 HD22 ASN A 692 36.187 -22.121 22.721 1.00 66.58 H new ATOM 172 N GLN A 693 34.862 -27.179 22.714 1.00 58.98 N ATOM 173 CA GLN A 693 35.173 -28.590 22.551 1.00 59.83 C ATOM 174 C GLN A 693 33.919 -29.457 22.643 1.00 58.76 C ATOM 175 O GLN A 693 32.884 -29.024 23.152 1.00 57.62 O ATOM 176 CB GLN A 693 36.254 -29.036 23.550 1.00 60.82 C ATOM 177 CG GLN A 693 36.256 -28.336 24.896 1.00 63.54 C ATOM 178 CD GLN A 693 35.329 -28.983 25.904 1.00 65.00 C ATOM 179 OE1 GLN A 693 34.483 -29.894 25.434 1.00 66.00 O flip ATOM 180 NE2 GLN A 693 35.371 -28.663 27.095 1.00 63.85 N flip ATOM 0 H GLN A 693 34.996 -26.858 23.501 1.00 58.98 H new ATOM 0 HA GLN A 693 35.533 -28.712 21.659 1.00 59.83 H new ATOM 0 HB2 GLN A 693 36.153 -29.989 23.703 1.00 60.82 H new ATOM 0 HB3 GLN A 693 37.122 -28.905 23.138 1.00 60.82 H new ATOM 0 HG2 GLN A 693 37.159 -28.332 25.251 1.00 63.54 H new ATOM 0 HG3 GLN A 693 35.995 -27.410 24.773 1.00 63.54 H new ATOM 0 HE21 GLN A 693 35.933 -28.069 27.361 1.00 63.85 H new ATOM 0 HE22 GLN A 693 34.838 -29.034 27.659 1.00 63.85 H new ATOM 181 N PRO A 694 33.993 -30.688 22.118 1.00 58.15 N ATOM 182 CA PRO A 694 32.877 -31.638 22.117 1.00 56.30 C ATOM 183 C PRO A 694 32.301 -31.948 23.491 1.00 54.45 C ATOM 184 O PRO A 694 32.992 -31.855 24.508 1.00 54.66 O ATOM 185 CB PRO A 694 33.481 -32.878 21.463 1.00 57.96 C ATOM 186 CG PRO A 694 34.533 -32.306 20.555 1.00 58.13 C ATOM 187 CD PRO A 694 35.166 -31.265 21.435 1.00 57.96 C ATOM 0 HA PRO A 694 32.109 -31.275 21.648 1.00 56.30 H new ATOM 0 HB2 PRO A 694 33.863 -33.480 22.120 1.00 57.96 H new ATOM 0 HB3 PRO A 694 32.816 -33.383 20.969 1.00 57.96 H new ATOM 0 HG2 PRO A 694 35.172 -32.978 20.269 1.00 58.13 H new ATOM 0 HG3 PRO A 694 34.150 -31.919 19.752 1.00 58.13 H new ATOM 0 HD2 PRO A 694 35.796 -31.654 22.062 1.00 57.96 H new ATOM 0 HD3 PRO A 694 35.650 -30.600 20.921 1.00 57.96 H new ATOM 188 N ASP A 695 31.027 -32.321 23.509 1.00 51.36 N ATOM 189 CA ASP A 695 30.347 -32.674 24.747 1.00 49.79 C ATOM 190 C ASP A 695 30.717 -34.092 25.161 1.00 49.04 C ATOM 191 O ASP A 695 29.969 -35.034 24.908 1.00 51.29 O ATOM 192 CB ASP A 695 28.828 -32.597 24.578 1.00 48.55 C ATOM 193 CG ASP A 695 28.322 -31.180 24.492 1.00 48.43 C ATOM 194 OD1 ASP A 695 28.746 -30.344 25.315 1.00 48.91 O ATOM 195 OD2 ASP A 695 27.486 -30.905 23.611 1.00 49.59 O ATOM 0 H ASP A 695 30.534 -32.376 22.806 1.00 51.36 H new ATOM 0 HA ASP A 695 30.626 -32.043 25.428 1.00 49.79 H new ATOM 0 HB2 ASP A 695 28.571 -33.077 23.775 1.00 48.55 H new ATOM 0 HB3 ASP A 695 28.400 -33.044 25.325 1.00 48.55 H new ATOM 196 N SER A 696 31.872 -34.250 25.789 1.00 45.79 N ATOM 197 CA SER A 696 32.285 -35.567 26.231 1.00 43.88 C ATOM 198 C SER A 696 31.944 -35.711 27.707 1.00 41.83 C ATOM 199 O SER A 696 31.704 -34.721 28.395 1.00 41.53 O ATOM 200 CB SER A 696 33.789 -35.748 26.029 1.00 42.52 C ATOM 201 OG SER A 696 34.514 -34.801 26.789 1.00 45.09 O ATOM 0 H SER A 696 32.424 -33.615 25.967 1.00 45.79 H new ATOM 0 HA SER A 696 31.823 -36.244 25.712 1.00 43.88 H new ATOM 0 HB2 SER A 696 34.049 -36.646 26.289 1.00 42.52 H new ATOM 0 HB3 SER A 696 34.008 -35.651 25.089 1.00 42.52 H new ATOM 0 HG SER A 696 35.337 -34.915 26.668 1.00 45.09 H new ATOM 202 N PHE A 697 31.918 -36.949 28.183 1.00 39.44 N ATOM 203 CA PHE A 697 31.637 -37.226 29.581 1.00 37.96 C ATOM 204 C PHE A 697 32.733 -36.578 30.426 1.00 37.72 C ATOM 205 O PHE A 697 32.452 -35.874 31.397 1.00 35.75 O ATOM 206 CB PHE A 697 31.624 -38.740 29.815 1.00 37.10 C ATOM 207 CG PHE A 697 31.568 -39.131 31.266 1.00 38.32 C ATOM 208 CD1 PHE A 697 30.457 -38.814 32.044 1.00 38.78 C ATOM 209 CD2 PHE A 697 32.627 -39.815 31.854 1.00 38.32 C ATOM 210 CE1 PHE A 697 30.398 -39.173 33.387 1.00 40.42 C ATOM 211 CE2 PHE A 697 32.582 -40.180 33.198 1.00 40.22 C ATOM 212 CZ PHE A 697 31.462 -39.858 33.969 1.00 40.46 C ATOM 0 H PHE A 697 32.062 -37.649 27.705 1.00 39.44 H new ATOM 0 HA PHE A 697 30.770 -36.867 29.828 1.00 37.96 H new ATOM 0 HB2 PHE A 697 30.860 -39.123 29.356 1.00 37.10 H new ATOM 0 HB3 PHE A 697 32.418 -39.127 29.415 1.00 37.10 H new ATOM 0 HD1 PHE A 697 29.744 -38.356 31.660 1.00 38.78 H new ATOM 0 HD2 PHE A 697 33.374 -40.031 31.344 1.00 38.32 H new ATOM 0 HE1 PHE A 697 29.650 -38.956 33.895 1.00 40.42 H new ATOM 0 HE2 PHE A 697 33.296 -40.637 33.581 1.00 40.22 H new ATOM 0 HZ PHE A 697 31.427 -40.100 34.866 1.00 40.46 H new ATOM 213 N ALA A 698 33.986 -36.812 30.033 1.00 38.05 N ATOM 214 CA ALA A 698 35.142 -36.270 30.746 1.00 38.31 C ATOM 215 C ALA A 698 35.091 -34.750 30.891 1.00 36.98 C ATOM 216 O ALA A 698 35.281 -34.212 31.982 1.00 38.17 O ATOM 217 CB ALA A 698 36.417 -36.671 30.029 1.00 39.00 C ATOM 0 H ALA A 698 34.189 -37.289 29.347 1.00 38.05 H new ATOM 0 HA ALA A 698 35.125 -36.642 31.641 1.00 38.31 H new ATOM 0 HB1 ALA A 698 37.182 -36.311 30.503 1.00 39.00 H new ATOM 0 HB2 ALA A 698 36.481 -37.638 30.000 1.00 39.00 H new ATOM 0 HB3 ALA A 698 36.404 -36.321 29.124 1.00 39.00 H new ATOM 218 N ALA A 699 34.835 -34.067 29.783 1.00 35.99 N ATOM 219 CA ALA A 699 34.775 -32.614 29.770 1.00 35.80 C ATOM 220 C ALA A 699 33.592 -32.062 30.558 1.00 35.02 C ATOM 221 O ALA A 699 33.739 -31.127 31.338 1.00 32.98 O ATOM 222 CB ALA A 699 34.717 -32.122 28.337 1.00 36.26 C ATOM 0 H ALA A 699 34.691 -34.433 29.018 1.00 35.99 H new ATOM 0 HA ALA A 699 35.578 -32.289 30.206 1.00 35.80 H new ATOM 0 HB1 ALA A 699 34.677 -31.153 28.329 1.00 36.26 H new ATOM 0 HB2 ALA A 699 35.509 -32.417 27.861 1.00 36.26 H new ATOM 0 HB3 ALA A 699 33.927 -32.481 27.903 1.00 36.26 H new ATOM 223 N LEU A 700 32.416 -32.641 30.351 1.00 36.22 N ATOM 224 CA LEU A 700 31.225 -32.171 31.050 1.00 35.00 C ATOM 225 C LEU A 700 31.371 -32.339 32.556 1.00 32.72 C ATOM 226 O LEU A 700 31.131 -31.410 33.312 1.00 33.80 O ATOM 227 CB LEU A 700 29.984 -32.921 30.553 1.00 33.70 C ATOM 228 CG LEU A 700 29.472 -32.559 29.155 1.00 36.41 C ATOM 229 CD1 LEU A 700 28.278 -33.447 28.808 1.00 35.35 C ATOM 230 CD2 LEU A 700 29.069 -31.087 29.114 1.00 35.52 C ATOM 0 H LEU A 700 32.285 -33.301 29.816 1.00 36.22 H new ATOM 0 HA LEU A 700 31.120 -31.226 30.859 1.00 35.00 H new ATOM 0 HB2 LEU A 700 30.179 -33.871 30.567 1.00 33.70 H new ATOM 0 HB3 LEU A 700 29.265 -32.770 31.187 1.00 33.70 H new ATOM 0 HG LEU A 700 30.176 -32.704 28.503 1.00 36.41 H new ATOM 0 HD11 LEU A 700 27.952 -33.220 27.923 1.00 35.35 H new ATOM 0 HD12 LEU A 700 28.552 -34.378 28.822 1.00 35.35 H new ATOM 0 HD13 LEU A 700 27.572 -33.308 29.458 1.00 35.35 H new ATOM 0 HD21 LEU A 700 28.746 -30.864 28.227 1.00 35.52 H new ATOM 0 HD22 LEU A 700 28.367 -30.925 29.763 1.00 35.52 H new ATOM 0 HD23 LEU A 700 29.838 -30.535 29.326 1.00 35.52 H new ATOM 231 N LEU A 701 31.791 -33.520 32.991 1.00 34.10 N ATOM 232 CA LEU A 701 31.950 -33.770 34.417 1.00 33.22 C ATOM 233 C LEU A 701 33.110 -33.000 35.053 1.00 33.13 C ATOM 234 O LEU A 701 33.019 -32.572 36.204 1.00 31.36 O ATOM 235 CB LEU A 701 32.080 -35.276 34.667 1.00 31.43 C ATOM 236 CG LEU A 701 30.733 -35.988 34.880 1.00 31.74 C ATOM 237 CD1 LEU A 701 30.167 -35.561 36.219 1.00 29.92 C ATOM 238 CD2 LEU A 701 29.749 -35.664 33.753 1.00 29.21 C ATOM 0 H LEU A 701 31.988 -34.185 32.482 1.00 34.10 H new ATOM 0 HA LEU A 701 31.151 -33.434 34.853 1.00 33.22 H new ATOM 0 HB2 LEU A 701 32.536 -35.682 33.913 1.00 31.43 H new ATOM 0 HB3 LEU A 701 32.639 -35.419 35.447 1.00 31.43 H new ATOM 0 HG LEU A 701 30.874 -36.948 34.871 1.00 31.74 H new ATOM 0 HD11 LEU A 701 29.316 -36.003 36.367 1.00 29.92 H new ATOM 0 HD12 LEU A 701 30.785 -35.806 36.925 1.00 29.92 H new ATOM 0 HD13 LEU A 701 30.037 -34.600 36.224 1.00 29.92 H new ATOM 0 HD21 LEU A 701 28.911 -36.125 33.913 1.00 29.21 H new ATOM 0 HD22 LEU A 701 29.591 -34.707 33.726 1.00 29.21 H new ATOM 0 HD23 LEU A 701 30.121 -35.954 32.905 1.00 29.21 H new ATOM 239 N SER A 702 34.193 -32.802 34.310 1.00 34.25 N ATOM 240 CA SER A 702 35.315 -32.051 34.859 1.00 35.34 C ATOM 241 C SER A 702 34.877 -30.610 35.101 1.00 34.50 C ATOM 242 O SER A 702 35.253 -30.004 36.101 1.00 35.69 O ATOM 243 CB SER A 702 36.518 -32.095 33.910 1.00 36.09 C ATOM 244 OG SER A 702 37.062 -33.403 33.862 1.00 36.36 O ATOM 0 H SER A 702 34.298 -33.086 33.505 1.00 34.25 H new ATOM 0 HA SER A 702 35.588 -32.453 35.699 1.00 35.34 H new ATOM 0 HB2 SER A 702 36.246 -31.819 33.021 1.00 36.09 H new ATOM 0 HB3 SER A 702 37.195 -31.467 34.207 1.00 36.09 H new ATOM 0 HG SER A 702 36.643 -33.860 33.296 1.00 36.36 H new ATOM 245 N SER A 703 34.069 -30.066 34.196 1.00 35.15 N ATOM 246 CA SER A 703 33.586 -28.701 34.355 1.00 34.88 C ATOM 247 C SER A 703 32.568 -28.620 35.489 1.00 34.35 C ATOM 248 O SER A 703 32.529 -27.629 36.212 1.00 35.19 O ATOM 249 CB SER A 703 32.960 -28.182 33.056 1.00 35.29 C ATOM 250 OG SER A 703 33.956 -27.919 32.082 1.00 37.21 O ATOM 0 H SER A 703 33.791 -30.468 33.488 1.00 35.15 H new ATOM 0 HA SER A 703 34.348 -28.142 34.574 1.00 34.88 H new ATOM 0 HB2 SER A 703 32.331 -28.836 32.712 1.00 35.29 H new ATOM 0 HB3 SER A 703 32.457 -27.372 33.236 1.00 35.29 H new ATOM 0 HG SER A 703 33.616 -27.958 31.315 1.00 37.21 H new ATOM 251 N LEU A 704 31.741 -29.654 35.643 1.00 34.81 N ATOM 252 CA LEU A 704 30.749 -29.659 36.725 1.00 34.45 C ATOM 253 C LEU A 704 31.493 -29.700 38.064 1.00 34.58 C ATOM 254 O LEU A 704 31.055 -29.103 39.047 1.00 32.26 O ATOM 255 CB LEU A 704 29.804 -30.868 36.605 1.00 33.44 C ATOM 256 CG LEU A 704 28.642 -30.773 35.603 1.00 33.86 C ATOM 257 CD1 LEU A 704 27.877 -32.090 35.601 1.00 34.40 C ATOM 258 CD2 LEU A 704 27.705 -29.623 35.988 1.00 34.72 C ATOM 0 H LEU A 704 31.735 -30.353 35.142 1.00 34.81 H new ATOM 0 HA LEU A 704 30.206 -28.857 36.667 1.00 34.45 H new ATOM 0 HB2 LEU A 704 30.339 -31.642 36.369 1.00 33.44 H new ATOM 0 HB3 LEU A 704 29.428 -31.040 37.482 1.00 33.44 H new ATOM 0 HG LEU A 704 28.994 -30.600 34.716 1.00 33.86 H new ATOM 0 HD11 LEU A 704 27.142 -32.037 34.970 1.00 34.40 H new ATOM 0 HD12 LEU A 704 28.473 -32.810 35.342 1.00 34.40 H new ATOM 0 HD13 LEU A 704 27.528 -32.263 36.489 1.00 34.40 H new ATOM 0 HD21 LEU A 704 26.976 -29.572 35.350 1.00 34.72 H new ATOM 0 HD22 LEU A 704 27.347 -29.780 36.876 1.00 34.72 H new ATOM 0 HD23 LEU A 704 28.198 -28.788 35.982 1.00 34.72 H new ATOM 259 N ASN A 705 32.624 -30.404 38.094 1.00 33.78 N ATOM 260 CA ASN A 705 33.426 -30.485 39.310 1.00 34.33 C ATOM 261 C ASN A 705 34.020 -29.131 39.638 1.00 32.05 C ATOM 262 O ASN A 705 34.016 -28.713 40.796 1.00 32.60 O ATOM 263 CB ASN A 705 34.547 -31.525 39.172 1.00 34.41 C ATOM 264 CG ASN A 705 34.021 -32.942 39.230 1.00 38.16 C ATOM 265 OD1 ASN A 705 32.946 -33.187 39.784 1.00 34.89 O ATOM 266 ND2 ASN A 705 34.779 -33.889 38.678 1.00 36.69 N ATOM 0 H ASN A 705 32.942 -30.839 37.424 1.00 33.78 H new ATOM 0 HA ASN A 705 32.841 -30.763 40.032 1.00 34.33 H new ATOM 0 HB2 ASN A 705 35.011 -31.388 38.331 1.00 34.41 H new ATOM 0 HB3 ASN A 705 35.197 -31.394 39.880 1.00 34.41 H new ATOM 0 HD21 ASN A 705 34.524 -34.710 38.699 1.00 36.69 H new ATOM 0 HD22 ASN A 705 35.523 -33.679 38.301 1.00 36.69 H new ATOM 267 N GLU A 706 34.528 -28.439 38.620 1.00 34.28 N ATOM 268 CA GLU A 706 35.107 -27.113 38.836 1.00 32.87 C ATOM 269 C GLU A 706 34.030 -26.149 39.318 1.00 31.93 C ATOM 270 O GLU A 706 34.268 -25.332 40.204 1.00 32.13 O ATOM 271 CB GLU A 706 35.737 -26.587 37.546 1.00 34.05 C ATOM 272 CG GLU A 706 36.319 -25.170 37.634 1.00 36.09 C ATOM 273 CD GLU A 706 37.368 -25.016 38.734 1.00 38.04 C ATOM 274 OE1 GLU A 706 38.061 -26.006 39.049 1.00 39.27 O ATOM 275 OE2 GLU A 706 37.507 -23.899 39.272 1.00 40.02 O ATOM 0 H GLU A 706 34.548 -28.715 37.806 1.00 34.28 H new ATOM 0 HA GLU A 706 35.799 -27.183 39.512 1.00 32.87 H new ATOM 0 HB2 GLU A 706 36.443 -27.195 37.276 1.00 34.05 H new ATOM 0 HB3 GLU A 706 35.066 -26.603 36.845 1.00 34.05 H new ATOM 0 HG2 GLU A 706 36.717 -24.937 36.781 1.00 36.09 H new ATOM 0 HG3 GLU A 706 35.598 -24.540 37.792 1.00 36.09 H new ATOM 276 N LEU A 707 32.839 -26.237 38.731 1.00 32.12 N ATOM 277 CA LEU A 707 31.740 -25.364 39.144 1.00 30.20 C ATOM 278 C LEU A 707 31.459 -25.601 40.621 1.00 29.17 C ATOM 279 O LEU A 707 31.274 -24.661 41.393 1.00 31.79 O ATOM 280 CB LEU A 707 30.476 -25.666 38.336 1.00 30.02 C ATOM 281 CG LEU A 707 29.258 -24.829 38.734 1.00 29.56 C ATOM 282 CD1 LEU A 707 29.574 -23.344 38.547 1.00 28.82 C ATOM 283 CD2 LEU A 707 28.057 -25.240 37.876 1.00 29.83 C ATOM 0 H LEU A 707 32.647 -26.788 38.099 1.00 32.12 H new ATOM 0 HA LEU A 707 31.992 -24.440 38.988 1.00 30.20 H new ATOM 0 HB2 LEU A 707 30.663 -25.519 37.396 1.00 30.02 H new ATOM 0 HB3 LEU A 707 30.257 -26.605 38.438 1.00 30.02 H new ATOM 0 HG LEU A 707 29.042 -24.983 39.667 1.00 29.56 H new ATOM 0 HD11 LEU A 707 28.802 -22.814 38.799 1.00 28.82 H new ATOM 0 HD12 LEU A 707 30.329 -23.101 39.105 1.00 28.82 H new ATOM 0 HD13 LEU A 707 29.792 -23.174 37.617 1.00 28.82 H new ATOM 0 HD21 LEU A 707 27.284 -24.711 38.127 1.00 29.83 H new ATOM 0 HD22 LEU A 707 28.261 -25.090 36.940 1.00 29.83 H new ATOM 0 HD23 LEU A 707 27.864 -26.180 38.018 1.00 29.83 H new ATOM 284 N GLY A 708 31.422 -26.868 41.011 1.00 30.83 N ATOM 285 CA GLY A 708 31.175 -27.193 42.402 1.00 31.60 C ATOM 286 C GLY A 708 32.225 -26.564 43.300 1.00 33.20 C ATOM 287 O GLY A 708 31.900 -25.968 44.325 1.00 32.50 O ATOM 0 H GLY A 708 31.536 -27.544 40.492 1.00 30.83 H new ATOM 0 HA2 GLY A 708 30.294 -26.880 42.660 1.00 31.60 H new ATOM 0 HA3 GLY A 708 31.179 -28.156 42.519 1.00 31.60 H new ATOM 288 N GLU A 709 33.493 -26.695 42.918 1.00 33.90 N ATOM 289 CA GLU A 709 34.584 -26.129 43.709 1.00 33.48 C ATOM 290 C GLU A 709 34.346 -24.627 43.868 1.00 32.63 C ATOM 291 O GLU A 709 34.463 -24.078 44.961 1.00 32.69 O ATOM 292 CB GLU A 709 35.931 -26.378 43.009 1.00 35.85 C ATOM 293 CG GLU A 709 37.170 -25.908 43.793 1.00 39.60 C ATOM 294 CD GLU A 709 37.653 -26.933 44.812 1.00 42.57 C ATOM 295 OE1 GLU A 709 38.724 -26.719 45.430 1.00 42.48 O ATOM 296 OE2 GLU A 709 36.965 -27.961 44.993 1.00 44.83 O ATOM 0 H GLU A 709 33.743 -27.107 42.206 1.00 33.90 H new ATOM 0 HA GLU A 709 34.610 -26.553 44.581 1.00 33.48 H new ATOM 0 HB2 GLU A 709 36.018 -27.328 42.833 1.00 35.85 H new ATOM 0 HB3 GLU A 709 35.920 -25.930 42.149 1.00 35.85 H new ATOM 0 HG2 GLU A 709 37.888 -25.716 43.169 1.00 39.60 H new ATOM 0 HG3 GLU A 709 36.962 -25.078 44.250 1.00 39.60 H new ATOM 297 N ARG A 710 33.989 -23.969 42.772 1.00 32.30 N ATOM 298 CA ARG A 710 33.736 -22.537 42.802 1.00 33.43 C ATOM 299 C ARG A 710 32.519 -22.167 43.649 1.00 34.12 C ATOM 300 O ARG A 710 32.564 -21.217 44.431 1.00 33.83 O ATOM 301 CB ARG A 710 33.568 -22.014 41.377 1.00 33.68 C ATOM 302 CG ARG A 710 34.825 -22.193 40.538 1.00 36.63 C ATOM 303 CD ARG A 710 34.656 -21.588 39.170 1.00 38.69 C ATOM 304 NE ARG A 710 35.851 -21.745 38.348 1.00 36.90 N ATOM 305 CZ ARG A 710 35.997 -21.186 37.154 1.00 37.93 C ATOM 306 NH1 ARG A 710 35.016 -20.434 36.657 1.00 32.27 N ATOM 307 NH2 ARG A 710 37.116 -21.382 36.460 1.00 36.67 N ATOM 0 H ARG A 710 33.888 -24.335 42.000 1.00 32.30 H new ATOM 0 HA ARG A 710 34.504 -22.118 43.221 1.00 33.43 H new ATOM 0 HB2 ARG A 710 32.830 -22.477 40.951 1.00 33.68 H new ATOM 0 HB3 ARG A 710 33.334 -21.073 41.407 1.00 33.68 H new ATOM 0 HG2 ARG A 710 35.578 -21.779 40.987 1.00 36.63 H new ATOM 0 HG3 ARG A 710 35.029 -23.138 40.454 1.00 36.63 H new ATOM 0 HD2 ARG A 710 33.902 -22.005 38.725 1.00 38.69 H new ATOM 0 HD3 ARG A 710 34.448 -20.645 39.258 1.00 38.69 H new ATOM 0 HE ARG A 710 36.495 -22.226 38.654 1.00 36.90 H new ATOM 0 HH11 ARG A 710 34.295 -20.314 37.110 1.00 32.27 H new ATOM 0 HH12 ARG A 710 35.104 -20.069 35.883 1.00 32.27 H new ATOM 0 HH21 ARG A 710 37.744 -21.871 36.786 1.00 36.67 H new ATOM 0 HH22 ARG A 710 37.211 -21.020 35.686 1.00 36.67 H new ATOM 308 N GLN A 711 31.432 -22.916 43.499 1.00 33.15 N ATOM 309 CA GLN A 711 30.238 -22.630 44.271 1.00 33.12 C ATOM 310 C GLN A 711 30.466 -22.935 45.738 1.00 33.05 C ATOM 311 O GLN A 711 29.870 -22.308 46.605 1.00 32.74 O ATOM 312 CB GLN A 711 29.045 -23.426 43.734 1.00 32.59 C ATOM 313 CG GLN A 711 28.624 -22.971 42.340 1.00 33.53 C ATOM 314 CD GLN A 711 27.219 -23.396 41.975 1.00 35.69 C ATOM 315 OE1 GLN A 711 26.529 -24.024 42.917 1.00 38.85 O flip ATOM 316 NE2 GLN A 711 26.756 -23.160 40.855 1.00 30.90 N flip ATOM 0 H GLN A 711 31.368 -23.585 42.962 1.00 33.15 H new ATOM 0 HA GLN A 711 30.038 -21.685 44.184 1.00 33.12 H new ATOM 0 HB2 GLN A 711 29.273 -24.369 43.709 1.00 32.59 H new ATOM 0 HB3 GLN A 711 28.296 -23.331 44.343 1.00 32.59 H new ATOM 0 HG2 GLN A 711 28.687 -22.004 42.289 1.00 33.53 H new ATOM 0 HG3 GLN A 711 29.245 -23.331 41.687 1.00 33.53 H new ATOM 0 HE21 GLN A 711 27.234 -22.750 40.270 1.00 30.90 H new ATOM 0 HE22 GLN A 711 25.955 -23.406 40.660 1.00 30.90 H new ATOM 317 N LEU A 712 31.344 -23.892 46.019 1.00 34.28 N ATOM 318 CA LEU A 712 31.636 -24.238 47.401 1.00 35.55 C ATOM 319 C LEU A 712 32.123 -22.985 48.132 1.00 34.53 C ATOM 320 O LEU A 712 31.739 -22.726 49.266 1.00 32.15 O ATOM 321 CB LEU A 712 32.707 -25.332 47.453 1.00 38.71 C ATOM 322 CG LEU A 712 32.771 -26.146 48.747 1.00 45.05 C ATOM 323 CD1 LEU A 712 31.405 -26.790 49.016 1.00 44.35 C ATOM 324 CD2 LEU A 712 33.855 -27.223 48.631 1.00 45.93 C ATOM 0 H LEU A 712 31.776 -24.347 45.431 1.00 34.28 H new ATOM 0 HA LEU A 712 30.834 -24.574 47.832 1.00 35.55 H new ATOM 0 HB2 LEU A 712 32.556 -25.943 46.715 1.00 38.71 H new ATOM 0 HB3 LEU A 712 33.573 -24.920 47.308 1.00 38.71 H new ATOM 0 HG LEU A 712 32.994 -25.560 49.487 1.00 45.05 H new ATOM 0 HD11 LEU A 712 31.446 -27.306 49.836 1.00 44.35 H new ATOM 0 HD12 LEU A 712 30.732 -26.097 49.104 1.00 44.35 H new ATOM 0 HD13 LEU A 712 31.172 -27.375 48.278 1.00 44.35 H new ATOM 0 HD21 LEU A 712 33.891 -27.736 49.454 1.00 45.93 H new ATOM 0 HD22 LEU A 712 33.646 -27.814 47.891 1.00 45.93 H new ATOM 0 HD23 LEU A 712 34.715 -26.802 48.475 1.00 45.93 H new ATOM 325 N VAL A 713 32.966 -22.201 47.466 1.00 35.72 N ATOM 326 CA VAL A 713 33.492 -20.974 48.068 1.00 35.40 C ATOM 327 C VAL A 713 32.360 -20.018 48.453 1.00 34.25 C ATOM 328 O VAL A 713 32.357 -19.455 49.542 1.00 34.12 O ATOM 329 CB VAL A 713 34.459 -20.262 47.105 1.00 34.93 C ATOM 330 CG1 VAL A 713 34.809 -18.882 47.644 1.00 38.84 C ATOM 331 CG2 VAL A 713 35.733 -21.105 46.932 1.00 36.41 C ATOM 0 H VAL A 713 33.246 -22.359 46.668 1.00 35.72 H new ATOM 0 HA VAL A 713 33.973 -21.229 48.871 1.00 35.40 H new ATOM 0 HB VAL A 713 34.030 -20.158 46.241 1.00 34.93 H new ATOM 0 HG11 VAL A 713 35.418 -18.440 47.032 1.00 38.84 H new ATOM 0 HG12 VAL A 713 34.000 -18.354 47.732 1.00 38.84 H new ATOM 0 HG13 VAL A 713 35.232 -18.971 48.512 1.00 38.84 H new ATOM 0 HG21 VAL A 713 36.340 -20.654 46.325 1.00 36.41 H new ATOM 0 HG22 VAL A 713 36.164 -21.220 47.793 1.00 36.41 H new ATOM 0 HG23 VAL A 713 35.500 -21.974 46.569 1.00 36.41 H new ATOM 332 N HIS A 714 31.403 -19.845 47.551 1.00 34.18 N ATOM 333 CA HIS A 714 30.265 -18.967 47.797 1.00 35.07 C ATOM 334 C HIS A 714 29.331 -19.509 48.869 1.00 33.28 C ATOM 335 O HIS A 714 28.762 -18.742 49.640 1.00 35.13 O ATOM 336 CB HIS A 714 29.493 -18.740 46.496 1.00 37.31 C ATOM 337 CG HIS A 714 30.234 -17.909 45.495 1.00 41.28 C ATOM 338 ND1 HIS A 714 30.328 -16.536 45.591 1.00 42.57 N ATOM 339 CD2 HIS A 714 30.922 -18.256 44.381 1.00 42.74 C ATOM 340 CE1 HIS A 714 31.039 -16.074 44.579 1.00 44.14 C ATOM 341 NE2 HIS A 714 31.412 -17.097 43.829 1.00 43.35 N ATOM 0 H HIS A 714 31.393 -20.231 46.782 1.00 34.18 H new ATOM 0 HA HIS A 714 30.617 -18.124 48.124 1.00 35.07 H new ATOM 0 HB2 HIS A 714 29.283 -19.600 46.099 1.00 37.31 H new ATOM 0 HB3 HIS A 714 28.649 -18.309 46.701 1.00 37.31 H new ATOM 0 HD2 HIS A 714 31.041 -19.118 44.051 1.00 42.74 H new ATOM 0 HE1 HIS A 714 31.243 -15.181 44.421 1.00 44.14 H new ATOM 0 HE2 HIS A 714 31.884 -17.045 43.112 1.00 43.35 H new ATOM 342 N VAL A 715 29.163 -20.828 48.924 1.00 32.33 N ATOM 343 CA VAL A 715 28.298 -21.422 49.941 1.00 31.55 C ATOM 344 C VAL A 715 28.886 -21.186 51.328 1.00 30.65 C ATOM 345 O VAL A 715 28.160 -20.876 52.271 1.00 27.42 O ATOM 346 CB VAL A 715 28.104 -22.947 49.715 1.00 32.23 C ATOM 347 CG1 VAL A 715 27.384 -23.570 50.904 1.00 33.43 C ATOM 348 CG2 VAL A 715 27.288 -23.178 48.452 1.00 33.16 C ATOM 0 H VAL A 715 29.535 -21.390 48.390 1.00 32.33 H new ATOM 0 HA VAL A 715 27.430 -20.994 49.872 1.00 31.55 H new ATOM 0 HB VAL A 715 28.976 -23.362 49.621 1.00 32.23 H new ATOM 0 HG11 VAL A 715 27.269 -24.521 50.751 1.00 33.43 H new ATOM 0 HG12 VAL A 715 27.909 -23.433 51.708 1.00 33.43 H new ATOM 0 HG13 VAL A 715 26.515 -23.153 51.011 1.00 33.43 H new ATOM 0 HG21 VAL A 715 27.169 -24.131 48.313 1.00 33.16 H new ATOM 0 HG22 VAL A 715 26.421 -22.754 48.545 1.00 33.16 H new ATOM 0 HG23 VAL A 715 27.754 -22.797 47.691 1.00 33.16 H new ATOM 349 N VAL A 716 30.203 -21.332 51.461 1.00 31.19 N ATOM 350 CA VAL A 716 30.829 -21.103 52.757 1.00 30.14 C ATOM 351 C VAL A 716 30.653 -19.650 53.224 1.00 30.56 C ATOM 352 O VAL A 716 30.296 -19.405 54.376 1.00 32.07 O ATOM 353 CB VAL A 716 32.345 -21.444 52.737 1.00 29.02 C ATOM 354 CG1 VAL A 716 33.013 -20.856 53.955 1.00 31.74 C ATOM 355 CG2 VAL A 716 32.547 -22.956 52.754 1.00 31.82 C ATOM 0 H VAL A 716 30.740 -21.558 50.828 1.00 31.19 H new ATOM 0 HA VAL A 716 30.380 -21.696 53.380 1.00 30.14 H new ATOM 0 HB VAL A 716 32.734 -21.073 51.929 1.00 29.02 H new ATOM 0 HG11 VAL A 716 33.959 -21.070 53.941 1.00 31.74 H new ATOM 0 HG12 VAL A 716 32.900 -19.893 53.953 1.00 31.74 H new ATOM 0 HG13 VAL A 716 32.610 -21.227 54.756 1.00 31.74 H new ATOM 0 HG21 VAL A 716 33.496 -23.156 52.741 1.00 31.82 H new ATOM 0 HG22 VAL A 716 32.150 -23.327 53.557 1.00 31.82 H new ATOM 0 HG23 VAL A 716 32.124 -23.348 51.974 1.00 31.82 H new ATOM 356 N LYS A 717 30.909 -18.690 52.343 1.00 31.03 N ATOM 357 CA LYS A 717 30.767 -17.280 52.712 1.00 32.19 C ATOM 358 C LYS A 717 29.309 -16.931 53.009 1.00 32.55 C ATOM 359 O LYS A 717 29.011 -16.157 53.927 1.00 28.72 O ATOM 360 CB LYS A 717 31.311 -16.391 51.592 1.00 34.54 C ATOM 361 CG LYS A 717 32.823 -16.484 51.427 1.00 38.28 C ATOM 362 CD LYS A 717 33.297 -15.747 50.183 1.00 40.96 C ATOM 363 CE LYS A 717 34.814 -15.789 50.066 1.00 44.79 C ATOM 364 NZ LYS A 717 35.296 -15.150 48.803 1.00 46.80 N ATOM 0 H LYS A 717 31.164 -18.828 51.533 1.00 31.03 H new ATOM 0 HA LYS A 717 31.280 -17.123 53.520 1.00 32.19 H new ATOM 0 HB2 LYS A 717 30.885 -16.638 50.756 1.00 34.54 H new ATOM 0 HB3 LYS A 717 31.068 -15.469 51.773 1.00 34.54 H new ATOM 0 HG2 LYS A 717 33.258 -16.112 52.210 1.00 38.28 H new ATOM 0 HG3 LYS A 717 33.087 -17.416 51.372 1.00 38.28 H new ATOM 0 HD2 LYS A 717 32.898 -16.147 49.395 1.00 40.96 H new ATOM 0 HD3 LYS A 717 32.998 -14.825 50.216 1.00 40.96 H new ATOM 0 HE2 LYS A 717 35.209 -15.337 50.828 1.00 44.79 H new ATOM 0 HE3 LYS A 717 35.115 -16.711 50.096 1.00 44.79 H new ATOM 0 HZ1 LYS A 717 36.184 -15.193 48.769 1.00 46.80 H new ATOM 0 HZ2 LYS A 717 34.951 -15.578 48.103 1.00 46.80 H new ATOM 0 HZ3 LYS A 717 35.040 -14.298 48.784 1.00 46.80 H new ATOM 365 N TRP A 718 28.404 -17.505 52.222 1.00 32.61 N ATOM 366 CA TRP A 718 26.969 -17.291 52.401 1.00 31.77 C ATOM 367 C TRP A 718 26.524 -17.795 53.779 1.00 31.37 C ATOM 368 O TRP A 718 25.910 -17.060 54.554 1.00 31.98 O ATOM 369 CB TRP A 718 26.198 -18.040 51.299 1.00 32.12 C ATOM 370 CG TRP A 718 24.706 -18.164 51.535 1.00 32.29 C ATOM 371 CD1 TRP A 718 23.763 -17.197 51.348 1.00 29.89 C ATOM 372 CD2 TRP A 718 23.997 -19.337 51.977 1.00 32.34 C ATOM 373 NE1 TRP A 718 22.511 -17.690 51.638 1.00 30.50 N ATOM 374 CE2 TRP A 718 22.623 -19.001 52.025 1.00 31.78 C ATOM 375 CE3 TRP A 718 24.390 -20.637 52.334 1.00 30.58 C ATOM 376 CZ2 TRP A 718 21.633 -19.921 52.414 1.00 27.55 C ATOM 377 CZ3 TRP A 718 23.404 -21.556 52.721 1.00 30.50 C ATOM 378 CH2 TRP A 718 22.040 -21.186 52.756 1.00 31.45 C ATOM 0 H TRP A 718 28.603 -18.029 51.570 1.00 32.61 H new ATOM 0 HA TRP A 718 26.781 -16.341 52.341 1.00 31.77 H new ATOM 0 HB2 TRP A 718 26.342 -17.584 50.455 1.00 32.12 H new ATOM 0 HB3 TRP A 718 26.573 -18.930 51.208 1.00 32.12 H new ATOM 0 HD1 TRP A 718 23.940 -16.329 51.065 1.00 29.89 H new ATOM 0 HE1 TRP A 718 21.776 -17.247 51.585 1.00 30.50 H new ATOM 0 HE3 TRP A 718 25.286 -20.884 52.314 1.00 30.58 H new ATOM 0 HZ2 TRP A 718 20.735 -19.681 52.439 1.00 27.55 H new ATOM 0 HZ3 TRP A 718 23.651 -22.421 52.958 1.00 30.50 H new ATOM 0 HH2 TRP A 718 21.405 -21.813 53.016 1.00 31.45 H new ATOM 379 N ALA A 719 26.849 -19.051 54.083 1.00 33.91 N ATOM 380 CA ALA A 719 26.470 -19.676 55.352 1.00 33.47 C ATOM 381 C ALA A 719 26.958 -18.925 56.582 1.00 35.57 C ATOM 382 O ALA A 719 26.197 -18.714 57.526 1.00 32.70 O ATOM 383 CB ALA A 719 26.978 -21.125 55.401 1.00 32.82 C ATOM 0 H ALA A 719 27.296 -19.566 53.559 1.00 33.91 H new ATOM 0 HA ALA A 719 25.501 -19.652 55.380 1.00 33.47 H new ATOM 0 HB1 ALA A 719 26.722 -21.529 56.245 1.00 32.82 H new ATOM 0 HB2 ALA A 719 26.589 -21.630 54.670 1.00 32.82 H new ATOM 0 HB3 ALA A 719 27.945 -21.132 55.320 1.00 32.82 H new ATOM 384 N LYS A 720 28.232 -18.538 56.576 1.00 35.86 N ATOM 385 CA LYS A 720 28.813 -17.817 57.703 1.00 37.19 C ATOM 386 C LYS A 720 28.116 -16.487 57.979 1.00 36.41 C ATOM 387 O LYS A 720 28.156 -15.984 59.099 1.00 38.59 O ATOM 388 CB LYS A 720 30.305 -17.571 57.462 1.00 39.13 C ATOM 389 CG LYS A 720 31.209 -18.747 57.786 1.00 40.95 C ATOM 390 CD LYS A 720 32.630 -18.469 57.318 1.00 48.56 C ATOM 391 CE LYS A 720 33.633 -19.482 57.875 1.00 51.81 C ATOM 392 NZ LYS A 720 34.284 -19.012 59.136 1.00 57.37 N ATOM 0 H LYS A 720 28.777 -18.684 55.927 1.00 35.86 H new ATOM 0 HA LYS A 720 28.688 -18.378 58.485 1.00 37.19 H new ATOM 0 HB2 LYS A 720 30.433 -17.329 56.532 1.00 39.13 H new ATOM 0 HB3 LYS A 720 30.584 -16.810 57.994 1.00 39.13 H new ATOM 0 HG2 LYS A 720 31.204 -18.913 58.742 1.00 40.95 H new ATOM 0 HG3 LYS A 720 30.872 -19.549 57.357 1.00 40.95 H new ATOM 0 HD2 LYS A 720 32.659 -18.488 56.349 1.00 48.56 H new ATOM 0 HD3 LYS A 720 32.890 -17.575 57.592 1.00 48.56 H new ATOM 0 HE2 LYS A 720 33.179 -20.323 58.043 1.00 51.81 H new ATOM 0 HE3 LYS A 720 34.315 -19.657 57.208 1.00 51.81 H new ATOM 0 HZ1 LYS A 720 35.164 -19.128 59.077 1.00 57.37 H new ATOM 0 HZ2 LYS A 720 34.107 -18.148 59.258 1.00 57.37 H new ATOM 0 HZ3 LYS A 720 33.969 -19.479 59.825 1.00 57.37 H new ATOM 393 N ALA A 721 27.462 -15.928 56.965 1.00 35.02 N ATOM 394 CA ALA A 721 26.771 -14.650 57.102 1.00 32.48 C ATOM 395 C ALA A 721 25.285 -14.800 57.448 1.00 33.89 C ATOM 396 O ALA A 721 24.568 -13.804 57.554 1.00 31.73 O ATOM 397 CB ALA A 721 26.923 -13.847 55.819 1.00 31.73 C ATOM 0 H ALA A 721 27.406 -16.277 56.181 1.00 35.02 H new ATOM 0 HA ALA A 721 27.185 -14.184 57.846 1.00 32.48 H new ATOM 0 HB1 ALA A 721 26.463 -12.998 55.912 1.00 31.73 H new ATOM 0 HB2 ALA A 721 27.864 -13.687 55.647 1.00 31.73 H new ATOM 0 HB3 ALA A 721 26.539 -14.343 55.079 1.00 31.73 H new ATOM 398 N LEU A 722 24.827 -16.040 57.614 1.00 33.49 N ATOM 399 CA LEU A 722 23.432 -16.301 57.956 1.00 34.64 C ATOM 400 C LEU A 722 23.145 -15.989 59.418 1.00 35.25 C ATOM 401 O LEU A 722 24.005 -16.172 60.285 1.00 34.23 O ATOM 402 CB LEU A 722 23.086 -17.764 57.698 1.00 33.82 C ATOM 403 CG LEU A 722 22.817 -18.201 56.259 1.00 34.97 C ATOM 404 CD1 LEU A 722 22.810 -19.720 56.201 1.00 32.80 C ATOM 405 CD2 LEU A 722 21.481 -17.628 55.785 1.00 34.04 C ATOM 0 H LEU A 722 25.311 -16.746 57.532 1.00 33.49 H new ATOM 0 HA LEU A 722 22.890 -15.723 57.397 1.00 34.64 H new ATOM 0 HB2 LEU A 722 23.814 -18.305 58.040 1.00 33.82 H new ATOM 0 HB3 LEU A 722 22.300 -17.980 58.225 1.00 33.82 H new ATOM 0 HG LEU A 722 23.512 -17.866 55.671 1.00 34.97 H new ATOM 0 HD11 LEU A 722 22.640 -20.008 55.291 1.00 32.80 H new ATOM 0 HD12 LEU A 722 23.671 -20.059 56.492 1.00 32.80 H new ATOM 0 HD13 LEU A 722 22.115 -20.063 56.784 1.00 32.80 H new ATOM 0 HD21 LEU A 722 21.315 -17.908 54.871 1.00 34.04 H new ATOM 0 HD22 LEU A 722 20.768 -17.953 56.357 1.00 34.04 H new ATOM 0 HD23 LEU A 722 21.512 -16.659 55.825 1.00 34.04 H new ATOM 406 N PRO A 723 21.927 -15.508 59.713 1.00 34.99 N ATOM 407 CA PRO A 723 21.582 -15.193 61.102 1.00 35.82 C ATOM 408 C PRO A 723 21.794 -16.388 62.042 1.00 37.72 C ATOM 409 O PRO A 723 21.288 -17.489 61.795 1.00 36.42 O ATOM 410 CB PRO A 723 20.115 -14.782 61.006 1.00 34.81 C ATOM 411 CG PRO A 723 20.050 -14.129 59.658 1.00 33.19 C ATOM 412 CD PRO A 723 20.868 -15.062 58.788 1.00 33.87 C ATOM 0 HA PRO A 723 22.144 -14.500 61.483 1.00 35.82 H new ATOM 0 HB2 PRO A 723 19.521 -15.546 61.066 1.00 34.81 H new ATOM 0 HB3 PRO A 723 19.864 -14.171 61.716 1.00 34.81 H new ATOM 0 HG2 PRO A 723 19.137 -14.050 59.341 1.00 33.19 H new ATOM 0 HG3 PRO A 723 20.423 -13.234 59.674 1.00 33.19 H new ATOM 0 HD2 PRO A 723 20.339 -15.805 58.458 1.00 33.87 H new ATOM 0 HD3 PRO A 723 21.233 -14.607 58.013 1.00 33.87 H new ATOM 413 N GLY A 724 22.563 -16.162 63.105 1.00 37.24 N ATOM 414 CA GLY A 724 22.823 -17.202 64.087 1.00 37.71 C ATOM 415 C GLY A 724 23.793 -18.329 63.754 1.00 38.36 C ATOM 416 O GLY A 724 24.141 -19.106 64.638 1.00 40.22 O ATOM 0 H GLY A 724 22.943 -15.409 63.273 1.00 37.24 H new ATOM 0 HA2 GLY A 724 23.149 -16.767 64.890 1.00 37.71 H new ATOM 0 HA3 GLY A 724 21.971 -17.609 64.310 1.00 37.71 H new ATOM 417 N PHE A 725 24.247 -18.428 62.507 1.00 38.47 N ATOM 418 CA PHE A 725 25.156 -19.515 62.129 1.00 39.11 C ATOM 419 C PHE A 725 26.449 -19.566 62.942 1.00 40.99 C ATOM 420 O PHE A 725 26.936 -20.649 63.283 1.00 38.87 O ATOM 421 CB PHE A 725 25.516 -19.426 60.647 1.00 37.80 C ATOM 422 CG PHE A 725 26.304 -20.608 60.140 1.00 37.70 C ATOM 423 CD1 PHE A 725 25.667 -21.809 59.840 1.00 37.59 C ATOM 424 CD2 PHE A 725 27.682 -20.513 59.942 1.00 37.08 C ATOM 425 CE1 PHE A 725 26.388 -22.894 59.345 1.00 38.05 C ATOM 426 CE2 PHE A 725 28.412 -21.591 59.450 1.00 36.22 C ATOM 427 CZ PHE A 725 27.767 -22.784 59.149 1.00 37.04 C ATOM 0 H PHE A 725 24.046 -17.886 61.871 1.00 38.47 H new ATOM 0 HA PHE A 725 24.665 -20.329 62.321 1.00 39.11 H new ATOM 0 HB2 PHE A 725 24.700 -19.346 60.129 1.00 37.80 H new ATOM 0 HB3 PHE A 725 26.029 -18.617 60.495 1.00 37.80 H new ATOM 0 HD1 PHE A 725 24.750 -21.888 59.971 1.00 37.59 H new ATOM 0 HD2 PHE A 725 28.119 -19.717 60.142 1.00 37.08 H new ATOM 0 HE1 PHE A 725 25.952 -23.691 59.145 1.00 38.05 H new ATOM 0 HE2 PHE A 725 29.330 -21.513 59.323 1.00 36.22 H new ATOM 0 HZ PHE A 725 28.251 -23.506 58.819 1.00 37.04 H new ATOM 428 N ARG A 726 27.011 -18.401 63.243 1.00 43.30 N ATOM 429 CA ARG A 726 28.251 -18.355 64.006 1.00 47.40 C ATOM 430 C ARG A 726 28.096 -18.817 65.453 1.00 48.44 C ATOM 431 O ARG A 726 29.087 -18.986 66.163 1.00 50.27 O ATOM 432 CB ARG A 726 28.860 -16.952 63.951 1.00 49.03 C ATOM 433 CG ARG A 726 29.526 -16.637 62.617 1.00 51.29 C ATOM 434 CD ARG A 726 30.258 -15.308 62.676 1.00 56.85 C ATOM 435 NE ARG A 726 31.118 -15.095 61.514 1.00 60.29 N ATOM 436 CZ ARG A 726 32.162 -15.857 61.200 1.00 61.45 C ATOM 437 NH1 ARG A 726 32.484 -16.896 61.960 1.00 63.16 N ATOM 438 NH2 ARG A 726 32.892 -15.576 60.128 1.00 61.57 N ATOM 0 H ARG A 726 26.694 -17.634 63.018 1.00 43.30 H new ATOM 0 HA ARG A 726 28.854 -18.988 63.585 1.00 47.40 H new ATOM 0 HB2 ARG A 726 28.165 -16.297 64.121 1.00 49.03 H new ATOM 0 HB3 ARG A 726 29.514 -16.862 64.661 1.00 49.03 H new ATOM 0 HG2 ARG A 726 30.150 -17.344 62.388 1.00 51.29 H new ATOM 0 HG3 ARG A 726 28.857 -16.611 61.915 1.00 51.29 H new ATOM 0 HD2 ARG A 726 29.611 -14.587 62.733 1.00 56.85 H new ATOM 0 HD3 ARG A 726 30.794 -15.272 63.483 1.00 56.85 H new ATOM 0 HE ARG A 726 30.937 -14.431 60.998 1.00 60.29 H new ATOM 0 HH11 ARG A 726 32.017 -17.079 62.659 1.00 63.16 H new ATOM 0 HH12 ARG A 726 33.160 -17.387 61.754 1.00 63.16 H new ATOM 0 HH21 ARG A 726 32.690 -14.901 59.635 1.00 61.57 H new ATOM 0 HH22 ARG A 726 33.567 -16.069 59.926 1.00 61.57 H new ATOM 439 N ASN A 727 26.861 -19.031 65.896 1.00 48.60 N ATOM 440 CA ASN A 727 26.658 -19.511 67.252 1.00 49.11 C ATOM 441 C ASN A 727 26.990 -21.001 67.314 1.00 48.80 C ATOM 442 O ASN A 727 27.227 -21.540 68.392 1.00 49.64 O ATOM 443 CB ASN A 727 25.219 -19.290 67.716 1.00 51.53 C ATOM 444 CG ASN A 727 24.925 -17.844 68.046 1.00 55.02 C ATOM 445 OD1 ASN A 727 25.710 -17.181 68.728 1.00 57.15 O ATOM 446 ND2 ASN A 727 23.779 -17.347 67.578 1.00 55.40 N ATOM 0 H ASN A 727 26.144 -18.907 65.438 1.00 48.60 H new ATOM 0 HA ASN A 727 27.243 -19.010 67.842 1.00 49.11 H new ATOM 0 HB2 ASN A 727 24.610 -19.589 67.022 1.00 51.53 H new ATOM 0 HB3 ASN A 727 25.048 -19.837 68.499 1.00 51.53 H new ATOM 0 HD21 ASN A 727 23.562 -16.533 67.749 1.00 55.40 H new ATOM 0 HD22 ASN A 727 23.257 -17.841 67.105 1.00 55.40 H new ATOM 447 N LEU A 728 27.004 -21.662 66.160 1.00 45.85 N ATOM 448 CA LEU A 728 27.327 -23.084 66.102 1.00 44.95 C ATOM 449 C LEU A 728 28.814 -23.285 66.351 1.00 45.70 C ATOM 450 O LEU A 728 29.630 -22.436 65.993 1.00 43.93 O ATOM 451 CB LEU A 728 26.993 -23.666 64.722 1.00 43.18 C ATOM 452 CG LEU A 728 25.547 -23.671 64.220 1.00 42.48 C ATOM 453 CD1 LEU A 728 25.516 -24.160 62.781 1.00 42.29 C ATOM 454 CD2 LEU A 728 24.697 -24.567 65.099 1.00 43.96 C ATOM 0 H LEU A 728 26.829 -21.304 65.398 1.00 45.85 H new ATOM 0 HA LEU A 728 26.802 -23.536 66.781 1.00 44.95 H new ATOM 0 HB2 LEU A 728 27.523 -23.182 64.069 1.00 43.18 H new ATOM 0 HB3 LEU A 728 27.304 -24.585 64.714 1.00 43.18 H new ATOM 0 HG LEU A 728 25.187 -22.771 64.258 1.00 42.48 H new ATOM 0 HD11 LEU A 728 24.601 -24.164 62.460 1.00 42.29 H new ATOM 0 HD12 LEU A 728 26.050 -23.569 62.227 1.00 42.29 H new ATOM 0 HD13 LEU A 728 25.878 -25.059 62.737 1.00 42.29 H new ATOM 0 HD21 LEU A 728 23.783 -24.565 64.775 1.00 43.96 H new ATOM 0 HD22 LEU A 728 25.047 -25.471 65.074 1.00 43.96 H new ATOM 0 HD23 LEU A 728 24.717 -24.239 66.011 1.00 43.96 H new ATOM 455 N HIS A 729 29.166 -24.416 66.955 1.00 47.83 N ATOM 456 CA HIS A 729 30.569 -24.720 67.199 1.00 48.64 C ATOM 457 C HIS A 729 31.257 -24.771 65.837 1.00 49.01 C ATOM 458 O HIS A 729 30.721 -25.345 64.887 1.00 48.22 O ATOM 459 CB HIS A 729 30.707 -26.072 67.904 1.00 51.61 C ATOM 460 CG HIS A 729 32.127 -26.473 68.165 1.00 53.07 C ATOM 461 ND1 HIS A 729 33.180 -26.621 67.328 1.00 56.19 N flip ATOM 462 CD2 HIS A 729 32.600 -26.761 69.428 1.00 53.81 C flip ATOM 463 CE1 HIS A 729 34.260 -26.989 68.093 1.00 55.82 C flip ATOM 464 NE2 HIS A 729 33.884 -27.067 69.356 1.00 55.89 N flip ATOM 0 H HIS A 729 28.613 -25.015 67.229 1.00 47.83 H new ATOM 0 HA HIS A 729 30.971 -24.046 67.769 1.00 48.64 H new ATOM 0 HB2 HIS A 729 30.229 -26.038 68.747 1.00 51.61 H new ATOM 0 HB3 HIS A 729 30.281 -26.755 67.363 1.00 51.61 H new ATOM 0 HD2 HIS A 729 32.095 -26.743 70.208 1.00 53.81 H new ATOM 0 HE1 HIS A 729 35.117 -27.156 67.773 1.00 55.82 H new ATOM 0 HE2 HIS A 729 34.388 -27.281 70.019 1.00 55.89 H new ATOM 465 N VAL A 730 32.442 -24.176 65.749 1.00 47.68 N ATOM 466 CA VAL A 730 33.196 -24.132 64.503 1.00 47.75 C ATOM 467 C VAL A 730 33.237 -25.461 63.750 1.00 48.11 C ATOM 468 O VAL A 730 33.185 -25.483 62.515 1.00 46.75 O ATOM 469 CB VAL A 730 34.645 -23.660 64.753 1.00 49.47 C ATOM 470 CG1 VAL A 730 35.380 -24.665 65.642 1.00 48.06 C ATOM 471 CG2 VAL A 730 35.366 -23.474 63.427 1.00 47.63 C ATOM 0 H VAL A 730 32.831 -23.787 66.410 1.00 47.68 H new ATOM 0 HA VAL A 730 32.719 -23.499 63.944 1.00 47.75 H new ATOM 0 HB VAL A 730 34.628 -22.806 65.213 1.00 49.47 H new ATOM 0 HG11 VAL A 730 36.288 -24.360 65.793 1.00 48.06 H new ATOM 0 HG12 VAL A 730 34.920 -24.742 66.492 1.00 48.06 H new ATOM 0 HG13 VAL A 730 35.399 -25.531 65.205 1.00 48.06 H new ATOM 0 HG21 VAL A 730 36.275 -23.178 63.591 1.00 47.63 H new ATOM 0 HG22 VAL A 730 35.383 -24.317 62.947 1.00 47.63 H new ATOM 0 HG23 VAL A 730 34.901 -22.809 62.896 1.00 47.63 H new ATOM 472 N ASP A 731 33.335 -26.565 64.488 1.00 47.72 N ATOM 473 CA ASP A 731 33.377 -27.887 63.871 1.00 46.82 C ATOM 474 C ASP A 731 32.006 -28.285 63.325 1.00 44.54 C ATOM 475 O ASP A 731 31.918 -29.012 62.344 1.00 42.30 O ATOM 476 CB ASP A 731 33.864 -28.939 64.872 1.00 50.33 C ATOM 477 CG ASP A 731 35.337 -28.767 65.236 1.00 53.62 C ATOM 478 OD1 ASP A 731 36.158 -28.507 64.327 1.00 54.31 O ATOM 479 OD2 ASP A 731 35.678 -28.906 66.429 1.00 55.62 O ATOM 0 H ASP A 731 33.378 -26.569 65.347 1.00 47.72 H new ATOM 0 HA ASP A 731 34.003 -27.844 63.131 1.00 46.82 H new ATOM 0 HB2 ASP A 731 33.327 -28.886 65.678 1.00 50.33 H new ATOM 0 HB3 ASP A 731 33.728 -29.824 64.498 1.00 50.33 H new ATOM 480 N ASP A 732 30.940 -27.816 63.965 1.00 43.32 N ATOM 481 CA ASP A 732 29.592 -28.118 63.494 1.00 42.86 C ATOM 482 C ASP A 732 29.311 -27.274 62.258 1.00 42.61 C ATOM 483 O ASP A 732 28.604 -27.705 61.341 1.00 42.73 O ATOM 484 CB ASP A 732 28.547 -27.816 64.568 1.00 42.76 C ATOM 485 CG ASP A 732 28.571 -28.815 65.700 1.00 42.71 C ATOM 486 OD1 ASP A 732 29.039 -29.950 65.477 1.00 44.25 O ATOM 487 OD2 ASP A 732 28.096 -28.480 66.802 1.00 42.74 O ATOM 0 H ASP A 732 30.974 -27.324 64.670 1.00 43.32 H new ATOM 0 HA ASP A 732 29.537 -29.063 63.283 1.00 42.86 H new ATOM 0 HB2 ASP A 732 28.701 -26.927 64.923 1.00 42.76 H new ATOM 0 HB3 ASP A 732 27.665 -27.811 64.164 1.00 42.76 H new ATOM 488 N GLN A 733 29.863 -26.064 62.252 1.00 40.65 N ATOM 489 CA GLN A 733 29.708 -25.159 61.126 1.00 40.06 C ATOM 490 C GLN A 733 30.277 -25.836 59.880 1.00 40.19 C ATOM 491 O GLN A 733 29.633 -25.849 58.832 1.00 38.14 O ATOM 492 CB GLN A 733 30.444 -23.838 61.389 1.00 38.66 C ATOM 493 CG GLN A 733 29.757 -22.871 62.336 1.00 40.72 C ATOM 494 CD GLN A 733 30.594 -21.615 62.545 1.00 42.18 C ATOM 495 OE1 GLN A 733 31.190 -21.097 61.602 1.00 43.68 O ATOM 496 NE2 GLN A 733 30.631 -21.117 63.771 1.00 42.55 N ATOM 0 H GLN A 733 30.335 -25.749 62.898 1.00 40.65 H new ATOM 0 HA GLN A 733 28.768 -24.958 60.998 1.00 40.06 H new ATOM 0 HB2 GLN A 733 31.322 -24.043 61.746 1.00 38.66 H new ATOM 0 HB3 GLN A 733 30.580 -23.390 60.540 1.00 38.66 H new ATOM 0 HG2 GLN A 733 28.888 -22.628 61.980 1.00 40.72 H new ATOM 0 HG3 GLN A 733 29.602 -23.305 63.189 1.00 40.72 H new ATOM 0 HE21 GLN A 733 30.202 -21.506 64.406 1.00 42.55 H new ATOM 0 HE22 GLN A 733 31.084 -20.404 63.932 1.00 42.55 H new ATOM 497 N MET A 734 31.479 -26.401 60.000 1.00 37.87 N ATOM 498 CA MET A 734 32.101 -27.082 58.872 1.00 38.76 C ATOM 499 C MET A 734 31.318 -28.325 58.488 1.00 36.76 C ATOM 500 O MET A 734 31.189 -28.652 57.310 1.00 34.70 O ATOM 501 CB MET A 734 33.539 -27.499 59.202 1.00 41.29 C ATOM 502 CG MET A 734 34.578 -26.397 59.046 1.00 47.66 C ATOM 503 SD MET A 734 36.256 -26.941 59.504 1.00 51.29 S ATOM 504 CE MET A 734 36.512 -28.231 58.348 1.00 47.47 C ATOM 0 H MET A 734 31.946 -26.400 60.722 1.00 37.87 H new ATOM 0 HA MET A 734 32.106 -26.455 58.132 1.00 38.76 H new ATOM 0 HB2 MET A 734 33.566 -27.824 60.116 1.00 41.29 H new ATOM 0 HB3 MET A 734 33.786 -28.242 58.629 1.00 41.29 H new ATOM 0 HG2 MET A 734 34.582 -26.089 58.126 1.00 47.66 H new ATOM 0 HG3 MET A 734 34.326 -25.640 59.597 1.00 47.66 H new ATOM 0 HE1 MET A 734 36.572 -29.078 58.816 1.00 47.47 H new ATOM 0 HE2 MET A 734 35.770 -28.259 57.724 1.00 47.47 H new ATOM 0 HE3 MET A 734 37.336 -28.071 57.862 1.00 47.47 H new ATOM 505 N ALA A 735 30.808 -29.022 59.493 1.00 35.84 N ATOM 506 CA ALA A 735 30.060 -30.241 59.254 1.00 36.72 C ATOM 507 C ALA A 735 28.770 -30.032 58.448 1.00 34.02 C ATOM 508 O ALA A 735 28.588 -30.675 57.422 1.00 32.08 O ATOM 509 CB ALA A 735 29.758 -30.931 60.585 1.00 36.14 C ATOM 0 H ALA A 735 30.885 -28.804 60.321 1.00 35.84 H new ATOM 0 HA ALA A 735 30.623 -30.808 58.704 1.00 36.72 H new ATOM 0 HB1 ALA A 735 29.258 -31.746 60.421 1.00 36.14 H new ATOM 0 HB2 ALA A 735 30.590 -31.148 61.033 1.00 36.14 H new ATOM 0 HB3 ALA A 735 29.234 -30.338 61.146 1.00 36.14 H new ATOM 510 N VAL A 736 27.878 -29.149 58.896 1.00 34.00 N ATOM 511 CA VAL A 736 26.630 -28.939 58.156 1.00 35.67 C ATOM 512 C VAL A 736 26.845 -28.483 56.723 1.00 33.97 C ATOM 513 O VAL A 736 26.075 -28.846 55.828 1.00 33.94 O ATOM 514 CB VAL A 736 25.691 -27.939 58.869 1.00 35.73 C ATOM 515 CG1 VAL A 736 25.370 -28.461 60.252 1.00 36.26 C ATOM 516 CG2 VAL A 736 26.319 -26.558 58.935 1.00 36.64 C ATOM 0 H VAL A 736 27.970 -28.673 59.606 1.00 34.00 H new ATOM 0 HA VAL A 736 26.211 -29.813 58.131 1.00 35.67 H new ATOM 0 HB VAL A 736 24.867 -27.855 58.363 1.00 35.73 H new ATOM 0 HG11 VAL A 736 24.781 -27.837 60.705 1.00 36.26 H new ATOM 0 HG12 VAL A 736 24.933 -29.324 60.179 1.00 36.26 H new ATOM 0 HG13 VAL A 736 26.191 -28.557 60.760 1.00 36.26 H new ATOM 0 HG21 VAL A 736 25.714 -25.948 59.385 1.00 36.64 H new ATOM 0 HG22 VAL A 736 27.154 -26.605 59.426 1.00 36.64 H new ATOM 0 HG23 VAL A 736 26.491 -26.237 58.036 1.00 36.64 H new ATOM 517 N ILE A 737 27.889 -27.690 56.498 1.00 32.82 N ATOM 518 CA ILE A 737 28.193 -27.227 55.151 1.00 31.10 C ATOM 519 C ILE A 737 28.689 -28.405 54.306 1.00 32.36 C ATOM 520 O ILE A 737 28.298 -28.565 53.144 1.00 32.33 O ATOM 521 CB ILE A 737 29.271 -26.118 55.170 1.00 30.86 C ATOM 522 CG1 ILE A 737 28.702 -24.841 55.795 1.00 31.59 C ATOM 523 CG2 ILE A 737 29.766 -25.857 53.764 1.00 32.30 C ATOM 524 CD1 ILE A 737 29.727 -23.764 56.040 1.00 32.83 C ATOM 0 H ILE A 737 28.429 -27.411 57.107 1.00 32.82 H new ATOM 0 HA ILE A 737 27.383 -26.858 54.766 1.00 31.10 H new ATOM 0 HB ILE A 737 30.022 -26.411 55.710 1.00 30.86 H new ATOM 0 HG12 ILE A 737 28.010 -24.489 55.213 1.00 31.59 H new ATOM 0 HG13 ILE A 737 28.277 -25.067 56.637 1.00 31.59 H new ATOM 0 HG21 ILE A 737 30.441 -25.161 53.782 1.00 32.30 H new ATOM 0 HG22 ILE A 737 30.150 -26.670 53.400 1.00 32.30 H new ATOM 0 HG23 ILE A 737 29.024 -25.573 53.207 1.00 32.30 H new ATOM 0 HD11 ILE A 737 29.296 -22.990 56.435 1.00 32.83 H new ATOM 0 HD12 ILE A 737 30.409 -24.097 56.644 1.00 32.83 H new ATOM 0 HD13 ILE A 737 30.138 -23.510 55.199 1.00 32.83 H new ATOM 525 N GLN A 738 29.544 -29.237 54.893 1.00 32.99 N ATOM 526 CA GLN A 738 30.095 -30.390 54.192 1.00 33.12 C ATOM 527 C GLN A 738 29.048 -31.443 53.822 1.00 32.40 C ATOM 528 O GLN A 738 29.205 -32.157 52.836 1.00 32.70 O ATOM 529 CB GLN A 738 31.196 -31.036 55.041 1.00 35.04 C ATOM 530 CG GLN A 738 32.543 -30.328 54.938 1.00 38.67 C ATOM 531 CD GLN A 738 33.525 -30.755 56.026 1.00 41.54 C ATOM 532 OE1 GLN A 738 33.001 -31.249 57.142 1.00 45.56 O flip ATOM 533 NE2 GLN A 738 34.739 -30.622 55.866 1.00 39.71 N flip ATOM 0 H GLN A 738 29.819 -29.150 55.703 1.00 32.99 H new ATOM 0 HA GLN A 738 30.457 -30.055 53.357 1.00 33.12 H new ATOM 0 HB2 GLN A 738 30.914 -31.045 55.969 1.00 35.04 H new ATOM 0 HB3 GLN A 738 31.304 -31.961 54.768 1.00 35.04 H new ATOM 0 HG2 GLN A 738 32.932 -30.509 54.068 1.00 38.67 H new ATOM 0 HG3 GLN A 738 32.404 -29.370 54.992 1.00 38.67 H new ATOM 0 HE21 GLN A 738 35.043 -30.298 55.129 1.00 39.71 H new ATOM 0 HE22 GLN A 738 35.283 -30.853 56.491 1.00 39.71 H new ATOM 534 N TYR A 739 27.987 -31.542 54.612 1.00 31.01 N ATOM 535 CA TYR A 739 26.941 -32.522 54.340 1.00 33.11 C ATOM 536 C TYR A 739 25.824 -32.003 53.445 1.00 33.11 C ATOM 537 O TYR A 739 25.286 -32.744 52.621 1.00 33.44 O ATOM 538 CB TYR A 739 26.305 -33.019 55.645 1.00 34.49 C ATOM 539 CG TYR A 739 27.272 -33.619 56.634 1.00 37.36 C ATOM 540 CD1 TYR A 739 28.329 -34.422 56.208 1.00 39.84 C ATOM 541 CD2 TYR A 739 27.127 -33.391 57.999 1.00 40.42 C ATOM 542 CE1 TYR A 739 29.223 -34.978 57.119 1.00 42.99 C ATOM 543 CE2 TYR A 739 28.015 -33.947 58.922 1.00 43.22 C ATOM 544 CZ TYR A 739 29.059 -34.734 58.473 1.00 43.94 C ATOM 545 OH TYR A 739 29.947 -35.265 59.377 1.00 50.64 O ATOM 0 H TYR A 739 27.852 -31.055 55.308 1.00 31.01 H new ATOM 0 HA TYR A 739 27.392 -33.242 53.871 1.00 33.11 H new ATOM 0 HB2 TYR A 739 25.847 -32.277 56.070 1.00 34.49 H new ATOM 0 HB3 TYR A 739 25.631 -33.682 55.429 1.00 34.49 H new ATOM 0 HD1 TYR A 739 28.439 -34.589 55.300 1.00 39.84 H new ATOM 0 HD2 TYR A 739 26.427 -32.859 58.302 1.00 40.42 H new ATOM 0 HE1 TYR A 739 29.925 -35.510 56.821 1.00 42.99 H new ATOM 0 HE2 TYR A 739 27.905 -33.789 59.832 1.00 43.22 H new ATOM 0 HH TYR A 739 29.726 -35.036 60.154 1.00 50.64 H new ATOM 546 N SER A 740 25.494 -30.725 53.591 1.00 31.75 N ATOM 547 CA SER A 740 24.390 -30.144 52.842 1.00 33.29 C ATOM 548 C SER A 740 24.680 -29.417 51.537 1.00 32.88 C ATOM 549 O SER A 740 23.744 -29.026 50.845 1.00 30.19 O ATOM 550 CB SER A 740 23.610 -29.200 53.756 1.00 31.77 C ATOM 551 OG SER A 740 24.385 -28.043 54.022 1.00 39.56 O ATOM 0 H SER A 740 25.897 -30.178 54.119 1.00 31.75 H new ATOM 0 HA SER A 740 23.896 -30.928 52.555 1.00 33.29 H new ATOM 0 HB2 SER A 740 22.772 -28.949 53.337 1.00 31.77 H new ATOM 0 HB3 SER A 740 23.389 -29.650 54.587 1.00 31.77 H new ATOM 0 HG SER A 740 25.022 -28.243 54.532 1.00 39.56 H new ATOM 552 N TRP A 741 25.944 -29.246 51.169 1.00 29.59 N ATOM 553 CA TRP A 741 26.226 -28.511 49.944 1.00 29.46 C ATOM 554 C TRP A 741 25.557 -29.037 48.682 1.00 28.69 C ATOM 555 O TRP A 741 25.101 -28.246 47.862 1.00 29.70 O ATOM 556 CB TRP A 741 27.731 -28.406 49.684 1.00 29.52 C ATOM 557 CG TRP A 741 28.415 -29.712 49.487 1.00 29.56 C ATOM 558 CD1 TRP A 741 28.976 -30.490 50.449 1.00 30.50 C ATOM 559 CD2 TRP A 741 28.672 -30.369 48.237 1.00 32.49 C ATOM 560 NE1 TRP A 741 29.578 -31.587 49.883 1.00 34.33 N ATOM 561 CE2 TRP A 741 29.406 -31.538 48.525 1.00 33.20 C ATOM 562 CE3 TRP A 741 28.357 -30.079 46.902 1.00 30.28 C ATOM 563 CZ2 TRP A 741 29.833 -32.421 47.529 1.00 34.08 C ATOM 564 CZ3 TRP A 741 28.783 -30.957 45.907 1.00 33.83 C ATOM 565 CH2 TRP A 741 29.514 -32.114 46.228 1.00 35.48 C ATOM 0 H TRP A 741 26.631 -29.536 51.597 1.00 29.59 H new ATOM 0 HA TRP A 741 25.836 -27.640 50.120 1.00 29.46 H new ATOM 0 HB2 TRP A 741 27.874 -27.857 48.897 1.00 29.52 H new ATOM 0 HB3 TRP A 741 28.145 -27.946 50.431 1.00 29.52 H new ATOM 0 HD1 TRP A 741 28.955 -30.306 51.360 1.00 30.50 H new ATOM 0 HE1 TRP A 741 29.995 -32.205 50.312 1.00 34.33 H new ATOM 0 HE3 TRP A 741 27.873 -29.315 46.685 1.00 30.28 H new ATOM 0 HZ2 TRP A 741 30.315 -33.188 47.739 1.00 34.08 H new ATOM 0 HZ3 TRP A 741 28.581 -30.775 45.018 1.00 33.83 H new ATOM 0 HH2 TRP A 741 29.787 -32.684 45.546 1.00 35.48 H new ATOM 566 N MET A 742 25.502 -30.354 48.516 1.00 28.03 N ATOM 567 CA MET A 742 24.895 -30.923 47.318 1.00 28.87 C ATOM 568 C MET A 742 23.452 -30.449 47.158 1.00 27.98 C ATOM 569 O MET A 742 23.079 -29.934 46.104 1.00 28.30 O ATOM 570 CB MET A 742 24.916 -32.452 47.360 1.00 29.36 C ATOM 571 CG MET A 742 24.383 -33.100 46.090 1.00 28.67 C ATOM 572 SD MET A 742 25.489 -32.909 44.657 1.00 34.99 S ATOM 573 CE MET A 742 26.644 -34.247 44.971 1.00 28.31 C ATOM 0 H MET A 742 25.806 -30.930 49.078 1.00 28.03 H new ATOM 0 HA MET A 742 25.419 -30.619 46.561 1.00 28.87 H new ATOM 0 HB2 MET A 742 25.826 -32.752 47.511 1.00 29.36 H new ATOM 0 HB3 MET A 742 24.389 -32.755 48.116 1.00 29.36 H new ATOM 0 HG2 MET A 742 24.238 -34.045 46.254 1.00 28.67 H new ATOM 0 HG3 MET A 742 23.519 -32.714 45.876 1.00 28.67 H new ATOM 0 HE1 MET A 742 27.149 -34.435 44.164 1.00 28.31 H new ATOM 0 HE2 MET A 742 27.253 -33.989 45.680 1.00 28.31 H new ATOM 0 HE3 MET A 742 26.155 -35.041 45.238 1.00 28.31 H new ATOM 574 N GLY A 743 22.655 -30.640 48.206 1.00 27.27 N ATOM 575 CA GLY A 743 21.264 -30.220 48.181 1.00 28.98 C ATOM 576 C GLY A 743 21.122 -28.722 47.992 1.00 29.89 C ATOM 577 O GLY A 743 20.261 -28.264 47.239 1.00 29.55 O ATOM 0 H GLY A 743 22.904 -31.012 48.941 1.00 27.27 H new ATOM 0 HA2 GLY A 743 20.802 -30.680 47.463 1.00 28.98 H new ATOM 0 HA3 GLY A 743 20.834 -30.482 49.010 1.00 28.98 H new ATOM 578 N LEU A 744 21.969 -27.949 48.671 1.00 29.03 N ATOM 579 CA LEU A 744 21.919 -26.494 48.555 1.00 30.67 C ATOM 580 C LEU A 744 22.147 -26.051 47.122 1.00 30.37 C ATOM 581 O LEU A 744 21.398 -25.223 46.601 1.00 31.42 O ATOM 582 CB LEU A 744 22.968 -25.830 49.463 1.00 28.84 C ATOM 583 CG LEU A 744 22.651 -25.807 50.959 1.00 30.83 C ATOM 584 CD1 LEU A 744 23.890 -25.413 51.749 1.00 28.47 C ATOM 585 CD2 LEU A 744 21.492 -24.836 51.222 1.00 26.71 C ATOM 0 H LEU A 744 22.577 -28.247 49.202 1.00 29.03 H new ATOM 0 HA LEU A 744 21.033 -26.215 48.836 1.00 30.67 H new ATOM 0 HB2 LEU A 744 23.813 -26.289 49.338 1.00 28.84 H new ATOM 0 HB3 LEU A 744 23.094 -24.916 49.164 1.00 28.84 H new ATOM 0 HG LEU A 744 22.382 -26.692 51.249 1.00 30.83 H new ATOM 0 HD11 LEU A 744 23.680 -25.401 52.696 1.00 28.47 H new ATOM 0 HD12 LEU A 744 24.598 -26.056 51.583 1.00 28.47 H new ATOM 0 HD13 LEU A 744 24.184 -24.531 51.472 1.00 28.47 H new ATOM 0 HD21 LEU A 744 21.291 -24.821 52.171 1.00 26.71 H new ATOM 0 HD22 LEU A 744 21.743 -23.945 50.931 1.00 26.71 H new ATOM 0 HD23 LEU A 744 20.708 -25.127 50.730 1.00 26.71 H new ATOM 586 N MET A 745 23.179 -26.607 46.488 1.00 28.25 N ATOM 587 CA MET A 745 23.519 -26.263 45.117 1.00 28.14 C ATOM 588 C MET A 745 22.484 -26.740 44.092 1.00 28.63 C ATOM 589 O MET A 745 22.204 -26.041 43.129 1.00 29.13 O ATOM 590 CB MET A 745 24.900 -26.833 44.751 1.00 25.84 C ATOM 591 CG MET A 745 26.056 -26.228 45.548 1.00 27.02 C ATOM 592 SD MET A 745 27.664 -26.885 45.020 1.00 29.90 S ATOM 593 CE MET A 745 28.768 -26.125 46.288 1.00 28.66 C ATOM 0 H MET A 745 23.698 -27.193 46.844 1.00 28.25 H new ATOM 0 HA MET A 745 23.531 -25.294 45.079 1.00 28.14 H new ATOM 0 HB2 MET A 745 24.891 -27.793 44.891 1.00 25.84 H new ATOM 0 HB3 MET A 745 25.060 -26.686 43.806 1.00 25.84 H new ATOM 0 HG2 MET A 745 26.051 -25.264 45.442 1.00 27.02 H new ATOM 0 HG3 MET A 745 25.927 -26.410 46.492 1.00 27.02 H new ATOM 0 HE1 MET A 745 29.660 -26.023 45.921 1.00 28.66 H new ATOM 0 HE2 MET A 745 28.421 -25.255 46.540 1.00 28.66 H new ATOM 0 HE3 MET A 745 28.804 -26.697 47.070 1.00 28.66 H new ATOM 594 N VAL A 746 21.931 -27.931 44.287 1.00 29.10 N ATOM 595 CA VAL A 746 20.930 -28.442 43.357 1.00 30.47 C ATOM 596 C VAL A 746 19.663 -27.576 43.424 1.00 30.43 C ATOM 597 O VAL A 746 19.088 -27.238 42.393 1.00 30.24 O ATOM 598 CB VAL A 746 20.568 -29.927 43.677 1.00 31.94 C ATOM 599 CG1 VAL A 746 19.299 -30.346 42.928 1.00 31.96 C ATOM 600 CG2 VAL A 746 21.720 -30.835 43.276 1.00 27.56 C ATOM 0 H VAL A 746 22.118 -28.454 44.943 1.00 29.10 H new ATOM 0 HA VAL A 746 21.304 -28.405 42.463 1.00 30.47 H new ATOM 0 HB VAL A 746 20.408 -30.007 44.630 1.00 31.94 H new ATOM 0 HG11 VAL A 746 19.089 -31.269 43.138 1.00 31.96 H new ATOM 0 HG12 VAL A 746 18.561 -29.778 43.198 1.00 31.96 H new ATOM 0 HG13 VAL A 746 19.442 -30.257 41.973 1.00 31.96 H new ATOM 0 HG21 VAL A 746 21.491 -31.756 43.476 1.00 27.56 H new ATOM 0 HG22 VAL A 746 21.888 -30.744 42.325 1.00 27.56 H new ATOM 0 HG23 VAL A 746 22.516 -30.585 43.770 1.00 27.56 H new ATOM 601 N PHE A 747 19.257 -27.210 44.638 1.00 29.36 N ATOM 602 CA PHE A 747 18.065 -26.384 44.854 1.00 30.06 C ATOM 603 C PHE A 747 18.212 -25.015 44.174 1.00 31.94 C ATOM 604 O PHE A 747 17.293 -24.549 43.487 1.00 29.15 O ATOM 605 CB PHE A 747 17.831 -26.208 46.358 1.00 27.99 C ATOM 606 CG PHE A 747 16.470 -25.668 46.717 1.00 26.63 C ATOM 607 CD1 PHE A 747 15.325 -26.448 46.542 1.00 27.88 C ATOM 608 CD2 PHE A 747 16.336 -24.401 47.266 1.00 25.90 C ATOM 609 CE1 PHE A 747 14.069 -25.966 46.916 1.00 27.22 C ATOM 610 CE2 PHE A 747 15.075 -23.907 47.645 1.00 30.74 C ATOM 611 CZ PHE A 747 13.945 -24.695 47.468 1.00 26.68 C ATOM 0 H PHE A 747 19.664 -27.433 45.362 1.00 29.36 H new ATOM 0 HA PHE A 747 17.301 -26.832 44.458 1.00 30.06 H new ATOM 0 HB2 PHE A 747 17.953 -27.065 46.796 1.00 27.99 H new ATOM 0 HB3 PHE A 747 18.508 -25.610 46.712 1.00 27.99 H new ATOM 0 HD1 PHE A 747 15.400 -27.298 46.172 1.00 27.88 H new ATOM 0 HD2 PHE A 747 17.091 -23.871 47.385 1.00 25.90 H new ATOM 0 HE1 PHE A 747 13.314 -26.496 46.796 1.00 27.22 H new ATOM 0 HE2 PHE A 747 14.998 -23.056 48.013 1.00 30.74 H new ATOM 0 HZ PHE A 747 13.109 -24.374 47.718 1.00 26.68 H new ATOM 612 N ALA A 748 19.367 -24.374 44.360 1.00 30.46 N ATOM 613 CA ALA A 748 19.620 -23.074 43.742 1.00 30.51 C ATOM 614 C ALA A 748 19.726 -23.220 42.226 1.00 30.79 C ATOM 615 O ALA A 748 19.374 -22.316 41.483 1.00 30.03 O ATOM 616 CB ALA A 748 20.915 -22.447 44.303 1.00 30.83 C ATOM 0 H ALA A 748 20.015 -24.675 44.839 1.00 30.46 H new ATOM 0 HA ALA A 748 18.876 -22.488 43.951 1.00 30.51 H new ATOM 0 HB1 ALA A 748 21.067 -21.586 43.882 1.00 30.83 H new ATOM 0 HB2 ALA A 748 20.828 -22.327 45.262 1.00 30.83 H new ATOM 0 HB3 ALA A 748 21.665 -23.033 44.118 1.00 30.83 H new ATOM 617 N MET A 749 20.224 -24.359 41.766 1.00 30.08 N ATOM 618 CA MET A 749 20.341 -24.577 40.335 1.00 32.23 C ATOM 619 C MET A 749 18.928 -24.723 39.755 1.00 32.81 C ATOM 620 O MET A 749 18.639 -24.235 38.664 1.00 32.10 O ATOM 621 CB MET A 749 21.171 -25.832 40.058 1.00 31.31 C ATOM 622 CG MET A 749 21.482 -26.085 38.587 1.00 34.35 C ATOM 623 SD MET A 749 20.159 -26.959 37.693 1.00 35.20 S ATOM 624 CE MET A 749 20.272 -28.582 38.472 1.00 35.91 C ATOM 0 H MET A 749 20.496 -25.009 42.258 1.00 30.08 H new ATOM 0 HA MET A 749 20.791 -23.826 39.917 1.00 32.23 H new ATOM 0 HB2 MET A 749 22.007 -25.765 40.545 1.00 31.31 H new ATOM 0 HB3 MET A 749 20.698 -26.601 40.412 1.00 31.31 H new ATOM 0 HG2 MET A 749 21.649 -25.235 38.150 1.00 34.35 H new ATOM 0 HG3 MET A 749 22.300 -26.602 38.523 1.00 34.35 H new ATOM 0 HE1 MET A 749 20.046 -29.268 37.825 1.00 35.91 H new ATOM 0 HE2 MET A 749 21.176 -28.725 38.792 1.00 35.91 H new ATOM 0 HE3 MET A 749 19.654 -28.627 39.219 1.00 35.91 H new ATOM 625 N GLY A 750 18.056 -25.394 40.497 1.00 32.78 N ATOM 626 CA GLY A 750 16.689 -25.575 40.039 1.00 33.54 C ATOM 627 C GLY A 750 16.023 -24.220 39.904 1.00 33.17 C ATOM 628 O GLY A 750 15.285 -23.975 38.952 1.00 34.00 O ATOM 0 H GLY A 750 18.234 -25.748 41.260 1.00 32.78 H new ATOM 0 HA2 GLY A 750 16.681 -26.037 39.186 1.00 33.54 H new ATOM 0 HA3 GLY A 750 16.197 -26.128 40.666 1.00 33.54 H new ATOM 629 N TRP A 751 16.287 -23.332 40.858 1.00 32.08 N ATOM 630 CA TRP A 751 15.717 -22.002 40.816 1.00 32.37 C ATOM 631 C TRP A 751 16.244 -21.229 39.609 1.00 34.89 C ATOM 632 O TRP A 751 15.472 -20.539 38.935 1.00 33.84 O ATOM 633 CB TRP A 751 16.010 -21.250 42.116 1.00 33.17 C ATOM 634 CG TRP A 751 15.466 -19.850 42.118 1.00 35.10 C ATOM 635 CD1 TRP A 751 16.145 -18.701 41.802 1.00 33.09 C ATOM 636 CD2 TRP A 751 14.110 -19.450 42.396 1.00 32.82 C ATOM 637 NE1 TRP A 751 15.295 -17.618 41.866 1.00 34.81 N ATOM 638 CE2 TRP A 751 14.045 -18.050 42.228 1.00 32.90 C ATOM 639 CE3 TRP A 751 12.949 -20.141 42.769 1.00 33.76 C ATOM 640 CZ2 TRP A 751 12.861 -17.325 42.422 1.00 35.52 C ATOM 641 CZ3 TRP A 751 11.771 -19.419 42.962 1.00 31.86 C ATOM 642 CH2 TRP A 751 11.740 -18.026 42.788 1.00 31.74 C ATOM 0 H TRP A 751 16.794 -23.485 41.536 1.00 32.08 H new ATOM 0 HA TRP A 751 14.755 -22.084 40.725 1.00 32.37 H new ATOM 0 HB2 TRP A 751 15.629 -21.741 42.861 1.00 33.17 H new ATOM 0 HB3 TRP A 751 16.969 -21.219 42.257 1.00 33.17 H new ATOM 0 HD1 TRP A 751 17.047 -18.659 41.578 1.00 33.09 H new ATOM 0 HE1 TRP A 751 15.514 -16.802 41.705 1.00 34.81 H new ATOM 0 HE3 TRP A 751 12.964 -21.064 42.886 1.00 33.76 H new ATOM 0 HZ2 TRP A 751 12.836 -16.402 42.307 1.00 35.52 H new ATOM 0 HZ3 TRP A 751 10.995 -19.867 43.210 1.00 31.86 H new ATOM 0 HH2 TRP A 751 10.942 -17.568 42.924 1.00 31.74 H new ATOM 643 N ARG A 752 17.546 -21.352 39.323 1.00 34.76 N ATOM 644 CA ARG A 752 18.151 -20.667 38.172 1.00 34.82 C ATOM 645 C ARG A 752 17.532 -21.149 36.873 1.00 35.53 C ATOM 646 O ARG A 752 17.233 -20.353 35.985 1.00 37.51 O ATOM 647 CB ARG A 752 19.667 -20.919 38.084 1.00 34.10 C ATOM 648 CG ARG A 752 20.493 -20.193 39.109 1.00 36.54 C ATOM 649 CD ARG A 752 21.967 -20.134 38.682 1.00 35.88 C ATOM 650 NE ARG A 752 22.625 -21.438 38.681 1.00 32.46 N ATOM 651 CZ ARG A 752 22.963 -22.109 39.780 1.00 31.77 C ATOM 652 NH1 ARG A 752 22.698 -21.607 40.978 1.00 31.57 N ATOM 653 NH2 ARG A 752 23.599 -23.270 39.680 1.00 30.26 N ATOM 0 H ARG A 752 18.096 -21.827 39.783 1.00 34.76 H new ATOM 0 HA ARG A 752 17.986 -19.720 38.302 1.00 34.82 H new ATOM 0 HB2 ARG A 752 19.829 -21.871 38.174 1.00 34.10 H new ATOM 0 HB3 ARG A 752 19.973 -20.661 37.200 1.00 34.10 H new ATOM 0 HG2 ARG A 752 20.150 -19.293 39.228 1.00 36.54 H new ATOM 0 HG3 ARG A 752 20.418 -20.641 39.966 1.00 36.54 H new ATOM 0 HD2 ARG A 752 22.024 -19.750 37.793 1.00 35.88 H new ATOM 0 HD3 ARG A 752 22.446 -19.538 39.279 1.00 35.88 H new ATOM 0 HE ARG A 752 22.806 -21.796 37.920 1.00 32.46 H new ATOM 0 HH11 ARG A 752 22.306 -20.845 41.048 1.00 31.57 H new ATOM 0 HH12 ARG A 752 22.918 -22.044 41.685 1.00 31.57 H new ATOM 0 HH21 ARG A 752 23.793 -23.589 38.905 1.00 30.26 H new ATOM 0 HH22 ARG A 752 23.817 -23.703 40.390 1.00 30.26 H new ATOM 654 N SER A 753 17.364 -22.462 36.761 1.00 36.18 N ATOM 655 CA SER A 753 16.786 -23.067 35.570 1.00 38.10 C ATOM 656 C SER A 753 15.366 -22.549 35.360 1.00 39.08 C ATOM 657 O SER A 753 14.989 -22.167 34.252 1.00 39.64 O ATOM 658 CB SER A 753 16.766 -24.588 35.712 1.00 38.04 C ATOM 659 OG SER A 753 18.073 -25.112 35.866 1.00 38.11 O ATOM 0 H SER A 753 17.582 -23.026 37.373 1.00 36.18 H new ATOM 0 HA SER A 753 17.328 -22.828 34.802 1.00 38.10 H new ATOM 0 HB2 SER A 753 16.225 -24.836 36.478 1.00 38.04 H new ATOM 0 HB3 SER A 753 16.348 -24.982 34.930 1.00 38.04 H new ATOM 0 HG SER A 753 18.371 -24.905 36.624 1.00 38.11 H new ATOM 660 N PHE A 754 14.587 -22.543 36.436 1.00 40.41 N ATOM 661 CA PHE A 754 13.208 -22.070 36.395 1.00 41.40 C ATOM 662 C PHE A 754 13.127 -20.636 35.899 1.00 43.35 C ATOM 663 O PHE A 754 12.410 -20.345 34.939 1.00 43.74 O ATOM 664 CB PHE A 754 12.578 -22.164 37.787 1.00 40.99 C ATOM 665 CG PHE A 754 11.301 -21.372 37.940 1.00 42.67 C ATOM 666 CD1 PHE A 754 10.203 -21.623 37.125 1.00 43.29 C ATOM 667 CD2 PHE A 754 11.200 -20.377 38.909 1.00 43.68 C ATOM 668 CE1 PHE A 754 9.020 -20.895 37.275 1.00 43.68 C ATOM 669 CE2 PHE A 754 10.022 -19.644 39.069 1.00 44.25 C ATOM 670 CZ PHE A 754 8.932 -19.906 38.248 1.00 42.82 C ATOM 0 H PHE A 754 14.843 -22.813 37.211 1.00 40.41 H new ATOM 0 HA PHE A 754 12.721 -22.636 35.776 1.00 41.40 H new ATOM 0 HB2 PHE A 754 12.396 -23.096 37.987 1.00 40.99 H new ATOM 0 HB3 PHE A 754 13.221 -21.854 38.444 1.00 40.99 H new ATOM 0 HD1 PHE A 754 10.257 -22.283 36.472 1.00 43.29 H new ATOM 0 HD2 PHE A 754 11.929 -20.198 39.458 1.00 43.68 H new ATOM 0 HE1 PHE A 754 8.292 -21.072 36.724 1.00 43.68 H new ATOM 0 HE2 PHE A 754 9.967 -18.984 39.722 1.00 44.25 H new ATOM 0 HZ PHE A 754 8.145 -19.421 38.349 1.00 42.82 H new ATOM 671 N THR A 755 13.868 -19.746 36.552 1.00 43.86 N ATOM 672 CA THR A 755 13.863 -18.334 36.200 1.00 45.55 C ATOM 673 C THR A 755 14.580 -17.960 34.901 1.00 47.17 C ATOM 674 O THR A 755 14.332 -16.888 34.353 1.00 48.02 O ATOM 675 CB THR A 755 14.469 -17.486 37.330 1.00 45.92 C ATOM 676 OG1 THR A 755 15.860 -17.795 37.466 1.00 46.73 O ATOM 677 CG2 THR A 755 13.766 -17.771 38.644 1.00 44.82 C ATOM 0 H THR A 755 14.386 -19.945 37.209 1.00 43.86 H new ATOM 0 HA THR A 755 12.922 -18.145 36.061 1.00 45.55 H new ATOM 0 HB THR A 755 14.357 -16.548 37.108 1.00 45.92 H new ATOM 0 HG1 THR A 755 15.946 -18.539 37.846 1.00 46.73 H new ATOM 0 HG21 THR A 755 14.159 -17.229 39.346 1.00 44.82 H new ATOM 0 HG22 THR A 755 12.824 -17.557 38.560 1.00 44.82 H new ATOM 0 HG23 THR A 755 13.865 -18.710 38.867 1.00 44.82 H new ATOM 678 N ASN A 756 15.459 -18.828 34.406 1.00 48.91 N ATOM 679 CA ASN A 756 16.201 -18.528 33.179 1.00 50.13 C ATOM 680 C ASN A 756 15.678 -19.209 31.921 1.00 51.21 C ATOM 681 O ASN A 756 15.257 -18.542 30.981 1.00 52.72 O ATOM 682 CB ASN A 756 17.685 -18.872 33.345 1.00 49.72 C ATOM 683 CG ASN A 756 18.414 -17.895 34.242 1.00 50.61 C ATOM 684 OD1 ASN A 756 18.321 -16.687 34.059 1.00 54.29 O ATOM 685 ND2 ASN A 756 19.157 -18.414 35.207 1.00 52.39 N ATOM 0 H ASN A 756 15.641 -19.590 34.760 1.00 48.91 H new ATOM 0 HA ASN A 756 16.072 -17.575 33.049 1.00 50.13 H new ATOM 0 HB2 ASN A 756 17.767 -19.766 33.713 1.00 49.72 H new ATOM 0 HB3 ASN A 756 18.110 -18.884 32.473 1.00 49.72 H new ATOM 0 HD21 ASN A 756 19.598 -17.898 35.735 1.00 52.39 H new ATOM 0 HD22 ASN A 756 19.199 -19.267 35.306 1.00 52.39 H new ATOM 686 N VAL A 757 15.729 -20.533 31.891 1.00 52.34 N ATOM 687 CA VAL A 757 15.255 -21.274 30.731 1.00 53.32 C ATOM 688 C VAL A 757 13.878 -21.882 30.998 1.00 54.00 C ATOM 689 O VAL A 757 13.448 -22.807 30.313 1.00 54.31 O ATOM 690 CB VAL A 757 16.258 -22.387 30.335 1.00 52.91 C ATOM 691 CG1 VAL A 757 17.573 -21.762 29.887 1.00 53.42 C ATOM 692 CG2 VAL A 757 16.505 -23.314 31.510 1.00 53.81 C ATOM 0 H VAL A 757 16.034 -21.021 32.530 1.00 52.34 H new ATOM 0 HA VAL A 757 15.181 -20.649 29.993 1.00 53.32 H new ATOM 0 HB VAL A 757 15.882 -22.901 29.604 1.00 52.91 H new ATOM 0 HG11 VAL A 757 18.197 -22.462 29.640 1.00 53.42 H new ATOM 0 HG12 VAL A 757 17.414 -21.187 29.122 1.00 53.42 H new ATOM 0 HG13 VAL A 757 17.946 -21.238 30.613 1.00 53.42 H new ATOM 0 HG21 VAL A 757 17.134 -24.006 31.250 1.00 53.81 H new ATOM 0 HG22 VAL A 757 16.871 -22.807 32.251 1.00 53.81 H new ATOM 0 HG23 VAL A 757 15.668 -23.723 31.781 1.00 53.81 H new ATOM 693 N ASN A 758 13.194 -21.345 32.003 1.00 55.88 N ATOM 694 CA ASN A 758 11.863 -21.812 32.376 1.00 57.62 C ATOM 695 C ASN A 758 11.830 -23.304 32.705 1.00 57.93 C ATOM 696 O ASN A 758 10.838 -23.985 32.444 1.00 58.06 O ATOM 697 CB ASN A 758 10.867 -21.501 31.255 1.00 59.67 C ATOM 698 CG ASN A 758 9.447 -21.897 31.611 1.00 62.32 C ATOM 699 OD1 ASN A 758 8.935 -21.530 32.671 1.00 63.50 O ATOM 700 ND2 ASN A 758 8.802 -22.650 30.725 1.00 63.92 N ATOM 0 H ASN A 758 13.489 -20.699 32.488 1.00 55.88 H new ATOM 0 HA ASN A 758 11.612 -21.338 33.184 1.00 57.62 H new ATOM 0 HB2 ASN A 758 10.894 -20.552 31.056 1.00 59.67 H new ATOM 0 HB3 ASN A 758 11.137 -21.967 30.448 1.00 59.67 H new ATOM 0 HD21 ASN A 758 7.994 -22.901 30.881 1.00 63.92 H new ATOM 0 HD22 ASN A 758 9.193 -22.886 29.996 1.00 63.92 H new ATOM 701 N SER A 759 12.925 -23.807 33.271 1.00 57.19 N ATOM 702 CA SER A 759 13.033 -25.212 33.659 1.00 56.02 C ATOM 703 C SER A 759 13.115 -26.189 32.487 1.00 56.10 C ATOM 704 O SER A 759 13.056 -27.402 32.688 1.00 56.47 O ATOM 705 CB SER A 759 11.849 -25.599 34.553 1.00 55.24 C ATOM 706 OG SER A 759 11.683 -24.670 35.608 1.00 51.62 O ATOM 0 H SER A 759 13.628 -23.342 33.441 1.00 57.19 H new ATOM 0 HA SER A 759 13.874 -25.286 34.136 1.00 56.02 H new ATOM 0 HB2 SER A 759 11.038 -25.638 34.022 1.00 55.24 H new ATOM 0 HB3 SER A 759 11.992 -26.486 34.919 1.00 55.24 H new ATOM 0 HG SER A 759 12.283 -24.790 36.184 1.00 51.62 H new ATOM 707 N ARG A 760 13.258 -25.671 31.271 1.00 55.30 N ATOM 708 CA ARG A 760 13.336 -26.530 30.095 1.00 55.97 C ATOM 709 C ARG A 760 14.722 -27.146 29.926 1.00 53.87 C ATOM 710 O ARG A 760 14.882 -28.188 29.296 1.00 53.61 O ATOM 711 CB ARG A 760 12.952 -25.739 28.845 1.00 59.93 C ATOM 712 CG ARG A 760 11.520 -25.234 28.882 1.00 63.46 C ATOM 713 CD ARG A 760 11.148 -24.543 27.586 1.00 68.22 C ATOM 714 NE ARG A 760 11.274 -25.439 26.441 1.00 71.63 N ATOM 715 CZ ARG A 760 10.979 -25.098 25.191 1.00 74.12 C ATOM 716 NH1 ARG A 760 10.537 -23.874 24.920 1.00 74.96 N ATOM 717 NH2 ARG A 760 11.130 -25.981 24.211 1.00 74.56 N ATOM 0 H ARG A 760 13.312 -24.829 31.106 1.00 55.30 H new ATOM 0 HA ARG A 760 12.710 -27.260 30.222 1.00 55.97 H new ATOM 0 HB2 ARG A 760 13.554 -24.984 28.748 1.00 59.93 H new ATOM 0 HB3 ARG A 760 13.072 -26.300 28.063 1.00 59.93 H new ATOM 0 HG2 ARG A 760 10.917 -25.977 29.040 1.00 63.46 H new ATOM 0 HG3 ARG A 760 11.411 -24.617 29.623 1.00 63.46 H new ATOM 0 HD2 ARG A 760 10.236 -24.217 27.643 1.00 68.22 H new ATOM 0 HD3 ARG A 760 11.719 -23.769 27.456 1.00 68.22 H new ATOM 0 HE ARG A 760 11.557 -26.238 26.584 1.00 71.63 H new ATOM 0 HH11 ARG A 760 10.442 -23.301 25.554 1.00 74.96 H new ATOM 0 HH12 ARG A 760 10.347 -23.655 24.110 1.00 74.96 H new ATOM 0 HH21 ARG A 760 11.418 -26.772 24.386 1.00 74.56 H new ATOM 0 HH22 ARG A 760 10.939 -25.762 23.402 1.00 74.56 H new ATOM 718 N MET A 761 15.723 -26.493 30.497 1.00 51.90 N ATOM 719 CA MET A 761 17.092 -26.980 30.440 1.00 48.56 C ATOM 720 C MET A 761 17.684 -26.767 31.820 1.00 44.81 C ATOM 721 O MET A 761 17.140 -25.995 32.607 1.00 43.96 O ATOM 722 CB MET A 761 17.885 -26.195 29.403 1.00 50.93 C ATOM 723 CG MET A 761 17.404 -26.402 27.981 1.00 55.74 C ATOM 724 SD MET A 761 18.294 -25.355 26.825 1.00 60.18 S ATOM 725 CE MET A 761 19.794 -26.275 26.612 1.00 60.29 C ATOM 0 H MET A 761 15.628 -25.755 30.928 1.00 51.90 H new ATOM 0 HA MET A 761 17.121 -27.916 30.187 1.00 48.56 H new ATOM 0 HB2 MET A 761 17.836 -25.250 29.618 1.00 50.93 H new ATOM 0 HB3 MET A 761 18.819 -26.451 29.460 1.00 50.93 H new ATOM 0 HG2 MET A 761 17.519 -27.332 27.732 1.00 55.74 H new ATOM 0 HG3 MET A 761 16.455 -26.210 27.928 1.00 55.74 H new ATOM 0 HE1 MET A 761 20.546 -25.745 26.919 1.00 60.29 H new ATOM 0 HE2 MET A 761 19.746 -27.096 27.126 1.00 60.29 H new ATOM 0 HE3 MET A 761 19.912 -26.489 25.673 1.00 60.29 H new ATOM 726 N LEU A 762 18.781 -27.451 32.128 1.00 40.44 N ATOM 727 CA LEU A 762 19.404 -27.280 33.437 1.00 37.23 C ATOM 728 C LEU A 762 20.459 -26.196 33.363 1.00 36.39 C ATOM 729 O LEU A 762 21.501 -26.349 32.707 1.00 36.25 O ATOM 730 CB LEU A 762 20.010 -28.592 33.937 1.00 36.15 C ATOM 731 CG LEU A 762 18.975 -29.661 34.303 1.00 37.51 C ATOM 732 CD1 LEU A 762 19.686 -30.860 34.910 1.00 36.52 C ATOM 733 CD2 LEU A 762 17.945 -29.082 35.290 1.00 35.14 C ATOM 0 H LEU A 762 19.175 -28.009 31.605 1.00 40.44 H new ATOM 0 HA LEU A 762 18.721 -27.014 34.072 1.00 37.23 H new ATOM 0 HB2 LEU A 762 20.599 -28.947 33.252 1.00 36.15 H new ATOM 0 HB3 LEU A 762 20.559 -28.407 34.715 1.00 36.15 H new ATOM 0 HG LEU A 762 18.503 -29.945 33.505 1.00 37.51 H new ATOM 0 HD11 LEU A 762 19.034 -31.539 35.143 1.00 36.52 H new ATOM 0 HD12 LEU A 762 20.315 -31.223 34.267 1.00 36.52 H new ATOM 0 HD13 LEU A 762 20.164 -30.584 35.708 1.00 36.52 H new ATOM 0 HD21 LEU A 762 17.294 -29.765 35.516 1.00 35.14 H new ATOM 0 HD22 LEU A 762 18.398 -28.788 36.096 1.00 35.14 H new ATOM 0 HD23 LEU A 762 17.493 -28.328 34.881 1.00 35.14 H new ATOM 734 N TYR A 763 20.170 -25.096 34.046 1.00 33.91 N ATOM 735 CA TYR A 763 21.039 -23.934 34.067 1.00 33.98 C ATOM 736 C TYR A 763 22.074 -24.005 35.194 1.00 32.72 C ATOM 737 O TYR A 763 21.989 -23.290 36.190 1.00 32.31 O ATOM 738 CB TYR A 763 20.170 -22.677 34.189 1.00 35.92 C ATOM 739 CG TYR A 763 20.848 -21.399 33.749 1.00 40.06 C ATOM 740 CD1 TYR A 763 21.724 -20.719 34.597 1.00 42.23 C ATOM 741 CD2 TYR A 763 20.622 -20.874 32.477 1.00 40.33 C ATOM 742 CE1 TYR A 763 22.358 -19.546 34.189 1.00 44.90 C ATOM 743 CE2 TYR A 763 21.251 -19.700 32.057 1.00 43.17 C ATOM 744 CZ TYR A 763 22.114 -19.043 32.918 1.00 45.38 C ATOM 745 OH TYR A 763 22.721 -17.875 32.518 1.00 46.85 O ATOM 0 H TYR A 763 19.455 -25.005 34.515 1.00 33.91 H new ATOM 0 HA TYR A 763 21.545 -23.906 33.240 1.00 33.98 H new ATOM 0 HB2 TYR A 763 19.366 -22.801 33.661 1.00 35.92 H new ATOM 0 HB3 TYR A 763 19.890 -22.580 35.113 1.00 35.92 H new ATOM 0 HD1 TYR A 763 21.888 -21.054 35.449 1.00 42.23 H new ATOM 0 HD2 TYR A 763 20.042 -21.314 31.898 1.00 40.33 H new ATOM 0 HE1 TYR A 763 22.940 -19.104 34.764 1.00 44.90 H new ATOM 0 HE2 TYR A 763 21.091 -19.362 31.205 1.00 43.17 H new ATOM 0 HH TYR A 763 22.486 -17.691 31.733 1.00 46.85 H new ATOM 746 N PHE A 764 23.059 -24.880 35.027 1.00 32.03 N ATOM 747 CA PHE A 764 24.101 -25.031 36.033 1.00 31.74 C ATOM 748 C PHE A 764 24.875 -23.728 36.210 1.00 29.54 C ATOM 749 O PHE A 764 25.101 -23.287 37.331 1.00 29.23 O ATOM 750 CB PHE A 764 25.044 -26.167 35.640 1.00 28.41 C ATOM 751 CG PHE A 764 24.424 -27.530 35.749 1.00 29.85 C ATOM 752 CD1 PHE A 764 24.200 -28.111 36.994 1.00 29.10 C ATOM 753 CD2 PHE A 764 24.052 -28.233 34.608 1.00 31.12 C ATOM 754 CE1 PHE A 764 23.616 -29.372 37.103 1.00 30.43 C ATOM 755 CE2 PHE A 764 23.464 -29.498 34.705 1.00 32.62 C ATOM 756 CZ PHE A 764 23.247 -30.069 35.958 1.00 32.41 C ATOM 0 H PHE A 764 23.142 -25.393 34.342 1.00 32.03 H new ATOM 0 HA PHE A 764 23.684 -25.249 36.881 1.00 31.74 H new ATOM 0 HB2 PHE A 764 25.342 -26.028 34.728 1.00 28.41 H new ATOM 0 HB3 PHE A 764 25.832 -26.133 36.205 1.00 28.41 H new ATOM 0 HD1 PHE A 764 24.444 -27.651 37.765 1.00 29.10 H new ATOM 0 HD2 PHE A 764 24.196 -27.857 33.770 1.00 31.12 H new ATOM 0 HE1 PHE A 764 23.473 -29.747 37.942 1.00 30.43 H new ATOM 0 HE2 PHE A 764 23.218 -29.958 33.935 1.00 32.62 H new ATOM 0 HZ PHE A 764 22.858 -30.911 36.028 1.00 32.41 H new ATOM 757 N ALA A 765 25.259 -23.117 35.093 1.00 31.06 N ATOM 758 CA ALA A 765 25.995 -21.853 35.087 1.00 33.00 C ATOM 759 C ALA A 765 25.705 -21.199 33.747 1.00 33.51 C ATOM 760 O ALA A 765 25.199 -21.851 32.842 1.00 32.95 O ATOM 761 CB ALA A 765 27.504 -22.109 35.233 1.00 31.35 C ATOM 0 H ALA A 765 25.098 -23.427 34.307 1.00 31.06 H new ATOM 0 HA ALA A 765 25.724 -21.287 35.826 1.00 33.00 H new ATOM 0 HB1 ALA A 765 27.978 -21.263 35.227 1.00 31.35 H new ATOM 0 HB2 ALA A 765 27.675 -22.569 36.070 1.00 31.35 H new ATOM 0 HB3 ALA A 765 27.812 -22.657 34.494 1.00 31.35 H new ATOM 762 N PRO A 766 26.004 -19.898 33.606 1.00 36.00 N ATOM 763 CA PRO A 766 25.755 -19.206 32.338 1.00 37.40 C ATOM 764 C PRO A 766 26.491 -19.891 31.189 1.00 37.17 C ATOM 765 O PRO A 766 25.979 -19.970 30.073 1.00 36.22 O ATOM 766 CB PRO A 766 26.299 -17.808 32.602 1.00 37.62 C ATOM 767 CG PRO A 766 26.023 -17.625 34.044 1.00 39.17 C ATOM 768 CD PRO A 766 26.467 -18.944 34.626 1.00 36.33 C ATOM 0 HA PRO A 766 24.822 -19.203 32.074 1.00 37.40 H new ATOM 0 HB2 PRO A 766 27.247 -17.746 32.405 1.00 37.62 H new ATOM 0 HB3 PRO A 766 25.852 -17.138 32.061 1.00 37.62 H new ATOM 0 HG2 PRO A 766 26.520 -16.880 34.416 1.00 39.17 H new ATOM 0 HG3 PRO A 766 25.084 -17.452 34.214 1.00 39.17 H new ATOM 0 HD2 PRO A 766 27.428 -18.982 34.749 1.00 36.33 H new ATOM 0 HD3 PRO A 766 26.064 -19.113 35.492 1.00 36.33 H new ATOM 769 N ASP A 767 27.687 -20.399 31.478 1.00 36.81 N ATOM 770 CA ASP A 767 28.500 -21.067 30.465 1.00 38.18 C ATOM 771 C ASP A 767 28.420 -22.596 30.502 1.00 38.75 C ATOM 772 O ASP A 767 29.250 -23.275 29.904 1.00 39.44 O ATOM 773 CB ASP A 767 29.959 -20.624 30.606 1.00 38.54 C ATOM 774 CG ASP A 767 30.552 -20.996 31.949 1.00 38.98 C ATOM 775 OD1 ASP A 767 29.797 -21.044 32.942 1.00 37.86 O ATOM 776 OD2 ASP A 767 31.775 -21.232 32.014 1.00 41.03 O ATOM 0 H ASP A 767 28.047 -20.367 32.258 1.00 36.81 H new ATOM 0 HA ASP A 767 28.135 -20.800 29.607 1.00 38.18 H new ATOM 0 HB2 ASP A 767 30.486 -21.029 29.900 1.00 38.54 H new ATOM 0 HB3 ASP A 767 30.015 -19.663 30.486 1.00 38.54 H new ATOM 777 N LEU A 768 27.429 -23.142 31.203 1.00 37.90 N ATOM 778 CA LEU A 768 27.277 -24.592 31.269 1.00 36.68 C ATOM 779 C LEU A 768 25.796 -24.952 31.417 1.00 37.35 C ATOM 780 O LEU A 768 25.322 -25.298 32.505 1.00 35.21 O ATOM 781 CB LEU A 768 28.094 -25.160 32.436 1.00 35.97 C ATOM 782 CG LEU A 768 28.221 -26.687 32.506 1.00 35.84 C ATOM 783 CD1 LEU A 768 28.822 -27.213 31.210 1.00 35.86 C ATOM 784 CD2 LEU A 768 29.084 -27.083 33.694 1.00 34.24 C ATOM 0 H LEU A 768 26.840 -22.696 31.643 1.00 37.90 H new ATOM 0 HA LEU A 768 27.611 -24.985 30.447 1.00 36.68 H new ATOM 0 HB2 LEU A 768 28.987 -24.783 32.393 1.00 35.97 H new ATOM 0 HB3 LEU A 768 27.695 -24.851 33.264 1.00 35.97 H new ATOM 0 HG LEU A 768 27.340 -27.077 32.622 1.00 35.84 H new ATOM 0 HD11 LEU A 768 28.901 -28.179 31.258 1.00 35.86 H new ATOM 0 HD12 LEU A 768 28.248 -26.972 30.466 1.00 35.86 H new ATOM 0 HD13 LEU A 768 29.701 -26.824 31.079 1.00 35.86 H new ATOM 0 HD21 LEU A 768 29.160 -28.049 33.732 1.00 34.24 H new ATOM 0 HD22 LEU A 768 29.967 -26.694 33.597 1.00 34.24 H new ATOM 0 HD23 LEU A 768 28.677 -26.759 34.512 1.00 34.24 H new ATOM 785 N VAL A 769 25.070 -24.842 30.309 1.00 36.73 N ATOM 786 CA VAL A 769 23.642 -25.141 30.276 1.00 35.78 C ATOM 787 C VAL A 769 23.456 -26.494 29.616 1.00 34.83 C ATOM 788 O VAL A 769 23.958 -26.736 28.514 1.00 34.88 O ATOM 789 CB VAL A 769 22.862 -24.074 29.474 1.00 37.22 C ATOM 790 CG1 VAL A 769 21.364 -24.403 29.477 1.00 37.77 C ATOM 791 CG2 VAL A 769 23.110 -22.685 30.076 1.00 35.97 C ATOM 0 H VAL A 769 25.393 -24.591 29.552 1.00 36.73 H new ATOM 0 HA VAL A 769 23.300 -25.144 31.184 1.00 35.78 H new ATOM 0 HB VAL A 769 23.174 -24.075 28.556 1.00 37.22 H new ATOM 0 HG11 VAL A 769 20.883 -23.729 28.972 1.00 37.77 H new ATOM 0 HG12 VAL A 769 21.223 -25.272 29.071 1.00 37.77 H new ATOM 0 HG13 VAL A 769 21.037 -24.416 30.390 1.00 37.77 H new ATOM 0 HG21 VAL A 769 22.618 -22.020 29.569 1.00 35.97 H new ATOM 0 HG22 VAL A 769 22.811 -22.674 30.999 1.00 35.97 H new ATOM 0 HG23 VAL A 769 24.058 -22.482 30.041 1.00 35.97 H new ATOM 792 N PHE A 770 22.746 -27.382 30.301 1.00 33.73 N ATOM 793 CA PHE A 770 22.510 -28.719 29.787 1.00 34.22 C ATOM 794 C PHE A 770 21.235 -28.872 28.972 1.00 36.94 C ATOM 795 O PHE A 770 20.146 -28.499 29.420 1.00 36.42 O ATOM 796 CB PHE A 770 22.449 -29.729 30.940 1.00 33.96 C ATOM 797 CG PHE A 770 23.782 -30.312 31.330 1.00 33.61 C ATOM 798 CD1 PHE A 770 24.944 -29.539 31.310 1.00 32.76 C ATOM 799 CD2 PHE A 770 23.866 -31.632 31.754 1.00 30.73 C ATOM 800 CE1 PHE A 770 26.178 -30.085 31.713 1.00 31.40 C ATOM 801 CE2 PHE A 770 25.084 -32.180 32.157 1.00 33.61 C ATOM 802 CZ PHE A 770 26.241 -31.403 32.135 1.00 31.06 C ATOM 0 H PHE A 770 22.392 -27.227 31.069 1.00 33.73 H new ATOM 0 HA PHE A 770 23.257 -28.888 29.192 1.00 34.22 H new ATOM 0 HB2 PHE A 770 22.059 -29.295 31.715 1.00 33.96 H new ATOM 0 HB3 PHE A 770 21.853 -30.452 30.690 1.00 33.96 H new ATOM 0 HD1 PHE A 770 24.903 -28.654 31.028 1.00 32.76 H new ATOM 0 HD2 PHE A 770 23.099 -32.158 31.769 1.00 30.73 H new ATOM 0 HE1 PHE A 770 26.947 -29.563 31.696 1.00 31.40 H new ATOM 0 HE2 PHE A 770 25.124 -33.065 32.441 1.00 33.61 H new ATOM 0 HZ PHE A 770 27.053 -31.768 32.403 1.00 31.06 H new ATOM 803 N ASN A 771 21.386 -29.421 27.772 1.00 37.20 N ATOM 804 CA ASN A 771 20.251 -29.731 26.915 1.00 37.39 C ATOM 805 C ASN A 771 20.157 -31.253 27.037 1.00 37.61 C ATOM 806 O ASN A 771 20.940 -31.860 27.778 1.00 37.16 O ATOM 807 CB ASN A 771 20.505 -29.322 25.457 1.00 36.40 C ATOM 808 CG ASN A 771 21.896 -29.697 24.968 1.00 35.51 C ATOM 809 OD1 ASN A 771 22.484 -30.683 25.413 1.00 35.20 O ATOM 810 ND2 ASN A 771 22.419 -28.915 24.027 1.00 37.03 N ATOM 0 H ASN A 771 22.150 -29.624 27.433 1.00 37.20 H new ATOM 0 HA ASN A 771 19.443 -29.260 27.172 1.00 37.39 H new ATOM 0 HB2 ASN A 771 19.843 -29.744 24.888 1.00 36.40 H new ATOM 0 HB3 ASN A 771 20.384 -28.364 25.370 1.00 36.40 H new ATOM 0 HD21 ASN A 771 23.197 -29.090 23.706 1.00 37.03 H new ATOM 0 HD22 ASN A 771 21.979 -28.234 23.740 1.00 37.03 H new ATOM 811 N GLU A 772 19.221 -31.871 26.321 1.00 37.80 N ATOM 812 CA GLU A 772 19.050 -33.319 26.381 1.00 38.43 C ATOM 813 C GLU A 772 20.317 -34.075 25.993 1.00 38.84 C ATOM 814 O GLU A 772 20.660 -35.086 26.610 1.00 38.24 O ATOM 815 CB GLU A 772 17.904 -33.757 25.463 1.00 39.47 C ATOM 816 CG GLU A 772 16.511 -33.390 25.957 1.00 41.55 C ATOM 817 CD GLU A 772 15.853 -34.512 26.743 1.00 43.48 C ATOM 818 OE1 GLU A 772 15.992 -35.688 26.332 1.00 42.42 O ATOM 819 OE2 GLU A 772 15.184 -34.219 27.760 1.00 44.39 O ATOM 0 H GLU A 772 18.674 -31.469 25.793 1.00 37.80 H new ATOM 0 HA GLU A 772 18.844 -33.536 27.304 1.00 38.43 H new ATOM 0 HB2 GLU A 772 18.038 -33.360 24.588 1.00 39.47 H new ATOM 0 HB3 GLU A 772 17.949 -34.719 25.348 1.00 39.47 H new ATOM 0 HG2 GLU A 772 16.568 -32.599 26.516 1.00 41.55 H new ATOM 0 HG3 GLU A 772 15.952 -33.161 25.198 1.00 41.55 H new ATOM 820 N TYR A 773 21.005 -33.591 24.964 1.00 37.38 N ATOM 821 CA TYR A 773 22.220 -34.255 24.512 1.00 36.11 C ATOM 822 C TYR A 773 23.235 -34.335 25.655 1.00 34.13 C ATOM 823 O TYR A 773 23.773 -35.400 25.935 1.00 36.64 O ATOM 824 CB TYR A 773 22.827 -33.516 23.313 1.00 35.19 C ATOM 825 CG TYR A 773 24.004 -34.245 22.703 1.00 36.64 C ATOM 826 CD1 TYR A 773 23.836 -35.482 22.079 1.00 37.30 C ATOM 827 CD2 TYR A 773 25.293 -33.715 22.779 1.00 37.91 C ATOM 828 CE1 TYR A 773 24.926 -36.178 21.546 1.00 40.02 C ATOM 829 CE2 TYR A 773 26.390 -34.401 22.249 1.00 37.27 C ATOM 830 CZ TYR A 773 26.200 -35.627 21.638 1.00 39.70 C ATOM 831 OH TYR A 773 27.279 -36.313 21.131 1.00 43.36 O ATOM 0 H TYR A 773 20.788 -32.888 24.519 1.00 37.38 H new ATOM 0 HA TYR A 773 21.992 -35.155 24.232 1.00 36.11 H new ATOM 0 HB2 TYR A 773 22.143 -33.392 22.636 1.00 35.19 H new ATOM 0 HB3 TYR A 773 23.111 -32.632 23.594 1.00 35.19 H new ATOM 0 HD1 TYR A 773 22.984 -35.850 22.016 1.00 37.30 H new ATOM 0 HD2 TYR A 773 25.425 -32.891 23.189 1.00 37.91 H new ATOM 0 HE1 TYR A 773 24.800 -37.002 21.134 1.00 40.02 H new ATOM 0 HE2 TYR A 773 27.243 -34.035 22.307 1.00 37.27 H new ATOM 0 HH TYR A 773 27.979 -35.865 21.254 1.00 43.36 H new ATOM 832 N ARG A 774 23.490 -33.215 26.320 1.00 34.17 N ATOM 833 CA ARG A 774 24.438 -33.217 27.428 1.00 33.70 C ATOM 834 C ARG A 774 23.955 -34.084 28.592 1.00 34.32 C ATOM 835 O ARG A 774 24.756 -34.743 29.255 1.00 33.54 O ATOM 836 CB ARG A 774 24.702 -31.787 27.888 1.00 33.56 C ATOM 837 CG ARG A 774 25.573 -31.020 26.915 1.00 34.10 C ATOM 838 CD ARG A 774 25.759 -29.580 27.326 1.00 34.60 C ATOM 839 NE ARG A 774 26.844 -28.967 26.568 1.00 36.22 N ATOM 840 CZ ARG A 774 27.212 -27.694 26.662 1.00 37.55 C ATOM 841 NH1 ARG A 774 26.581 -26.863 27.487 1.00 37.03 N ATOM 842 NH2 ARG A 774 28.227 -27.255 25.931 1.00 37.01 N ATOM 0 H ARG A 774 23.131 -32.453 26.149 1.00 34.17 H new ATOM 0 HA ARG A 774 25.268 -33.607 27.111 1.00 33.70 H new ATOM 0 HB2 ARG A 774 23.857 -31.323 27.997 1.00 33.56 H new ATOM 0 HB3 ARG A 774 25.130 -31.804 28.758 1.00 33.56 H new ATOM 0 HG2 ARG A 774 26.440 -31.451 26.851 1.00 34.10 H new ATOM 0 HG3 ARG A 774 25.174 -31.053 26.031 1.00 34.10 H new ATOM 0 HD2 ARG A 774 24.936 -29.087 27.179 1.00 34.60 H new ATOM 0 HD3 ARG A 774 25.953 -29.532 28.275 1.00 34.60 H new ATOM 0 HE ARG A 774 27.278 -29.467 26.019 1.00 36.22 H new ATOM 0 HH11 ARG A 774 25.927 -27.148 27.967 1.00 37.03 H new ATOM 0 HH12 ARG A 774 26.827 -26.041 27.540 1.00 37.03 H new ATOM 0 HH21 ARG A 774 28.640 -27.793 25.402 1.00 37.01 H new ATOM 0 HH22 ARG A 774 28.472 -26.432 25.985 1.00 37.01 H new ATOM 843 N MET A 775 22.648 -34.086 28.840 1.00 33.68 N ATOM 844 CA MET A 775 22.102 -34.907 29.911 1.00 35.28 C ATOM 845 C MET A 775 22.506 -36.355 29.678 1.00 34.49 C ATOM 846 O MET A 775 22.850 -37.067 30.617 1.00 34.45 O ATOM 847 CB MET A 775 20.574 -34.800 29.956 1.00 35.44 C ATOM 848 CG MET A 775 20.072 -33.489 30.511 1.00 38.09 C ATOM 849 SD MET A 775 18.278 -33.394 30.466 1.00 44.05 S ATOM 850 CE MET A 775 18.033 -31.613 30.381 1.00 45.90 C ATOM 0 H MET A 775 22.068 -33.624 28.404 1.00 33.68 H new ATOM 0 HA MET A 775 22.454 -34.593 30.759 1.00 35.28 H new ATOM 0 HB2 MET A 775 20.223 -34.918 29.059 1.00 35.44 H new ATOM 0 HB3 MET A 775 20.223 -35.526 30.495 1.00 35.44 H new ATOM 0 HG2 MET A 775 20.379 -33.385 31.425 1.00 38.09 H new ATOM 0 HG3 MET A 775 20.448 -32.755 30.000 1.00 38.09 H new ATOM 0 HE1 MET A 775 17.083 -31.418 30.351 1.00 45.90 H new ATOM 0 HE2 MET A 775 18.424 -31.195 31.164 1.00 45.90 H new ATOM 0 HE3 MET A 775 18.460 -31.265 29.582 1.00 45.90 H new ATOM 851 N HIS A 776 22.461 -36.783 28.420 1.00 35.05 N ATOM 852 CA HIS A 776 22.834 -38.145 28.054 1.00 36.46 C ATOM 853 C HIS A 776 24.348 -38.358 28.129 1.00 37.15 C ATOM 854 O HIS A 776 24.814 -39.355 28.668 1.00 38.34 O ATOM 855 CB HIS A 776 22.359 -38.462 26.636 1.00 37.38 C ATOM 856 CG HIS A 776 22.792 -39.809 26.142 1.00 40.15 C ATOM 857 ND1 HIS A 776 22.188 -40.982 26.546 1.00 43.23 N ATOM 858 CD2 HIS A 776 23.781 -40.170 25.290 1.00 41.36 C ATOM 859 CE1 HIS A 776 22.785 -42.007 25.960 1.00 42.63 C ATOM 860 NE2 HIS A 776 23.755 -41.541 25.193 1.00 41.00 N ATOM 0 H HIS A 776 22.214 -36.294 27.757 1.00 35.05 H new ATOM 0 HA HIS A 776 22.406 -38.740 28.690 1.00 36.46 H new ATOM 0 HB2 HIS A 776 21.391 -38.413 26.609 1.00 37.38 H new ATOM 0 HB3 HIS A 776 22.694 -37.782 26.032 1.00 37.38 H new ATOM 0 HD2 HIS A 776 24.368 -39.597 24.852 1.00 41.36 H new ATOM 0 HE1 HIS A 776 22.560 -42.903 26.069 1.00 42.63 H new ATOM 0 HE2 HIS A 776 24.284 -42.018 24.711 1.00 41.00 H new ATOM 861 N LYS A 777 25.102 -37.412 27.577 1.00 37.37 N ATOM 862 CA LYS A 777 26.561 -37.467 27.550 1.00 39.47 C ATOM 863 C LYS A 777 27.197 -37.527 28.943 1.00 39.02 C ATOM 864 O LYS A 777 28.214 -38.193 29.139 1.00 39.03 O ATOM 865 CB LYS A 777 27.090 -36.246 26.799 1.00 39.92 C ATOM 866 CG LYS A 777 27.775 -36.553 25.488 1.00 45.29 C ATOM 867 CD LYS A 777 26.945 -37.443 24.590 1.00 44.19 C ATOM 868 CE LYS A 777 27.701 -38.728 24.299 1.00 47.51 C ATOM 869 NZ LYS A 777 29.064 -38.461 23.752 1.00 46.44 N ATOM 0 H LYS A 777 24.776 -36.710 27.202 1.00 37.37 H new ATOM 0 HA LYS A 777 26.807 -38.290 27.100 1.00 39.47 H new ATOM 0 HB2 LYS A 777 26.350 -35.642 26.629 1.00 39.92 H new ATOM 0 HB3 LYS A 777 27.715 -35.775 27.373 1.00 39.92 H new ATOM 0 HG2 LYS A 777 27.967 -35.722 25.025 1.00 45.29 H new ATOM 0 HG3 LYS A 777 28.626 -36.983 25.665 1.00 45.29 H new ATOM 0 HD2 LYS A 777 26.097 -37.646 25.016 1.00 44.19 H new ATOM 0 HD3 LYS A 777 26.743 -36.982 23.761 1.00 44.19 H new ATOM 0 HE2 LYS A 777 27.776 -39.250 25.113 1.00 47.51 H new ATOM 0 HE3 LYS A 777 27.198 -39.262 23.665 1.00 47.51 H new ATOM 0 HZ1 LYS A 777 29.302 -39.126 23.211 1.00 46.44 H new ATOM 0 HZ2 LYS A 777 29.057 -37.696 23.297 1.00 46.44 H new ATOM 0 HZ3 LYS A 777 29.647 -38.401 24.422 1.00 46.44 H new ATOM 870 N SER A 778 26.598 -36.824 29.900 1.00 38.45 N ATOM 871 CA SER A 778 27.098 -36.788 31.272 1.00 39.02 C ATOM 872 C SER A 778 26.880 -38.111 31.996 1.00 38.83 C ATOM 873 O SER A 778 27.403 -38.318 33.090 1.00 38.84 O ATOM 874 CB SER A 778 26.396 -35.685 32.059 1.00 38.58 C ATOM 875 OG SER A 778 25.035 -36.023 32.270 1.00 38.78 O ATOM 0 H SER A 778 25.889 -36.354 29.772 1.00 38.45 H new ATOM 0 HA SER A 778 28.051 -36.617 31.220 1.00 39.02 H new ATOM 0 HB2 SER A 778 26.840 -35.555 32.912 1.00 38.58 H new ATOM 0 HB3 SER A 778 26.457 -34.846 31.576 1.00 38.58 H new ATOM 0 HG SER A 778 24.696 -36.286 31.548 1.00 38.78 H new ATOM 876 N ARG A 779 26.093 -38.994 31.389 1.00 39.10 N ATOM 877 CA ARG A 779 25.778 -40.298 31.971 1.00 39.58 C ATOM 878 C ARG A 779 24.929 -40.193 33.243 1.00 39.69 C ATOM 879 O ARG A 779 24.856 -41.127 34.038 1.00 38.59 O ATOM 880 CB ARG A 779 27.070 -41.080 32.247 1.00 40.83 C ATOM 881 CG ARG A 779 27.889 -41.327 30.980 1.00 41.74 C ATOM 882 CD ARG A 779 29.200 -42.059 31.245 1.00 44.41 C ATOM 883 NE ARG A 779 30.036 -42.075 30.046 1.00 47.60 N ATOM 884 CZ ARG A 779 31.265 -42.579 29.987 1.00 48.28 C ATOM 885 NH1 ARG A 779 31.814 -43.122 31.062 1.00 49.56 N ATOM 886 NH2 ARG A 779 31.955 -42.517 28.858 1.00 48.27 N ATOM 0 H ARG A 779 25.724 -38.854 30.625 1.00 39.10 H new ATOM 0 HA ARG A 779 25.242 -40.778 31.320 1.00 39.58 H new ATOM 0 HB2 ARG A 779 27.610 -40.590 32.887 1.00 40.83 H new ATOM 0 HB3 ARG A 779 26.848 -41.931 32.656 1.00 40.83 H new ATOM 0 HG2 ARG A 779 27.358 -41.844 30.354 1.00 41.74 H new ATOM 0 HG3 ARG A 779 28.081 -40.476 30.555 1.00 41.74 H new ATOM 0 HD2 ARG A 779 29.676 -41.626 31.971 1.00 44.41 H new ATOM 0 HD3 ARG A 779 29.016 -42.968 31.529 1.00 44.41 H new ATOM 0 HE ARG A 779 29.710 -41.734 29.327 1.00 47.60 H new ATOM 0 HH11 ARG A 779 31.376 -43.150 31.801 1.00 49.56 H new ATOM 0 HH12 ARG A 779 32.609 -43.447 31.021 1.00 49.56 H new ATOM 0 HH21 ARG A 779 31.608 -42.150 28.162 1.00 48.27 H new ATOM 0 HH22 ARG A 779 32.750 -42.843 28.821 1.00 48.27 H new ATOM 887 N MET A 780 24.289 -39.048 33.440 1.00 39.82 N ATOM 888 CA MET A 780 23.425 -38.874 34.599 1.00 41.23 C ATOM 889 C MET A 780 22.106 -38.261 34.156 1.00 38.54 C ATOM 890 O MET A 780 21.626 -37.281 34.719 1.00 38.59 O ATOM 891 CB MET A 780 24.108 -38.019 35.679 1.00 44.03 C ATOM 892 CG MET A 780 24.876 -36.816 35.193 1.00 47.03 C ATOM 893 SD MET A 780 25.641 -35.934 36.594 1.00 51.82 S ATOM 894 CE MET A 780 24.518 -34.550 36.770 1.00 50.72 C ATOM 0 H MET A 780 24.340 -38.365 32.920 1.00 39.82 H new ATOM 0 HA MET A 780 23.249 -39.741 34.996 1.00 41.23 H new ATOM 0 HB2 MET A 780 23.429 -37.715 36.301 1.00 44.03 H new ATOM 0 HB3 MET A 780 24.716 -38.587 36.178 1.00 44.03 H new ATOM 0 HG2 MET A 780 25.562 -37.095 34.567 1.00 47.03 H new ATOM 0 HG3 MET A 780 24.281 -36.218 34.714 1.00 47.03 H new ATOM 0 HE1 MET A 780 24.814 -33.984 37.500 1.00 50.72 H new ATOM 0 HE2 MET A 780 24.506 -34.036 35.947 1.00 50.72 H new ATOM 0 HE3 MET A 780 23.625 -34.879 36.959 1.00 50.72 H new ATOM 895 N TYR A 781 21.523 -38.878 33.136 1.00 38.27 N ATOM 896 CA TYR A 781 20.270 -38.425 32.561 1.00 36.75 C ATOM 897 C TYR A 781 19.101 -38.584 33.531 1.00 36.41 C ATOM 898 O TYR A 781 18.287 -37.672 33.670 1.00 37.20 O ATOM 899 CB TYR A 781 20.006 -39.189 31.255 1.00 37.41 C ATOM 900 CG TYR A 781 18.776 -38.742 30.492 1.00 38.99 C ATOM 901 CD1 TYR A 781 17.494 -39.047 30.951 1.00 38.24 C ATOM 902 CD2 TYR A 781 18.896 -38.008 29.311 1.00 39.98 C ATOM 903 CE1 TYR A 781 16.361 -38.630 30.255 1.00 37.53 C ATOM 904 CE2 TYR A 781 17.770 -37.588 28.607 1.00 40.57 C ATOM 905 CZ TYR A 781 16.503 -37.902 29.086 1.00 40.50 C ATOM 906 OH TYR A 781 15.383 -37.479 28.397 1.00 39.78 O ATOM 0 H TYR A 781 21.849 -39.578 32.756 1.00 38.27 H new ATOM 0 HA TYR A 781 20.347 -37.476 32.373 1.00 36.75 H new ATOM 0 HB2 TYR A 781 20.780 -39.095 30.678 1.00 37.41 H new ATOM 0 HB3 TYR A 781 19.918 -40.133 31.460 1.00 37.41 H new ATOM 0 HD1 TYR A 781 17.394 -39.537 31.735 1.00 38.24 H new ATOM 0 HD2 TYR A 781 19.742 -37.796 28.989 1.00 39.98 H new ATOM 0 HE1 TYR A 781 15.513 -38.840 30.574 1.00 37.53 H new ATOM 0 HE2 TYR A 781 17.865 -37.100 27.821 1.00 40.57 H new ATOM 0 HH TYR A 781 15.612 -36.945 27.790 1.00 39.78 H new ATOM 907 N SER A 782 19.013 -39.727 34.203 1.00 35.78 N ATOM 908 CA SER A 782 17.919 -39.933 35.141 1.00 37.65 C ATOM 909 C SER A 782 18.003 -38.924 36.279 1.00 37.88 C ATOM 910 O SER A 782 16.980 -38.396 36.728 1.00 36.78 O ATOM 911 CB SER A 782 17.913 -41.372 35.683 1.00 38.48 C ATOM 912 OG SER A 782 19.181 -41.773 36.170 1.00 44.05 O ATOM 0 H SER A 782 19.565 -40.383 34.132 1.00 35.78 H new ATOM 0 HA SER A 782 17.084 -39.796 34.667 1.00 37.65 H new ATOM 0 HB2 SER A 782 17.259 -41.443 36.396 1.00 38.48 H new ATOM 0 HB3 SER A 782 17.633 -41.978 34.979 1.00 38.48 H new ATOM 0 HG SER A 782 19.671 -41.097 36.267 1.00 44.05 H new ATOM 913 N GLN A 783 19.218 -38.630 36.738 1.00 36.29 N ATOM 914 CA GLN A 783 19.362 -37.656 37.809 1.00 36.87 C ATOM 915 C GLN A 783 18.970 -36.274 37.305 1.00 35.57 C ATOM 916 O GLN A 783 18.314 -35.508 38.019 1.00 36.31 O ATOM 917 CB GLN A 783 20.794 -37.640 38.346 1.00 37.45 C ATOM 918 CG GLN A 783 21.180 -38.922 39.057 1.00 38.54 C ATOM 919 CD GLN A 783 21.754 -39.954 38.119 1.00 40.43 C ATOM 920 OE1 GLN A 783 21.492 -39.932 36.916 1.00 40.43 O ATOM 921 NE2 GLN A 783 22.541 -40.875 38.666 1.00 43.88 N ATOM 0 H GLN A 783 19.952 -38.974 36.450 1.00 36.29 H new ATOM 0 HA GLN A 783 18.773 -37.909 38.537 1.00 36.87 H new ATOM 0 HB2 GLN A 783 21.407 -37.488 37.610 1.00 37.45 H new ATOM 0 HB3 GLN A 783 20.895 -36.894 38.958 1.00 37.45 H new ATOM 0 HG2 GLN A 783 21.830 -38.721 39.749 1.00 38.54 H new ATOM 0 HG3 GLN A 783 20.399 -39.290 39.499 1.00 38.54 H new ATOM 0 HE21 GLN A 783 22.701 -40.857 39.511 1.00 43.88 H new ATOM 0 HE22 GLN A 783 22.890 -41.489 38.175 1.00 43.88 H new ATOM 922 N CYS A 784 19.357 -35.960 36.068 1.00 35.15 N ATOM 923 CA CYS A 784 19.020 -34.663 35.484 1.00 34.59 C ATOM 924 C CYS A 784 17.510 -34.518 35.320 1.00 33.47 C ATOM 925 O CYS A 784 16.970 -33.428 35.469 1.00 35.50 O ATOM 926 CB CYS A 784 19.714 -34.476 34.128 1.00 34.25 C ATOM 927 SG CYS A 784 21.530 -34.233 34.218 1.00 36.43 S ATOM 0 H CYS A 784 19.811 -36.479 35.555 1.00 35.15 H new ATOM 0 HA CYS A 784 19.335 -33.975 36.091 1.00 34.59 H new ATOM 0 HB2 CYS A 784 19.532 -35.253 33.576 1.00 34.25 H new ATOM 0 HB3 CYS A 784 19.320 -33.711 33.680 1.00 34.25 H new ATOM 0 HG CYS A 784 22.064 -35.283 34.448 1.00 36.43 H new ATOM 928 N VAL A 785 16.824 -35.612 35.006 1.00 35.37 N ATOM 929 CA VAL A 785 15.374 -35.551 34.852 1.00 35.60 C ATOM 930 C VAL A 785 14.762 -35.145 36.190 1.00 35.33 C ATOM 931 O VAL A 785 13.899 -34.272 36.249 1.00 35.92 O ATOM 932 CB VAL A 785 14.793 -36.913 34.410 1.00 36.16 C ATOM 933 CG1 VAL A 785 13.290 -36.949 34.675 1.00 36.01 C ATOM 934 CG2 VAL A 785 15.062 -37.131 32.923 1.00 35.10 C ATOM 0 H VAL A 785 17.172 -36.388 34.879 1.00 35.37 H new ATOM 0 HA VAL A 785 15.160 -34.902 34.164 1.00 35.60 H new ATOM 0 HB VAL A 785 15.220 -37.620 34.918 1.00 36.16 H new ATOM 0 HG11 VAL A 785 12.932 -37.806 34.395 1.00 36.01 H new ATOM 0 HG12 VAL A 785 13.125 -36.824 35.623 1.00 36.01 H new ATOM 0 HG13 VAL A 785 12.856 -36.240 34.176 1.00 36.01 H new ATOM 0 HG21 VAL A 785 14.696 -37.987 32.650 1.00 35.10 H new ATOM 0 HG22 VAL A 785 14.643 -36.422 32.411 1.00 35.10 H new ATOM 0 HG23 VAL A 785 16.019 -37.123 32.762 1.00 35.10 H new ATOM 935 N ARG A 786 15.220 -35.770 37.270 1.00 36.18 N ATOM 936 CA ARG A 786 14.700 -35.433 38.591 1.00 36.87 C ATOM 937 C ARG A 786 14.988 -33.978 38.953 1.00 35.13 C ATOM 938 O ARG A 786 14.152 -33.302 39.558 1.00 33.36 O ATOM 939 CB ARG A 786 15.277 -36.383 39.642 1.00 39.40 C ATOM 940 CG ARG A 786 14.853 -37.826 39.410 1.00 42.24 C ATOM 941 CD ARG A 786 15.211 -38.718 40.573 1.00 46.00 C ATOM 942 NE ARG A 786 14.466 -38.362 41.777 1.00 50.36 N ATOM 943 CZ ARG A 786 14.574 -39.005 42.936 1.00 51.60 C ATOM 944 NH1 ARG A 786 15.398 -40.039 43.048 1.00 52.53 N ATOM 945 NH2 ARG A 786 13.854 -38.616 43.979 1.00 53.16 N ATOM 0 H ARG A 786 15.823 -36.383 37.261 1.00 36.18 H new ATOM 0 HA ARG A 786 13.736 -35.539 38.571 1.00 36.87 H new ATOM 0 HB2 ARG A 786 16.245 -36.326 39.629 1.00 39.40 H new ATOM 0 HB3 ARG A 786 14.988 -36.101 40.524 1.00 39.40 H new ATOM 0 HG2 ARG A 786 13.895 -37.860 39.261 1.00 42.24 H new ATOM 0 HG3 ARG A 786 15.278 -38.161 38.605 1.00 42.24 H new ATOM 0 HD2 ARG A 786 15.028 -39.642 40.341 1.00 46.00 H new ATOM 0 HD3 ARG A 786 16.162 -38.653 40.750 1.00 46.00 H new ATOM 0 HE ARG A 786 13.924 -37.696 41.734 1.00 50.36 H new ATOM 0 HH11 ARG A 786 15.863 -40.294 42.371 1.00 52.53 H new ATOM 0 HH12 ARG A 786 15.467 -40.454 43.798 1.00 52.53 H new ATOM 0 HH21 ARG A 786 13.317 -37.948 43.906 1.00 53.16 H new ATOM 0 HH22 ARG A 786 13.924 -39.032 44.729 1.00 53.16 H new ATOM 946 N MET A 787 16.157 -33.476 38.563 1.00 34.17 N ATOM 947 CA MET A 787 16.476 -32.089 38.868 1.00 34.49 C ATOM 948 C MET A 787 15.561 -31.173 38.061 1.00 36.11 C ATOM 949 O MET A 787 15.152 -30.113 38.541 1.00 34.08 O ATOM 950 CB MET A 787 17.957 -31.792 38.581 1.00 33.73 C ATOM 951 CG MET A 787 18.898 -32.461 39.577 1.00 33.85 C ATOM 952 SD MET A 787 20.643 -31.937 39.482 1.00 33.96 S ATOM 953 CE MET A 787 21.216 -32.988 38.186 1.00 33.25 C ATOM 0 H MET A 787 16.763 -33.909 38.133 1.00 34.17 H new ATOM 0 HA MET A 787 16.329 -31.926 39.813 1.00 34.49 H new ATOM 0 HB2 MET A 787 18.175 -32.092 37.685 1.00 33.73 H new ATOM 0 HB3 MET A 787 18.100 -30.833 38.601 1.00 33.73 H new ATOM 0 HG2 MET A 787 18.572 -32.286 40.474 1.00 33.85 H new ATOM 0 HG3 MET A 787 18.857 -33.421 39.443 1.00 33.85 H new ATOM 0 HE1 MET A 787 22.180 -33.081 38.247 1.00 33.25 H new ATOM 0 HE2 MET A 787 20.801 -33.861 38.270 1.00 33.25 H new ATOM 0 HE3 MET A 787 20.982 -32.601 37.328 1.00 33.25 H new ATOM 954 N ARG A 788 15.224 -31.589 36.841 1.00 38.09 N ATOM 955 CA ARG A 788 14.330 -30.790 36.009 1.00 40.25 C ATOM 956 C ARG A 788 12.954 -30.741 36.687 1.00 38.73 C ATOM 957 O ARG A 788 12.315 -29.688 36.726 1.00 38.87 O ATOM 958 CB ARG A 788 14.200 -31.393 34.602 1.00 43.16 C ATOM 959 CG ARG A 788 14.228 -30.352 33.480 1.00 50.61 C ATOM 960 CD ARG A 788 13.321 -30.714 32.294 1.00 53.48 C ATOM 961 NE ARG A 788 13.624 -32.016 31.701 1.00 57.38 N ATOM 962 CZ ARG A 788 12.769 -33.037 31.662 1.00 59.85 C ATOM 963 NH1 ARG A 788 11.553 -32.910 32.184 1.00 60.24 N ATOM 964 NH2 ARG A 788 13.125 -34.186 31.097 1.00 59.74 N ATOM 0 H ARG A 788 15.498 -32.321 36.481 1.00 38.09 H new ATOM 0 HA ARG A 788 14.693 -29.896 35.914 1.00 40.25 H new ATOM 0 HB2 ARG A 788 14.921 -32.026 34.463 1.00 43.16 H new ATOM 0 HB3 ARG A 788 13.370 -31.892 34.548 1.00 43.16 H new ATOM 0 HG2 ARG A 788 13.955 -29.493 33.838 1.00 50.61 H new ATOM 0 HG3 ARG A 788 15.139 -30.251 33.163 1.00 50.61 H new ATOM 0 HD2 ARG A 788 12.397 -30.709 32.590 1.00 53.48 H new ATOM 0 HD3 ARG A 788 13.404 -30.029 31.612 1.00 53.48 H new ATOM 0 HE ARG A 788 14.403 -32.130 31.356 1.00 57.38 H new ATOM 0 HH11 ARG A 788 11.317 -32.167 32.548 1.00 60.24 H new ATOM 0 HH12 ARG A 788 11.003 -33.570 32.158 1.00 60.24 H new ATOM 0 HH21 ARG A 788 13.909 -34.272 30.755 1.00 59.74 H new ATOM 0 HH22 ARG A 788 12.571 -34.843 31.073 1.00 59.74 H new ATOM 965 N HIS A 789 12.505 -31.879 37.217 1.00 38.59 N ATOM 966 CA HIS A 789 11.214 -31.947 37.915 1.00 40.46 C ATOM 967 C HIS A 789 11.212 -30.974 39.088 1.00 39.79 C ATOM 968 O HIS A 789 10.249 -30.241 39.296 1.00 39.91 O ATOM 969 CB HIS A 789 10.948 -33.364 38.447 1.00 41.75 C ATOM 970 CG HIS A 789 10.695 -34.382 37.376 1.00 44.92 C ATOM 971 ND1 HIS A 789 10.616 -35.734 37.639 1.00 45.19 N ATOM 972 CD2 HIS A 789 10.498 -34.247 36.043 1.00 45.58 C ATOM 973 CE1 HIS A 789 10.382 -36.387 36.516 1.00 44.82 C ATOM 974 NE2 HIS A 789 10.306 -35.509 35.532 1.00 46.24 N ATOM 0 H HIS A 789 12.931 -32.625 37.185 1.00 38.59 H new ATOM 0 HA HIS A 789 10.518 -31.712 37.282 1.00 40.46 H new ATOM 0 HB2 HIS A 789 11.709 -33.648 38.977 1.00 41.75 H new ATOM 0 HB3 HIS A 789 10.182 -33.337 39.042 1.00 41.75 H new ATOM 0 HD2 HIS A 789 10.493 -33.450 35.563 1.00 45.58 H new ATOM 0 HE1 HIS A 789 10.287 -37.308 36.432 1.00 44.82 H new ATOM 0 HE2 HIS A 789 10.160 -35.696 34.705 1.00 46.24 H new ATOM 975 N LEU A 790 12.294 -30.978 39.863 1.00 39.83 N ATOM 976 CA LEU A 790 12.407 -30.074 41.004 1.00 39.07 C ATOM 977 C LEU A 790 12.260 -28.647 40.499 1.00 38.31 C ATOM 978 O LEU A 790 11.495 -27.848 41.045 1.00 38.68 O ATOM 979 CB LEU A 790 13.768 -30.245 41.685 1.00 38.68 C ATOM 980 CG LEU A 790 14.097 -29.309 42.849 1.00 39.93 C ATOM 981 CD1 LEU A 790 13.116 -29.539 43.999 1.00 39.21 C ATOM 982 CD2 LEU A 790 15.534 -29.571 43.312 1.00 38.56 C ATOM 0 H LEU A 790 12.971 -31.495 39.746 1.00 39.83 H new ATOM 0 HA LEU A 790 11.714 -30.275 41.652 1.00 39.07 H new ATOM 0 HB2 LEU A 790 13.829 -31.158 42.008 1.00 38.68 H new ATOM 0 HB3 LEU A 790 14.456 -30.137 41.010 1.00 38.68 H new ATOM 0 HG LEU A 790 14.017 -28.387 42.559 1.00 39.93 H new ATOM 0 HD11 LEU A 790 13.331 -28.942 44.733 1.00 39.21 H new ATOM 0 HD12 LEU A 790 12.212 -29.363 43.694 1.00 39.21 H new ATOM 0 HD13 LEU A 790 13.181 -30.458 44.301 1.00 39.21 H new ATOM 0 HD21 LEU A 790 15.749 -28.980 44.051 1.00 38.56 H new ATOM 0 HD22 LEU A 790 15.618 -30.493 43.601 1.00 38.56 H new ATOM 0 HD23 LEU A 790 16.146 -29.406 42.578 1.00 38.56 H new ATOM 983 N SER A 791 12.992 -28.342 39.435 1.00 36.55 N ATOM 984 CA SER A 791 12.957 -27.020 38.839 1.00 37.48 C ATOM 985 C SER A 791 11.544 -26.603 38.424 1.00 37.84 C ATOM 986 O SER A 791 11.149 -25.456 38.615 1.00 38.36 O ATOM 987 CB SER A 791 13.875 -26.972 37.622 1.00 34.54 C ATOM 988 OG SER A 791 13.801 -25.695 37.019 1.00 38.80 O ATOM 0 H SER A 791 13.520 -28.895 39.041 1.00 36.55 H new ATOM 0 HA SER A 791 13.262 -26.396 39.516 1.00 37.48 H new ATOM 0 HB2 SER A 791 14.789 -27.162 37.887 1.00 34.54 H new ATOM 0 HB3 SER A 791 13.617 -27.656 36.984 1.00 34.54 H new ATOM 0 HG SER A 791 14.222 -25.139 37.487 1.00 38.80 H new ATOM 989 N GLN A 792 10.795 -27.536 37.848 1.00 39.01 N ATOM 990 CA GLN A 792 9.430 -27.262 37.409 1.00 41.57 C ATOM 991 C GLN A 792 8.494 -27.003 38.587 1.00 41.45 C ATOM 992 O GLN A 792 7.541 -26.235 38.475 1.00 42.86 O ATOM 993 CB GLN A 792 8.924 -28.428 36.553 1.00 42.74 C ATOM 994 CG GLN A 792 9.662 -28.525 35.218 1.00 45.91 C ATOM 995 CD GLN A 792 9.368 -29.795 34.448 1.00 47.41 C ATOM 996 OE1 GLN A 792 9.775 -30.886 34.846 1.00 50.33 O ATOM 997 NE2 GLN A 792 8.658 -29.659 33.336 1.00 48.17 N ATOM 0 H GLN A 792 11.060 -28.341 37.701 1.00 39.01 H new ATOM 0 HA GLN A 792 9.439 -26.452 36.875 1.00 41.57 H new ATOM 0 HB2 GLN A 792 9.033 -29.258 37.043 1.00 42.74 H new ATOM 0 HB3 GLN A 792 7.974 -28.319 36.389 1.00 42.74 H new ATOM 0 HG2 GLN A 792 9.423 -27.762 34.670 1.00 45.91 H new ATOM 0 HG3 GLN A 792 10.617 -28.469 35.381 1.00 45.91 H new ATOM 0 HE21 GLN A 792 8.391 -28.880 33.089 1.00 48.17 H new ATOM 0 HE22 GLN A 792 8.465 -30.350 32.862 1.00 48.17 H new ATOM 998 N GLU A 793 8.780 -27.626 39.724 1.00 41.34 N ATOM 999 CA GLU A 793 7.955 -27.433 40.908 1.00 41.35 C ATOM 1000 C GLU A 793 7.898 -25.958 41.307 1.00 41.03 C ATOM 1001 O GLU A 793 6.862 -25.473 41.770 1.00 38.25 O ATOM 1002 CB GLU A 793 8.495 -28.272 42.069 1.00 43.53 C ATOM 1003 CG GLU A 793 8.415 -29.770 41.846 1.00 47.54 C ATOM 1004 CD GLU A 793 6.996 -30.309 41.908 1.00 52.22 C ATOM 1005 OE1 GLU A 793 6.817 -31.526 41.677 1.00 55.60 O ATOM 1006 OE2 GLU A 793 6.061 -29.526 42.191 1.00 53.06 O ATOM 0 H GLU A 793 9.444 -28.162 39.830 1.00 41.34 H new ATOM 0 HA GLU A 793 7.054 -27.723 40.697 1.00 41.35 H new ATOM 0 HB2 GLU A 793 9.420 -28.028 42.228 1.00 43.53 H new ATOM 0 HB3 GLU A 793 8.001 -28.048 42.873 1.00 43.53 H new ATOM 0 HG2 GLU A 793 8.798 -29.983 40.981 1.00 47.54 H new ATOM 0 HG3 GLU A 793 8.955 -30.220 42.514 1.00 47.54 H new ATOM 1007 N PHE A 794 9.007 -25.240 41.128 1.00 39.02 N ATOM 1008 CA PHE A 794 9.034 -23.822 41.468 1.00 39.33 C ATOM 1009 C PHE A 794 7.940 -23.129 40.668 1.00 40.51 C ATOM 1010 O PHE A 794 7.277 -22.215 41.160 1.00 40.27 O ATOM 1011 CB PHE A 794 10.392 -23.192 41.127 1.00 37.21 C ATOM 1012 CG PHE A 794 11.508 -23.615 42.042 1.00 36.70 C ATOM 1013 CD1 PHE A 794 11.434 -23.370 43.413 1.00 35.03 C ATOM 1014 CD2 PHE A 794 12.639 -24.253 41.535 1.00 36.57 C ATOM 1015 CE1 PHE A 794 12.476 -23.758 44.267 1.00 35.77 C ATOM 1016 CE2 PHE A 794 13.684 -24.645 42.380 1.00 35.89 C ATOM 1017 CZ PHE A 794 13.600 -24.396 43.747 1.00 34.96 C ATOM 0 H PHE A 794 9.745 -25.552 40.815 1.00 39.02 H new ATOM 0 HA PHE A 794 8.891 -23.718 42.422 1.00 39.33 H new ATOM 0 HB2 PHE A 794 10.627 -23.426 40.215 1.00 37.21 H new ATOM 0 HB3 PHE A 794 10.308 -22.226 41.159 1.00 37.21 H new ATOM 0 HD1 PHE A 794 10.685 -22.945 43.765 1.00 35.03 H new ATOM 0 HD2 PHE A 794 12.700 -24.421 40.622 1.00 36.57 H new ATOM 0 HE1 PHE A 794 12.417 -23.590 45.180 1.00 35.77 H new ATOM 0 HE2 PHE A 794 14.433 -25.071 42.029 1.00 35.89 H new ATOM 0 HZ PHE A 794 14.292 -24.655 44.312 1.00 34.96 H new ATOM 1018 N GLY A 795 7.770 -23.571 39.427 1.00 41.31 N ATOM 1019 CA GLY A 795 6.746 -23.001 38.573 1.00 43.88 C ATOM 1020 C GLY A 795 5.357 -23.502 38.940 1.00 44.89 C ATOM 1021 O GLY A 795 4.425 -22.713 39.096 1.00 44.90 O ATOM 0 H GLY A 795 8.236 -24.197 39.065 1.00 41.31 H new ATOM 0 HA2 GLY A 795 6.769 -22.034 38.642 1.00 43.88 H new ATOM 0 HA3 GLY A 795 6.936 -23.224 37.648 1.00 43.88 H new ATOM 1022 N TRP A 796 5.222 -24.815 39.093 1.00 46.39 N ATOM 1023 CA TRP A 796 3.936 -25.416 39.427 1.00 48.78 C ATOM 1024 C TRP A 796 3.352 -24.910 40.740 1.00 49.50 C ATOM 1025 O TRP A 796 2.134 -24.757 40.859 1.00 49.42 O ATOM 1026 CB TRP A 796 4.048 -26.946 39.466 1.00 51.56 C ATOM 1027 CG TRP A 796 4.341 -27.569 38.123 1.00 55.04 C ATOM 1028 CD1 TRP A 796 3.914 -27.124 36.898 1.00 56.44 C ATOM 1029 CD2 TRP A 796 5.099 -28.761 37.871 1.00 56.52 C ATOM 1030 NE1 TRP A 796 4.361 -27.963 35.905 1.00 56.64 N ATOM 1031 CE2 TRP A 796 5.090 -28.976 36.472 1.00 57.19 C ATOM 1032 CE3 TRP A 796 5.784 -29.671 38.691 1.00 57.95 C ATOM 1033 CZ2 TRP A 796 5.744 -30.065 35.873 1.00 58.42 C ATOM 1034 CZ3 TRP A 796 6.434 -30.757 38.095 1.00 58.05 C ATOM 1035 CH2 TRP A 796 6.407 -30.941 36.698 1.00 58.40 C ATOM 0 H TRP A 796 5.866 -25.378 39.007 1.00 46.39 H new ATOM 0 HA TRP A 796 3.325 -25.146 38.724 1.00 48.78 H new ATOM 0 HB2 TRP A 796 4.749 -27.195 40.089 1.00 51.56 H new ATOM 0 HB3 TRP A 796 3.219 -27.314 39.810 1.00 51.56 H new ATOM 0 HD1 TRP A 796 3.396 -26.364 36.759 1.00 56.44 H new ATOM 0 HE1 TRP A 796 4.208 -27.868 35.064 1.00 56.64 H new ATOM 0 HE3 TRP A 796 5.805 -29.554 39.613 1.00 57.95 H new ATOM 0 HZ2 TRP A 796 5.729 -30.189 34.951 1.00 58.42 H new ATOM 0 HZ3 TRP A 796 6.891 -31.367 38.629 1.00 58.05 H new ATOM 0 HH2 TRP A 796 6.847 -31.671 36.327 1.00 58.40 H new ATOM 1036 N LEU A 797 4.215 -24.635 41.717 1.00 46.99 N ATOM 1037 CA LEU A 797 3.765 -24.156 43.019 1.00 44.06 C ATOM 1038 C LEU A 797 3.766 -22.641 43.156 1.00 43.25 C ATOM 1039 O LEU A 797 3.260 -22.105 44.141 1.00 44.37 O ATOM 1040 CB LEU A 797 4.633 -24.760 44.126 1.00 45.24 C ATOM 1041 CG LEU A 797 4.498 -26.267 44.341 1.00 45.11 C ATOM 1042 CD1 LEU A 797 5.594 -26.750 45.271 1.00 45.43 C ATOM 1043 CD2 LEU A 797 3.123 -26.580 44.925 1.00 45.41 C ATOM 0 H LEU A 797 5.068 -24.720 41.644 1.00 46.99 H new ATOM 0 HA LEU A 797 2.842 -24.443 43.103 1.00 44.06 H new ATOM 0 HB2 LEU A 797 5.562 -24.562 43.928 1.00 45.24 H new ATOM 0 HB3 LEU A 797 4.419 -24.313 44.960 1.00 45.24 H new ATOM 0 HG LEU A 797 4.587 -26.726 43.491 1.00 45.11 H new ATOM 0 HD11 LEU A 797 5.506 -27.707 45.406 1.00 45.43 H new ATOM 0 HD12 LEU A 797 6.460 -26.557 44.878 1.00 45.43 H new ATOM 0 HD13 LEU A 797 5.518 -26.295 46.124 1.00 45.43 H new ATOM 0 HD21 LEU A 797 3.039 -27.537 45.061 1.00 45.41 H new ATOM 0 HD22 LEU A 797 3.020 -26.123 45.774 1.00 45.41 H new ATOM 0 HD23 LEU A 797 2.435 -26.279 44.311 1.00 45.41 H new ATOM 1044 N GLN A 798 4.334 -21.946 42.179 1.00 42.02 N ATOM 1045 CA GLN A 798 4.390 -20.491 42.237 1.00 42.86 C ATOM 1046 C GLN A 798 5.198 -20.029 43.454 1.00 41.43 C ATOM 1047 O GLN A 798 4.797 -19.112 44.186 1.00 39.63 O ATOM 1048 CB GLN A 798 2.973 -19.907 42.296 1.00 46.30 C ATOM 1049 CG GLN A 798 2.086 -20.330 41.130 1.00 50.17 C ATOM 1050 CD GLN A 798 0.747 -19.611 41.126 1.00 53.77 C ATOM 1051 OE1 GLN A 798 0.685 -18.389 40.966 1.00 54.02 O ATOM 1052 NE2 GLN A 798 -0.331 -20.367 41.307 1.00 54.62 N ATOM 0 H GLN A 798 4.691 -22.294 41.478 1.00 42.02 H new ATOM 0 HA GLN A 798 4.830 -20.171 41.434 1.00 42.86 H new ATOM 0 HB2 GLN A 798 2.554 -20.180 43.127 1.00 46.30 H new ATOM 0 HB3 GLN A 798 3.031 -18.939 42.313 1.00 46.30 H new ATOM 0 HG2 GLN A 798 2.548 -20.152 40.296 1.00 50.17 H new ATOM 0 HG3 GLN A 798 1.936 -21.287 41.173 1.00 50.17 H new ATOM 0 HE21 GLN A 798 -0.248 -21.216 41.415 1.00 54.62 H new ATOM 0 HE22 GLN A 798 -1.112 -20.007 41.316 1.00 54.62 H new ATOM 1053 N ILE A 799 6.340 -20.673 43.665 1.00 38.26 N ATOM 1054 CA ILE A 799 7.214 -20.335 44.781 1.00 37.83 C ATOM 1055 C ILE A 799 7.704 -18.911 44.594 1.00 36.54 C ATOM 1056 O ILE A 799 8.175 -18.563 43.520 1.00 39.22 O ATOM 1057 CB ILE A 799 8.454 -21.272 44.827 1.00 35.43 C ATOM 1058 CG1 ILE A 799 8.010 -22.733 44.920 1.00 35.42 C ATOM 1059 CG2 ILE A 799 9.343 -20.901 45.996 1.00 36.46 C ATOM 1060 CD1 ILE A 799 7.256 -23.074 46.182 1.00 34.81 C ATOM 0 H ILE A 799 6.629 -21.314 43.169 1.00 38.26 H new ATOM 0 HA ILE A 799 6.714 -20.435 45.606 1.00 37.83 H new ATOM 0 HB ILE A 799 8.964 -21.163 44.009 1.00 35.43 H new ATOM 0 HG12 ILE A 799 7.450 -22.939 44.155 1.00 35.42 H new ATOM 0 HG13 ILE A 799 8.793 -23.302 44.860 1.00 35.42 H new ATOM 0 HG21 ILE A 799 10.113 -21.490 46.017 1.00 36.46 H new ATOM 0 HG22 ILE A 799 9.641 -19.983 45.898 1.00 36.46 H new ATOM 0 HG23 ILE A 799 8.845 -20.992 46.823 1.00 36.46 H new ATOM 0 HD11 ILE A 799 7.009 -24.012 46.168 1.00 34.81 H new ATOM 0 HD12 ILE A 799 7.819 -22.899 46.953 1.00 34.81 H new ATOM 0 HD13 ILE A 799 6.455 -22.530 46.237 1.00 34.81 H new ATOM 1061 N THR A 800 7.593 -18.087 45.632 1.00 36.85 N ATOM 1062 CA THR A 800 8.055 -16.708 45.549 1.00 38.47 C ATOM 1063 C THR A 800 9.549 -16.650 45.878 1.00 39.23 C ATOM 1064 O THR A 800 10.104 -17.597 46.430 1.00 38.23 O ATOM 1065 CB THR A 800 7.313 -15.797 46.545 1.00 39.49 C ATOM 1066 OG1 THR A 800 7.582 -16.234 47.885 1.00 40.84 O ATOM 1067 CG2 THR A 800 5.806 -15.836 46.287 1.00 40.55 C ATOM 0 H THR A 800 7.254 -18.307 46.391 1.00 36.85 H new ATOM 0 HA THR A 800 7.881 -16.396 44.647 1.00 38.47 H new ATOM 0 HB THR A 800 7.625 -14.886 46.428 1.00 39.49 H new ATOM 0 HG1 THR A 800 7.179 -15.736 48.428 1.00 40.84 H new ATOM 0 HG21 THR A 800 5.354 -15.258 46.921 1.00 40.55 H new ATOM 0 HG22 THR A 800 5.624 -15.530 45.385 1.00 40.55 H new ATOM 0 HG23 THR A 800 5.483 -16.745 46.391 1.00 40.55 H new ATOM 1068 N PRO A 801 10.218 -15.542 45.525 1.00 39.92 N ATOM 1069 CA PRO A 801 11.651 -15.415 45.813 1.00 40.21 C ATOM 1070 C PRO A 801 11.920 -15.507 47.319 1.00 40.68 C ATOM 1071 O PRO A 801 12.938 -16.050 47.739 1.00 39.33 O ATOM 1072 CB PRO A 801 11.998 -14.042 45.235 1.00 40.56 C ATOM 1073 CG PRO A 801 11.050 -13.930 44.063 1.00 41.58 C ATOM 1074 CD PRO A 801 9.754 -14.444 44.655 1.00 40.71 C ATOM 0 HA PRO A 801 12.192 -16.122 45.428 1.00 40.21 H new ATOM 0 HB2 PRO A 801 11.858 -13.332 45.881 1.00 40.56 H new ATOM 0 HB3 PRO A 801 12.925 -13.992 44.955 1.00 40.56 H new ATOM 0 HG2 PRO A 801 10.968 -13.016 43.748 1.00 41.58 H new ATOM 0 HG3 PRO A 801 11.341 -14.465 43.308 1.00 41.58 H new ATOM 0 HD2 PRO A 801 9.288 -13.757 45.157 1.00 40.71 H new ATOM 0 HD3 PRO A 801 9.143 -14.759 43.970 1.00 40.71 H new ATOM 1075 N GLN A 802 10.993 -14.987 48.121 1.00 39.67 N ATOM 1076 CA GLN A 802 11.126 -15.014 49.573 1.00 39.67 C ATOM 1077 C GLN A 802 10.998 -16.432 50.119 1.00 39.03 C ATOM 1078 O GLN A 802 11.690 -16.804 51.076 1.00 38.22 O ATOM 1079 CB GLN A 802 10.068 -14.123 50.234 1.00 41.76 C ATOM 1080 CG GLN A 802 10.097 -12.658 49.808 1.00 47.23 C ATOM 1081 CD GLN A 802 9.731 -12.455 48.341 1.00 48.88 C ATOM 1082 OE1 GLN A 802 8.831 -13.109 47.813 1.00 49.48 O ATOM 1083 NE2 GLN A 802 10.425 -11.535 47.682 1.00 53.54 N ATOM 0 H GLN A 802 10.273 -14.611 47.839 1.00 39.67 H new ATOM 0 HA GLN A 802 12.011 -14.676 49.784 1.00 39.67 H new ATOM 0 HB2 GLN A 802 9.190 -14.486 50.036 1.00 41.76 H new ATOM 0 HB3 GLN A 802 10.183 -14.168 51.196 1.00 41.76 H new ATOM 0 HG2 GLN A 802 9.481 -12.153 50.362 1.00 47.23 H new ATOM 0 HG3 GLN A 802 10.983 -12.298 49.968 1.00 47.23 H new ATOM 0 HE21 GLN A 802 11.047 -11.097 48.083 1.00 53.54 H new ATOM 0 HE22 GLN A 802 10.252 -11.377 46.854 1.00 53.54 H new ATOM 1084 N GLU A 803 10.104 -17.219 49.526 1.00 36.62 N ATOM 1085 CA GLU A 803 9.913 -18.593 49.963 1.00 34.53 C ATOM 1086 C GLU A 803 11.156 -19.384 49.576 1.00 35.01 C ATOM 1087 O GLU A 803 11.661 -20.197 50.358 1.00 34.24 O ATOM 1088 CB GLU A 803 8.668 -19.207 49.307 1.00 35.39 C ATOM 1089 CG GLU A 803 7.363 -18.543 49.752 1.00 38.69 C ATOM 1090 CD GLU A 803 6.137 -19.091 49.038 1.00 40.68 C ATOM 1091 OE1 GLU A 803 6.247 -19.437 47.842 1.00 39.54 O ATOM 1092 OE2 GLU A 803 5.061 -19.159 49.673 1.00 43.45 O ATOM 0 H GLU A 803 9.601 -16.976 48.872 1.00 36.62 H new ATOM 0 HA GLU A 803 9.780 -18.618 50.923 1.00 34.53 H new ATOM 0 HB2 GLU A 803 8.749 -19.135 48.343 1.00 35.39 H new ATOM 0 HB3 GLU A 803 8.631 -20.153 49.518 1.00 35.39 H new ATOM 0 HG2 GLU A 803 7.255 -18.665 50.708 1.00 38.69 H new ATOM 0 HG3 GLU A 803 7.422 -17.588 49.593 1.00 38.69 H new ATOM 1093 N PHE A 804 11.649 -19.129 48.369 1.00 32.15 N ATOM 1094 CA PHE A 804 12.834 -19.807 47.881 1.00 33.35 C ATOM 1095 C PHE A 804 14.014 -19.580 48.831 1.00 31.72 C ATOM 1096 O PHE A 804 14.701 -20.526 49.223 1.00 29.43 O ATOM 1097 CB PHE A 804 13.184 -19.301 46.481 1.00 32.29 C ATOM 1098 CG PHE A 804 14.597 -19.602 46.070 1.00 33.49 C ATOM 1099 CD1 PHE A 804 14.995 -20.902 45.780 1.00 31.28 C ATOM 1100 CD2 PHE A 804 15.538 -18.583 45.999 1.00 31.34 C ATOM 1101 CE1 PHE A 804 16.316 -21.183 45.425 1.00 33.71 C ATOM 1102 CE2 PHE A 804 16.858 -18.854 45.644 1.00 31.17 C ATOM 1103 CZ PHE A 804 17.246 -20.155 45.357 1.00 32.10 C ATOM 0 H PHE A 804 11.308 -18.564 47.818 1.00 32.15 H new ATOM 0 HA PHE A 804 12.651 -20.759 47.840 1.00 33.35 H new ATOM 0 HB2 PHE A 804 12.576 -19.701 45.839 1.00 32.29 H new ATOM 0 HB3 PHE A 804 13.042 -18.342 46.447 1.00 32.29 H new ATOM 0 HD1 PHE A 804 14.374 -21.593 45.823 1.00 31.28 H new ATOM 0 HD2 PHE A 804 15.284 -17.709 46.191 1.00 31.34 H new ATOM 0 HE1 PHE A 804 16.572 -22.057 45.235 1.00 33.71 H new ATOM 0 HE2 PHE A 804 17.479 -18.163 45.599 1.00 31.17 H new ATOM 0 HZ PHE A 804 18.127 -20.338 45.120 1.00 32.10 H new ATOM 1104 N LEU A 805 14.226 -18.324 49.208 1.00 32.84 N ATOM 1105 CA LEU A 805 15.328 -17.963 50.092 1.00 34.55 C ATOM 1106 C LEU A 805 15.238 -18.603 51.471 1.00 34.05 C ATOM 1107 O LEU A 805 16.243 -19.094 51.985 1.00 32.33 O ATOM 1108 CB LEU A 805 15.431 -16.438 50.212 1.00 34.44 C ATOM 1109 CG LEU A 805 15.857 -15.688 48.941 1.00 37.69 C ATOM 1110 CD1 LEU A 805 15.832 -14.185 49.197 1.00 37.66 C ATOM 1111 CD2 LEU A 805 17.258 -16.117 48.519 1.00 38.68 C ATOM 0 H LEU A 805 13.738 -17.660 48.960 1.00 32.84 H new ATOM 0 HA LEU A 805 16.135 -18.316 49.685 1.00 34.55 H new ATOM 0 HB2 LEU A 805 14.569 -16.095 50.495 1.00 34.44 H new ATOM 0 HB3 LEU A 805 16.064 -16.229 50.917 1.00 34.44 H new ATOM 0 HG LEU A 805 15.236 -15.903 48.227 1.00 37.69 H new ATOM 0 HD11 LEU A 805 16.102 -13.715 48.392 1.00 37.66 H new ATOM 0 HD12 LEU A 805 14.934 -13.914 49.444 1.00 37.66 H new ATOM 0 HD13 LEU A 805 16.444 -13.969 49.918 1.00 37.66 H new ATOM 0 HD21 LEU A 805 17.516 -15.637 47.716 1.00 38.68 H new ATOM 0 HD22 LEU A 805 17.886 -15.917 49.231 1.00 38.68 H new ATOM 0 HD23 LEU A 805 17.265 -17.071 48.341 1.00 38.68 H new ATOM 1112 N CYS A 806 14.047 -18.621 52.071 1.00 33.20 N ATOM 1113 CA CYS A 806 13.900 -19.228 53.390 1.00 33.14 C ATOM 1114 C CYS A 806 14.050 -20.740 53.332 1.00 32.94 C ATOM 1115 O CYS A 806 14.595 -21.359 54.258 1.00 31.38 O ATOM 1116 CB CYS A 806 12.549 -18.888 54.010 1.00 34.26 C ATOM 1117 SG ACYS A 806 12.456 -19.362 55.743 0.50 41.26 S ATOM 1118 SG BCYS A 806 12.312 -17.131 54.319 0.50 35.74 S ATOM 0 H CYS A 806 13.325 -18.293 51.737 1.00 33.20 H new ATOM 0 HA CYS A 806 14.608 -18.861 53.942 1.00 33.14 H new ATOM 0 HB2ACYS A 806 12.388 -17.935 53.928 0.50 34.26 H new ATOM 0 HB2BCYS A 806 11.845 -19.202 53.422 0.50 34.26 H new ATOM 0 HB3ACYS A 806 11.846 -19.338 53.515 0.50 34.26 H new ATOM 0 HB3BCYS A 806 12.456 -19.370 54.847 0.50 34.26 H new ATOM 0 HG ACYS A 806 12.058 -18.434 56.391 0.50 35.74 H new ATOM 0 HG BCYS A 806 12.023 -16.579 53.293 0.50 35.74 H new ATOM 1119 N MET A 807 13.548 -21.337 52.256 1.00 30.79 N ATOM 1120 CA MET A 807 13.651 -22.775 52.078 1.00 30.69 C ATOM 1121 C MET A 807 15.114 -23.173 51.874 1.00 27.62 C ATOM 1122 O MET A 807 15.558 -24.187 52.390 1.00 24.90 O ATOM 1123 CB MET A 807 12.831 -23.242 50.865 1.00 27.86 C ATOM 1124 CG MET A 807 11.336 -23.394 51.139 1.00 32.11 C ATOM 1125 SD MET A 807 10.487 -24.193 49.775 1.00 34.99 S ATOM 1126 CE MET A 807 10.402 -22.886 48.664 1.00 28.35 C ATOM 0 H MET A 807 13.144 -20.925 51.618 1.00 30.79 H new ATOM 0 HA MET A 807 13.300 -23.200 52.876 1.00 30.69 H new ATOM 0 HB2 MET A 807 12.954 -22.608 50.141 1.00 27.86 H new ATOM 0 HB3 MET A 807 13.181 -24.093 50.559 1.00 27.86 H new ATOM 0 HG2 MET A 807 11.207 -23.912 51.949 1.00 32.11 H new ATOM 0 HG3 MET A 807 10.945 -22.520 51.296 1.00 32.11 H new ATOM 0 HE1 MET A 807 9.955 -23.178 47.854 1.00 28.35 H new ATOM 0 HE2 MET A 807 9.905 -22.154 49.062 1.00 28.35 H new ATOM 0 HE3 MET A 807 11.299 -22.586 48.447 1.00 28.35 H new ATOM 1127 N LYS A 808 15.852 -22.372 51.116 1.00 27.33 N ATOM 1128 CA LYS A 808 17.246 -22.695 50.852 1.00 28.32 C ATOM 1129 C LYS A 808 18.058 -22.614 52.141 1.00 28.51 C ATOM 1130 O LYS A 808 18.919 -23.454 52.391 1.00 28.44 O ATOM 1131 CB LYS A 808 17.832 -21.757 49.792 1.00 27.08 C ATOM 1132 CG LYS A 808 19.250 -22.139 49.375 1.00 29.67 C ATOM 1133 CD LYS A 808 19.597 -21.639 47.963 1.00 29.45 C ATOM 1134 CE LYS A 808 19.599 -20.120 47.895 1.00 27.32 C ATOM 1135 NZ LYS A 808 20.527 -19.560 48.924 1.00 27.60 N ATOM 0 H LYS A 808 15.570 -21.647 50.750 1.00 27.33 H new ATOM 0 HA LYS A 808 17.290 -23.602 50.510 1.00 28.32 H new ATOM 0 HB2 LYS A 808 17.258 -21.762 49.010 1.00 27.08 H new ATOM 0 HB3 LYS A 808 17.835 -20.850 50.136 1.00 27.08 H new ATOM 0 HG2 LYS A 808 19.883 -21.770 50.011 1.00 29.67 H new ATOM 0 HG3 LYS A 808 19.346 -23.104 49.407 1.00 29.67 H new ATOM 0 HD2 LYS A 808 20.469 -21.977 47.704 1.00 29.45 H new ATOM 0 HD3 LYS A 808 18.955 -21.992 47.327 1.00 29.45 H new ATOM 0 HE2 LYS A 808 19.872 -19.829 47.011 1.00 27.32 H new ATOM 0 HE3 LYS A 808 18.702 -19.782 48.040 1.00 27.32 H new ATOM 0 HZ1 LYS A 808 20.783 -18.743 48.680 1.00 27.60 H new ATOM 0 HZ2 LYS A 808 20.110 -19.518 49.709 1.00 27.60 H new ATOM 0 HZ3 LYS A 808 21.242 -20.085 48.996 1.00 27.60 H new ATOM 1136 N ALA A 809 17.765 -21.612 52.962 1.00 28.33 N ATOM 1137 CA ALA A 809 18.468 -21.445 54.223 1.00 29.81 C ATOM 1138 C ALA A 809 18.200 -22.674 55.092 1.00 32.18 C ATOM 1139 O ALA A 809 19.099 -23.192 55.756 1.00 30.89 O ATOM 1140 CB ALA A 809 17.997 -20.173 54.923 1.00 28.56 C ATOM 0 H ALA A 809 17.162 -21.019 52.806 1.00 28.33 H new ATOM 0 HA ALA A 809 19.421 -21.361 54.066 1.00 29.81 H new ATOM 0 HB1 ALA A 809 18.472 -20.071 55.763 1.00 28.56 H new ATOM 0 HB2 ALA A 809 18.175 -19.406 54.356 1.00 28.56 H new ATOM 0 HB3 ALA A 809 17.044 -20.232 55.096 1.00 28.56 H new ATOM 1141 N LEU A 810 16.960 -23.155 55.066 1.00 31.47 N ATOM 1142 CA LEU A 810 16.578 -24.329 55.841 1.00 31.28 C ATOM 1143 C LEU A 810 17.298 -25.600 55.368 1.00 29.94 C ATOM 1144 O LEU A 810 17.563 -26.498 56.168 1.00 31.47 O ATOM 1145 CB LEU A 810 15.054 -24.520 55.774 1.00 34.25 C ATOM 1146 CG LEU A 810 14.395 -25.364 56.865 1.00 38.73 C ATOM 1147 CD1 LEU A 810 14.762 -24.835 58.250 1.00 38.55 C ATOM 1148 CD2 LEU A 810 12.884 -25.331 56.671 1.00 41.77 C ATOM 0 H LEU A 810 16.322 -22.812 54.602 1.00 31.47 H new ATOM 0 HA LEU A 810 16.849 -24.176 56.760 1.00 31.28 H new ATOM 0 HB2 LEU A 810 14.642 -23.642 55.787 1.00 34.25 H new ATOM 0 HB3 LEU A 810 14.841 -24.921 54.917 1.00 34.25 H new ATOM 0 HG LEU A 810 14.713 -26.278 56.800 1.00 38.73 H new ATOM 0 HD11 LEU A 810 14.336 -25.382 58.929 1.00 38.55 H new ATOM 0 HD12 LEU A 810 15.725 -24.869 58.365 1.00 38.55 H new ATOM 0 HD13 LEU A 810 14.459 -23.918 58.337 1.00 38.55 H new ATOM 0 HD21 LEU A 810 12.457 -25.865 57.360 1.00 41.77 H new ATOM 0 HD22 LEU A 810 12.570 -24.415 56.731 1.00 41.77 H new ATOM 0 HD23 LEU A 810 12.662 -25.692 55.799 1.00 41.77 H new ATOM 1149 N LEU A 811 17.610 -25.692 54.076 1.00 29.15 N ATOM 1150 CA LEU A 811 18.318 -26.869 53.561 1.00 30.10 C ATOM 1151 C LEU A 811 19.709 -27.031 54.182 1.00 30.62 C ATOM 1152 O LEU A 811 20.251 -28.138 54.239 1.00 31.82 O ATOM 1153 CB LEU A 811 18.457 -26.799 52.036 1.00 30.31 C ATOM 1154 CG LEU A 811 17.296 -27.308 51.184 1.00 32.77 C ATOM 1155 CD1 LEU A 811 17.599 -27.044 49.719 1.00 33.49 C ATOM 1156 CD2 LEU A 811 17.093 -28.803 51.420 1.00 31.95 C ATOM 0 H LEU A 811 17.425 -25.094 53.486 1.00 29.15 H new ATOM 0 HA LEU A 811 17.783 -27.639 53.808 1.00 30.10 H new ATOM 0 HB2 LEU A 811 18.619 -25.873 51.795 1.00 30.31 H new ATOM 0 HB3 LEU A 811 19.250 -27.300 51.787 1.00 30.31 H new ATOM 0 HG LEU A 811 16.482 -26.843 51.432 1.00 32.77 H new ATOM 0 HD11 LEU A 811 16.864 -27.366 49.173 1.00 33.49 H new ATOM 0 HD12 LEU A 811 17.713 -26.091 49.578 1.00 33.49 H new ATOM 0 HD13 LEU A 811 18.414 -27.507 49.468 1.00 33.49 H new ATOM 0 HD21 LEU A 811 16.355 -29.119 50.876 1.00 31.95 H new ATOM 0 HD22 LEU A 811 17.901 -29.282 51.177 1.00 31.95 H new ATOM 0 HD23 LEU A 811 16.894 -28.959 52.357 1.00 31.95 H new ATOM 1157 N LEU A 812 20.298 -25.930 54.634 1.00 30.50 N ATOM 1158 CA LEU A 812 21.617 -26.002 55.260 1.00 31.28 C ATOM 1159 C LEU A 812 21.527 -26.754 56.591 1.00 32.36 C ATOM 1160 O LEU A 812 22.490 -27.382 57.034 1.00 30.75 O ATOM 1161 CB LEU A 812 22.164 -24.589 55.494 1.00 30.43 C ATOM 1162 CG LEU A 812 23.448 -24.459 56.331 1.00 32.21 C ATOM 1163 CD1 LEU A 812 24.634 -25.114 55.613 1.00 30.92 C ATOM 1164 CD2 LEU A 812 23.723 -22.999 56.577 1.00 27.66 C ATOM 0 H LEU A 812 19.959 -25.141 54.590 1.00 30.50 H new ATOM 0 HA LEU A 812 22.219 -26.480 54.669 1.00 31.28 H new ATOM 0 HB2 LEU A 812 22.328 -24.183 54.628 1.00 30.43 H new ATOM 0 HB3 LEU A 812 21.470 -24.066 55.926 1.00 30.43 H new ATOM 0 HG LEU A 812 23.327 -24.916 57.178 1.00 32.21 H new ATOM 0 HD11 LEU A 812 25.432 -25.021 56.156 1.00 30.92 H new ATOM 0 HD12 LEU A 812 24.447 -26.055 55.471 1.00 30.92 H new ATOM 0 HD13 LEU A 812 24.774 -24.680 54.757 1.00 30.92 H new ATOM 0 HD21 LEU A 812 24.532 -22.906 57.105 1.00 27.66 H new ATOM 0 HD22 LEU A 812 23.837 -22.544 55.728 1.00 27.66 H new ATOM 0 HD23 LEU A 812 22.977 -22.605 57.057 1.00 27.66 H new ATOM 1165 N PHE A 813 20.350 -26.698 57.214 1.00 32.19 N ATOM 1166 CA PHE A 813 20.110 -27.341 58.503 1.00 31.42 C ATOM 1167 C PHE A 813 19.250 -28.591 58.366 1.00 32.76 C ATOM 1168 O PHE A 813 18.467 -28.919 59.263 1.00 30.70 O ATOM 1169 CB PHE A 813 19.415 -26.345 59.436 1.00 35.02 C ATOM 1170 CG PHE A 813 20.143 -25.037 59.567 1.00 37.45 C ATOM 1171 CD1 PHE A 813 21.387 -24.980 60.193 1.00 39.14 C ATOM 1172 CD2 PHE A 813 19.610 -23.872 59.031 1.00 37.43 C ATOM 1173 CE1 PHE A 813 22.088 -23.778 60.279 1.00 38.50 C ATOM 1174 CE2 PHE A 813 20.304 -22.669 59.111 1.00 37.84 C ATOM 1175 CZ PHE A 813 21.545 -22.621 59.736 1.00 38.34 C ATOM 0 H PHE A 813 19.666 -26.284 56.898 1.00 32.19 H new ATOM 0 HA PHE A 813 20.967 -27.612 58.868 1.00 31.42 H new ATOM 0 HB2 PHE A 813 18.518 -26.176 59.107 1.00 35.02 H new ATOM 0 HB3 PHE A 813 19.324 -26.746 60.315 1.00 35.02 H new ATOM 0 HD1 PHE A 813 21.754 -25.753 60.558 1.00 39.14 H new ATOM 0 HD2 PHE A 813 18.779 -23.896 58.614 1.00 37.43 H new ATOM 0 HE1 PHE A 813 22.917 -23.751 60.699 1.00 38.50 H new ATOM 0 HE2 PHE A 813 19.937 -21.896 58.746 1.00 37.84 H new ATOM 0 HZ PHE A 813 22.010 -21.817 59.790 1.00 38.34 H new ATOM 1176 N SER A 814 19.409 -29.305 57.255 1.00 31.05 N ATOM 1177 CA SER A 814 18.591 -30.485 57.022 1.00 33.16 C ATOM 1178 C SER A 814 19.313 -31.821 56.922 1.00 33.32 C ATOM 1179 O SER A 814 18.725 -32.793 56.465 1.00 33.28 O ATOM 1180 CB SER A 814 17.738 -30.260 55.769 1.00 33.50 C ATOM 1181 OG SER A 814 16.889 -29.143 55.965 1.00 34.36 O ATOM 0 H SER A 814 19.976 -29.125 56.634 1.00 31.05 H new ATOM 0 HA SER A 814 18.057 -30.574 57.827 1.00 33.16 H new ATOM 0 HB2 SER A 814 18.310 -30.112 55.000 1.00 33.50 H new ATOM 0 HB3 SER A 814 17.209 -31.051 55.581 1.00 33.50 H new ATOM 0 HG SER A 814 17.346 -28.438 55.952 1.00 34.36 H new ATOM 1182 N ILE A 815 20.578 -31.876 57.334 1.00 33.16 N ATOM 1183 CA ILE A 815 21.332 -33.130 57.297 1.00 34.68 C ATOM 1184 C ILE A 815 22.454 -33.130 58.342 1.00 36.16 C ATOM 1185 O ILE A 815 23.364 -32.299 58.303 1.00 35.28 O ATOM 1186 CB ILE A 815 21.904 -33.413 55.879 1.00 37.21 C ATOM 1187 CG1 ILE A 815 22.623 -34.767 55.877 1.00 38.28 C ATOM 1188 CG2 ILE A 815 22.856 -32.293 55.447 1.00 40.56 C ATOM 1189 CD1 ILE A 815 23.039 -35.243 54.501 1.00 39.94 C ATOM 0 H ILE A 815 21.017 -31.202 57.638 1.00 33.16 H new ATOM 0 HA ILE A 815 20.713 -33.845 57.514 1.00 34.68 H new ATOM 0 HB ILE A 815 21.173 -33.443 55.243 1.00 37.21 H new ATOM 0 HG12 ILE A 815 23.411 -34.705 56.439 1.00 38.28 H new ATOM 0 HG13 ILE A 815 22.041 -35.432 56.277 1.00 38.28 H new ATOM 0 HG21 ILE A 815 23.203 -32.486 54.562 1.00 40.56 H new ATOM 0 HG22 ILE A 815 22.377 -31.450 55.429 1.00 40.56 H new ATOM 0 HG23 ILE A 815 23.592 -32.233 56.076 1.00 40.56 H new ATOM 0 HD11 ILE A 815 23.485 -36.101 54.576 1.00 39.94 H new ATOM 0 HD12 ILE A 815 22.254 -35.336 53.939 1.00 39.94 H new ATOM 0 HD13 ILE A 815 23.645 -34.597 54.105 1.00 39.94 H new ATOM 1190 N ILE A 816 22.366 -34.069 59.282 1.00 35.87 N ATOM 1191 CA ILE A 816 23.326 -34.170 60.376 1.00 38.34 C ATOM 1192 C ILE A 816 23.680 -35.611 60.753 1.00 38.83 C ATOM 1193 O ILE A 816 22.965 -36.550 60.412 1.00 37.91 O ATOM 1194 CB ILE A 816 22.766 -33.495 61.658 1.00 37.69 C ATOM 1195 CG1 ILE A 816 21.472 -34.188 62.081 1.00 38.72 C ATOM 1196 CG2 ILE A 816 22.490 -32.015 61.410 1.00 38.89 C ATOM 1197 CD1 ILE A 816 20.872 -33.629 63.355 1.00 39.77 C ATOM 0 H ILE A 816 21.747 -34.665 59.302 1.00 35.87 H new ATOM 0 HA ILE A 816 24.124 -33.726 60.050 1.00 38.34 H new ATOM 0 HB ILE A 816 23.428 -33.576 62.363 1.00 37.69 H new ATOM 0 HG12 ILE A 816 20.823 -34.109 61.365 1.00 38.72 H new ATOM 0 HG13 ILE A 816 21.646 -35.135 62.203 1.00 38.72 H new ATOM 0 HG21 ILE A 816 22.141 -31.610 62.220 1.00 38.89 H new ATOM 0 HG22 ILE A 816 23.314 -31.570 61.156 1.00 38.89 H new ATOM 0 HG23 ILE A 816 21.839 -31.922 60.697 1.00 38.89 H new ATOM 0 HD11 ILE A 816 20.057 -34.110 63.567 1.00 39.77 H new ATOM 0 HD12 ILE A 816 21.505 -33.730 64.083 1.00 39.77 H new ATOM 0 HD13 ILE A 816 20.669 -32.688 63.232 1.00 39.77 H new ATOM 1198 N PRO A 817 24.801 -35.800 61.467 1.00 41.05 N ATOM 1199 CA PRO A 817 25.195 -37.152 61.874 1.00 42.12 C ATOM 1200 C PRO A 817 24.187 -37.717 62.867 1.00 42.67 C ATOM 1201 O PRO A 817 23.651 -36.985 63.698 1.00 41.65 O ATOM 1202 CB PRO A 817 26.580 -36.940 62.494 1.00 42.09 C ATOM 1203 CG PRO A 817 26.544 -35.522 62.952 1.00 42.58 C ATOM 1204 CD PRO A 817 25.845 -34.824 61.824 1.00 41.01 C ATOM 0 HA PRO A 817 25.220 -37.795 61.148 1.00 42.12 H new ATOM 0 HB2 PRO A 817 26.738 -37.550 63.232 1.00 42.09 H new ATOM 0 HB3 PRO A 817 27.287 -37.088 61.847 1.00 42.09 H new ATOM 0 HG2 PRO A 817 26.062 -35.426 63.788 1.00 42.58 H new ATOM 0 HG3 PRO A 817 27.435 -35.168 63.097 1.00 42.58 H new ATOM 0 HD2 PRO A 817 25.469 -33.973 62.100 1.00 41.01 H new ATOM 0 HD3 PRO A 817 26.443 -34.643 61.082 1.00 41.01 H new ATOM 1205 N VAL A 818 23.921 -39.017 62.772 1.00 44.87 N ATOM 1206 CA VAL A 818 22.964 -39.661 63.667 1.00 47.58 C ATOM 1207 C VAL A 818 23.449 -39.599 65.115 1.00 48.69 C ATOM 1208 O VAL A 818 22.644 -39.630 66.042 1.00 48.02 O ATOM 1209 CB VAL A 818 22.729 -41.139 63.281 1.00 47.88 C ATOM 1210 CG1 VAL A 818 21.631 -41.733 64.150 1.00 50.59 C ATOM 1211 CG2 VAL A 818 22.351 -41.242 61.815 1.00 49.64 C ATOM 0 H VAL A 818 24.284 -39.543 62.197 1.00 44.87 H new ATOM 0 HA VAL A 818 22.128 -39.177 63.581 1.00 47.58 H new ATOM 0 HB VAL A 818 23.548 -41.637 63.426 1.00 47.88 H new ATOM 0 HG11 VAL A 818 21.488 -42.660 63.903 1.00 50.59 H new ATOM 0 HG12 VAL A 818 21.894 -41.684 65.082 1.00 50.59 H new ATOM 0 HG13 VAL A 818 20.809 -41.234 64.020 1.00 50.59 H new ATOM 0 HG21 VAL A 818 22.206 -42.173 61.583 1.00 49.64 H new ATOM 0 HG22 VAL A 818 21.538 -40.738 61.654 1.00 49.64 H new ATOM 0 HG23 VAL A 818 23.068 -40.881 61.270 1.00 49.64 H new ATOM 1212 N ASP A 819 24.765 -39.510 65.300 1.00 51.18 N ATOM 1213 CA ASP A 819 25.345 -39.426 66.636 1.00 53.72 C ATOM 1214 C ASP A 819 25.313 -37.986 67.140 1.00 53.83 C ATOM 1215 O ASP A 819 25.825 -37.692 68.218 1.00 55.26 O ATOM 1216 CB ASP A 819 26.795 -39.923 66.645 1.00 57.36 C ATOM 1217 CG ASP A 819 26.910 -41.414 66.376 1.00 61.78 C ATOM 1218 OD1 ASP A 819 26.176 -42.198 67.016 1.00 62.79 O ATOM 1219 OD2 ASP A 819 27.747 -41.805 65.529 1.00 65.45 O ATOM 0 H ASP A 819 25.340 -39.497 64.661 1.00 51.18 H new ATOM 0 HA ASP A 819 24.814 -39.991 67.219 1.00 53.72 H new ATOM 0 HB2 ASP A 819 27.303 -39.438 65.976 1.00 57.36 H new ATOM 0 HB3 ASP A 819 27.196 -39.722 67.505 1.00 57.36 H new ATOM 1220 N GLY A 820 24.727 -37.090 66.350 1.00 52.66 N ATOM 1221 CA GLY A 820 24.633 -35.696 66.749 1.00 50.86 C ATOM 1222 C GLY A 820 25.860 -34.836 66.493 1.00 50.75 C ATOM 1223 O GLY A 820 26.943 -35.332 66.166 1.00 49.27 O ATOM 0 H GLY A 820 24.380 -37.271 65.584 1.00 52.66 H new ATOM 0 HA2 GLY A 820 23.880 -35.297 66.286 1.00 50.86 H new ATOM 0 HA3 GLY A 820 24.432 -35.664 67.697 1.00 50.86 H new ATOM 1224 N LEU A 821 25.676 -33.528 66.650 1.00 49.05 N ATOM 1225 CA LEU A 821 26.737 -32.549 66.451 1.00 48.78 C ATOM 1226 C LEU A 821 27.370 -32.176 67.797 1.00 49.31 C ATOM 1227 O LEU A 821 26.844 -32.541 68.850 1.00 48.69 O ATOM 1228 CB LEU A 821 26.155 -31.293 65.798 1.00 46.64 C ATOM 1229 CG LEU A 821 25.578 -31.408 64.384 1.00 45.83 C ATOM 1230 CD1 LEU A 821 24.819 -30.135 64.036 1.00 45.23 C ATOM 1231 CD2 LEU A 821 26.700 -31.641 63.394 1.00 42.16 C ATOM 0 H LEU A 821 24.923 -33.181 66.878 1.00 49.05 H new ATOM 0 HA LEU A 821 27.418 -32.933 65.876 1.00 48.78 H new ATOM 0 HB2 LEU A 821 25.453 -30.957 66.377 1.00 46.64 H new ATOM 0 HB3 LEU A 821 26.853 -30.620 65.778 1.00 46.64 H new ATOM 0 HG LEU A 821 24.965 -32.158 64.343 1.00 45.83 H new ATOM 0 HD11 LEU A 821 24.455 -30.210 63.140 1.00 45.23 H new ATOM 0 HD12 LEU A 821 24.096 -30.006 64.669 1.00 45.23 H new ATOM 0 HD13 LEU A 821 25.423 -29.377 64.077 1.00 45.23 H new ATOM 0 HD21 LEU A 821 26.332 -31.714 62.499 1.00 42.16 H new ATOM 0 HD22 LEU A 821 27.322 -30.897 63.428 1.00 42.16 H new ATOM 0 HD23 LEU A 821 27.165 -32.462 63.619 1.00 42.16 H new ATOM 1232 N LYS A 822 28.494 -31.458 67.760 1.00 49.46 N ATOM 1233 CA LYS A 822 29.163 -31.024 68.988 1.00 51.27 C ATOM 1234 C LYS A 822 28.130 -30.396 69.917 1.00 51.07 C ATOM 1235 O LYS A 822 27.909 -30.872 71.029 1.00 52.27 O ATOM 1236 CB LYS A 822 30.256 -29.995 68.678 1.00 53.75 C ATOM 1237 CG LYS A 822 31.659 -30.562 68.622 1.00 56.54 C ATOM 1238 CD LYS A 822 31.801 -31.587 67.516 1.00 61.30 C ATOM 1239 CE LYS A 822 33.203 -32.173 67.502 1.00 63.91 C ATOM 1240 NZ LYS A 822 34.238 -31.107 67.365 1.00 66.14 N ATOM 0 H LYS A 822 28.885 -31.212 67.035 1.00 49.46 H new ATOM 0 HA LYS A 822 29.575 -31.794 69.410 1.00 51.27 H new ATOM 0 HB2 LYS A 822 30.056 -29.575 67.827 1.00 53.75 H new ATOM 0 HB3 LYS A 822 30.228 -29.298 69.352 1.00 53.75 H new ATOM 0 HG2 LYS A 822 32.294 -29.843 68.481 1.00 56.54 H new ATOM 0 HG3 LYS A 822 31.878 -30.971 69.474 1.00 56.54 H new ATOM 0 HD2 LYS A 822 31.151 -32.296 67.640 1.00 61.30 H new ATOM 0 HD3 LYS A 822 31.610 -31.174 66.660 1.00 61.30 H new ATOM 0 HE2 LYS A 822 33.355 -32.671 68.321 1.00 63.91 H new ATOM 0 HE3 LYS A 822 33.285 -32.802 66.768 1.00 63.91 H new ATOM 0 HZ1 LYS A 822 34.836 -31.350 66.752 1.00 66.14 H new ATOM 0 HZ2 LYS A 822 33.850 -30.346 67.115 1.00 66.14 H new ATOM 0 HZ3 LYS A 822 34.647 -30.988 68.147 1.00 66.14 H new ATOM 1241 N ASN A 823 27.509 -29.313 69.462 1.00 49.85 N ATOM 1242 CA ASN A 823 26.475 -28.654 70.243 1.00 49.69 C ATOM 1243 C ASN A 823 25.164 -28.824 69.491 1.00 47.99 C ATOM 1244 O ASN A 823 24.679 -27.907 68.826 1.00 47.14 O ATOM 1245 CB ASN A 823 26.786 -27.167 70.443 1.00 51.81 C ATOM 1246 CG ASN A 823 25.716 -26.450 71.267 1.00 55.68 C ATOM 1247 OD1 ASN A 823 25.603 -25.135 71.078 1.00 54.67 O flip ATOM 1248 ND2 ASN A 823 25.012 -27.068 72.074 1.00 57.96 N flip ATOM 0 H ASN A 823 27.673 -28.945 68.702 1.00 49.85 H new ATOM 0 HA ASN A 823 26.424 -29.051 71.126 1.00 49.69 H new ATOM 0 HB2 ASN A 823 27.645 -27.076 70.885 1.00 51.81 H new ATOM 0 HB3 ASN A 823 26.865 -26.737 69.577 1.00 51.81 H new ATOM 0 HD21 ASN A 823 25.112 -27.917 72.170 1.00 57.96 H new ATOM 0 HD22 ASN A 823 24.422 -26.649 72.539 1.00 57.96 H new ATOM 1249 N GLN A 824 24.608 -30.023 69.600 1.00 46.69 N ATOM 1250 CA GLN A 824 23.355 -30.372 68.952 1.00 46.80 C ATOM 1251 C GLN A 824 22.219 -29.465 69.410 1.00 45.06 C ATOM 1252 O GLN A 824 21.360 -29.082 68.612 1.00 45.12 O ATOM 1253 CB GLN A 824 23.015 -31.832 69.258 1.00 47.35 C ATOM 1254 CG GLN A 824 21.745 -32.354 68.600 1.00 48.00 C ATOM 1255 CD GLN A 824 21.822 -32.329 67.088 1.00 49.62 C ATOM 1256 OE1 GLN A 824 22.806 -32.780 66.498 1.00 50.60 O ATOM 1257 NE2 GLN A 824 20.777 -31.808 66.451 1.00 48.38 N ATOM 0 H GLN A 824 24.953 -30.664 70.058 1.00 46.69 H new ATOM 0 HA GLN A 824 23.461 -30.252 67.995 1.00 46.80 H new ATOM 0 HB2 GLN A 824 23.759 -32.388 68.978 1.00 47.35 H new ATOM 0 HB3 GLN A 824 22.930 -31.935 70.219 1.00 47.35 H new ATOM 0 HG2 GLN A 824 21.580 -33.262 68.897 1.00 48.00 H new ATOM 0 HG3 GLN A 824 20.990 -31.819 68.891 1.00 48.00 H new ATOM 0 HE21 GLN A 824 20.109 -31.503 66.899 1.00 48.38 H new ATOM 0 HE22 GLN A 824 20.770 -31.776 65.592 1.00 48.38 H new ATOM 1258 N LYS A 825 22.223 -29.109 70.690 1.00 43.57 N ATOM 1259 CA LYS A 825 21.166 -28.266 71.234 1.00 44.01 C ATOM 1260 C LYS A 825 21.039 -26.914 70.541 1.00 43.78 C ATOM 1261 O LYS A 825 19.921 -26.462 70.277 1.00 42.08 O ATOM 1262 CB LYS A 825 21.345 -28.087 72.747 1.00 44.96 C ATOM 1263 CG LYS A 825 21.324 -29.417 73.500 1.00 47.82 C ATOM 1264 CD LYS A 825 21.167 -29.246 75.009 1.00 50.90 C ATOM 1265 CE LYS A 825 21.422 -30.565 75.745 1.00 52.50 C ATOM 1266 NZ LYS A 825 20.683 -31.707 75.132 1.00 53.83 N ATOM 0 H LYS A 825 22.825 -29.344 71.257 1.00 43.57 H new ATOM 0 HA LYS A 825 20.333 -28.732 71.060 1.00 44.01 H new ATOM 0 HB2 LYS A 825 22.186 -27.635 72.919 1.00 44.96 H new ATOM 0 HB3 LYS A 825 20.640 -27.515 73.088 1.00 44.96 H new ATOM 0 HG2 LYS A 825 20.595 -29.962 73.164 1.00 47.82 H new ATOM 0 HG3 LYS A 825 22.146 -29.899 73.318 1.00 47.82 H new ATOM 0 HD2 LYS A 825 21.786 -28.570 75.327 1.00 50.90 H new ATOM 0 HD3 LYS A 825 20.273 -28.928 75.210 1.00 50.90 H new ATOM 0 HE2 LYS A 825 22.373 -30.757 75.740 1.00 52.50 H new ATOM 0 HE3 LYS A 825 21.157 -30.472 76.673 1.00 52.50 H new ATOM 0 HZ1 LYS A 825 20.689 -32.399 75.691 1.00 53.83 H new ATOM 0 HZ2 LYS A 825 19.842 -31.464 74.970 1.00 53.83 H new ATOM 0 HZ3 LYS A 825 21.076 -31.940 74.368 1.00 53.83 H new ATOM 1267 N PHE A 826 22.153 -26.255 70.233 1.00 41.86 N ATOM 1268 CA PHE A 826 22.001 -24.987 69.551 1.00 42.39 C ATOM 1269 C PHE A 826 21.645 -25.187 68.084 1.00 39.59 C ATOM 1270 O PHE A 826 21.021 -24.325 67.471 1.00 40.15 O ATOM 1271 CB PHE A 826 23.233 -24.092 69.620 1.00 46.42 C ATOM 1272 CG PHE A 826 23.024 -22.803 68.891 1.00 50.33 C ATOM 1273 CD1 PHE A 826 22.048 -21.903 69.330 1.00 52.41 C ATOM 1274 CD2 PHE A 826 23.657 -22.560 67.677 1.00 51.87 C ATOM 1275 CE1 PHE A 826 21.696 -20.792 68.567 1.00 51.94 C ATOM 1276 CE2 PHE A 826 23.310 -21.449 66.904 1.00 53.77 C ATOM 1277 CZ PHE A 826 22.324 -20.564 67.352 1.00 52.85 C ATOM 0 H PHE A 826 22.958 -26.509 70.400 1.00 41.86 H new ATOM 0 HA PHE A 826 21.281 -24.542 70.025 1.00 42.39 H new ATOM 0 HB2 PHE A 826 23.448 -23.908 70.548 1.00 46.42 H new ATOM 0 HB3 PHE A 826 23.994 -24.559 69.240 1.00 46.42 H new ATOM 0 HD1 PHE A 826 21.626 -22.049 70.146 1.00 52.41 H new ATOM 0 HD2 PHE A 826 24.317 -23.142 67.377 1.00 51.87 H new ATOM 0 HE1 PHE A 826 21.042 -20.205 68.872 1.00 51.94 H new ATOM 0 HE2 PHE A 826 23.735 -21.298 66.091 1.00 53.77 H new ATOM 0 HZ PHE A 826 22.091 -19.826 66.837 1.00 52.85 H new ATOM 1278 N PHE A 827 22.066 -26.303 67.505 1.00 37.24 N ATOM 1279 CA PHE A 827 21.710 -26.570 66.123 1.00 35.60 C ATOM 1280 C PHE A 827 20.192 -26.731 66.078 1.00 35.64 C ATOM 1281 O PHE A 827 19.537 -26.230 65.165 1.00 33.65 O ATOM 1282 CB PHE A 827 22.376 -27.848 65.610 1.00 33.60 C ATOM 1283 CG PHE A 827 21.790 -28.353 64.320 1.00 33.90 C ATOM 1284 CD1 PHE A 827 20.625 -29.127 64.324 1.00 35.60 C ATOM 1285 CD2 PHE A 827 22.358 -28.010 63.102 1.00 32.36 C ATOM 1286 CE1 PHE A 827 20.036 -29.544 63.135 1.00 32.49 C ATOM 1287 CE2 PHE A 827 21.775 -28.423 61.904 1.00 33.78 C ATOM 1288 CZ PHE A 827 20.606 -29.193 61.923 1.00 30.85 C ATOM 0 H PHE A 827 22.548 -26.905 67.885 1.00 37.24 H new ATOM 0 HA PHE A 827 22.012 -25.841 65.558 1.00 35.60 H new ATOM 0 HB2 PHE A 827 23.323 -27.682 65.484 1.00 33.60 H new ATOM 0 HB3 PHE A 827 22.297 -28.539 66.286 1.00 33.60 H new ATOM 0 HD1 PHE A 827 20.238 -29.367 65.135 1.00 35.60 H new ATOM 0 HD2 PHE A 827 23.135 -27.500 63.084 1.00 32.36 H new ATOM 0 HE1 PHE A 827 19.261 -30.058 63.154 1.00 32.49 H new ATOM 0 HE2 PHE A 827 22.163 -28.187 61.092 1.00 33.78 H new ATOM 0 HZ PHE A 827 20.214 -29.467 61.125 1.00 30.85 H new ATOM 1289 N ASP A 828 19.640 -27.427 67.070 1.00 35.90 N ATOM 1290 CA ASP A 828 18.197 -27.648 67.130 1.00 37.06 C ATOM 1291 C ASP A 828 17.433 -26.334 67.247 1.00 37.45 C ATOM 1292 O ASP A 828 16.403 -26.156 66.604 1.00 37.23 O ATOM 1293 CB ASP A 828 17.825 -28.570 68.305 1.00 38.80 C ATOM 1294 CG ASP A 828 18.293 -30.002 68.102 1.00 39.39 C ATOM 1295 OD1 ASP A 828 18.389 -30.444 66.940 1.00 40.15 O ATOM 1296 OD2 ASP A 828 18.556 -30.697 69.107 1.00 42.09 O ATOM 0 H ASP A 828 20.083 -27.779 67.717 1.00 35.90 H new ATOM 0 HA ASP A 828 17.942 -28.079 66.299 1.00 37.06 H new ATOM 0 HB2 ASP A 828 18.215 -28.220 69.121 1.00 38.80 H new ATOM 0 HB3 ASP A 828 16.862 -28.563 68.424 1.00 38.80 H new ATOM 1297 N GLU A 829 17.938 -25.410 68.059 1.00 38.25 N ATOM 1298 CA GLU A 829 17.271 -24.122 68.233 1.00 38.81 C ATOM 1299 C GLU A 829 17.322 -23.315 66.942 1.00 38.04 C ATOM 1300 O GLU A 829 16.340 -22.684 66.538 1.00 34.19 O ATOM 1301 CB GLU A 829 17.930 -23.314 69.355 1.00 42.29 C ATOM 1302 CG GLU A 829 17.305 -21.934 69.543 1.00 48.83 C ATOM 1303 CD GLU A 829 17.936 -21.132 70.669 1.00 54.31 C ATOM 1304 OE1 GLU A 829 19.151 -20.849 70.602 1.00 56.00 O ATOM 1305 OE2 GLU A 829 17.210 -20.778 71.623 1.00 58.37 O ATOM 0 H GLU A 829 18.660 -25.507 68.516 1.00 38.25 H new ATOM 0 HA GLU A 829 16.347 -24.298 68.468 1.00 38.81 H new ATOM 0 HB2 GLU A 829 17.863 -23.810 70.186 1.00 42.29 H new ATOM 0 HB3 GLU A 829 18.875 -23.212 69.161 1.00 42.29 H new ATOM 0 HG2 GLU A 829 17.385 -21.435 68.715 1.00 48.83 H new ATOM 0 HG3 GLU A 829 16.357 -22.037 69.721 1.00 48.83 H new ATOM 1306 N LEU A 830 18.484 -23.328 66.305 1.00 35.89 N ATOM 1307 CA LEU A 830 18.670 -22.601 65.058 1.00 37.19 C ATOM 1308 C LEU A 830 17.723 -23.138 63.984 1.00 36.29 C ATOM 1309 O LEU A 830 17.032 -22.365 63.321 1.00 35.23 O ATOM 1310 CB LEU A 830 20.123 -22.733 64.600 1.00 38.34 C ATOM 1311 CG LEU A 830 20.658 -21.692 63.618 1.00 41.92 C ATOM 1312 CD1 LEU A 830 20.427 -20.294 64.170 1.00 41.64 C ATOM 1313 CD2 LEU A 830 22.148 -21.938 63.392 1.00 41.94 C ATOM 0 H LEU A 830 19.180 -23.753 66.579 1.00 35.89 H new ATOM 0 HA LEU A 830 18.467 -21.664 65.203 1.00 37.19 H new ATOM 0 HB2 LEU A 830 20.687 -22.716 65.389 1.00 38.34 H new ATOM 0 HB3 LEU A 830 20.229 -23.608 64.194 1.00 38.34 H new ATOM 0 HG LEU A 830 20.190 -21.768 62.771 1.00 41.92 H new ATOM 0 HD11 LEU A 830 20.768 -19.638 63.543 1.00 41.64 H new ATOM 0 HD12 LEU A 830 19.477 -20.151 64.302 1.00 41.64 H new ATOM 0 HD13 LEU A 830 20.888 -20.200 65.018 1.00 41.64 H new ATOM 0 HD21 LEU A 830 22.494 -21.280 62.769 1.00 41.94 H new ATOM 0 HD22 LEU A 830 22.620 -21.863 64.236 1.00 41.94 H new ATOM 0 HD23 LEU A 830 22.278 -22.827 63.027 1.00 41.94 H new ATOM 1314 N ARG A 831 17.683 -24.461 63.827 1.00 35.82 N ATOM 1315 CA ARG A 831 16.818 -25.078 62.826 1.00 37.51 C ATOM 1316 C ARG A 831 15.365 -24.691 63.099 1.00 36.21 C ATOM 1317 O ARG A 831 14.621 -24.321 62.191 1.00 35.26 O ATOM 1318 CB ARG A 831 16.977 -26.606 62.834 1.00 37.14 C ATOM 1319 CG ARG A 831 16.046 -27.329 61.858 1.00 38.64 C ATOM 1320 CD ARG A 831 16.123 -28.855 61.986 1.00 39.37 C ATOM 1321 NE ARG A 831 14.954 -29.508 61.391 1.00 37.47 N ATOM 1322 CZ ARG A 831 14.722 -29.588 60.083 1.00 39.09 C ATOM 1323 NH1 ARG A 831 15.583 -29.066 59.223 1.00 39.26 N ATOM 1324 NH2 ARG A 831 13.611 -30.160 59.632 1.00 38.14 N ATOM 0 H ARG A 831 18.148 -25.017 64.290 1.00 35.82 H new ATOM 0 HA ARG A 831 17.075 -24.756 61.948 1.00 37.51 H new ATOM 0 HB2 ARG A 831 17.896 -26.828 62.616 1.00 37.14 H new ATOM 0 HB3 ARG A 831 16.810 -26.935 63.731 1.00 37.14 H new ATOM 0 HG2 ARG A 831 15.133 -27.041 62.014 1.00 38.64 H new ATOM 0 HG3 ARG A 831 16.273 -27.073 60.950 1.00 38.64 H new ATOM 0 HD2 ARG A 831 16.929 -29.176 61.552 1.00 39.37 H new ATOM 0 HD3 ARG A 831 16.188 -29.099 62.923 1.00 39.37 H new ATOM 0 HE ARG A 831 14.379 -29.863 61.923 1.00 37.47 H new ATOM 0 HH11 ARG A 831 16.293 -28.675 59.509 1.00 39.26 H new ATOM 0 HH12 ARG A 831 15.432 -29.118 58.378 1.00 39.26 H new ATOM 0 HH21 ARG A 831 13.037 -30.481 60.186 1.00 38.14 H new ATOM 0 HH22 ARG A 831 13.466 -30.209 58.786 1.00 38.14 H new ATOM 1325 N MET A 832 14.968 -24.771 64.361 1.00 37.07 N ATOM 1326 CA MET A 832 13.610 -24.407 64.744 1.00 38.13 C ATOM 1327 C MET A 832 13.287 -22.965 64.352 1.00 37.06 C ATOM 1328 O MET A 832 12.182 -22.671 63.901 1.00 35.63 O ATOM 1329 CB MET A 832 13.421 -24.578 66.254 1.00 38.33 C ATOM 1330 CG MET A 832 12.101 -23.997 66.769 1.00 41.12 C ATOM 1331 SD MET A 832 11.903 -24.177 68.545 1.00 44.72 S ATOM 1332 CE MET A 832 12.917 -22.848 69.151 1.00 42.69 C ATOM 0 H MET A 832 15.467 -25.033 65.010 1.00 37.07 H new ATOM 0 HA MET A 832 13.004 -24.998 64.270 1.00 38.13 H new ATOM 0 HB2 MET A 832 13.459 -25.522 66.473 1.00 38.33 H new ATOM 0 HB3 MET A 832 14.158 -24.149 66.716 1.00 38.33 H new ATOM 0 HG2 MET A 832 12.055 -23.056 66.537 1.00 41.12 H new ATOM 0 HG3 MET A 832 11.362 -24.437 66.320 1.00 41.12 H new ATOM 0 HE1 MET A 832 12.893 -22.838 70.121 1.00 42.69 H new ATOM 0 HE2 MET A 832 13.831 -22.976 68.852 1.00 42.69 H new ATOM 0 HE3 MET A 832 12.581 -22.004 68.811 1.00 42.69 H new ATOM 1333 N ASN A 833 14.250 -22.062 64.530 1.00 37.20 N ATOM 1334 CA ASN A 833 14.026 -20.659 64.188 1.00 37.85 C ATOM 1335 C ASN A 833 13.853 -20.442 62.692 1.00 36.25 C ATOM 1336 O ASN A 833 13.062 -19.601 62.275 1.00 35.12 O ATOM 1337 CB ASN A 833 15.165 -19.782 64.720 1.00 41.71 C ATOM 1338 CG ASN A 833 15.016 -19.482 66.199 1.00 45.00 C ATOM 1339 OD1 ASN A 833 14.017 -18.913 66.623 1.00 50.52 O ATOM 1340 ND2 ASN A 833 16.006 -19.867 66.989 1.00 46.83 N ATOM 0 H ASN A 833 15.031 -22.238 64.844 1.00 37.20 H new ATOM 0 HA ASN A 833 13.195 -20.399 64.615 1.00 37.85 H new ATOM 0 HB2 ASN A 833 16.013 -20.228 64.566 1.00 41.71 H new ATOM 0 HB3 ASN A 833 15.188 -18.949 64.224 1.00 41.71 H new ATOM 0 HD21 ASN A 833 15.963 -19.720 67.835 1.00 46.83 H new ATOM 0 HD22 ASN A 833 16.692 -20.264 66.656 1.00 46.83 H new ATOM 1341 N TYR A 834 14.584 -21.203 61.886 1.00 34.33 N ATOM 1342 CA TYR A 834 14.467 -21.071 60.446 1.00 34.38 C ATOM 1343 C TYR A 834 13.148 -21.651 59.954 1.00 34.90 C ATOM 1344 O TYR A 834 12.641 -21.244 58.914 1.00 33.74 O ATOM 1345 CB TYR A 834 15.656 -21.737 59.746 1.00 35.00 C ATOM 1346 CG TYR A 834 16.847 -20.811 59.664 1.00 38.10 C ATOM 1347 CD1 TYR A 834 17.615 -20.524 60.794 1.00 37.31 C ATOM 1348 CD2 TYR A 834 17.155 -20.151 58.473 1.00 39.08 C ATOM 1349 CE1 TYR A 834 18.654 -19.601 60.743 1.00 37.04 C ATOM 1350 CE2 TYR A 834 18.189 -19.222 58.411 1.00 39.98 C ATOM 1351 CZ TYR A 834 18.933 -18.952 59.549 1.00 39.37 C ATOM 1352 OH TYR A 834 19.943 -18.023 59.485 1.00 37.91 O ATOM 0 H TYR A 834 15.148 -21.796 62.152 1.00 34.33 H new ATOM 0 HA TYR A 834 14.477 -20.127 60.225 1.00 34.38 H new ATOM 0 HB2 TYR A 834 15.905 -22.542 60.226 1.00 35.00 H new ATOM 0 HB3 TYR A 834 15.395 -22.009 58.852 1.00 35.00 H new ATOM 0 HD1 TYR A 834 17.428 -20.958 61.595 1.00 37.31 H new ATOM 0 HD2 TYR A 834 16.660 -20.336 57.707 1.00 39.08 H new ATOM 0 HE1 TYR A 834 19.158 -19.420 61.503 1.00 37.04 H new ATOM 0 HE2 TYR A 834 18.379 -18.786 57.612 1.00 39.98 H new ATOM 0 HH TYR A 834 20.286 -17.929 60.246 1.00 37.91 H new ATOM 1353 N ILE A 835 12.598 -22.609 60.696 1.00 35.15 N ATOM 1354 CA ILE A 835 11.308 -23.184 60.326 1.00 37.08 C ATOM 1355 C ILE A 835 10.259 -22.112 60.627 1.00 37.81 C ATOM 1356 O ILE A 835 9.350 -21.877 59.834 1.00 39.17 O ATOM 1357 CB ILE A 835 10.987 -24.456 61.135 1.00 35.01 C ATOM 1358 CG1 ILE A 835 11.971 -25.570 60.762 1.00 34.56 C ATOM 1359 CG2 ILE A 835 9.545 -24.893 60.859 1.00 34.59 C ATOM 1360 CD1 ILE A 835 11.753 -26.884 61.502 1.00 32.24 C ATOM 0 H ILE A 835 12.950 -22.937 61.409 1.00 35.15 H new ATOM 0 HA ILE A 835 11.318 -23.442 59.391 1.00 37.08 H new ATOM 0 HB ILE A 835 11.078 -24.269 62.083 1.00 35.01 H new ATOM 0 HG12 ILE A 835 11.908 -25.735 59.808 1.00 34.56 H new ATOM 0 HG13 ILE A 835 12.873 -25.260 60.937 1.00 34.56 H new ATOM 0 HG21 ILE A 835 9.346 -25.694 61.369 1.00 34.59 H new ATOM 0 HG22 ILE A 835 8.936 -24.184 61.120 1.00 34.59 H new ATOM 0 HG23 ILE A 835 9.438 -25.078 59.913 1.00 34.59 H new ATOM 0 HD11 ILE A 835 12.413 -27.533 61.211 1.00 32.24 H new ATOM 0 HD12 ILE A 835 11.844 -26.737 62.456 1.00 32.24 H new ATOM 0 HD13 ILE A 835 10.863 -27.220 61.310 1.00 32.24 H new ATOM 1361 N LYS A 836 10.415 -21.461 61.777 1.00 39.92 N ATOM 1362 CA LYS A 836 9.521 -20.397 62.215 1.00 40.72 C ATOM 1363 C LYS A 836 9.506 -19.270 61.187 1.00 41.62 C ATOM 1364 O LYS A 836 8.449 -18.720 60.871 1.00 39.46 O ATOM 1365 CB LYS A 836 9.982 -19.853 63.570 1.00 43.51 C ATOM 1366 CG LYS A 836 9.173 -18.668 64.084 1.00 49.45 C ATOM 1367 CD LYS A 836 9.928 -17.904 65.177 1.00 53.27 C ATOM 1368 CE LYS A 836 11.238 -17.319 64.636 1.00 56.47 C ATOM 1369 NZ LYS A 836 12.010 -16.565 65.666 1.00 59.05 N ATOM 0 H LYS A 836 11.052 -21.628 62.331 1.00 39.92 H new ATOM 0 HA LYS A 836 8.625 -20.757 62.304 1.00 40.72 H new ATOM 0 HB2 LYS A 836 9.939 -20.568 64.224 1.00 43.51 H new ATOM 0 HB3 LYS A 836 10.913 -19.589 63.500 1.00 43.51 H new ATOM 0 HG2 LYS A 836 8.972 -18.068 63.348 1.00 49.45 H new ATOM 0 HG3 LYS A 836 8.324 -18.982 64.434 1.00 49.45 H new ATOM 0 HD2 LYS A 836 9.369 -17.190 65.522 1.00 53.27 H new ATOM 0 HD3 LYS A 836 10.118 -18.499 65.919 1.00 53.27 H new ATOM 0 HE2 LYS A 836 11.788 -18.038 64.289 1.00 56.47 H new ATOM 0 HE3 LYS A 836 11.040 -16.729 63.892 1.00 56.47 H new ATOM 0 HZ1 LYS A 836 12.419 -15.874 65.283 1.00 59.05 H new ATOM 0 HZ2 LYS A 836 11.455 -16.269 66.296 1.00 59.05 H new ATOM 0 HZ3 LYS A 836 12.617 -17.102 66.034 1.00 59.05 H new ATOM 1370 N GLU A 837 10.681 -18.926 60.663 1.00 42.21 N ATOM 1371 CA GLU A 837 10.781 -17.866 59.659 1.00 42.69 C ATOM 1372 C GLU A 837 10.066 -18.235 58.356 1.00 41.29 C ATOM 1373 O GLU A 837 9.450 -17.380 57.724 1.00 40.28 O ATOM 1374 CB GLU A 837 12.250 -17.531 59.380 1.00 44.59 C ATOM 1375 CG GLU A 837 12.965 -16.911 60.576 1.00 48.57 C ATOM 1376 CD GLU A 837 12.367 -15.571 60.982 1.00 52.12 C ATOM 1377 OE1 GLU A 837 12.731 -15.059 62.061 1.00 54.11 O ATOM 1378 OE2 GLU A 837 11.536 -15.026 60.221 1.00 54.38 O ATOM 0 H GLU A 837 11.430 -19.292 60.874 1.00 42.21 H new ATOM 0 HA GLU A 837 10.337 -17.084 60.022 1.00 42.69 H new ATOM 0 HB2 GLU A 837 12.715 -18.340 59.117 1.00 44.59 H new ATOM 0 HB3 GLU A 837 12.299 -16.919 58.629 1.00 44.59 H new ATOM 0 HG2 GLU A 837 12.921 -17.522 61.328 1.00 48.57 H new ATOM 0 HG3 GLU A 837 13.903 -16.791 60.362 1.00 48.57 H new ATOM 1379 N LEU A 838 10.146 -19.501 57.956 1.00 41.01 N ATOM 1380 CA LEU A 838 9.477 -19.952 56.736 1.00 43.21 C ATOM 1381 C LEU A 838 7.963 -19.876 56.934 1.00 45.04 C ATOM 1382 O LEU A 838 7.237 -19.412 56.065 1.00 45.38 O ATOM 1383 CB LEU A 838 9.872 -21.391 56.402 1.00 41.69 C ATOM 1384 CG LEU A 838 9.109 -22.071 55.257 1.00 42.36 C ATOM 1385 CD1 LEU A 838 9.377 -21.357 53.929 1.00 41.07 C ATOM 1386 CD2 LEU A 838 9.533 -23.520 55.169 1.00 41.08 C ATOM 0 H LEU A 838 10.581 -20.114 58.374 1.00 41.01 H new ATOM 0 HA LEU A 838 9.747 -19.378 56.002 1.00 43.21 H new ATOM 0 HB2 LEU A 838 10.817 -21.402 56.184 1.00 41.69 H new ATOM 0 HB3 LEU A 838 9.759 -21.929 57.201 1.00 41.69 H new ATOM 0 HG LEU A 838 8.157 -22.022 55.436 1.00 42.36 H new ATOM 0 HD11 LEU A 838 8.887 -21.800 53.219 1.00 41.07 H new ATOM 0 HD12 LEU A 838 9.087 -20.434 53.994 1.00 41.07 H new ATOM 0 HD13 LEU A 838 10.326 -21.384 53.732 1.00 41.07 H new ATOM 0 HD21 LEU A 838 9.053 -23.954 54.446 1.00 41.08 H new ATOM 0 HD22 LEU A 838 10.487 -23.569 54.999 1.00 41.08 H new ATOM 0 HD23 LEU A 838 9.331 -23.968 56.006 1.00 41.08 H new ATOM 1387 N ASP A 839 7.501 -20.346 58.086 1.00 47.40 N ATOM 1388 CA ASP A 839 6.085 -20.328 58.423 1.00 50.29 C ATOM 1389 C ASP A 839 5.617 -18.867 58.426 1.00 52.03 C ATOM 1390 O ASP A 839 4.543 -18.542 57.930 1.00 51.45 O ATOM 1391 CB ASP A 839 5.892 -20.970 59.804 1.00 51.15 C ATOM 1392 CG ASP A 839 4.433 -21.120 60.191 1.00 52.86 C ATOM 1393 OD1 ASP A 839 3.697 -21.871 59.516 1.00 53.75 O ATOM 1394 OD2 ASP A 839 4.024 -20.482 61.182 1.00 54.37 O ATOM 0 H ASP A 839 8.003 -20.686 58.696 1.00 47.40 H new ATOM 0 HA ASP A 839 5.563 -20.830 57.778 1.00 50.29 H new ATOM 0 HB2 ASP A 839 6.314 -21.843 59.811 1.00 51.15 H new ATOM 0 HB3 ASP A 839 6.344 -20.431 60.472 1.00 51.15 H new ATOM 1395 N ARG A 840 6.448 -17.989 58.974 1.00 53.84 N ATOM 1396 CA ARG A 840 6.138 -16.567 59.040 1.00 55.15 C ATOM 1397 C ARG A 840 6.021 -15.947 57.646 1.00 54.60 C ATOM 1398 O ARG A 840 5.142 -15.118 57.400 1.00 52.85 O ATOM 1399 CB ARG A 840 7.217 -15.844 59.853 1.00 57.53 C ATOM 1400 CG ARG A 840 7.231 -14.333 59.704 1.00 61.79 C ATOM 1401 CD ARG A 840 8.372 -13.720 60.506 1.00 67.03 C ATOM 1402 NE ARG A 840 8.771 -12.410 59.992 1.00 71.55 N ATOM 1403 CZ ARG A 840 9.327 -12.208 58.799 1.00 73.58 C ATOM 1404 NH1 ARG A 840 9.553 -13.234 57.986 1.00 75.36 N ATOM 1405 NH2 ARG A 840 9.661 -10.981 58.416 1.00 74.82 N ATOM 0 H ARG A 840 7.207 -18.201 59.318 1.00 53.84 H new ATOM 0 HA ARG A 840 5.277 -16.466 59.476 1.00 55.15 H new ATOM 0 HB2 ARG A 840 7.096 -16.062 60.791 1.00 57.53 H new ATOM 0 HB3 ARG A 840 8.085 -16.189 59.591 1.00 57.53 H new ATOM 0 HG2 ARG A 840 7.325 -14.097 58.768 1.00 61.79 H new ATOM 0 HG3 ARG A 840 6.385 -13.966 60.005 1.00 61.79 H new ATOM 0 HD2 ARG A 840 8.102 -13.633 61.434 1.00 67.03 H new ATOM 0 HD3 ARG A 840 9.135 -14.318 60.488 1.00 67.03 H new ATOM 0 HE ARG A 840 8.638 -11.724 60.494 1.00 71.55 H new ATOM 0 HH11 ARG A 840 9.340 -14.031 58.230 1.00 75.36 H new ATOM 0 HH12 ARG A 840 9.912 -13.101 57.216 1.00 75.36 H new ATOM 0 HH21 ARG A 840 9.518 -10.313 58.939 1.00 74.82 H new ATOM 0 HH22 ARG A 840 10.020 -10.854 57.645 1.00 74.82 H new ATOM 1406 N ILE A 841 6.901 -16.354 56.735 1.00 54.57 N ATOM 1407 CA ILE A 841 6.882 -15.824 55.378 1.00 54.84 C ATOM 1408 C ILE A 841 5.605 -16.257 54.674 1.00 56.25 C ATOM 1409 O ILE A 841 5.052 -15.520 53.865 1.00 55.47 O ATOM 1410 CB ILE A 841 8.118 -16.297 54.562 1.00 54.49 C ATOM 1411 CG1AILE A 841 9.402 -15.798 55.225 0.50 54.64 C ATOM 1412 CG1BILE A 841 8.394 -15.310 53.430 0.50 54.27 C ATOM 1413 CG2AILE A 841 8.027 -15.791 53.129 0.50 55.17 C ATOM 1414 CG2BILE A 841 7.872 -17.670 53.960 0.50 53.68 C ATOM 1415 CD1AILE A 841 10.662 -16.233 54.519 0.50 54.61 C ATOM 1416 CD1BILE A 841 8.458 -13.878 53.891 0.50 53.52 C ATOM 0 H ILE A 841 7.516 -16.936 56.884 1.00 54.57 H new ATOM 0 HA ILE A 841 6.914 -14.856 55.435 1.00 54.84 H new ATOM 0 HB AILE A 841 8.133 -17.267 54.545 0.50 54.49 H new ATOM 0 HB BILE A 841 8.878 -16.343 55.162 0.50 54.49 H new ATOM 0 HG12AILE A 841 9.381 -14.829 55.263 0.50 54.27 H new ATOM 0 HG12BILE A 841 9.233 -15.544 53.003 0.50 54.27 H new ATOM 0 HG13AILE A 841 9.428 -16.117 56.141 0.50 54.27 H new ATOM 0 HG13BILE A 841 7.700 -15.396 52.758 0.50 54.27 H new ATOM 0 HG21AILE A 841 8.802 -16.092 52.630 0.50 53.68 H new ATOM 0 HG21BILE A 841 8.653 -17.947 53.456 0.50 53.68 H new ATOM 0 HG22AILE A 841 7.221 -16.137 52.714 0.50 53.68 H new ATOM 0 HG22BILE A 841 7.702 -18.309 54.670 0.50 53.68 H new ATOM 0 HG23AILE A 841 7.999 -14.821 53.129 0.50 53.68 H new ATOM 0 HG23BILE A 841 7.103 -17.632 53.370 0.50 53.68 H new ATOM 0 HD11AILE A 841 11.434 -15.883 54.990 0.50 53.52 H new ATOM 0 HD11BILE A 841 8.635 -13.301 53.132 0.50 53.52 H new ATOM 0 HD12AILE A 841 10.705 -17.202 54.502 0.50 53.52 H new ATOM 0 HD12BILE A 841 7.612 -13.630 54.295 0.50 53.52 H new ATOM 0 HD13AILE A 841 10.658 -15.894 53.610 0.50 53.52 H new ATOM 0 HD13BILE A 841 9.169 -13.779 54.544 0.50 53.52 H new ATOM 1417 N ILE A 842 5.140 -17.459 54.989 1.00 59.27 N ATOM 1418 CA ILE A 842 3.917 -17.979 54.395 1.00 63.32 C ATOM 1419 C ILE A 842 2.700 -17.222 54.940 1.00 66.07 C ATOM 1420 O ILE A 842 1.804 -16.844 54.185 1.00 65.64 O ATOM 1421 CB ILE A 842 3.764 -19.480 54.698 1.00 62.22 C ATOM 1422 CG1 ILE A 842 4.879 -20.254 53.995 1.00 61.53 C ATOM 1423 CG2 ILE A 842 2.389 -19.968 54.267 1.00 61.46 C ATOM 1424 CD1 ILE A 842 4.905 -21.728 54.326 1.00 62.35 C ATOM 0 H ILE A 842 5.520 -17.991 55.547 1.00 59.27 H new ATOM 0 HA ILE A 842 3.970 -17.855 53.434 1.00 63.32 H new ATOM 0 HB ILE A 842 3.840 -19.631 55.653 1.00 62.22 H new ATOM 0 HG12 ILE A 842 4.778 -20.149 53.036 1.00 61.53 H new ATOM 0 HG13 ILE A 842 5.733 -19.863 54.235 1.00 61.53 H new ATOM 0 HG21 ILE A 842 2.305 -20.914 54.463 1.00 61.46 H new ATOM 0 HG22 ILE A 842 1.705 -19.477 54.749 1.00 61.46 H new ATOM 0 HG23 ILE A 842 2.279 -19.825 53.314 1.00 61.46 H new ATOM 0 HD11 ILE A 842 5.633 -22.154 53.848 1.00 62.35 H new ATOM 0 HD12 ILE A 842 5.034 -21.843 55.280 1.00 62.35 H new ATOM 0 HD13 ILE A 842 4.064 -22.134 54.062 1.00 62.35 H new ATOM 1425 N ALA A 843 2.691 -16.997 56.253 1.00 69.45 N ATOM 1426 CA ALA A 843 1.597 -16.297 56.921 1.00 74.18 C ATOM 1427 C ALA A 843 1.623 -14.785 56.699 1.00 77.31 C ATOM 1428 O ALA A 843 0.596 -14.118 56.820 1.00 77.95 O ATOM 1429 CB ALA A 843 1.626 -16.603 58.417 1.00 73.54 C ATOM 0 H ALA A 843 3.321 -17.247 56.782 1.00 69.45 H new ATOM 0 HA ALA A 843 0.773 -16.622 56.525 1.00 74.18 H new ATOM 0 HB1 ALA A 843 0.898 -16.137 58.857 1.00 73.54 H new ATOM 0 HB2 ALA A 843 1.527 -17.558 58.554 1.00 73.54 H new ATOM 0 HB3 ALA A 843 2.471 -16.309 58.791 1.00 73.54 H new ATOM 1430 N CYS A 844 2.795 -14.246 56.376 1.00 80.99 N ATOM 1431 CA CYS A 844 2.937 -12.811 56.141 1.00 84.46 C ATOM 1432 C CYS A 844 2.296 -12.413 54.813 1.00 85.98 C ATOM 1433 O CYS A 844 2.285 -11.238 54.442 1.00 86.52 O ATOM 1434 CB CYS A 844 4.422 -12.423 56.140 1.00 85.33 C ATOM 1435 SG CYS A 844 4.761 -10.654 55.935 1.00 88.77 S ATOM 0 H CYS A 844 3.523 -14.695 56.287 1.00 80.99 H new ATOM 0 HA CYS A 844 2.483 -12.338 56.856 1.00 84.46 H new ATOM 0 HB2 CYS A 844 4.819 -12.719 56.974 1.00 85.33 H new ATOM 0 HB3 CYS A 844 4.867 -12.907 55.427 1.00 85.33 H new ATOM 0 HG CYS A 844 3.878 -10.148 55.300 1.00 88.77 H new ATOM 1436 N LYS A 845 1.757 -13.398 54.101 1.00 87.65 N ATOM 1437 CA LYS A 845 1.120 -13.144 52.815 1.00 89.65 C ATOM 1438 C LYS A 845 -0.244 -13.829 52.703 1.00 90.98 C ATOM 1439 O LYS A 845 -0.865 -13.821 51.636 1.00 91.69 O ATOM 1440 CB LYS A 845 2.039 -13.609 51.687 1.00 89.32 C ATOM 0 H LYS A 845 1.750 -14.222 54.346 1.00 87.65 H new ATOM 0 HA LYS A 845 0.968 -12.189 52.742 1.00 89.65 H new ATOM 1441 N ARG A 846 -0.709 -14.414 53.806 1.00 91.74 N ATOM 1442 CA ARG A 846 -1.996 -15.108 53.826 1.00 92.44 C ATOM 1443 C ARG A 846 -2.776 -14.887 55.118 1.00 93.12 C ATOM 1444 O ARG A 846 -2.197 -14.784 56.202 1.00 93.12 O ATOM 1445 CB ARG A 846 -1.788 -16.609 53.615 1.00 92.09 C ATOM 1446 CG ARG A 846 -1.224 -16.964 52.261 1.00 91.63 C ATOM 1447 CD ARG A 846 -0.985 -18.449 52.157 1.00 91.21 C ATOM 1448 NE ARG A 846 -0.514 -18.824 50.829 1.00 90.79 N ATOM 1449 CZ ARG A 846 0.626 -18.412 50.284 1.00 90.36 C ATOM 1450 NH1 ARG A 846 1.439 -17.597 50.947 1.00 89.82 N ATOM 1451 NH2 ARG A 846 0.956 -18.831 49.072 1.00 90.54 N ATOM 0 H ARG A 846 -0.291 -14.420 54.558 1.00 91.74 H new ATOM 0 HA ARG A 846 -2.521 -14.732 53.102 1.00 92.44 H new ATOM 0 HB2 ARG A 846 -1.191 -16.943 54.302 1.00 92.09 H new ATOM 0 HB3 ARG A 846 -2.637 -17.064 53.731 1.00 92.09 H new ATOM 0 HG2 ARG A 846 -1.838 -16.681 51.565 1.00 91.63 H new ATOM 0 HG3 ARG A 846 -0.392 -16.487 52.117 1.00 91.63 H new ATOM 0 HD2 ARG A 846 -0.332 -18.720 52.821 1.00 91.21 H new ATOM 0 HD3 ARG A 846 -1.807 -18.925 52.356 1.00 91.21 H new ATOM 0 HE ARG A 846 -1.010 -19.350 50.364 1.00 90.79 H new ATOM 0 HH11 ARG A 846 1.230 -17.330 51.737 1.00 89.82 H new ATOM 0 HH12 ARG A 846 2.175 -17.336 50.586 1.00 89.82 H new ATOM 0 HH21 ARG A 846 0.434 -19.365 48.645 1.00 90.54 H new ATOM 0 HH22 ARG A 846 1.692 -18.569 48.712 1.00 90.54 H new ATOM 1452 N LYS A 847 -4.098 -14.823 54.993 1.00 93.77 N ATOM 1453 CA LYS A 847 -4.964 -14.614 56.145 1.00 94.39 C ATOM 1454 C LYS A 847 -5.661 -15.910 56.544 1.00 94.71 C ATOM 1455 O LYS A 847 -5.886 -16.164 57.728 1.00 94.63 O ATOM 1456 CB LYS A 847 -5.997 -13.536 55.831 1.00 94.18 C ATOM 0 H LYS A 847 -4.514 -14.899 54.244 1.00 93.77 H new ATOM 0 HA LYS A 847 -4.417 -14.323 56.891 1.00 94.39 H new ATOM 1457 N ASN A 848 -5.992 -16.732 55.552 1.00 95.14 N ATOM 1458 CA ASN A 848 -6.672 -18.000 55.803 1.00 95.39 C ATOM 1459 C ASN A 848 -5.735 -19.061 56.386 1.00 94.85 C ATOM 1460 O ASN A 848 -4.592 -19.209 55.944 1.00 94.99 O ATOM 1461 CB ASN A 848 -7.303 -18.523 54.508 1.00 95.74 C ATOM 1462 CG ASN A 848 -8.095 -19.799 54.721 1.00 95.98 C ATOM 1463 OD1 ASN A 848 -7.749 -20.844 53.976 1.00 96.25 O flip ATOM 1464 ND2 ASN A 848 -9.009 -19.845 55.544 1.00 95.70 N flip ATOM 0 H ASN A 848 -5.831 -16.573 54.722 1.00 95.14 H new ATOM 0 HA ASN A 848 -7.362 -17.828 56.462 1.00 95.39 H new ATOM 0 HB2 ASN A 848 -7.886 -17.842 54.138 1.00 95.74 H new ATOM 0 HB3 ASN A 848 -6.605 -18.685 53.854 1.00 95.74 H new ATOM 0 HD21 ASN A 848 -9.205 -19.148 56.009 1.00 95.70 H new ATOM 0 HD22 ASN A 848 -9.452 -20.574 55.655 1.00 95.70 H new ATOM 1465 N PRO A 849 -6.214 -19.812 57.395 1.00 93.87 N ATOM 1466 CA PRO A 849 -5.433 -20.866 58.051 1.00 92.29 C ATOM 1467 C PRO A 849 -5.270 -22.107 57.179 1.00 90.35 C ATOM 1468 O PRO A 849 -4.223 -22.753 57.196 1.00 90.37 O ATOM 1469 CB PRO A 849 -6.241 -21.151 59.313 1.00 93.02 C ATOM 1470 CG PRO A 849 -7.646 -20.949 58.842 1.00 93.49 C ATOM 1471 CD PRO A 849 -7.533 -19.667 58.040 1.00 93.62 C ATOM 0 HA PRO A 849 -4.519 -20.597 58.234 1.00 92.29 H new ATOM 0 HB2 PRO A 849 -6.095 -22.052 59.641 1.00 93.02 H new ATOM 0 HB3 PRO A 849 -6.010 -20.546 60.035 1.00 93.02 H new ATOM 0 HG2 PRO A 849 -7.956 -21.690 58.299 1.00 93.49 H new ATOM 0 HG3 PRO A 849 -8.267 -20.860 59.582 1.00 93.49 H new ATOM 0 HD2 PRO A 849 -8.247 -19.584 57.388 1.00 93.62 H new ATOM 0 HD3 PRO A 849 -7.574 -18.881 58.607 1.00 93.62 H new ATOM 1472 N THR A 850 -6.313 -22.436 56.424 1.00 87.93 N ATOM 1473 CA THR A 850 -6.280 -23.597 55.543 1.00 85.09 C ATOM 1474 C THR A 850 -5.291 -23.356 54.406 1.00 82.49 C ATOM 1475 O THR A 850 -4.643 -24.288 53.927 1.00 82.02 O ATOM 1476 CB THR A 850 -7.672 -23.887 54.939 1.00 85.68 C ATOM 1477 OG1 THR A 850 -8.624 -24.063 55.995 1.00 86.62 O ATOM 1478 CG2 THR A 850 -7.633 -25.154 54.088 1.00 85.33 C ATOM 0 H THR A 850 -7.053 -21.997 56.408 1.00 87.93 H new ATOM 0 HA THR A 850 -6.005 -24.361 56.073 1.00 85.09 H new ATOM 0 HB THR A 850 -7.929 -23.137 54.380 1.00 85.68 H new ATOM 0 HG1 THR A 850 -9.381 -24.219 55.667 1.00 86.62 H new ATOM 0 HG21 THR A 850 -8.513 -25.322 53.717 1.00 85.33 H new ATOM 0 HG22 THR A 850 -6.995 -25.040 53.367 1.00 85.33 H new ATOM 0 HG23 THR A 850 -7.366 -25.906 54.639 1.00 85.33 H new ATOM 1479 N SER A 851 -5.180 -22.103 53.974 1.00 79.00 N ATOM 1480 CA SER A 851 -4.261 -21.762 52.898 1.00 76.32 C ATOM 1481 C SER A 851 -2.830 -21.846 53.423 1.00 73.50 C ATOM 1482 O SER A 851 -1.968 -22.462 52.796 1.00 72.30 O ATOM 1483 CB SER A 851 -4.546 -20.352 52.374 1.00 77.27 C ATOM 1484 OG SER A 851 -3.786 -20.084 51.204 1.00 77.83 O ATOM 0 H SER A 851 -5.627 -21.440 54.290 1.00 79.00 H new ATOM 0 HA SER A 851 -4.380 -22.387 52.165 1.00 76.32 H new ATOM 0 HB2 SER A 851 -5.492 -20.260 52.178 1.00 77.27 H new ATOM 0 HB3 SER A 851 -4.334 -19.699 53.059 1.00 77.27 H new ATOM 0 HG SER A 851 -3.956 -19.308 50.931 1.00 77.83 H new ATOM 1485 N CYS A 852 -2.590 -21.223 54.575 1.00 70.36 N ATOM 1486 CA CYS A 852 -1.273 -21.239 55.202 1.00 67.46 C ATOM 1487 C CYS A 852 -0.849 -22.681 55.452 1.00 64.47 C ATOM 1488 O CYS A 852 0.248 -23.091 55.081 1.00 62.92 O ATOM 1489 CB CYS A 852 -1.300 -20.484 56.533 1.00 68.47 C ATOM 1490 SG CYS A 852 -1.454 -18.693 56.391 1.00 72.51 S ATOM 0 H CYS A 852 -3.184 -20.781 55.013 1.00 70.36 H new ATOM 0 HA CYS A 852 -0.641 -20.804 54.608 1.00 67.46 H new ATOM 0 HB2 CYS A 852 -2.040 -20.818 57.064 1.00 68.47 H new ATOM 0 HB3 CYS A 852 -0.487 -20.687 57.021 1.00 68.47 H new ATOM 0 HG CYS A 852 -2.602 -18.404 56.194 1.00 72.51 H new ATOM 1491 N SER A 853 -1.735 -23.444 56.084 1.00 61.22 N ATOM 1492 CA SER A 853 -1.483 -24.846 56.393 1.00 58.62 C ATOM 1493 C SER A 853 -1.246 -25.674 55.131 1.00 56.14 C ATOM 1494 O SER A 853 -0.440 -26.605 55.127 1.00 54.38 O ATOM 1495 CB SER A 853 -2.664 -25.425 57.175 1.00 59.04 C ATOM 1496 OG SER A 853 -2.512 -26.819 57.380 1.00 59.59 O ATOM 0 H SER A 853 -2.503 -23.161 56.347 1.00 61.22 H new ATOM 0 HA SER A 853 -0.677 -24.888 56.931 1.00 58.62 H new ATOM 0 HB2 SER A 853 -2.739 -24.976 58.032 1.00 59.04 H new ATOM 0 HB3 SER A 853 -3.488 -25.255 56.693 1.00 59.04 H new ATOM 0 HG SER A 853 -3.170 -27.112 57.811 1.00 59.59 H new ATOM 1497 N ARG A 854 -1.954 -25.336 54.060 1.00 53.75 N ATOM 1498 CA ARG A 854 -1.804 -26.055 52.802 1.00 52.24 C ATOM 1499 C ARG A 854 -0.450 -25.730 52.172 1.00 48.99 C ATOM 1500 O ARG A 854 0.219 -26.607 51.632 1.00 47.75 O ATOM 1501 CB ARG A 854 -2.921 -25.662 51.837 1.00 54.38 C ATOM 1502 CG ARG A 854 -2.882 -26.381 50.498 1.00 59.07 C ATOM 1503 CD ARG A 854 -3.947 -25.817 49.564 1.00 64.82 C ATOM 1504 NE ARG A 854 -3.956 -26.470 48.257 1.00 69.17 N ATOM 1505 CZ ARG A 854 -4.638 -26.027 47.203 1.00 71.64 C ATOM 1506 NH1 ARG A 854 -5.371 -24.923 47.298 1.00 71.62 N ATOM 1507 NH2 ARG A 854 -4.586 -26.686 46.051 1.00 72.65 N ATOM 0 H ARG A 854 -2.526 -24.694 54.041 1.00 53.75 H new ATOM 0 HA ARG A 854 -1.855 -27.007 52.980 1.00 52.24 H new ATOM 0 HB2 ARG A 854 -3.776 -25.838 52.261 1.00 54.38 H new ATOM 0 HB3 ARG A 854 -2.875 -24.706 51.679 1.00 54.38 H new ATOM 0 HG2 ARG A 854 -2.005 -26.282 50.096 1.00 59.07 H new ATOM 0 HG3 ARG A 854 -3.028 -27.331 50.629 1.00 59.07 H new ATOM 0 HD2 ARG A 854 -4.819 -25.917 49.977 1.00 64.82 H new ATOM 0 HD3 ARG A 854 -3.796 -24.866 49.445 1.00 64.82 H new ATOM 0 HE ARG A 854 -3.491 -27.187 48.162 1.00 69.17 H new ATOM 0 HH11 ARG A 854 -5.406 -24.493 48.042 1.00 71.62 H new ATOM 0 HH12 ARG A 854 -5.811 -24.639 46.616 1.00 71.62 H new ATOM 0 HH21 ARG A 854 -4.111 -27.400 45.985 1.00 72.65 H new ATOM 0 HH22 ARG A 854 -5.027 -26.399 45.371 1.00 72.65 H new ATOM 1508 N ARG A 855 -0.061 -24.462 52.254 1.00 46.99 N ATOM 1509 CA ARG A 855 1.198 -23.991 51.692 1.00 46.64 C ATOM 1510 C ARG A 855 2.390 -24.582 52.434 1.00 46.65 C ATOM 1511 O ARG A 855 3.341 -25.057 51.809 1.00 46.63 O ATOM 1512 CB ARG A 855 1.256 -22.462 51.751 1.00 45.85 C ATOM 1513 CG ARG A 855 2.424 -21.835 50.989 1.00 45.74 C ATOM 1514 CD ARG A 855 2.370 -22.190 49.512 1.00 45.42 C ATOM 1515 NE ARG A 855 3.291 -21.394 48.699 1.00 42.19 N ATOM 1516 CZ ARG A 855 3.327 -21.440 47.372 1.00 41.94 C ATOM 1517 NH1 ARG A 855 2.500 -22.244 46.720 1.00 43.00 N ATOM 1518 NH2 ARG A 855 4.171 -20.679 46.695 1.00 42.24 N ATOM 0 H ARG A 855 -0.523 -23.848 52.640 1.00 46.99 H new ATOM 0 HA ARG A 855 1.242 -24.282 50.768 1.00 46.64 H new ATOM 0 HB2 ARG A 855 0.426 -22.105 51.397 1.00 45.85 H new ATOM 0 HB3 ARG A 855 1.308 -22.188 52.680 1.00 45.85 H new ATOM 0 HG2 ARG A 855 2.402 -20.871 51.094 1.00 45.74 H new ATOM 0 HG3 ARG A 855 3.263 -22.142 51.368 1.00 45.74 H new ATOM 0 HD2 ARG A 855 2.580 -23.131 49.403 1.00 45.42 H new ATOM 0 HD3 ARG A 855 1.465 -22.062 49.186 1.00 45.42 H new ATOM 0 HE ARG A 855 3.839 -20.868 49.103 1.00 42.19 H new ATOM 0 HH11 ARG A 855 1.943 -22.733 47.156 1.00 43.00 H new ATOM 0 HH12 ARG A 855 2.520 -22.277 45.861 1.00 43.00 H new ATOM 0 HH21 ARG A 855 4.703 -20.149 47.114 1.00 42.24 H new ATOM 0 HH22 ARG A 855 4.188 -20.715 45.836 1.00 42.24 H new ATOM 1519 N PHE A 856 2.330 -24.557 53.765 1.00 46.03 N ATOM 1520 CA PHE A 856 3.407 -25.091 54.592 1.00 44.48 C ATOM 1521 C PHE A 856 3.603 -26.562 54.262 1.00 44.11 C ATOM 1522 O PHE A 856 4.730 -27.068 54.247 1.00 42.69 O ATOM 1523 CB PHE A 856 3.082 -24.934 56.080 1.00 42.86 C ATOM 1524 CG PHE A 856 4.226 -25.305 56.987 1.00 43.02 C ATOM 1525 CD1 PHE A 856 5.291 -24.425 57.182 1.00 43.33 C ATOM 1526 CD2 PHE A 856 4.272 -26.554 57.598 1.00 41.48 C ATOM 1527 CE1 PHE A 856 6.391 -24.787 57.976 1.00 43.66 C ATOM 1528 CE2 PHE A 856 5.367 -26.926 58.391 1.00 43.29 C ATOM 1529 CZ PHE A 856 6.427 -26.039 58.578 1.00 41.55 C ATOM 0 H PHE A 856 1.669 -24.233 54.209 1.00 46.03 H new ATOM 0 HA PHE A 856 4.221 -24.597 54.406 1.00 44.48 H new ATOM 0 HB2 PHE A 856 2.827 -24.014 56.253 1.00 42.86 H new ATOM 0 HB3 PHE A 856 2.315 -25.487 56.296 1.00 42.86 H new ATOM 0 HD1 PHE A 856 5.272 -23.586 56.780 1.00 43.33 H new ATOM 0 HD2 PHE A 856 3.568 -27.150 57.479 1.00 41.48 H new ATOM 0 HE1 PHE A 856 7.094 -24.190 58.099 1.00 43.66 H new ATOM 0 HE2 PHE A 856 5.386 -27.765 58.792 1.00 43.29 H new ATOM 0 HZ PHE A 856 7.154 -26.284 59.103 1.00 41.55 H new ATOM 1530 N TYR A 857 2.498 -27.248 53.996 1.00 42.12 N ATOM 1531 CA TYR A 857 2.551 -28.660 53.649 1.00 41.71 C ATOM 1532 C TYR A 857 3.277 -28.855 52.319 1.00 41.68 C ATOM 1533 O TYR A 857 4.150 -29.720 52.197 1.00 39.24 O ATOM 1534 CB TYR A 857 1.141 -29.229 53.522 1.00 44.11 C ATOM 1535 CG TYR A 857 1.117 -30.672 53.080 1.00 45.51 C ATOM 1536 CD1 TYR A 857 1.487 -31.692 53.952 1.00 48.43 C ATOM 1537 CD2 TYR A 857 0.735 -31.017 51.785 1.00 47.61 C ATOM 1538 CE1 TYR A 857 1.477 -33.024 53.549 1.00 50.51 C ATOM 1539 CE2 TYR A 857 0.722 -32.348 51.368 1.00 49.61 C ATOM 1540 CZ TYR A 857 1.095 -33.345 52.256 1.00 51.43 C ATOM 1541 OH TYR A 857 1.092 -34.663 51.858 1.00 53.01 O ATOM 0 H TYR A 857 1.706 -26.913 54.011 1.00 42.12 H new ATOM 0 HA TYR A 857 3.029 -29.123 54.354 1.00 41.71 H new ATOM 0 HB2 TYR A 857 0.690 -29.152 54.377 1.00 44.11 H new ATOM 0 HB3 TYR A 857 0.639 -28.694 52.887 1.00 44.11 H new ATOM 0 HD1 TYR A 857 1.746 -31.479 54.820 1.00 48.43 H new ATOM 0 HD2 TYR A 857 0.485 -30.349 51.189 1.00 47.61 H new ATOM 0 HE1 TYR A 857 1.725 -33.695 54.144 1.00 50.51 H new ATOM 0 HE2 TYR A 857 0.465 -32.565 50.501 1.00 49.61 H new ATOM 0 HH TYR A 857 1.342 -35.149 52.496 1.00 53.01 H new ATOM 1542 N GLN A 858 2.896 -28.052 51.326 1.00 39.55 N ATOM 1543 CA GLN A 858 3.489 -28.129 49.994 1.00 41.34 C ATOM 1544 C GLN A 858 4.986 -27.834 50.003 1.00 40.30 C ATOM 1545 O GLN A 858 5.760 -28.525 49.348 1.00 39.70 O ATOM 1546 CB GLN A 858 2.815 -27.137 49.044 1.00 43.03 C ATOM 1547 CG GLN A 858 1.309 -27.281 48.915 1.00 47.15 C ATOM 1548 CD GLN A 858 0.702 -26.190 48.049 1.00 47.46 C ATOM 1549 OE1 GLN A 858 0.978 -25.004 48.240 1.00 48.15 O ATOM 1550 NE2 GLN A 858 -0.131 -26.585 47.097 1.00 47.61 N ATOM 0 H GLN A 858 2.288 -27.449 51.406 1.00 39.55 H new ATOM 0 HA GLN A 858 3.352 -29.040 49.691 1.00 41.34 H new ATOM 0 HB2 GLN A 858 3.014 -26.237 49.346 1.00 43.03 H new ATOM 0 HB3 GLN A 858 3.211 -27.235 48.164 1.00 43.03 H new ATOM 0 HG2 GLN A 858 1.100 -28.148 48.534 1.00 47.15 H new ATOM 0 HG3 GLN A 858 0.906 -27.254 49.797 1.00 47.15 H new ATOM 0 HE21 GLN A 858 -0.300 -27.422 46.993 1.00 47.61 H new ATOM 0 HE22 GLN A 858 -0.503 -26.004 46.583 1.00 47.61 H new ATOM 1551 N LEU A 859 5.386 -26.798 50.736 1.00 40.17 N ATOM 1552 CA LEU A 859 6.793 -26.417 50.803 1.00 41.17 C ATOM 1553 C LEU A 859 7.661 -27.423 51.564 1.00 40.52 C ATOM 1554 O LEU A 859 8.777 -27.711 51.139 1.00 39.19 O ATOM 1555 CB LEU A 859 6.934 -25.015 51.402 1.00 40.27 C ATOM 1556 CG LEU A 859 6.136 -23.910 50.693 1.00 43.73 C ATOM 1557 CD1 LEU A 859 6.696 -22.546 51.072 1.00 43.97 C ATOM 1558 CD2 LEU A 859 6.206 -24.093 49.184 1.00 44.88 C ATOM 0 H LEU A 859 4.858 -26.303 51.201 1.00 40.17 H new ATOM 0 HA LEU A 859 7.123 -26.414 49.891 1.00 41.17 H new ATOM 0 HB2 LEU A 859 6.656 -25.048 52.331 1.00 40.27 H new ATOM 0 HB3 LEU A 859 7.873 -24.770 51.395 1.00 40.27 H new ATOM 0 HG LEU A 859 5.209 -23.966 50.972 1.00 43.73 H new ATOM 0 HD11 LEU A 859 6.189 -21.852 50.622 1.00 43.97 H new ATOM 0 HD12 LEU A 859 6.629 -22.424 52.032 1.00 43.97 H new ATOM 0 HD13 LEU A 859 7.627 -22.492 50.804 1.00 43.97 H new ATOM 0 HD21 LEU A 859 5.699 -23.390 48.749 1.00 44.88 H new ATOM 0 HD22 LEU A 859 7.131 -24.050 48.895 1.00 44.88 H new ATOM 0 HD23 LEU A 859 5.833 -24.956 48.945 1.00 44.88 H new ATOM 1559 N THR A 860 7.160 -27.963 52.674 1.00 39.28 N ATOM 1560 CA THR A 860 7.934 -28.954 53.423 1.00 39.11 C ATOM 1561 C THR A 860 8.066 -30.224 52.589 1.00 38.51 C ATOM 1562 O THR A 860 9.061 -30.954 52.690 1.00 37.31 O ATOM 1563 CB THR A 860 7.291 -29.284 54.801 1.00 40.28 C ATOM 1564 OG1 THR A 860 5.906 -29.635 54.637 1.00 41.38 O ATOM 1565 CG2 THR A 860 7.414 -28.088 55.734 1.00 39.02 C ATOM 0 H THR A 860 6.389 -27.775 53.006 1.00 39.28 H new ATOM 0 HA THR A 860 8.810 -28.577 53.600 1.00 39.11 H new ATOM 0 HB THR A 860 7.761 -30.039 55.188 1.00 40.28 H new ATOM 0 HG1 THR A 860 5.804 -30.454 54.791 1.00 41.38 H new ATOM 0 HG21 THR A 860 7.011 -28.302 56.590 1.00 39.02 H new ATOM 0 HG22 THR A 860 8.351 -27.873 55.863 1.00 39.02 H new ATOM 0 HG23 THR A 860 6.958 -27.325 55.345 1.00 39.02 H new ATOM 1566 N LYS A 861 7.065 -30.481 51.750 1.00 36.87 N ATOM 1567 CA LYS A 861 7.095 -31.645 50.869 1.00 36.10 C ATOM 1568 C LYS A 861 8.159 -31.413 49.789 1.00 35.15 C ATOM 1569 O LYS A 861 8.888 -32.330 49.410 1.00 35.26 O ATOM 1570 CB LYS A 861 5.723 -31.854 50.213 1.00 39.43 C ATOM 1571 CG LYS A 861 4.721 -32.612 51.071 1.00 41.92 C ATOM 1572 CD LYS A 861 5.197 -34.039 51.280 1.00 44.25 C ATOM 1573 CE LYS A 861 4.179 -34.880 52.024 1.00 47.31 C ATOM 1574 NZ LYS A 861 4.586 -36.317 52.024 1.00 49.19 N ATOM 0 H LYS A 861 6.360 -29.994 51.676 1.00 36.87 H new ATOM 0 HA LYS A 861 7.310 -32.438 51.385 1.00 36.10 H new ATOM 0 HB2 LYS A 861 5.349 -30.987 49.989 1.00 39.43 H new ATOM 0 HB3 LYS A 861 5.846 -32.334 49.379 1.00 39.43 H new ATOM 0 HG2 LYS A 861 4.616 -32.169 51.927 1.00 41.92 H new ATOM 0 HG3 LYS A 861 3.851 -32.612 50.643 1.00 41.92 H new ATOM 0 HD2 LYS A 861 5.382 -34.446 50.419 1.00 44.25 H new ATOM 0 HD3 LYS A 861 6.031 -34.031 51.775 1.00 44.25 H new ATOM 0 HE2 LYS A 861 4.094 -34.562 52.937 1.00 47.31 H new ATOM 0 HE3 LYS A 861 3.308 -34.785 51.609 1.00 47.31 H new ATOM 0 HZ1 LYS A 861 3.980 -36.798 52.464 1.00 49.19 H new ATOM 0 HZ2 LYS A 861 4.644 -36.609 51.185 1.00 49.19 H new ATOM 0 HZ3 LYS A 861 5.377 -36.402 52.423 1.00 49.19 H new ATOM 1575 N LEU A 862 8.231 -30.182 49.293 1.00 34.58 N ATOM 1576 CA LEU A 862 9.219 -29.818 48.277 1.00 34.95 C ATOM 1577 C LEU A 862 10.637 -29.981 48.853 1.00 35.33 C ATOM 1578 O LEU A 862 11.509 -30.586 48.223 1.00 36.47 O ATOM 1579 CB LEU A 862 8.999 -28.371 47.830 1.00 33.78 C ATOM 1580 CG LEU A 862 9.997 -27.794 46.820 1.00 33.91 C ATOM 1581 CD1 LEU A 862 9.960 -28.607 45.536 1.00 35.54 C ATOM 1582 CD2 LEU A 862 9.660 -26.344 46.534 1.00 33.62 C ATOM 0 H LEU A 862 7.714 -29.538 49.532 1.00 34.58 H new ATOM 0 HA LEU A 862 9.118 -30.402 47.509 1.00 34.95 H new ATOM 0 HB2 LEU A 862 8.111 -28.306 47.446 1.00 33.78 H new ATOM 0 HB3 LEU A 862 9.009 -27.807 48.619 1.00 33.78 H new ATOM 0 HG LEU A 862 10.891 -27.839 47.193 1.00 33.91 H new ATOM 0 HD11 LEU A 862 10.593 -28.238 44.901 1.00 35.54 H new ATOM 0 HD12 LEU A 862 10.196 -29.528 45.729 1.00 35.54 H new ATOM 0 HD13 LEU A 862 9.067 -28.575 45.158 1.00 35.54 H new ATOM 0 HD21 LEU A 862 10.294 -25.984 45.895 1.00 33.62 H new ATOM 0 HD22 LEU A 862 8.764 -26.286 46.167 1.00 33.62 H new ATOM 0 HD23 LEU A 862 9.706 -25.833 47.357 1.00 33.62 H new ATOM 1583 N LEU A 863 10.857 -29.440 50.051 1.00 34.04 N ATOM 1584 CA LEU A 863 12.158 -29.540 50.722 1.00 34.59 C ATOM 1585 C LEU A 863 12.579 -31.001 50.851 1.00 35.33 C ATOM 1586 O LEU A 863 13.712 -31.360 50.516 1.00 33.12 O ATOM 1587 CB LEU A 863 12.090 -28.884 52.108 1.00 33.50 C ATOM 1588 CG LEU A 863 12.113 -27.348 52.088 1.00 33.23 C ATOM 1589 CD1 LEU A 863 11.579 -26.788 53.387 1.00 34.70 C ATOM 1590 CD2 LEU A 863 13.548 -26.870 51.849 1.00 35.77 C ATOM 0 H LEU A 863 10.262 -29.007 50.497 1.00 34.04 H new ATOM 0 HA LEU A 863 12.819 -29.074 50.187 1.00 34.59 H new ATOM 0 HB2 LEU A 863 11.280 -29.178 52.553 1.00 33.50 H new ATOM 0 HB3 LEU A 863 12.837 -29.200 52.640 1.00 33.50 H new ATOM 0 HG LEU A 863 11.543 -27.030 51.371 1.00 33.23 H new ATOM 0 HD11 LEU A 863 11.601 -25.819 53.355 1.00 34.70 H new ATOM 0 HD12 LEU A 863 10.665 -27.086 53.516 1.00 34.70 H new ATOM 0 HD13 LEU A 863 12.128 -27.100 54.124 1.00 34.70 H new ATOM 0 HD21 LEU A 863 13.568 -25.900 51.835 1.00 35.77 H new ATOM 0 HD22 LEU A 863 14.120 -27.195 52.561 1.00 35.77 H new ATOM 0 HD23 LEU A 863 13.866 -27.211 50.998 1.00 35.77 H new ATOM 1591 N ASP A 864 11.660 -31.843 51.327 1.00 35.34 N ATOM 1592 CA ASP A 864 11.931 -33.269 51.477 1.00 36.49 C ATOM 1593 C ASP A 864 12.372 -33.903 50.158 1.00 35.43 C ATOM 1594 O ASP A 864 13.288 -34.724 50.136 1.00 35.77 O ATOM 1595 CB ASP A 864 10.685 -34.021 51.975 1.00 38.37 C ATOM 1596 CG ASP A 864 10.458 -33.883 53.475 1.00 41.57 C ATOM 1597 OD1 ASP A 864 11.331 -33.321 54.183 1.00 37.75 O ATOM 1598 OD2 ASP A 864 9.394 -34.357 53.940 1.00 39.65 O ATOM 0 H ASP A 864 10.870 -31.604 51.569 1.00 35.34 H new ATOM 0 HA ASP A 864 12.647 -33.343 52.127 1.00 36.49 H new ATOM 0 HB2 ASP A 864 9.905 -33.689 51.504 1.00 38.37 H new ATOM 0 HB3 ASP A 864 10.772 -34.961 51.752 1.00 38.37 H new ATOM 1599 N SER A 865 11.706 -33.534 49.065 1.00 35.63 N ATOM 1600 CA SER A 865 12.024 -34.096 47.757 1.00 34.79 C ATOM 1601 C SER A 865 13.466 -33.822 47.315 1.00 33.93 C ATOM 1602 O SER A 865 14.010 -34.542 46.482 1.00 33.96 O ATOM 1603 CB SER A 865 11.034 -33.586 46.693 1.00 35.85 C ATOM 1604 OG SER A 865 11.219 -32.212 46.373 1.00 38.59 O ATOM 0 H SER A 865 11.066 -32.959 49.061 1.00 35.63 H new ATOM 0 HA SER A 865 11.938 -35.058 47.846 1.00 34.79 H new ATOM 0 HB2 SER A 865 11.132 -34.116 45.887 1.00 35.85 H new ATOM 0 HB3 SER A 865 10.128 -33.719 47.012 1.00 35.85 H new ATOM 0 HG SER A 865 11.194 -31.754 47.077 1.00 38.59 H new ATOM 1605 N VAL A 866 14.095 -32.798 47.881 1.00 34.59 N ATOM 1606 CA VAL A 866 15.475 -32.483 47.513 1.00 32.94 C ATOM 1607 C VAL A 866 16.458 -33.569 47.956 1.00 32.54 C ATOM 1608 O VAL A 866 17.426 -33.878 47.249 1.00 29.70 O ATOM 1609 CB VAL A 866 15.936 -31.139 48.135 1.00 32.08 C ATOM 1610 CG1 VAL A 866 17.393 -30.866 47.772 1.00 34.49 C ATOM 1611 CG2 VAL A 866 15.060 -30.010 47.653 1.00 29.75 C ATOM 0 H VAL A 866 13.749 -32.278 48.472 1.00 34.59 H new ATOM 0 HA VAL A 866 15.479 -32.423 46.545 1.00 32.94 H new ATOM 0 HB VAL A 866 15.859 -31.200 49.100 1.00 32.08 H new ATOM 0 HG11 VAL A 866 17.672 -30.024 48.165 1.00 34.49 H new ATOM 0 HG12 VAL A 866 17.951 -31.582 48.113 1.00 34.49 H new ATOM 0 HG13 VAL A 866 17.483 -30.818 46.807 1.00 34.49 H new ATOM 0 HG21 VAL A 866 15.359 -29.177 48.049 1.00 29.75 H new ATOM 0 HG22 VAL A 866 15.116 -29.947 46.687 1.00 29.75 H new ATOM 0 HG23 VAL A 866 14.141 -30.180 47.913 1.00 29.75 H new ATOM 1612 N GLN A 867 16.203 -34.158 49.121 1.00 33.03 N ATOM 1613 CA GLN A 867 17.101 -35.171 49.674 1.00 33.82 C ATOM 1614 C GLN A 867 17.341 -36.403 48.803 1.00 33.62 C ATOM 1615 O GLN A 867 18.490 -36.804 48.600 1.00 32.71 O ATOM 1616 CB GLN A 867 16.630 -35.589 51.076 1.00 35.22 C ATOM 1617 CG GLN A 867 16.531 -34.428 52.082 1.00 37.12 C ATOM 1618 CD GLN A 867 17.826 -33.628 52.222 1.00 37.46 C ATOM 1619 OE1 GLN A 867 18.910 -34.132 51.954 1.00 38.15 O ATOM 1620 NE2 GLN A 867 17.709 -32.380 52.662 1.00 36.45 N ATOM 0 H GLN A 867 15.515 -33.986 49.608 1.00 33.03 H new ATOM 0 HA GLN A 867 17.966 -34.734 49.715 1.00 33.82 H new ATOM 0 HB2 GLN A 867 15.761 -36.013 51.001 1.00 35.22 H new ATOM 0 HB3 GLN A 867 17.242 -36.255 51.426 1.00 35.22 H new ATOM 0 HG2 GLN A 867 15.819 -33.830 51.806 1.00 37.12 H new ATOM 0 HG3 GLN A 867 16.283 -34.782 52.950 1.00 37.12 H new ATOM 0 HE21 GLN A 867 16.932 -32.058 52.841 1.00 36.45 H new ATOM 0 HE22 GLN A 867 18.410 -31.894 52.768 1.00 36.45 H new ATOM 1621 N PRO A 868 16.270 -37.027 48.280 1.00 33.87 N ATOM 1622 CA PRO A 868 16.470 -38.211 47.434 1.00 33.53 C ATOM 1623 C PRO A 868 17.377 -37.900 46.243 1.00 32.12 C ATOM 1624 O PRO A 868 18.223 -38.707 45.857 1.00 30.42 O ATOM 1625 CB PRO A 868 15.051 -38.563 46.992 1.00 36.57 C ATOM 1626 CG PRO A 868 14.216 -38.110 48.154 1.00 35.88 C ATOM 1627 CD PRO A 868 14.835 -36.776 48.506 1.00 34.31 C ATOM 0 HA PRO A 868 16.912 -38.941 47.895 1.00 33.53 H new ATOM 0 HB2 PRO A 868 14.806 -38.105 46.173 1.00 36.57 H new ATOM 0 HB3 PRO A 868 14.951 -39.514 46.827 1.00 36.57 H new ATOM 0 HG2 PRO A 868 13.281 -38.021 47.913 1.00 35.88 H new ATOM 0 HG3 PRO A 868 14.260 -38.735 48.895 1.00 35.88 H new ATOM 0 HD2 PRO A 868 14.499 -36.061 47.943 1.00 34.31 H new ATOM 0 HD3 PRO A 868 14.652 -36.523 49.424 1.00 34.31 H new ATOM 1628 N ILE A 869 17.185 -36.723 45.664 1.00 31.56 N ATOM 1629 CA ILE A 869 17.975 -36.290 44.513 1.00 32.68 C ATOM 1630 C ILE A 869 19.441 -36.111 44.922 1.00 31.20 C ATOM 1631 O ILE A 869 20.350 -36.587 44.243 1.00 31.00 O ATOM 1632 CB ILE A 869 17.434 -34.948 43.947 1.00 31.76 C ATOM 1633 CG1 ILE A 869 15.997 -35.140 43.447 1.00 33.48 C ATOM 1634 CG2 ILE A 869 18.336 -34.442 42.829 1.00 33.05 C ATOM 1635 CD1 ILE A 869 15.356 -33.869 42.947 1.00 33.77 C ATOM 0 H ILE A 869 16.596 -36.152 45.924 1.00 31.56 H new ATOM 0 HA ILE A 869 17.907 -36.971 43.826 1.00 32.68 H new ATOM 0 HB ILE A 869 17.431 -34.282 44.652 1.00 31.76 H new ATOM 0 HG12 ILE A 869 15.996 -35.796 42.733 1.00 33.48 H new ATOM 0 HG13 ILE A 869 15.458 -35.504 44.167 1.00 33.48 H new ATOM 0 HG21 ILE A 869 17.987 -33.605 42.485 1.00 33.05 H new ATOM 0 HG22 ILE A 869 19.232 -34.301 43.174 1.00 33.05 H new ATOM 0 HG23 ILE A 869 18.365 -35.097 42.115 1.00 33.05 H new ATOM 0 HD11 ILE A 869 14.453 -34.058 42.647 1.00 33.77 H new ATOM 0 HD12 ILE A 869 15.328 -33.217 43.664 1.00 33.77 H new ATOM 0 HD13 ILE A 869 15.874 -33.514 42.208 1.00 33.77 H new ATOM 1636 N ALA A 870 19.657 -35.414 46.032 1.00 29.96 N ATOM 1637 CA ALA A 870 21.007 -35.175 46.525 1.00 32.67 C ATOM 1638 C ALA A 870 21.695 -36.511 46.786 1.00 34.21 C ATOM 1639 O ALA A 870 22.897 -36.670 46.520 1.00 33.12 O ATOM 1640 CB ALA A 870 20.958 -34.340 47.804 1.00 29.77 C ATOM 0 H ALA A 870 19.034 -35.070 46.515 1.00 29.96 H new ATOM 0 HA ALA A 870 21.512 -34.684 45.858 1.00 32.67 H new ATOM 0 HB1 ALA A 870 21.860 -34.186 48.125 1.00 29.77 H new ATOM 0 HB2 ALA A 870 20.531 -33.489 47.619 1.00 29.77 H new ATOM 0 HB3 ALA A 870 20.451 -34.815 48.481 1.00 29.77 H new ATOM 1641 N ARG A 871 20.921 -37.471 47.293 1.00 34.37 N ATOM 1642 CA ARG A 871 21.432 -38.807 47.587 1.00 35.46 C ATOM 1643 C ARG A 871 21.943 -39.508 46.331 1.00 35.39 C ATOM 1644 O ARG A 871 23.005 -40.123 46.349 1.00 34.90 O ATOM 1645 CB ARG A 871 20.345 -39.655 48.265 1.00 38.04 C ATOM 1646 CG ARG A 871 20.748 -41.096 48.549 1.00 41.17 C ATOM 1647 CD ARG A 871 22.117 -41.161 49.203 1.00 45.31 C ATOM 1648 NE ARG A 871 22.581 -42.533 49.390 1.00 49.22 N ATOM 1649 CZ ARG A 871 22.257 -43.299 50.426 1.00 49.16 C ATOM 1650 NH1 ARG A 871 21.463 -42.828 51.379 1.00 49.46 N ATOM 1651 NH2 ARG A 871 22.732 -44.533 50.509 1.00 49.50 N ATOM 0 H ARG A 871 20.087 -37.365 47.475 1.00 34.37 H new ATOM 0 HA ARG A 871 22.183 -38.707 48.193 1.00 35.46 H new ATOM 0 HB2 ARG A 871 20.095 -39.231 49.101 1.00 38.04 H new ATOM 0 HB3 ARG A 871 19.555 -39.658 47.701 1.00 38.04 H new ATOM 0 HG2 ARG A 871 20.090 -41.511 49.128 1.00 41.17 H new ATOM 0 HG3 ARG A 871 20.757 -41.602 47.721 1.00 41.17 H new ATOM 0 HD2 ARG A 871 22.757 -40.678 48.657 1.00 45.31 H new ATOM 0 HD3 ARG A 871 22.083 -40.714 50.063 1.00 45.31 H new ATOM 0 HE ARG A 871 23.098 -42.867 48.790 1.00 49.22 H new ATOM 0 HH11 ARG A 871 21.157 -42.026 51.327 1.00 49.46 H new ATOM 0 HH12 ARG A 871 21.254 -43.325 52.049 1.00 49.46 H new ATOM 0 HH21 ARG A 871 23.249 -44.837 49.893 1.00 49.50 H new ATOM 0 HH22 ARG A 871 22.523 -45.030 51.179 1.00 49.50 H new ATOM 1652 N GLU A 872 21.198 -39.414 45.235 1.00 34.48 N ATOM 1653 CA GLU A 872 21.631 -40.051 43.999 1.00 35.45 C ATOM 1654 C GLU A 872 22.910 -39.408 43.474 1.00 34.25 C ATOM 1655 O GLU A 872 23.795 -40.092 42.968 1.00 32.44 O ATOM 1656 CB GLU A 872 20.541 -39.961 42.939 1.00 38.07 C ATOM 1657 CG GLU A 872 19.250 -40.645 43.342 1.00 44.85 C ATOM 1658 CD GLU A 872 18.292 -40.795 42.180 1.00 49.41 C ATOM 1659 OE1 GLU A 872 18.117 -39.817 41.426 1.00 53.67 O ATOM 1660 OE2 GLU A 872 17.708 -41.887 42.024 1.00 53.00 O ATOM 0 H GLU A 872 20.450 -38.993 45.186 1.00 34.48 H new ATOM 0 HA GLU A 872 21.808 -40.985 44.194 1.00 35.45 H new ATOM 0 HB2 GLU A 872 20.359 -39.027 42.751 1.00 38.07 H new ATOM 0 HB3 GLU A 872 20.866 -40.358 42.116 1.00 38.07 H new ATOM 0 HG2 GLU A 872 19.451 -41.521 43.708 1.00 44.85 H new ATOM 0 HG3 GLU A 872 18.822 -40.134 44.047 1.00 44.85 H new ATOM 1661 N LEU A 873 22.999 -38.089 43.602 1.00 33.33 N ATOM 1662 CA LEU A 873 24.172 -37.368 43.146 1.00 32.41 C ATOM 1663 C LEU A 873 25.366 -37.711 44.033 1.00 32.33 C ATOM 1664 O LEU A 873 26.489 -37.814 43.554 1.00 32.85 O ATOM 1665 CB LEU A 873 23.881 -35.862 43.141 1.00 31.48 C ATOM 1666 CG LEU A 873 22.844 -35.472 42.071 1.00 31.00 C ATOM 1667 CD1 LEU A 873 22.417 -34.033 42.236 1.00 30.68 C ATOM 1668 CD2 LEU A 873 23.434 -35.703 40.681 1.00 32.17 C ATOM 0 H LEU A 873 22.388 -37.595 43.951 1.00 33.33 H new ATOM 0 HA LEU A 873 24.392 -37.632 42.239 1.00 32.41 H new ATOM 0 HB2 LEU A 873 23.557 -35.594 44.015 1.00 31.48 H new ATOM 0 HB3 LEU A 873 24.705 -35.376 42.982 1.00 31.48 H new ATOM 0 HG LEU A 873 22.057 -36.028 42.178 1.00 31.00 H new ATOM 0 HD11 LEU A 873 21.765 -33.808 41.554 1.00 30.68 H new ATOM 0 HD12 LEU A 873 22.021 -33.911 43.113 1.00 30.68 H new ATOM 0 HD13 LEU A 873 23.190 -33.454 42.147 1.00 30.68 H new ATOM 0 HD21 LEU A 873 22.781 -35.457 40.007 1.00 32.17 H new ATOM 0 HD22 LEU A 873 24.230 -35.159 40.573 1.00 32.17 H new ATOM 0 HD23 LEU A 873 23.666 -36.639 40.579 1.00 32.17 H new ATOM 1669 N HIS A 874 25.113 -37.910 45.324 1.00 32.96 N ATOM 1670 CA HIS A 874 26.169 -38.273 46.266 1.00 31.45 C ATOM 1671 C HIS A 874 26.777 -39.612 45.863 1.00 32.27 C ATOM 1672 O HIS A 874 28.004 -39.776 45.825 1.00 29.60 O ATOM 1673 CB HIS A 874 25.604 -38.386 47.683 1.00 30.60 C ATOM 1674 CG HIS A 874 25.457 -37.074 48.387 1.00 31.70 C ATOM 1675 ND1 HIS A 874 24.403 -36.799 49.232 1.00 29.92 N ATOM 1676 CD2 HIS A 874 26.248 -35.976 48.402 1.00 30.76 C ATOM 1677 CE1 HIS A 874 24.551 -35.589 49.738 1.00 30.07 C ATOM 1678 NE2 HIS A 874 25.663 -35.068 49.252 1.00 31.02 N ATOM 0 H HIS A 874 24.332 -37.839 45.676 1.00 32.96 H new ATOM 0 HA HIS A 874 26.850 -37.582 46.249 1.00 31.45 H new ATOM 0 HB2 HIS A 874 24.737 -38.819 47.642 1.00 30.60 H new ATOM 0 HB3 HIS A 874 26.184 -38.961 48.207 1.00 30.60 H new ATOM 0 HD1 HIS A 874 23.751 -37.333 49.403 1.00 29.92 H new ATOM 0 HD2 HIS A 874 27.039 -35.858 47.927 1.00 30.76 H new ATOM 0 HE1 HIS A 874 23.971 -35.174 50.335 1.00 30.07 H new ATOM 1679 N GLN A 875 25.909 -40.570 45.556 1.00 31.41 N ATOM 1680 CA GLN A 875 26.351 -41.901 45.153 1.00 34.27 C ATOM 1681 C GLN A 875 27.097 -41.830 43.834 1.00 33.93 C ATOM 1682 O GLN A 875 28.152 -42.443 43.669 1.00 32.89 O ATOM 1683 CB GLN A 875 25.153 -42.843 45.001 1.00 37.15 C ATOM 1684 CG GLN A 875 25.536 -44.291 44.724 1.00 40.55 C ATOM 1685 CD GLN A 875 26.293 -44.926 45.881 1.00 40.87 C ATOM 1686 OE1 GLN A 875 25.752 -45.092 46.974 1.00 39.97 O ATOM 1687 NE2 GLN A 875 27.553 -45.279 45.643 1.00 41.23 N ATOM 0 H GLN A 875 25.055 -40.469 45.575 1.00 31.41 H new ATOM 0 HA GLN A 875 26.942 -42.243 45.842 1.00 34.27 H new ATOM 0 HB2 GLN A 875 24.621 -42.808 45.811 1.00 37.15 H new ATOM 0 HB3 GLN A 875 24.591 -42.523 44.278 1.00 37.15 H new ATOM 0 HG2 GLN A 875 24.734 -44.806 44.545 1.00 40.55 H new ATOM 0 HG3 GLN A 875 26.083 -44.330 43.924 1.00 40.55 H new ATOM 0 HE21 GLN A 875 27.897 -45.147 44.866 1.00 41.23 H new ATOM 0 HE22 GLN A 875 28.024 -45.639 46.266 1.00 41.23 H new ATOM 1688 N PHE A 876 26.544 -41.066 42.899 1.00 33.18 N ATOM 1689 CA PHE A 876 27.141 -40.906 41.577 1.00 34.78 C ATOM 1690 C PHE A 876 28.533 -40.274 41.616 1.00 33.69 C ATOM 1691 O PHE A 876 29.462 -40.781 40.991 1.00 32.65 O ATOM 1692 CB PHE A 876 26.209 -40.072 40.693 1.00 35.43 C ATOM 1693 CG PHE A 876 26.656 -39.961 39.265 1.00 36.31 C ATOM 1694 CD1 PHE A 876 27.548 -38.968 38.871 1.00 36.13 C ATOM 1695 CD2 PHE A 876 26.168 -40.839 38.304 1.00 37.12 C ATOM 1696 CE1 PHE A 876 27.943 -38.849 37.537 1.00 37.57 C ATOM 1697 CE2 PHE A 876 26.561 -40.728 36.963 1.00 37.39 C ATOM 1698 CZ PHE A 876 27.448 -39.731 36.581 1.00 36.33 C ATOM 0 H PHE A 876 25.814 -40.626 43.012 1.00 33.18 H new ATOM 0 HA PHE A 876 27.254 -41.795 41.206 1.00 34.78 H new ATOM 0 HB2 PHE A 876 25.322 -40.464 40.715 1.00 35.43 H new ATOM 0 HB3 PHE A 876 26.134 -39.181 41.069 1.00 35.43 H new ATOM 0 HD1 PHE A 876 27.885 -38.376 39.504 1.00 36.13 H new ATOM 0 HD2 PHE A 876 25.573 -41.509 38.554 1.00 37.12 H new ATOM 0 HE1 PHE A 876 28.538 -38.179 37.287 1.00 37.57 H new ATOM 0 HE2 PHE A 876 26.228 -41.322 36.330 1.00 37.39 H new ATOM 0 HZ PHE A 876 27.710 -39.653 35.692 1.00 36.33 H new ATOM 1699 N THR A 877 28.680 -39.180 42.358 1.00 34.38 N ATOM 1700 CA THR A 877 29.968 -38.499 42.433 1.00 34.64 C ATOM 1701 C THR A 877 31.019 -39.313 43.187 1.00 35.00 C ATOM 1702 O THR A 877 32.214 -39.245 42.873 1.00 34.44 O ATOM 1703 CB THR A 877 29.826 -37.090 43.067 1.00 35.12 C ATOM 1704 OG1 THR A 877 31.049 -36.366 42.886 1.00 35.75 O ATOM 1705 CG2 THR A 877 29.505 -37.183 44.546 1.00 34.58 C ATOM 0 H THR A 877 28.052 -38.819 42.822 1.00 34.38 H new ATOM 0 HA THR A 877 30.276 -38.401 41.519 1.00 34.64 H new ATOM 0 HB THR A 877 29.095 -36.627 42.628 1.00 35.12 H new ATOM 0 HG1 THR A 877 31.025 -35.953 42.155 1.00 35.75 H new ATOM 0 HG21 THR A 877 29.422 -36.290 44.916 1.00 34.58 H new ATOM 0 HG22 THR A 877 28.670 -37.662 44.667 1.00 34.58 H new ATOM 0 HG23 THR A 877 30.218 -37.657 45.003 1.00 34.58 H new ATOM 1706 N PHE A 878 30.577 -40.076 44.181 1.00 33.61 N ATOM 1707 CA PHE A 878 31.482 -40.926 44.934 1.00 35.47 C ATOM 1708 C PHE A 878 32.055 -41.988 43.987 1.00 36.54 C ATOM 1709 O PHE A 878 33.274 -42.154 43.881 1.00 35.33 O ATOM 1710 CB PHE A 878 30.754 -41.627 46.082 1.00 34.80 C ATOM 1711 CG PHE A 878 31.587 -42.679 46.762 1.00 35.40 C ATOM 1712 CD1 PHE A 878 32.610 -42.316 47.637 1.00 34.66 C ATOM 1713 CD2 PHE A 878 31.383 -44.031 46.489 1.00 35.56 C ATOM 1714 CE1 PHE A 878 33.422 -43.290 48.231 1.00 36.15 C ATOM 1715 CE2 PHE A 878 32.185 -45.012 47.073 1.00 36.08 C ATOM 1716 CZ PHE A 878 33.209 -44.641 47.947 1.00 36.17 C ATOM 0 H PHE A 878 29.756 -40.114 44.433 1.00 33.61 H new ATOM 0 HA PHE A 878 32.188 -40.376 45.309 1.00 35.47 H new ATOM 0 HB2 PHE A 878 30.483 -40.965 46.737 1.00 34.80 H new ATOM 0 HB3 PHE A 878 29.944 -42.036 45.741 1.00 34.80 H new ATOM 0 HD1 PHE A 878 32.755 -41.417 47.828 1.00 34.66 H new ATOM 0 HD2 PHE A 878 30.702 -44.283 45.908 1.00 35.56 H new ATOM 0 HE1 PHE A 878 34.102 -43.038 48.813 1.00 36.15 H new ATOM 0 HE2 PHE A 878 32.038 -45.910 46.881 1.00 36.08 H new ATOM 0 HZ PHE A 878 33.747 -45.291 48.338 1.00 36.17 H new ATOM 1717 N ASP A 879 31.170 -42.707 43.301 1.00 36.83 N ATOM 1718 CA ASP A 879 31.613 -43.734 42.366 1.00 38.31 C ATOM 1719 C ASP A 879 32.525 -43.144 41.301 1.00 37.87 C ATOM 1720 O ASP A 879 33.506 -43.774 40.893 1.00 35.80 O ATOM 1721 CB ASP A 879 30.421 -44.415 41.684 1.00 40.85 C ATOM 1722 CG ASP A 879 29.574 -45.217 42.651 1.00 44.71 C ATOM 1723 OD1 ASP A 879 30.106 -45.631 43.706 1.00 48.45 O ATOM 1724 OD2 ASP A 879 28.380 -45.450 42.349 1.00 46.15 O ATOM 0 H ASP A 879 30.317 -42.616 43.362 1.00 36.83 H new ATOM 0 HA ASP A 879 32.104 -44.394 42.879 1.00 38.31 H new ATOM 0 HB2 ASP A 879 29.868 -43.741 41.258 1.00 40.85 H new ATOM 0 HB3 ASP A 879 30.746 -45.000 40.982 1.00 40.85 H new ATOM 1725 N LEU A 880 32.195 -41.940 40.840 1.00 36.30 N ATOM 1726 CA LEU A 880 33.001 -41.279 39.824 1.00 35.51 C ATOM 1727 C LEU A 880 34.392 -40.917 40.354 1.00 35.85 C ATOM 1728 O LEU A 880 35.374 -40.986 39.618 1.00 35.73 O ATOM 1729 CB LEU A 880 32.299 -40.017 39.324 1.00 35.08 C ATOM 1730 CG LEU A 880 33.023 -39.227 38.224 1.00 35.85 C ATOM 1731 CD1 LEU A 880 33.308 -40.132 37.027 1.00 37.23 C ATOM 1732 CD2 LEU A 880 32.174 -38.044 37.796 1.00 34.65 C ATOM 0 H LEU A 880 31.510 -41.492 41.103 1.00 36.30 H new ATOM 0 HA LEU A 880 33.109 -41.903 39.089 1.00 35.51 H new ATOM 0 HB2 LEU A 880 31.422 -40.267 38.993 1.00 35.08 H new ATOM 0 HB3 LEU A 880 32.158 -39.427 40.081 1.00 35.08 H new ATOM 0 HG LEU A 880 33.867 -38.900 38.573 1.00 35.85 H new ATOM 0 HD11 LEU A 880 33.765 -39.624 36.339 1.00 37.23 H new ATOM 0 HD12 LEU A 880 33.868 -40.873 37.307 1.00 37.23 H new ATOM 0 HD13 LEU A 880 32.472 -40.475 36.674 1.00 37.23 H new ATOM 0 HD21 LEU A 880 32.636 -37.549 37.101 1.00 34.65 H new ATOM 0 HD22 LEU A 880 31.324 -38.362 37.455 1.00 34.65 H new ATOM 0 HD23 LEU A 880 32.019 -37.464 38.558 1.00 34.65 H new ATOM 1733 N LEU A 881 34.477 -40.535 41.624 1.00 36.60 N ATOM 1734 CA LEU A 881 35.762 -40.164 42.207 1.00 37.15 C ATOM 1735 C LEU A 881 36.688 -41.375 42.256 1.00 39.15 C ATOM 1736 O LEU A 881 37.861 -41.281 41.888 1.00 38.00 O ATOM 1737 CB LEU A 881 35.579 -39.595 43.616 1.00 36.38 C ATOM 1738 CG LEU A 881 36.892 -39.265 44.351 1.00 37.98 C ATOM 1739 CD1 LEU A 881 37.682 -38.207 43.576 1.00 36.14 C ATOM 1740 CD2 LEU A 881 36.592 -38.783 45.758 1.00 35.93 C ATOM 0 H LEU A 881 33.808 -40.484 42.162 1.00 36.60 H new ATOM 0 HA LEU A 881 36.160 -39.479 41.647 1.00 37.15 H new ATOM 0 HB2 LEU A 881 35.043 -38.789 43.559 1.00 36.38 H new ATOM 0 HB3 LEU A 881 35.077 -40.233 44.147 1.00 36.38 H new ATOM 0 HG LEU A 881 37.432 -40.069 44.408 1.00 37.98 H new ATOM 0 HD11 LEU A 881 38.506 -38.008 44.048 1.00 36.14 H new ATOM 0 HD12 LEU A 881 37.891 -38.543 42.690 1.00 36.14 H new ATOM 0 HD13 LEU A 881 37.151 -37.399 43.498 1.00 36.14 H new ATOM 0 HD21 LEU A 881 37.423 -38.577 46.214 1.00 35.93 H new ATOM 0 HD22 LEU A 881 36.041 -37.986 45.717 1.00 35.93 H new ATOM 0 HD23 LEU A 881 36.120 -39.477 46.244 1.00 35.93 H new ATOM 1741 N ILE A 882 36.147 -42.508 42.700 1.00 39.22 N ATOM 1742 CA ILE A 882 36.907 -43.749 42.797 1.00 41.47 C ATOM 1743 C ILE A 882 37.639 -44.059 41.489 1.00 43.37 C ATOM 1744 O ILE A 882 38.831 -44.361 41.491 1.00 43.83 O ATOM 1745 CB ILE A 882 35.983 -44.953 43.152 1.00 41.12 C ATOM 1746 CG1 ILE A 882 35.228 -44.674 44.456 1.00 38.80 C ATOM 1747 CG2 ILE A 882 36.809 -46.237 43.282 1.00 41.51 C ATOM 1748 CD1 ILE A 882 36.112 -44.279 45.628 1.00 41.15 C ATOM 0 H ILE A 882 35.328 -42.577 42.953 1.00 39.22 H new ATOM 0 HA ILE A 882 37.557 -43.622 43.506 1.00 41.47 H new ATOM 0 HB ILE A 882 35.338 -45.071 42.437 1.00 41.12 H new ATOM 0 HG12 ILE A 882 34.585 -43.965 44.298 1.00 38.80 H new ATOM 0 HG13 ILE A 882 34.723 -45.466 44.699 1.00 38.80 H new ATOM 0 HG21 ILE A 882 36.223 -46.978 43.503 1.00 41.51 H new ATOM 0 HG22 ILE A 882 37.258 -46.420 42.442 1.00 41.51 H new ATOM 0 HG23 ILE A 882 37.470 -46.127 43.984 1.00 41.51 H new ATOM 0 HD11 ILE A 882 35.561 -44.121 46.410 1.00 41.15 H new ATOM 0 HD12 ILE A 882 36.740 -44.994 45.815 1.00 41.15 H new ATOM 0 HD13 ILE A 882 36.600 -43.470 45.408 1.00 41.15 H new ATOM 1749 N LYS A 883 36.936 -43.978 40.366 1.00 45.07 N ATOM 1750 CA LYS A 883 37.580 -44.277 39.091 1.00 47.07 C ATOM 1751 C LYS A 883 37.764 -43.082 38.174 1.00 46.49 C ATOM 1752 O LYS A 883 37.793 -43.230 36.954 1.00 47.82 O ATOM 1753 CB LYS A 883 36.805 -45.376 38.369 1.00 48.57 C ATOM 1754 CG LYS A 883 35.316 -45.131 38.267 1.00 50.26 C ATOM 1755 CD LYS A 883 34.981 -44.137 37.184 1.00 49.86 C ATOM 1756 CE LYS A 883 33.477 -44.037 37.026 1.00 53.58 C ATOM 1757 NZ LYS A 883 32.874 -45.394 36.890 1.00 54.96 N ATOM 0 H LYS A 883 36.106 -43.758 40.318 1.00 45.07 H new ATOM 0 HA LYS A 883 38.477 -44.572 39.312 1.00 47.07 H new ATOM 0 HB2 LYS A 883 37.167 -45.477 37.475 1.00 48.57 H new ATOM 0 HB3 LYS A 883 36.952 -46.216 38.831 1.00 48.57 H new ATOM 0 HG2 LYS A 883 34.863 -45.969 38.087 1.00 50.26 H new ATOM 0 HG3 LYS A 883 34.983 -44.805 39.118 1.00 50.26 H new ATOM 0 HD2 LYS A 883 35.350 -43.268 37.406 1.00 49.86 H new ATOM 0 HD3 LYS A 883 35.385 -44.411 36.346 1.00 49.86 H new ATOM 0 HE2 LYS A 883 33.095 -43.583 37.794 1.00 53.58 H new ATOM 0 HE3 LYS A 883 33.263 -43.503 36.245 1.00 53.58 H new ATOM 0 HZ1 LYS A 883 32.063 -45.324 36.530 1.00 54.96 H new ATOM 0 HZ2 LYS A 883 33.388 -45.896 36.365 1.00 54.96 H new ATOM 0 HZ3 LYS A 883 32.810 -45.773 37.693 1.00 54.96 H new ATOM 1758 N SER A 884 37.908 -41.900 38.763 1.00 46.51 N ATOM 1759 CA SER A 884 38.085 -40.679 37.989 1.00 47.21 C ATOM 1760 C SER A 884 39.327 -40.731 37.101 1.00 50.21 C ATOM 1761 O SER A 884 39.344 -40.162 36.011 1.00 49.86 O ATOM 1762 CB SER A 884 38.152 -39.472 38.927 1.00 45.63 C ATOM 1763 OG SER A 884 39.049 -39.696 39.999 1.00 47.24 O ATOM 0 H SER A 884 37.906 -41.784 39.615 1.00 46.51 H new ATOM 0 HA SER A 884 37.318 -40.592 37.402 1.00 47.21 H new ATOM 0 HB2 SER A 884 38.432 -38.688 38.428 1.00 45.63 H new ATOM 0 HB3 SER A 884 37.267 -39.284 39.278 1.00 45.63 H new ATOM 0 HG SER A 884 38.658 -40.124 40.607 1.00 47.24 H new ATOM 1764 N HIS A 885 40.361 -41.423 37.566 1.00 52.52 N ATOM 1765 CA HIS A 885 41.605 -41.545 36.810 1.00 56.46 C ATOM 1766 C HIS A 885 41.459 -42.428 35.565 1.00 56.78 C ATOM 1767 O HIS A 885 42.240 -42.319 34.623 1.00 56.72 O ATOM 1768 CB HIS A 885 42.699 -42.097 37.727 1.00 59.55 C ATOM 1769 CG HIS A 885 42.250 -43.253 38.565 1.00 63.64 C ATOM 1770 ND1 HIS A 885 42.099 -44.526 38.058 1.00 65.92 N ATOM 1771 CD2 HIS A 885 41.868 -43.318 39.863 1.00 64.90 C ATOM 1772 CE1 HIS A 885 41.642 -45.325 39.007 1.00 66.41 C ATOM 1773 NE2 HIS A 885 41.493 -44.616 40.111 1.00 66.77 N ATOM 0 H HIS A 885 40.363 -41.833 38.322 1.00 52.52 H new ATOM 0 HA HIS A 885 41.846 -40.660 36.494 1.00 56.46 H new ATOM 0 HB2 HIS A 885 43.455 -42.374 37.186 1.00 59.55 H new ATOM 0 HB3 HIS A 885 43.011 -41.387 38.309 1.00 59.55 H new ATOM 0 HD2 HIS A 885 41.861 -42.615 40.472 1.00 64.90 H new ATOM 0 HE1 HIS A 885 41.457 -46.232 38.913 1.00 66.41 H new ATOM 0 HE2 HIS A 885 41.207 -44.918 40.864 1.00 66.77 H new ATOM 1774 N MET A 886 40.449 -43.291 35.560 1.00 58.05 N ATOM 1775 CA MET A 886 40.212 -44.184 34.431 1.00 58.64 C ATOM 1776 C MET A 886 39.249 -43.611 33.389 1.00 56.89 C ATOM 1777 O MET A 886 39.154 -44.133 32.278 1.00 56.39 O ATOM 1778 CB MET A 886 39.678 -45.530 34.929 1.00 62.40 C ATOM 1779 CG MET A 886 40.675 -46.331 35.757 1.00 68.34 C ATOM 1780 SD MET A 886 42.084 -46.931 34.781 1.00 75.92 S ATOM 1781 CE MET A 886 43.273 -45.560 34.993 1.00 73.93 C ATOM 0 H MET A 886 39.886 -43.376 36.205 1.00 58.05 H new ATOM 0 HA MET A 886 41.069 -44.297 33.991 1.00 58.64 H new ATOM 0 HB2 MET A 886 38.883 -45.374 35.462 1.00 62.40 H new ATOM 0 HB3 MET A 886 39.407 -46.062 34.164 1.00 62.40 H new ATOM 0 HG2 MET A 886 41.003 -45.778 36.484 1.00 68.34 H new ATOM 0 HG3 MET A 886 40.220 -47.088 36.159 1.00 68.34 H new ATOM 0 HE1 MET A 886 43.564 -45.246 34.122 1.00 73.93 H new ATOM 0 HE2 MET A 886 42.846 -44.833 35.472 1.00 73.93 H new ATOM 0 HE3 MET A 886 44.041 -45.872 35.497 1.00 73.93 H new ATOM 1782 N VAL A 887 38.535 -42.545 33.740 1.00 54.02 N ATOM 1783 CA VAL A 887 37.598 -41.935 32.799 1.00 51.38 C ATOM 1784 C VAL A 887 37.993 -40.500 32.460 1.00 51.08 C ATOM 1785 O VAL A 887 37.246 -39.774 31.802 1.00 51.69 O ATOM 1786 CB VAL A 887 36.147 -41.959 33.344 1.00 50.34 C ATOM 1787 CG1 VAL A 887 35.652 -43.395 33.433 1.00 49.37 C ATOM 1788 CG2 VAL A 887 36.083 -41.292 34.705 1.00 48.90 C ATOM 0 H VAL A 887 38.577 -42.163 34.509 1.00 54.02 H new ATOM 0 HA VAL A 887 37.636 -42.467 31.988 1.00 51.38 H new ATOM 0 HB VAL A 887 35.574 -41.467 32.735 1.00 50.34 H new ATOM 0 HG11 VAL A 887 34.744 -43.404 33.774 1.00 49.37 H new ATOM 0 HG12 VAL A 887 35.669 -43.799 32.551 1.00 49.37 H new ATOM 0 HG13 VAL A 887 36.227 -43.899 34.030 1.00 49.37 H new ATOM 0 HG21 VAL A 887 35.171 -41.314 35.034 1.00 48.90 H new ATOM 0 HG22 VAL A 887 36.661 -41.764 35.325 1.00 48.90 H new ATOM 0 HG23 VAL A 887 36.376 -40.371 34.628 1.00 48.90 H new ATOM 1789 N SER A 888 39.177 -40.104 32.915 1.00 50.26 N ATOM 1790 CA SER A 888 39.713 -38.772 32.660 1.00 49.36 C ATOM 1791 C SER A 888 38.865 -37.617 33.202 1.00 47.39 C ATOM 1792 O SER A 888 38.669 -36.606 32.526 1.00 46.15 O ATOM 1793 CB SER A 888 39.933 -38.590 31.160 1.00 51.12 C ATOM 1794 OG SER A 888 40.717 -39.651 30.651 1.00 55.12 O ATOM 0 H SER A 888 39.696 -40.605 33.384 1.00 50.26 H new ATOM 0 HA SER A 888 40.550 -38.729 33.149 1.00 49.36 H new ATOM 0 HB2 SER A 888 39.079 -38.561 30.702 1.00 51.12 H new ATOM 0 HB3 SER A 888 40.374 -37.743 30.991 1.00 51.12 H new ATOM 0 HG SER A 888 40.832 -39.544 29.826 1.00 55.12 H new ATOM 1795 N VAL A 889 38.368 -37.769 34.424 1.00 45.95 N ATOM 1796 CA VAL A 889 37.567 -36.722 35.047 1.00 44.03 C ATOM 1797 C VAL A 889 38.359 -36.112 36.190 1.00 43.99 C ATOM 1798 O VAL A 889 38.732 -36.805 37.129 1.00 44.46 O ATOM 1799 CB VAL A 889 36.236 -37.278 35.601 1.00 43.28 C ATOM 1800 CG1 VAL A 889 35.548 -36.225 36.456 1.00 39.88 C ATOM 1801 CG2 VAL A 889 35.334 -37.701 34.451 1.00 41.08 C ATOM 0 H VAL A 889 38.483 -38.470 34.909 1.00 45.95 H new ATOM 0 HA VAL A 889 37.361 -36.056 34.373 1.00 44.03 H new ATOM 0 HB VAL A 889 36.420 -38.053 36.154 1.00 43.28 H new ATOM 0 HG11 VAL A 889 34.714 -36.581 36.800 1.00 39.88 H new ATOM 0 HG12 VAL A 889 36.125 -35.982 37.197 1.00 39.88 H new ATOM 0 HG13 VAL A 889 35.366 -35.439 35.917 1.00 39.88 H new ATOM 0 HG21 VAL A 889 34.500 -38.049 34.804 1.00 41.08 H new ATOM 0 HG22 VAL A 889 35.150 -36.935 33.885 1.00 41.08 H new ATOM 0 HG23 VAL A 889 35.776 -38.389 33.929 1.00 41.08 H new ATOM 1802 N ASP A 890 38.611 -34.811 36.103 1.00 45.02 N ATOM 1803 CA ASP A 890 39.362 -34.102 37.129 1.00 45.83 C ATOM 1804 C ASP A 890 38.485 -33.621 38.285 1.00 45.03 C ATOM 1805 O ASP A 890 37.432 -33.023 38.074 1.00 42.54 O ATOM 1806 CB ASP A 890 40.072 -32.893 36.514 1.00 50.44 C ATOM 1807 CG ASP A 890 41.201 -33.286 35.575 1.00 53.85 C ATOM 1808 OD1 ASP A 890 41.691 -32.404 34.836 1.00 57.69 O ATOM 1809 OD2 ASP A 890 41.606 -34.468 35.580 1.00 56.33 O ATOM 0 H ASP A 890 38.352 -34.316 35.449 1.00 45.02 H new ATOM 0 HA ASP A 890 40.004 -34.735 37.488 1.00 45.83 H new ATOM 0 HB2 ASP A 890 39.426 -32.356 36.029 1.00 50.44 H new ATOM 0 HB3 ASP A 890 40.427 -32.336 37.224 1.00 50.44 H new ATOM 1810 N PHE A 891 38.929 -33.895 39.507 1.00 43.69 N ATOM 1811 CA PHE A 891 38.219 -33.454 40.701 1.00 42.96 C ATOM 1812 C PHE A 891 39.086 -32.423 41.420 1.00 43.48 C ATOM 1813 O PHE A 891 40.240 -32.701 41.756 1.00 43.81 O ATOM 1814 CB PHE A 891 37.949 -34.620 41.660 1.00 39.88 C ATOM 1815 CG PHE A 891 36.703 -35.405 41.344 1.00 37.95 C ATOM 1816 CD1 PHE A 891 36.718 -36.412 40.382 1.00 35.93 C ATOM 1817 CD2 PHE A 891 35.513 -35.138 42.012 1.00 35.99 C ATOM 1818 CE1 PHE A 891 35.562 -37.145 40.091 1.00 36.22 C ATOM 1819 CE2 PHE A 891 34.348 -35.863 41.730 1.00 34.07 C ATOM 1820 CZ PHE A 891 34.371 -36.866 40.772 1.00 33.84 C ATOM 0 H PHE A 891 39.647 -34.340 39.667 1.00 43.69 H new ATOM 0 HA PHE A 891 37.366 -33.078 40.432 1.00 42.96 H new ATOM 0 HB2 PHE A 891 38.710 -35.221 41.644 1.00 39.88 H new ATOM 0 HB3 PHE A 891 37.880 -34.273 42.563 1.00 39.88 H new ATOM 0 HD1 PHE A 891 37.507 -36.600 39.927 1.00 35.93 H new ATOM 0 HD2 PHE A 891 35.490 -34.468 42.656 1.00 35.99 H new ATOM 0 HE1 PHE A 891 35.585 -37.816 39.447 1.00 36.22 H new ATOM 0 HE2 PHE A 891 33.560 -35.672 42.185 1.00 34.07 H new ATOM 0 HZ PHE A 891 33.600 -37.350 40.583 1.00 33.84 H new ATOM 1821 N PRO A 892 38.549 -31.213 41.650 1.00 43.44 N ATOM 1822 CA PRO A 892 39.311 -30.164 42.342 1.00 42.87 C ATOM 1823 C PRO A 892 39.625 -30.595 43.774 1.00 42.52 C ATOM 1824 O PRO A 892 39.019 -31.531 44.295 1.00 42.76 O ATOM 1825 CB PRO A 892 38.370 -28.962 42.293 1.00 42.92 C ATOM 1826 CG PRO A 892 37.589 -29.193 41.037 1.00 42.62 C ATOM 1827 CD PRO A 892 37.294 -30.671 41.101 1.00 43.06 C ATOM 0 HA PRO A 892 40.172 -29.970 41.940 1.00 42.87 H new ATOM 0 HB2 PRO A 892 37.794 -28.926 43.072 1.00 42.92 H new ATOM 0 HB3 PRO A 892 38.859 -28.125 42.263 1.00 42.92 H new ATOM 0 HG2 PRO A 892 36.777 -28.664 41.015 1.00 42.62 H new ATOM 0 HG3 PRO A 892 38.101 -28.961 40.246 1.00 42.62 H new ATOM 0 HD2 PRO A 892 36.535 -30.865 41.672 1.00 43.06 H new ATOM 0 HD3 PRO A 892 37.092 -31.039 40.226 1.00 43.06 H new ATOM 1828 N GLU A 893 40.550 -29.890 44.413 1.00 41.78 N ATOM 1829 CA GLU A 893 40.975 -30.213 45.774 1.00 42.30 C ATOM 1830 C GLU A 893 39.879 -30.349 46.846 1.00 40.80 C ATOM 1831 O GLU A 893 39.726 -31.407 47.455 1.00 41.50 O ATOM 1832 CB GLU A 893 42.001 -29.180 46.247 1.00 44.68 C ATOM 1833 CG GLU A 893 42.694 -29.556 47.547 1.00 46.97 C ATOM 1834 CD GLU A 893 43.334 -28.364 48.231 1.00 50.14 C ATOM 1835 OE1 GLU A 893 43.918 -27.514 47.527 1.00 52.39 O ATOM 1836 OE2 GLU A 893 43.260 -28.281 49.475 1.00 52.50 O ATOM 0 H GLU A 893 40.951 -29.210 44.072 1.00 41.78 H new ATOM 0 HA GLU A 893 41.343 -31.107 45.692 1.00 42.30 H new ATOM 0 HB2 GLU A 893 42.671 -29.061 45.556 1.00 44.68 H new ATOM 0 HB3 GLU A 893 41.558 -28.325 46.362 1.00 44.68 H new ATOM 0 HG2 GLU A 893 42.050 -29.962 48.148 1.00 46.97 H new ATOM 0 HG3 GLU A 893 43.373 -30.224 47.366 1.00 46.97 H new ATOM 1837 N MET A 894 39.134 -29.279 47.092 1.00 39.82 N ATOM 1838 CA MET A 894 38.096 -29.324 48.116 1.00 40.54 C ATOM 1839 C MET A 894 37.038 -30.378 47.815 1.00 39.34 C ATOM 1840 O MET A 894 36.614 -31.102 48.711 1.00 38.26 O ATOM 1841 CB MET A 894 37.446 -27.947 48.287 1.00 40.49 C ATOM 1842 CG MET A 894 38.425 -26.869 48.727 1.00 42.62 C ATOM 1843 SD MET A 894 37.626 -25.355 49.288 1.00 43.44 S ATOM 1844 CE MET A 894 37.023 -24.697 47.713 1.00 42.10 C ATOM 0 H MET A 894 39.210 -28.526 46.684 1.00 39.82 H new ATOM 0 HA MET A 894 38.526 -29.575 48.948 1.00 40.54 H new ATOM 0 HB2 MET A 894 37.039 -27.682 47.447 1.00 40.49 H new ATOM 0 HB3 MET A 894 36.732 -28.012 48.940 1.00 40.49 H new ATOM 0 HG2 MET A 894 38.979 -27.218 49.443 1.00 42.62 H new ATOM 0 HG3 MET A 894 39.017 -26.659 47.988 1.00 42.62 H new ATOM 0 HE1 MET A 894 37.059 -23.728 47.732 1.00 42.10 H new ATOM 0 HE2 MET A 894 37.579 -25.027 46.990 1.00 42.10 H new ATOM 0 HE3 MET A 894 36.107 -24.983 47.572 1.00 42.10 H new ATOM 1845 N MET A 895 36.618 -30.467 46.557 1.00 39.71 N ATOM 1846 CA MET A 895 35.623 -31.458 46.163 1.00 40.05 C ATOM 1847 C MET A 895 36.136 -32.870 46.472 1.00 39.39 C ATOM 1848 O MET A 895 35.438 -33.670 47.091 1.00 38.11 O ATOM 1849 CB MET A 895 35.309 -31.327 44.665 1.00 40.36 C ATOM 1850 CG MET A 895 34.482 -30.092 44.277 1.00 41.05 C ATOM 1851 SD MET A 895 32.743 -30.165 44.826 1.00 43.44 S ATOM 1852 CE MET A 895 32.657 -28.782 45.941 1.00 47.47 C ATOM 0 H MET A 895 36.896 -29.964 45.917 1.00 39.71 H new ATOM 0 HA MET A 895 34.809 -31.302 46.667 1.00 40.05 H new ATOM 0 HB2 MET A 895 36.145 -31.306 44.174 1.00 40.36 H new ATOM 0 HB3 MET A 895 34.832 -32.121 44.378 1.00 40.36 H new ATOM 0 HG2 MET A 895 34.899 -29.302 44.656 1.00 41.05 H new ATOM 0 HG3 MET A 895 34.504 -29.989 43.313 1.00 41.05 H new ATOM 0 HE1 MET A 895 32.504 -29.103 46.844 1.00 47.47 H new ATOM 0 HE2 MET A 895 33.492 -28.289 45.910 1.00 47.47 H new ATOM 0 HE3 MET A 895 31.928 -28.199 45.678 1.00 47.47 H new ATOM 1853 N ALA A 896 37.366 -33.164 46.050 1.00 39.67 N ATOM 1854 CA ALA A 896 37.972 -34.474 46.275 1.00 39.16 C ATOM 1855 C ALA A 896 38.040 -34.845 47.752 1.00 39.08 C ATOM 1856 O ALA A 896 37.789 -35.995 48.130 1.00 38.77 O ATOM 1857 CB ALA A 896 39.379 -34.507 45.670 1.00 41.13 C ATOM 0 H ALA A 896 37.870 -32.611 45.627 1.00 39.67 H new ATOM 0 HA ALA A 896 37.404 -35.129 45.840 1.00 39.16 H new ATOM 0 HB1 ALA A 896 39.777 -35.379 45.822 1.00 41.13 H new ATOM 0 HB2 ALA A 896 39.325 -34.339 44.716 1.00 41.13 H new ATOM 0 HB3 ALA A 896 39.927 -33.825 46.088 1.00 41.13 H new ATOM 1858 N GLU A 897 38.383 -33.870 48.587 1.00 39.66 N ATOM 1859 CA GLU A 897 38.490 -34.098 50.021 1.00 40.57 C ATOM 1860 C GLU A 897 37.119 -34.375 50.639 1.00 39.78 C ATOM 1861 O GLU A 897 36.933 -35.357 51.356 1.00 38.96 O ATOM 1862 CB GLU A 897 39.131 -32.883 50.697 1.00 43.84 C ATOM 1863 CG GLU A 897 39.485 -33.090 52.169 1.00 47.57 C ATOM 1864 CD GLU A 897 39.924 -31.798 52.855 1.00 51.98 C ATOM 1865 OE1 GLU A 897 40.818 -31.101 52.321 1.00 54.16 O ATOM 1866 OE2 GLU A 897 39.376 -31.481 53.933 1.00 54.62 O ATOM 0 H GLU A 897 38.559 -33.065 48.340 1.00 39.66 H new ATOM 0 HA GLU A 897 39.049 -34.878 50.162 1.00 40.57 H new ATOM 0 HB2 GLU A 897 39.937 -32.646 50.213 1.00 43.84 H new ATOM 0 HB3 GLU A 897 38.524 -32.130 50.625 1.00 43.84 H new ATOM 0 HG2 GLU A 897 38.716 -33.454 52.635 1.00 47.57 H new ATOM 0 HG3 GLU A 897 40.196 -33.746 52.238 1.00 47.57 H new ATOM 1867 N ILE A 898 36.152 -33.517 50.351 1.00 38.55 N ATOM 1868 CA ILE A 898 34.814 -33.700 50.902 1.00 38.69 C ATOM 1869 C ILE A 898 34.126 -34.975 50.394 1.00 37.38 C ATOM 1870 O ILE A 898 33.438 -35.661 51.152 1.00 37.91 O ATOM 1871 CB ILE A 898 33.929 -32.463 50.596 1.00 39.13 C ATOM 1872 CG1 ILE A 898 34.450 -31.262 51.388 1.00 39.34 C ATOM 1873 CG2 ILE A 898 32.470 -32.744 50.954 1.00 39.57 C ATOM 1874 CD1 ILE A 898 33.847 -29.932 50.979 1.00 41.72 C ATOM 0 H ILE A 898 36.245 -32.828 49.844 1.00 38.55 H new ATOM 0 HA ILE A 898 34.921 -33.798 51.861 1.00 38.69 H new ATOM 0 HB ILE A 898 33.973 -32.267 49.647 1.00 39.13 H new ATOM 0 HG12 ILE A 898 34.273 -31.409 52.330 1.00 39.34 H new ATOM 0 HG13 ILE A 898 35.413 -31.213 51.284 1.00 39.34 H new ATOM 0 HG21 ILE A 898 31.932 -31.962 50.757 1.00 39.57 H new ATOM 0 HG22 ILE A 898 32.148 -33.497 50.434 1.00 39.57 H new ATOM 0 HG23 ILE A 898 32.403 -32.952 51.899 1.00 39.57 H new ATOM 0 HD11 ILE A 898 34.225 -29.224 51.523 1.00 41.72 H new ATOM 0 HD12 ILE A 898 34.044 -29.761 50.045 1.00 41.72 H new ATOM 0 HD13 ILE A 898 32.886 -29.959 51.107 1.00 41.72 H new ATOM 1875 N ILE A 899 34.327 -35.313 49.125 1.00 36.92 N ATOM 1876 CA ILE A 899 33.683 -36.499 48.576 1.00 37.56 C ATOM 1877 C ILE A 899 34.271 -37.823 49.072 1.00 37.48 C ATOM 1878 O ILE A 899 33.584 -38.845 49.082 1.00 37.54 O ATOM 1879 CB ILE A 899 33.681 -36.442 47.033 1.00 37.20 C ATOM 1880 CG1 ILE A 899 32.859 -35.229 46.584 1.00 37.58 C ATOM 1881 CG2 ILE A 899 33.085 -37.713 46.448 1.00 36.10 C ATOM 1882 CD1 ILE A 899 32.845 -34.994 45.091 1.00 39.14 C ATOM 0 H ILE A 899 34.823 -34.878 48.574 1.00 36.92 H new ATOM 0 HA ILE A 899 32.771 -36.484 48.906 1.00 37.56 H new ATOM 0 HB ILE A 899 34.594 -36.362 46.716 1.00 37.20 H new ATOM 0 HG12 ILE A 899 31.945 -35.341 46.890 1.00 37.58 H new ATOM 0 HG13 ILE A 899 33.209 -34.437 47.021 1.00 37.58 H new ATOM 0 HG21 ILE A 899 33.092 -37.658 45.480 1.00 36.10 H new ATOM 0 HG22 ILE A 899 33.610 -38.477 46.732 1.00 36.10 H new ATOM 0 HG23 ILE A 899 32.172 -37.815 46.759 1.00 36.10 H new ATOM 0 HD11 ILE A 899 32.306 -34.213 44.891 1.00 39.14 H new ATOM 0 HD12 ILE A 899 33.752 -34.850 44.777 1.00 39.14 H new ATOM 0 HD13 ILE A 899 32.468 -35.769 44.645 1.00 39.14 H new ATOM 1883 N SER A 900 35.525 -37.809 49.508 1.00 37.48 N ATOM 1884 CA SER A 900 36.154 -39.033 50.001 1.00 37.18 C ATOM 1885 C SER A 900 36.078 -39.161 51.523 1.00 37.51 C ATOM 1886 O SER A 900 36.212 -40.253 52.068 1.00 38.16 O ATOM 1887 CB SER A 900 37.618 -39.094 49.548 1.00 37.01 C ATOM 1888 OG SER A 900 38.364 -38.006 50.061 1.00 38.02 O ATOM 0 H SER A 900 36.026 -37.110 49.528 1.00 37.48 H new ATOM 0 HA SER A 900 35.659 -39.777 49.623 1.00 37.18 H new ATOM 0 HB2 SER A 900 38.015 -39.928 49.843 1.00 37.01 H new ATOM 0 HB3 SER A 900 37.659 -39.088 48.579 1.00 37.01 H new ATOM 0 HG SER A 900 38.258 -37.335 49.567 1.00 38.02 H new ATOM 1889 N VAL A 901 35.841 -38.047 52.209 1.00 38.97 N ATOM 1890 CA VAL A 901 35.775 -38.051 53.666 1.00 39.58 C ATOM 1891 C VAL A 901 34.370 -37.869 54.239 1.00 41.32 C ATOM 1892 O VAL A 901 33.960 -38.609 55.135 1.00 42.99 O ATOM 1893 CB VAL A 901 36.676 -36.942 54.265 1.00 38.99 C ATOM 1894 CG1 VAL A 901 36.561 -36.941 55.777 1.00 39.07 C ATOM 1895 CG2 VAL A 901 38.121 -37.147 53.833 1.00 38.60 C ATOM 0 H VAL A 901 35.715 -37.277 51.848 1.00 38.97 H new ATOM 0 HA VAL A 901 36.084 -38.936 53.917 1.00 39.58 H new ATOM 0 HB VAL A 901 36.380 -36.080 53.934 1.00 38.99 H new ATOM 0 HG11 VAL A 901 37.128 -36.245 56.144 1.00 39.07 H new ATOM 0 HG12 VAL A 901 35.640 -36.776 56.032 1.00 39.07 H new ATOM 0 HG13 VAL A 901 36.842 -37.802 56.124 1.00 39.07 H new ATOM 0 HG21 VAL A 901 38.675 -36.448 54.214 1.00 38.60 H new ATOM 0 HG22 VAL A 901 38.433 -38.011 54.144 1.00 38.60 H new ATOM 0 HG23 VAL A 901 38.178 -37.113 52.865 1.00 38.60 H new ATOM 1896 N GLN A 902 33.637 -36.885 53.730 1.00 40.44 N ATOM 1897 CA GLN A 902 32.292 -36.604 54.236 1.00 39.06 C ATOM 1898 C GLN A 902 31.164 -37.364 53.532 1.00 38.28 C ATOM 1899 O GLN A 902 30.250 -37.871 54.186 1.00 37.64 O ATOM 1900 CB GLN A 902 32.001 -35.101 54.143 1.00 40.83 C ATOM 1901 CG GLN A 902 33.093 -34.195 54.703 1.00 42.91 C ATOM 1902 CD GLN A 902 33.453 -34.533 56.130 1.00 46.30 C ATOM 1903 OE1 GLN A 902 32.596 -34.932 56.923 1.00 47.61 O ATOM 1904 NE2 GLN A 902 34.727 -34.358 56.474 1.00 46.98 N ATOM 0 H GLN A 902 33.896 -36.368 53.093 1.00 40.44 H new ATOM 0 HA GLN A 902 32.300 -36.914 55.155 1.00 39.06 H new ATOM 0 HB2 GLN A 902 31.855 -34.871 53.212 1.00 40.83 H new ATOM 0 HB3 GLN A 902 31.173 -34.916 54.614 1.00 40.83 H new ATOM 0 HG2 GLN A 902 33.885 -34.267 54.147 1.00 42.91 H new ATOM 0 HG3 GLN A 902 32.798 -33.272 54.657 1.00 42.91 H new ATOM 0 HE21 GLN A 902 35.295 -34.078 55.892 1.00 46.98 H new ATOM 0 HE22 GLN A 902 34.982 -34.525 57.278 1.00 46.98 H new ATOM 1905 N VAL A 903 31.211 -37.426 52.204 1.00 35.93 N ATOM 1906 CA VAL A 903 30.162 -38.118 51.461 1.00 35.56 C ATOM 1907 C VAL A 903 29.986 -39.581 51.893 1.00 35.45 C ATOM 1908 O VAL A 903 28.854 -40.039 52.080 1.00 33.76 O ATOM 1909 CB VAL A 903 30.412 -38.030 49.936 1.00 36.31 C ATOM 1910 CG1 VAL A 903 29.376 -38.854 49.174 1.00 38.91 C ATOM 1911 CG2 VAL A 903 30.328 -36.572 49.490 1.00 35.81 C ATOM 0 H VAL A 903 31.832 -37.080 51.720 1.00 35.93 H new ATOM 0 HA VAL A 903 29.333 -37.661 51.672 1.00 35.56 H new ATOM 0 HB VAL A 903 31.295 -38.384 49.744 1.00 36.31 H new ATOM 0 HG11 VAL A 903 29.547 -38.788 48.221 1.00 38.91 H new ATOM 0 HG12 VAL A 903 29.435 -39.782 49.449 1.00 38.91 H new ATOM 0 HG13 VAL A 903 28.488 -38.516 49.367 1.00 38.91 H new ATOM 0 HG21 VAL A 903 30.485 -36.516 48.534 1.00 35.81 H new ATOM 0 HG22 VAL A 903 29.447 -36.221 49.694 1.00 35.81 H new ATOM 0 HG23 VAL A 903 30.999 -36.051 49.958 1.00 35.81 H new ATOM 1912 N PRO A 904 31.096 -40.327 52.078 1.00 34.77 N ATOM 1913 CA PRO A 904 30.982 -41.732 52.491 1.00 34.42 C ATOM 1914 C PRO A 904 30.236 -41.891 53.811 1.00 33.88 C ATOM 1915 O PRO A 904 29.607 -42.916 54.052 1.00 36.67 O ATOM 1916 CB PRO A 904 32.439 -42.191 52.587 1.00 33.74 C ATOM 1917 CG PRO A 904 33.141 -41.306 51.607 1.00 32.97 C ATOM 1918 CD PRO A 904 32.509 -39.965 51.850 1.00 33.65 C ATOM 0 HA PRO A 904 30.462 -42.264 51.868 1.00 34.42 H new ATOM 0 HB2 PRO A 904 32.791 -42.082 53.484 1.00 33.74 H new ATOM 0 HB3 PRO A 904 32.535 -43.128 52.357 1.00 33.74 H new ATOM 0 HG2 PRO A 904 34.098 -41.286 51.763 1.00 32.97 H new ATOM 0 HG3 PRO A 904 33.009 -41.605 50.694 1.00 32.97 H new ATOM 0 HD2 PRO A 904 32.897 -39.515 52.617 1.00 33.65 H new ATOM 0 HD3 PRO A 904 32.613 -39.371 51.090 1.00 33.65 H new ATOM 1919 N LYS A 905 30.302 -40.875 54.665 1.00 35.25 N ATOM 1920 CA LYS A 905 29.608 -40.930 55.944 1.00 35.25 C ATOM 1921 C LYS A 905 28.098 -40.871 55.714 1.00 35.23 C ATOM 1922 O LYS A 905 27.318 -41.397 56.499 1.00 35.54 O ATOM 1923 CB LYS A 905 30.044 -39.772 56.835 1.00 38.62 C ATOM 1924 CG LYS A 905 31.526 -39.779 57.186 1.00 39.47 C ATOM 1925 CD LYS A 905 31.855 -38.635 58.122 1.00 41.96 C ATOM 1926 CE LYS A 905 33.357 -38.507 58.336 1.00 43.59 C ATOM 1927 NZ LYS A 905 33.677 -37.305 59.150 1.00 45.82 N ATOM 0 H LYS A 905 30.741 -40.149 54.523 1.00 35.25 H new ATOM 0 HA LYS A 905 29.833 -41.763 56.387 1.00 35.25 H new ATOM 0 HB2 LYS A 905 29.831 -38.937 56.390 1.00 38.62 H new ATOM 0 HB3 LYS A 905 29.527 -39.796 57.656 1.00 38.62 H new ATOM 0 HG2 LYS A 905 31.761 -40.623 57.603 1.00 39.47 H new ATOM 0 HG3 LYS A 905 32.056 -39.705 56.377 1.00 39.47 H new ATOM 0 HD2 LYS A 905 31.507 -37.806 57.758 1.00 41.96 H new ATOM 0 HD3 LYS A 905 31.416 -38.776 58.975 1.00 41.96 H new ATOM 0 HE2 LYS A 905 33.693 -39.301 58.780 1.00 43.59 H new ATOM 0 HE3 LYS A 905 33.806 -38.450 57.478 1.00 43.59 H new ATOM 0 HZ1 LYS A 905 34.558 -37.249 59.263 1.00 45.82 H new ATOM 0 HZ2 LYS A 905 33.385 -36.576 58.731 1.00 45.82 H new ATOM 0 HZ3 LYS A 905 33.280 -37.369 59.944 1.00 45.82 H new ATOM 1928 N ILE A 906 27.690 -40.222 54.633 1.00 34.57 N ATOM 1929 CA ILE A 906 26.270 -40.131 54.298 1.00 35.77 C ATOM 1930 C ILE A 906 25.844 -41.460 53.666 1.00 34.44 C ATOM 1931 O ILE A 906 24.850 -42.066 54.065 1.00 34.22 O ATOM 1932 CB ILE A 906 26.009 -38.984 53.285 1.00 36.51 C ATOM 1933 CG1 ILE A 906 26.420 -37.649 53.908 1.00 35.42 C ATOM 1934 CG2 ILE A 906 24.531 -38.970 52.861 1.00 36.26 C ATOM 1935 CD1 ILE A 906 26.356 -36.468 52.942 1.00 37.34 C ATOM 0 H ILE A 906 28.216 -39.827 54.079 1.00 34.57 H new ATOM 0 HA ILE A 906 25.763 -39.947 55.104 1.00 35.77 H new ATOM 0 HB ILE A 906 26.542 -39.129 52.488 1.00 36.51 H new ATOM 0 HG12 ILE A 906 25.844 -37.466 54.667 1.00 35.42 H new ATOM 0 HG13 ILE A 906 27.324 -37.727 54.250 1.00 35.42 H new ATOM 0 HG21 ILE A 906 24.382 -38.249 52.229 1.00 36.26 H new ATOM 0 HG22 ILE A 906 24.306 -39.817 52.445 1.00 36.26 H new ATOM 0 HG23 ILE A 906 23.971 -38.835 53.642 1.00 36.26 H new ATOM 0 HD11 ILE A 906 26.628 -35.658 53.402 1.00 37.34 H new ATOM 0 HD12 ILE A 906 26.951 -36.630 52.193 1.00 37.34 H new ATOM 0 HD13 ILE A 906 25.448 -36.365 52.617 1.00 37.34 H new ATOM 1936 N LEU A 907 26.621 -41.918 52.691 1.00 33.42 N ATOM 1937 CA LEU A 907 26.315 -43.165 52.003 1.00 34.67 C ATOM 1938 C LEU A 907 26.347 -44.383 52.933 1.00 35.72 C ATOM 1939 O LEU A 907 25.619 -45.342 52.702 1.00 35.18 O ATOM 1940 CB LEU A 907 27.273 -43.358 50.813 1.00 33.40 C ATOM 1941 CG LEU A 907 27.223 -42.240 49.753 1.00 33.69 C ATOM 1942 CD1 LEU A 907 28.206 -42.529 48.634 1.00 29.10 C ATOM 1943 CD2 LEU A 907 25.805 -42.119 49.187 1.00 32.12 C ATOM 0 H LEU A 907 27.331 -41.521 52.413 1.00 33.42 H new ATOM 0 HA LEU A 907 25.404 -43.097 51.676 1.00 34.67 H new ATOM 0 HB2 LEU A 907 28.180 -43.425 51.152 1.00 33.40 H new ATOM 0 HB3 LEU A 907 27.068 -44.203 50.383 1.00 33.40 H new ATOM 0 HG LEU A 907 27.469 -41.401 50.173 1.00 33.69 H new ATOM 0 HD11 LEU A 907 28.164 -41.819 47.975 1.00 29.10 H new ATOM 0 HD12 LEU A 907 29.104 -42.580 48.997 1.00 29.10 H new ATOM 0 HD13 LEU A 907 27.979 -43.373 48.214 1.00 29.10 H new ATOM 0 HD21 LEU A 907 25.781 -41.414 48.521 1.00 32.12 H new ATOM 0 HD22 LEU A 907 25.547 -42.959 48.777 1.00 32.12 H new ATOM 0 HD23 LEU A 907 25.187 -41.907 49.904 1.00 32.12 H new ATOM 1944 N SER A 908 27.165 -44.343 53.989 1.00 34.80 N ATOM 1945 CA SER A 908 27.240 -45.471 54.923 1.00 35.25 C ATOM 1946 C SER A 908 26.177 -45.400 56.022 1.00 35.20 C ATOM 1947 O SER A 908 26.055 -46.322 56.830 1.00 35.54 O ATOM 1948 CB SER A 908 28.637 -45.568 55.564 1.00 35.45 C ATOM 1949 OG SER A 908 28.865 -44.528 56.498 1.00 36.35 O ATOM 0 H SER A 908 27.679 -43.681 54.181 1.00 34.80 H new ATOM 0 HA SER A 908 27.069 -46.268 54.397 1.00 35.25 H new ATOM 0 HB2 SER A 908 28.730 -46.426 56.007 1.00 35.45 H new ATOM 0 HB3 SER A 908 29.314 -45.533 54.870 1.00 35.45 H new ATOM 0 HG SER A 908 29.146 -43.846 56.096 1.00 36.35 H new ATOM 1950 N GLY A 909 25.411 -44.310 56.054 1.00 34.22 N ATOM 1951 CA GLY A 909 24.363 -44.180 57.055 1.00 34.91 C ATOM 1952 C GLY A 909 24.722 -43.467 58.350 1.00 35.45 C ATOM 1953 O GLY A 909 23.902 -43.395 59.265 1.00 36.53 O ATOM 0 H GLY A 909 25.482 -43.646 55.512 1.00 34.22 H new ATOM 0 HA2 GLY A 909 23.617 -43.710 56.650 1.00 34.91 H new ATOM 0 HA3 GLY A 909 24.049 -45.070 57.279 1.00 34.91 H new ATOM 1954 N LYS A 910 25.942 -42.946 58.447 1.00 37.19 N ATOM 1955 CA LYS A 910 26.363 -42.228 59.647 1.00 38.25 C ATOM 1956 C LYS A 910 25.760 -40.821 59.694 1.00 38.41 C ATOM 1957 O LYS A 910 25.594 -40.240 60.764 1.00 39.04 O ATOM 1958 CB LYS A 910 27.880 -42.102 59.694 1.00 40.38 C ATOM 1959 CG LYS A 910 28.627 -43.361 60.075 1.00 41.91 C ATOM 1960 CD LYS A 910 30.087 -43.005 60.234 1.00 42.08 C ATOM 1961 CE LYS A 910 30.922 -44.180 60.665 1.00 45.04 C ATOM 1962 NZ LYS A 910 32.358 -43.764 60.803 1.00 44.49 N ATOM 0 H LYS A 910 26.540 -42.997 57.831 1.00 37.19 H new ATOM 0 HA LYS A 910 26.048 -42.739 60.409 1.00 38.25 H new ATOM 0 HB2 LYS A 910 28.192 -41.811 58.823 1.00 40.38 H new ATOM 0 HB3 LYS A 910 28.111 -41.404 60.326 1.00 40.38 H new ATOM 0 HG2 LYS A 910 28.275 -43.728 60.901 1.00 41.91 H new ATOM 0 HG3 LYS A 910 28.516 -44.041 59.393 1.00 41.91 H new ATOM 0 HD2 LYS A 910 30.427 -42.662 59.393 1.00 42.08 H new ATOM 0 HD3 LYS A 910 30.174 -42.293 60.887 1.00 42.08 H new ATOM 0 HE2 LYS A 910 30.595 -44.527 61.510 1.00 45.04 H new ATOM 0 HE3 LYS A 910 30.846 -44.897 60.016 1.00 45.04 H new ATOM 0 HZ1 LYS A 910 32.847 -44.463 61.058 1.00 44.49 H new ATOM 0 HZ2 LYS A 910 32.657 -43.463 60.020 1.00 44.49 H new ATOM 0 HZ3 LYS A 910 32.423 -43.119 61.413 1.00 44.49 H new ATOM 1963 N VAL A 911 25.457 -40.276 58.520 1.00 37.12 N ATOM 1964 CA VAL A 911 24.876 -38.945 58.403 1.00 34.76 C ATOM 1965 C VAL A 911 23.568 -39.097 57.634 1.00 36.48 C ATOM 1966 O VAL A 911 23.546 -39.701 56.565 1.00 35.16 O ATOM 1967 CB VAL A 911 25.828 -38.006 57.635 1.00 34.46 C ATOM 1968 CG1 VAL A 911 25.193 -36.629 57.454 1.00 32.68 C ATOM 1969 CG2 VAL A 911 27.155 -37.893 58.392 1.00 32.70 C ATOM 0 H VAL A 911 25.584 -40.670 57.766 1.00 37.12 H new ATOM 0 HA VAL A 911 24.725 -38.560 59.281 1.00 34.76 H new ATOM 0 HB VAL A 911 25.996 -38.376 56.754 1.00 34.46 H new ATOM 0 HG11 VAL A 911 25.804 -36.052 56.970 1.00 32.68 H new ATOM 0 HG12 VAL A 911 24.367 -36.717 56.954 1.00 32.68 H new ATOM 0 HG13 VAL A 911 25.004 -36.243 58.323 1.00 32.68 H new ATOM 0 HG21 VAL A 911 27.754 -37.302 57.909 1.00 32.70 H new ATOM 0 HG22 VAL A 911 26.993 -37.534 59.278 1.00 32.70 H new ATOM 0 HG23 VAL A 911 27.560 -38.771 58.469 1.00 32.70 H new ATOM 1970 N LYS A 912 22.484 -38.552 58.178 1.00 35.26 N ATOM 1971 CA LYS A 912 21.181 -38.672 57.534 1.00 36.13 C ATOM 1972 C LYS A 912 20.384 -37.384 57.443 1.00 34.92 C ATOM 1973 O LYS A 912 20.483 -36.507 58.302 1.00 32.19 O ATOM 1974 CB LYS A 912 20.330 -39.710 58.263 1.00 38.75 C ATOM 1975 CG LYS A 912 20.854 -41.123 58.164 1.00 43.84 C ATOM 1976 CD LYS A 912 19.906 -42.102 58.847 1.00 49.40 C ATOM 1977 CE LYS A 912 20.419 -43.528 58.735 1.00 52.02 C ATOM 1978 NZ LYS A 912 19.519 -44.482 59.438 1.00 56.94 N ATOM 0 H LYS A 912 22.482 -38.111 58.916 1.00 35.26 H new ATOM 0 HA LYS A 912 21.381 -38.939 56.623 1.00 36.13 H new ATOM 0 HB2 LYS A 912 20.269 -39.463 59.199 1.00 38.75 H new ATOM 0 HB3 LYS A 912 19.429 -39.684 57.904 1.00 38.75 H new ATOM 0 HG2 LYS A 912 20.962 -41.368 57.232 1.00 43.84 H new ATOM 0 HG3 LYS A 912 21.731 -41.176 58.574 1.00 43.84 H new ATOM 0 HD2 LYS A 912 19.808 -41.863 59.782 1.00 49.40 H new ATOM 0 HD3 LYS A 912 19.026 -42.039 58.444 1.00 49.40 H new ATOM 0 HE2 LYS A 912 20.490 -43.776 57.800 1.00 52.02 H new ATOM 0 HE3 LYS A 912 21.311 -43.584 59.112 1.00 52.02 H new ATOM 0 HZ1 LYS A 912 19.841 -45.308 59.358 1.00 56.94 H new ATOM 0 HZ2 LYS A 912 19.471 -44.265 60.300 1.00 56.94 H new ATOM 0 HZ3 LYS A 912 18.706 -44.444 59.077 1.00 56.94 H new ATOM 1979 N PRO A 913 19.564 -37.262 56.392 1.00 34.91 N ATOM 1980 CA PRO A 913 18.740 -36.067 56.199 1.00 35.29 C ATOM 1981 C PRO A 913 17.658 -36.001 57.271 1.00 35.59 C ATOM 1982 O PRO A 913 17.288 -37.018 57.869 1.00 34.37 O ATOM 1983 CB PRO A 913 18.117 -36.284 54.816 1.00 35.14 C ATOM 1984 CG PRO A 913 19.031 -37.284 54.153 1.00 36.44 C ATOM 1985 CD PRO A 913 19.388 -38.203 55.274 1.00 34.76 C ATOM 0 HA PRO A 913 19.241 -35.239 56.260 1.00 35.29 H new ATOM 0 HB2 PRO A 913 17.211 -36.623 54.885 1.00 35.14 H new ATOM 0 HB3 PRO A 913 18.073 -35.456 54.313 1.00 35.14 H new ATOM 0 HG2 PRO A 913 18.586 -37.754 53.430 1.00 36.44 H new ATOM 0 HG3 PRO A 913 19.815 -36.858 53.774 1.00 36.44 H new ATOM 0 HD2 PRO A 913 18.688 -38.851 55.450 1.00 34.76 H new ATOM 0 HD3 PRO A 913 20.198 -38.704 55.090 1.00 34.76 H new ATOM 1986 N ILE A 914 17.149 -34.799 57.499 1.00 34.27 N ATOM 1987 CA ILE A 914 16.076 -34.593 58.450 1.00 35.48 C ATOM 1988 C ILE A 914 14.837 -34.341 57.585 1.00 35.34 C ATOM 1989 O ILE A 914 14.712 -33.287 56.966 1.00 36.82 O ATOM 1990 CB ILE A 914 16.352 -33.356 59.348 1.00 36.14 C ATOM 1991 CG1 ILE A 914 17.679 -33.540 60.105 1.00 35.05 C ATOM 1992 CG2 ILE A 914 15.217 -33.163 60.326 1.00 37.44 C ATOM 1993 CD1 ILE A 914 18.083 -32.340 60.932 1.00 30.92 C ATOM 0 H ILE A 914 17.417 -34.082 57.106 1.00 34.27 H new ATOM 0 HA ILE A 914 15.974 -35.352 59.046 1.00 35.48 H new ATOM 0 HB ILE A 914 16.419 -32.568 58.787 1.00 36.14 H new ATOM 0 HG12 ILE A 914 17.605 -34.313 60.687 1.00 35.05 H new ATOM 0 HG13 ILE A 914 18.382 -33.733 59.465 1.00 35.05 H new ATOM 0 HG21 ILE A 914 15.397 -32.389 60.882 1.00 37.44 H new ATOM 0 HG22 ILE A 914 14.390 -33.025 59.839 1.00 37.44 H new ATOM 0 HG23 ILE A 914 15.134 -33.951 60.886 1.00 37.44 H new ATOM 0 HD11 ILE A 914 18.924 -32.524 61.380 1.00 30.92 H new ATOM 0 HD12 ILE A 914 18.187 -31.568 60.354 1.00 30.92 H new ATOM 0 HD13 ILE A 914 17.398 -32.157 61.594 1.00 30.92 H new ATOM 1994 N TYR A 915 13.942 -35.319 57.504 1.00 34.91 N ATOM 1995 CA TYR A 915 12.724 -35.143 56.719 1.00 35.02 C ATOM 1996 C TYR A 915 11.614 -34.577 57.591 1.00 35.44 C ATOM 1997 O TYR A 915 11.577 -34.826 58.793 1.00 35.34 O ATOM 1998 CB TYR A 915 12.235 -36.471 56.145 1.00 36.06 C ATOM 1999 CG TYR A 915 13.100 -37.050 55.065 1.00 38.03 C ATOM 2000 CD1 TYR A 915 14.172 -37.883 55.376 1.00 39.70 C ATOM 2001 CD2 TYR A 915 12.850 -36.764 53.725 1.00 38.78 C ATOM 2002 CE1 TYR A 915 14.977 -38.421 54.376 1.00 40.63 C ATOM 2003 CE2 TYR A 915 13.651 -37.296 52.717 1.00 40.33 C ATOM 2004 CZ TYR A 915 14.712 -38.121 53.052 1.00 39.68 C ATOM 2005 OH TYR A 915 15.517 -38.631 52.063 1.00 44.10 O ATOM 0 H TYR A 915 14.018 -36.084 57.890 1.00 34.91 H new ATOM 0 HA TYR A 915 12.937 -34.534 55.994 1.00 35.02 H new ATOM 0 HB2 TYR A 915 12.168 -37.115 56.867 1.00 36.06 H new ATOM 0 HB3 TYR A 915 11.340 -36.346 55.792 1.00 36.06 H new ATOM 0 HD1 TYR A 915 14.353 -38.083 56.266 1.00 39.70 H new ATOM 0 HD2 TYR A 915 12.138 -36.210 53.500 1.00 38.78 H new ATOM 0 HE1 TYR A 915 15.688 -38.978 54.597 1.00 40.63 H new ATOM 0 HE2 TYR A 915 13.475 -37.099 51.825 1.00 40.33 H new ATOM 0 HH TYR A 915 15.241 -38.370 51.314 1.00 44.10 H new ATOM 2006 N PHE A 916 10.715 -33.810 56.985 1.00 35.62 N ATOM 2007 CA PHE A 916 9.584 -33.263 57.715 1.00 38.93 C ATOM 2008 C PHE A 916 8.539 -34.361 57.823 1.00 41.62 C ATOM 2009 O PHE A 916 7.978 -34.603 58.890 1.00 40.72 O ATOM 2010 CB PHE A 916 8.969 -32.075 56.973 1.00 38.13 C ATOM 2011 CG PHE A 916 9.662 -30.777 57.232 1.00 39.36 C ATOM 2012 CD1 PHE A 916 10.621 -30.295 56.352 1.00 38.18 C ATOM 2013 CD2 PHE A 916 9.356 -30.031 58.370 1.00 40.50 C ATOM 2014 CE1 PHE A 916 11.263 -29.086 56.598 1.00 36.60 C ATOM 2015 CE2 PHE A 916 9.997 -28.819 58.623 1.00 38.72 C ATOM 2016 CZ PHE A 916 10.952 -28.348 57.731 1.00 37.97 C ATOM 0 H PHE A 916 10.743 -33.596 56.153 1.00 35.62 H new ATOM 0 HA PHE A 916 9.880 -32.956 58.586 1.00 38.93 H new ATOM 0 HB2 PHE A 916 8.985 -32.256 56.020 1.00 38.13 H new ATOM 0 HB3 PHE A 916 8.037 -31.991 57.230 1.00 38.13 H new ATOM 0 HD1 PHE A 916 10.836 -30.785 55.591 1.00 38.18 H new ATOM 0 HD2 PHE A 916 8.717 -30.346 58.967 1.00 40.50 H new ATOM 0 HE1 PHE A 916 11.903 -28.771 56.001 1.00 36.60 H new ATOM 0 HE2 PHE A 916 9.786 -28.329 59.385 1.00 38.72 H new ATOM 0 HZ PHE A 916 11.382 -27.539 57.893 1.00 37.97 H new ATOM 2017 N HIS A 917 8.304 -35.027 56.694 1.00 44.89 N ATOM 2018 CA HIS A 917 7.320 -36.099 56.589 1.00 48.36 C ATOM 2019 C HIS A 917 7.973 -37.476 56.578 1.00 51.77 C ATOM 2020 O HIS A 917 9.113 -37.635 56.137 1.00 54.18 O ATOM 2021 CB HIS A 917 6.506 -35.906 55.312 1.00 43.76 C ATOM 2022 CG HIS A 917 5.913 -34.539 55.182 1.00 42.41 C ATOM 2023 ND1 HIS A 917 4.661 -34.218 55.665 1.00 41.16 N ATOM 2024 CD2 HIS A 917 6.414 -33.399 54.650 1.00 39.13 C ATOM 2025 CE1 HIS A 917 4.417 -32.941 55.433 1.00 40.25 C ATOM 2026 NE2 HIS A 917 5.464 -32.421 54.819 1.00 40.10 N ATOM 0 H HIS A 917 8.718 -34.865 55.958 1.00 44.89 H new ATOM 0 HA HIS A 917 6.744 -36.056 57.369 1.00 48.36 H new ATOM 0 HB2 HIS A 917 7.075 -36.078 54.545 1.00 43.76 H new ATOM 0 HB3 HIS A 917 5.793 -36.563 55.289 1.00 43.76 H new ATOM 0 HD1 HIS A 917 4.124 -34.764 56.056 1.00 41.16 H new ATOM 0 HD2 HIS A 917 7.245 -33.297 54.246 1.00 39.13 H new ATOM 0 HE1 HIS A 917 3.640 -32.485 55.663 1.00 40.25 H new ATOM 2027 N THR A 918 7.238 -38.468 57.064 1.00 55.89 N ATOM 2028 CA THR A 918 7.729 -39.841 57.115 1.00 60.04 C ATOM 2029 C THR A 918 7.291 -40.592 55.859 1.00 61.69 C ATOM 2030 O THR A 918 6.403 -41.463 55.988 1.00 63.40 O ATOM 2031 CB THR A 918 7.182 -40.591 58.357 1.00 61.14 C ATOM 2032 OG1 THR A 918 7.427 -39.812 59.534 1.00 60.63 O ATOM 2033 CG2 THR A 918 7.864 -41.954 58.510 1.00 61.24 C ATOM 0 H THR A 918 6.442 -38.366 57.373 1.00 55.89 H new ATOM 0 HA THR A 918 8.697 -39.807 57.171 1.00 60.04 H new ATOM 0 HB THR A 918 6.229 -40.726 58.238 1.00 61.14 H new ATOM 0 HG1 THR A 918 7.129 -40.218 60.206 1.00 60.63 H new ATOM 0 HG21 THR A 918 7.510 -42.408 59.291 1.00 61.24 H new ATOM 0 HG22 THR A 918 7.695 -42.491 57.720 1.00 61.24 H new ATOM 0 HG23 THR A 918 8.820 -41.828 58.616 1.00 61.24 H new TER 2034 THR A 918 ATOM 2035 N SER B 99 45.447 -27.134 52.503 1.00 71.04 N ATOM 2036 CA SER B 99 43.986 -27.437 52.412 1.00 70.67 C ATOM 2037 C SER B 99 43.202 -26.147 52.217 1.00 69.62 C ATOM 2038 O SER B 99 43.064 -25.347 53.143 1.00 68.70 O ATOM 2039 CB SER B 99 43.510 -28.141 53.690 1.00 71.36 C ATOM 2040 OG SER B 99 42.140 -28.513 53.611 1.00 72.79 O ATOM 0 HA SER B 99 43.835 -28.023 51.654 1.00 70.67 H new ATOM 0 HB2 SER B 99 44.051 -28.931 53.844 1.00 71.36 H new ATOM 0 HB3 SER B 99 43.642 -27.554 54.451 1.00 71.36 H new ATOM 0 HG SER B 99 42.073 -29.257 53.226 1.00 72.79 H new ATOM 2041 N ARG B 100 42.691 -25.946 51.007 1.00 68.74 N ATOM 2042 CA ARG B 100 41.923 -24.748 50.710 1.00 68.11 C ATOM 2043 C ARG B 100 40.682 -24.678 51.587 1.00 67.42 C ATOM 2044 O ARG B 100 40.201 -23.593 51.911 1.00 67.98 O ATOM 2045 CB ARG B 100 41.510 -24.724 49.235 1.00 68.45 C ATOM 2046 CG ARG B 100 40.789 -23.442 48.828 1.00 68.98 C ATOM 2047 CD ARG B 100 40.413 -23.430 47.353 1.00 68.93 C ATOM 2048 NE ARG B 100 39.824 -22.151 46.956 1.00 69.44 N ATOM 2049 CZ ARG B 100 39.407 -21.864 45.724 1.00 69.23 C ATOM 2050 NH1 ARG B 100 39.506 -22.763 44.753 1.00 69.44 N ATOM 2051 NH2 ARG B 100 38.895 -20.669 45.458 1.00 69.63 N ATOM 0 H ARG B 100 42.778 -26.491 50.347 1.00 68.74 H new ATOM 0 HA ARG B 100 42.485 -23.979 50.894 1.00 68.11 H new ATOM 0 HB2 ARG B 100 42.300 -24.832 48.683 1.00 68.45 H new ATOM 0 HB3 ARG B 100 40.933 -25.483 49.055 1.00 68.45 H new ATOM 0 HG2 ARG B 100 39.987 -23.341 49.364 1.00 68.98 H new ATOM 0 HG3 ARG B 100 41.357 -22.680 49.020 1.00 68.98 H new ATOM 0 HD2 ARG B 100 41.202 -23.604 46.816 1.00 68.93 H new ATOM 0 HD3 ARG B 100 39.784 -24.146 47.173 1.00 68.93 H new ATOM 0 HE ARG B 100 39.741 -21.543 47.559 1.00 69.44 H new ATOM 0 HH11 ARG B 100 39.841 -23.538 44.917 1.00 69.44 H new ATOM 0 HH12 ARG B 100 39.235 -22.571 43.960 1.00 69.44 H new ATOM 0 HH21 ARG B 100 38.832 -20.080 46.081 1.00 69.63 H new ATOM 0 HH22 ARG B 100 38.626 -20.484 44.662 1.00 69.63 H new ATOM 2052 N TRP B 101 40.174 -25.839 51.981 1.00 66.43 N ATOM 2053 CA TRP B 101 38.979 -25.903 52.812 1.00 66.49 C ATOM 2054 C TRP B 101 39.150 -25.269 54.183 1.00 67.23 C ATOM 2055 O TRP B 101 38.349 -24.425 54.591 1.00 66.39 O ATOM 2056 CB TRP B 101 38.541 -27.354 52.987 1.00 65.00 C ATOM 2057 CG TRP B 101 37.341 -27.489 53.852 1.00 64.84 C ATOM 2058 CD1 TRP B 101 37.294 -27.983 55.121 1.00 65.49 C ATOM 2059 CD2 TRP B 101 36.002 -27.109 53.518 1.00 63.20 C ATOM 2060 NE1 TRP B 101 36.006 -27.938 55.600 1.00 65.37 N ATOM 2061 CE2 TRP B 101 35.193 -27.404 54.635 1.00 63.45 C ATOM 2062 CE3 TRP B 101 35.408 -26.548 52.382 1.00 61.01 C ATOM 2063 CZ2 TRP B 101 33.818 -27.156 54.650 1.00 61.38 C ATOM 2064 CZ3 TRP B 101 34.043 -26.302 52.398 1.00 59.79 C ATOM 2065 CH2 TRP B 101 33.264 -26.606 53.524 1.00 59.04 C ATOM 0 H TRP B 101 40.508 -26.605 51.777 1.00 66.43 H new ATOM 0 HA TRP B 101 38.302 -25.389 52.344 1.00 66.49 H new ATOM 0 HB2 TRP B 101 38.353 -27.739 52.117 1.00 65.00 H new ATOM 0 HB3 TRP B 101 39.271 -27.864 53.371 1.00 65.00 H new ATOM 0 HD1 TRP B 101 38.027 -28.304 55.595 1.00 65.49 H new ATOM 0 HE1 TRP B 101 35.752 -28.202 56.378 1.00 65.37 H new ATOM 0 HE3 TRP B 101 35.918 -26.344 51.632 1.00 61.01 H new ATOM 0 HZ2 TRP B 101 33.299 -27.356 55.395 1.00 61.38 H new ATOM 0 HZ3 TRP B 101 33.637 -25.929 51.649 1.00 59.79 H new ATOM 0 HH2 TRP B 101 32.351 -26.430 53.506 1.00 59.04 H new ATOM 2066 N GLN B 102 40.184 -25.681 54.905 1.00 67.87 N ATOM 2067 CA GLN B 102 40.408 -25.127 56.231 1.00 69.50 C ATOM 2068 C GLN B 102 40.686 -23.636 56.105 1.00 69.82 C ATOM 2069 O GLN B 102 40.240 -22.841 56.932 1.00 69.83 O ATOM 2070 CB GLN B 102 41.590 -25.824 56.916 1.00 71.09 C ATOM 2071 CG GLN B 102 41.311 -26.288 58.353 1.00 72.63 C ATOM 2072 CD GLN B 102 40.446 -27.547 58.436 1.00 73.22 C ATOM 2073 OE1 GLN B 102 40.182 -28.171 57.288 1.00 73.40 O flip ATOM 2074 NE2 GLN B 102 40.031 -27.954 59.524 1.00 72.80 N flip ATOM 0 H GLN B 102 40.758 -26.269 54.651 1.00 67.87 H new ATOM 0 HA GLN B 102 39.617 -25.270 56.773 1.00 69.50 H new ATOM 0 HB2 GLN B 102 41.849 -26.593 56.385 1.00 71.09 H new ATOM 0 HB3 GLN B 102 42.347 -25.218 56.925 1.00 71.09 H new ATOM 0 HG2 GLN B 102 42.155 -26.455 58.800 1.00 72.63 H new ATOM 0 HG3 GLN B 102 40.872 -25.571 58.836 1.00 72.63 H new ATOM 0 HE21 GLN B 102 40.222 -27.525 60.245 1.00 72.80 H new ATOM 0 HE22 GLN B 102 39.551 -28.667 59.562 1.00 72.80 H new ATOM 2075 N ALA B 103 41.421 -23.268 55.060 1.00 70.66 N ATOM 2076 CA ALA B 103 41.763 -21.875 54.809 1.00 71.78 C ATOM 2077 C ALA B 103 40.498 -21.065 54.525 1.00 72.53 C ATOM 2078 O ALA B 103 40.471 -19.847 54.708 1.00 72.76 O ATOM 2079 CB ALA B 103 42.721 -21.780 53.623 1.00 71.68 C ATOM 0 H ALA B 103 41.734 -23.819 54.478 1.00 70.66 H new ATOM 0 HA ALA B 103 42.197 -21.511 55.597 1.00 71.78 H new ATOM 0 HB1 ALA B 103 42.945 -20.850 53.461 1.00 71.68 H new ATOM 0 HB2 ALA B 103 43.530 -22.277 53.820 1.00 71.68 H new ATOM 0 HB3 ALA B 103 42.297 -22.152 52.834 1.00 71.68 H new ATOM 2080 N LEU B 104 39.448 -21.752 54.088 1.00 72.89 N ATOM 2081 CA LEU B 104 38.187 -21.096 53.770 1.00 72.70 C ATOM 2082 C LEU B 104 37.467 -20.650 55.047 1.00 73.04 C ATOM 2083 O LEU B 104 36.782 -19.623 55.062 1.00 72.93 O ATOM 2084 CB LEU B 104 37.307 -22.046 52.938 1.00 71.80 C ATOM 2085 CG LEU B 104 36.336 -21.490 51.883 1.00 71.20 C ATOM 2086 CD1 LEU B 104 37.084 -20.547 50.966 1.00 71.09 C ATOM 2087 CD2 LEU B 104 35.713 -22.631 51.080 1.00 70.18 C ATOM 0 H LEU B 104 39.446 -22.604 53.969 1.00 72.89 H new ATOM 0 HA LEU B 104 38.367 -20.300 53.246 1.00 72.70 H new ATOM 0 HB2 LEU B 104 37.902 -22.662 52.483 1.00 71.80 H new ATOM 0 HB3 LEU B 104 36.781 -22.570 53.563 1.00 71.80 H new ATOM 0 HG LEU B 104 35.621 -21.007 52.327 1.00 71.20 H new ATOM 0 HD11 LEU B 104 36.475 -20.194 50.299 1.00 71.09 H new ATOM 0 HD12 LEU B 104 37.454 -19.816 51.485 1.00 71.09 H new ATOM 0 HD13 LEU B 104 37.803 -21.026 50.526 1.00 71.09 H new ATOM 0 HD21 LEU B 104 35.104 -22.267 50.419 1.00 70.18 H new ATOM 0 HD22 LEU B 104 36.413 -23.132 50.632 1.00 70.18 H new ATOM 0 HD23 LEU B 104 35.227 -23.220 51.678 1.00 70.18 H new ATOM 2088 N PHE B 105 37.643 -21.412 56.122 1.00 73.78 N ATOM 2089 CA PHE B 105 37.031 -21.086 57.407 1.00 75.15 C ATOM 2090 C PHE B 105 37.949 -20.182 58.209 1.00 77.88 C ATOM 2091 O PHE B 105 37.508 -19.248 58.880 1.00 79.08 O ATOM 2092 CB PHE B 105 36.762 -22.369 58.201 1.00 73.01 C ATOM 2093 CG PHE B 105 35.447 -23.009 57.888 1.00 70.82 C ATOM 2094 CD1 PHE B 105 35.289 -23.783 56.750 1.00 70.03 C ATOM 2095 CD2 PHE B 105 34.345 -22.782 58.707 1.00 70.62 C ATOM 2096 CE1 PHE B 105 34.049 -24.320 56.423 1.00 70.03 C ATOM 2097 CE2 PHE B 105 33.103 -23.311 58.393 1.00 69.09 C ATOM 2098 CZ PHE B 105 32.956 -24.080 57.249 1.00 69.59 C ATOM 0 H PHE B 105 38.118 -22.129 56.128 1.00 73.78 H new ATOM 0 HA PHE B 105 36.193 -20.627 57.242 1.00 75.15 H new ATOM 0 HB2 PHE B 105 37.472 -23.005 58.022 1.00 73.01 H new ATOM 0 HB3 PHE B 105 36.796 -22.166 59.149 1.00 73.01 H new ATOM 0 HD1 PHE B 105 36.020 -23.945 56.199 1.00 70.03 H new ATOM 0 HD2 PHE B 105 34.443 -22.268 59.476 1.00 70.62 H new ATOM 0 HE1 PHE B 105 33.951 -24.837 55.656 1.00 70.03 H new ATOM 0 HE2 PHE B 105 32.373 -23.151 58.946 1.00 69.09 H new ATOM 0 HZ PHE B 105 32.124 -24.436 57.033 1.00 69.59 H new ATOM 2099 N ASP B 106 39.235 -20.487 58.131 1.00 80.24 N ATOM 2100 CA ASP B 106 40.249 -19.730 58.835 1.00 81.99 C ATOM 2101 C ASP B 106 40.310 -18.287 58.309 1.00 83.26 C ATOM 2102 O ASP B 106 41.436 -17.767 58.136 1.00 84.58 O ATOM 2103 CB ASP B 106 41.593 -20.441 58.648 1.00 82.38 C ATOM 2104 CG ASP B 106 42.708 -19.823 59.457 1.00 83.28 C ATOM 2105 OD1 ASP B 106 43.820 -20.403 59.463 1.00 83.42 O ATOM 2106 OD2 ASP B 106 42.488 -18.762 60.086 1.00 83.85 O ATOM 0 H ASP B 106 39.543 -21.142 57.666 1.00 80.24 H new ATOM 0 HA ASP B 106 40.034 -19.682 59.780 1.00 81.99 H new ATOM 0 HB2 ASP B 106 41.497 -21.373 58.899 1.00 82.38 H new ATOM 0 HB3 ASP B 106 41.834 -20.423 57.709 1.00 82.38 H new TER 2107 ASP B 106 HETATM 2108 S SO4 A 300 32.106 -39.930 25.495 1.00 75.20 S HETATM 2109 O1 SO4 A 300 33.471 -40.459 25.713 1.00 74.86 O HETATM 2110 O2 SO4 A 300 32.018 -38.559 26.038 1.00 74.96 O HETATM 2111 O3 SO4 A 300 31.821 -39.906 24.042 1.00 75.54 O HETATM 2112 O4 SO4 A 300 31.114 -40.784 26.184 1.00 74.07 O HETATM 2113 C1 DHT A 200 27.477 -28.010 40.711 1.00 31.12 C HETATM 2114 C2 DHT A 200 26.723 -26.763 41.168 1.00 29.67 C HETATM 2115 C3 DHT A 200 25.285 -26.887 40.584 1.00 30.21 C HETATM 2116 O3 DHT A 200 24.846 -25.955 39.926 1.00 30.73 O HETATM 2117 C4 DHT A 200 24.538 -28.165 40.834 1.00 27.67 C HETATM 2118 C5 DHT A 200 25.347 -29.393 40.328 1.00 28.59 C HETATM 2119 C6 DHT A 200 24.610 -30.755 40.575 1.00 27.05 C HETATM 2120 C7 DHT A 200 25.464 -31.909 40.020 1.00 28.96 C HETATM 2121 C8 DHT A 200 26.892 -31.970 40.673 1.00 31.54 C HETATM 2122 C9 DHT A 200 27.615 -30.595 40.454 1.00 30.34 C HETATM 2123 C10 DHT A 200 26.797 -29.377 41.024 1.00 29.46 C HETATM 2124 C11 DHT A 200 29.056 -30.687 41.082 1.00 31.04 C HETATM 2125 C12 DHT A 200 29.936 -31.843 40.612 1.00 29.24 C HETATM 2126 C13 DHT A 200 29.216 -33.209 40.690 1.00 31.11 C HETATM 2127 C14 DHT A 200 27.769 -33.086 40.064 1.00 31.68 C HETATM 2128 C15 DHT A 200 27.255 -34.534 40.170 1.00 32.35 C HETATM 2129 C16 DHT A 200 28.493 -35.349 39.715 1.00 33.53 C HETATM 2130 C17 DHT A 200 29.690 -34.348 39.803 1.00 31.31 C HETATM 2131 O17 DHT A 200 30.841 -35.028 40.309 1.00 33.36 O HETATM 2132 C18 DHT A 200 29.168 -33.653 42.210 1.00 30.28 C HETATM 2133 C19 DHT A 200 26.661 -29.544 42.596 1.00 29.32 C HETATM 0 H193 DHT A 200 27.542 -29.518 43.002 1.00 29.32 H new HETATM 0 H192 DHT A 200 26.120 -28.822 42.953 1.00 29.32 H new HETATM 0 H191 DHT A 200 26.238 -30.394 42.796 1.00 29.32 H new HETATM 0 H183 DHT A 200 30.072 -33.732 42.553 1.00 30.28 H new HETATM 0 H182 DHT A 200 28.683 -32.990 42.726 1.00 30.28 H new HETATM 0 H181 DHT A 200 28.719 -34.510 42.283 1.00 30.28 H new HETATM 0 H162 DHT A 200 28.636 -36.119 40.287 1.00 33.53 H new HETATM 0 H161 DHT A 200 28.381 -35.684 38.812 1.00 33.53 H new HETATM 0 H152 DHT A 200 26.985 -34.758 41.074 1.00 32.35 H new HETATM 0 H151 DHT A 200 26.487 -34.690 39.598 1.00 32.35 H new HETATM 0 H122 DHT A 200 30.216 -31.681 39.698 1.00 29.24 H new HETATM 0 H121 DHT A 200 30.740 -31.874 41.154 1.00 29.24 H new HETATM 0 H112 DHT A 200 29.521 -29.857 40.895 1.00 31.04 H new HETATM 0 H111 DHT A 200 28.963 -30.749 42.046 1.00 31.04 H new HETATM 0 HO7 DHT A 200 31.520 -34.545 40.206 1.00 33.36 H new HETATM 0 H9 DHT A 200 27.684 -30.425 39.502 1.00 30.34 H new HETATM 0 H8 DHT A 200 26.773 -32.161 41.616 1.00 31.54 H new HETATM 0 H72 DHT A 200 25.005 -32.750 40.174 1.00 28.96 H new HETATM 0 H71 DHT A 200 25.555 -31.807 39.060 1.00 28.96 H new HETATM 0 H62 DHT A 200 24.455 -30.882 41.524 1.00 27.05 H new HETATM 0 H61 DHT A 200 23.741 -30.746 40.144 1.00 27.05 H new HETATM 0 H5 DHT A 200 25.440 -29.321 39.365 1.00 28.59 H new HETATM 0 H42 DHT A 200 24.361 -28.259 41.783 1.00 27.67 H new HETATM 0 H41 DHT A 200 23.678 -28.134 40.386 1.00 27.67 H new HETATM 0 H22 DHT A 200 26.700 -26.707 42.136 1.00 29.67 H new HETATM 0 H21 DHT A 200 27.159 -25.958 40.848 1.00 29.67 H new HETATM 0 H17 DHT A 200 29.956 -33.990 38.942 1.00 31.31 H new HETATM 0 H14 DHT A 200 27.755 -32.771 39.147 1.00 31.68 H new HETATM 0 H12 DHT A 200 27.614 -27.950 39.753 1.00 31.12 H new HETATM 0 H11 DHT A 200 28.355 -28.004 41.124 1.00 31.12 H new HETATM 2134 C1 EDO A 301 29.300 -14.719 47.871 1.00 56.92 C HETATM 2135 O1 EDO A 301 30.201 -13.784 48.453 1.00 61.93 O HETATM 2136 C2 EDO A 301 28.272 -15.157 48.904 1.00 55.78 C HETATM 2137 O2 EDO A 301 27.535 -14.029 49.359 1.00 54.25 O HETATM 0 HO2 EDO A 301 26.724 -14.234 49.431 1.00 54.25 H new HETATM 0 HO1 EDO A 301 29.810 -13.360 49.063 1.00 61.93 H new HETATM 0 H22 EDO A 301 27.670 -15.812 48.516 1.00 55.78 H new HETATM 0 H21 EDO A 301 28.716 -15.587 49.652 1.00 55.78 H new HETATM 0 H12 EDO A 301 28.854 -14.319 47.108 1.00 56.92 H new HETATM 0 H11 EDO A 301 29.789 -15.490 47.542 1.00 56.92 H new HETATM 2138 O HOH A 1 20.147 -16.094 50.747 1.00 27.73 O HETATM 2139 O HOH A 2 23.559 -13.790 64.050 1.00 40.90 O HETATM 2140 O HOH A 3 26.589 -32.623 50.283 1.00 33.72 O HETATM 2141 O HOH A 4 25.225 -18.752 38.960 1.00 39.61 O HETATM 2142 O HOH A 5 23.903 -23.966 42.553 1.00 32.78 O HETATM 2143 O HOH A 6 18.804 -18.507 51.180 1.00 33.74 O HETATM 2144 O HOH A 7 27.591 -39.313 21.328 1.00 46.34 O HETATM 2145 O HOH A 8 23.422 -32.535 50.491 1.00 30.38 O HETATM 2146 O HOH A 9 13.028 -37.723 29.373 1.00 41.67 O HETATM 2147 O HOH A 10 22.427 -29.733 58.126 1.00 33.89 O HETATM 2148 O HOH A 11 26.345 -26.361 67.301 1.00 44.69 O HETATM 2149 O HOH A 12 33.240 -46.568 41.254 1.00 43.60 O HETATM 2150 O HOH A 13 20.385 -42.054 33.553 1.00 40.86 O HETATM 2151 O HOH A 14 26.471 -15.374 60.932 1.00 47.12 O HETATM 2152 O HOH A 15 22.114 -37.601 50.721 1.00 41.08 O HETATM 2153 O HOH A 16 6.260 -14.897 49.846 1.00 44.56 O HETATM 2154 O HOH A 17 26.628 -21.208 38.652 1.00 33.01 O HETATM 2155 O HOH A 18 36.694 -32.915 55.150 1.00 60.33 O HETATM 2156 O HOH A 19 25.369 -32.620 72.015 1.00 62.54 O HETATM 2157 O HOH A 20 6.806 -25.541 35.586 1.00 53.46 O HETATM 2158 O HOH A 21 11.874 -35.158 28.591 1.00 58.71 O HETATM 2159 O HOH A 22 22.333 -41.431 54.880 1.00 38.29 O HETATM 2160 O HOH A 23 30.613 -31.984 64.185 1.00 48.13 O HETATM 2161 O HOH A 24 23.578 -18.466 28.919 1.00 53.26 O HETATM 2162 O HOH A 25 35.807 -40.431 29.734 1.00 47.01 O HETATM 2163 O HOH A 26 18.208 -6.837 51.535 1.00 45.27 O HETATM 2164 O HOH A 27 26.913 -24.042 27.907 1.00 46.29 O HETATM 2165 O HOH A 28 31.204 -37.373 61.096 1.00 67.16 O HETATM 2166 O HOH A 29 15.195 -42.109 45.170 1.00 60.44 O HETATM 2167 O HOH A 30 20.859 -32.347 51.158 1.00 43.02 O HETATM 2168 O HOH A 31 41.257 -35.692 39.720 1.00 55.66 O HETATM 2169 O HOH A 32 32.319 -18.543 64.451 1.00 63.94 O HETATM 2170 O HOH A 33 0.370 -24.289 44.766 1.00 64.44 O HETATM 2171 O HOH A 34 34.736 -38.920 27.928 1.00 44.64 O HETATM 2172 O HOH A 35 29.798 -34.871 21.250 1.00 57.26 O HETATM 2173 O HOH A 36 17.538 -41.547 46.427 1.00 48.39 O HETATM 2174 O HOH A 37 13.022 -11.485 47.912 1.00 50.36 O HETATM 2175 O HOH A 38 4.313 -20.130 38.297 1.00 72.39 O HETATM 2176 O HOH A 39 42.971 -40.121 31.833 1.00 49.50 O HETATM 2177 O HOH A 40 25.207 -48.236 52.850 1.00 39.93 O HETATM 2178 O HOH A 41 25.414 -29.467 23.343 1.00 52.24 O HETATM 2179 O HOH A 42 15.523 -15.249 67.321 1.00 68.59 O HETATM 2180 O HOH A 43 21.130 -40.192 52.401 1.00 42.60 O HETATM 2181 O HOH A 44 12.686 -36.066 44.553 1.00 41.71 O HETATM 2182 O HOH A 45 14.027 -37.702 59.419 1.00 46.90 O HETATM 2183 O HOH A 46 11.076 -36.406 61.073 1.00 50.39 O HETATM 2184 O HOH A 47 38.410 -23.232 41.874 1.00 46.99 O HETATM 2185 O HOH A 48 25.848 -47.543 42.525 1.00 65.92 O HETATM 2186 O HOH A 49 2.851 -17.651 45.246 1.00 54.79 O HETATM 2187 O HOH A 50 28.632 -45.898 48.237 1.00 40.32 O HETATM 2188 O HOH A 51 37.550 -30.220 37.095 1.00 39.01 O HETATM 2189 O HOH A 52 23.218 -44.971 46.924 1.00 44.85 O HETATM 2190 O HOH A 53 14.000 -32.349 54.295 1.00 49.51 O HETATM 2191 O HOH A 54 8.481 -34.912 49.450 1.00 44.43 O HETATM 2192 O HOH A 55 25.751 -11.272 58.268 1.00 42.89 O HETATM 2193 O HOH A 56 8.079 -35.899 51.978 1.00 42.81 O HETATM 2194 O HOH A 57 25.684 -46.760 49.241 1.00 48.54 O HETATM 2195 O HOH A 58 34.341 -43.106 29.652 1.00 53.96 O HETATM 2196 O HOH A 59 12.541 -41.213 45.787 1.00 50.86 O HETATM 2197 O HOH A 60 21.495 -15.576 67.805 1.00 59.08 O HETATM 2198 O HOH A 61 25.173 -18.674 41.734 1.00 51.67 O HETATM 2199 O HOH A 62 17.194 -41.351 49.131 1.00 44.61 O HETATM 2200 O HOH A 63 33.422 -20.579 30.081 1.00 45.80 O HETATM 2201 O HOH A 64 19.494 -43.329 46.337 1.00 51.03 O HETATM 2202 O HOH A 65 35.839 -29.420 30.621 1.00 51.43 O HETATM 2203 O HOH A 66 26.213 -21.493 26.985 1.00 50.84 O HETATM 2204 O HOH A 67 15.223 -14.723 41.682 1.00 63.20 O HETATM 2205 O HOH A 68 39.524 -27.159 26.101 1.00 63.34 O HETATM 2206 O HOH A 69 40.159 -25.362 41.184 1.00 53.13 O HETATM 2207 O HOH A 70 19.855 -6.321 49.283 1.00 47.00 O HETATM 2208 O HOH A 71 32.979 -17.169 38.066 1.00 50.56 O HETATM 2209 O HOH A 73 1.020 -23.464 59.311 1.00 58.93 O HETATM 2210 O HOH A 74 11.061 -37.062 40.004 1.00 65.81 O HETATM 2211 O HOH A 75 15.647 -14.797 44.529 1.00 54.23 O HETATM 2212 O HOH A 76 25.339 -35.091 70.379 1.00 57.64 O HETATM 2213 O HOH A 77 32.319 -20.473 26.908 1.00 56.90 O HETATM 2214 O HOH A 78 39.458 -22.379 38.015 1.00 63.35 O HETATM 2215 O HOH A 79 21.663 -7.572 47.082 1.00 55.63 O HETATM 2216 O HOH A 80 26.338 -11.324 40.022 1.00 49.26 O HETATM 2217 O HOH A 81 20.734 -41.591 28.942 1.00 48.01 O HETATM 2218 O HOH A 82 2.998 -17.628 48.302 1.00 52.76 O HETATM 2219 O HOH A 83 17.727 -17.033 63.204 1.00 52.08 O HETATM 2220 O HOH A 84 0.523 -19.043 60.295 1.00 56.49 O HETATM 2221 O HOH A 85 21.567 -19.133 42.078 1.00 37.64 O HETATM 2222 O HOH A 86 23.040 -20.925 48.929 1.00 41.63 O HETATM 2223 O HOH B 72 38.212 -17.807 45.600 1.00 58.30 O CONECT 2108 2109 2110 2111 2112 CONECT 2109 2108 CONECT 2110 2108 CONECT 2111 2108 CONECT 2112 2108 CONECT 2113 2114 2123 CONECT 2114 2113 2115 CONECT 2115 2114 2116 2117 CONECT 2116 2115 CONECT 2117 2115 2118 CONECT 2118 2117 2119 2123 CONECT 2119 2118 2120 CONECT 2120 2119 2121 CONECT 2121 2120 2122 2127 CONECT 2122 2121 2123 2124 CONECT 2123 2113 2118 2122 2133 CONECT 2124 2122 2125 CONECT 2125 2124 2126 CONECT 2126 2125 2127 2130 2132 CONECT 2127 2121 2126 2128 CONECT 2128 2127 2129 CONECT 2129 2128 2130 CONECT 2130 2126 2129 2131 CONECT 2131 2130 CONECT 2132 2126 CONECT 2133 2123 CONECT 2134 2135 2136 CONECT 2135 2134 CONECT 2136 2134 2137 CONECT 2137 2136 END