USER MOD reduce.3.24.130724 H: found=0, std=0, add=2170, rem=0, adj=60 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER HORMONE/GROWTH FACTOR RECEPTOR 07-MAY-04 1T73 TITLE CRYSTAL STRUCTURE OF THE ANDROGEN RECEPTOR LIGAND BINDING TITLE 2 DOMAIN IN COMPLEX WITH A FXXFF 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: FXXFF 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 1T73 1 VERSN REVDAT 2 28-SEP-04 1T73 1 JRNL REVDAT 1 31-AUG-04 1T73 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. 2.20 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) : 2.20 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 20.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 1220240.370 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 99.4 REMARK 3 NUMBER OF REFLECTIONS : 13332 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) : 0.200 REMARK 3 FREE R VALUE : 0.245 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.100 REMARK 3 FREE R VALUE TEST SET COUNT : 679 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.009 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) : 2.20 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.34 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 96.30 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 2017 REMARK 3 BIN R VALUE (WORKING SET) : 0.2890 REMARK 3 BIN FREE R VALUE : 0.3290 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 4.20 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 88 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.035 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2118 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 26 REMARK 3 SOLVENT ATOMS : 74 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 23.10 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 40.70 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 14.23000 REMARK 3 B22 (A**2) : -6.74000 REMARK 3 B33 (A**2) : -7.49000 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) : 0.32 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) : 0.33 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.26 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.007 REMARK 3 BOND ANGLES (DEGREES) : 1.10 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 18.62 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) : 1.400 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 2.290 ; 2.000 REMARK 3 SIDE-CHAIN BOND (A**2) : 2.180 ; 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 : 0.37 REMARK 3 BSOL : 45.94 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 1T73 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 RCSB022394. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 19-JUL-03 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.4 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) : 1.1271 REMARK 200 MONOCHROMATOR : DOUBLE CRYSTAL SI(111) REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 315 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 13397 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.200 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 (%) : 99.7 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) : 2.20 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.24 REMARK 200 COMPLETENESS FOR SHELL (%) : 98.6 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 (%): 35.10 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 1.90 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: SODIUM CITRATE, TRIS, HEPES, REMARK 280 LITHIUM SULFATE, GLYCEROL, TCEP, N-OCTYL GLUCOSIDE, 5-ALPHA REMARK 280 DIHYDROTESTOSTERONE, PH 7.4, VAPOR DIFFUSION, HANGING DROP, REMARK 280 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 27.16150 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 35.11150 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 33.29600 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 35.11150 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 27.16150 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 33.29600 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: 1770 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 12090 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -21.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY A 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 GLN A 919 REMARK 465 ASN B 107 REMARK 465 GLU B 108 REMARK 465 GLY B 109 REMARK 465 LEU B 110 REMARK 465 GLY B 111 REMARK 465 SER B 112 REMARK 465 ARG B 113 REMARK 465 SER B 114 REMARK 465 GLY B 115 REMARK 465 SER B 116 REMARK 465 GLY B 117 REMARK 465 LYS B 118 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 LEU A 768 74.14 -151.20 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 201 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE DHT A 200 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1T74 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 1T73 A 662 919 UNP O97775 ANDR_PANTR 654 911 DBREF 1T73 B 99 118 PDB 1T73 1T73 99 118 SEQADV 1T73 GLY A 651 UNP O97775 CLONING ARTIFACT SEQADV 1T73 SER A 652 UNP O97775 CLONING ARTIFACT SEQADV 1T73 PRO A 653 UNP O97775 CLONING ARTIFACT SEQADV 1T73 GLY A 654 UNP O97775 CLONING ARTIFACT SEQADV 1T73 ILE A 655 UNP O97775 CLONING ARTIFACT SEQADV 1T73 SER A 656 UNP O97775 CLONING ARTIFACT SEQADV 1T73 GLY A 657 UNP O97775 CLONING ARTIFACT SEQADV 1T73 GLY A 658 UNP O97775 CLONING ARTIFACT SEQADV 1T73 GLY A 659 UNP O97775 CLONING ARTIFACT SEQADV 1T73 GLY A 660 UNP O97775 CLONING ARTIFACT SEQADV 1T73 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 20 SER ARG PHE ALA ASP PHE PHE ARG ASN GLU GLY LEU GLY SEQRES 2 B 20 SER ARG SER GLY SER GLY LYS HET SO4 A 201 5 HET DHT A 200 21 HETNAM SO4 SULFATE ION HETNAM DHT 5-ALPHA-DIHYDROTESTOSTERONE FORMUL 3 SO4 O4 S 2- FORMUL 4 DHT C19 H30 O2 FORMUL 5 HOH *74(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 VAL A 757 1 29 HELIX 5 5 ASN A 771 SER A 778 1 8 HELIX 6 6 MET A 780 LEU A 797 1 18 HELIX 7 7 THR A 800 LEU A 812 1 13 HELIX 8 8 ASN A 823 ALA A 843 1 21 HELIX 9 9 ASN A 848 LYS A 883 1 36 HELIX 10 10 SER A 884 VAL A 887 5 4 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 PHE B 104 1 6 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 5 HOH A 47 SER A 696 PHE A 697 LYS A 777 SITE *** AC1 5 ARG A 779 SITE *** AC2 8 LEU A 704 ASN A 705 GLN A 711 MET A 745 SITE *** AC2 8 MET A 749 ARG A 752 PHE A 764 THR A 877 CRYST1 54.323 66.592 70.223 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 0.018408 0.000000 0.000000 0.00000 SCALE2 0.000000 0.015017 0.000000 0.00000 SCALE3 0.000000 0.000000 0.014240 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 109:sc= 1.31 USER MOD Set 1.2: A 917 HIS : no HE2:sc= 1.02 K(o=2.3,f=-3.3!) USER MOD Set 2.1: A 782 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 783 GLN : amide:sc= 0.795 K(o=0.79,f=-6.1!) USER MOD Set 3.1: A 780 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 784 CYS SG : rot 79:sc= 0.106 USER MOD Set 4.1: A 759 SER OG : rot -41:sc= 1.29 USER MOD Set 4.2: A 791 SER OG : rot 65:sc= 1.22 USER MOD Set 5.1: A 689 HIS : no HE2:sc= 2.57 K(o=6,f=-7!) USER MOD Set 5.2: A 691 ASN : amide:sc= 1.79 K(o=6,f=-1.1!) USER MOD Set 5.3: A 703 SER OG : rot 87:sc= 1.59 USER MOD Set 6.1: A 200 DHT O17 : rot -67:sc= 1.68 USER MOD Set 6.2: A 705 ASN : amide:sc= 0.885 K(o=3.1,f=0.027!) USER MOD Set 6.3: A 877 THR OG1 : rot 87:sc= 0.516 USER MOD Single : A 669 CYS SG : rot 180:sc= 0.332! USER MOD Single : A 670 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 675 ASN : amide:sc= -0.328 K(o=-0.33,f=-2!) USER MOD Single : A 686 CYS SG : rot 180:sc= 0 USER MOD Single : A 692 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 693 GLN : amide:sc= -0.122 K(o=-0.12,f=-1.5!) USER MOD Single : A 696 SER OG : rot 180:sc= -0.0332 USER MOD Single : A 702 SER OG : rot 88:sc= 0.775 USER MOD Single : A 711 GLN : amide:sc= 0.0172 X(o=0.017,f=-0.14) USER MOD Single : A 714 HIS : no HE2:sc= 0.0202 X(o=0.02,f=-0.17) USER MOD Single : A 717 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 720 LYS NZ :NH3+ 145:sc= 1.28 (180deg=1.05) USER MOD Single : A 727 ASN : amide:sc= -0.0638 K(o=-0.064,f=-1.4!) USER MOD Single : A 729 HIS : no HD1:sc= -5.42! K(o=-5.4!,f=0.39) USER MOD Single : A 733 GLN : amide:sc= 0.309 K(o=0.31,f=-0.41) USER MOD Single : A 734 MET CE :methyl -177:sc= -0.0042 (180deg=-0.0138) USER MOD Single : A 738 GLN : amide:sc= -2.07! K(o=-2.1!,f=-0.11) USER MOD Single : A 739 TYR OH : rot 180:sc= 0 USER MOD Single : A 740 SER OG A: rot 124:sc= -2.68! USER MOD Single : A 740 SER OG B: rot -89:sc= -0.952! USER MOD Single : A 742 MET CE :methyl -177:sc= -0.229 (180deg=-0.246) USER MOD Single : A 745 MET CE :methyl 157:sc= -0.371 (180deg=-0.989) USER MOD Single : A 749 MET CE :methyl -133:sc=-0.00858 (180deg=-1.6) USER MOD Single : A 753 SER OG : rot 75:sc= 1.05 USER MOD Single : A 755 THR OG1 : rot -160:sc= 0.572 USER MOD Single : A 756 ASN : amide:sc= -1.37 K(o=-1.4,f=-0.69) USER MOD Single : A 758 ASN : amide:sc= -0.913 X(o=-0.91,f=-0.94) USER MOD Single : A 761 MET CE :methyl -132:sc= -5.19! (180deg=-8.09!) USER MOD Single : A 763 TYR OH : rot 180:sc= 0 USER MOD Single : A 771 ASN : amide:sc= 0.121 K(o=0.12,f=-4.7!) USER MOD Single : A 773 TYR OH : rot 180:sc= 0 USER MOD Single : A 775 MET CE :methyl -165:sc= 0 (180deg=-0.16) USER MOD Single : A 776 HIS : no HD1:sc= -0.0112 X(o=-0.011,f=-0.27) USER MOD Single : A 777 LYS NZ :NH3+ -120:sc= 0.515 (180deg=-0.000498) USER MOD Single : A 778 SER OG : rot -56:sc= 0.237 USER MOD Single : A 781 TYR OH : rot 176:sc= 0.782 USER MOD Single : A 787 MET CE :methyl -148:sc= -0.0309 (180deg=-0.874) USER MOD Single : A 789 HIS : no HD1:sc= -0.529 X(o=-0.53,f=-0.76) USER MOD Single : A 792 GLN : amide:sc= -0.685 K(o=-0.68,f=-0.011) USER MOD Single : A 798 GLN : amide:sc= 0 X(o=0,f=-0.057) USER MOD Single : A 800 THR OG1 : rot 178:sc= -1.37! USER MOD Single : A 802 GLN : amide:sc= -2.01 K(o=-2,f=-2.5) USER MOD Single : A 806 CYS SG : rot 160:sc= 0 USER MOD Single : A 807 MET CE :methyl 171:sc= -0.108 (180deg=-0.206) USER MOD Single : A 808 LYS NZ :NH3+ 145:sc= 1.27 (180deg=0.257) USER MOD Single : A 814 SER OG : rot 72:sc= 1.44 USER MOD Single : A 822 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 823 ASN : amide:sc= -4.12! C(o=-4.1!,f=-5!) USER MOD Single : A 824 GLN : amide:sc= 1.14 K(o=1.1,f=-3.8!) USER MOD Single : A 825 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 832 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 833 ASN : amide:sc= -0.0675 K(o=-0.068,f=-0.66) USER MOD Single : A 834 TYR OH : rot -7:sc= 0.561 USER MOD Single : A 836 LYS NZ :NH3+ 150:sc= -3.07! (180deg=-4.55!) USER MOD Single : A 844 CYS SG : rot 180:sc= 0 USER MOD Single : A 845 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0223) USER MOD Single : A 847 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 848 ASN : amide:sc= -2.08 K(o=-2.1,f=-2.8!) USER MOD Single : A 850 THR OG1 : rot 180:sc= 0 USER MOD Single : A 851 SER OG : rot 180:sc= -0.211 USER MOD Single : A 852 CYS SG : rot 74:sc= 0.00183 USER MOD Single : A 853 SER OG : rot 180:sc= 0 USER MOD Single : A 857 TYR OH : rot 180:sc= -1.23 USER MOD Single : A 858 GLN : amide:sc= -0.173 K(o=-0.17,f=-2) USER MOD Single : A 861 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 865 SER OG : rot -32:sc= 1.28 USER MOD Single : A 867 GLN : amide:sc= 0.792 K(o=0.79,f=-1.4) USER MOD Single : A 874 HIS : no HE2:sc= -0.827 K(o=-0.83,f=0.8) USER MOD Single : A 875 GLN : amide:sc= -0.518 X(o=-0.52,f=-0.19) USER MOD Single : A 883 LYS NZ :NH3+ -151:sc= -0.12 (180deg=-0.591) USER MOD Single : A 884 SER OG : rot 180:sc= -0.0165 USER MOD Single : A 885 HIS : no HD1:sc= -2.05 K(o=-2,f=-4.5!) USER MOD Single : A 886 MET CE :methyl 165:sc= -0.0161 (180deg=-0.172) USER MOD Single : A 888 SER OG : rot 180:sc= 0 USER MOD Single : A 894 MET CE :methyl -156:sc=-0.00708 (180deg=-0.417) USER MOD Single : A 895 MET CE :methyl -112:sc= -1.31 (180deg=-2.99!) USER MOD Single : A 900 SER OG : rot -84:sc= 0.248 USER MOD Single : A 902 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 905 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 908 SER OG : rot -78:sc= 0.00294 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 -30:sc= 0.106 USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 669 -22.134 -2.395 57.047 1.00 79.92 N ATOM 2 CA CYS A 669 -21.026 -3.081 57.771 1.00 79.87 C ATOM 3 C CYS A 669 -19.816 -3.264 56.851 1.00 79.05 C ATOM 4 O CYS A 669 -19.803 -2.769 55.718 1.00 79.17 O ATOM 5 CB CYS A 669 -21.505 -4.444 58.286 1.00 80.86 C ATOM 6 SG CYS A 669 -20.347 -5.297 59.389 1.00 83.48 S ATOM 0 HA CYS A 669 -20.760 -2.531 58.524 1.00 79.87 H new ATOM 0 HB2 CYS A 669 -22.345 -4.320 58.755 1.00 80.86 H new ATOM 0 HB3 CYS A 669 -21.687 -5.017 57.524 1.00 80.86 H new ATOM 0 HG CYS A 669 -20.819 -6.345 59.732 1.00 83.48 H new ATOM 7 N GLN A 670 -18.803 -3.973 57.344 1.00 76.88 N ATOM 8 CA GLN A 670 -17.584 -4.222 56.577 1.00 73.85 C ATOM 9 C GLN A 670 -17.230 -5.708 56.475 1.00 69.65 C ATOM 10 O GLN A 670 -17.031 -6.383 57.488 1.00 69.79 O ATOM 11 CB GLN A 670 -16.398 -3.476 57.202 1.00 75.85 C ATOM 12 CG GLN A 670 -16.410 -1.961 57.033 1.00 77.25 C ATOM 13 CD GLN A 670 -15.057 -1.338 57.356 1.00 79.04 C ATOM 14 OE1 GLN A 670 -14.027 -1.744 56.809 1.00 79.45 O ATOM 15 NE2 GLN A 670 -15.053 -0.347 58.241 1.00 79.72 N ATOM 0 H GLN A 670 -18.803 -4.322 58.130 1.00 76.88 H new ATOM 0 HA GLN A 670 -17.760 -3.897 55.680 1.00 73.85 H new ATOM 0 HB2 GLN A 670 -16.372 -3.679 58.150 1.00 75.85 H new ATOM 0 HB3 GLN A 670 -15.579 -3.822 56.815 1.00 75.85 H new ATOM 0 HG2 GLN A 670 -16.657 -1.740 56.121 1.00 77.25 H new ATOM 0 HG3 GLN A 670 -17.088 -1.578 57.611 1.00 77.25 H new ATOM 0 HE21 GLN A 670 -15.790 -0.090 58.602 1.00 79.72 H new ATOM 0 HE22 GLN A 670 -14.313 0.038 58.453 1.00 79.72 H new ATOM 16 N PRO A 671 -17.149 -6.237 55.244 1.00 64.70 N ATOM 17 CA PRO A 671 -16.808 -7.650 55.066 1.00 61.10 C ATOM 18 C PRO A 671 -15.312 -7.843 55.305 1.00 56.76 C ATOM 19 O PRO A 671 -14.542 -8.052 54.371 1.00 55.47 O ATOM 20 CB PRO A 671 -17.222 -7.920 53.623 1.00 61.97 C ATOM 21 CG PRO A 671 -16.930 -6.617 52.957 1.00 62.95 C ATOM 22 CD PRO A 671 -17.458 -5.603 53.951 1.00 63.74 C ATOM 0 HA PRO A 671 -17.246 -8.259 55.681 1.00 61.10 H new ATOM 0 HB2 PRO A 671 -16.714 -8.648 53.231 1.00 61.97 H new ATOM 0 HB3 PRO A 671 -18.160 -8.159 53.555 1.00 61.97 H new ATOM 0 HG2 PRO A 671 -15.981 -6.501 52.795 1.00 62.95 H new ATOM 0 HG3 PRO A 671 -17.375 -6.544 52.098 1.00 62.95 H new ATOM 0 HD2 PRO A 671 -17.020 -4.742 53.857 1.00 63.74 H new ATOM 0 HD3 PRO A 671 -18.410 -5.451 53.841 1.00 63.74 H new ATOM 23 N ILE A 672 -14.919 -7.757 56.572 1.00 52.64 N ATOM 24 CA ILE A 672 -13.527 -7.896 56.977 1.00 48.48 C ATOM 25 C ILE A 672 -12.893 -9.186 56.475 1.00 44.91 C ATOM 26 O ILE A 672 -11.855 -9.162 55.819 1.00 43.99 O ATOM 27 CB ILE A 672 -13.393 -7.842 58.519 1.00 48.26 C ATOM 28 CG1 ILE A 672 -13.961 -6.524 59.050 1.00 48.93 C ATOM 29 CG2 ILE A 672 -11.936 -7.975 58.926 1.00 48.79 C ATOM 30 CD1 ILE A 672 -13.277 -5.281 58.500 1.00 50.58 C ATOM 0 H ILE A 672 -15.459 -7.615 57.226 1.00 52.64 H new ATOM 0 HA ILE A 672 -13.056 -7.150 56.574 1.00 48.48 H new ATOM 0 HB ILE A 672 -13.894 -8.580 58.899 1.00 48.26 H new ATOM 0 HG12 ILE A 672 -14.906 -6.482 58.836 1.00 48.93 H new ATOM 0 HG13 ILE A 672 -13.889 -6.519 60.017 1.00 48.93 H new ATOM 0 HG21 ILE A 672 -11.865 -7.940 59.893 1.00 48.79 H new ATOM 0 HG22 ILE A 672 -11.587 -8.822 58.607 1.00 48.79 H new ATOM 0 HG23 ILE A 672 -11.424 -7.248 58.538 1.00 48.79 H new ATOM 0 HD11 ILE A 672 -13.689 -4.490 58.880 1.00 50.58 H new ATOM 0 HD12 ILE A 672 -12.336 -5.299 58.734 1.00 50.58 H new ATOM 0 HD13 ILE A 672 -13.369 -5.261 57.535 1.00 50.58 H new ATOM 31 N PHE A 673 -13.525 -10.311 56.780 1.00 42.95 N ATOM 32 CA PHE A 673 -13.009 -11.615 56.375 1.00 41.41 C ATOM 33 C PHE A 673 -12.846 -11.732 54.867 1.00 39.96 C ATOM 34 O PHE A 673 -11.800 -12.165 54.377 1.00 37.43 O ATOM 35 CB PHE A 673 -13.935 -12.725 56.872 1.00 41.98 C ATOM 36 CG PHE A 673 -13.398 -14.107 56.643 1.00 41.38 C ATOM 37 CD1 PHE A 673 -12.272 -14.552 57.331 1.00 40.15 C ATOM 38 CD2 PHE A 673 -14.025 -14.970 55.751 1.00 43.27 C ATOM 39 CE1 PHE A 673 -11.780 -15.840 57.138 1.00 39.28 C ATOM 40 CE2 PHE A 673 -13.539 -16.270 55.548 1.00 42.03 C ATOM 41 CZ PHE A 673 -12.414 -16.702 56.245 1.00 41.65 C ATOM 0 H PHE A 673 -14.260 -10.343 57.225 1.00 42.95 H new ATOM 0 HA PHE A 673 -12.131 -11.708 56.776 1.00 41.41 H new ATOM 0 HB2 PHE A 673 -14.094 -12.602 57.821 1.00 41.98 H new ATOM 0 HB3 PHE A 673 -14.793 -12.642 56.427 1.00 41.98 H new ATOM 0 HD1 PHE A 673 -11.843 -13.981 57.927 1.00 40.15 H new ATOM 0 HD2 PHE A 673 -14.776 -14.682 55.283 1.00 43.27 H new ATOM 0 HE1 PHE A 673 -11.028 -16.125 57.605 1.00 39.28 H new ATOM 0 HE2 PHE A 673 -13.966 -16.841 54.951 1.00 42.03 H new ATOM 0 HZ PHE A 673 -12.087 -17.563 56.115 1.00 41.65 H new ATOM 42 N LEU A 674 -13.890 -11.353 54.138 1.00 39.35 N ATOM 43 CA LEU A 674 -13.868 -11.409 52.686 1.00 41.69 C ATOM 44 C LEU A 674 -12.870 -10.413 52.101 1.00 41.43 C ATOM 45 O LEU A 674 -12.222 -10.706 51.093 1.00 41.76 O ATOM 46 CB LEU A 674 -15.275 -11.159 52.125 1.00 44.94 C ATOM 47 CG LEU A 674 -16.123 -12.414 51.868 1.00 46.44 C ATOM 48 CD1 LEU A 674 -16.085 -13.327 53.080 1.00 48.80 C ATOM 49 CD2 LEU A 674 -17.548 -12.015 51.538 1.00 47.33 C ATOM 0 H LEU A 674 -14.626 -11.058 54.471 1.00 39.35 H new ATOM 0 HA LEU A 674 -13.579 -12.297 52.425 1.00 41.69 H new ATOM 0 HB2 LEU A 674 -15.755 -10.586 52.743 1.00 44.94 H new ATOM 0 HB3 LEU A 674 -15.191 -10.670 51.292 1.00 44.94 H new ATOM 0 HG LEU A 674 -15.756 -12.898 51.112 1.00 46.44 H new ATOM 0 HD11 LEU A 674 -16.623 -14.116 52.908 1.00 48.80 H new ATOM 0 HD12 LEU A 674 -15.169 -13.593 53.256 1.00 48.80 H new ATOM 0 HD13 LEU A 674 -16.439 -12.857 53.851 1.00 48.80 H new ATOM 0 HD21 LEU A 674 -18.078 -12.811 51.377 1.00 47.33 H new ATOM 0 HD22 LEU A 674 -17.926 -11.520 52.282 1.00 47.33 H new ATOM 0 HD23 LEU A 674 -17.553 -11.458 50.744 1.00 47.33 H new ATOM 50 N ASN A 675 -12.739 -9.244 52.730 1.00 39.00 N ATOM 51 CA ASN A 675 -11.787 -8.243 52.257 1.00 39.28 C ATOM 52 C ASN A 675 -10.390 -8.841 52.295 1.00 36.70 C ATOM 53 O ASN A 675 -9.563 -8.569 51.435 1.00 35.87 O ATOM 54 CB ASN A 675 -11.803 -6.982 53.140 1.00 39.98 C ATOM 55 CG ASN A 675 -12.981 -6.075 52.850 1.00 43.17 C ATOM 56 OD1 ASN A 675 -13.621 -6.189 51.804 1.00 44.60 O ATOM 57 ND2 ASN A 675 -13.262 -5.152 53.768 1.00 42.40 N ATOM 0 H ASN A 675 -13.188 -9.014 53.426 1.00 39.00 H new ATOM 0 HA ASN A 675 -12.038 -7.989 51.355 1.00 39.28 H new ATOM 0 HB2 ASN A 675 -11.826 -7.246 54.073 1.00 39.98 H new ATOM 0 HB3 ASN A 675 -10.979 -6.488 53.005 1.00 39.98 H new ATOM 0 HD21 ASN A 675 -13.913 -4.605 53.642 1.00 42.40 H new ATOM 0 HD22 ASN A 675 -12.792 -5.103 54.487 1.00 42.40 H new ATOM 58 N VAL A 676 -10.140 -9.663 53.307 1.00 36.04 N ATOM 59 CA VAL A 676 -8.843 -10.295 53.473 1.00 35.37 C ATOM 60 C VAL A 676 -8.552 -11.355 52.427 1.00 34.05 C ATOM 61 O VAL A 676 -7.516 -11.306 51.760 1.00 34.69 O ATOM 62 CB VAL A 676 -8.716 -10.933 54.869 1.00 34.99 C ATOM 63 CG1 VAL A 676 -7.345 -11.593 55.022 1.00 34.49 C ATOM 64 CG2 VAL A 676 -8.917 -9.861 55.943 1.00 34.73 C ATOM 0 H VAL A 676 -10.715 -9.868 53.913 1.00 36.04 H new ATOM 0 HA VAL A 676 -8.193 -9.583 53.365 1.00 35.37 H new ATOM 0 HB VAL A 676 -9.398 -11.615 54.974 1.00 34.99 H new ATOM 0 HG11 VAL A 676 -7.274 -11.992 55.903 1.00 34.49 H new ATOM 0 HG12 VAL A 676 -7.240 -12.281 54.347 1.00 34.49 H new ATOM 0 HG13 VAL A 676 -6.650 -10.925 54.913 1.00 34.49 H new ATOM 0 HG21 VAL A 676 -8.837 -10.264 56.822 1.00 34.73 H new ATOM 0 HG22 VAL A 676 -8.243 -9.171 55.842 1.00 34.73 H new ATOM 0 HG23 VAL A 676 -9.799 -9.468 55.847 1.00 34.73 H new ATOM 65 N LEU A 677 -9.465 -12.310 52.283 1.00 32.89 N ATOM 66 CA LEU A 677 -9.284 -13.393 51.325 1.00 29.93 C ATOM 67 C LEU A 677 -9.061 -12.833 49.935 1.00 30.75 C ATOM 68 O LEU A 677 -8.181 -13.290 49.200 1.00 29.19 O ATOM 69 CB LEU A 677 -10.495 -14.320 51.332 1.00 27.27 C ATOM 70 CG LEU A 677 -10.754 -15.103 52.620 1.00 28.27 C ATOM 71 CD1 LEU A 677 -11.759 -16.216 52.307 1.00 25.85 C ATOM 72 CD2 LEU A 677 -9.454 -15.717 53.153 1.00 26.85 C ATOM 0 H LEU A 677 -10.198 -12.348 52.732 1.00 32.89 H new ATOM 0 HA LEU A 677 -8.502 -13.905 51.584 1.00 29.93 H new ATOM 0 HB2 LEU A 677 -11.283 -13.790 51.136 1.00 27.27 H new ATOM 0 HB3 LEU A 677 -10.394 -14.956 50.606 1.00 27.27 H new ATOM 0 HG LEU A 677 -11.105 -14.506 53.299 1.00 28.27 H new ATOM 0 HD11 LEU A 677 -11.938 -16.726 53.112 1.00 25.85 H new ATOM 0 HD12 LEU A 677 -12.585 -15.825 51.982 1.00 25.85 H new ATOM 0 HD13 LEU A 677 -11.391 -16.803 51.628 1.00 25.85 H new ATOM 0 HD21 LEU A 677 -9.639 -16.209 53.969 1.00 26.85 H new ATOM 0 HD22 LEU A 677 -9.085 -16.320 52.489 1.00 26.85 H new ATOM 0 HD23 LEU A 677 -8.815 -15.011 53.339 1.00 26.85 H new ATOM 73 N GLU A 678 -9.858 -11.826 49.589 1.00 32.26 N ATOM 74 CA GLU A 678 -9.752 -11.164 48.297 1.00 34.32 C ATOM 75 C GLU A 678 -8.380 -10.497 48.163 1.00 32.85 C ATOM 76 O GLU A 678 -7.712 -10.628 47.144 1.00 29.57 O ATOM 77 CB GLU A 678 -10.841 -10.096 48.169 1.00 38.18 C ATOM 78 CG GLU A 678 -10.651 -9.170 46.986 1.00 45.47 C ATOM 79 CD GLU A 678 -11.066 -9.806 45.672 1.00 52.30 C ATOM 80 OE1 GLU A 678 -10.674 -10.967 45.416 1.00 55.13 O ATOM 81 OE2 GLU A 678 -11.783 -9.140 44.891 1.00 55.57 O ATOM 0 H GLU A 678 -10.475 -11.509 50.098 1.00 32.26 H new ATOM 0 HA GLU A 678 -9.861 -11.827 47.597 1.00 34.32 H new ATOM 0 HB2 GLU A 678 -11.704 -10.533 48.092 1.00 38.18 H new ATOM 0 HB3 GLU A 678 -10.862 -9.568 48.982 1.00 38.18 H new ATOM 0 HG2 GLU A 678 -11.168 -8.361 47.127 1.00 45.47 H new ATOM 0 HG3 GLU A 678 -9.719 -8.906 46.933 1.00 45.47 H new ATOM 82 N ALA A 679 -7.970 -9.781 49.206 1.00 32.14 N ATOM 83 CA ALA A 679 -6.692 -9.078 49.181 1.00 33.85 C ATOM 84 C ALA A 679 -5.482 -9.997 49.058 1.00 34.45 C ATOM 85 O ALA A 679 -4.525 -9.660 48.372 1.00 35.60 O ATOM 86 CB ALA A 679 -6.551 -8.194 50.431 1.00 31.55 C ATOM 0 H ALA A 679 -8.416 -9.690 49.936 1.00 32.14 H new ATOM 0 HA ALA A 679 -6.702 -8.532 48.379 1.00 33.85 H new ATOM 0 HB1 ALA A 679 -5.699 -7.731 50.406 1.00 31.55 H new ATOM 0 HB2 ALA A 679 -7.271 -7.544 50.451 1.00 31.55 H new ATOM 0 HB3 ALA A 679 -6.594 -8.748 51.226 1.00 31.55 H new ATOM 87 N ILE A 680 -5.523 -11.162 49.703 1.00 34.45 N ATOM 88 CA ILE A 680 -4.381 -12.071 49.656 1.00 33.88 C ATOM 89 C ILE A 680 -4.373 -13.115 48.533 1.00 34.68 C ATOM 90 O ILE A 680 -3.421 -13.876 48.416 1.00 34.52 O ATOM 91 CB ILE A 680 -4.218 -12.817 51.001 1.00 34.15 C ATOM 92 CG1 ILE A 680 -5.427 -13.726 51.245 1.00 34.23 C ATOM 93 CG2 ILE A 680 -4.060 -11.806 52.137 1.00 33.55 C ATOM 94 CD1 ILE A 680 -5.287 -14.625 52.463 1.00 29.65 C ATOM 0 H ILE A 680 -6.192 -11.441 50.166 1.00 34.45 H new ATOM 0 HA ILE A 680 -3.640 -11.474 49.469 1.00 33.88 H new ATOM 0 HB ILE A 680 -3.422 -13.371 50.968 1.00 34.15 H new ATOM 0 HG12 ILE A 680 -6.218 -13.175 51.350 1.00 34.23 H new ATOM 0 HG13 ILE A 680 -5.568 -14.279 50.461 1.00 34.23 H new ATOM 0 HG21 ILE A 680 -3.958 -12.278 52.978 1.00 33.55 H new ATOM 0 HG22 ILE A 680 -3.275 -11.259 51.977 1.00 33.55 H new ATOM 0 HG23 ILE A 680 -4.846 -11.239 52.178 1.00 33.55 H new ATOM 0 HD11 ILE A 680 -6.084 -15.170 52.557 1.00 29.65 H new ATOM 0 HD12 ILE A 680 -4.514 -15.200 52.354 1.00 29.65 H new ATOM 0 HD13 ILE A 680 -5.174 -14.079 53.257 1.00 29.65 H new ATOM 95 N GLU A 681 -5.416 -13.142 47.707 1.00 34.53 N ATOM 96 CA GLU A 681 -5.513 -14.118 46.623 1.00 34.61 C ATOM 97 C GLU A 681 -4.340 -13.999 45.632 1.00 36.16 C ATOM 98 O GLU A 681 -4.133 -12.952 45.014 1.00 35.59 O ATOM 99 CB GLU A 681 -6.863 -13.950 45.905 1.00 33.37 C ATOM 100 CG GLU A 681 -7.138 -14.936 44.777 1.00 33.45 C ATOM 101 CD GLU A 681 -7.257 -16.388 45.244 1.00 36.73 C ATOM 102 OE1 GLU A 681 -7.544 -17.247 44.390 1.00 37.75 O ATOM 103 OE2 GLU A 681 -7.060 -16.677 46.448 1.00 36.36 O ATOM 0 H GLU A 681 -6.082 -12.600 47.758 1.00 34.53 H new ATOM 0 HA GLU A 681 -5.461 -15.007 47.007 1.00 34.61 H new ATOM 0 HB2 GLU A 681 -7.572 -14.029 46.562 1.00 33.37 H new ATOM 0 HB3 GLU A 681 -6.909 -13.051 45.545 1.00 33.37 H new ATOM 0 HG2 GLU A 681 -7.959 -14.681 44.328 1.00 33.45 H new ATOM 0 HG3 GLU A 681 -6.425 -14.873 44.122 1.00 33.45 H new ATOM 104 N PRO A 682 -3.561 -15.082 45.468 1.00 35.04 N ATOM 105 CA PRO A 682 -2.408 -15.107 44.564 1.00 36.04 C ATOM 106 C PRO A 682 -2.728 -14.623 43.160 1.00 37.83 C ATOM 107 O PRO A 682 -3.854 -14.771 42.686 1.00 39.15 O ATOM 108 CB PRO A 682 -1.994 -16.577 44.572 1.00 37.33 C ATOM 109 CG PRO A 682 -2.379 -17.026 45.941 1.00 36.71 C ATOM 110 CD PRO A 682 -3.737 -16.389 46.123 1.00 35.45 C ATOM 0 HA PRO A 682 -1.708 -14.502 44.855 1.00 36.04 H new ATOM 0 HB2 PRO A 682 -2.455 -17.084 43.885 1.00 37.33 H new ATOM 0 HB3 PRO A 682 -1.043 -16.683 44.413 1.00 37.33 H new ATOM 0 HG2 PRO A 682 -2.422 -17.993 46.005 1.00 36.71 H new ATOM 0 HG3 PRO A 682 -1.746 -16.725 46.611 1.00 36.71 H new ATOM 0 HD2 PRO A 682 -4.440 -16.911 45.706 1.00 35.45 H new ATOM 0 HD3 PRO A 682 -3.970 -16.296 47.060 1.00 35.45 H new ATOM 111 N GLY A 683 -1.733 -14.041 42.499 1.00 37.37 N ATOM 112 CA GLY A 683 -1.935 -13.580 41.140 1.00 34.49 C ATOM 113 C GLY A 683 -1.700 -14.722 40.162 1.00 35.92 C ATOM 114 O GLY A 683 -1.692 -15.899 40.555 1.00 31.06 O ATOM 0 H GLY A 683 -0.945 -13.907 42.817 1.00 37.37 H new ATOM 0 HA2 GLY A 683 -2.837 -13.237 41.038 1.00 34.49 H new ATOM 0 HA3 GLY A 683 -1.329 -12.848 40.945 1.00 34.49 H new ATOM 115 N VAL A 684 -1.498 -14.371 38.894 1.00 35.06 N ATOM 116 CA VAL A 684 -1.269 -15.340 37.834 1.00 36.05 C ATOM 117 C VAL A 684 0.091 -16.009 37.946 1.00 36.36 C ATOM 118 O VAL A 684 1.098 -15.349 38.202 1.00 36.21 O ATOM 119 CB VAL A 684 -1.362 -14.667 36.449 1.00 37.41 C ATOM 120 CG1 VAL A 684 -1.044 -15.680 35.350 1.00 36.88 C ATOM 121 CG2 VAL A 684 -2.760 -14.084 36.252 1.00 38.70 C ATOM 0 H VAL A 684 -1.491 -13.554 38.625 1.00 35.06 H new ATOM 0 HA VAL A 684 -1.959 -16.015 37.931 1.00 36.05 H new ATOM 0 HB VAL A 684 -0.713 -13.948 36.399 1.00 37.41 H new ATOM 0 HG11 VAL A 684 -1.105 -15.248 34.484 1.00 36.88 H new ATOM 0 HG12 VAL A 684 -0.146 -16.024 35.477 1.00 36.88 H new ATOM 0 HG13 VAL A 684 -1.679 -16.412 35.391 1.00 36.88 H new ATOM 0 HG21 VAL A 684 -2.815 -13.662 35.380 1.00 38.70 H new ATOM 0 HG22 VAL A 684 -3.418 -14.794 36.309 1.00 38.70 H new ATOM 0 HG23 VAL A 684 -2.936 -13.425 36.942 1.00 38.70 H new ATOM 122 N VAL A 685 0.120 -17.322 37.742 1.00 35.22 N ATOM 123 CA VAL A 685 1.371 -18.066 37.808 1.00 34.25 C ATOM 124 C VAL A 685 1.533 -18.892 36.540 1.00 36.30 C ATOM 125 O VAL A 685 0.674 -19.707 36.204 1.00 36.21 O ATOM 126 CB VAL A 685 1.397 -19.002 39.039 1.00 34.76 C ATOM 127 CG1 VAL A 685 2.696 -19.797 39.076 1.00 32.68 C ATOM 128 CG2 VAL A 685 1.246 -18.189 40.309 1.00 31.53 C ATOM 0 H VAL A 685 -0.573 -17.800 37.564 1.00 35.22 H new ATOM 0 HA VAL A 685 2.101 -17.433 37.890 1.00 34.25 H new ATOM 0 HB VAL A 685 0.657 -19.625 38.972 1.00 34.76 H new ATOM 0 HG11 VAL A 685 2.698 -20.379 39.852 1.00 32.68 H new ATOM 0 HG12 VAL A 685 2.771 -20.333 38.271 1.00 32.68 H new ATOM 0 HG13 VAL A 685 3.448 -19.186 39.128 1.00 32.68 H new ATOM 0 HG21 VAL A 685 1.263 -18.782 41.077 1.00 31.53 H new ATOM 0 HG22 VAL A 685 1.976 -17.553 40.375 1.00 31.53 H new ATOM 0 HG23 VAL A 685 0.402 -17.711 40.289 1.00 31.53 H new ATOM 129 N CYS A 686 2.630 -18.671 35.823 1.00 37.71 N ATOM 130 CA CYS A 686 2.890 -19.412 34.594 1.00 38.76 C ATOM 131 C CYS A 686 3.789 -20.600 34.893 1.00 37.26 C ATOM 132 O CYS A 686 4.511 -20.605 35.891 1.00 37.55 O ATOM 133 CB CYS A 686 3.545 -18.508 33.542 1.00 41.06 C ATOM 134 SG CYS A 686 2.464 -17.182 32.939 1.00 49.04 S ATOM 0 H CYS A 686 3.236 -18.097 36.031 1.00 37.71 H new ATOM 0 HA CYS A 686 2.045 -19.729 34.238 1.00 38.76 H new ATOM 0 HB2 CYS A 686 4.346 -18.113 33.921 1.00 41.06 H new ATOM 0 HB3 CYS A 686 3.825 -19.052 32.790 1.00 41.06 H new ATOM 0 HG CYS A 686 3.052 -16.525 32.125 1.00 49.04 H new ATOM 135 N ALA A 687 3.738 -21.603 34.023 1.00 36.82 N ATOM 136 CA ALA A 687 4.535 -22.811 34.197 1.00 37.92 C ATOM 137 C ALA A 687 5.837 -22.749 33.413 1.00 39.03 C ATOM 138 O ALA A 687 6.753 -23.531 33.662 1.00 40.99 O ATOM 139 CB ALA A 687 3.725 -24.027 33.763 1.00 37.30 C ATOM 0 H ALA A 687 3.243 -21.603 33.319 1.00 36.82 H new ATOM 0 HA ALA A 687 4.762 -22.884 35.137 1.00 37.92 H new ATOM 0 HB1 ALA A 687 4.258 -24.829 33.880 1.00 37.30 H new ATOM 0 HB2 ALA A 687 2.922 -24.091 34.303 1.00 37.30 H new ATOM 0 HB3 ALA A 687 3.479 -23.936 32.829 1.00 37.30 H new ATOM 140 N GLY A 688 5.913 -21.819 32.464 1.00 39.37 N ATOM 141 CA GLY A 688 7.107 -21.689 31.646 1.00 39.01 C ATOM 142 C GLY A 688 7.225 -22.821 30.638 1.00 39.95 C ATOM 143 O GLY A 688 8.334 -23.211 30.257 1.00 40.10 O ATOM 0 H GLY A 688 5.287 -21.259 32.281 1.00 39.37 H new ATOM 0 HA2 GLY A 688 7.088 -20.840 31.178 1.00 39.01 H new ATOM 0 HA3 GLY A 688 7.891 -21.681 32.217 1.00 39.01 H new ATOM 144 N HIS A 689 6.081 -23.345 30.199 1.00 38.63 N ATOM 145 CA HIS A 689 6.045 -24.452 29.244 1.00 38.13 C ATOM 146 C HIS A 689 6.302 -24.001 27.807 1.00 37.50 C ATOM 147 O HIS A 689 5.812 -22.955 27.388 1.00 36.16 O ATOM 148 CB HIS A 689 4.683 -25.150 29.312 1.00 35.52 C ATOM 149 CG HIS A 689 4.553 -26.311 28.376 1.00 35.35 C ATOM 150 ND1 HIS A 689 5.243 -27.491 28.553 1.00 33.63 N ATOM 151 CD2 HIS A 689 3.824 -26.467 27.245 1.00 33.97 C ATOM 152 CE1 HIS A 689 4.943 -28.325 27.573 1.00 33.09 C ATOM 153 NE2 HIS A 689 4.086 -27.727 26.765 1.00 33.79 N ATOM 0 H HIS A 689 5.305 -23.069 30.446 1.00 38.63 H new ATOM 0 HA HIS A 689 6.757 -25.062 29.493 1.00 38.13 H new ATOM 0 HB2 HIS A 689 4.532 -25.458 30.219 1.00 35.52 H new ATOM 0 HB3 HIS A 689 3.987 -24.504 29.112 1.00 35.52 H new ATOM 0 HD1 HIS A 689 5.784 -27.658 29.200 1.00 33.63 H new ATOM 0 HD2 HIS A 689 3.253 -25.839 26.865 1.00 33.97 H new ATOM 0 HE1 HIS A 689 5.278 -29.186 27.470 1.00 33.09 H new ATOM 154 N ASP A 690 7.065 -24.795 27.055 1.00 37.83 N ATOM 155 CA ASP A 690 7.357 -24.470 25.656 1.00 39.15 C ATOM 156 C ASP A 690 6.246 -25.037 24.785 1.00 39.53 C ATOM 157 O ASP A 690 6.233 -26.230 24.476 1.00 39.21 O ATOM 158 CB ASP A 690 8.694 -25.076 25.219 1.00 40.32 C ATOM 159 CG ASP A 690 9.110 -24.638 23.813 1.00 41.91 C ATOM 160 OD1 ASP A 690 8.289 -24.032 23.084 1.00 40.09 O ATOM 161 OD2 ASP A 690 10.271 -24.912 23.435 1.00 45.04 O ATOM 0 H ASP A 690 7.423 -25.525 27.334 1.00 37.83 H new ATOM 0 HA ASP A 690 7.412 -23.506 25.562 1.00 39.15 H new ATOM 0 HB2 ASP A 690 9.383 -24.819 25.851 1.00 40.32 H new ATOM 0 HB3 ASP A 690 8.631 -26.044 25.247 1.00 40.32 H new ATOM 162 N ASN A 691 5.311 -24.178 24.397 1.00 40.88 N ATOM 163 CA ASN A 691 4.184 -24.590 23.570 1.00 45.10 C ATOM 164 C ASN A 691 4.567 -24.728 22.099 1.00 48.75 C ATOM 165 O ASN A 691 3.767 -25.174 21.276 1.00 49.60 O ATOM 166 CB ASN A 691 3.035 -23.590 23.733 1.00 43.75 C ATOM 167 CG ASN A 691 2.402 -23.657 25.112 1.00 44.55 C ATOM 168 OD1 ASN A 691 1.703 -24.618 25.439 1.00 43.61 O ATOM 169 ND2 ASN A 691 2.659 -22.646 25.935 1.00 42.17 N ATOM 0 H ASN A 691 5.312 -23.343 24.605 1.00 40.88 H new ATOM 0 HA ASN A 691 3.899 -25.467 23.871 1.00 45.10 H new ATOM 0 HB2 ASN A 691 3.366 -22.692 23.575 1.00 43.75 H new ATOM 0 HB3 ASN A 691 2.359 -23.766 23.060 1.00 43.75 H new ATOM 0 HD21 ASN A 691 2.333 -22.646 26.731 1.00 42.17 H new ATOM 0 HD22 ASN A 691 3.151 -21.992 25.672 1.00 42.17 H new ATOM 170 N ASN A 692 5.797 -24.349 21.773 1.00 52.22 N ATOM 171 CA ASN A 692 6.277 -24.444 20.402 1.00 56.38 C ATOM 172 C ASN A 692 6.879 -25.829 20.157 1.00 57.98 C ATOM 173 O ASN A 692 7.358 -26.122 19.064 1.00 58.53 O ATOM 174 CB ASN A 692 7.320 -23.355 20.137 1.00 57.38 C ATOM 175 CG ASN A 692 6.745 -21.952 20.266 1.00 58.32 C ATOM 176 OD1 ASN A 692 6.052 -21.466 19.372 1.00 58.25 O ATOM 177 ND2 ASN A 692 7.021 -21.299 21.390 1.00 60.21 N ATOM 0 H ASN A 692 6.370 -24.034 22.332 1.00 52.22 H new ATOM 0 HA ASN A 692 5.532 -24.315 19.794 1.00 56.38 H new ATOM 0 HB2 ASN A 692 8.056 -23.458 20.760 1.00 57.38 H new ATOM 0 HB3 ASN A 692 7.685 -23.471 19.246 1.00 57.38 H new ATOM 0 HD21 ASN A 692 6.712 -20.506 21.514 1.00 60.21 H new ATOM 0 HD22 ASN A 692 7.509 -21.669 21.994 1.00 60.21 H new ATOM 178 N GLN A 693 6.842 -26.677 21.181 1.00 59.20 N ATOM 179 CA GLN A 693 7.377 -28.032 21.082 1.00 60.99 C ATOM 180 C GLN A 693 6.263 -29.080 21.124 1.00 60.82 C ATOM 181 O GLN A 693 5.300 -28.945 21.880 1.00 60.22 O ATOM 182 CB GLN A 693 8.355 -28.301 22.229 1.00 63.47 C ATOM 183 CG GLN A 693 9.678 -27.553 22.130 1.00 67.45 C ATOM 184 CD GLN A 693 10.622 -28.163 21.110 1.00 69.55 C ATOM 185 OE1 GLN A 693 10.321 -28.215 19.918 1.00 71.20 O ATOM 186 NE2 GLN A 693 11.772 -28.635 21.580 1.00 70.58 N ATOM 0 H GLN A 693 6.508 -26.484 21.950 1.00 59.20 H new ATOM 0 HA GLN A 693 7.837 -28.100 20.231 1.00 60.99 H new ATOM 0 HB2 GLN A 693 7.926 -28.063 23.066 1.00 63.47 H new ATOM 0 HB3 GLN A 693 8.538 -29.253 22.264 1.00 63.47 H new ATOM 0 HG2 GLN A 693 9.505 -26.628 21.893 1.00 67.45 H new ATOM 0 HG3 GLN A 693 10.108 -27.547 23.000 1.00 67.45 H new ATOM 0 HE21 GLN A 693 11.948 -28.581 22.420 1.00 70.58 H new ATOM 0 HE22 GLN A 693 12.340 -28.994 21.044 1.00 70.58 H new ATOM 187 N PRO A 694 6.380 -30.138 20.304 1.00 60.41 N ATOM 188 CA PRO A 694 5.369 -31.199 20.273 1.00 58.15 C ATOM 189 C PRO A 694 5.149 -31.805 21.655 1.00 55.45 C ATOM 190 O PRO A 694 6.099 -32.026 22.407 1.00 55.76 O ATOM 191 CB PRO A 694 5.958 -32.203 19.286 1.00 59.64 C ATOM 192 CG PRO A 694 6.664 -31.314 18.308 1.00 61.33 C ATOM 193 CD PRO A 694 7.373 -30.336 19.231 1.00 61.38 C ATOM 0 HA PRO A 694 4.490 -30.886 20.008 1.00 58.15 H new ATOM 0 HB2 PRO A 694 6.568 -32.821 19.719 1.00 59.64 H new ATOM 0 HB3 PRO A 694 5.270 -32.736 18.859 1.00 59.64 H new ATOM 0 HG2 PRO A 694 7.288 -31.807 17.753 1.00 61.33 H new ATOM 0 HG3 PRO A 694 6.045 -30.866 17.710 1.00 61.33 H new ATOM 0 HD2 PRO A 694 8.206 -30.699 19.571 1.00 61.38 H new ATOM 0 HD3 PRO A 694 7.589 -29.505 18.780 1.00 61.38 H new ATOM 194 N ASP A 695 3.889 -32.073 21.979 1.00 52.10 N ATOM 195 CA ASP A 695 3.533 -32.646 23.268 1.00 48.43 C ATOM 196 C ASP A 695 4.163 -34.006 23.509 1.00 46.84 C ATOM 197 O ASP A 695 4.245 -34.843 22.609 1.00 46.11 O ATOM 198 CB ASP A 695 2.015 -32.774 23.392 1.00 45.94 C ATOM 199 CG ASP A 695 1.310 -31.440 23.293 1.00 44.76 C ATOM 200 OD1 ASP A 695 1.725 -30.496 23.998 1.00 41.91 O ATOM 201 OD2 ASP A 695 0.340 -31.338 22.517 1.00 45.26 O ATOM 0 H ASP A 695 3.220 -31.928 21.459 1.00 52.10 H new ATOM 0 HA ASP A 695 3.879 -32.037 23.939 1.00 48.43 H new ATOM 0 HB2 ASP A 695 1.685 -33.363 22.695 1.00 45.94 H new ATOM 0 HB3 ASP A 695 1.797 -33.189 24.241 1.00 45.94 H new ATOM 202 N SER A 696 4.608 -34.206 24.741 1.00 44.32 N ATOM 203 CA SER A 696 5.217 -35.453 25.164 1.00 43.00 C ATOM 204 C SER A 696 4.935 -35.602 26.647 1.00 41.75 C ATOM 205 O SER A 696 4.847 -34.612 27.375 1.00 40.45 O ATOM 206 CB SER A 696 6.731 -35.444 24.927 1.00 43.01 C ATOM 207 OG SER A 696 7.380 -34.493 25.754 1.00 42.76 O ATOM 0 H SER A 696 4.563 -33.613 25.362 1.00 44.32 H new ATOM 0 HA SER A 696 4.849 -36.191 24.653 1.00 43.00 H new ATOM 0 HB2 SER A 696 7.092 -36.327 25.102 1.00 43.01 H new ATOM 0 HB3 SER A 696 6.913 -35.242 23.996 1.00 43.01 H new ATOM 0 HG SER A 696 8.207 -34.510 25.605 1.00 42.76 H new ATOM 208 N PHE A 697 4.771 -36.845 27.077 1.00 40.52 N ATOM 209 CA PHE A 697 4.511 -37.160 28.465 1.00 40.42 C ATOM 210 C PHE A 697 5.553 -36.500 29.366 1.00 40.15 C ATOM 211 O PHE A 697 5.215 -35.875 30.372 1.00 41.10 O ATOM 212 CB PHE A 697 4.548 -38.674 28.660 1.00 39.43 C ATOM 213 CG PHE A 697 4.445 -39.100 30.089 1.00 39.23 C ATOM 214 CD1 PHE A 697 3.277 -38.879 30.810 1.00 39.15 C ATOM 215 CD2 PHE A 697 5.517 -39.723 30.717 1.00 39.25 C ATOM 216 CE1 PHE A 697 3.171 -39.276 32.142 1.00 39.19 C ATOM 217 CE2 PHE A 697 5.428 -40.125 32.048 1.00 40.30 C ATOM 218 CZ PHE A 697 4.247 -39.900 32.764 1.00 41.11 C ATOM 0 H PHE A 697 4.809 -37.534 26.563 1.00 40.52 H new ATOM 0 HA PHE A 697 3.634 -36.822 28.704 1.00 40.42 H new ATOM 0 HB2 PHE A 697 3.821 -39.074 28.159 1.00 39.43 H new ATOM 0 HB3 PHE A 697 5.374 -39.020 28.287 1.00 39.43 H new ATOM 0 HD1 PHE A 697 2.556 -38.460 30.398 1.00 39.15 H new ATOM 0 HD2 PHE A 697 6.303 -39.873 30.243 1.00 39.25 H new ATOM 0 HE1 PHE A 697 2.384 -39.124 32.613 1.00 39.19 H new ATOM 0 HE2 PHE A 697 6.151 -40.541 32.459 1.00 40.30 H new ATOM 0 HZ PHE A 697 4.182 -40.167 33.653 1.00 41.11 H new ATOM 219 N ALA A 698 6.821 -36.641 28.996 1.00 39.13 N ATOM 220 CA ALA A 698 7.909 -36.070 29.786 1.00 39.00 C ATOM 221 C ALA A 698 7.866 -34.545 29.868 1.00 36.71 C ATOM 222 O ALA A 698 7.980 -33.973 30.955 1.00 36.49 O ATOM 223 CB ALA A 698 9.250 -36.527 29.231 1.00 38.10 C ATOM 0 H ALA A 698 7.074 -37.064 28.291 1.00 39.13 H new ATOM 0 HA ALA A 698 7.794 -36.396 30.692 1.00 39.00 H new ATOM 0 HB1 ALA A 698 9.967 -36.144 29.760 1.00 38.10 H new ATOM 0 HB2 ALA A 698 9.303 -37.495 29.268 1.00 38.10 H new ATOM 0 HB3 ALA A 698 9.336 -36.234 28.310 1.00 38.10 H new ATOM 224 N ALA A 699 7.701 -33.886 28.728 1.00 35.10 N ATOM 225 CA ALA A 699 7.660 -32.425 28.706 1.00 34.82 C ATOM 226 C ALA A 699 6.481 -31.874 29.508 1.00 34.39 C ATOM 227 O ALA A 699 6.643 -30.963 30.327 1.00 33.23 O ATOM 228 CB ALA A 699 7.587 -31.926 27.267 1.00 34.86 C ATOM 0 H ALA A 699 7.611 -34.261 27.959 1.00 35.10 H new ATOM 0 HA ALA A 699 8.475 -32.104 29.122 1.00 34.82 H new ATOM 0 HB1 ALA A 699 7.560 -30.956 27.261 1.00 34.86 H new ATOM 0 HB2 ALA A 699 8.368 -32.230 26.779 1.00 34.86 H new ATOM 0 HB3 ALA A 699 6.786 -32.274 26.844 1.00 34.86 H new ATOM 229 N LEU A 700 5.302 -32.442 29.260 1.00 33.97 N ATOM 230 CA LEU A 700 4.066 -32.047 29.921 1.00 33.56 C ATOM 231 C LEU A 700 4.106 -32.285 31.431 1.00 32.17 C ATOM 232 O LEU A 700 3.791 -31.392 32.213 1.00 31.33 O ATOM 233 CB LEU A 700 2.876 -32.814 29.320 1.00 32.43 C ATOM 234 CG LEU A 700 2.424 -32.495 27.892 1.00 33.18 C ATOM 235 CD1 LEU A 700 1.263 -33.415 27.502 1.00 32.90 C ATOM 236 CD2 LEU A 700 1.988 -31.035 27.804 1.00 31.06 C ATOM 0 H LEU A 700 5.199 -33.079 28.692 1.00 33.97 H new ATOM 0 HA LEU A 700 3.962 -31.094 29.774 1.00 33.56 H new ATOM 0 HB2 LEU A 700 3.091 -33.759 29.353 1.00 32.43 H new ATOM 0 HB3 LEU A 700 2.115 -32.676 29.905 1.00 32.43 H new ATOM 0 HG LEU A 700 3.162 -32.641 27.280 1.00 33.18 H new ATOM 0 HD11 LEU A 700 0.978 -33.211 26.597 1.00 32.90 H new ATOM 0 HD12 LEU A 700 1.553 -34.340 27.549 1.00 32.90 H new ATOM 0 HD13 LEU A 700 0.522 -33.278 28.112 1.00 32.90 H new ATOM 0 HD21 LEU A 700 1.702 -30.836 26.899 1.00 31.06 H new ATOM 0 HD22 LEU A 700 1.252 -30.879 28.416 1.00 31.06 H new ATOM 0 HD23 LEU A 700 2.732 -30.460 28.041 1.00 31.06 H new ATOM 237 N LEU A 701 4.473 -33.492 31.846 1.00 33.18 N ATOM 238 CA LEU A 701 4.526 -33.774 33.275 1.00 32.09 C ATOM 239 C LEU A 701 5.608 -32.953 33.960 1.00 32.31 C ATOM 240 O LEU A 701 5.421 -32.502 35.089 1.00 31.70 O ATOM 241 CB LEU A 701 4.722 -35.272 33.535 1.00 30.34 C ATOM 242 CG LEU A 701 3.397 -36.015 33.756 1.00 30.21 C ATOM 243 CD1 LEU A 701 2.655 -35.390 34.946 1.00 30.00 C ATOM 244 CD2 LEU A 701 2.532 -35.930 32.498 1.00 27.81 C ATOM 0 H LEU A 701 4.690 -34.146 31.332 1.00 33.18 H new ATOM 0 HA LEU A 701 3.673 -33.515 33.658 1.00 32.09 H new ATOM 0 HB2 LEU A 701 5.189 -35.668 32.783 1.00 30.34 H new ATOM 0 HB3 LEU A 701 5.288 -35.390 34.314 1.00 30.34 H new ATOM 0 HG LEU A 701 3.580 -36.949 33.945 1.00 30.21 H new ATOM 0 HD11 LEU A 701 1.817 -35.858 35.087 1.00 30.00 H new ATOM 0 HD12 LEU A 701 3.203 -35.461 35.743 1.00 30.00 H new ATOM 0 HD13 LEU A 701 2.475 -34.455 34.761 1.00 30.00 H new ATOM 0 HD21 LEU A 701 1.698 -36.402 32.646 1.00 27.81 H new ATOM 0 HD22 LEU A 701 2.346 -35.000 32.295 1.00 27.81 H new ATOM 0 HD23 LEU A 701 3.003 -36.334 31.753 1.00 27.81 H new ATOM 245 N SER A 702 6.732 -32.744 33.277 1.00 32.46 N ATOM 246 CA SER A 702 7.806 -31.932 33.842 1.00 33.99 C ATOM 247 C SER A 702 7.329 -30.487 33.994 1.00 34.14 C ATOM 248 O SER A 702 7.717 -29.802 34.935 1.00 36.31 O ATOM 249 CB SER A 702 9.054 -31.964 32.950 1.00 34.46 C ATOM 250 OG SER A 702 9.683 -33.230 32.996 1.00 33.43 O ATOM 0 H SER A 702 6.891 -33.060 32.493 1.00 32.46 H new ATOM 0 HA SER A 702 8.040 -32.299 34.709 1.00 33.99 H new ATOM 0 HB2 SER A 702 8.806 -31.756 32.035 1.00 34.46 H new ATOM 0 HB3 SER A 702 9.678 -31.279 33.238 1.00 34.46 H new ATOM 0 HG SER A 702 9.347 -33.731 32.412 1.00 33.43 H new ATOM 251 N SER A 703 6.489 -30.021 33.070 1.00 34.09 N ATOM 252 CA SER A 703 5.982 -28.654 33.149 1.00 32.41 C ATOM 253 C SER A 703 4.957 -28.520 34.270 1.00 31.27 C ATOM 254 O SER A 703 4.887 -27.485 34.927 1.00 31.33 O ATOM 255 CB SER A 703 5.372 -28.221 31.817 1.00 34.80 C ATOM 256 OG SER A 703 6.388 -28.029 30.848 1.00 38.92 O ATOM 0 H SER A 703 6.204 -30.475 32.397 1.00 34.09 H new ATOM 0 HA SER A 703 6.731 -28.070 33.346 1.00 32.41 H new ATOM 0 HB2 SER A 703 4.745 -28.893 31.508 1.00 34.80 H new ATOM 0 HB3 SER A 703 4.871 -27.399 31.936 1.00 34.80 H new ATOM 0 HG SER A 703 6.554 -28.759 30.467 1.00 38.92 H new ATOM 257 N LEU A 704 4.168 -29.567 34.494 1.00 30.19 N ATOM 258 CA LEU A 704 3.190 -29.549 35.581 1.00 28.84 C ATOM 259 C LEU A 704 3.941 -29.552 36.919 1.00 28.41 C ATOM 260 O LEU A 704 3.569 -28.828 37.848 1.00 27.69 O ATOM 261 CB LEU A 704 2.253 -30.769 35.493 1.00 26.93 C ATOM 262 CG LEU A 704 1.117 -30.691 34.460 1.00 29.12 C ATOM 263 CD1 LEU A 704 0.433 -32.049 34.307 1.00 27.03 C ATOM 264 CD2 LEU A 704 0.099 -29.621 34.898 1.00 25.06 C ATOM 0 H LEU A 704 4.182 -30.293 34.033 1.00 30.19 H new ATOM 0 HA LEU A 704 2.645 -28.750 35.510 1.00 28.84 H new ATOM 0 HB2 LEU A 704 2.791 -31.551 35.293 1.00 26.93 H new ATOM 0 HB3 LEU A 704 1.858 -30.912 36.367 1.00 26.93 H new ATOM 0 HG LEU A 704 1.489 -30.445 33.599 1.00 29.12 H new ATOM 0 HD11 LEU A 704 -0.280 -31.981 33.653 1.00 27.03 H new ATOM 0 HD12 LEU A 704 1.082 -32.707 34.011 1.00 27.03 H new ATOM 0 HD13 LEU A 704 0.062 -32.323 35.161 1.00 27.03 H new ATOM 0 HD21 LEU A 704 -0.618 -29.571 34.247 1.00 25.06 H new ATOM 0 HD22 LEU A 704 -0.267 -29.858 35.764 1.00 25.06 H new ATOM 0 HD23 LEU A 704 0.541 -28.760 34.959 1.00 25.06 H new ATOM 265 N ASN A 705 5.005 -30.355 37.007 1.00 28.57 N ATOM 266 CA ASN A 705 5.804 -30.436 38.229 1.00 29.40 C ATOM 267 C ASN A 705 6.444 -29.095 38.593 1.00 30.62 C ATOM 268 O ASN A 705 6.479 -28.725 39.765 1.00 29.63 O ATOM 269 CB ASN A 705 6.891 -31.512 38.108 1.00 28.15 C ATOM 270 CG ASN A 705 6.346 -32.917 38.300 1.00 30.96 C ATOM 271 OD1 ASN A 705 5.301 -33.112 38.928 1.00 29.20 O ATOM 272 ND2 ASN A 705 7.067 -33.911 37.783 1.00 29.78 N ATOM 0 H ASN A 705 5.280 -30.861 36.368 1.00 28.57 H new ATOM 0 HA ASN A 705 5.193 -30.679 38.942 1.00 29.40 H new ATOM 0 HB2 ASN A 705 7.309 -31.448 37.235 1.00 28.15 H new ATOM 0 HB3 ASN A 705 7.582 -31.344 38.767 1.00 28.15 H new ATOM 0 HD21 ASN A 705 6.809 -34.726 37.881 1.00 29.78 H new ATOM 0 HD22 ASN A 705 7.790 -33.738 37.351 1.00 29.78 H new ATOM 273 N GLU A 706 6.948 -28.371 37.595 1.00 30.86 N ATOM 274 CA GLU A 706 7.564 -27.066 37.846 1.00 32.39 C ATOM 275 C GLU A 706 6.474 -26.057 38.231 1.00 32.21 C ATOM 276 O GLU A 706 6.704 -25.159 39.041 1.00 33.71 O ATOM 277 CB GLU A 706 8.317 -26.585 36.603 1.00 30.03 C ATOM 278 CG GLU A 706 8.809 -25.144 36.666 1.00 33.68 C ATOM 279 CD GLU A 706 9.831 -24.897 37.771 1.00 33.84 C ATOM 280 OE1 GLU A 706 10.460 -25.871 38.233 1.00 35.84 O ATOM 281 OE2 GLU A 706 10.017 -23.725 38.166 1.00 33.16 O ATOM 0 H GLU A 706 6.944 -28.614 36.770 1.00 30.86 H new ATOM 0 HA GLU A 706 8.200 -27.146 38.574 1.00 32.39 H new ATOM 0 HB2 GLU A 706 9.079 -27.167 36.458 1.00 30.03 H new ATOM 0 HB3 GLU A 706 7.736 -26.681 35.832 1.00 30.03 H new ATOM 0 HG2 GLU A 706 9.203 -24.907 35.812 1.00 33.68 H new ATOM 0 HG3 GLU A 706 8.049 -24.556 36.801 1.00 33.68 H new ATOM 282 N LEU A 707 5.289 -26.208 37.643 1.00 31.32 N ATOM 283 CA LEU A 707 4.165 -25.329 37.960 1.00 30.97 C ATOM 284 C LEU A 707 3.777 -25.579 39.423 1.00 30.73 C ATOM 285 O LEU A 707 3.406 -24.658 40.148 1.00 32.02 O ATOM 286 CB LEU A 707 2.963 -25.622 37.042 1.00 29.92 C ATOM 287 CG LEU A 707 1.691 -24.809 37.342 1.00 29.47 C ATOM 288 CD1 LEU A 707 1.996 -23.316 37.222 1.00 26.49 C ATOM 289 CD2 LEU A 707 0.572 -25.199 36.388 1.00 26.22 C ATOM 0 H LEU A 707 5.115 -26.813 37.058 1.00 31.32 H new ATOM 0 HA LEU A 707 4.421 -24.403 37.823 1.00 30.97 H new ATOM 0 HB2 LEU A 707 3.228 -25.453 36.124 1.00 29.92 H new ATOM 0 HB3 LEU A 707 2.748 -26.566 37.107 1.00 29.92 H new ATOM 0 HG LEU A 707 1.399 -25.002 38.247 1.00 29.47 H new ATOM 0 HD11 LEU A 707 1.193 -22.805 37.411 1.00 26.49 H new ATOM 0 HD12 LEU A 707 2.689 -23.075 37.856 1.00 26.49 H new ATOM 0 HD13 LEU A 707 2.299 -23.119 36.322 1.00 26.49 H new ATOM 0 HD21 LEU A 707 -0.221 -24.679 36.590 1.00 26.22 H new ATOM 0 HD22 LEU A 707 0.849 -25.024 35.475 1.00 26.22 H new ATOM 0 HD23 LEU A 707 0.374 -26.143 36.490 1.00 26.22 H new ATOM 290 N GLY A 708 3.870 -26.833 39.851 1.00 30.41 N ATOM 291 CA GLY A 708 3.545 -27.155 41.229 1.00 32.11 C ATOM 292 C GLY A 708 4.526 -26.478 42.174 1.00 31.60 C ATOM 293 O GLY A 708 4.136 -25.939 43.204 1.00 29.77 O ATOM 0 H GLY A 708 4.115 -27.500 39.367 1.00 30.41 H new ATOM 0 HA2 GLY A 708 2.641 -26.867 41.431 1.00 32.11 H new ATOM 0 HA3 GLY A 708 3.572 -28.116 41.358 1.00 32.11 H new ATOM 294 N GLU A 709 5.805 -26.505 41.809 1.00 31.85 N ATOM 295 CA GLU A 709 6.861 -25.886 42.605 1.00 35.15 C ATOM 296 C GLU A 709 6.589 -24.382 42.733 1.00 33.95 C ATOM 297 O GLU A 709 6.661 -23.822 43.824 1.00 36.33 O ATOM 298 CB GLU A 709 8.218 -26.105 41.927 1.00 37.37 C ATOM 299 CG GLU A 709 9.437 -25.711 42.757 1.00 40.28 C ATOM 300 CD GLU A 709 9.816 -26.772 43.771 1.00 43.80 C ATOM 301 OE1 GLU A 709 10.862 -26.608 44.436 1.00 45.05 O ATOM 302 OE2 GLU A 709 9.071 -27.772 43.900 1.00 44.76 O ATOM 0 H GLU A 709 6.086 -26.884 41.090 1.00 31.85 H new ATOM 0 HA GLU A 709 6.876 -26.290 43.487 1.00 35.15 H new ATOM 0 HB2 GLU A 709 8.296 -27.042 41.690 1.00 37.37 H new ATOM 0 HB3 GLU A 709 8.233 -25.601 41.098 1.00 37.37 H new ATOM 0 HG2 GLU A 709 10.189 -25.550 42.166 1.00 40.28 H new ATOM 0 HG3 GLU A 709 9.255 -24.877 43.218 1.00 40.28 H new ATOM 303 N ARG A 710 6.264 -23.738 41.617 1.00 32.61 N ATOM 304 CA ARG A 710 5.985 -22.304 41.619 1.00 32.76 C ATOM 305 C ARG A 710 4.739 -21.950 42.425 1.00 32.01 C ATOM 306 O ARG A 710 4.760 -21.018 43.229 1.00 31.90 O ATOM 307 CB ARG A 710 5.837 -21.797 40.184 1.00 32.91 C ATOM 308 CG ARG A 710 7.059 -22.076 39.338 1.00 35.50 C ATOM 309 CD ARG A 710 6.979 -21.417 37.966 1.00 35.98 C ATOM 310 NE ARG A 710 8.187 -21.696 37.199 1.00 34.22 N ATOM 311 CZ ARG A 710 8.512 -21.101 36.057 1.00 35.99 C ATOM 312 NH1 ARG A 710 7.722 -20.179 35.532 1.00 33.75 N ATOM 313 NH2 ARG A 710 9.636 -21.436 35.440 1.00 37.10 N ATOM 0 H ARG A 710 6.199 -24.113 40.846 1.00 32.61 H new ATOM 0 HA ARG A 710 6.738 -21.868 42.048 1.00 32.76 H new ATOM 0 HB2 ARG A 710 5.063 -22.215 39.775 1.00 32.91 H new ATOM 0 HB3 ARG A 710 5.669 -20.842 40.198 1.00 32.91 H new ATOM 0 HG2 ARG A 710 7.849 -21.758 39.801 1.00 35.50 H new ATOM 0 HG3 ARG A 710 7.161 -23.034 39.228 1.00 35.50 H new ATOM 0 HD2 ARG A 710 6.202 -21.745 37.488 1.00 35.98 H new ATOM 0 HD3 ARG A 710 6.866 -20.459 38.067 1.00 35.98 H new ATOM 0 HE ARG A 710 8.728 -22.289 37.508 1.00 34.22 H new ATOM 0 HH11 ARG A 710 6.992 -19.961 35.931 1.00 33.75 H new ATOM 0 HH12 ARG A 710 7.939 -19.798 34.792 1.00 33.75 H new ATOM 0 HH21 ARG A 710 10.150 -22.036 35.779 1.00 37.10 H new ATOM 0 HH22 ARG A 710 9.851 -21.054 34.700 1.00 37.10 H new ATOM 314 N GLN A 711 3.659 -22.699 42.213 1.00 31.00 N ATOM 315 CA GLN A 711 2.406 -22.470 42.930 1.00 31.10 C ATOM 316 C GLN A 711 2.576 -22.694 44.420 1.00 30.16 C ATOM 317 O GLN A 711 1.979 -21.995 45.237 1.00 32.05 O ATOM 318 CB GLN A 711 1.319 -23.418 42.437 1.00 33.35 C ATOM 319 CG GLN A 711 1.025 -23.346 40.967 1.00 38.30 C ATOM 320 CD GLN A 711 -0.283 -22.656 40.673 1.00 43.54 C ATOM 321 OE1 GLN A 711 -1.012 -23.053 39.754 1.00 45.07 O ATOM 322 NE2 GLN A 711 -0.592 -21.608 41.442 1.00 44.47 N ATOM 0 H GLN A 711 3.631 -23.351 41.653 1.00 31.00 H new ATOM 0 HA GLN A 711 2.151 -21.549 42.762 1.00 31.10 H new ATOM 0 HB2 GLN A 711 1.579 -24.327 42.656 1.00 33.35 H new ATOM 0 HB3 GLN A 711 0.502 -23.231 42.925 1.00 33.35 H new ATOM 0 HG2 GLN A 711 1.744 -22.874 40.519 1.00 38.30 H new ATOM 0 HG3 GLN A 711 1.003 -24.244 40.600 1.00 38.30 H new ATOM 0 HE21 GLN A 711 -0.058 -21.364 42.071 1.00 44.47 H new ATOM 0 HE22 GLN A 711 -1.325 -21.178 41.308 1.00 44.47 H new ATOM 323 N LEU A 712 3.375 -23.687 44.781 1.00 30.16 N ATOM 324 CA LEU A 712 3.578 -23.976 46.189 1.00 30.55 C ATOM 325 C LEU A 712 4.103 -22.735 46.918 1.00 28.88 C ATOM 326 O LEU A 712 3.679 -22.433 48.045 1.00 26.58 O ATOM 327 CB LEU A 712 4.541 -25.154 46.354 1.00 30.75 C ATOM 328 CG LEU A 712 4.737 -25.622 47.795 1.00 33.36 C ATOM 329 CD1 LEU A 712 3.378 -25.948 48.417 1.00 35.12 C ATOM 330 CD2 LEU A 712 5.645 -26.843 47.816 1.00 34.91 C ATOM 0 H LEU A 712 3.802 -24.197 44.236 1.00 30.16 H new ATOM 0 HA LEU A 712 2.727 -24.221 46.584 1.00 30.55 H new ATOM 0 HB2 LEU A 712 4.214 -25.899 45.826 1.00 30.75 H new ATOM 0 HB3 LEU A 712 5.404 -24.904 45.988 1.00 30.75 H new ATOM 0 HG LEU A 712 5.154 -24.917 48.315 1.00 33.36 H new ATOM 0 HD11 LEU A 712 3.504 -26.245 49.332 1.00 35.12 H new ATOM 0 HD12 LEU A 712 2.820 -25.155 48.409 1.00 35.12 H new ATOM 0 HD13 LEU A 712 2.948 -26.651 47.905 1.00 35.12 H new ATOM 0 HD21 LEU A 712 5.769 -27.139 48.731 1.00 34.91 H new ATOM 0 HD22 LEU A 712 5.240 -27.556 47.298 1.00 34.91 H new ATOM 0 HD23 LEU A 712 6.506 -26.613 47.432 1.00 34.91 H new ATOM 331 N VAL A 713 5.019 -22.019 46.270 1.00 29.66 N ATOM 332 CA VAL A 713 5.585 -20.797 46.843 1.00 28.61 C ATOM 333 C VAL A 713 4.450 -19.822 47.146 1.00 28.68 C ATOM 334 O VAL A 713 4.400 -19.239 48.221 1.00 28.00 O ATOM 335 CB VAL A 713 6.585 -20.122 45.864 1.00 31.46 C ATOM 336 CG1 VAL A 713 7.010 -18.748 46.403 1.00 31.63 C ATOM 337 CG2 VAL A 713 7.813 -21.014 45.677 1.00 28.18 C ATOM 0 H VAL A 713 5.328 -22.224 45.494 1.00 29.66 H new ATOM 0 HA VAL A 713 6.064 -21.031 47.653 1.00 28.61 H new ATOM 0 HB VAL A 713 6.149 -19.999 45.006 1.00 31.46 H new ATOM 0 HG11 VAL A 713 7.634 -18.336 45.784 1.00 31.63 H new ATOM 0 HG12 VAL A 713 6.228 -18.182 46.498 1.00 31.63 H new ATOM 0 HG13 VAL A 713 7.437 -18.857 47.267 1.00 31.63 H new ATOM 0 HG21 VAL A 713 8.433 -20.587 45.065 1.00 28.18 H new ATOM 0 HG22 VAL A 713 8.247 -21.151 46.534 1.00 28.18 H new ATOM 0 HG23 VAL A 713 7.539 -21.870 45.314 1.00 28.18 H new ATOM 338 N HIS A 714 3.531 -19.657 46.200 1.00 29.74 N ATOM 339 CA HIS A 714 2.403 -18.752 46.405 1.00 31.76 C ATOM 340 C HIS A 714 1.415 -19.271 47.445 1.00 30.41 C ATOM 341 O HIS A 714 0.792 -18.482 48.152 1.00 31.92 O ATOM 342 CB HIS A 714 1.663 -18.490 45.088 1.00 35.19 C ATOM 343 CG HIS A 714 2.421 -17.618 44.135 1.00 40.12 C ATOM 344 ND1 HIS A 714 3.385 -18.108 43.280 1.00 42.71 N ATOM 345 CD2 HIS A 714 2.369 -16.282 43.918 1.00 40.43 C ATOM 346 CE1 HIS A 714 3.893 -17.111 42.576 1.00 41.79 C ATOM 347 NE2 HIS A 714 3.294 -15.993 42.944 1.00 41.68 N ATOM 0 H HIS A 714 3.541 -20.056 45.438 1.00 29.74 H new ATOM 0 HA HIS A 714 2.779 -17.923 46.739 1.00 31.76 H new ATOM 0 HB2 HIS A 714 1.475 -19.339 44.658 1.00 35.19 H new ATOM 0 HB3 HIS A 714 0.808 -18.075 45.283 1.00 35.19 H new ATOM 0 HD1 HIS A 714 3.619 -18.933 43.215 1.00 42.71 H new ATOM 0 HD2 HIS A 714 1.812 -15.674 44.348 1.00 40.43 H new ATOM 0 HE1 HIS A 714 4.559 -17.184 41.931 1.00 41.79 H new ATOM 348 N VAL A 715 1.261 -20.591 47.535 1.00 28.75 N ATOM 349 CA VAL A 715 0.348 -21.172 48.521 1.00 26.93 C ATOM 350 C VAL A 715 0.901 -20.912 49.928 1.00 27.60 C ATOM 351 O VAL A 715 0.149 -20.567 50.843 1.00 25.72 O ATOM 352 CB VAL A 715 0.162 -22.702 48.297 1.00 26.52 C ATOM 353 CG1 VAL A 715 -0.609 -23.321 49.462 1.00 26.49 C ATOM 354 CG2 VAL A 715 -0.595 -22.951 46.991 1.00 25.53 C ATOM 0 H VAL A 715 1.671 -21.163 47.041 1.00 28.75 H new ATOM 0 HA VAL A 715 -0.521 -20.754 48.421 1.00 26.93 H new ATOM 0 HB VAL A 715 1.038 -23.115 48.245 1.00 26.52 H new ATOM 0 HG11 VAL A 715 -0.717 -24.273 49.309 1.00 26.49 H new ATOM 0 HG12 VAL A 715 -0.118 -23.180 50.287 1.00 26.49 H new ATOM 0 HG13 VAL A 715 -1.482 -22.904 49.531 1.00 26.49 H new ATOM 0 HG21 VAL A 715 -0.707 -23.905 46.858 1.00 25.53 H new ATOM 0 HG22 VAL A 715 -1.466 -22.527 47.036 1.00 25.53 H new ATOM 0 HG23 VAL A 715 -0.093 -22.579 46.249 1.00 25.53 H new ATOM 355 N VAL A 716 2.216 -21.068 50.096 1.00 27.17 N ATOM 356 CA VAL A 716 2.848 -20.822 51.396 1.00 27.59 C ATOM 357 C VAL A 716 2.627 -19.357 51.815 1.00 28.86 C ATOM 358 O VAL A 716 2.245 -19.072 52.946 1.00 30.36 O ATOM 359 CB VAL A 716 4.383 -21.116 51.342 1.00 30.12 C ATOM 360 CG1 VAL A 716 5.068 -20.656 52.630 1.00 28.11 C ATOM 361 CG2 VAL A 716 4.618 -22.606 51.136 1.00 27.30 C ATOM 0 H VAL A 716 2.757 -21.314 49.475 1.00 27.17 H new ATOM 0 HA VAL A 716 2.441 -21.417 52.045 1.00 27.59 H new ATOM 0 HB VAL A 716 4.764 -20.624 50.598 1.00 30.12 H new ATOM 0 HG11 VAL A 716 6.018 -20.847 52.578 1.00 28.11 H new ATOM 0 HG12 VAL A 716 4.936 -19.702 52.744 1.00 28.11 H new ATOM 0 HG13 VAL A 716 4.685 -21.128 53.386 1.00 28.11 H new ATOM 0 HG21 VAL A 716 5.571 -22.782 51.103 1.00 27.30 H new ATOM 0 HG22 VAL A 716 4.223 -23.101 51.871 1.00 27.30 H new ATOM 0 HG23 VAL A 716 4.209 -22.886 50.302 1.00 27.30 H new ATOM 362 N LYS A 717 2.862 -18.431 50.895 1.00 29.17 N ATOM 363 CA LYS A 717 2.685 -17.007 51.185 1.00 30.01 C ATOM 364 C LYS A 717 1.229 -16.646 51.478 1.00 29.16 C ATOM 365 O LYS A 717 0.954 -15.826 52.340 1.00 28.50 O ATOM 366 CB LYS A 717 3.190 -16.181 50.010 1.00 31.12 C ATOM 367 CG LYS A 717 4.689 -16.250 49.810 1.00 36.15 C ATOM 368 CD LYS A 717 5.060 -15.800 48.404 1.00 42.44 C ATOM 369 CE LYS A 717 4.506 -14.418 48.083 1.00 43.97 C ATOM 370 NZ LYS A 717 4.623 -14.117 46.626 1.00 49.85 N ATOM 0 H LYS A 717 3.125 -18.603 50.094 1.00 29.17 H new ATOM 0 HA LYS A 717 3.198 -16.808 51.984 1.00 30.01 H new ATOM 0 HB2 LYS A 717 2.750 -16.484 49.200 1.00 31.12 H new ATOM 0 HB3 LYS A 717 2.933 -15.255 50.143 1.00 31.12 H new ATOM 0 HG2 LYS A 717 5.134 -15.688 50.463 1.00 36.15 H new ATOM 0 HG3 LYS A 717 4.999 -17.157 49.958 1.00 36.15 H new ATOM 0 HD2 LYS A 717 6.026 -15.790 48.313 1.00 42.44 H new ATOM 0 HD3 LYS A 717 4.721 -16.441 47.760 1.00 42.44 H new ATOM 0 HE2 LYS A 717 3.576 -14.369 48.353 1.00 43.97 H new ATOM 0 HE3 LYS A 717 4.985 -13.747 48.594 1.00 43.97 H new ATOM 0 HZ1 LYS A 717 4.294 -13.306 46.463 1.00 49.85 H new ATOM 0 HZ2 LYS A 717 5.479 -14.143 46.385 1.00 49.85 H new ATOM 0 HZ3 LYS A 717 4.166 -14.722 46.160 1.00 49.85 H new ATOM 371 N TRP A 718 0.309 -17.261 50.740 1.00 29.68 N ATOM 372 CA TRP A 718 -1.124 -17.053 50.907 1.00 28.50 C ATOM 373 C TRP A 718 -1.577 -17.507 52.299 1.00 28.89 C ATOM 374 O TRP A 718 -2.182 -16.742 53.050 1.00 29.57 O ATOM 375 CB TRP A 718 -1.878 -17.862 49.835 1.00 28.63 C ATOM 376 CG TRP A 718 -3.373 -18.009 50.063 1.00 28.18 C ATOM 377 CD1 TRP A 718 -4.328 -17.044 49.908 1.00 29.13 C ATOM 378 CD2 TRP A 718 -4.076 -19.207 50.441 1.00 28.27 C ATOM 379 NE1 TRP A 718 -5.583 -17.564 50.159 1.00 27.22 N ATOM 380 CE2 TRP A 718 -5.457 -18.888 50.487 1.00 27.86 C ATOM 381 CE3 TRP A 718 -3.675 -20.518 50.738 1.00 25.90 C ATOM 382 CZ2 TRP A 718 -6.437 -19.836 50.820 1.00 25.24 C ATOM 383 CZ3 TRP A 718 -4.655 -21.462 51.069 1.00 25.31 C ATOM 384 CH2 TRP A 718 -6.018 -21.112 51.107 1.00 25.40 C ATOM 0 H TRP A 718 0.505 -17.821 50.117 1.00 29.68 H new ATOM 0 HA TRP A 718 -1.318 -16.107 50.811 1.00 28.50 H new ATOM 0 HB2 TRP A 718 -1.737 -17.439 48.974 1.00 28.63 H new ATOM 0 HB3 TRP A 718 -1.485 -18.747 49.784 1.00 28.63 H new ATOM 0 HD1 TRP A 718 -4.157 -16.162 49.668 1.00 29.13 H new ATOM 0 HE1 TRP A 718 -6.323 -17.128 50.116 1.00 27.22 H new ATOM 0 HE3 TRP A 718 -2.776 -20.756 50.716 1.00 25.90 H new ATOM 0 HZ2 TRP A 718 -7.338 -19.608 50.845 1.00 25.24 H new ATOM 0 HZ3 TRP A 718 -4.401 -22.335 51.267 1.00 25.31 H new ATOM 0 HH2 TRP A 718 -6.648 -21.758 51.331 1.00 25.40 H new ATOM 385 N ALA A 719 -1.279 -18.765 52.621 1.00 28.88 N ATOM 386 CA ALA A 719 -1.654 -19.382 53.897 1.00 29.13 C ATOM 387 C ALA A 719 -1.168 -18.599 55.111 1.00 28.81 C ATOM 388 O ALA A 719 -1.949 -18.281 56.018 1.00 27.33 O ATOM 389 CB ALA A 719 -1.115 -20.825 53.955 1.00 28.60 C ATOM 0 H ALA A 719 -0.847 -19.293 52.098 1.00 28.88 H new ATOM 0 HA ALA A 719 -2.623 -19.380 53.935 1.00 29.13 H new ATOM 0 HB1 ALA A 719 -1.365 -21.230 54.800 1.00 28.60 H new ATOM 0 HB2 ALA A 719 -1.492 -21.341 53.225 1.00 28.60 H new ATOM 0 HB3 ALA A 719 -0.148 -20.813 53.876 1.00 28.60 H new ATOM 390 N LYS A 720 0.124 -18.293 55.126 1.00 28.49 N ATOM 391 CA LYS A 720 0.710 -17.548 56.228 1.00 29.80 C ATOM 392 C LYS A 720 -0.024 -16.234 56.452 1.00 28.39 C ATOM 393 O LYS A 720 0.012 -15.682 57.547 1.00 28.05 O ATOM 394 CB LYS A 720 2.195 -17.283 55.957 1.00 31.61 C ATOM 395 CG LYS A 720 3.034 -18.547 55.957 1.00 33.87 C ATOM 396 CD LYS A 720 4.451 -18.296 55.502 1.00 37.71 C ATOM 397 CE LYS A 720 5.292 -17.684 56.596 1.00 40.93 C ATOM 398 NZ LYS A 720 6.661 -17.396 56.094 1.00 44.27 N ATOM 0 H LYS A 720 0.678 -18.509 54.505 1.00 28.49 H new ATOM 0 HA LYS A 720 0.625 -18.083 57.033 1.00 29.80 H new ATOM 0 HB2 LYS A 720 2.288 -16.840 55.099 1.00 31.61 H new ATOM 0 HB3 LYS A 720 2.537 -16.674 56.630 1.00 31.61 H new ATOM 0 HG2 LYS A 720 3.046 -18.925 56.850 1.00 33.87 H new ATOM 0 HG3 LYS A 720 2.622 -19.206 55.376 1.00 33.87 H new ATOM 0 HD2 LYS A 720 4.851 -19.132 55.216 1.00 37.71 H new ATOM 0 HD3 LYS A 720 4.444 -17.706 54.732 1.00 37.71 H new ATOM 0 HE2 LYS A 720 4.878 -16.866 56.912 1.00 40.93 H new ATOM 0 HE3 LYS A 720 5.339 -18.289 57.353 1.00 40.93 H new ATOM 0 HZ1 LYS A 720 6.966 -16.652 56.474 1.00 44.27 H new ATOM 0 HZ2 LYS A 720 7.200 -18.075 56.296 1.00 44.27 H new ATOM 0 HZ3 LYS A 720 6.637 -17.289 55.211 1.00 44.27 H new ATOM 399 N ALA A 721 -0.714 -15.752 55.424 1.00 28.47 N ATOM 400 CA ALA A 721 -1.443 -14.486 55.525 1.00 30.08 C ATOM 401 C ALA A 721 -2.946 -14.619 55.827 1.00 29.44 C ATOM 402 O ALA A 721 -3.652 -13.617 55.895 1.00 29.99 O ATOM 403 CB ALA A 721 -1.245 -13.679 54.238 1.00 28.17 C ATOM 0 H ALA A 721 -0.775 -16.140 54.659 1.00 28.47 H new ATOM 0 HA ALA A 721 -1.066 -14.029 56.293 1.00 30.08 H new ATOM 0 HB1 ALA A 721 -1.728 -12.840 54.304 1.00 28.17 H new ATOM 0 HB2 ALA A 721 -0.300 -13.499 54.111 1.00 28.17 H new ATOM 0 HB3 ALA A 721 -1.581 -14.186 53.483 1.00 28.17 H new ATOM 404 N LEU A 722 -3.432 -15.846 56.002 1.00 29.84 N ATOM 405 CA LEU A 722 -4.846 -16.078 56.302 1.00 28.08 C ATOM 406 C LEU A 722 -5.156 -15.729 57.751 1.00 28.38 C ATOM 407 O LEU A 722 -4.344 -15.962 58.647 1.00 28.92 O ATOM 408 CB LEU A 722 -5.215 -17.549 56.081 1.00 28.39 C ATOM 409 CG LEU A 722 -5.361 -18.066 54.652 1.00 30.05 C ATOM 410 CD1 LEU A 722 -5.311 -19.604 54.645 1.00 26.67 C ATOM 411 CD2 LEU A 722 -6.683 -17.548 54.069 1.00 25.47 C ATOM 0 H LEU A 722 -2.958 -16.562 55.951 1.00 29.84 H new ATOM 0 HA LEU A 722 -5.362 -15.512 55.706 1.00 28.08 H new ATOM 0 HB2 LEU A 722 -4.541 -18.090 56.521 1.00 28.39 H new ATOM 0 HB3 LEU A 722 -6.054 -17.713 56.539 1.00 28.39 H new ATOM 0 HG LEU A 722 -4.630 -17.744 54.102 1.00 30.05 H new ATOM 0 HD11 LEU A 722 -5.404 -19.927 53.735 1.00 26.67 H new ATOM 0 HD12 LEU A 722 -4.462 -19.902 55.008 1.00 26.67 H new ATOM 0 HD13 LEU A 722 -6.035 -19.954 55.187 1.00 26.67 H new ATOM 0 HD21 LEU A 722 -6.785 -17.872 53.160 1.00 25.47 H new ATOM 0 HD22 LEU A 722 -7.422 -17.867 54.610 1.00 25.47 H new ATOM 0 HD23 LEU A 722 -6.678 -16.578 54.068 1.00 25.47 H new ATOM 412 N PRO A 723 -6.351 -15.184 58.003 1.00 28.83 N ATOM 413 CA PRO A 723 -6.737 -14.823 59.370 1.00 28.96 C ATOM 414 C PRO A 723 -6.617 -16.002 60.336 1.00 31.60 C ATOM 415 O PRO A 723 -7.199 -17.066 60.115 1.00 32.28 O ATOM 416 CB PRO A 723 -8.183 -14.370 59.211 1.00 30.16 C ATOM 417 CG PRO A 723 -8.202 -13.796 57.808 1.00 29.10 C ATOM 418 CD PRO A 723 -7.397 -14.803 57.034 1.00 26.32 C ATOM 0 HA PRO A 723 -6.163 -14.142 59.753 1.00 28.96 H new ATOM 0 HB2 PRO A 723 -8.804 -15.109 59.306 1.00 30.16 H new ATOM 0 HB3 PRO A 723 -8.428 -13.706 59.875 1.00 30.16 H new ATOM 0 HG2 PRO A 723 -9.105 -13.714 57.464 1.00 29.10 H new ATOM 0 HG3 PRO A 723 -7.804 -12.912 57.774 1.00 29.10 H new ATOM 0 HD2 PRO A 723 -7.934 -15.564 56.763 1.00 26.32 H new ATOM 0 HD3 PRO A 723 -7.020 -14.421 56.226 1.00 26.32 H new ATOM 419 N GLY A 724 -5.846 -15.805 61.402 1.00 32.97 N ATOM 420 CA GLY A 724 -5.679 -16.832 62.414 1.00 31.31 C ATOM 421 C GLY A 724 -4.669 -17.920 62.122 1.00 32.28 C ATOM 422 O GLY A 724 -4.342 -18.701 63.015 1.00 33.40 O ATOM 0 H GLY A 724 -5.411 -15.079 61.555 1.00 32.97 H new ATOM 0 HA2 GLY A 724 -5.426 -16.400 63.245 1.00 31.31 H new ATOM 0 HA3 GLY A 724 -6.541 -17.252 62.564 1.00 31.31 H new ATOM 423 N PHE A 725 -4.160 -17.977 60.895 1.00 32.51 N ATOM 424 CA PHE A 725 -3.205 -19.015 60.541 1.00 31.85 C ATOM 425 C PHE A 725 -2.001 -19.113 61.476 1.00 34.83 C ATOM 426 O PHE A 725 -1.564 -20.215 61.815 1.00 31.96 O ATOM 427 CB PHE A 725 -2.698 -18.828 59.117 1.00 31.25 C ATOM 428 CG PHE A 725 -1.914 -20.006 58.608 1.00 29.45 C ATOM 429 CD1 PHE A 725 -2.565 -21.172 58.227 1.00 27.77 C ATOM 430 CD2 PHE A 725 -0.528 -19.965 58.550 1.00 28.82 C ATOM 431 CE1 PHE A 725 -1.845 -22.279 57.795 1.00 27.64 C ATOM 432 CE2 PHE A 725 0.202 -21.066 58.117 1.00 29.80 C ATOM 433 CZ PHE A 725 -0.458 -22.227 57.738 1.00 30.50 C ATOM 0 H PHE A 725 -4.353 -17.430 60.261 1.00 32.51 H new ATOM 0 HA PHE A 725 -3.703 -19.843 60.626 1.00 31.85 H new ATOM 0 HB2 PHE A 725 -3.453 -18.671 58.529 1.00 31.25 H new ATOM 0 HB3 PHE A 725 -2.140 -18.035 59.080 1.00 31.25 H new ATOM 0 HD1 PHE A 725 -3.493 -21.212 58.261 1.00 27.77 H new ATOM 0 HD2 PHE A 725 -0.081 -19.190 58.804 1.00 28.82 H new ATOM 0 HE1 PHE A 725 -2.292 -23.055 57.544 1.00 27.64 H new ATOM 0 HE2 PHE A 725 1.130 -21.025 58.081 1.00 29.80 H new ATOM 0 HZ PHE A 725 0.026 -22.966 57.447 1.00 30.50 H new ATOM 434 N ARG A 726 -1.459 -17.966 61.886 1.00 38.37 N ATOM 435 CA ARG A 726 -0.295 -17.955 62.771 1.00 42.52 C ATOM 436 C ARG A 726 -0.600 -18.445 64.181 1.00 42.46 C ATOM 437 O ARG A 726 0.301 -18.544 65.015 1.00 41.92 O ATOM 438 CB ARG A 726 0.325 -16.556 62.825 1.00 44.61 C ATOM 439 CG ARG A 726 0.937 -16.136 61.501 1.00 49.48 C ATOM 440 CD ARG A 726 1.504 -14.727 61.547 1.00 54.68 C ATOM 441 NE ARG A 726 1.865 -14.258 60.208 1.00 59.78 N ATOM 442 CZ ARG A 726 2.821 -14.790 59.447 1.00 62.06 C ATOM 443 NH1 ARG A 726 3.533 -15.821 59.886 1.00 63.60 N ATOM 444 NH2 ARG A 726 3.064 -14.291 58.239 1.00 64.35 N ATOM 0 H ARG A 726 -1.749 -17.187 61.664 1.00 38.37 H new ATOM 0 HA ARG A 726 0.339 -18.582 62.390 1.00 42.52 H new ATOM 0 HB2 ARG A 726 -0.356 -15.914 63.081 1.00 44.61 H new ATOM 0 HB3 ARG A 726 1.008 -16.535 63.514 1.00 44.61 H new ATOM 0 HG2 ARG A 726 1.642 -16.758 61.261 1.00 49.48 H new ATOM 0 HG3 ARG A 726 0.263 -16.189 60.805 1.00 49.48 H new ATOM 0 HD2 ARG A 726 0.851 -14.126 61.938 1.00 54.68 H new ATOM 0 HD3 ARG A 726 2.286 -14.709 62.121 1.00 54.68 H new ATOM 0 HE ARG A 726 1.428 -13.590 59.889 1.00 59.78 H new ATOM 0 HH11 ARG A 726 3.378 -16.149 60.666 1.00 63.60 H new ATOM 0 HH12 ARG A 726 4.149 -16.160 59.391 1.00 63.60 H new ATOM 0 HH21 ARG A 726 2.604 -13.625 57.949 1.00 64.35 H new ATOM 0 HH22 ARG A 726 3.681 -14.634 57.748 1.00 64.35 H new ATOM 445 N ASN A 727 -1.867 -18.755 64.446 1.00 42.62 N ATOM 446 CA ASN A 727 -2.256 -19.266 65.752 1.00 43.38 C ATOM 447 C ASN A 727 -1.844 -20.730 65.860 1.00 42.24 C ATOM 448 O ASN A 727 -1.664 -21.248 66.955 1.00 42.11 O ATOM 449 CB ASN A 727 -3.766 -19.157 65.962 1.00 46.94 C ATOM 450 CG ASN A 727 -4.206 -17.752 66.308 1.00 50.26 C ATOM 451 OD1 ASN A 727 -3.404 -16.939 66.777 1.00 53.14 O ATOM 452 ND2 ASN A 727 -5.492 -17.462 66.100 1.00 50.38 N ATOM 0 H ASN A 727 -2.513 -18.676 63.884 1.00 42.62 H new ATOM 0 HA ASN A 727 -1.812 -18.736 66.432 1.00 43.38 H new ATOM 0 HB2 ASN A 727 -4.223 -19.446 65.157 1.00 46.94 H new ATOM 0 HB3 ASN A 727 -4.035 -19.760 66.672 1.00 46.94 H new ATOM 0 HD21 ASN A 727 -5.794 -16.680 66.295 1.00 50.38 H new ATOM 0 HD22 ASN A 727 -6.019 -18.057 65.771 1.00 50.38 H new ATOM 453 N LEU A 728 -1.707 -21.389 64.714 1.00 40.29 N ATOM 454 CA LEU A 728 -1.312 -22.790 64.671 1.00 39.53 C ATOM 455 C LEU A 728 0.145 -22.925 65.060 1.00 39.07 C ATOM 456 O LEU A 728 0.927 -21.998 64.884 1.00 39.07 O ATOM 457 CB LEU A 728 -1.467 -23.357 63.260 1.00 38.16 C ATOM 458 CG LEU A 728 -2.834 -23.390 62.587 1.00 39.09 C ATOM 459 CD1 LEU A 728 -2.684 -23.954 61.175 1.00 38.03 C ATOM 460 CD2 LEU A 728 -3.791 -24.235 63.413 1.00 38.60 C ATOM 0 H LEU A 728 -1.840 -21.036 63.941 1.00 40.29 H new ATOM 0 HA LEU A 728 -1.883 -23.276 65.287 1.00 39.53 H new ATOM 0 HB2 LEU A 728 -0.875 -22.852 62.681 1.00 38.16 H new ATOM 0 HB3 LEU A 728 -1.135 -24.268 63.279 1.00 38.16 H new ATOM 0 HG LEU A 728 -3.197 -22.493 62.527 1.00 39.09 H new ATOM 0 HD11 LEU A 728 -3.552 -23.977 60.742 1.00 38.03 H new ATOM 0 HD12 LEU A 728 -2.083 -23.390 60.663 1.00 38.03 H new ATOM 0 HD13 LEU A 728 -2.322 -24.853 61.222 1.00 38.03 H new ATOM 0 HD21 LEU A 728 -4.660 -24.254 62.983 1.00 38.60 H new ATOM 0 HD22 LEU A 728 -3.446 -25.139 63.484 1.00 38.60 H new ATOM 0 HD23 LEU A 728 -3.878 -23.852 64.300 1.00 38.60 H new ATOM 461 N HIS A 729 0.504 -24.086 65.587 1.00 40.03 N ATOM 462 CA HIS A 729 1.885 -24.354 65.951 1.00 39.97 C ATOM 463 C HIS A 729 2.642 -24.315 64.622 1.00 39.95 C ATOM 464 O HIS A 729 2.092 -24.698 63.589 1.00 38.72 O ATOM 465 CB HIS A 729 2.000 -25.747 66.567 1.00 39.60 C ATOM 466 CG HIS A 729 3.390 -26.113 66.977 1.00 40.53 C ATOM 467 ND1 HIS A 729 3.833 -26.016 68.279 1.00 42.46 N ATOM 468 CD2 HIS A 729 4.443 -26.563 66.255 1.00 41.44 C ATOM 469 CE1 HIS A 729 5.098 -26.393 68.342 1.00 41.11 C ATOM 470 NE2 HIS A 729 5.493 -26.730 67.127 1.00 42.22 N ATOM 0 H HIS A 729 -0.039 -24.734 65.742 1.00 40.03 H new ATOM 0 HA HIS A 729 2.229 -23.719 66.599 1.00 39.97 H new ATOM 0 HB2 HIS A 729 1.419 -25.797 67.342 1.00 39.60 H new ATOM 0 HB3 HIS A 729 1.677 -26.402 65.928 1.00 39.60 H new ATOM 0 HD2 HIS A 729 4.454 -26.728 65.340 1.00 41.44 H new ATOM 0 HE1 HIS A 729 5.621 -26.417 69.111 1.00 41.11 H new ATOM 0 HE2 HIS A 729 6.279 -27.008 66.916 1.00 42.22 H new ATOM 471 N VAL A 730 3.891 -23.861 64.638 1.00 40.69 N ATOM 472 CA VAL A 730 4.662 -23.790 63.403 1.00 40.79 C ATOM 473 C VAL A 730 4.717 -25.127 62.665 1.00 40.08 C ATOM 474 O VAL A 730 4.616 -25.166 61.438 1.00 40.48 O ATOM 475 CB VAL A 730 6.111 -23.303 63.654 1.00 43.02 C ATOM 476 CG1 VAL A 730 6.819 -24.227 64.638 1.00 43.36 C ATOM 477 CG2 VAL A 730 6.875 -23.265 62.336 1.00 44.55 C ATOM 0 H VAL A 730 4.305 -23.593 65.342 1.00 40.69 H new ATOM 0 HA VAL A 730 4.195 -23.147 62.847 1.00 40.79 H new ATOM 0 HB VAL A 730 6.081 -22.411 64.034 1.00 43.02 H new ATOM 0 HG11 VAL A 730 7.724 -23.911 64.786 1.00 43.36 H new ATOM 0 HG12 VAL A 730 6.338 -24.233 65.480 1.00 43.36 H new ATOM 0 HG13 VAL A 730 6.847 -25.126 64.275 1.00 43.36 H new ATOM 0 HG21 VAL A 730 7.782 -22.960 62.496 1.00 44.55 H new ATOM 0 HG22 VAL A 730 6.897 -24.154 61.949 1.00 44.55 H new ATOM 0 HG23 VAL A 730 6.433 -22.657 61.723 1.00 44.55 H new ATOM 478 N ASP A 731 4.872 -26.221 63.401 1.00 39.26 N ATOM 479 CA ASP A 731 4.943 -27.529 62.765 1.00 40.29 C ATOM 480 C ASP A 731 3.635 -27.892 62.073 1.00 37.77 C ATOM 481 O ASP A 731 3.644 -28.569 61.046 1.00 34.52 O ATOM 482 CB ASP A 731 5.306 -28.621 63.782 1.00 44.41 C ATOM 483 CG ASP A 731 6.727 -28.478 64.319 1.00 48.84 C ATOM 484 OD1 ASP A 731 7.637 -28.118 63.536 1.00 51.63 O ATOM 485 OD2 ASP A 731 6.934 -28.743 65.522 1.00 50.00 O ATOM 0 H ASP A 731 4.937 -26.229 64.258 1.00 39.26 H new ATOM 0 HA ASP A 731 5.641 -27.476 62.094 1.00 40.29 H new ATOM 0 HB2 ASP A 731 4.680 -28.589 64.522 1.00 44.41 H new ATOM 0 HB3 ASP A 731 5.208 -29.491 63.365 1.00 44.41 H new ATOM 486 N ASP A 732 2.519 -27.439 62.641 1.00 37.48 N ATOM 487 CA ASP A 732 1.200 -27.711 62.078 1.00 36.07 C ATOM 488 C ASP A 732 0.937 -26.853 60.847 1.00 35.28 C ATOM 489 O ASP A 732 0.280 -27.299 59.896 1.00 32.87 O ATOM 490 CB ASP A 732 0.107 -27.481 63.129 1.00 36.14 C ATOM 491 CG ASP A 732 0.165 -28.496 64.262 1.00 38.65 C ATOM 492 OD1 ASP A 732 0.819 -29.552 64.077 1.00 38.21 O ATOM 493 OD2 ASP A 732 -0.449 -28.248 65.327 1.00 37.44 O ATOM 0 H ASP A 732 2.506 -26.968 63.360 1.00 37.48 H new ATOM 0 HA ASP A 732 1.181 -28.642 61.806 1.00 36.07 H new ATOM 0 HB2 ASP A 732 0.197 -26.587 63.495 1.00 36.14 H new ATOM 0 HB3 ASP A 732 -0.763 -27.527 62.702 1.00 36.14 H new ATOM 494 N GLN A 733 1.448 -25.625 60.871 1.00 33.39 N ATOM 495 CA GLN A 733 1.303 -24.709 59.744 1.00 33.91 C ATOM 496 C GLN A 733 1.905 -25.384 58.510 1.00 33.41 C ATOM 497 O GLN A 733 1.298 -25.401 57.435 1.00 32.49 O ATOM 498 CB GLN A 733 2.054 -23.404 60.013 1.00 35.09 C ATOM 499 CG GLN A 733 1.413 -22.486 61.044 1.00 36.55 C ATOM 500 CD GLN A 733 2.238 -21.234 61.267 1.00 36.09 C ATOM 501 OE1 GLN A 733 2.797 -20.686 60.329 1.00 37.38 O ATOM 502 NE2 GLN A 733 2.310 -20.775 62.508 1.00 35.51 N ATOM 0 H GLN A 733 1.886 -25.301 61.537 1.00 33.39 H new ATOM 0 HA GLN A 733 0.365 -24.503 59.609 1.00 33.91 H new ATOM 0 HB2 GLN A 733 2.952 -23.620 60.308 1.00 35.09 H new ATOM 0 HB3 GLN A 733 2.139 -22.919 59.177 1.00 35.09 H new ATOM 0 HG2 GLN A 733 0.522 -22.239 60.749 1.00 36.55 H new ATOM 0 HG3 GLN A 733 1.312 -22.962 61.883 1.00 36.55 H new ATOM 0 HE21 GLN A 733 1.903 -21.188 63.143 1.00 35.51 H new ATOM 0 HE22 GLN A 733 2.764 -20.064 62.678 1.00 35.51 H new ATOM 503 N MET A 734 3.106 -25.935 58.678 1.00 30.99 N ATOM 504 CA MET A 734 3.797 -26.624 57.597 1.00 31.44 C ATOM 505 C MET A 734 3.055 -27.899 57.194 1.00 30.95 C ATOM 506 O MET A 734 2.948 -28.217 56.015 1.00 27.37 O ATOM 507 CB MET A 734 5.224 -26.983 58.020 1.00 33.14 C ATOM 508 CG MET A 734 6.122 -25.783 58.275 1.00 39.66 C ATOM 509 SD MET A 734 7.852 -26.235 58.538 1.00 41.07 S ATOM 510 CE MET A 734 7.780 -27.031 60.156 1.00 38.34 C ATOM 0 H MET A 734 3.540 -25.919 59.420 1.00 30.99 H new ATOM 0 HA MET A 734 3.825 -26.024 56.835 1.00 31.44 H new ATOM 0 HB2 MET A 734 5.185 -27.522 58.826 1.00 33.14 H new ATOM 0 HB3 MET A 734 5.626 -27.533 57.330 1.00 33.14 H new ATOM 0 HG2 MET A 734 6.063 -25.176 57.521 1.00 39.66 H new ATOM 0 HG3 MET A 734 5.797 -25.302 59.052 1.00 39.66 H new ATOM 0 HE1 MET A 734 8.675 -27.281 60.434 1.00 38.34 H new ATOM 0 HE2 MET A 734 7.401 -26.416 60.803 1.00 38.34 H new ATOM 0 HE3 MET A 734 7.225 -27.825 60.102 1.00 38.34 H new ATOM 511 N ALA A 735 2.541 -28.618 58.189 1.00 29.99 N ATOM 512 CA ALA A 735 1.823 -29.864 57.956 1.00 31.08 C ATOM 513 C ALA A 735 0.569 -29.704 57.101 1.00 29.40 C ATOM 514 O ALA A 735 0.416 -30.403 56.099 1.00 28.35 O ATOM 515 CB ALA A 735 1.473 -30.527 59.305 1.00 30.26 C ATOM 0 H ALA A 735 2.600 -28.396 59.018 1.00 29.99 H new ATOM 0 HA ALA A 735 2.420 -30.434 57.447 1.00 31.08 H new ATOM 0 HB1 ALA A 735 0.995 -31.356 59.144 1.00 30.26 H new ATOM 0 HB2 ALA A 735 2.289 -30.714 59.795 1.00 30.26 H new ATOM 0 HB3 ALA A 735 0.915 -29.928 59.825 1.00 30.26 H new ATOM 516 N VAL A 736 -0.322 -28.786 57.479 1.00 29.36 N ATOM 517 CA VAL A 736 -1.551 -28.591 56.712 1.00 28.79 C ATOM 518 C VAL A 736 -1.270 -28.216 55.266 1.00 27.56 C ATOM 519 O VAL A 736 -1.975 -28.656 54.371 1.00 28.82 O ATOM 520 CB VAL A 736 -2.498 -27.518 57.346 1.00 31.29 C ATOM 521 CG1 VAL A 736 -2.971 -27.992 58.709 1.00 30.18 C ATOM 522 CG2 VAL A 736 -1.805 -26.159 57.437 1.00 30.52 C ATOM 0 H VAL A 736 -0.236 -28.274 58.165 1.00 29.36 H new ATOM 0 HA VAL A 736 -2.003 -29.449 56.735 1.00 28.79 H new ATOM 0 HB VAL A 736 -3.273 -27.406 56.773 1.00 31.29 H new ATOM 0 HG11 VAL A 736 -3.557 -27.325 59.098 1.00 30.18 H new ATOM 0 HG12 VAL A 736 -3.453 -28.828 58.612 1.00 30.18 H new ATOM 0 HG13 VAL A 736 -2.205 -28.127 59.289 1.00 30.18 H new ATOM 0 HG21 VAL A 736 -2.411 -25.513 57.832 1.00 30.52 H new ATOM 0 HG22 VAL A 736 -1.011 -26.237 57.989 1.00 30.52 H new ATOM 0 HG23 VAL A 736 -1.553 -25.864 56.548 1.00 30.52 H new ATOM 523 N ILE A 737 -0.235 -27.414 55.032 1.00 28.40 N ATOM 524 CA ILE A 737 0.119 -27.017 53.673 1.00 26.29 C ATOM 525 C ILE A 737 0.676 -28.214 52.898 1.00 26.50 C ATOM 526 O ILE A 737 0.353 -28.417 51.735 1.00 25.08 O ATOM 527 CB ILE A 737 1.184 -25.897 53.670 1.00 27.12 C ATOM 528 CG1 ILE A 737 0.607 -24.613 54.257 1.00 24.72 C ATOM 529 CG2 ILE A 737 1.659 -25.638 52.248 1.00 26.72 C ATOM 530 CD1 ILE A 737 1.662 -23.498 54.435 1.00 28.00 C ATOM 0 H ILE A 737 0.274 -27.090 55.645 1.00 28.40 H new ATOM 0 HA ILE A 737 -0.690 -26.688 53.251 1.00 26.29 H new ATOM 0 HB ILE A 737 1.934 -26.183 54.214 1.00 27.12 H new ATOM 0 HG12 ILE A 737 -0.102 -24.290 53.679 1.00 24.72 H new ATOM 0 HG13 ILE A 737 0.204 -24.810 55.117 1.00 24.72 H new ATOM 0 HG21 ILE A 737 2.327 -24.935 52.253 1.00 26.72 H new ATOM 0 HG22 ILE A 737 2.047 -26.449 51.883 1.00 26.72 H new ATOM 0 HG23 ILE A 737 0.907 -25.365 51.700 1.00 26.72 H new ATOM 0 HD11 ILE A 737 1.240 -22.709 54.810 1.00 28.00 H new ATOM 0 HD12 ILE A 737 2.360 -23.806 55.034 1.00 28.00 H new ATOM 0 HD13 ILE A 737 2.049 -23.278 53.573 1.00 28.00 H new ATOM 531 N GLN A 738 1.523 -28.999 53.556 1.00 27.87 N ATOM 532 CA GLN A 738 2.120 -30.168 52.934 1.00 27.49 C ATOM 533 C GLN A 738 1.086 -31.233 52.575 1.00 28.45 C ATOM 534 O GLN A 738 1.268 -31.960 51.607 1.00 28.68 O ATOM 535 CB GLN A 738 3.178 -30.767 53.864 1.00 29.38 C ATOM 536 CG GLN A 738 4.507 -30.044 53.828 1.00 32.97 C ATOM 537 CD GLN A 738 5.402 -30.396 55.002 1.00 34.55 C ATOM 538 OE1 GLN A 738 6.609 -30.225 54.937 1.00 34.78 O ATOM 539 NE2 GLN A 738 4.806 -30.877 56.084 1.00 35.20 N ATOM 0 H GLN A 738 1.765 -28.868 54.371 1.00 27.87 H new ATOM 0 HA GLN A 738 2.531 -29.874 52.106 1.00 27.49 H new ATOM 0 HB2 GLN A 738 2.839 -30.758 54.773 1.00 29.38 H new ATOM 0 HB3 GLN A 738 3.319 -31.696 53.623 1.00 29.38 H new ATOM 0 HG2 GLN A 738 4.966 -30.261 53.001 1.00 32.97 H new ATOM 0 HG3 GLN A 738 4.349 -29.087 53.823 1.00 32.97 H new ATOM 0 HE21 GLN A 738 3.953 -30.984 56.093 1.00 35.20 H new ATOM 0 HE22 GLN A 738 5.273 -31.082 56.777 1.00 35.20 H new ATOM 540 N TYR A 739 0.011 -31.326 53.356 1.00 27.36 N ATOM 541 CA TYR A 739 -1.035 -32.310 53.098 1.00 27.82 C ATOM 542 C TYR A 739 -2.093 -31.810 52.136 1.00 27.75 C ATOM 543 O TYR A 739 -2.603 -32.580 51.328 1.00 28.91 O ATOM 544 CB TYR A 739 -1.756 -32.727 54.389 1.00 27.67 C ATOM 545 CG TYR A 739 -0.872 -33.311 55.464 1.00 29.68 C ATOM 546 CD1 TYR A 739 0.163 -34.188 55.145 1.00 32.27 C ATOM 547 CD2 TYR A 739 -1.084 -33.001 56.809 1.00 31.67 C ATOM 548 CE1 TYR A 739 0.970 -34.744 56.138 1.00 35.40 C ATOM 549 CE2 TYR A 739 -0.285 -33.553 57.814 1.00 35.15 C ATOM 550 CZ TYR A 739 0.740 -34.421 57.468 1.00 36.23 C ATOM 551 OH TYR A 739 1.540 -34.960 58.447 1.00 41.28 O ATOM 0 H TYR A 739 -0.131 -30.827 54.042 1.00 27.36 H new ATOM 0 HA TYR A 739 -0.571 -33.065 52.704 1.00 27.82 H new ATOM 0 HB2 TYR A 739 -2.212 -31.951 54.752 1.00 27.67 H new ATOM 0 HB3 TYR A 739 -2.439 -33.378 54.164 1.00 27.67 H new ATOM 0 HD1 TYR A 739 0.318 -34.406 54.254 1.00 32.27 H new ATOM 0 HD2 TYR A 739 -1.769 -32.417 57.040 1.00 31.67 H new ATOM 0 HE1 TYR A 739 1.658 -35.327 55.910 1.00 35.40 H new ATOM 0 HE2 TYR A 739 -0.439 -33.340 58.706 1.00 35.15 H new ATOM 0 HH TYR A 739 1.290 -34.680 59.199 1.00 41.28 H new ATOM 552 N SER A 740 -2.412 -30.522 52.213 1.00 27.72 N ATOM 553 CA SER A 740 -3.462 -29.953 51.377 1.00 27.79 C ATOM 554 C SER A 740 -3.124 -29.286 50.044 1.00 28.37 C ATOM 555 O SER A 740 -4.039 -28.995 49.275 1.00 30.23 O ATOM 556 CB SER A 740 -4.287 -28.964 52.209 1.00 29.45 C ATOM 557 OG ASER A 740 -5.000 -29.626 53.238 0.50 31.04 O ATOM 558 OG BSER A 740 -3.511 -27.849 52.601 0.50 25.48 O ATOM 0 H SER A 740 -2.032 -29.961 52.743 1.00 27.72 H new ATOM 0 HA SER A 740 -3.930 -30.754 51.094 1.00 27.79 H new ATOM 0 HB2ASER A 740 -3.700 -28.296 52.597 0.50 29.45 H new ATOM 0 HB2BSER A 740 -5.051 -28.663 51.693 0.50 29.45 H new ATOM 0 HB3ASER A 740 -4.909 -28.494 51.633 0.50 29.45 H new ATOM 0 HB3BSER A 740 -4.634 -29.412 52.996 0.50 29.45 H new ATOM 0 HG ASER A 740 -4.800 -29.287 53.980 0.50 25.48 H new ATOM 0 HG BSER A 740 -3.137 -28.012 53.335 0.50 25.48 H new ATOM 559 N TRP A 741 -1.852 -29.045 49.743 1.00 27.61 N ATOM 560 CA TRP A 741 -1.534 -28.363 48.488 1.00 28.18 C ATOM 561 C TRP A 741 -2.196 -28.921 47.227 1.00 27.17 C ATOM 562 O TRP A 741 -2.590 -28.155 46.347 1.00 28.18 O ATOM 563 CB TRP A 741 -0.013 -28.259 48.266 1.00 28.50 C ATOM 564 CG TRP A 741 0.730 -29.565 48.164 1.00 29.52 C ATOM 565 CD1 TRP A 741 1.293 -30.260 49.185 1.00 28.70 C ATOM 566 CD2 TRP A 741 0.974 -30.328 46.971 1.00 29.61 C ATOM 567 NE1 TRP A 741 1.875 -31.415 48.714 1.00 32.08 N ATOM 568 CE2 TRP A 741 1.695 -31.483 47.356 1.00 30.86 C ATOM 569 CE3 TRP A 741 0.653 -30.149 45.616 1.00 29.50 C ATOM 570 CZ2 TRP A 741 2.105 -32.461 46.433 1.00 27.74 C ATOM 571 CZ3 TRP A 741 1.061 -31.122 44.692 1.00 28.28 C ATOM 572 CH2 TRP A 741 1.781 -32.264 45.111 1.00 28.56 C ATOM 0 H TRP A 741 -1.177 -29.259 50.231 1.00 27.61 H new ATOM 0 HA TRP A 741 -1.922 -27.483 48.616 1.00 28.18 H new ATOM 0 HB2 TRP A 741 0.143 -27.754 47.453 1.00 28.50 H new ATOM 0 HB3 TRP A 741 0.368 -27.747 48.996 1.00 28.50 H new ATOM 0 HD1 TRP A 741 1.286 -29.994 50.076 1.00 28.70 H new ATOM 0 HE1 TRP A 741 2.285 -31.999 49.194 1.00 32.08 H new ATOM 0 HE3 TRP A 741 0.179 -29.399 45.336 1.00 29.50 H new ATOM 0 HZ2 TRP A 741 2.578 -33.214 46.706 1.00 27.74 H new ATOM 0 HZ3 TRP A 741 0.855 -31.014 43.791 1.00 28.28 H new ATOM 0 HH2 TRP A 741 2.041 -32.895 44.480 1.00 28.56 H new ATOM 573 N MET A 742 -2.338 -30.239 47.134 1.00 26.46 N ATOM 574 CA MET A 742 -2.949 -30.833 45.946 1.00 25.82 C ATOM 575 C MET A 742 -4.400 -30.407 45.757 1.00 25.87 C ATOM 576 O MET A 742 -4.774 -29.954 44.677 1.00 25.56 O ATOM 577 CB MET A 742 -2.888 -32.357 46.007 1.00 24.33 C ATOM 578 CG MET A 742 -3.413 -33.036 44.744 1.00 21.71 C ATOM 579 SD MET A 742 -2.300 -32.860 43.339 1.00 26.29 S ATOM 580 CE MET A 742 -1.014 -34.041 43.819 1.00 22.72 C ATOM 0 H MET A 742 -2.092 -30.801 47.737 1.00 26.46 H new ATOM 0 HA MET A 742 -2.436 -30.508 45.190 1.00 25.82 H new ATOM 0 HB2 MET A 742 -1.970 -32.632 46.156 1.00 24.33 H new ATOM 0 HB3 MET A 742 -3.403 -32.664 46.769 1.00 24.33 H new ATOM 0 HG2 MET A 742 -3.553 -33.979 44.924 1.00 21.71 H new ATOM 0 HG3 MET A 742 -4.277 -32.659 44.515 1.00 21.71 H new ATOM 0 HE1 MET A 742 -0.299 -34.025 43.164 1.00 22.72 H new ATOM 0 HE2 MET A 742 -0.660 -33.799 44.689 1.00 22.72 H new ATOM 0 HE3 MET A 742 -1.393 -34.933 43.862 1.00 22.72 H new ATOM 581 N GLY A 743 -5.208 -30.559 46.806 1.00 24.88 N ATOM 582 CA GLY A 743 -6.609 -30.179 46.722 1.00 25.21 C ATOM 583 C GLY A 743 -6.757 -28.690 46.474 1.00 25.66 C ATOM 584 O GLY A 743 -7.581 -28.261 45.666 1.00 24.45 O ATOM 0 H GLY A 743 -4.964 -30.877 47.567 1.00 24.88 H new ATOM 0 HA2 GLY A 743 -7.039 -30.673 46.007 1.00 25.21 H new ATOM 0 HA3 GLY A 743 -7.062 -30.419 47.545 1.00 25.21 H new ATOM 585 N LEU A 744 -5.956 -27.895 47.178 1.00 25.43 N ATOM 586 CA LEU A 744 -5.994 -26.449 47.006 1.00 26.39 C ATOM 587 C LEU A 744 -5.689 -26.061 45.557 1.00 25.60 C ATOM 588 O LEU A 744 -6.425 -25.289 44.945 1.00 22.78 O ATOM 589 CB LEU A 744 -4.976 -25.777 47.933 1.00 26.82 C ATOM 590 CG LEU A 744 -5.313 -25.725 49.426 1.00 27.25 C ATOM 591 CD1 LEU A 744 -4.086 -25.263 50.206 1.00 25.41 C ATOM 592 CD2 LEU A 744 -6.484 -24.779 49.659 1.00 26.87 C ATOM 0 H LEU A 744 -5.386 -28.173 47.758 1.00 25.43 H new ATOM 0 HA LEU A 744 -6.888 -26.147 47.231 1.00 26.39 H new ATOM 0 HB2 LEU A 744 -4.128 -26.238 47.832 1.00 26.82 H new ATOM 0 HB3 LEU A 744 -4.843 -24.867 47.623 1.00 26.82 H new ATOM 0 HG LEU A 744 -5.567 -26.609 49.735 1.00 27.25 H new ATOM 0 HD11 LEU A 744 -4.297 -25.229 51.152 1.00 25.41 H new ATOM 0 HD12 LEU A 744 -3.356 -25.885 50.060 1.00 25.41 H new ATOM 0 HD13 LEU A 744 -3.823 -24.380 49.902 1.00 25.41 H new ATOM 0 HD21 LEU A 744 -6.693 -24.750 50.606 1.00 26.87 H new ATOM 0 HD22 LEU A 744 -6.247 -23.889 49.353 1.00 26.87 H new ATOM 0 HD23 LEU A 744 -7.258 -25.095 49.167 1.00 26.87 H new ATOM 593 N MET A 745 -4.599 -26.600 45.013 1.00 26.30 N ATOM 594 CA MET A 745 -4.201 -26.281 43.644 1.00 25.95 C ATOM 595 C MET A 745 -5.191 -26.776 42.600 1.00 26.65 C ATOM 596 O MET A 745 -5.410 -26.117 41.580 1.00 26.75 O ATOM 597 CB MET A 745 -2.807 -26.842 43.349 1.00 27.17 C ATOM 598 CG MET A 745 -1.679 -26.101 44.074 1.00 25.25 C ATOM 599 SD MET A 745 -0.041 -26.697 43.614 1.00 26.07 S ATOM 600 CE MET A 745 0.934 -26.125 44.997 1.00 24.31 C ATOM 0 H MET A 745 -4.078 -27.151 45.419 1.00 26.30 H new ATOM 0 HA MET A 745 -4.187 -25.313 43.582 1.00 25.95 H new ATOM 0 HB2 MET A 745 -2.783 -27.778 43.602 1.00 27.17 H new ATOM 0 HB3 MET A 745 -2.647 -26.803 42.393 1.00 27.17 H new ATOM 0 HG2 MET A 745 -1.741 -25.153 43.876 1.00 25.25 H new ATOM 0 HG3 MET A 745 -1.797 -26.199 45.032 1.00 25.25 H new ATOM 0 HE1 MET A 745 1.736 -26.665 45.073 1.00 24.31 H new ATOM 0 HE2 MET A 745 1.181 -25.197 44.858 1.00 24.31 H new ATOM 0 HE3 MET A 745 0.415 -26.202 45.813 1.00 24.31 H new ATOM 601 N VAL A 746 -5.792 -27.934 42.855 1.00 25.64 N ATOM 602 CA VAL A 746 -6.758 -28.497 41.926 1.00 26.60 C ATOM 603 C VAL A 746 -8.026 -27.665 41.939 1.00 26.60 C ATOM 604 O VAL A 746 -8.637 -27.425 40.896 1.00 28.64 O ATOM 605 CB VAL A 746 -7.121 -29.943 42.294 1.00 27.55 C ATOM 606 CG1 VAL A 746 -8.235 -30.439 41.375 1.00 30.98 C ATOM 607 CG2 VAL A 746 -5.901 -30.839 42.155 1.00 27.95 C ATOM 0 H VAL A 746 -5.653 -28.407 43.560 1.00 25.64 H new ATOM 0 HA VAL A 746 -6.353 -28.491 41.045 1.00 26.60 H new ATOM 0 HB VAL A 746 -7.426 -29.970 43.214 1.00 27.55 H new ATOM 0 HG11 VAL A 746 -8.464 -31.352 41.608 1.00 30.98 H new ATOM 0 HG12 VAL A 746 -9.016 -29.874 41.479 1.00 30.98 H new ATOM 0 HG13 VAL A 746 -7.933 -30.406 40.454 1.00 30.98 H new ATOM 0 HG21 VAL A 746 -6.140 -31.750 42.389 1.00 27.95 H new ATOM 0 HG22 VAL A 746 -5.584 -30.814 41.239 1.00 27.95 H new ATOM 0 HG23 VAL A 746 -5.200 -30.526 42.748 1.00 27.95 H new ATOM 608 N PHE A 747 -8.418 -27.225 43.128 1.00 27.59 N ATOM 609 CA PHE A 747 -9.616 -26.413 43.286 1.00 28.49 C ATOM 610 C PHE A 747 -9.454 -25.074 42.565 1.00 28.51 C ATOM 611 O PHE A 747 -10.336 -24.651 41.818 1.00 28.03 O ATOM 612 CB PHE A 747 -9.888 -26.165 44.772 1.00 28.06 C ATOM 613 CG PHE A 747 -11.290 -25.709 45.065 1.00 27.59 C ATOM 614 CD1 PHE A 747 -12.383 -26.507 44.712 1.00 28.66 C ATOM 615 CD2 PHE A 747 -11.521 -24.509 45.725 1.00 26.62 C ATOM 616 CE1 PHE A 747 -13.683 -26.116 45.015 1.00 28.91 C ATOM 617 CE2 PHE A 747 -12.821 -24.101 46.037 1.00 26.39 C ATOM 618 CZ PHE A 747 -13.906 -24.908 45.682 1.00 29.60 C ATOM 0 H PHE A 747 -8.000 -27.388 43.862 1.00 27.59 H new ATOM 0 HA PHE A 747 -10.365 -26.891 42.897 1.00 28.49 H new ATOM 0 HB2 PHE A 747 -9.713 -26.982 45.265 1.00 28.06 H new ATOM 0 HB3 PHE A 747 -9.265 -25.497 45.099 1.00 28.06 H new ATOM 0 HD1 PHE A 747 -12.238 -27.311 44.268 1.00 28.66 H new ATOM 0 HD2 PHE A 747 -10.801 -23.970 45.962 1.00 26.62 H new ATOM 0 HE1 PHE A 747 -14.401 -26.656 44.775 1.00 28.91 H new ATOM 0 HE2 PHE A 747 -12.964 -23.295 46.479 1.00 26.39 H new ATOM 0 HZ PHE A 747 -14.773 -24.642 45.889 1.00 29.60 H new ATOM 619 N ALA A 748 -8.327 -24.405 42.796 1.00 26.76 N ATOM 620 CA ALA A 748 -8.081 -23.119 42.159 1.00 27.73 C ATOM 621 C ALA A 748 -7.998 -23.288 40.648 1.00 27.49 C ATOM 622 O ALA A 748 -8.418 -22.411 39.891 1.00 30.10 O ATOM 623 CB ALA A 748 -6.787 -22.484 42.706 1.00 23.40 C ATOM 0 H ALA A 748 -7.698 -24.678 43.315 1.00 26.76 H new ATOM 0 HA ALA A 748 -8.820 -22.525 42.363 1.00 27.73 H new ATOM 0 HB1 ALA A 748 -6.637 -21.629 42.272 1.00 23.40 H new ATOM 0 HB2 ALA A 748 -6.871 -22.350 43.663 1.00 23.40 H new ATOM 0 HB3 ALA A 748 -6.037 -23.072 42.527 1.00 23.40 H new ATOM 624 N MET A 749 -7.467 -24.421 40.208 1.00 27.88 N ATOM 625 CA MET A 749 -7.339 -24.684 38.779 1.00 28.65 C ATOM 626 C MET A 749 -8.708 -24.900 38.140 1.00 29.82 C ATOM 627 O MET A 749 -8.922 -24.525 36.990 1.00 29.97 O ATOM 628 CB MET A 749 -6.456 -25.912 38.545 1.00 26.28 C ATOM 629 CG MET A 749 -6.137 -26.188 37.083 1.00 28.20 C ATOM 630 SD MET A 749 -7.423 -27.057 36.134 1.00 29.00 S ATOM 631 CE MET A 749 -7.197 -28.739 36.698 1.00 31.47 C ATOM 0 H MET A 749 -7.175 -25.050 40.717 1.00 27.88 H new ATOM 0 HA MET A 749 -6.926 -23.910 38.365 1.00 28.65 H new ATOM 0 HB2 MET A 749 -5.624 -25.795 39.030 1.00 26.28 H new ATOM 0 HB3 MET A 749 -6.897 -26.690 38.921 1.00 26.28 H new ATOM 0 HG2 MET A 749 -5.954 -25.342 36.645 1.00 28.20 H new ATOM 0 HG3 MET A 749 -5.321 -26.711 37.042 1.00 28.20 H new ATOM 0 HE1 MET A 749 -7.184 -29.337 35.935 1.00 31.47 H new ATOM 0 HE2 MET A 749 -6.357 -28.809 37.178 1.00 31.47 H new ATOM 0 HE3 MET A 749 -7.927 -28.984 37.288 1.00 31.47 H new ATOM 632 N GLY A 750 -9.622 -25.522 38.886 1.00 30.01 N ATOM 633 CA GLY A 750 -10.960 -25.763 38.376 1.00 30.02 C ATOM 634 C GLY A 750 -11.708 -24.456 38.182 1.00 30.25 C ATOM 635 O GLY A 750 -12.444 -24.289 37.216 1.00 27.62 O ATOM 0 H GLY A 750 -9.483 -25.809 39.685 1.00 30.01 H new ATOM 0 HA2 GLY A 750 -10.908 -26.239 37.532 1.00 30.02 H new ATOM 0 HA3 GLY A 750 -11.448 -26.331 38.992 1.00 30.02 H new ATOM 636 N TRP A 751 -11.508 -23.528 39.113 1.00 30.74 N ATOM 637 CA TRP A 751 -12.139 -22.217 39.061 1.00 33.14 C ATOM 638 C TRP A 751 -11.583 -21.429 37.865 1.00 35.66 C ATOM 639 O TRP A 751 -12.344 -20.804 37.109 1.00 35.07 O ATOM 640 CB TRP A 751 -11.882 -21.481 40.386 1.00 33.10 C ATOM 641 CG TRP A 751 -12.379 -20.065 40.447 1.00 32.38 C ATOM 642 CD1 TRP A 751 -11.624 -18.935 40.388 1.00 31.81 C ATOM 643 CD2 TRP A 751 -13.741 -19.633 40.577 1.00 31.95 C ATOM 644 NE1 TRP A 751 -12.425 -17.821 40.473 1.00 31.23 N ATOM 645 CE2 TRP A 751 -13.731 -18.222 40.588 1.00 32.20 C ATOM 646 CE3 TRP A 751 -14.969 -20.302 40.684 1.00 33.56 C ATOM 647 CZ2 TRP A 751 -14.907 -17.459 40.700 1.00 33.08 C ATOM 648 CZ3 TRP A 751 -16.142 -19.542 40.797 1.00 33.11 C ATOM 649 CH2 TRP A 751 -16.097 -18.136 40.803 1.00 31.63 C ATOM 0 H TRP A 751 -10.999 -23.644 39.796 1.00 30.74 H new ATOM 0 HA TRP A 751 -13.097 -22.308 38.942 1.00 33.14 H new ATOM 0 HB2 TRP A 751 -12.298 -21.984 41.103 1.00 33.10 H new ATOM 0 HB3 TRP A 751 -10.927 -21.480 40.557 1.00 33.10 H new ATOM 0 HD1 TRP A 751 -10.698 -18.918 40.302 1.00 31.81 H new ATOM 0 HE1 TRP A 751 -12.152 -17.006 40.457 1.00 31.23 H new ATOM 0 HE3 TRP A 751 -15.005 -21.231 40.680 1.00 33.56 H new ATOM 0 HZ2 TRP A 751 -14.880 -16.529 40.704 1.00 33.08 H new ATOM 0 HZ3 TRP A 751 -16.962 -19.974 40.869 1.00 33.11 H new ATOM 0 HH2 TRP A 751 -16.890 -17.655 40.878 1.00 31.63 H new ATOM 650 N ARG A 752 -10.263 -21.473 37.688 1.00 36.71 N ATOM 651 CA ARG A 752 -9.616 -20.783 36.571 1.00 37.59 C ATOM 652 C ARG A 752 -10.183 -21.287 35.250 1.00 39.06 C ATOM 653 O ARG A 752 -10.469 -20.503 34.344 1.00 40.69 O ATOM 654 CB ARG A 752 -8.113 -21.043 36.561 1.00 36.35 C ATOM 655 CG ARG A 752 -7.319 -20.278 37.582 1.00 33.60 C ATOM 656 CD ARG A 752 -5.860 -20.246 37.161 1.00 30.60 C ATOM 657 NE ARG A 752 -5.234 -21.568 37.151 1.00 25.61 N ATOM 658 CZ ARG A 752 -4.857 -22.220 38.251 1.00 30.40 C ATOM 659 NH1 ARG A 752 -5.050 -21.678 39.450 1.00 24.09 N ATOM 660 NH2 ARG A 752 -4.248 -23.401 38.155 1.00 28.21 N ATOM 0 H ARG A 752 -9.723 -21.898 38.205 1.00 36.71 H new ATOM 0 HA ARG A 752 -9.783 -19.834 36.679 1.00 37.59 H new ATOM 0 HB2 ARG A 752 -7.963 -21.991 36.701 1.00 36.35 H new ATOM 0 HB3 ARG A 752 -7.769 -20.829 35.680 1.00 36.35 H new ATOM 0 HG2 ARG A 752 -7.663 -19.375 37.664 1.00 33.60 H new ATOM 0 HG3 ARG A 752 -7.406 -20.695 38.454 1.00 33.60 H new ATOM 0 HD2 ARG A 752 -5.794 -19.856 36.275 1.00 30.60 H new ATOM 0 HD3 ARG A 752 -5.368 -19.666 37.763 1.00 30.60 H new ATOM 0 HE ARG A 752 -5.101 -21.947 36.391 1.00 25.61 H new ATOM 0 HH11 ARG A 752 -5.419 -20.904 39.518 1.00 24.09 H new ATOM 0 HH12 ARG A 752 -4.806 -22.101 40.158 1.00 24.09 H new ATOM 0 HH21 ARG A 752 -4.097 -23.745 37.382 1.00 28.21 H new ATOM 0 HH22 ARG A 752 -4.006 -23.819 38.866 1.00 28.21 H new ATOM 661 N SER A 753 -10.320 -22.605 35.147 1.00 39.03 N ATOM 662 CA SER A 753 -10.853 -23.237 33.947 1.00 39.69 C ATOM 663 C SER A 753 -12.271 -22.747 33.692 1.00 40.36 C ATOM 664 O SER A 753 -12.634 -22.402 32.567 1.00 39.29 O ATOM 665 CB SER A 753 -10.857 -24.758 34.110 1.00 36.33 C ATOM 666 OG SER A 753 -9.536 -25.264 34.221 1.00 34.65 O ATOM 0 H SER A 753 -10.107 -23.157 35.771 1.00 39.03 H new ATOM 0 HA SER A 753 -10.291 -23.001 33.193 1.00 39.69 H new ATOM 0 HB2 SER A 753 -11.367 -25.000 34.899 1.00 36.33 H new ATOM 0 HB3 SER A 753 -11.300 -25.166 33.350 1.00 36.33 H new ATOM 0 HG SER A 753 -9.235 -25.096 34.987 1.00 34.65 H new ATOM 667 N PHE A 754 -13.066 -22.728 34.753 1.00 42.58 N ATOM 668 CA PHE A 754 -14.448 -22.285 34.680 1.00 43.74 C ATOM 669 C PHE A 754 -14.578 -20.842 34.208 1.00 43.79 C ATOM 670 O PHE A 754 -15.374 -20.546 33.320 1.00 45.39 O ATOM 671 CB PHE A 754 -15.115 -22.436 36.053 1.00 44.21 C ATOM 672 CG PHE A 754 -16.361 -21.610 36.217 1.00 45.38 C ATOM 673 CD1 PHE A 754 -17.459 -21.805 35.382 1.00 45.70 C ATOM 674 CD2 PHE A 754 -16.423 -20.614 37.187 1.00 45.28 C ATOM 675 CE1 PHE A 754 -18.598 -21.017 35.507 1.00 46.26 C ATOM 676 CE2 PHE A 754 -17.558 -19.819 37.322 1.00 47.15 C ATOM 677 CZ PHE A 754 -18.647 -20.020 36.481 1.00 46.53 C ATOM 0 H PHE A 754 -12.817 -22.973 35.539 1.00 42.58 H new ATOM 0 HA PHE A 754 -14.892 -22.846 34.025 1.00 43.74 H new ATOM 0 HB2 PHE A 754 -15.335 -23.370 36.195 1.00 44.21 H new ATOM 0 HB3 PHE A 754 -14.479 -22.187 36.741 1.00 44.21 H new ATOM 0 HD1 PHE A 754 -17.430 -22.470 34.733 1.00 45.70 H new ATOM 0 HD2 PHE A 754 -15.697 -20.478 37.752 1.00 45.28 H new ATOM 0 HE1 PHE A 754 -19.325 -21.154 34.943 1.00 46.26 H new ATOM 0 HE2 PHE A 754 -17.588 -19.155 37.973 1.00 47.15 H new ATOM 0 HZ PHE A 754 -19.407 -19.491 36.568 1.00 46.53 H new ATOM 678 N THR A 755 -13.783 -19.949 34.790 1.00 44.80 N ATOM 679 CA THR A 755 -13.857 -18.535 34.448 1.00 43.70 C ATOM 680 C THR A 755 -13.059 -18.078 33.225 1.00 45.72 C ATOM 681 O THR A 755 -13.327 -17.007 32.687 1.00 44.74 O ATOM 682 CB THR A 755 -13.428 -17.656 35.646 1.00 43.08 C ATOM 683 OG1 THR A 755 -11.998 -17.592 35.710 1.00 42.48 O ATOM 684 CG2 THR A 755 -13.960 -18.236 36.953 1.00 39.68 C ATOM 0 H THR A 755 -13.194 -20.143 35.386 1.00 44.80 H new ATOM 0 HA THR A 755 -14.792 -18.421 34.217 1.00 43.70 H new ATOM 0 HB THR A 755 -13.794 -16.766 35.521 1.00 43.08 H new ATOM 0 HG1 THR A 755 -11.762 -17.356 36.481 1.00 42.48 H new ATOM 0 HG21 THR A 755 -13.683 -17.674 37.693 1.00 39.68 H new ATOM 0 HG22 THR A 755 -14.929 -18.272 36.920 1.00 39.68 H new ATOM 0 HG23 THR A 755 -13.607 -19.131 37.077 1.00 39.68 H new ATOM 685 N ASN A 756 -12.085 -18.867 32.779 1.00 46.74 N ATOM 686 CA ASN A 756 -11.279 -18.457 31.629 1.00 47.07 C ATOM 687 C ASN A 756 -11.735 -19.057 30.312 1.00 47.75 C ATOM 688 O ASN A 756 -11.885 -18.342 29.327 1.00 49.80 O ATOM 689 CB ASN A 756 -9.804 -18.800 31.852 1.00 47.48 C ATOM 690 CG ASN A 756 -9.220 -18.087 33.048 1.00 49.00 C ATOM 691 OD1 ASN A 756 -9.349 -16.874 33.183 1.00 51.65 O ATOM 692 ND2 ASN A 756 -8.570 -18.836 33.923 1.00 51.14 N ATOM 0 H ASN A 756 -11.876 -19.629 33.119 1.00 46.74 H new ATOM 0 HA ASN A 756 -11.399 -17.497 31.561 1.00 47.07 H new ATOM 0 HB2 ASN A 756 -9.712 -19.758 31.974 1.00 47.48 H new ATOM 0 HB3 ASN A 756 -9.297 -18.565 31.059 1.00 47.48 H new ATOM 0 HD21 ASN A 756 -8.218 -18.475 34.620 1.00 51.14 H new ATOM 0 HD22 ASN A 756 -8.500 -19.684 33.795 1.00 51.14 H new ATOM 693 N VAL A 757 -11.943 -20.370 30.295 1.00 48.09 N ATOM 694 CA VAL A 757 -12.380 -21.061 29.088 1.00 47.80 C ATOM 695 C VAL A 757 -13.680 -21.809 29.334 1.00 47.45 C ATOM 696 O VAL A 757 -14.049 -22.701 28.573 1.00 47.78 O ATOM 697 CB VAL A 757 -11.304 -22.062 28.592 1.00 46.88 C ATOM 698 CG1 VAL A 757 -10.003 -21.327 28.337 1.00 47.01 C ATOM 699 CG2 VAL A 757 -11.096 -23.166 29.614 1.00 45.75 C ATOM 0 H VAL A 757 -11.836 -20.882 30.978 1.00 48.09 H new ATOM 0 HA VAL A 757 -12.521 -20.386 28.406 1.00 47.80 H new ATOM 0 HB VAL A 757 -11.607 -22.467 27.764 1.00 46.88 H new ATOM 0 HG11 VAL A 757 -9.332 -21.955 28.027 1.00 47.01 H new ATOM 0 HG12 VAL A 757 -10.143 -20.645 27.662 1.00 47.01 H new ATOM 0 HG13 VAL A 757 -9.700 -20.910 29.159 1.00 47.01 H new ATOM 0 HG21 VAL A 757 -10.421 -23.784 29.291 1.00 45.75 H new ATOM 0 HG22 VAL A 757 -10.803 -22.779 30.454 1.00 45.75 H new ATOM 0 HG23 VAL A 757 -11.930 -23.642 29.751 1.00 45.75 H new ATOM 700 N ASN A 758 -14.365 -21.439 30.411 1.00 47.64 N ATOM 701 CA ASN A 758 -15.635 -22.051 30.778 1.00 49.11 C ATOM 702 C ASN A 758 -15.600 -23.583 30.867 1.00 49.27 C ATOM 703 O ASN A 758 -16.484 -24.269 30.349 1.00 48.39 O ATOM 704 CB ASN A 758 -16.724 -21.601 29.797 1.00 51.40 C ATOM 705 CG ASN A 758 -18.090 -22.154 30.151 1.00 53.93 C ATOM 706 OD1 ASN A 758 -18.511 -22.100 31.309 1.00 53.52 O ATOM 707 ND2 ASN A 758 -18.793 -22.686 29.153 1.00 53.41 N ATOM 0 H ASN A 758 -14.104 -20.823 30.951 1.00 47.64 H new ATOM 0 HA ASN A 758 -15.834 -21.744 31.677 1.00 49.11 H new ATOM 0 HB2 ASN A 758 -16.764 -20.632 29.785 1.00 51.40 H new ATOM 0 HB3 ASN A 758 -16.486 -21.886 28.901 1.00 51.40 H new ATOM 0 HD21 ASN A 758 -19.575 -23.010 29.303 1.00 53.41 H new ATOM 0 HD22 ASN A 758 -18.465 -22.705 28.358 1.00 53.41 H new ATOM 708 N SER A 759 -14.575 -24.113 31.529 1.00 48.88 N ATOM 709 CA SER A 759 -14.436 -25.555 31.710 1.00 48.81 C ATOM 710 C SER A 759 -14.196 -26.352 30.427 1.00 49.76 C ATOM 711 O SER A 759 -14.110 -27.581 30.469 1.00 50.01 O ATOM 712 CB SER A 759 -15.674 -26.119 32.414 1.00 47.40 C ATOM 713 OG SER A 759 -15.880 -25.513 33.677 1.00 47.11 O ATOM 0 H SER A 759 -13.944 -23.649 31.884 1.00 48.88 H new ATOM 0 HA SER A 759 -13.636 -25.660 32.249 1.00 48.81 H new ATOM 0 HB2 SER A 759 -16.455 -25.979 31.856 1.00 47.40 H new ATOM 0 HB3 SER A 759 -15.574 -27.077 32.527 1.00 47.40 H new ATOM 0 HG SER A 759 -15.142 -25.423 34.069 1.00 47.11 H new ATOM 714 N ARG A 760 -14.093 -25.674 29.290 1.00 50.46 N ATOM 715 CA ARG A 760 -13.860 -26.380 28.035 1.00 52.04 C ATOM 716 C ARG A 760 -12.520 -27.111 28.061 1.00 50.27 C ATOM 717 O ARG A 760 -12.355 -28.150 27.426 1.00 51.68 O ATOM 718 CB ARG A 760 -13.895 -25.402 26.857 1.00 54.75 C ATOM 719 CG ARG A 760 -15.274 -24.843 26.551 1.00 60.79 C ATOM 720 CD ARG A 760 -16.279 -25.959 26.282 1.00 65.85 C ATOM 721 NE ARG A 760 -15.852 -26.845 25.200 1.00 69.71 N ATOM 722 CZ ARG A 760 -16.500 -27.949 24.836 1.00 72.40 C ATOM 723 NH1 ARG A 760 -17.612 -28.309 25.468 1.00 73.75 N ATOM 724 NH2 ARG A 760 -16.037 -28.696 23.840 1.00 72.19 N ATOM 0 H ARG A 760 -14.154 -24.819 29.222 1.00 50.46 H new ATOM 0 HA ARG A 760 -14.567 -27.035 27.925 1.00 52.04 H new ATOM 0 HB2 ARG A 760 -13.293 -24.665 27.044 1.00 54.75 H new ATOM 0 HB3 ARG A 760 -13.557 -25.851 26.067 1.00 54.75 H new ATOM 0 HG2 ARG A 760 -15.579 -24.303 27.297 1.00 60.79 H new ATOM 0 HG3 ARG A 760 -15.224 -24.258 25.779 1.00 60.79 H new ATOM 0 HD2 ARG A 760 -16.406 -26.479 27.091 1.00 65.85 H new ATOM 0 HD3 ARG A 760 -17.139 -25.570 26.058 1.00 65.85 H new ATOM 0 HE ARG A 760 -15.136 -26.639 24.771 1.00 69.71 H new ATOM 0 HH11 ARG A 760 -17.914 -27.828 26.114 1.00 73.75 H new ATOM 0 HH12 ARG A 760 -18.029 -29.023 25.231 1.00 73.75 H new ATOM 0 HH21 ARG A 760 -15.317 -28.467 23.429 1.00 72.19 H new ATOM 0 HH22 ARG A 760 -16.457 -29.409 23.606 1.00 72.19 H new ATOM 725 N MET A 761 -11.568 -26.557 28.802 1.00 48.09 N ATOM 726 CA MET A 761 -10.240 -27.141 28.928 1.00 45.00 C ATOM 727 C MET A 761 -9.697 -26.854 30.320 1.00 42.15 C ATOM 728 O MET A 761 -10.182 -25.961 31.009 1.00 41.55 O ATOM 729 CB MET A 761 -9.301 -26.535 27.892 1.00 46.62 C ATOM 730 CG MET A 761 -9.718 -26.770 26.460 1.00 50.20 C ATOM 731 SD MET A 761 -8.828 -25.666 25.365 1.00 53.19 S ATOM 732 CE MET A 761 -7.293 -26.529 25.194 1.00 52.55 C ATOM 0 H MET A 761 -11.675 -25.829 29.247 1.00 48.09 H new ATOM 0 HA MET A 761 -10.299 -28.098 28.784 1.00 45.00 H new ATOM 0 HB2 MET A 761 -9.239 -25.579 28.047 1.00 46.62 H new ATOM 0 HB3 MET A 761 -8.412 -26.901 28.023 1.00 46.62 H new ATOM 0 HG2 MET A 761 -9.543 -27.691 26.213 1.00 50.20 H new ATOM 0 HG3 MET A 761 -10.673 -26.628 26.367 1.00 50.20 H new ATOM 0 HE1 MET A 761 -6.557 -25.912 25.331 1.00 52.55 H new ATOM 0 HE2 MET A 761 -7.246 -27.239 25.853 1.00 52.55 H new ATOM 0 HE3 MET A 761 -7.233 -26.910 24.304 1.00 52.55 H new ATOM 733 N LEU A 762 -8.683 -27.611 30.727 1.00 39.42 N ATOM 734 CA LEU A 762 -8.069 -27.424 32.037 1.00 36.68 C ATOM 735 C LEU A 762 -6.992 -26.350 31.935 1.00 36.30 C ATOM 736 O LEU A 762 -5.942 -26.563 31.330 1.00 36.45 O ATOM 737 CB LEU A 762 -7.465 -28.736 32.529 1.00 33.76 C ATOM 738 CG LEU A 762 -8.447 -29.903 32.650 1.00 32.27 C ATOM 739 CD1 LEU A 762 -7.706 -31.132 33.148 1.00 32.89 C ATOM 740 CD2 LEU A 762 -9.570 -29.544 33.606 1.00 29.97 C ATOM 0 H LEU A 762 -8.334 -28.241 30.257 1.00 39.42 H new ATOM 0 HA LEU A 762 -8.745 -27.143 32.674 1.00 36.68 H new ATOM 0 HB2 LEU A 762 -6.752 -28.994 31.924 1.00 33.76 H new ATOM 0 HB3 LEU A 762 -7.059 -28.583 33.397 1.00 33.76 H new ATOM 0 HG LEU A 762 -8.833 -30.091 31.780 1.00 32.27 H new ATOM 0 HD11 LEU A 762 -8.326 -31.874 33.226 1.00 32.89 H new ATOM 0 HD12 LEU A 762 -7.003 -31.363 32.521 1.00 32.89 H new ATOM 0 HD13 LEU A 762 -7.315 -30.945 34.016 1.00 32.89 H new ATOM 0 HD21 LEU A 762 -10.187 -30.290 33.676 1.00 29.97 H new ATOM 0 HD22 LEU A 762 -9.200 -29.348 34.481 1.00 29.97 H new ATOM 0 HD23 LEU A 762 -10.042 -28.765 33.273 1.00 29.97 H new ATOM 741 N TYR A 763 -7.278 -25.194 32.530 1.00 35.52 N ATOM 742 CA TYR A 763 -6.385 -24.036 32.522 1.00 33.62 C ATOM 743 C TYR A 763 -5.397 -24.065 33.694 1.00 31.91 C ATOM 744 O TYR A 763 -5.549 -23.322 34.661 1.00 28.01 O ATOM 745 CB TYR A 763 -7.242 -22.762 32.574 1.00 36.35 C ATOM 746 CG TYR A 763 -6.548 -21.463 32.214 1.00 38.34 C ATOM 747 CD1 TYR A 763 -5.646 -20.855 33.092 1.00 39.63 C ATOM 748 CD2 TYR A 763 -6.836 -20.811 31.011 1.00 39.94 C ATOM 749 CE1 TYR A 763 -5.057 -19.622 32.787 1.00 40.58 C ATOM 750 CE2 TYR A 763 -6.248 -19.579 30.693 1.00 40.43 C ATOM 751 CZ TYR A 763 -5.366 -18.990 31.586 1.00 41.47 C ATOM 752 OH TYR A 763 -4.813 -17.760 31.289 1.00 43.46 O ATOM 0 H TYR A 763 -8.011 -25.058 32.958 1.00 35.52 H new ATOM 0 HA TYR A 763 -5.855 -24.055 31.710 1.00 33.62 H new ATOM 0 HB2 TYR A 763 -7.996 -22.879 31.975 1.00 36.35 H new ATOM 0 HB3 TYR A 763 -7.602 -22.675 33.470 1.00 36.35 H new ATOM 0 HD1 TYR A 763 -5.433 -21.277 33.893 1.00 39.63 H new ATOM 0 HD2 TYR A 763 -7.429 -21.202 30.411 1.00 39.94 H new ATOM 0 HE1 TYR A 763 -4.463 -19.227 33.384 1.00 40.58 H new ATOM 0 HE2 TYR A 763 -6.448 -19.159 29.888 1.00 40.43 H new ATOM 0 HH TYR A 763 -5.087 -17.504 30.537 1.00 43.46 H new ATOM 753 N PHE A 764 -4.389 -24.928 33.604 1.00 31.04 N ATOM 754 CA PHE A 764 -3.382 -25.041 34.662 1.00 30.65 C ATOM 755 C PHE A 764 -2.629 -23.709 34.820 1.00 31.06 C ATOM 756 O PHE A 764 -2.441 -23.216 35.931 1.00 31.21 O ATOM 757 CB PHE A 764 -2.410 -26.177 34.325 1.00 28.63 C ATOM 758 CG PHE A 764 -3.020 -27.553 34.442 1.00 28.43 C ATOM 759 CD1 PHE A 764 -3.209 -28.145 35.692 1.00 22.17 C ATOM 760 CD2 PHE A 764 -3.419 -28.250 33.303 1.00 26.29 C ATOM 761 CE1 PHE A 764 -3.790 -29.418 35.799 1.00 25.81 C ATOM 762 CE2 PHE A 764 -3.995 -29.511 33.400 1.00 25.71 C ATOM 763 CZ PHE A 764 -4.183 -30.101 34.649 1.00 23.29 C ATOM 0 H PHE A 764 -4.268 -25.459 32.938 1.00 31.04 H new ATOM 0 HA PHE A 764 -3.820 -25.243 35.504 1.00 30.65 H new ATOM 0 HB2 PHE A 764 -2.082 -26.053 33.421 1.00 28.63 H new ATOM 0 HB3 PHE A 764 -1.642 -26.121 34.915 1.00 28.63 H new ATOM 0 HD1 PHE A 764 -2.948 -27.692 36.461 1.00 22.17 H new ATOM 0 HD2 PHE A 764 -3.298 -27.865 32.465 1.00 26.29 H new ATOM 0 HE1 PHE A 764 -3.913 -29.805 36.636 1.00 25.81 H new ATOM 0 HE2 PHE A 764 -4.256 -29.962 32.630 1.00 25.71 H new ATOM 0 HZ PHE A 764 -4.568 -30.945 34.715 1.00 23.29 H new ATOM 764 N ALA A 765 -2.214 -23.141 33.693 1.00 29.98 N ATOM 765 CA ALA A 765 -1.510 -21.860 33.646 1.00 31.56 C ATOM 766 C ALA A 765 -1.795 -21.264 32.272 1.00 32.03 C ATOM 767 O ALA A 765 -2.233 -21.971 31.360 1.00 31.62 O ATOM 768 CB ALA A 765 -0.001 -22.055 33.832 1.00 30.24 C ATOM 0 H ALA A 765 -2.335 -23.495 32.918 1.00 29.98 H new ATOM 0 HA ALA A 765 -1.812 -21.276 34.359 1.00 31.56 H new ATOM 0 HB1 ALA A 765 0.444 -21.194 33.797 1.00 30.24 H new ATOM 0 HB2 ALA A 765 0.168 -22.471 34.692 1.00 30.24 H new ATOM 0 HB3 ALA A 765 0.342 -22.624 33.125 1.00 30.24 H new ATOM 769 N PRO A 766 -1.542 -19.959 32.097 1.00 32.38 N ATOM 770 CA PRO A 766 -1.801 -19.327 30.802 1.00 33.18 C ATOM 771 C PRO A 766 -1.039 -20.018 29.682 1.00 33.20 C ATOM 772 O PRO A 766 -1.473 -20.011 28.534 1.00 33.21 O ATOM 773 CB PRO A 766 -1.318 -17.889 31.012 1.00 32.42 C ATOM 774 CG PRO A 766 -1.407 -17.703 32.501 1.00 32.67 C ATOM 775 CD PRO A 766 -0.893 -19.009 33.015 1.00 31.30 C ATOM 0 HA PRO A 766 -2.732 -19.377 30.535 1.00 33.18 H new ATOM 0 HB2 PRO A 766 -0.411 -17.766 30.690 1.00 32.42 H new ATOM 0 HB3 PRO A 766 -1.876 -17.252 30.538 1.00 32.42 H new ATOM 0 HG2 PRO A 766 -0.868 -16.956 32.806 1.00 32.67 H new ATOM 0 HG3 PRO A 766 -2.317 -17.533 32.791 1.00 32.67 H new ATOM 0 HD2 PRO A 766 0.075 -19.063 32.973 1.00 31.30 H new ATOM 0 HD3 PRO A 766 -1.146 -19.163 33.939 1.00 31.30 H new ATOM 776 N ASP A 767 0.093 -20.620 30.035 1.00 33.40 N ATOM 777 CA ASP A 767 0.954 -21.296 29.075 1.00 35.05 C ATOM 778 C ASP A 767 0.921 -22.812 29.204 1.00 34.37 C ATOM 779 O ASP A 767 1.809 -23.509 28.707 1.00 35.02 O ATOM 780 CB ASP A 767 2.391 -20.796 29.247 1.00 35.95 C ATOM 781 CG ASP A 767 2.900 -20.985 30.657 1.00 37.60 C ATOM 782 OD1 ASP A 767 2.111 -20.755 31.602 1.00 36.19 O ATOM 783 OD2 ASP A 767 4.084 -21.352 30.824 1.00 36.96 O ATOM 0 H ASP A 767 0.383 -20.647 30.844 1.00 33.40 H new ATOM 0 HA ASP A 767 0.618 -21.084 28.190 1.00 35.05 H new ATOM 0 HB2 ASP A 767 2.971 -21.268 28.630 1.00 35.95 H new ATOM 0 HB3 ASP A 767 2.434 -19.856 29.013 1.00 35.95 H new ATOM 784 N LEU A 768 -0.101 -23.322 29.875 1.00 33.65 N ATOM 785 CA LEU A 768 -0.245 -24.759 30.047 1.00 32.54 C ATOM 786 C LEU A 768 -1.729 -25.066 30.172 1.00 32.91 C ATOM 787 O LEU A 768 -2.236 -25.344 31.262 1.00 31.17 O ATOM 788 CB LEU A 768 0.508 -25.233 31.296 1.00 33.17 C ATOM 789 CG LEU A 768 0.711 -26.749 31.406 1.00 31.20 C ATOM 790 CD1 LEU A 768 1.509 -27.239 30.195 1.00 32.56 C ATOM 791 CD2 LEU A 768 1.443 -27.090 32.701 1.00 30.98 C ATOM 0 H LEU A 768 -0.723 -22.853 30.239 1.00 33.65 H new ATOM 0 HA LEU A 768 0.133 -25.226 29.285 1.00 32.54 H new ATOM 0 HB2 LEU A 768 1.378 -24.803 31.313 1.00 33.17 H new ATOM 0 HB3 LEU A 768 0.026 -24.929 32.081 1.00 33.17 H new ATOM 0 HG LEU A 768 -0.152 -27.191 31.420 1.00 31.20 H new ATOM 0 HD11 LEU A 768 1.640 -28.198 30.260 1.00 32.56 H new ATOM 0 HD12 LEU A 768 1.022 -27.034 29.382 1.00 32.56 H new ATOM 0 HD13 LEU A 768 2.372 -26.796 30.175 1.00 32.56 H new ATOM 0 HD21 LEU A 768 1.566 -28.050 32.760 1.00 30.98 H new ATOM 0 HD22 LEU A 768 2.309 -26.653 32.708 1.00 30.98 H new ATOM 0 HD23 LEU A 768 0.920 -26.784 33.459 1.00 30.98 H new ATOM 792 N VAL A 769 -2.414 -24.989 29.035 1.00 34.02 N ATOM 793 CA VAL A 769 -3.847 -25.238 28.947 1.00 34.96 C ATOM 794 C VAL A 769 -4.051 -26.587 28.272 1.00 33.33 C ATOM 795 O VAL A 769 -3.683 -26.774 27.121 1.00 34.50 O ATOM 796 CB VAL A 769 -4.547 -24.138 28.104 1.00 36.80 C ATOM 797 CG1 VAL A 769 -6.050 -24.393 28.049 1.00 38.31 C ATOM 798 CG2 VAL A 769 -4.248 -22.760 28.690 1.00 34.81 C ATOM 0 H VAL A 769 -2.052 -24.787 28.281 1.00 34.02 H new ATOM 0 HA VAL A 769 -4.230 -25.231 29.838 1.00 34.96 H new ATOM 0 HB VAL A 769 -4.202 -24.165 27.198 1.00 36.80 H new ATOM 0 HG11 VAL A 769 -6.477 -23.701 27.520 1.00 38.31 H new ATOM 0 HG12 VAL A 769 -6.217 -25.258 27.643 1.00 38.31 H new ATOM 0 HG13 VAL A 769 -6.413 -24.383 28.948 1.00 38.31 H new ATOM 0 HG21 VAL A 769 -4.689 -22.079 28.158 1.00 34.81 H new ATOM 0 HG22 VAL A 769 -4.575 -22.718 29.602 1.00 34.81 H new ATOM 0 HG23 VAL A 769 -3.290 -22.606 28.683 1.00 34.81 H new ATOM 799 N PHE A 770 -4.647 -27.524 28.990 1.00 34.91 N ATOM 800 CA PHE A 770 -4.875 -28.857 28.453 1.00 35.57 C ATOM 801 C PHE A 770 -6.144 -29.060 27.631 1.00 36.76 C ATOM 802 O PHE A 770 -7.244 -28.735 28.072 1.00 36.60 O ATOM 803 CB PHE A 770 -4.886 -29.880 29.595 1.00 35.20 C ATOM 804 CG PHE A 770 -3.529 -30.406 29.971 1.00 32.84 C ATOM 805 CD1 PHE A 770 -2.405 -29.586 29.934 1.00 33.68 C ATOM 806 CD2 PHE A 770 -3.383 -31.718 30.411 1.00 32.53 C ATOM 807 CE1 PHE A 770 -1.156 -30.066 30.334 1.00 30.92 C ATOM 808 CE2 PHE A 770 -2.139 -32.206 30.814 1.00 28.08 C ATOM 809 CZ PHE A 770 -1.029 -31.380 30.775 1.00 29.91 C ATOM 0 H PHE A 770 -4.929 -27.409 29.794 1.00 34.91 H new ATOM 0 HA PHE A 770 -4.139 -28.982 27.833 1.00 35.57 H new ATOM 0 HB2 PHE A 770 -5.290 -29.472 30.376 1.00 35.20 H new ATOM 0 HB3 PHE A 770 -5.451 -30.626 29.341 1.00 35.20 H new ATOM 0 HD1 PHE A 770 -2.487 -28.708 29.639 1.00 33.68 H new ATOM 0 HD2 PHE A 770 -4.125 -32.278 30.437 1.00 32.53 H new ATOM 0 HE1 PHE A 770 -0.411 -29.509 30.306 1.00 30.92 H new ATOM 0 HE2 PHE A 770 -2.056 -33.084 31.108 1.00 28.08 H new ATOM 0 HZ PHE A 770 -0.199 -31.703 31.043 1.00 29.91 H new ATOM 810 N ASN A 771 -5.975 -29.601 26.430 1.00 36.67 N ATOM 811 CA ASN A 771 -7.109 -29.946 25.586 1.00 36.27 C ATOM 812 C ASN A 771 -7.148 -31.469 25.690 1.00 37.14 C ATOM 813 O ASN A 771 -6.307 -32.056 26.383 1.00 37.19 O ATOM 814 CB ASN A 771 -6.904 -29.505 24.124 1.00 36.00 C ATOM 815 CG ASN A 771 -5.507 -29.796 23.599 1.00 35.03 C ATOM 816 OD1 ASN A 771 -4.843 -30.748 24.020 1.00 35.60 O ATOM 817 ND2 ASN A 771 -5.064 -28.980 22.649 1.00 34.59 N ATOM 0 H ASN A 771 -5.207 -29.777 26.085 1.00 36.67 H new ATOM 0 HA ASN A 771 -7.929 -29.508 25.864 1.00 36.27 H new ATOM 0 HB2 ASN A 771 -7.554 -29.956 23.563 1.00 36.00 H new ATOM 0 HB3 ASN A 771 -7.078 -28.553 24.052 1.00 36.00 H new ATOM 0 HD21 ASN A 771 -4.287 -29.105 22.303 1.00 34.59 H new ATOM 0 HD22 ASN A 771 -5.554 -28.327 22.380 1.00 34.59 H new ATOM 818 N GLU A 772 -8.103 -32.110 25.021 1.00 37.09 N ATOM 819 CA GLU A 772 -8.222 -33.570 25.081 1.00 37.96 C ATOM 820 C GLU A 772 -6.920 -34.286 24.730 1.00 37.07 C ATOM 821 O GLU A 772 -6.552 -35.285 25.356 1.00 36.45 O ATOM 822 CB GLU A 772 -9.318 -34.056 24.128 1.00 39.52 C ATOM 823 CG GLU A 772 -10.716 -33.639 24.510 1.00 42.25 C ATOM 824 CD GLU A 772 -11.338 -34.553 25.538 1.00 42.85 C ATOM 825 OE1 GLU A 772 -11.559 -35.744 25.225 1.00 43.41 O ATOM 826 OE2 GLU A 772 -11.606 -34.080 26.660 1.00 46.68 O ATOM 0 H GLU A 772 -8.691 -31.722 24.528 1.00 37.09 H new ATOM 0 HA GLU A 772 -8.447 -33.786 26.000 1.00 37.96 H new ATOM 0 HB2 GLU A 772 -9.126 -33.723 23.237 1.00 39.52 H new ATOM 0 HB3 GLU A 772 -9.284 -35.024 24.082 1.00 39.52 H new ATOM 0 HG2 GLU A 772 -10.695 -32.734 24.858 1.00 42.25 H new ATOM 0 HG3 GLU A 772 -11.273 -33.625 23.716 1.00 42.25 H new ATOM 827 N TYR A 773 -6.230 -33.783 23.716 1.00 36.24 N ATOM 828 CA TYR A 773 -4.991 -34.411 23.290 1.00 36.63 C ATOM 829 C TYR A 773 -3.946 -34.423 24.413 1.00 36.66 C ATOM 830 O TYR A 773 -3.294 -35.447 24.653 1.00 36.59 O ATOM 831 CB TYR A 773 -4.428 -33.698 22.055 1.00 36.20 C ATOM 832 CG TYR A 773 -3.261 -34.434 21.450 1.00 39.79 C ATOM 833 CD1 TYR A 773 -3.439 -35.687 20.869 1.00 38.59 C ATOM 834 CD2 TYR A 773 -1.968 -33.904 21.500 1.00 40.48 C ATOM 835 CE1 TYR A 773 -2.366 -36.400 20.354 1.00 41.92 C ATOM 836 CE2 TYR A 773 -0.879 -34.613 20.989 1.00 41.14 C ATOM 837 CZ TYR A 773 -1.087 -35.862 20.421 1.00 42.06 C ATOM 838 OH TYR A 773 -0.022 -36.598 19.946 1.00 44.41 O ATOM 0 H TYR A 773 -6.459 -33.087 23.266 1.00 36.24 H new ATOM 0 HA TYR A 773 -5.194 -35.332 23.063 1.00 36.63 H new ATOM 0 HB2 TYR A 773 -5.129 -33.605 21.391 1.00 36.20 H new ATOM 0 HB3 TYR A 773 -4.150 -32.802 22.301 1.00 36.20 H new ATOM 0 HD1 TYR A 773 -4.293 -36.053 20.825 1.00 38.59 H new ATOM 0 HD2 TYR A 773 -1.831 -33.066 21.880 1.00 40.48 H new ATOM 0 HE1 TYR A 773 -2.502 -37.234 19.966 1.00 41.92 H new ATOM 0 HE2 TYR A 773 -0.023 -34.252 21.029 1.00 41.14 H new ATOM 0 HH TYR A 773 0.688 -36.160 20.045 1.00 44.41 H new ATOM 839 N ARG A 774 -3.785 -33.291 25.097 1.00 35.06 N ATOM 840 CA ARG A 774 -2.812 -33.216 26.186 1.00 35.19 C ATOM 841 C ARG A 774 -3.269 -34.023 27.386 1.00 35.26 C ATOM 842 O ARG A 774 -2.446 -34.585 28.117 1.00 35.79 O ATOM 843 CB ARG A 774 -2.560 -31.763 26.590 1.00 31.98 C ATOM 844 CG ARG A 774 -1.673 -31.026 25.608 1.00 33.64 C ATOM 845 CD ARG A 774 -1.506 -29.560 25.980 1.00 33.79 C ATOM 846 NE ARG A 774 -0.452 -28.929 25.191 1.00 32.27 N ATOM 847 CZ ARG A 774 -0.059 -27.670 25.349 1.00 37.19 C ATOM 848 NH1 ARG A 774 -0.640 -26.905 26.269 1.00 36.41 N ATOM 849 NH2 ARG A 774 0.920 -27.175 24.598 1.00 37.85 N ATOM 0 H ARG A 774 -4.222 -32.565 24.950 1.00 35.06 H new ATOM 0 HA ARG A 774 -1.980 -33.597 25.864 1.00 35.19 H new ATOM 0 HB2 ARG A 774 -3.409 -31.300 26.663 1.00 31.98 H new ATOM 0 HB3 ARG A 774 -2.150 -31.743 27.469 1.00 31.98 H new ATOM 0 HG2 ARG A 774 -0.802 -31.452 25.577 1.00 33.64 H new ATOM 0 HG3 ARG A 774 -2.053 -31.092 24.718 1.00 33.64 H new ATOM 0 HD2 ARG A 774 -2.343 -29.091 25.839 1.00 33.79 H new ATOM 0 HD3 ARG A 774 -1.295 -29.486 26.924 1.00 33.79 H new ATOM 0 HE ARG A 774 -0.062 -29.401 24.587 1.00 32.27 H new ATOM 0 HH11 ARG A 774 -1.269 -27.226 26.760 1.00 36.41 H new ATOM 0 HH12 ARG A 774 -0.387 -26.090 26.373 1.00 36.41 H new ATOM 0 HH21 ARG A 774 1.301 -27.670 24.007 1.00 37.85 H new ATOM 0 HH22 ARG A 774 1.172 -26.359 24.703 1.00 37.85 H new ATOM 850 N MET A 775 -4.581 -34.082 27.591 1.00 34.03 N ATOM 851 CA MET A 775 -5.124 -34.857 28.695 1.00 33.96 C ATOM 852 C MET A 775 -4.729 -36.310 28.499 1.00 34.16 C ATOM 853 O MET A 775 -4.485 -37.029 29.458 1.00 35.10 O ATOM 854 CB MET A 775 -6.649 -34.758 28.730 1.00 33.39 C ATOM 855 CG MET A 775 -7.179 -33.445 29.240 1.00 32.42 C ATOM 856 SD MET A 775 -8.982 -33.417 29.250 1.00 37.88 S ATOM 857 CE MET A 775 -9.302 -31.648 29.007 1.00 33.72 C ATOM 0 H MET A 775 -5.168 -33.683 27.105 1.00 34.03 H new ATOM 0 HA MET A 775 -4.773 -34.510 29.530 1.00 33.96 H new ATOM 0 HB2 MET A 775 -6.992 -34.906 27.835 1.00 33.39 H new ATOM 0 HB3 MET A 775 -6.995 -35.472 29.288 1.00 33.39 H new ATOM 0 HG2 MET A 775 -6.847 -33.288 30.138 1.00 32.42 H new ATOM 0 HG3 MET A 775 -6.846 -32.723 28.684 1.00 32.42 H new ATOM 0 HE1 MET A 775 -10.227 -31.453 29.226 1.00 33.72 H new ATOM 0 HE2 MET A 775 -8.718 -31.131 29.583 1.00 33.72 H new ATOM 0 HE3 MET A 775 -9.133 -31.413 28.081 1.00 33.72 H new ATOM 858 N HIS A 776 -4.669 -36.736 27.241 1.00 35.65 N ATOM 859 CA HIS A 776 -4.322 -38.113 26.922 1.00 36.80 C ATOM 860 C HIS A 776 -2.811 -38.343 26.876 1.00 35.84 C ATOM 861 O HIS A 776 -2.322 -39.389 27.308 1.00 37.33 O ATOM 862 CB HIS A 776 -4.978 -38.514 25.591 1.00 37.47 C ATOM 863 CG HIS A 776 -4.727 -39.937 25.195 1.00 40.34 C ATOM 864 ND1 HIS A 776 -3.609 -40.330 24.487 1.00 42.88 N ATOM 865 CD2 HIS A 776 -5.434 -41.067 25.436 1.00 42.01 C ATOM 866 CE1 HIS A 776 -3.641 -41.639 24.308 1.00 41.51 C ATOM 867 NE2 HIS A 776 -4.737 -42.110 24.874 1.00 40.99 N ATOM 0 H HIS A 776 -4.827 -36.240 26.556 1.00 35.65 H new ATOM 0 HA HIS A 776 -4.662 -38.676 27.635 1.00 36.80 H new ATOM 0 HB2 HIS A 776 -5.935 -38.370 25.656 1.00 37.47 H new ATOM 0 HB3 HIS A 776 -4.650 -37.930 24.890 1.00 37.47 H new ATOM 0 HD2 HIS A 776 -6.240 -41.126 25.896 1.00 42.01 H new ATOM 0 HE1 HIS A 776 -3.001 -42.143 23.860 1.00 41.51 H new ATOM 0 HE2 HIS A 776 -4.976 -42.936 24.889 1.00 40.99 H new ATOM 868 N LYS A 777 -2.067 -37.371 26.361 1.00 35.53 N ATOM 869 CA LYS A 777 -0.615 -37.509 26.290 1.00 36.99 C ATOM 870 C LYS A 777 0.016 -37.528 27.685 1.00 36.45 C ATOM 871 O LYS A 777 1.084 -38.117 27.887 1.00 32.46 O ATOM 872 CB LYS A 777 -0.015 -36.367 25.469 1.00 39.18 C ATOM 873 CG LYS A 777 -0.407 -36.410 24.005 1.00 43.16 C ATOM 874 CD LYS A 777 0.174 -37.638 23.314 1.00 45.24 C ATOM 875 CE LYS A 777 1.693 -37.558 23.247 1.00 46.77 C ATOM 876 NZ LYS A 777 2.276 -38.710 22.511 1.00 49.06 N ATOM 0 H LYS A 777 -2.377 -36.632 26.050 1.00 35.53 H new ATOM 0 HA LYS A 777 -0.421 -38.356 25.858 1.00 36.99 H new ATOM 0 HB2 LYS A 777 -0.299 -35.521 25.848 1.00 39.18 H new ATOM 0 HB3 LYS A 777 0.952 -36.400 25.539 1.00 39.18 H new ATOM 0 HG2 LYS A 777 -1.374 -36.419 23.927 1.00 43.16 H new ATOM 0 HG3 LYS A 777 -0.094 -35.607 23.560 1.00 43.16 H new ATOM 0 HD2 LYS A 777 -0.090 -38.439 23.794 1.00 45.24 H new ATOM 0 HD3 LYS A 777 -0.189 -37.711 22.418 1.00 45.24 H new ATOM 0 HE2 LYS A 777 1.954 -36.731 22.812 1.00 46.77 H new ATOM 0 HE3 LYS A 777 2.055 -37.532 24.146 1.00 46.77 H new ATOM 0 HZ1 LYS A 777 2.824 -39.159 23.049 1.00 49.06 H new ATOM 0 HZ2 LYS A 777 1.623 -39.249 22.237 1.00 49.06 H new ATOM 0 HZ3 LYS A 777 2.730 -38.413 21.806 1.00 49.06 H new ATOM 877 N SER A 778 -0.657 -36.888 28.640 1.00 34.18 N ATOM 878 CA SER A 778 -0.179 -36.809 30.017 1.00 33.85 C ATOM 879 C SER A 778 -0.325 -38.121 30.767 1.00 34.15 C ATOM 880 O SER A 778 0.210 -38.271 31.860 1.00 34.02 O ATOM 881 CB SER A 778 -0.955 -35.739 30.781 1.00 33.02 C ATOM 882 OG SER A 778 -2.290 -36.164 31.013 1.00 32.75 O ATOM 0 H SER A 778 -1.406 -36.487 28.506 1.00 34.18 H new ATOM 0 HA SER A 778 0.764 -36.589 29.965 1.00 33.85 H new ATOM 0 HB2 SER A 778 -0.517 -35.555 31.627 1.00 33.02 H new ATOM 0 HB3 SER A 778 -0.956 -34.911 30.277 1.00 33.02 H new ATOM 0 HG SER A 778 -2.653 -36.361 30.281 1.00 32.75 H new ATOM 883 N ARG A 779 -1.068 -39.056 30.184 1.00 35.63 N ATOM 884 CA ARG A 779 -1.320 -40.360 30.793 1.00 37.71 C ATOM 885 C ARG A 779 -2.184 -40.279 32.056 1.00 38.88 C ATOM 886 O ARG A 779 -2.174 -41.192 32.886 1.00 40.08 O ATOM 887 CB ARG A 779 0.006 -41.083 31.089 1.00 39.80 C ATOM 888 CG ARG A 779 0.847 -41.338 29.834 1.00 39.81 C ATOM 889 CD ARG A 779 2.140 -42.097 30.127 1.00 42.67 C ATOM 890 NE ARG A 779 3.073 -42.009 29.001 1.00 44.45 N ATOM 891 CZ ARG A 779 4.312 -42.496 29.004 1.00 46.17 C ATOM 892 NH1 ARG A 779 4.782 -43.120 30.076 1.00 46.46 N ATOM 893 NH2 ARG A 779 5.091 -42.337 27.941 1.00 45.46 N ATOM 0 H ARG A 779 -1.444 -38.952 29.417 1.00 35.63 H new ATOM 0 HA ARG A 779 -1.828 -40.874 30.145 1.00 37.71 H new ATOM 0 HB2 ARG A 779 0.523 -40.554 31.716 1.00 39.80 H new ATOM 0 HB3 ARG A 779 -0.184 -41.930 31.522 1.00 39.80 H new ATOM 0 HG2 ARG A 779 0.320 -41.842 29.194 1.00 39.81 H new ATOM 0 HG3 ARG A 779 1.063 -40.489 29.418 1.00 39.81 H new ATOM 0 HD2 ARG A 779 2.557 -41.735 30.925 1.00 42.67 H new ATOM 0 HD3 ARG A 779 1.937 -43.028 30.310 1.00 42.67 H new ATOM 0 HE ARG A 779 2.801 -41.614 28.287 1.00 44.45 H new ATOM 0 HH11 ARG A 779 4.286 -43.211 30.773 1.00 46.46 H new ATOM 0 HH12 ARG A 779 5.583 -43.433 30.075 1.00 46.46 H new ATOM 0 HH21 ARG A 779 4.795 -41.919 27.250 1.00 45.46 H new ATOM 0 HH22 ARG A 779 5.891 -42.652 27.943 1.00 45.46 H new ATOM 894 N MET A 780 -2.926 -39.182 32.208 1.00 39.25 N ATOM 895 CA MET A 780 -3.822 -39.023 33.351 1.00 39.55 C ATOM 896 C MET A 780 -5.151 -38.447 32.896 1.00 38.61 C ATOM 897 O MET A 780 -5.717 -37.542 33.511 1.00 37.45 O ATOM 898 CB MET A 780 -3.203 -38.147 34.447 1.00 41.07 C ATOM 899 CG MET A 780 -2.345 -37.008 33.978 1.00 44.14 C ATOM 900 SD MET A 780 -1.666 -36.113 35.406 1.00 49.03 S ATOM 901 CE MET A 780 -2.669 -34.648 35.404 1.00 44.47 C ATOM 0 H MET A 780 -2.924 -38.519 31.660 1.00 39.25 H new ATOM 0 HA MET A 780 -3.970 -39.902 33.734 1.00 39.55 H new ATOM 0 HB2 MET A 780 -3.921 -37.785 34.990 1.00 41.07 H new ATOM 0 HB3 MET A 780 -2.669 -38.714 35.025 1.00 41.07 H new ATOM 0 HG2 MET A 780 -1.623 -37.344 33.424 1.00 44.14 H new ATOM 0 HG3 MET A 780 -2.868 -36.405 33.427 1.00 44.14 H new ATOM 0 HE1 MET A 780 -2.401 -34.071 36.136 1.00 44.47 H new ATOM 0 HE2 MET A 780 -2.553 -34.178 34.564 1.00 44.47 H new ATOM 0 HE3 MET A 780 -3.601 -34.894 35.511 1.00 44.47 H new ATOM 902 N TYR A 781 -5.646 -39.012 31.803 1.00 38.86 N ATOM 903 CA TYR A 781 -6.903 -38.597 31.214 1.00 38.83 C ATOM 904 C TYR A 781 -8.075 -38.757 32.180 1.00 36.36 C ATOM 905 O TYR A 781 -8.879 -37.835 32.347 1.00 36.09 O ATOM 906 CB TYR A 781 -7.150 -39.399 29.931 1.00 40.70 C ATOM 907 CG TYR A 781 -8.389 -38.983 29.179 1.00 43.23 C ATOM 908 CD1 TYR A 781 -9.644 -39.481 29.530 1.00 43.96 C ATOM 909 CD2 TYR A 781 -8.314 -38.071 28.131 1.00 43.87 C ATOM 910 CE1 TYR A 781 -10.793 -39.080 28.852 1.00 45.09 C ATOM 911 CE2 TYR A 781 -9.461 -37.661 27.448 1.00 45.15 C ATOM 912 CZ TYR A 781 -10.695 -38.169 27.814 1.00 44.44 C ATOM 913 OH TYR A 781 -11.831 -37.761 27.150 1.00 44.44 O ATOM 0 H TYR A 781 -5.256 -39.652 31.381 1.00 38.86 H new ATOM 0 HA TYR A 781 -6.840 -37.652 31.005 1.00 38.83 H new ATOM 0 HB2 TYR A 781 -6.381 -39.304 29.347 1.00 40.70 H new ATOM 0 HB3 TYR A 781 -7.220 -40.340 30.157 1.00 40.70 H new ATOM 0 HD1 TYR A 781 -9.715 -40.091 30.228 1.00 43.96 H new ATOM 0 HD2 TYR A 781 -7.486 -37.729 27.881 1.00 43.87 H new ATOM 0 HE1 TYR A 781 -11.622 -39.423 29.096 1.00 45.09 H new ATOM 0 HE2 TYR A 781 -9.396 -37.049 26.750 1.00 45.15 H new ATOM 0 HH TYR A 781 -11.631 -37.166 26.592 1.00 44.44 H new ATOM 914 N SER A 782 -8.169 -39.916 32.826 1.00 35.59 N ATOM 915 CA SER A 782 -9.270 -40.155 33.753 1.00 36.18 C ATOM 916 C SER A 782 -9.277 -39.123 34.872 1.00 36.24 C ATOM 917 O SER A 782 -10.327 -38.571 35.216 1.00 37.02 O ATOM 918 CB SER A 782 -9.203 -41.578 34.329 1.00 35.95 C ATOM 919 OG SER A 782 -7.958 -41.846 34.947 1.00 38.76 O ATOM 0 H SER A 782 -7.614 -40.568 32.744 1.00 35.59 H new ATOM 0 HA SER A 782 -10.099 -40.067 33.257 1.00 36.18 H new ATOM 0 HB2 SER A 782 -9.916 -41.697 34.976 1.00 35.95 H new ATOM 0 HB3 SER A 782 -9.355 -42.220 33.618 1.00 35.95 H new ATOM 0 HG SER A 782 -7.958 -42.629 35.250 1.00 38.76 H new ATOM 920 N GLN A 783 -8.108 -38.843 35.435 1.00 35.28 N ATOM 921 CA GLN A 783 -8.047 -37.853 36.499 1.00 34.83 C ATOM 922 C GLN A 783 -8.413 -36.482 35.931 1.00 33.94 C ATOM 923 O GLN A 783 -9.078 -35.688 36.591 1.00 32.97 O ATOM 924 CB GLN A 783 -6.655 -37.836 37.137 1.00 35.45 C ATOM 925 CG GLN A 783 -6.282 -39.159 37.803 1.00 35.49 C ATOM 926 CD GLN A 783 -5.494 -40.076 36.891 1.00 36.30 C ATOM 927 OE1 GLN A 783 -5.710 -40.101 35.686 1.00 37.88 O ATOM 928 NE2 GLN A 783 -4.573 -40.840 37.466 1.00 39.36 N ATOM 0 H GLN A 783 -7.357 -39.205 35.222 1.00 35.28 H new ATOM 0 HA GLN A 783 -8.683 -38.083 37.194 1.00 34.83 H new ATOM 0 HB2 GLN A 783 -5.996 -37.626 36.457 1.00 35.45 H new ATOM 0 HB3 GLN A 783 -6.617 -37.126 37.797 1.00 35.45 H new ATOM 0 HG2 GLN A 783 -5.761 -38.979 38.601 1.00 35.49 H new ATOM 0 HG3 GLN A 783 -7.091 -39.612 38.089 1.00 35.49 H new ATOM 0 HE21 GLN A 783 -4.448 -40.797 38.316 1.00 39.36 H new ATOM 0 HE22 GLN A 783 -4.102 -41.378 36.989 1.00 39.36 H new ATOM 929 N CYS A 784 -8.003 -36.215 34.695 1.00 35.00 N ATOM 930 CA CYS A 784 -8.315 -34.933 34.064 1.00 36.03 C ATOM 931 C CYS A 784 -9.815 -34.741 33.857 1.00 36.50 C ATOM 932 O CYS A 784 -10.332 -33.637 34.008 1.00 37.10 O ATOM 933 CB CYS A 784 -7.594 -34.809 32.715 1.00 35.80 C ATOM 934 SG CYS A 784 -5.838 -34.380 32.833 1.00 31.94 S ATOM 0 H CYS A 784 -7.547 -36.756 34.207 1.00 35.00 H new ATOM 0 HA CYS A 784 -8.005 -34.240 34.667 1.00 36.03 H new ATOM 0 HB2 CYS A 784 -7.678 -35.650 32.239 1.00 35.80 H new ATOM 0 HB3 CYS A 784 -8.044 -34.135 32.182 1.00 35.80 H new ATOM 0 HG CYS A 784 -5.205 -35.359 33.116 1.00 31.94 H new ATOM 935 N VAL A 785 -10.512 -35.816 33.500 1.00 38.62 N ATOM 936 CA VAL A 785 -11.953 -35.745 33.284 1.00 38.83 C ATOM 937 C VAL A 785 -12.649 -35.317 34.568 1.00 38.04 C ATOM 938 O VAL A 785 -13.554 -34.485 34.545 1.00 39.04 O ATOM 939 CB VAL A 785 -12.530 -37.114 32.834 1.00 41.60 C ATOM 940 CG1 VAL A 785 -14.047 -37.052 32.812 1.00 42.24 C ATOM 941 CG2 VAL A 785 -12.004 -37.476 31.449 1.00 39.85 C ATOM 0 H VAL A 785 -10.169 -36.595 33.378 1.00 38.62 H new ATOM 0 HA VAL A 785 -12.112 -35.095 32.582 1.00 38.83 H new ATOM 0 HB VAL A 785 -12.249 -37.796 33.464 1.00 41.60 H new ATOM 0 HG11 VAL A 785 -14.402 -37.910 32.530 1.00 42.24 H new ATOM 0 HG12 VAL A 785 -14.375 -36.843 33.700 1.00 42.24 H new ATOM 0 HG13 VAL A 785 -14.334 -36.364 32.191 1.00 42.24 H new ATOM 0 HG21 VAL A 785 -12.370 -38.332 31.177 1.00 39.85 H new ATOM 0 HG22 VAL A 785 -12.271 -36.794 30.813 1.00 39.85 H new ATOM 0 HG23 VAL A 785 -11.036 -37.532 31.475 1.00 39.85 H new ATOM 942 N ARG A 786 -12.225 -35.882 35.691 1.00 38.27 N ATOM 943 CA ARG A 786 -12.823 -35.523 36.972 1.00 40.00 C ATOM 944 C ARG A 786 -12.558 -34.049 37.285 1.00 39.51 C ATOM 945 O ARG A 786 -13.461 -33.326 37.722 1.00 37.89 O ATOM 946 CB ARG A 786 -12.283 -36.432 38.080 1.00 42.43 C ATOM 947 CG ARG A 786 -12.628 -37.906 37.843 1.00 46.01 C ATOM 948 CD ARG A 786 -12.372 -38.776 39.063 1.00 48.16 C ATOM 949 NE ARG A 786 -13.161 -38.348 40.219 1.00 50.77 N ATOM 950 CZ ARG A 786 -13.213 -39.002 41.378 1.00 51.74 C ATOM 951 NH1 ARG A 786 -12.527 -40.125 41.553 1.00 51.44 N ATOM 952 NH2 ARG A 786 -13.950 -38.530 42.372 1.00 53.43 N ATOM 0 H ARG A 786 -11.599 -36.470 35.735 1.00 38.27 H new ATOM 0 HA ARG A 786 -13.783 -35.650 36.921 1.00 40.00 H new ATOM 0 HB2 ARG A 786 -11.320 -36.332 38.136 1.00 42.43 H new ATOM 0 HB3 ARG A 786 -12.648 -36.150 38.933 1.00 42.43 H new ATOM 0 HG2 ARG A 786 -13.562 -37.978 37.590 1.00 46.01 H new ATOM 0 HG3 ARG A 786 -12.105 -38.240 37.097 1.00 46.01 H new ATOM 0 HD2 ARG A 786 -12.585 -39.698 38.851 1.00 48.16 H new ATOM 0 HD3 ARG A 786 -11.429 -38.747 39.288 1.00 48.16 H new ATOM 0 HE ARG A 786 -13.622 -37.626 40.145 1.00 50.77 H new ATOM 0 HH11 ARG A 786 -12.043 -40.437 40.914 1.00 51.44 H new ATOM 0 HH12 ARG A 786 -12.567 -40.540 42.305 1.00 51.44 H new ATOM 0 HH21 ARG A 786 -14.395 -37.801 42.269 1.00 53.43 H new ATOM 0 HH22 ARG A 786 -13.984 -38.952 43.120 1.00 53.43 H new ATOM 953 N MET A 787 -11.331 -33.594 37.036 1.00 37.83 N ATOM 954 CA MET A 787 -11.000 -32.191 37.278 1.00 36.52 C ATOM 955 C MET A 787 -11.856 -31.298 36.374 1.00 36.06 C ATOM 956 O MET A 787 -12.312 -30.236 36.795 1.00 35.08 O ATOM 957 CB MET A 787 -9.505 -31.928 37.027 1.00 34.07 C ATOM 958 CG MET A 787 -8.582 -32.560 38.060 1.00 32.99 C ATOM 959 SD MET A 787 -6.864 -32.021 37.937 1.00 34.16 S ATOM 960 CE MET A 787 -6.239 -33.150 36.683 1.00 29.34 C ATOM 0 H MET A 787 -10.685 -34.073 36.731 1.00 37.83 H new ATOM 0 HA MET A 787 -11.189 -31.983 38.206 1.00 36.52 H new ATOM 0 HB2 MET A 787 -9.270 -32.265 36.148 1.00 34.07 H new ATOM 0 HB3 MET A 787 -9.352 -30.970 37.014 1.00 34.07 H new ATOM 0 HG2 MET A 787 -8.914 -32.352 38.947 1.00 32.99 H new ATOM 0 HG3 MET A 787 -8.616 -33.525 37.964 1.00 32.99 H new ATOM 0 HE1 MET A 787 -5.303 -33.339 36.855 1.00 29.34 H new ATOM 0 HE2 MET A 787 -6.745 -33.977 36.711 1.00 29.34 H new ATOM 0 HE3 MET A 787 -6.331 -32.744 35.807 1.00 29.34 H new ATOM 961 N ARG A 788 -12.080 -31.726 35.134 1.00 37.15 N ATOM 962 CA ARG A 788 -12.906 -30.937 34.221 1.00 39.57 C ATOM 963 C ARG A 788 -14.344 -30.907 34.738 1.00 39.02 C ATOM 964 O ARG A 788 -15.042 -29.903 34.609 1.00 39.86 O ATOM 965 CB ARG A 788 -12.892 -31.534 32.814 1.00 42.04 C ATOM 966 CG ARG A 788 -13.588 -30.659 31.772 1.00 46.98 C ATOM 967 CD ARG A 788 -13.651 -31.347 30.416 1.00 50.65 C ATOM 968 NE ARG A 788 -15.013 -31.727 30.046 1.00 55.00 N ATOM 969 CZ ARG A 788 -15.967 -30.865 29.692 1.00 57.29 C ATOM 970 NH1 ARG A 788 -15.713 -29.564 29.658 1.00 57.32 N ATOM 971 NH2 ARG A 788 -17.178 -31.305 29.364 1.00 58.64 N ATOM 0 H ARG A 788 -11.769 -32.457 34.805 1.00 37.15 H new ATOM 0 HA ARG A 788 -12.544 -30.038 34.179 1.00 39.57 H new ATOM 0 HB2 ARG A 788 -11.972 -31.679 32.541 1.00 42.04 H new ATOM 0 HB3 ARG A 788 -13.322 -32.403 32.835 1.00 42.04 H new ATOM 0 HG2 ARG A 788 -14.487 -30.450 32.072 1.00 46.98 H new ATOM 0 HG3 ARG A 788 -13.114 -29.817 31.687 1.00 46.98 H new ATOM 0 HD2 ARG A 788 -13.288 -30.755 29.739 1.00 50.65 H new ATOM 0 HD3 ARG A 788 -13.090 -32.138 30.431 1.00 50.65 H new ATOM 0 HE ARG A 788 -15.213 -32.563 30.057 1.00 55.00 H new ATOM 0 HH11 ARG A 788 -14.931 -29.273 29.865 1.00 57.32 H new ATOM 0 HH12 ARG A 788 -16.331 -29.011 29.429 1.00 57.32 H new ATOM 0 HH21 ARG A 788 -17.348 -32.148 29.380 1.00 58.64 H new ATOM 0 HH22 ARG A 788 -17.791 -30.747 29.136 1.00 58.64 H new ATOM 972 N HIS A 789 -14.776 -32.018 35.324 1.00 39.08 N ATOM 973 CA HIS A 789 -16.124 -32.128 35.866 1.00 41.71 C ATOM 974 C HIS A 789 -16.254 -31.156 37.039 1.00 40.64 C ATOM 975 O HIS A 789 -17.199 -30.368 37.104 1.00 39.63 O ATOM 976 CB HIS A 789 -16.379 -33.568 36.318 1.00 44.23 C ATOM 977 CG HIS A 789 -17.799 -33.842 36.711 1.00 50.24 C ATOM 978 ND1 HIS A 789 -18.374 -33.318 37.850 1.00 52.44 N ATOM 979 CD2 HIS A 789 -18.750 -34.614 36.131 1.00 50.58 C ATOM 980 CE1 HIS A 789 -19.615 -33.759 37.957 1.00 52.31 C ATOM 981 NE2 HIS A 789 -19.867 -34.547 36.927 1.00 52.45 N ATOM 0 H HIS A 789 -14.298 -32.727 35.418 1.00 39.08 H new ATOM 0 HA HIS A 789 -16.783 -31.903 35.190 1.00 41.71 H new ATOM 0 HB2 HIS A 789 -16.130 -34.171 35.600 1.00 44.23 H new ATOM 0 HB3 HIS A 789 -15.801 -33.768 37.071 1.00 44.23 H new ATOM 0 HD2 HIS A 789 -18.663 -35.098 35.342 1.00 50.58 H new ATOM 0 HE1 HIS A 789 -20.210 -33.550 38.641 1.00 52.31 H new ATOM 0 HE2 HIS A 789 -20.611 -34.953 36.779 1.00 52.45 H new ATOM 982 N LEU A 790 -15.298 -31.212 37.962 1.00 39.47 N ATOM 983 CA LEU A 790 -15.300 -30.306 39.103 1.00 38.04 C ATOM 984 C LEU A 790 -15.402 -28.886 38.566 1.00 37.98 C ATOM 985 O LEU A 790 -16.179 -28.070 39.061 1.00 37.73 O ATOM 986 CB LEU A 790 -14.005 -30.451 39.908 1.00 36.63 C ATOM 987 CG LEU A 790 -13.725 -29.331 40.916 1.00 34.84 C ATOM 988 CD1 LEU A 790 -14.826 -29.281 41.966 1.00 35.63 C ATOM 989 CD2 LEU A 790 -12.380 -29.563 41.572 1.00 37.74 C ATOM 0 H LEU A 790 -14.641 -31.767 37.945 1.00 39.47 H new ATOM 0 HA LEU A 790 -16.046 -30.513 39.687 1.00 38.04 H new ATOM 0 HB2 LEU A 790 -14.032 -31.295 40.385 1.00 36.63 H new ATOM 0 HB3 LEU A 790 -13.261 -30.500 39.288 1.00 36.63 H new ATOM 0 HG LEU A 790 -13.707 -28.480 40.451 1.00 34.84 H new ATOM 0 HD11 LEU A 790 -14.639 -28.569 42.598 1.00 35.63 H new ATOM 0 HD12 LEU A 790 -15.678 -29.113 41.534 1.00 35.63 H new ATOM 0 HD13 LEU A 790 -14.864 -30.129 42.436 1.00 35.63 H new ATOM 0 HD21 LEU A 790 -12.204 -28.854 42.210 1.00 37.74 H new ATOM 0 HD22 LEU A 790 -12.387 -30.417 42.033 1.00 37.74 H new ATOM 0 HD23 LEU A 790 -11.686 -29.568 40.895 1.00 37.74 H new ATOM 990 N SER A 791 -14.603 -28.598 37.545 1.00 37.55 N ATOM 991 CA SER A 791 -14.600 -27.283 36.928 1.00 37.52 C ATOM 992 C SER A 791 -16.001 -26.888 36.482 1.00 38.72 C ATOM 993 O SER A 791 -16.401 -25.730 36.616 1.00 38.05 O ATOM 994 CB SER A 791 -13.666 -27.272 35.721 1.00 36.51 C ATOM 995 OG SER A 791 -13.764 -26.039 35.032 1.00 37.81 O ATOM 0 H SER A 791 -14.052 -29.157 37.194 1.00 37.55 H new ATOM 0 HA SER A 791 -14.289 -26.644 37.588 1.00 37.52 H new ATOM 0 HB2 SER A 791 -12.752 -27.415 36.011 1.00 36.51 H new ATOM 0 HB3 SER A 791 -13.892 -28.002 35.123 1.00 36.51 H new ATOM 0 HG SER A 791 -13.488 -25.419 35.527 1.00 37.81 H new ATOM 996 N GLN A 792 -16.738 -27.853 35.938 1.00 39.90 N ATOM 997 CA GLN A 792 -18.098 -27.604 35.466 1.00 40.61 C ATOM 998 C GLN A 792 -19.048 -27.370 36.638 1.00 40.00 C ATOM 999 O GLN A 792 -20.027 -26.628 36.520 1.00 39.48 O ATOM 1000 CB GLN A 792 -18.583 -28.781 34.615 1.00 41.48 C ATOM 1001 CG GLN A 792 -17.694 -29.060 33.405 1.00 44.94 C ATOM 1002 CD GLN A 792 -18.147 -30.269 32.616 1.00 46.62 C ATOM 1003 OE1 GLN A 792 -19.152 -30.219 31.908 1.00 47.21 O ATOM 1004 NE2 GLN A 792 -17.414 -31.369 32.746 1.00 47.39 N ATOM 0 H GLN A 792 -16.468 -28.663 35.833 1.00 39.90 H new ATOM 0 HA GLN A 792 -18.090 -26.802 34.920 1.00 40.61 H new ATOM 0 HB2 GLN A 792 -18.624 -29.577 35.168 1.00 41.48 H new ATOM 0 HB3 GLN A 792 -19.486 -28.601 34.310 1.00 41.48 H new ATOM 0 HG2 GLN A 792 -17.690 -28.283 32.825 1.00 44.94 H new ATOM 0 HG3 GLN A 792 -16.781 -29.196 33.703 1.00 44.94 H new ATOM 0 HE21 GLN A 792 -16.718 -31.365 33.251 1.00 47.39 H new ATOM 0 HE22 GLN A 792 -17.636 -32.086 32.325 1.00 47.39 H new ATOM 1005 N GLU A 793 -18.763 -28.010 37.766 1.00 38.90 N ATOM 1006 CA GLU A 793 -19.591 -27.826 38.952 1.00 39.79 C ATOM 1007 C GLU A 793 -19.658 -26.339 39.296 1.00 38.35 C ATOM 1008 O GLU A 793 -20.693 -25.843 39.727 1.00 39.01 O ATOM 1009 CB GLU A 793 -19.009 -28.598 40.130 1.00 40.85 C ATOM 1010 CG GLU A 793 -19.154 -30.104 40.037 1.00 45.62 C ATOM 1011 CD GLU A 793 -20.559 -30.576 40.366 1.00 48.67 C ATOM 1012 OE1 GLU A 793 -20.719 -31.775 40.685 1.00 50.71 O ATOM 1013 OE2 GLU A 793 -21.503 -29.755 40.301 1.00 51.03 O ATOM 0 H GLU A 793 -18.101 -28.550 37.866 1.00 38.90 H new ATOM 0 HA GLU A 793 -20.483 -28.161 38.770 1.00 39.79 H new ATOM 0 HB2 GLU A 793 -18.067 -28.381 40.209 1.00 40.85 H new ATOM 0 HB3 GLU A 793 -19.440 -28.294 40.944 1.00 40.85 H new ATOM 0 HG2 GLU A 793 -18.921 -30.393 39.141 1.00 45.62 H new ATOM 0 HG3 GLU A 793 -18.525 -30.524 40.644 1.00 45.62 H new ATOM 1014 N PHE A 794 -18.551 -25.628 39.098 1.00 37.46 N ATOM 1015 CA PHE A 794 -18.512 -24.200 39.389 1.00 38.01 C ATOM 1016 C PHE A 794 -19.585 -23.463 38.611 1.00 40.20 C ATOM 1017 O PHE A 794 -20.168 -22.494 39.106 1.00 38.96 O ATOM 1018 CB PHE A 794 -17.142 -23.617 39.044 1.00 36.85 C ATOM 1019 CG PHE A 794 -16.079 -23.949 40.046 1.00 38.28 C ATOM 1020 CD1 PHE A 794 -16.135 -23.423 41.333 1.00 37.62 C ATOM 1021 CD2 PHE A 794 -15.039 -24.811 39.719 1.00 35.51 C ATOM 1022 CE1 PHE A 794 -15.168 -23.755 42.283 1.00 39.61 C ATOM 1023 CE2 PHE A 794 -14.071 -25.147 40.661 1.00 38.79 C ATOM 1024 CZ PHE A 794 -14.134 -24.620 41.944 1.00 36.47 C ATOM 0 H PHE A 794 -17.814 -25.953 38.797 1.00 37.46 H new ATOM 0 HA PHE A 794 -18.676 -24.087 40.338 1.00 38.01 H new ATOM 0 HB2 PHE A 794 -16.869 -23.946 38.173 1.00 36.85 H new ATOM 0 HB3 PHE A 794 -17.218 -22.653 38.972 1.00 36.85 H new ATOM 0 HD1 PHE A 794 -16.825 -22.843 41.563 1.00 37.62 H new ATOM 0 HD2 PHE A 794 -14.989 -25.167 38.861 1.00 35.51 H new ATOM 0 HE1 PHE A 794 -15.215 -23.398 43.141 1.00 39.61 H new ATOM 0 HE2 PHE A 794 -13.380 -25.726 40.431 1.00 38.79 H new ATOM 0 HZ PHE A 794 -13.487 -24.845 42.574 1.00 36.47 H new ATOM 1025 N GLY A 795 -19.831 -23.925 37.386 1.00 41.54 N ATOM 1026 CA GLY A 795 -20.847 -23.317 36.545 1.00 42.46 C ATOM 1027 C GLY A 795 -22.239 -23.833 36.879 1.00 43.03 C ATOM 1028 O GLY A 795 -23.179 -23.051 37.030 1.00 42.78 O ATOM 0 H GLY A 795 -19.419 -24.589 37.028 1.00 41.54 H new ATOM 0 HA2 GLY A 795 -20.824 -22.354 36.655 1.00 42.46 H new ATOM 0 HA3 GLY A 795 -20.649 -23.501 35.613 1.00 42.46 H new ATOM 1029 N TRP A 796 -22.372 -25.151 37.000 1.00 43.44 N ATOM 1030 CA TRP A 796 -23.657 -25.756 37.316 1.00 45.18 C ATOM 1031 C TRP A 796 -24.245 -25.195 38.610 1.00 46.40 C ATOM 1032 O TRP A 796 -25.436 -24.888 38.664 1.00 48.31 O ATOM 1033 CB TRP A 796 -23.534 -27.287 37.410 1.00 44.45 C ATOM 1034 CG TRP A 796 -23.168 -27.944 36.098 1.00 47.78 C ATOM 1035 CD1 TRP A 796 -23.460 -27.485 34.838 1.00 49.17 C ATOM 1036 CD2 TRP A 796 -22.471 -29.188 35.916 1.00 46.69 C ATOM 1037 NE1 TRP A 796 -22.989 -28.364 33.889 1.00 49.69 N ATOM 1038 CE2 TRP A 796 -22.379 -29.417 34.520 1.00 47.57 C ATOM 1039 CE3 TRP A 796 -21.917 -30.131 36.793 1.00 47.26 C ATOM 1040 CZ2 TRP A 796 -21.752 -30.550 33.983 1.00 47.16 C ATOM 1041 CZ3 TRP A 796 -21.291 -31.264 36.257 1.00 46.75 C ATOM 1042 CH2 TRP A 796 -21.216 -31.460 34.864 1.00 46.76 C ATOM 0 H TRP A 796 -21.727 -25.712 36.902 1.00 43.44 H new ATOM 0 HA TRP A 796 -24.263 -25.534 36.592 1.00 45.18 H new ATOM 0 HB2 TRP A 796 -22.863 -27.510 38.074 1.00 44.45 H new ATOM 0 HB3 TRP A 796 -24.376 -27.653 37.723 1.00 44.45 H new ATOM 0 HD1 TRP A 796 -23.911 -26.693 34.652 1.00 49.17 H new ATOM 0 HE1 TRP A 796 -23.065 -28.268 33.038 1.00 49.69 H new ATOM 0 HE3 TRP A 796 -21.964 -30.007 37.713 1.00 47.26 H new ATOM 0 HZ2 TRP A 796 -21.700 -30.682 33.064 1.00 47.16 H new ATOM 0 HZ3 TRP A 796 -20.920 -31.896 36.829 1.00 46.75 H new ATOM 0 HH2 TRP A 796 -20.795 -32.221 34.533 1.00 46.76 H new ATOM 1043 N LEU A 797 -23.415 -25.042 39.641 1.00 45.46 N ATOM 1044 CA LEU A 797 -23.882 -24.518 40.925 1.00 43.89 C ATOM 1045 C LEU A 797 -23.861 -22.997 41.010 1.00 42.59 C ATOM 1046 O LEU A 797 -24.309 -22.418 42.001 1.00 42.34 O ATOM 1047 CB LEU A 797 -23.037 -25.094 42.069 1.00 45.49 C ATOM 1048 CG LEU A 797 -23.141 -26.601 42.329 1.00 46.04 C ATOM 1049 CD1 LEU A 797 -22.054 -27.044 43.294 1.00 46.32 C ATOM 1050 CD2 LEU A 797 -24.518 -26.923 42.886 1.00 45.59 C ATOM 0 H LEU A 797 -22.577 -25.236 39.618 1.00 45.46 H new ATOM 0 HA LEU A 797 -24.808 -24.796 41.005 1.00 43.89 H new ATOM 0 HB2 LEU A 797 -22.107 -24.883 41.891 1.00 45.49 H new ATOM 0 HB3 LEU A 797 -23.281 -24.631 42.885 1.00 45.49 H new ATOM 0 HG LEU A 797 -23.018 -27.082 41.496 1.00 46.04 H new ATOM 0 HD11 LEU A 797 -22.130 -27.998 43.451 1.00 46.32 H new ATOM 0 HD12 LEU A 797 -21.184 -26.847 42.914 1.00 46.32 H new ATOM 0 HD13 LEU A 797 -22.154 -26.570 44.134 1.00 46.32 H new ATOM 0 HD21 LEU A 797 -24.586 -27.876 43.051 1.00 45.59 H new ATOM 0 HD22 LEU A 797 -24.652 -26.441 43.717 1.00 45.59 H new ATOM 0 HD23 LEU A 797 -25.197 -26.657 42.246 1.00 45.59 H new ATOM 1051 N GLN A 798 -23.349 -22.343 39.975 1.00 42.23 N ATOM 1052 CA GLN A 798 -23.261 -20.886 39.983 1.00 41.73 C ATOM 1053 C GLN A 798 -22.453 -20.412 41.193 1.00 39.85 C ATOM 1054 O GLN A 798 -22.890 -19.524 41.923 1.00 40.77 O ATOM 1055 CB GLN A 798 -24.652 -20.248 40.049 1.00 43.67 C ATOM 1056 CG GLN A 798 -25.277 -19.851 38.714 1.00 46.03 C ATOM 1057 CD GLN A 798 -26.597 -19.111 38.909 1.00 46.21 C ATOM 1058 OE1 GLN A 798 -26.654 -18.102 39.613 1.00 47.36 O ATOM 1059 NE2 GLN A 798 -27.659 -19.613 38.295 1.00 44.31 N ATOM 0 H GLN A 798 -23.049 -22.719 39.262 1.00 42.23 H new ATOM 0 HA GLN A 798 -22.824 -20.616 39.160 1.00 41.73 H new ATOM 0 HB2 GLN A 798 -25.251 -20.868 40.493 1.00 43.67 H new ATOM 0 HB3 GLN A 798 -24.598 -19.457 40.607 1.00 43.67 H new ATOM 0 HG2 GLN A 798 -24.659 -19.288 38.222 1.00 46.03 H new ATOM 0 HG3 GLN A 798 -25.427 -20.645 38.177 1.00 46.03 H new ATOM 0 HE21 GLN A 798 -27.582 -20.320 37.811 1.00 44.31 H new ATOM 0 HE22 GLN A 798 -28.425 -19.232 38.381 1.00 44.31 H new ATOM 1060 N ILE A 799 -21.288 -21.012 41.411 1.00 37.28 N ATOM 1061 CA ILE A 799 -20.431 -20.621 42.527 1.00 35.39 C ATOM 1062 C ILE A 799 -19.967 -19.179 42.348 1.00 36.47 C ATOM 1063 O ILE A 799 -19.426 -18.811 41.307 1.00 36.74 O ATOM 1064 CB ILE A 799 -19.170 -21.519 42.627 1.00 33.05 C ATOM 1065 CG1 ILE A 799 -19.574 -22.987 42.753 1.00 29.70 C ATOM 1066 CG2 ILE A 799 -18.324 -21.101 43.826 1.00 31.44 C ATOM 1067 CD1 ILE A 799 -20.373 -23.301 43.996 1.00 33.37 C ATOM 0 H ILE A 799 -20.974 -21.648 40.925 1.00 37.28 H new ATOM 0 HA ILE A 799 -20.956 -20.719 43.337 1.00 35.39 H new ATOM 0 HB ILE A 799 -18.644 -21.410 41.819 1.00 33.05 H new ATOM 0 HG12 ILE A 799 -20.094 -23.238 41.974 1.00 29.70 H new ATOM 0 HG13 ILE A 799 -18.773 -23.535 42.748 1.00 29.70 H new ATOM 0 HG21 ILE A 799 -17.538 -21.667 43.881 1.00 31.44 H new ATOM 0 HG22 ILE A 799 -18.049 -20.177 43.722 1.00 31.44 H new ATOM 0 HG23 ILE A 799 -18.846 -21.193 44.638 1.00 31.44 H new ATOM 0 HD11 ILE A 799 -20.593 -24.246 44.009 1.00 33.37 H new ATOM 0 HD12 ILE A 799 -19.849 -23.080 44.782 1.00 33.37 H new ATOM 0 HD13 ILE A 799 -21.190 -22.779 43.996 1.00 33.37 H new ATOM 1068 N THR A 800 -20.182 -18.363 43.368 1.00 37.85 N ATOM 1069 CA THR A 800 -19.774 -16.972 43.318 1.00 38.45 C ATOM 1070 C THR A 800 -18.300 -16.854 43.698 1.00 39.00 C ATOM 1071 O THR A 800 -17.759 -17.703 44.419 1.00 39.13 O ATOM 1072 CB THR A 800 -20.579 -16.130 44.299 1.00 39.37 C ATOM 1073 OG1 THR A 800 -20.195 -16.480 45.634 1.00 41.09 O ATOM 1074 CG2 THR A 800 -22.072 -16.385 44.116 1.00 39.59 C ATOM 0 H THR A 800 -20.565 -18.598 44.102 1.00 37.85 H new ATOM 0 HA THR A 800 -19.925 -16.652 42.415 1.00 38.45 H new ATOM 0 HB THR A 800 -20.402 -15.190 44.136 1.00 39.37 H new ATOM 0 HG1 THR A 800 -20.612 -15.998 46.181 1.00 41.09 H new ATOM 0 HG21 THR A 800 -22.573 -15.843 44.746 1.00 39.59 H new ATOM 0 HG22 THR A 800 -22.332 -16.151 43.211 1.00 39.59 H new ATOM 0 HG23 THR A 800 -22.262 -17.323 44.274 1.00 39.59 H new ATOM 1075 N PRO A 801 -17.628 -15.799 43.206 1.00 37.85 N ATOM 1076 CA PRO A 801 -16.208 -15.535 43.477 1.00 37.75 C ATOM 1077 C PRO A 801 -15.905 -15.567 44.972 1.00 37.59 C ATOM 1078 O PRO A 801 -14.839 -16.016 45.395 1.00 39.16 O ATOM 1079 CB PRO A 801 -15.997 -14.146 42.882 1.00 37.68 C ATOM 1080 CG PRO A 801 -16.940 -14.148 41.711 1.00 38.18 C ATOM 1081 CD PRO A 801 -18.188 -14.787 42.293 1.00 36.28 C ATOM 0 HA PRO A 801 -15.616 -16.202 43.096 1.00 37.75 H new ATOM 0 HB2 PRO A 801 -16.211 -13.445 43.517 1.00 37.68 H new ATOM 0 HB3 PRO A 801 -15.078 -14.007 42.605 1.00 37.68 H new ATOM 0 HG2 PRO A 801 -17.112 -13.251 41.385 1.00 38.18 H new ATOM 0 HG3 PRO A 801 -16.588 -14.658 40.965 1.00 38.18 H new ATOM 0 HD2 PRO A 801 -18.739 -14.142 42.763 1.00 36.28 H new ATOM 0 HD3 PRO A 801 -18.743 -15.188 41.606 1.00 36.28 H new ATOM 1082 N GLN A 802 -16.858 -15.088 45.764 1.00 36.03 N ATOM 1083 CA GLN A 802 -16.725 -15.047 47.212 1.00 34.97 C ATOM 1084 C GLN A 802 -16.870 -16.437 47.845 1.00 35.10 C ATOM 1085 O GLN A 802 -16.189 -16.749 48.825 1.00 34.62 O ATOM 1086 CB GLN A 802 -17.767 -14.089 47.803 1.00 36.09 C ATOM 1087 CG GLN A 802 -17.621 -12.626 47.352 1.00 39.70 C ATOM 1088 CD GLN A 802 -17.852 -12.422 45.856 1.00 38.73 C ATOM 1089 OE1 GLN A 802 -18.827 -12.922 45.292 1.00 40.57 O ATOM 1090 NE2 GLN A 802 -16.956 -11.675 45.212 1.00 38.90 N ATOM 0 H GLN A 802 -17.605 -14.776 45.473 1.00 36.03 H new ATOM 0 HA GLN A 802 -15.832 -14.727 47.416 1.00 34.97 H new ATOM 0 HB2 GLN A 802 -18.652 -14.403 47.560 1.00 36.09 H new ATOM 0 HB3 GLN A 802 -17.709 -14.124 48.771 1.00 36.09 H new ATOM 0 HG2 GLN A 802 -18.251 -12.079 47.847 1.00 39.70 H new ATOM 0 HG3 GLN A 802 -16.732 -12.312 47.580 1.00 39.70 H new ATOM 0 HE21 GLN A 802 -16.288 -11.342 45.639 1.00 38.90 H new ATOM 0 HE22 GLN A 802 -17.046 -11.526 44.370 1.00 38.90 H new ATOM 1091 N GLU A 803 -17.769 -17.262 47.306 1.00 32.91 N ATOM 1092 CA GLU A 803 -17.941 -18.611 47.828 1.00 31.88 C ATOM 1093 C GLU A 803 -16.671 -19.398 47.478 1.00 32.38 C ATOM 1094 O GLU A 803 -16.199 -20.215 48.270 1.00 30.91 O ATOM 1095 CB GLU A 803 -19.170 -19.298 47.212 1.00 33.19 C ATOM 1096 CG GLU A 803 -20.517 -18.652 47.546 1.00 35.49 C ATOM 1097 CD GLU A 803 -21.693 -19.361 46.873 1.00 37.39 C ATOM 1098 OE1 GLU A 803 -21.568 -19.745 45.689 1.00 35.76 O ATOM 1099 OE2 GLU A 803 -22.753 -19.524 47.521 1.00 38.38 O ATOM 0 H GLU A 803 -18.282 -17.060 46.646 1.00 32.91 H new ATOM 0 HA GLU A 803 -18.083 -18.578 48.787 1.00 31.88 H new ATOM 0 HB2 GLU A 803 -19.065 -19.312 46.248 1.00 33.19 H new ATOM 0 HB3 GLU A 803 -19.188 -20.221 47.509 1.00 33.19 H new ATOM 0 HG2 GLU A 803 -20.646 -18.660 48.507 1.00 35.49 H new ATOM 0 HG3 GLU A 803 -20.503 -17.722 47.270 1.00 35.49 H new ATOM 1100 N PHE A 804 -16.118 -19.138 46.294 1.00 30.58 N ATOM 1101 CA PHE A 804 -14.892 -19.811 45.866 1.00 30.55 C ATOM 1102 C PHE A 804 -13.761 -19.519 46.853 1.00 30.85 C ATOM 1103 O PHE A 804 -13.087 -20.433 47.333 1.00 30.27 O ATOM 1104 CB PHE A 804 -14.467 -19.343 44.471 1.00 27.76 C ATOM 1105 CG PHE A 804 -13.032 -19.661 44.142 1.00 29.46 C ATOM 1106 CD1 PHE A 804 -12.626 -20.978 43.917 1.00 28.57 C ATOM 1107 CD2 PHE A 804 -12.073 -18.647 44.104 1.00 28.17 C ATOM 1108 CE1 PHE A 804 -11.285 -21.282 43.662 1.00 30.75 C ATOM 1109 CE2 PHE A 804 -10.732 -18.938 43.849 1.00 26.94 C ATOM 1110 CZ PHE A 804 -10.334 -20.259 43.629 1.00 27.94 C ATOM 0 H PHE A 804 -16.436 -18.577 45.725 1.00 30.58 H new ATOM 0 HA PHE A 804 -15.070 -20.764 45.839 1.00 30.55 H new ATOM 0 HB2 PHE A 804 -15.043 -19.758 43.809 1.00 27.76 H new ATOM 0 HB3 PHE A 804 -14.602 -18.385 44.404 1.00 27.76 H new ATOM 0 HD1 PHE A 804 -13.256 -21.662 43.937 1.00 28.57 H new ATOM 0 HD2 PHE A 804 -12.331 -17.766 44.251 1.00 28.17 H new ATOM 0 HE1 PHE A 804 -11.027 -22.163 43.515 1.00 30.75 H new ATOM 0 HE2 PHE A 804 -10.104 -18.253 43.826 1.00 26.94 H new ATOM 0 HZ PHE A 804 -9.441 -20.456 43.461 1.00 27.94 H new ATOM 1111 N LEU A 805 -13.569 -18.242 47.161 1.00 30.09 N ATOM 1112 CA LEU A 805 -12.520 -17.830 48.088 1.00 31.07 C ATOM 1113 C LEU A 805 -12.597 -18.503 49.451 1.00 32.46 C ATOM 1114 O LEU A 805 -11.586 -19.016 49.946 1.00 31.59 O ATOM 1115 CB LEU A 805 -12.545 -16.315 48.289 1.00 26.72 C ATOM 1116 CG LEU A 805 -12.202 -15.492 47.054 1.00 27.75 C ATOM 1117 CD1 LEU A 805 -12.267 -14.018 47.390 1.00 29.93 C ATOM 1118 CD2 LEU A 805 -10.831 -15.874 46.565 1.00 27.42 C ATOM 0 H LEU A 805 -14.037 -17.595 46.843 1.00 30.09 H new ATOM 0 HA LEU A 805 -11.689 -18.112 47.674 1.00 31.07 H new ATOM 0 HB2 LEU A 805 -13.429 -16.058 48.596 1.00 26.72 H new ATOM 0 HB3 LEU A 805 -11.921 -16.086 48.996 1.00 26.72 H new ATOM 0 HG LEU A 805 -12.843 -15.671 46.348 1.00 27.75 H new ATOM 0 HD11 LEU A 805 -12.048 -13.496 46.602 1.00 29.93 H new ATOM 0 HD12 LEU A 805 -13.162 -13.793 47.688 1.00 29.93 H new ATOM 0 HD13 LEU A 805 -11.632 -13.818 48.096 1.00 29.93 H new ATOM 0 HD21 LEU A 805 -10.610 -15.351 45.778 1.00 27.42 H new ATOM 0 HD22 LEU A 805 -10.179 -15.700 47.262 1.00 27.42 H new ATOM 0 HD23 LEU A 805 -10.819 -16.817 46.339 1.00 27.42 H new ATOM 1119 N CYS A 806 -13.783 -18.499 50.064 1.00 31.91 N ATOM 1120 CA CYS A 806 -13.928 -19.112 51.387 1.00 33.07 C ATOM 1121 C CYS A 806 -13.822 -20.624 51.333 1.00 31.22 C ATOM 1122 O CYS A 806 -13.273 -21.240 52.247 1.00 30.93 O ATOM 1123 CB CYS A 806 -15.252 -18.712 52.056 1.00 32.48 C ATOM 1124 SG CYS A 806 -15.337 -19.183 53.837 1.00 39.10 S ATOM 0 H CYS A 806 -14.501 -18.155 49.740 1.00 31.91 H new ATOM 0 HA CYS A 806 -13.192 -18.774 51.921 1.00 33.07 H new ATOM 0 HB2 CYS A 806 -15.372 -17.753 51.975 1.00 32.48 H new ATOM 0 HB3 CYS A 806 -15.987 -19.131 51.581 1.00 32.48 H new ATOM 0 HG CYS A 806 -16.177 -18.525 54.386 1.00 39.10 H new ATOM 1125 N MET A 807 -14.353 -21.227 50.273 1.00 30.97 N ATOM 1126 CA MET A 807 -14.270 -22.672 50.138 1.00 30.17 C ATOM 1127 C MET A 807 -12.813 -23.076 50.019 1.00 28.74 C ATOM 1128 O MET A 807 -12.392 -24.046 50.635 1.00 27.61 O ATOM 1129 CB MET A 807 -15.048 -23.174 48.910 1.00 29.48 C ATOM 1130 CG MET A 807 -16.562 -23.248 49.120 1.00 32.28 C ATOM 1131 SD MET A 807 -17.404 -24.164 47.815 1.00 34.12 S ATOM 1132 CE MET A 807 -17.367 -22.977 46.549 1.00 30.19 C ATOM 0 H MET A 807 -14.759 -20.823 49.632 1.00 30.97 H new ATOM 0 HA MET A 807 -14.669 -23.075 50.925 1.00 30.17 H new ATOM 0 HB2 MET A 807 -14.863 -22.588 48.160 1.00 29.48 H new ATOM 0 HB3 MET A 807 -14.721 -24.055 48.669 1.00 29.48 H new ATOM 0 HG2 MET A 807 -16.746 -23.668 49.975 1.00 32.28 H new ATOM 0 HG3 MET A 807 -16.923 -22.349 49.163 1.00 32.28 H new ATOM 0 HE1 MET A 807 -17.666 -23.380 45.719 1.00 30.19 H new ATOM 0 HE2 MET A 807 -17.953 -22.239 46.779 1.00 30.19 H new ATOM 0 HE3 MET A 807 -16.461 -22.648 46.440 1.00 30.19 H new ATOM 1133 N LYS A 808 -12.042 -22.327 49.231 1.00 29.28 N ATOM 1134 CA LYS A 808 -10.629 -22.638 49.055 1.00 29.16 C ATOM 1135 C LYS A 808 -9.877 -22.536 50.380 1.00 29.64 C ATOM 1136 O LYS A 808 -9.035 -23.387 50.685 1.00 28.82 O ATOM 1137 CB LYS A 808 -9.990 -21.714 48.013 1.00 30.57 C ATOM 1138 CG LYS A 808 -8.553 -22.105 47.653 1.00 27.65 C ATOM 1139 CD LYS A 808 -8.099 -21.520 46.316 1.00 29.21 C ATOM 1140 CE LYS A 808 -8.124 -19.994 46.315 1.00 28.44 C ATOM 1141 NZ LYS A 808 -7.302 -19.412 47.421 1.00 27.82 N ATOM 0 H LYS A 808 -12.317 -21.640 48.793 1.00 29.28 H new ATOM 0 HA LYS A 808 -10.567 -23.552 48.736 1.00 29.16 H new ATOM 0 HB2 LYS A 808 -10.531 -21.722 47.208 1.00 30.57 H new ATOM 0 HB3 LYS A 808 -9.996 -20.804 48.350 1.00 30.57 H new ATOM 0 HG2 LYS A 808 -7.954 -21.803 48.354 1.00 27.65 H new ATOM 0 HG3 LYS A 808 -8.484 -23.072 47.619 1.00 27.65 H new ATOM 0 HD2 LYS A 808 -7.200 -21.827 46.119 1.00 29.21 H new ATOM 0 HD3 LYS A 808 -8.673 -21.852 45.608 1.00 29.21 H new ATOM 0 HE2 LYS A 808 -7.794 -19.668 45.463 1.00 28.44 H new ATOM 0 HE3 LYS A 808 -9.040 -19.688 46.400 1.00 28.44 H new ATOM 0 HZ1 LYS A 808 -6.921 -18.657 47.143 1.00 27.82 H new ATOM 0 HZ2 LYS A 808 -7.825 -19.240 48.121 1.00 27.82 H new ATOM 0 HZ3 LYS A 808 -6.670 -19.992 47.659 1.00 27.82 H new ATOM 1142 N ALA A 809 -10.174 -21.505 51.166 1.00 28.80 N ATOM 1143 CA ALA A 809 -9.520 -21.346 52.466 1.00 29.65 C ATOM 1144 C ALA A 809 -9.806 -22.581 53.335 1.00 31.43 C ATOM 1145 O ALA A 809 -8.902 -23.142 53.973 1.00 30.64 O ATOM 1146 CB ALA A 809 -10.030 -20.095 53.158 1.00 29.94 C ATOM 0 H ALA A 809 -10.744 -20.892 50.970 1.00 28.80 H new ATOM 0 HA ALA A 809 -8.563 -21.259 52.334 1.00 29.65 H new ATOM 0 HB1 ALA A 809 -9.591 -19.999 54.018 1.00 29.94 H new ATOM 0 HB2 ALA A 809 -9.837 -19.319 52.608 1.00 29.94 H new ATOM 0 HB3 ALA A 809 -10.988 -20.166 53.291 1.00 29.94 H new ATOM 1147 N LEU A 810 -11.062 -23.015 53.342 1.00 30.95 N ATOM 1148 CA LEU A 810 -11.462 -24.183 54.132 1.00 32.29 C ATOM 1149 C LEU A 810 -10.745 -25.468 53.688 1.00 32.28 C ATOM 1150 O LEU A 810 -10.553 -26.388 54.486 1.00 32.79 O ATOM 1151 CB LEU A 810 -12.985 -24.353 54.058 1.00 31.18 C ATOM 1152 CG LEU A 810 -13.690 -25.238 55.091 1.00 34.70 C ATOM 1153 CD1 LEU A 810 -13.204 -24.923 56.503 1.00 30.34 C ATOM 1154 CD2 LEU A 810 -15.190 -25.011 54.980 1.00 31.29 C ATOM 0 H LEU A 810 -11.701 -22.649 52.897 1.00 30.95 H new ATOM 0 HA LEU A 810 -11.196 -24.026 55.051 1.00 32.29 H new ATOM 0 HB2 LEU A 810 -13.380 -23.469 54.113 1.00 31.18 H new ATOM 0 HB3 LEU A 810 -13.197 -24.705 53.179 1.00 31.18 H new ATOM 0 HG LEU A 810 -13.483 -26.169 54.913 1.00 34.70 H new ATOM 0 HD11 LEU A 810 -13.663 -25.494 57.138 1.00 30.34 H new ATOM 0 HD12 LEU A 810 -12.248 -25.080 56.559 1.00 30.34 H new ATOM 0 HD13 LEU A 810 -13.391 -23.994 56.710 1.00 30.34 H new ATOM 0 HD21 LEU A 810 -15.650 -25.566 55.629 1.00 31.29 H new ATOM 0 HD22 LEU A 810 -15.390 -24.078 55.153 1.00 31.29 H new ATOM 0 HD23 LEU A 810 -15.488 -25.245 54.087 1.00 31.29 H new ATOM 1155 N LEU A 811 -10.343 -25.534 52.421 1.00 31.31 N ATOM 1156 CA LEU A 811 -9.625 -26.705 51.930 1.00 31.33 C ATOM 1157 C LEU A 811 -8.252 -26.862 52.597 1.00 31.50 C ATOM 1158 O LEU A 811 -7.724 -27.972 52.682 1.00 32.13 O ATOM 1159 CB LEU A 811 -9.445 -26.640 50.401 1.00 30.57 C ATOM 1160 CG LEU A 811 -10.645 -27.082 49.554 1.00 30.97 C ATOM 1161 CD1 LEU A 811 -10.314 -26.962 48.071 1.00 31.74 C ATOM 1162 CD2 LEU A 811 -11.006 -28.534 49.898 1.00 30.91 C ATOM 0 H LEU A 811 -10.475 -24.918 51.836 1.00 31.31 H new ATOM 0 HA LEU A 811 -10.165 -27.477 52.160 1.00 31.33 H new ATOM 0 HB2 LEU A 811 -9.222 -25.727 50.160 1.00 30.57 H new ATOM 0 HB3 LEU A 811 -8.684 -27.191 50.161 1.00 30.57 H new ATOM 0 HG LEU A 811 -11.402 -26.508 49.749 1.00 30.97 H new ATOM 0 HD11 LEU A 811 -11.079 -27.244 47.545 1.00 31.74 H new ATOM 0 HD12 LEU A 811 -10.099 -26.040 47.861 1.00 31.74 H new ATOM 0 HD13 LEU A 811 -9.553 -27.526 47.862 1.00 31.74 H new ATOM 0 HD21 LEU A 811 -11.765 -28.814 49.363 1.00 30.91 H new ATOM 0 HD22 LEU A 811 -10.248 -29.109 49.710 1.00 30.91 H new ATOM 0 HD23 LEU A 811 -11.234 -28.597 50.839 1.00 30.91 H new ATOM 1163 N LEU A 812 -7.664 -25.763 53.068 1.00 30.89 N ATOM 1164 CA LEU A 812 -6.360 -25.849 53.721 1.00 29.44 C ATOM 1165 C LEU A 812 -6.454 -26.537 55.087 1.00 29.99 C ATOM 1166 O LEU A 812 -5.456 -27.035 55.612 1.00 29.26 O ATOM 1167 CB LEU A 812 -5.753 -24.453 53.907 1.00 29.96 C ATOM 1168 CG LEU A 812 -4.427 -24.429 54.692 1.00 30.61 C ATOM 1169 CD1 LEU A 812 -3.332 -25.160 53.901 1.00 28.70 C ATOM 1170 CD2 LEU A 812 -4.015 -22.992 54.966 1.00 29.61 C ATOM 0 H LEU A 812 -7.997 -24.971 53.021 1.00 30.89 H new ATOM 0 HA LEU A 812 -5.790 -26.380 53.143 1.00 29.44 H new ATOM 0 HB2 LEU A 812 -5.605 -24.059 53.033 1.00 29.96 H new ATOM 0 HB3 LEU A 812 -6.397 -23.892 54.366 1.00 29.96 H new ATOM 0 HG LEU A 812 -4.551 -24.885 55.539 1.00 30.61 H new ATOM 0 HD11 LEU A 812 -2.502 -25.140 54.403 1.00 28.70 H new ATOM 0 HD12 LEU A 812 -3.598 -26.081 53.755 1.00 28.70 H new ATOM 0 HD13 LEU A 812 -3.203 -24.721 53.045 1.00 28.70 H new ATOM 0 HD21 LEU A 812 -3.180 -22.983 55.460 1.00 29.61 H new ATOM 0 HD22 LEU A 812 -3.898 -22.523 54.125 1.00 29.61 H new ATOM 0 HD23 LEU A 812 -4.704 -22.552 55.488 1.00 29.61 H new ATOM 1171 N PHE A 813 -7.653 -26.548 55.663 1.00 29.65 N ATOM 1172 CA PHE A 813 -7.877 -27.166 56.968 1.00 30.00 C ATOM 1173 C PHE A 813 -8.789 -28.386 56.806 1.00 29.97 C ATOM 1174 O PHE A 813 -9.586 -28.693 57.688 1.00 27.94 O ATOM 1175 CB PHE A 813 -8.543 -26.155 57.909 1.00 31.85 C ATOM 1176 CG PHE A 813 -7.855 -24.806 57.948 1.00 31.73 C ATOM 1177 CD1 PHE A 813 -6.579 -24.670 58.497 1.00 32.01 C ATOM 1178 CD2 PHE A 813 -8.480 -23.680 57.423 1.00 29.95 C ATOM 1179 CE1 PHE A 813 -5.936 -23.423 58.521 1.00 32.90 C ATOM 1180 CE2 PHE A 813 -7.855 -22.436 57.440 1.00 31.40 C ATOM 1181 CZ PHE A 813 -6.576 -22.304 57.992 1.00 31.29 C ATOM 0 H PHE A 813 -8.356 -26.200 55.311 1.00 29.65 H new ATOM 0 HA PHE A 813 -7.026 -27.444 57.342 1.00 30.00 H new ATOM 0 HB2 PHE A 813 -9.465 -26.030 57.635 1.00 31.85 H new ATOM 0 HB3 PHE A 813 -8.561 -26.525 58.806 1.00 31.85 H new ATOM 0 HD1 PHE A 813 -6.150 -25.415 58.851 1.00 32.01 H new ATOM 0 HD2 PHE A 813 -9.330 -23.759 57.054 1.00 29.95 H new ATOM 0 HE1 PHE A 813 -5.085 -23.344 58.889 1.00 32.90 H new ATOM 0 HE2 PHE A 813 -8.287 -21.693 57.085 1.00 31.40 H new ATOM 0 HZ PHE A 813 -6.156 -21.475 58.006 1.00 31.29 H new ATOM 1182 N SER A 814 -8.660 -29.085 55.680 1.00 30.13 N ATOM 1183 CA SER A 814 -9.508 -30.244 55.412 1.00 32.86 C ATOM 1184 C SER A 814 -8.837 -31.613 55.368 1.00 33.77 C ATOM 1185 O SER A 814 -9.434 -32.572 54.883 1.00 34.47 O ATOM 1186 CB SER A 814 -10.274 -30.022 54.109 1.00 30.42 C ATOM 1187 OG SER A 814 -11.213 -28.976 54.272 1.00 35.72 O ATOM 0 H SER A 814 -8.090 -28.906 55.061 1.00 30.13 H new ATOM 0 HA SER A 814 -10.086 -30.290 56.190 1.00 32.86 H new ATOM 0 HB2 SER A 814 -9.655 -29.803 53.395 1.00 30.42 H new ATOM 0 HB3 SER A 814 -10.729 -30.838 53.850 1.00 30.42 H new ATOM 0 HG SER A 814 -10.809 -28.241 54.320 1.00 35.72 H new ATOM 1188 N ILE A 815 -7.602 -31.706 55.851 1.00 34.19 N ATOM 1189 CA ILE A 815 -6.903 -32.986 55.877 1.00 36.80 C ATOM 1190 C ILE A 815 -5.855 -32.998 56.990 1.00 36.94 C ATOM 1191 O ILE A 815 -4.944 -32.168 57.014 1.00 36.31 O ATOM 1192 CB ILE A 815 -6.255 -33.317 54.501 1.00 38.33 C ATOM 1193 CG1 ILE A 815 -5.552 -34.674 54.574 1.00 41.55 C ATOM 1194 CG2 ILE A 815 -5.273 -32.239 54.097 1.00 41.53 C ATOM 1195 CD1 ILE A 815 -5.117 -35.208 53.224 1.00 42.58 C ATOM 0 H ILE A 815 -7.153 -31.044 56.167 1.00 34.19 H new ATOM 0 HA ILE A 815 -7.558 -33.677 56.060 1.00 36.80 H new ATOM 0 HB ILE A 815 -6.954 -33.356 53.830 1.00 38.33 H new ATOM 0 HG12 ILE A 815 -4.774 -34.596 55.148 1.00 41.55 H new ATOM 0 HG13 ILE A 815 -6.148 -35.316 54.990 1.00 41.55 H new ATOM 0 HG21 ILE A 815 -4.881 -32.463 53.239 1.00 41.53 H new ATOM 0 HG22 ILE A 815 -5.735 -31.389 54.028 1.00 41.53 H new ATOM 0 HG23 ILE A 815 -4.572 -32.173 54.765 1.00 41.53 H new ATOM 0 HD11 ILE A 815 -4.680 -36.066 53.341 1.00 42.58 H new ATOM 0 HD12 ILE A 815 -5.894 -35.316 52.653 1.00 42.58 H new ATOM 0 HD13 ILE A 815 -4.498 -34.584 52.813 1.00 42.58 H new ATOM 1196 N ILE A 816 -6.002 -33.948 57.913 1.00 36.91 N ATOM 1197 CA ILE A 816 -5.110 -34.073 59.070 1.00 38.55 C ATOM 1198 C ILE A 816 -4.721 -35.516 59.398 1.00 38.04 C ATOM 1199 O ILE A 816 -5.382 -36.458 58.967 1.00 36.78 O ATOM 1200 CB ILE A 816 -5.783 -33.487 60.332 1.00 39.76 C ATOM 1201 CG1 ILE A 816 -7.146 -34.153 60.535 1.00 38.33 C ATOM 1202 CG2 ILE A 816 -5.949 -31.977 60.190 1.00 40.51 C ATOM 1203 CD1 ILE A 816 -7.834 -33.767 61.814 1.00 41.51 C ATOM 0 H ILE A 816 -6.624 -34.541 57.887 1.00 36.91 H new ATOM 0 HA ILE A 816 -4.308 -33.587 58.824 1.00 38.55 H new ATOM 0 HB ILE A 816 -5.222 -33.661 61.104 1.00 39.76 H new ATOM 0 HG12 ILE A 816 -7.721 -33.924 59.788 1.00 38.33 H new ATOM 0 HG13 ILE A 816 -7.030 -35.116 60.519 1.00 38.33 H new ATOM 0 HG21 ILE A 816 -6.372 -31.621 60.987 1.00 40.51 H new ATOM 0 HG22 ILE A 816 -5.078 -31.565 60.075 1.00 40.51 H new ATOM 0 HG23 ILE A 816 -6.502 -31.783 59.417 1.00 40.51 H new ATOM 0 HD11 ILE A 816 -8.687 -34.225 61.874 1.00 41.51 H new ATOM 0 HD12 ILE A 816 -7.279 -34.018 62.569 1.00 41.51 H new ATOM 0 HD13 ILE A 816 -7.981 -32.808 61.826 1.00 41.51 H new ATOM 1204 N PRO A 817 -3.640 -35.704 60.178 1.00 39.89 N ATOM 1205 CA PRO A 817 -3.205 -37.058 60.544 1.00 40.75 C ATOM 1206 C PRO A 817 -4.177 -37.645 61.560 1.00 42.46 C ATOM 1207 O PRO A 817 -4.656 -36.928 62.449 1.00 41.12 O ATOM 1208 CB PRO A 817 -1.818 -36.826 61.136 1.00 39.44 C ATOM 1209 CG PRO A 817 -1.962 -35.493 61.778 1.00 41.01 C ATOM 1210 CD PRO A 817 -2.720 -34.696 60.738 1.00 40.36 C ATOM 0 HA PRO A 817 -3.182 -37.688 59.807 1.00 40.75 H new ATOM 0 HB2 PRO A 817 -1.580 -37.513 61.779 1.00 39.44 H new ATOM 0 HB3 PRO A 817 -1.129 -36.826 60.453 1.00 39.44 H new ATOM 0 HG2 PRO A 817 -2.450 -35.548 62.615 1.00 41.01 H new ATOM 0 HG3 PRO A 817 -1.100 -35.095 61.978 1.00 41.01 H new ATOM 0 HD2 PRO A 817 -3.198 -33.949 61.132 1.00 40.36 H new ATOM 0 HD3 PRO A 817 -2.129 -34.330 60.061 1.00 40.36 H new ATOM 1211 N VAL A 818 -4.485 -38.934 61.427 1.00 42.90 N ATOM 1212 CA VAL A 818 -5.412 -39.567 62.365 1.00 44.52 C ATOM 1213 C VAL A 818 -4.919 -39.402 63.801 1.00 44.26 C ATOM 1214 O VAL A 818 -5.721 -39.304 64.723 1.00 45.42 O ATOM 1215 CB VAL A 818 -5.607 -41.075 62.055 1.00 44.94 C ATOM 1216 CG1 VAL A 818 -6.298 -41.240 60.712 1.00 43.32 C ATOM 1217 CG2 VAL A 818 -4.264 -41.793 62.062 1.00 45.17 C ATOM 0 H VAL A 818 -4.176 -39.451 60.814 1.00 42.90 H new ATOM 0 HA VAL A 818 -6.268 -39.123 62.263 1.00 44.52 H new ATOM 0 HB VAL A 818 -6.166 -41.471 62.742 1.00 44.94 H new ATOM 0 HG11 VAL A 818 -6.417 -42.184 60.523 1.00 43.32 H new ATOM 0 HG12 VAL A 818 -7.164 -40.804 60.738 1.00 43.32 H new ATOM 0 HG13 VAL A 818 -5.754 -40.838 60.017 1.00 43.32 H new ATOM 0 HG21 VAL A 818 -4.399 -42.734 61.867 1.00 45.17 H new ATOM 0 HG22 VAL A 818 -3.685 -41.403 61.388 1.00 45.17 H new ATOM 0 HG23 VAL A 818 -3.852 -41.700 62.935 1.00 45.17 H new ATOM 1218 N ASP A 819 -3.598 -39.358 63.976 1.00 45.85 N ATOM 1219 CA ASP A 819 -2.976 -39.190 65.292 1.00 46.41 C ATOM 1220 C ASP A 819 -3.044 -37.745 65.782 1.00 45.52 C ATOM 1221 O ASP A 819 -2.438 -37.403 66.798 1.00 44.38 O ATOM 1222 CB ASP A 819 -1.502 -39.610 65.252 1.00 49.54 C ATOM 1223 CG ASP A 819 -1.305 -41.104 65.442 1.00 55.08 C ATOM 1224 OD1 ASP A 819 -0.132 -41.542 65.419 1.00 57.11 O ATOM 1225 OD2 ASP A 819 -2.305 -41.839 65.618 1.00 54.20 O ATOM 0 H ASP A 819 -3.033 -39.425 63.331 1.00 45.85 H new ATOM 0 HA ASP A 819 -3.475 -39.755 65.903 1.00 46.41 H new ATOM 0 HB2 ASP A 819 -1.118 -39.344 64.402 1.00 49.54 H new ATOM 0 HB3 ASP A 819 -1.016 -39.134 65.944 1.00 49.54 H new ATOM 1226 N GLY A 820 -3.759 -36.899 65.047 1.00 44.10 N ATOM 1227 CA GLY A 820 -3.882 -35.503 65.431 1.00 44.51 C ATOM 1228 C GLY A 820 -2.635 -34.673 65.172 1.00 43.42 C ATOM 1229 O GLY A 820 -1.566 -35.209 64.883 1.00 42.18 O ATOM 0 H GLY A 820 -4.177 -37.114 64.327 1.00 44.10 H new ATOM 0 HA2 GLY A 820 -4.626 -35.110 64.949 1.00 44.51 H new ATOM 0 HA3 GLY A 820 -4.099 -35.456 66.375 1.00 44.51 H new ATOM 1230 N LEU A 821 -2.782 -33.355 65.284 1.00 43.41 N ATOM 1231 CA LEU A 821 -1.686 -32.415 65.067 1.00 41.52 C ATOM 1232 C LEU A 821 -0.963 -32.100 66.372 1.00 42.81 C ATOM 1233 O LEU A 821 -1.354 -32.575 67.438 1.00 43.95 O ATOM 1234 CB LEU A 821 -2.236 -31.124 64.464 1.00 40.99 C ATOM 1235 CG LEU A 821 -2.827 -31.237 63.057 1.00 40.65 C ATOM 1236 CD1 LEU A 821 -3.684 -30.021 62.754 1.00 40.22 C ATOM 1237 CD2 LEU A 821 -1.701 -31.382 62.042 1.00 39.93 C ATOM 0 H LEU A 821 -3.527 -32.978 65.490 1.00 43.41 H new ATOM 0 HA LEU A 821 -1.050 -32.823 64.458 1.00 41.52 H new ATOM 0 HB2 LEU A 821 -2.922 -30.778 65.056 1.00 40.99 H new ATOM 0 HB3 LEU A 821 -1.522 -30.468 64.443 1.00 40.99 H new ATOM 0 HG LEU A 821 -3.393 -32.023 63.003 1.00 40.65 H new ATOM 0 HD11 LEU A 821 -4.055 -30.100 61.861 1.00 40.22 H new ATOM 0 HD12 LEU A 821 -4.406 -29.965 63.399 1.00 40.22 H new ATOM 0 HD13 LEU A 821 -3.140 -29.220 62.808 1.00 40.22 H new ATOM 0 HD21 LEU A 821 -2.076 -31.454 61.150 1.00 39.93 H new ATOM 0 HD22 LEU A 821 -1.122 -30.605 62.087 1.00 39.93 H new ATOM 0 HD23 LEU A 821 -1.187 -32.180 62.241 1.00 39.93 H new ATOM 1238 N LYS A 822 0.090 -31.294 66.287 1.00 42.15 N ATOM 1239 CA LYS A 822 0.853 -30.915 67.471 1.00 42.53 C ATOM 1240 C LYS A 822 -0.107 -30.232 68.443 1.00 41.93 C ATOM 1241 O LYS A 822 -0.188 -30.587 69.616 1.00 40.95 O ATOM 1242 CB LYS A 822 1.974 -29.952 67.090 1.00 44.12 C ATOM 1243 CG LYS A 822 3.219 -30.090 67.943 1.00 48.46 C ATOM 1244 CD LYS A 822 4.081 -31.263 67.482 1.00 52.19 C ATOM 1245 CE LYS A 822 4.547 -31.071 66.038 1.00 53.78 C ATOM 1246 NZ LYS A 822 5.598 -32.047 65.619 1.00 54.40 N ATOM 0 H LYS A 822 0.380 -30.955 65.552 1.00 42.15 H new ATOM 0 HA LYS A 822 1.253 -31.699 67.878 1.00 42.53 H new ATOM 0 HB2 LYS A 822 2.212 -30.098 66.161 1.00 44.12 H new ATOM 0 HB3 LYS A 822 1.644 -29.042 67.159 1.00 44.12 H new ATOM 0 HG2 LYS A 822 3.735 -29.270 67.900 1.00 48.46 H new ATOM 0 HG3 LYS A 822 2.965 -30.217 68.871 1.00 48.46 H new ATOM 0 HD2 LYS A 822 4.852 -31.350 68.065 1.00 52.19 H new ATOM 0 HD3 LYS A 822 3.576 -32.088 67.555 1.00 52.19 H new ATOM 0 HE2 LYS A 822 3.784 -31.154 65.445 1.00 53.78 H new ATOM 0 HE3 LYS A 822 4.891 -30.170 65.933 1.00 53.78 H new ATOM 0 HZ1 LYS A 822 5.830 -31.889 64.774 1.00 54.40 H new ATOM 0 HZ2 LYS A 822 6.311 -31.959 66.144 1.00 54.40 H new ATOM 0 HZ3 LYS A 822 5.279 -32.875 65.689 1.00 54.40 H new ATOM 1247 N ASN A 823 -0.834 -29.238 67.950 1.00 42.41 N ATOM 1248 CA ASN A 823 -1.807 -28.551 68.779 1.00 41.49 C ATOM 1249 C ASN A 823 -3.155 -28.609 68.067 1.00 41.42 C ATOM 1250 O ASN A 823 -3.581 -27.647 67.430 1.00 41.67 O ATOM 1251 CB ASN A 823 -1.402 -27.102 69.013 1.00 44.05 C ATOM 1252 CG ASN A 823 -2.149 -26.485 70.176 1.00 49.92 C ATOM 1253 OD1 ASN A 823 -3.348 -26.741 70.371 1.00 48.51 O ATOM 1254 ND2 ASN A 823 -1.452 -25.661 70.959 1.00 51.37 N ATOM 0 H ASN A 823 -0.778 -28.949 67.142 1.00 42.41 H new ATOM 0 HA ASN A 823 -1.859 -28.983 69.646 1.00 41.49 H new ATOM 0 HB2 ASN A 823 -0.448 -27.057 69.182 1.00 44.05 H new ATOM 0 HB3 ASN A 823 -1.572 -26.586 68.210 1.00 44.05 H new ATOM 0 HD21 ASN A 823 -1.832 -25.282 71.631 1.00 51.37 H new ATOM 0 HD22 ASN A 823 -0.622 -25.508 70.792 1.00 51.37 H new ATOM 1255 N GLN A 824 -3.810 -29.758 68.187 1.00 39.62 N ATOM 1256 CA GLN A 824 -5.101 -30.024 67.568 1.00 40.12 C ATOM 1257 C GLN A 824 -6.200 -29.017 67.931 1.00 40.57 C ATOM 1258 O GLN A 824 -7.007 -28.636 67.082 1.00 39.02 O ATOM 1259 CB GLN A 824 -5.546 -31.443 67.947 1.00 40.01 C ATOM 1260 CG GLN A 824 -6.758 -31.977 67.200 1.00 42.49 C ATOM 1261 CD GLN A 824 -6.506 -32.133 65.715 1.00 44.23 C ATOM 1262 OE1 GLN A 824 -5.475 -32.670 65.300 1.00 44.50 O ATOM 1263 NE2 GLN A 824 -7.454 -31.673 64.902 1.00 43.90 N ATOM 0 H GLN A 824 -3.507 -30.421 68.643 1.00 39.62 H new ATOM 0 HA GLN A 824 -4.975 -29.934 66.610 1.00 40.12 H new ATOM 0 HB2 GLN A 824 -4.803 -32.048 67.798 1.00 40.01 H new ATOM 0 HB3 GLN A 824 -5.739 -31.460 68.897 1.00 40.01 H new ATOM 0 HG2 GLN A 824 -7.011 -32.836 67.573 1.00 42.49 H new ATOM 0 HG3 GLN A 824 -7.508 -31.377 67.336 1.00 42.49 H new ATOM 0 HE21 GLN A 824 -8.159 -31.305 65.229 1.00 43.90 H new ATOM 0 HE22 GLN A 824 -7.362 -31.744 64.050 1.00 43.90 H new ATOM 1264 N LYS A 825 -6.244 -28.591 69.189 1.00 41.12 N ATOM 1265 CA LYS A 825 -7.273 -27.641 69.610 1.00 42.08 C ATOM 1266 C LYS A 825 -7.268 -26.342 68.806 1.00 39.83 C ATOM 1267 O LYS A 825 -8.324 -25.876 68.381 1.00 41.10 O ATOM 1268 CB LYS A 825 -7.151 -27.355 71.111 1.00 43.77 C ATOM 1269 CG LYS A 825 -7.994 -28.300 71.961 1.00 49.10 C ATOM 1270 CD LYS A 825 -9.478 -27.901 71.918 1.00 55.08 C ATOM 1271 CE LYS A 825 -10.421 -29.083 72.160 1.00 55.69 C ATOM 1272 NZ LYS A 825 -10.657 -29.874 70.908 1.00 58.20 N ATOM 0 H LYS A 825 -5.698 -28.834 69.807 1.00 41.12 H new ATOM 0 HA LYS A 825 -8.128 -28.062 69.431 1.00 42.08 H new ATOM 0 HB2 LYS A 825 -6.221 -27.430 71.376 1.00 43.77 H new ATOM 0 HB3 LYS A 825 -7.423 -26.440 71.285 1.00 43.77 H new ATOM 0 HG2 LYS A 825 -7.890 -29.209 71.640 1.00 49.10 H new ATOM 0 HG3 LYS A 825 -7.678 -28.285 72.878 1.00 49.10 H new ATOM 0 HD2 LYS A 825 -9.644 -27.219 72.587 1.00 55.08 H new ATOM 0 HD3 LYS A 825 -9.677 -27.506 71.055 1.00 55.08 H new ATOM 0 HE2 LYS A 825 -10.046 -29.662 72.842 1.00 55.69 H new ATOM 0 HE3 LYS A 825 -11.268 -28.756 72.500 1.00 55.69 H new ATOM 0 HZ1 LYS A 825 -11.207 -30.551 71.084 1.00 58.20 H new ATOM 0 HZ2 LYS A 825 -11.022 -29.349 70.289 1.00 58.20 H new ATOM 0 HZ3 LYS A 825 -9.882 -30.192 70.607 1.00 58.20 H new ATOM 1273 N PHE A 826 -6.092 -25.761 68.593 1.00 37.63 N ATOM 1274 CA PHE A 826 -5.996 -24.534 67.809 1.00 37.61 C ATOM 1275 C PHE A 826 -6.476 -24.768 66.379 1.00 35.95 C ATOM 1276 O PHE A 826 -7.082 -23.886 65.765 1.00 32.42 O ATOM 1277 CB PHE A 826 -4.559 -24.013 67.791 1.00 41.40 C ATOM 1278 CG PHE A 826 -4.200 -23.187 68.992 1.00 46.76 C ATOM 1279 CD1 PHE A 826 -4.790 -21.940 69.196 1.00 49.99 C ATOM 1280 CD2 PHE A 826 -3.283 -23.653 69.927 1.00 47.97 C ATOM 1281 CE1 PHE A 826 -4.468 -21.168 70.317 1.00 49.91 C ATOM 1282 CE2 PHE A 826 -2.953 -22.895 71.048 1.00 48.49 C ATOM 1283 CZ PHE A 826 -3.547 -21.649 71.244 1.00 50.28 C ATOM 0 H PHE A 826 -5.342 -26.058 68.891 1.00 37.63 H new ATOM 0 HA PHE A 826 -6.565 -23.869 68.227 1.00 37.61 H new ATOM 0 HB2 PHE A 826 -3.951 -24.767 67.734 1.00 41.40 H new ATOM 0 HB3 PHE A 826 -4.427 -23.480 66.991 1.00 41.40 H new ATOM 0 HD1 PHE A 826 -5.406 -21.617 68.578 1.00 49.99 H new ATOM 0 HD2 PHE A 826 -2.884 -24.484 69.802 1.00 47.97 H new ATOM 0 HE1 PHE A 826 -4.867 -20.337 70.443 1.00 49.91 H new ATOM 0 HE2 PHE A 826 -2.337 -23.220 71.665 1.00 48.49 H new ATOM 0 HZ PHE A 826 -3.329 -21.141 71.992 1.00 50.28 H new ATOM 1284 N PHE A 827 -6.208 -25.956 65.848 1.00 34.66 N ATOM 1285 CA PHE A 827 -6.644 -26.285 64.496 1.00 33.62 C ATOM 1286 C PHE A 827 -8.170 -26.398 64.429 1.00 33.70 C ATOM 1287 O PHE A 827 -8.807 -25.868 63.515 1.00 32.86 O ATOM 1288 CB PHE A 827 -6.014 -27.599 64.036 1.00 30.55 C ATOM 1289 CG PHE A 827 -6.582 -28.116 62.740 1.00 31.80 C ATOM 1290 CD1 PHE A 827 -7.779 -28.840 62.724 1.00 30.62 C ATOM 1291 CD2 PHE A 827 -5.939 -27.857 61.529 1.00 29.41 C ATOM 1292 CE1 PHE A 827 -8.327 -29.298 61.512 1.00 31.48 C ATOM 1293 CE2 PHE A 827 -6.478 -28.311 60.314 1.00 30.44 C ATOM 1294 CZ PHE A 827 -7.675 -29.034 60.306 1.00 28.24 C ATOM 0 H PHE A 827 -5.778 -26.582 66.251 1.00 34.66 H new ATOM 0 HA PHE A 827 -6.356 -25.570 63.908 1.00 33.62 H new ATOM 0 HB2 PHE A 827 -5.058 -27.473 63.934 1.00 30.55 H new ATOM 0 HB3 PHE A 827 -6.140 -28.269 64.726 1.00 30.55 H new ATOM 0 HD1 PHE A 827 -8.218 -29.021 63.524 1.00 30.62 H new ATOM 0 HD2 PHE A 827 -5.142 -27.377 61.526 1.00 29.41 H new ATOM 0 HE1 PHE A 827 -9.124 -29.777 61.514 1.00 31.48 H new ATOM 0 HE2 PHE A 827 -6.039 -28.131 59.514 1.00 30.44 H new ATOM 0 HZ PHE A 827 -8.034 -29.337 59.503 1.00 28.24 H new ATOM 1295 N ASP A 828 -8.746 -27.096 65.401 1.00 35.41 N ATOM 1296 CA ASP A 828 -10.191 -27.289 65.460 1.00 37.36 C ATOM 1297 C ASP A 828 -10.909 -25.950 65.537 1.00 36.79 C ATOM 1298 O ASP A 828 -11.938 -25.749 64.902 1.00 36.03 O ATOM 1299 CB ASP A 828 -10.569 -28.143 66.680 1.00 38.93 C ATOM 1300 CG ASP A 828 -10.039 -29.568 66.590 1.00 38.35 C ATOM 1301 OD1 ASP A 828 -9.797 -30.037 65.460 1.00 38.94 O ATOM 1302 OD2 ASP A 828 -9.883 -30.225 67.647 1.00 39.70 O ATOM 0 H ASP A 828 -8.313 -27.470 66.043 1.00 35.41 H new ATOM 0 HA ASP A 828 -10.465 -27.748 64.651 1.00 37.36 H new ATOM 0 HB2 ASP A 828 -10.222 -27.724 67.483 1.00 38.93 H new ATOM 0 HB3 ASP A 828 -11.535 -28.166 66.766 1.00 38.93 H new ATOM 1303 N GLU A 829 -10.350 -25.043 66.328 1.00 38.60 N ATOM 1304 CA GLU A 829 -10.902 -23.707 66.512 1.00 40.22 C ATOM 1305 C GLU A 829 -10.864 -22.951 65.180 1.00 39.23 C ATOM 1306 O GLU A 829 -11.838 -22.310 64.779 1.00 37.87 O ATOM 1307 CB GLU A 829 -10.071 -22.969 67.568 1.00 44.01 C ATOM 1308 CG GLU A 829 -10.530 -21.566 67.922 1.00 50.33 C ATOM 1309 CD GLU A 829 -9.603 -20.901 68.938 1.00 54.36 C ATOM 1310 OE1 GLU A 829 -9.455 -21.443 70.058 1.00 55.42 O ATOM 1311 OE2 GLU A 829 -9.022 -19.840 68.619 1.00 54.94 O ATOM 0 H GLU A 829 -9.632 -25.187 66.778 1.00 38.60 H new ATOM 0 HA GLU A 829 -11.823 -23.764 66.811 1.00 40.22 H new ATOM 0 HB2 GLU A 829 -10.066 -23.502 68.379 1.00 44.01 H new ATOM 0 HB3 GLU A 829 -9.154 -22.920 67.255 1.00 44.01 H new ATOM 0 HG2 GLU A 829 -10.567 -21.026 67.117 1.00 50.33 H new ATOM 0 HG3 GLU A 829 -11.430 -21.602 68.281 1.00 50.33 H new ATOM 1312 N LEU A 830 -9.737 -23.049 64.489 1.00 37.42 N ATOM 1313 CA LEU A 830 -9.565 -22.375 63.211 1.00 37.05 C ATOM 1314 C LEU A 830 -10.526 -22.921 62.157 1.00 35.87 C ATOM 1315 O LEU A 830 -11.222 -22.161 61.492 1.00 36.42 O ATOM 1316 CB LEU A 830 -8.115 -22.529 62.750 1.00 39.62 C ATOM 1317 CG LEU A 830 -7.566 -21.521 61.740 1.00 41.84 C ATOM 1318 CD1 LEU A 830 -7.973 -20.105 62.128 1.00 42.21 C ATOM 1319 CD2 LEU A 830 -6.044 -21.655 61.695 1.00 43.24 C ATOM 0 H LEU A 830 -9.054 -23.505 64.745 1.00 37.42 H new ATOM 0 HA LEU A 830 -9.770 -21.434 63.327 1.00 37.05 H new ATOM 0 HB2 LEU A 830 -7.549 -22.498 63.537 1.00 39.62 H new ATOM 0 HB3 LEU A 830 -8.019 -23.415 62.367 1.00 39.62 H new ATOM 0 HG LEU A 830 -7.933 -21.702 60.861 1.00 41.84 H new ATOM 0 HD11 LEU A 830 -7.618 -19.477 61.479 1.00 42.21 H new ATOM 0 HD12 LEU A 830 -8.941 -20.039 62.145 1.00 42.21 H new ATOM 0 HD13 LEU A 830 -7.620 -19.896 63.007 1.00 42.21 H new ATOM 0 HD21 LEU A 830 -5.682 -21.020 61.057 1.00 43.24 H new ATOM 0 HD22 LEU A 830 -5.677 -21.474 62.574 1.00 43.24 H new ATOM 0 HD23 LEU A 830 -5.806 -22.556 61.425 1.00 43.24 H new ATOM 1320 N ARG A 831 -10.571 -24.240 62.007 1.00 35.19 N ATOM 1321 CA ARG A 831 -11.468 -24.848 61.033 1.00 35.17 C ATOM 1322 C ARG A 831 -12.925 -24.457 61.301 1.00 35.90 C ATOM 1323 O ARG A 831 -13.669 -24.129 60.374 1.00 35.69 O ATOM 1324 CB ARG A 831 -11.334 -26.376 61.056 1.00 34.07 C ATOM 1325 CG ARG A 831 -12.332 -27.092 60.146 1.00 31.97 C ATOM 1326 CD ARG A 831 -12.245 -28.607 60.297 1.00 30.01 C ATOM 1327 NE ARG A 831 -13.385 -29.298 59.701 1.00 28.39 N ATOM 1328 CZ ARG A 831 -13.570 -29.478 58.394 1.00 31.91 C ATOM 1329 NH1 ARG A 831 -12.685 -29.018 57.504 1.00 30.06 N ATOM 1330 NH2 ARG A 831 -14.638 -30.139 57.972 1.00 30.03 N ATOM 0 H ARG A 831 -10.094 -24.797 62.456 1.00 35.19 H new ATOM 0 HA ARG A 831 -11.215 -24.518 60.157 1.00 35.17 H new ATOM 0 HB2 ARG A 831 -10.433 -26.618 60.789 1.00 34.07 H new ATOM 0 HB3 ARG A 831 -11.455 -26.690 61.966 1.00 34.07 H new ATOM 0 HG2 ARG A 831 -13.232 -26.797 60.356 1.00 31.97 H new ATOM 0 HG3 ARG A 831 -12.162 -26.848 59.223 1.00 31.97 H new ATOM 0 HD2 ARG A 831 -11.427 -28.923 59.883 1.00 30.01 H new ATOM 0 HD3 ARG A 831 -12.191 -28.832 61.239 1.00 30.01 H new ATOM 0 HE ARG A 831 -13.982 -29.613 60.234 1.00 28.39 H new ATOM 0 HH11 ARG A 831 -11.984 -28.599 57.772 1.00 30.06 H new ATOM 0 HH12 ARG A 831 -12.817 -29.141 56.663 1.00 30.06 H new ATOM 0 HH21 ARG A 831 -15.205 -30.448 58.540 1.00 30.03 H new ATOM 0 HH22 ARG A 831 -14.764 -30.259 57.130 1.00 30.03 H new ATOM 1331 N MET A 832 -13.335 -24.499 62.565 1.00 35.82 N ATOM 1332 CA MET A 832 -14.705 -24.144 62.919 1.00 36.91 C ATOM 1333 C MET A 832 -15.036 -22.719 62.490 1.00 35.72 C ATOM 1334 O MET A 832 -16.115 -22.455 61.950 1.00 36.50 O ATOM 1335 CB MET A 832 -14.936 -24.277 64.431 1.00 38.22 C ATOM 1336 CG MET A 832 -16.256 -23.660 64.884 1.00 40.03 C ATOM 1337 SD MET A 832 -16.601 -23.852 66.645 1.00 47.31 S ATOM 1338 CE MET A 832 -15.448 -22.661 67.385 1.00 41.84 C ATOM 0 H MET A 832 -12.839 -24.729 63.229 1.00 35.82 H new ATOM 0 HA MET A 832 -15.288 -24.761 62.449 1.00 36.91 H new ATOM 0 HB2 MET A 832 -14.922 -25.216 64.675 1.00 38.22 H new ATOM 0 HB3 MET A 832 -14.205 -23.850 64.904 1.00 38.22 H new ATOM 0 HG2 MET A 832 -16.250 -22.714 64.668 1.00 40.03 H new ATOM 0 HG3 MET A 832 -16.979 -24.062 64.378 1.00 40.03 H new ATOM 0 HE1 MET A 832 -15.544 -22.675 68.350 1.00 41.84 H new ATOM 0 HE2 MET A 832 -14.539 -22.900 67.147 1.00 41.84 H new ATOM 0 HE3 MET A 832 -15.645 -21.771 67.054 1.00 41.84 H new ATOM 1339 N ASN A 833 -14.110 -21.800 62.736 1.00 34.20 N ATOM 1340 CA ASN A 833 -14.333 -20.413 62.368 1.00 34.40 C ATOM 1341 C ASN A 833 -14.460 -20.208 60.867 1.00 34.81 C ATOM 1342 O ASN A 833 -15.213 -19.342 60.427 1.00 32.74 O ATOM 1343 CB ASN A 833 -13.229 -19.528 62.940 1.00 35.26 C ATOM 1344 CG ASN A 833 -13.483 -19.169 64.391 1.00 38.29 C ATOM 1345 OD1 ASN A 833 -14.612 -18.872 64.766 1.00 40.61 O ATOM 1346 ND2 ASN A 833 -12.438 -19.182 65.208 1.00 37.80 N ATOM 0 H ASN A 833 -13.353 -21.959 63.112 1.00 34.20 H new ATOM 0 HA ASN A 833 -15.185 -20.155 62.754 1.00 34.40 H new ATOM 0 HB2 ASN A 833 -12.377 -19.986 62.865 1.00 35.26 H new ATOM 0 HB3 ASN A 833 -13.161 -18.716 62.414 1.00 35.26 H new ATOM 0 HD21 ASN A 833 -12.538 -18.977 66.037 1.00 37.80 H new ATOM 0 HD22 ASN A 833 -11.661 -19.396 64.909 1.00 37.80 H new ATOM 1347 N TYR A 834 -13.736 -21.001 60.080 1.00 32.31 N ATOM 1348 CA TYR A 834 -13.829 -20.872 58.634 1.00 32.90 C ATOM 1349 C TYR A 834 -15.142 -21.467 58.121 1.00 33.35 C ATOM 1350 O TYR A 834 -15.664 -21.052 57.088 1.00 33.82 O ATOM 1351 CB TYR A 834 -12.620 -21.518 57.949 1.00 32.04 C ATOM 1352 CG TYR A 834 -11.429 -20.579 57.868 1.00 32.74 C ATOM 1353 CD1 TYR A 834 -10.665 -20.285 58.996 1.00 31.54 C ATOM 1354 CD2 TYR A 834 -11.122 -19.918 56.678 1.00 32.77 C ATOM 1355 CE1 TYR A 834 -9.632 -19.354 58.946 1.00 33.50 C ATOM 1356 CE2 TYR A 834 -10.093 -18.984 56.615 1.00 33.88 C ATOM 1357 CZ TYR A 834 -9.355 -18.704 57.753 1.00 34.37 C ATOM 1358 OH TYR A 834 -8.361 -17.758 57.702 1.00 35.44 O ATOM 0 H TYR A 834 -13.195 -21.609 60.359 1.00 32.31 H new ATOM 0 HA TYR A 834 -13.824 -19.928 58.412 1.00 32.90 H new ATOM 0 HB2 TYR A 834 -12.365 -22.318 58.435 1.00 32.04 H new ATOM 0 HB3 TYR A 834 -12.870 -21.797 57.054 1.00 32.04 H new ATOM 0 HD1 TYR A 834 -10.849 -20.719 59.797 1.00 31.54 H new ATOM 0 HD2 TYR A 834 -11.615 -20.106 55.912 1.00 32.77 H new ATOM 0 HE1 TYR A 834 -9.131 -19.169 59.707 1.00 33.50 H new ATOM 0 HE2 TYR A 834 -9.902 -18.551 55.815 1.00 33.88 H new ATOM 0 HH TYR A 834 -8.071 -17.613 58.477 1.00 35.44 H new ATOM 1359 N ILE A 835 -15.687 -22.436 58.843 1.00 33.54 N ATOM 1360 CA ILE A 835 -16.963 -23.010 58.433 1.00 34.90 C ATOM 1361 C ILE A 835 -18.025 -21.949 58.738 1.00 35.58 C ATOM 1362 O ILE A 835 -18.937 -21.713 57.945 1.00 34.07 O ATOM 1363 CB ILE A 835 -17.258 -24.321 59.195 1.00 34.41 C ATOM 1364 CG1 ILE A 835 -16.264 -25.403 58.738 1.00 35.07 C ATOM 1365 CG2 ILE A 835 -18.700 -24.759 58.957 1.00 35.82 C ATOM 1366 CD1 ILE A 835 -16.550 -26.801 59.269 1.00 32.10 C ATOM 0 H ILE A 835 -15.345 -22.770 59.558 1.00 33.54 H new ATOM 0 HA ILE A 835 -16.954 -23.240 57.491 1.00 34.90 H new ATOM 0 HB ILE A 835 -17.149 -24.178 60.148 1.00 34.41 H new ATOM 0 HG12 ILE A 835 -16.262 -25.433 57.768 1.00 35.07 H new ATOM 0 HG13 ILE A 835 -15.372 -25.142 59.015 1.00 35.07 H new ATOM 0 HG21 ILE A 835 -18.872 -25.582 59.440 1.00 35.82 H new ATOM 0 HG22 ILE A 835 -19.304 -24.068 59.271 1.00 35.82 H new ATOM 0 HG23 ILE A 835 -18.842 -24.906 58.009 1.00 35.82 H new ATOM 0 HD11 ILE A 835 -15.880 -27.418 58.935 1.00 32.10 H new ATOM 0 HD12 ILE A 835 -16.524 -26.791 60.239 1.00 32.10 H new ATOM 0 HD13 ILE A 835 -17.428 -27.087 58.972 1.00 32.10 H new ATOM 1367 N LYS A 836 -17.885 -21.299 59.886 1.00 37.68 N ATOM 1368 CA LYS A 836 -18.805 -20.240 60.285 1.00 42.35 C ATOM 1369 C LYS A 836 -18.844 -19.140 59.222 1.00 44.07 C ATOM 1370 O LYS A 836 -19.914 -18.645 58.865 1.00 45.05 O ATOM 1371 CB LYS A 836 -18.370 -19.635 61.620 1.00 43.21 C ATOM 1372 CG LYS A 836 -19.115 -18.351 61.986 1.00 49.16 C ATOM 1373 CD LYS A 836 -18.708 -17.810 63.350 1.00 49.96 C ATOM 1374 CE LYS A 836 -19.289 -18.647 64.488 1.00 54.35 C ATOM 1375 NZ LYS A 836 -18.808 -20.063 64.482 1.00 53.94 N ATOM 0 H LYS A 836 -17.258 -21.457 60.453 1.00 37.68 H new ATOM 0 HA LYS A 836 -19.690 -20.626 60.380 1.00 42.35 H new ATOM 0 HB2 LYS A 836 -18.507 -20.290 62.322 1.00 43.21 H new ATOM 0 HB3 LYS A 836 -17.419 -19.449 61.587 1.00 43.21 H new ATOM 0 HG2 LYS A 836 -18.944 -17.677 61.310 1.00 49.16 H new ATOM 0 HG3 LYS A 836 -20.070 -18.522 61.981 1.00 49.16 H new ATOM 0 HD2 LYS A 836 -17.740 -17.799 63.418 1.00 49.96 H new ATOM 0 HD3 LYS A 836 -19.009 -16.892 63.437 1.00 49.96 H new ATOM 0 HE2 LYS A 836 -19.057 -18.236 65.335 1.00 54.35 H new ATOM 0 HE3 LYS A 836 -20.257 -18.640 64.425 1.00 54.35 H new ATOM 0 HZ1 LYS A 836 -18.790 -20.374 65.316 1.00 53.94 H new ATOM 0 HZ2 LYS A 836 -19.358 -20.562 63.991 1.00 53.94 H new ATOM 0 HZ3 LYS A 836 -17.989 -20.097 64.136 1.00 53.94 H new ATOM 1376 N GLU A 837 -17.674 -18.757 58.720 1.00 44.81 N ATOM 1377 CA GLU A 837 -17.595 -17.718 57.700 1.00 45.31 C ATOM 1378 C GLU A 837 -18.280 -18.151 56.409 1.00 45.79 C ATOM 1379 O GLU A 837 -18.973 -17.356 55.774 1.00 45.75 O ATOM 1380 CB GLU A 837 -16.135 -17.353 57.412 1.00 44.28 C ATOM 1381 CG GLU A 837 -15.445 -16.570 58.527 1.00 44.66 C ATOM 1382 CD GLU A 837 -16.191 -15.294 58.897 1.00 46.19 C ATOM 1383 OE1 GLU A 837 -16.687 -14.598 57.983 1.00 46.02 O ATOM 1384 OE2 GLU A 837 -16.270 -14.977 60.101 1.00 45.98 O ATOM 0 H GLU A 837 -16.915 -19.086 58.956 1.00 44.81 H new ATOM 0 HA GLU A 837 -18.057 -16.938 58.045 1.00 45.31 H new ATOM 0 HB2 GLU A 837 -15.636 -18.169 57.249 1.00 44.28 H new ATOM 0 HB3 GLU A 837 -16.099 -16.830 56.596 1.00 44.28 H new ATOM 0 HG2 GLU A 837 -15.367 -17.134 59.312 1.00 44.66 H new ATOM 0 HG3 GLU A 837 -14.544 -16.344 58.249 1.00 44.66 H new ATOM 1385 N LEU A 838 -18.082 -19.406 56.018 1.00 46.31 N ATOM 1386 CA LEU A 838 -18.707 -19.919 54.804 1.00 49.41 C ATOM 1387 C LEU A 838 -20.218 -19.864 54.982 1.00 50.27 C ATOM 1388 O LEU A 838 -20.959 -19.555 54.051 1.00 50.10 O ATOM 1389 CB LEU A 838 -18.276 -21.368 54.540 1.00 48.97 C ATOM 1390 CG LEU A 838 -18.904 -22.038 53.305 1.00 50.57 C ATOM 1391 CD1 LEU A 838 -18.465 -21.304 52.045 1.00 49.87 C ATOM 1392 CD2 LEU A 838 -18.490 -23.498 53.227 1.00 50.40 C ATOM 0 H LEU A 838 -17.592 -19.974 56.439 1.00 46.31 H new ATOM 0 HA LEU A 838 -18.431 -19.378 54.048 1.00 49.41 H new ATOM 0 HB2 LEU A 838 -17.311 -21.388 54.443 1.00 48.97 H new ATOM 0 HB3 LEU A 838 -18.493 -21.900 55.321 1.00 48.97 H new ATOM 0 HG LEU A 838 -19.870 -21.995 53.381 1.00 50.57 H new ATOM 0 HD11 LEU A 838 -18.862 -21.728 51.268 1.00 49.87 H new ATOM 0 HD12 LEU A 838 -18.755 -20.379 52.091 1.00 49.87 H new ATOM 0 HD13 LEU A 838 -17.498 -21.336 51.972 1.00 49.87 H new ATOM 0 HD21 LEU A 838 -18.892 -23.907 52.445 1.00 50.40 H new ATOM 0 HD22 LEU A 838 -17.524 -23.558 53.162 1.00 50.40 H new ATOM 0 HD23 LEU A 838 -18.789 -23.962 54.024 1.00 50.40 H new ATOM 1393 N ASP A 839 -20.660 -20.154 56.200 1.00 52.63 N ATOM 1394 CA ASP A 839 -22.076 -20.158 56.533 1.00 54.17 C ATOM 1395 C ASP A 839 -22.705 -18.763 56.424 1.00 54.48 C ATOM 1396 O ASP A 839 -23.844 -18.631 55.971 1.00 53.41 O ATOM 1397 CB ASP A 839 -22.265 -20.727 57.944 1.00 57.20 C ATOM 1398 CG ASP A 839 -23.676 -21.223 58.192 1.00 59.68 C ATOM 1399 OD1 ASP A 839 -24.160 -22.070 57.410 1.00 59.98 O ATOM 1400 OD2 ASP A 839 -24.302 -20.770 59.173 1.00 62.67 O ATOM 0 H ASP A 839 -20.144 -20.355 56.858 1.00 52.63 H new ATOM 0 HA ASP A 839 -22.533 -20.720 55.888 1.00 54.17 H new ATOM 0 HB2 ASP A 839 -21.641 -21.457 58.080 1.00 57.20 H new ATOM 0 HB3 ASP A 839 -22.048 -20.043 58.596 1.00 57.20 H new ATOM 1401 N ARG A 840 -21.972 -17.723 56.823 1.00 54.43 N ATOM 1402 CA ARG A 840 -22.508 -16.363 56.746 1.00 55.71 C ATOM 1403 C ARG A 840 -22.446 -15.777 55.336 1.00 55.91 C ATOM 1404 O ARG A 840 -23.196 -14.858 55.005 1.00 55.08 O ATOM 1405 CB ARG A 840 -21.791 -15.423 57.725 1.00 56.28 C ATOM 1406 CG ARG A 840 -20.290 -15.322 57.560 1.00 58.82 C ATOM 1407 CD ARG A 840 -19.759 -14.032 58.185 1.00 61.18 C ATOM 1408 NE ARG A 840 -20.282 -13.787 59.531 1.00 64.08 N ATOM 1409 CZ ARG A 840 -19.989 -14.514 60.608 1.00 64.83 C ATOM 1410 NH1 ARG A 840 -19.165 -15.552 60.519 1.00 66.51 N ATOM 1411 NH2 ARG A 840 -20.527 -14.202 61.780 1.00 64.59 N ATOM 0 H ARG A 840 -21.173 -17.781 57.137 1.00 54.43 H new ATOM 0 HA ARG A 840 -23.443 -16.434 56.994 1.00 55.71 H new ATOM 0 HB2 ARG A 840 -22.170 -14.535 57.631 1.00 56.28 H new ATOM 0 HB3 ARG A 840 -21.981 -15.719 58.629 1.00 56.28 H new ATOM 0 HG2 ARG A 840 -19.863 -16.087 57.976 1.00 58.82 H new ATOM 0 HG3 ARG A 840 -20.062 -15.347 56.618 1.00 58.82 H new ATOM 0 HD2 ARG A 840 -18.791 -14.072 58.223 1.00 61.18 H new ATOM 0 HD3 ARG A 840 -19.990 -13.283 57.613 1.00 61.18 H new ATOM 0 HE ARG A 840 -20.819 -13.123 59.634 1.00 64.08 H new ATOM 0 HH11 ARG A 840 -18.815 -15.760 59.761 1.00 66.51 H new ATOM 0 HH12 ARG A 840 -18.981 -16.016 61.219 1.00 66.51 H new ATOM 0 HH21 ARG A 840 -21.063 -13.532 61.842 1.00 64.59 H new ATOM 0 HH22 ARG A 840 -20.340 -14.669 62.477 1.00 64.59 H new ATOM 1412 N ILE A 841 -21.546 -16.302 54.513 1.00 56.40 N ATOM 1413 CA ILE A 841 -21.422 -15.841 53.139 1.00 57.95 C ATOM 1414 C ILE A 841 -22.670 -16.327 52.407 1.00 58.59 C ATOM 1415 O ILE A 841 -23.142 -15.702 51.455 1.00 58.71 O ATOM 1416 CB ILE A 841 -20.157 -16.430 52.466 1.00 58.34 C ATOM 1417 CG1 ILE A 841 -18.904 -15.867 53.143 1.00 58.66 C ATOM 1418 CG2 ILE A 841 -20.140 -16.096 50.976 1.00 59.21 C ATOM 1419 CD1 ILE A 841 -17.600 -16.408 52.586 1.00 58.28 C ATOM 0 H ILE A 841 -20.997 -16.927 54.732 1.00 56.40 H new ATOM 0 HA ILE A 841 -21.340 -14.875 53.110 1.00 57.95 H new ATOM 0 HB ILE A 841 -20.170 -17.395 52.565 1.00 58.34 H new ATOM 0 HG12 ILE A 841 -18.906 -14.901 53.053 1.00 58.66 H new ATOM 0 HG13 ILE A 841 -18.945 -16.064 54.092 1.00 58.66 H new ATOM 0 HG21 ILE A 841 -19.343 -16.471 50.569 1.00 59.21 H new ATOM 0 HG22 ILE A 841 -20.927 -16.472 50.551 1.00 59.21 H new ATOM 0 HG23 ILE A 841 -20.139 -15.133 50.860 1.00 59.21 H new ATOM 0 HD11 ILE A 841 -16.855 -16.009 53.061 1.00 58.28 H new ATOM 0 HD12 ILE A 841 -17.575 -17.371 52.698 1.00 58.28 H new ATOM 0 HD13 ILE A 841 -17.536 -16.190 51.643 1.00 58.28 H new ATOM 1420 N ILE A 842 -23.201 -17.448 52.882 1.00 58.64 N ATOM 1421 CA ILE A 842 -24.394 -18.057 52.317 1.00 59.18 C ATOM 1422 C ILE A 842 -25.657 -17.316 52.744 1.00 61.35 C ATOM 1423 O ILE A 842 -26.638 -17.283 52.005 1.00 61.16 O ATOM 1424 CB ILE A 842 -24.521 -19.531 52.762 1.00 57.36 C ATOM 1425 CG1 ILE A 842 -23.352 -20.342 52.200 1.00 56.33 C ATOM 1426 CG2 ILE A 842 -25.857 -20.111 52.305 1.00 56.01 C ATOM 1427 CD1 ILE A 842 -23.374 -21.804 52.594 1.00 54.18 C ATOM 0 H ILE A 842 -22.873 -17.880 53.549 1.00 58.64 H new ATOM 0 HA ILE A 842 -24.304 -18.007 51.352 1.00 59.18 H new ATOM 0 HB ILE A 842 -24.492 -19.576 53.731 1.00 57.36 H new ATOM 0 HG12 ILE A 842 -23.360 -20.277 51.232 1.00 56.33 H new ATOM 0 HG13 ILE A 842 -22.520 -19.947 52.504 1.00 56.33 H new ATOM 0 HG21 ILE A 842 -25.923 -21.036 52.591 1.00 56.01 H new ATOM 0 HG22 ILE A 842 -26.583 -19.599 52.696 1.00 56.01 H new ATOM 0 HG23 ILE A 842 -25.915 -20.067 51.338 1.00 56.01 H new ATOM 0 HD11 ILE A 842 -22.609 -22.256 52.205 1.00 54.18 H new ATOM 0 HD12 ILE A 842 -23.337 -21.880 53.560 1.00 54.18 H new ATOM 0 HD13 ILE A 842 -24.190 -22.215 52.269 1.00 54.18 H new ATOM 1428 N ALA A 843 -25.629 -16.715 53.929 1.00 63.71 N ATOM 1429 CA ALA A 843 -26.794 -16.005 54.446 1.00 66.72 C ATOM 1430 C ALA A 843 -26.749 -14.490 54.262 1.00 69.81 C ATOM 1431 O ALA A 843 -27.478 -13.759 54.934 1.00 69.70 O ATOM 1432 CB ALA A 843 -26.984 -16.343 55.915 1.00 65.71 C ATOM 0 H ALA A 843 -24.945 -16.707 54.450 1.00 63.71 H new ATOM 0 HA ALA A 843 -27.549 -16.309 53.918 1.00 66.72 H new ATOM 0 HB1 ALA A 843 -27.759 -15.871 56.258 1.00 65.71 H new ATOM 0 HB2 ALA A 843 -27.119 -17.299 56.013 1.00 65.71 H new ATOM 0 HB3 ALA A 843 -26.196 -16.076 56.413 1.00 65.71 H new ATOM 1433 N CYS A 844 -25.901 -14.019 53.355 1.00 73.83 N ATOM 1434 CA CYS A 844 -25.786 -12.587 53.095 1.00 77.58 C ATOM 1435 C CYS A 844 -27.037 -12.074 52.392 1.00 79.83 C ATOM 1436 O CYS A 844 -27.759 -11.228 52.923 1.00 80.08 O ATOM 1437 CB CYS A 844 -24.561 -12.298 52.225 1.00 78.62 C ATOM 1438 SG CYS A 844 -24.388 -10.556 51.740 1.00 81.91 S ATOM 0 H CYS A 844 -25.382 -14.512 52.878 1.00 73.83 H new ATOM 0 HA CYS A 844 -25.687 -12.132 53.946 1.00 77.58 H new ATOM 0 HB2 CYS A 844 -23.764 -12.570 52.706 1.00 78.62 H new ATOM 0 HB3 CYS A 844 -24.609 -12.843 51.424 1.00 78.62 H new ATOM 0 HG CYS A 844 -23.405 -10.424 51.065 1.00 81.91 H new ATOM 1439 N LYS A 845 -27.286 -12.591 51.194 1.00 82.16 N ATOM 1440 CA LYS A 845 -28.452 -12.193 50.413 1.00 84.28 C ATOM 1441 C LYS A 845 -29.666 -13.075 50.709 1.00 85.21 C ATOM 1442 O LYS A 845 -30.807 -12.615 50.641 1.00 85.83 O ATOM 1443 CB LYS A 845 -28.122 -12.239 48.916 1.00 84.71 C ATOM 1444 CG LYS A 845 -27.290 -11.060 48.419 1.00 85.04 C ATOM 1445 CD LYS A 845 -28.107 -9.772 48.418 1.00 84.93 C ATOM 1446 CE LYS A 845 -27.318 -8.595 47.856 1.00 84.86 C ATOM 1447 NZ LYS A 845 -26.139 -8.254 48.699 1.00 84.72 N ATOM 0 H LYS A 845 -26.787 -13.179 50.812 1.00 82.16 H new ATOM 0 HA LYS A 845 -28.680 -11.285 50.668 1.00 84.28 H new ATOM 0 HB2 LYS A 845 -27.644 -13.061 48.726 1.00 84.71 H new ATOM 0 HB3 LYS A 845 -28.951 -12.271 48.414 1.00 84.71 H new ATOM 0 HG2 LYS A 845 -26.509 -10.951 48.984 1.00 85.04 H new ATOM 0 HG3 LYS A 845 -26.968 -11.243 47.522 1.00 85.04 H new ATOM 0 HD2 LYS A 845 -28.912 -9.901 47.892 1.00 84.93 H new ATOM 0 HD3 LYS A 845 -28.389 -9.568 49.323 1.00 84.93 H new ATOM 0 HE2 LYS A 845 -27.021 -8.807 46.957 1.00 84.86 H new ATOM 0 HE3 LYS A 845 -27.899 -7.821 47.788 1.00 84.86 H new ATOM 0 HZ1 LYS A 845 -25.765 -7.505 48.398 1.00 84.72 H new ATOM 0 HZ2 LYS A 845 -26.400 -8.137 49.542 1.00 84.72 H new ATOM 0 HZ3 LYS A 845 -25.546 -8.917 48.662 1.00 84.72 H new ATOM 1448 N ARG A 846 -29.420 -14.340 51.038 1.00 85.98 N ATOM 1449 CA ARG A 846 -30.507 -15.264 51.347 1.00 86.43 C ATOM 1450 C ARG A 846 -31.136 -14.884 52.682 1.00 87.23 C ATOM 1451 O ARG A 846 -30.433 -14.605 53.653 1.00 87.19 O ATOM 1452 CB ARG A 846 -29.985 -16.701 51.412 1.00 85.66 C ATOM 1453 CG ARG A 846 -29.334 -17.177 50.129 1.00 84.55 C ATOM 1454 CD ARG A 846 -28.794 -18.589 50.274 1.00 84.86 C ATOM 1455 NE ARG A 846 -28.090 -19.031 49.072 1.00 84.73 N ATOM 1456 CZ ARG A 846 -26.989 -18.458 48.594 1.00 84.47 C ATOM 1457 NH1 ARG A 846 -26.454 -17.414 49.212 1.00 84.71 N ATOM 1458 NH2 ARG A 846 -26.425 -18.926 47.490 1.00 85.25 N ATOM 0 H ARG A 846 -28.633 -14.682 51.088 1.00 85.98 H new ATOM 0 HA ARG A 846 -31.175 -15.208 50.646 1.00 86.43 H new ATOM 0 HB2 ARG A 846 -29.342 -16.770 52.135 1.00 85.66 H new ATOM 0 HB3 ARG A 846 -30.721 -17.294 51.630 1.00 85.66 H new ATOM 0 HG2 ARG A 846 -29.980 -17.148 49.406 1.00 84.55 H new ATOM 0 HG3 ARG A 846 -28.612 -16.576 49.888 1.00 84.55 H new ATOM 0 HD2 ARG A 846 -28.192 -18.628 51.033 1.00 84.86 H new ATOM 0 HD3 ARG A 846 -29.526 -19.197 50.461 1.00 84.86 H new ATOM 0 HE ARG A 846 -28.409 -19.706 48.645 1.00 84.73 H new ATOM 0 HH11 ARG A 846 -26.819 -17.104 49.926 1.00 84.71 H new ATOM 0 HH12 ARG A 846 -25.742 -17.047 48.899 1.00 84.71 H new ATOM 0 HH21 ARG A 846 -26.771 -19.600 47.083 1.00 85.25 H new ATOM 0 HH22 ARG A 846 -25.713 -18.556 47.181 1.00 85.25 H new ATOM 1459 N LYS A 847 -32.463 -14.871 52.722 1.00 88.27 N ATOM 1460 CA LYS A 847 -33.188 -14.522 53.939 1.00 89.23 C ATOM 1461 C LYS A 847 -34.136 -15.668 54.299 1.00 88.99 C ATOM 1462 O LYS A 847 -35.046 -15.510 55.113 1.00 89.11 O ATOM 1463 CB LYS A 847 -33.973 -13.223 53.713 1.00 90.49 C ATOM 1464 CG LYS A 847 -34.483 -12.538 54.979 1.00 91.90 C ATOM 1465 CD LYS A 847 -35.170 -11.215 54.637 1.00 93.32 C ATOM 1466 CE LYS A 847 -35.584 -10.437 55.884 1.00 93.89 C ATOM 1467 NZ LYS A 847 -36.599 -11.155 56.706 1.00 94.38 N ATOM 0 H LYS A 847 -32.966 -15.062 52.051 1.00 88.27 H new ATOM 0 HA LYS A 847 -32.566 -14.383 54.671 1.00 89.23 H new ATOM 0 HB2 LYS A 847 -33.406 -12.600 53.232 1.00 90.49 H new ATOM 0 HB3 LYS A 847 -34.731 -13.417 53.140 1.00 90.49 H new ATOM 0 HG2 LYS A 847 -35.106 -13.122 55.440 1.00 91.90 H new ATOM 0 HG3 LYS A 847 -33.743 -12.377 55.586 1.00 91.90 H new ATOM 0 HD2 LYS A 847 -34.571 -10.671 54.103 1.00 93.32 H new ATOM 0 HD3 LYS A 847 -35.954 -11.391 54.093 1.00 93.32 H new ATOM 0 HE2 LYS A 847 -34.799 -10.264 56.427 1.00 93.89 H new ATOM 0 HE3 LYS A 847 -35.941 -9.575 55.618 1.00 93.89 H new ATOM 0 HZ1 LYS A 847 -36.807 -10.663 57.418 1.00 94.38 H new ATOM 0 HZ2 LYS A 847 -37.331 -11.295 56.219 1.00 94.38 H new ATOM 0 HZ3 LYS A 847 -36.267 -11.936 56.973 1.00 94.38 H new ATOM 1468 N ASN A 848 -33.901 -16.825 53.683 1.00 88.65 N ATOM 1469 CA ASN A 848 -34.712 -18.021 53.902 1.00 87.48 C ATOM 1470 C ASN A 848 -33.837 -19.166 54.425 1.00 86.85 C ATOM 1471 O ASN A 848 -32.738 -19.399 53.918 1.00 87.11 O ATOM 1472 CB ASN A 848 -35.375 -18.435 52.584 1.00 87.52 C ATOM 1473 CG ASN A 848 -36.326 -19.600 52.747 1.00 87.16 C ATOM 1474 OD1 ASN A 848 -37.333 -19.500 53.446 1.00 87.37 O ATOM 1475 ND2 ASN A 848 -36.013 -20.716 52.098 1.00 87.28 N ATOM 0 H ASN A 848 -33.260 -16.939 53.121 1.00 88.65 H new ATOM 0 HA ASN A 848 -35.396 -17.825 54.562 1.00 87.48 H new ATOM 0 HB2 ASN A 848 -35.858 -17.678 52.218 1.00 87.52 H new ATOM 0 HB3 ASN A 848 -34.688 -18.671 51.941 1.00 87.52 H new ATOM 0 HD21 ASN A 848 -36.523 -21.406 52.158 1.00 87.28 H new ATOM 0 HD22 ASN A 848 -35.300 -20.749 51.618 1.00 87.28 H new ATOM 1476 N PRO A 849 -34.321 -19.902 55.443 1.00 85.85 N ATOM 1477 CA PRO A 849 -33.586 -21.025 56.040 1.00 84.14 C ATOM 1478 C PRO A 849 -33.340 -22.204 55.099 1.00 82.38 C ATOM 1479 O PRO A 849 -32.199 -22.638 54.931 1.00 82.62 O ATOM 1480 CB PRO A 849 -34.458 -21.408 57.233 1.00 84.59 C ATOM 1481 CG PRO A 849 -35.832 -21.111 56.735 1.00 85.18 C ATOM 1482 CD PRO A 849 -35.644 -19.758 56.076 1.00 86.06 C ATOM 0 HA PRO A 849 -32.681 -20.769 56.279 1.00 84.14 H new ATOM 0 HB2 PRO A 849 -34.354 -22.343 57.471 1.00 84.59 H new ATOM 0 HB3 PRO A 849 -34.239 -20.888 58.022 1.00 84.59 H new ATOM 0 HG2 PRO A 849 -36.143 -21.781 56.106 1.00 85.18 H new ATOM 0 HG3 PRO A 849 -36.480 -21.077 57.456 1.00 85.18 H new ATOM 0 HD2 PRO A 849 -36.339 -19.572 55.425 1.00 86.06 H new ATOM 0 HD3 PRO A 849 -35.660 -19.035 56.722 1.00 86.06 H new ATOM 1483 N THR A 850 -34.405 -22.725 54.496 1.00 80.00 N ATOM 1484 CA THR A 850 -34.277 -23.854 53.579 1.00 77.64 C ATOM 1485 C THR A 850 -33.379 -23.480 52.406 1.00 75.28 C ATOM 1486 O THR A 850 -32.845 -24.350 51.712 1.00 75.04 O ATOM 1487 CB THR A 850 -35.658 -24.309 53.048 1.00 78.18 C ATOM 1488 OG1 THR A 850 -36.418 -24.878 54.123 1.00 79.08 O ATOM 1489 CG2 THR A 850 -35.499 -25.354 51.947 1.00 78.59 C ATOM 0 H THR A 850 -35.209 -22.440 54.604 1.00 80.00 H new ATOM 0 HA THR A 850 -33.880 -24.590 54.071 1.00 77.64 H new ATOM 0 HB THR A 850 -36.116 -23.536 52.683 1.00 78.18 H new ATOM 0 HG1 THR A 850 -37.168 -25.124 53.836 1.00 79.08 H new ATOM 0 HG21 THR A 850 -36.374 -25.625 51.629 1.00 78.59 H new ATOM 0 HG22 THR A 850 -34.991 -24.976 51.212 1.00 78.59 H new ATOM 0 HG23 THR A 850 -35.030 -26.127 52.299 1.00 78.59 H new ATOM 1490 N SER A 851 -33.215 -22.178 52.194 1.00 72.46 N ATOM 1491 CA SER A 851 -32.369 -21.675 51.120 1.00 69.95 C ATOM 1492 C SER A 851 -30.908 -21.819 51.542 1.00 67.52 C ATOM 1493 O SER A 851 -30.105 -22.434 50.842 1.00 66.56 O ATOM 1494 CB SER A 851 -32.692 -20.205 50.844 1.00 70.33 C ATOM 1495 OG SER A 851 -31.865 -19.684 49.821 1.00 71.38 O ATOM 0 H SER A 851 -33.589 -21.565 52.667 1.00 72.46 H new ATOM 0 HA SER A 851 -32.529 -22.182 50.309 1.00 69.95 H new ATOM 0 HB2 SER A 851 -33.623 -20.118 50.586 1.00 70.33 H new ATOM 0 HB3 SER A 851 -32.573 -19.687 51.655 1.00 70.33 H new ATOM 0 HG SER A 851 -32.060 -18.878 49.686 1.00 71.38 H new ATOM 1496 N CYS A 852 -30.577 -21.250 52.698 1.00 65.04 N ATOM 1497 CA CYS A 852 -29.224 -21.324 53.232 1.00 63.22 C ATOM 1498 C CYS A 852 -28.846 -22.781 53.445 1.00 61.30 C ATOM 1499 O CYS A 852 -27.735 -23.201 53.127 1.00 60.47 O ATOM 1500 CB CYS A 852 -29.137 -20.579 54.564 1.00 62.97 C ATOM 1501 SG CYS A 852 -29.331 -18.797 54.437 1.00 64.58 S ATOM 0 H CYS A 852 -31.129 -20.812 53.192 1.00 65.04 H new ATOM 0 HA CYS A 852 -28.613 -20.912 52.601 1.00 63.22 H new ATOM 0 HB2 CYS A 852 -29.819 -20.925 55.160 1.00 62.97 H new ATOM 0 HB3 CYS A 852 -28.279 -20.771 54.973 1.00 62.97 H new ATOM 0 HG CYS A 852 -30.484 -18.533 54.234 1.00 64.58 H new ATOM 1502 N SER A 853 -29.788 -23.545 53.986 1.00 60.03 N ATOM 1503 CA SER A 853 -29.578 -24.961 54.249 1.00 58.47 C ATOM 1504 C SER A 853 -29.223 -25.714 52.966 1.00 56.96 C ATOM 1505 O SER A 853 -28.311 -26.543 52.956 1.00 57.42 O ATOM 1506 CB SER A 853 -30.839 -25.562 54.882 1.00 58.33 C ATOM 1507 OG SER A 853 -30.643 -26.919 55.236 1.00 58.87 O ATOM 0 H SER A 853 -30.566 -23.256 54.211 1.00 60.03 H new ATOM 0 HA SER A 853 -28.833 -25.051 54.864 1.00 58.47 H new ATOM 0 HB2 SER A 853 -31.082 -25.052 55.671 1.00 58.33 H new ATOM 0 HB3 SER A 853 -31.580 -25.492 54.260 1.00 58.33 H new ATOM 0 HG SER A 853 -31.346 -27.223 55.581 1.00 58.87 H new ATOM 1508 N ARG A 854 -29.945 -25.423 51.887 1.00 55.36 N ATOM 1509 CA ARG A 854 -29.696 -26.073 50.601 1.00 53.96 C ATOM 1510 C ARG A 854 -28.311 -25.718 50.056 1.00 51.51 C ATOM 1511 O ARG A 854 -27.574 -26.587 49.588 1.00 50.58 O ATOM 1512 CB ARG A 854 -30.759 -25.657 49.577 1.00 56.02 C ATOM 1513 CG ARG A 854 -30.469 -26.142 48.158 1.00 60.73 C ATOM 1514 CD ARG A 854 -30.819 -25.082 47.104 1.00 64.82 C ATOM 1515 NE ARG A 854 -30.163 -23.800 47.373 1.00 67.36 N ATOM 1516 CZ ARG A 854 -29.375 -23.150 46.518 1.00 68.40 C ATOM 1517 NH1 ARG A 854 -29.124 -23.650 45.314 1.00 69.02 N ATOM 1518 NH2 ARG A 854 -28.837 -21.989 46.870 1.00 68.65 N ATOM 0 H ARG A 854 -30.586 -24.850 51.878 1.00 55.36 H new ATOM 0 HA ARG A 854 -29.738 -27.031 50.747 1.00 53.96 H new ATOM 0 HB2 ARG A 854 -31.620 -26.003 49.859 1.00 56.02 H new ATOM 0 HB3 ARG A 854 -30.830 -24.690 49.571 1.00 56.02 H new ATOM 0 HG2 ARG A 854 -29.530 -26.374 48.082 1.00 60.73 H new ATOM 0 HG3 ARG A 854 -30.976 -26.950 47.983 1.00 60.73 H new ATOM 0 HD2 ARG A 854 -30.556 -25.401 46.227 1.00 64.82 H new ATOM 0 HD3 ARG A 854 -31.780 -24.954 47.083 1.00 64.82 H new ATOM 0 HE ARG A 854 -30.297 -23.439 48.142 1.00 67.36 H new ATOM 0 HH11 ARG A 854 -29.471 -24.401 45.079 1.00 69.02 H new ATOM 0 HH12 ARG A 854 -28.614 -23.223 44.769 1.00 69.02 H new ATOM 0 HH21 ARG A 854 -28.998 -21.659 47.648 1.00 68.65 H new ATOM 0 HH22 ARG A 854 -28.328 -21.567 46.320 1.00 68.65 H new ATOM 1519 N ARG A 855 -27.965 -24.436 50.117 1.00 49.21 N ATOM 1520 CA ARG A 855 -26.677 -23.966 49.622 1.00 46.60 C ATOM 1521 C ARG A 855 -25.511 -24.597 50.389 1.00 46.19 C ATOM 1522 O ARG A 855 -24.551 -25.093 49.788 1.00 45.02 O ATOM 1523 CB ARG A 855 -26.608 -22.442 49.721 1.00 46.28 C ATOM 1524 CG ARG A 855 -25.460 -21.815 48.931 1.00 46.03 C ATOM 1525 CD ARG A 855 -25.467 -22.321 47.498 1.00 42.70 C ATOM 1526 NE ARG A 855 -24.570 -21.577 46.624 1.00 38.49 N ATOM 1527 CZ ARG A 855 -24.457 -21.814 45.323 1.00 38.14 C ATOM 1528 NH1 ARG A 855 -25.185 -22.771 44.766 1.00 35.92 N ATOM 1529 NH2 ARG A 855 -23.628 -21.096 44.574 1.00 37.87 N ATOM 0 H ARG A 855 -28.466 -23.819 50.444 1.00 49.21 H new ATOM 0 HA ARG A 855 -26.598 -24.235 48.693 1.00 46.60 H new ATOM 0 HB2 ARG A 855 -27.446 -22.069 49.406 1.00 46.28 H new ATOM 0 HB3 ARG A 855 -26.520 -22.192 50.654 1.00 46.28 H new ATOM 0 HG2 ARG A 855 -25.543 -20.849 48.940 1.00 46.03 H new ATOM 0 HG3 ARG A 855 -24.613 -22.031 49.353 1.00 46.03 H new ATOM 0 HD2 ARG A 855 -25.214 -23.257 47.490 1.00 42.70 H new ATOM 0 HD3 ARG A 855 -26.370 -22.268 47.147 1.00 42.70 H new ATOM 0 HE ARG A 855 -24.089 -20.953 46.968 1.00 38.49 H new ATOM 0 HH11 ARG A 855 -25.727 -23.234 45.247 1.00 35.92 H new ATOM 0 HH12 ARG A 855 -25.116 -22.929 43.923 1.00 35.92 H new ATOM 0 HH21 ARG A 855 -23.158 -20.471 44.931 1.00 37.87 H new ATOM 0 HH22 ARG A 855 -23.561 -21.256 43.732 1.00 37.87 H new ATOM 1530 N PHE A 856 -25.598 -24.590 51.715 1.00 44.62 N ATOM 1531 CA PHE A 856 -24.538 -25.169 52.537 1.00 44.10 C ATOM 1532 C PHE A 856 -24.351 -26.622 52.151 1.00 42.61 C ATOM 1533 O PHE A 856 -23.230 -27.122 52.074 1.00 42.67 O ATOM 1534 CB PHE A 856 -24.891 -25.085 54.025 1.00 43.12 C ATOM 1535 CG PHE A 856 -23.769 -25.500 54.938 1.00 42.69 C ATOM 1536 CD1 PHE A 856 -22.641 -24.695 55.088 1.00 42.72 C ATOM 1537 CD2 PHE A 856 -23.832 -26.697 55.642 1.00 41.68 C ATOM 1538 CE1 PHE A 856 -21.593 -25.083 55.930 1.00 41.06 C ATOM 1539 CE2 PHE A 856 -22.787 -27.090 56.485 1.00 41.05 C ATOM 1540 CZ PHE A 856 -21.669 -26.281 56.628 1.00 39.24 C ATOM 0 H PHE A 856 -26.257 -24.258 52.157 1.00 44.62 H new ATOM 0 HA PHE A 856 -23.720 -24.670 52.386 1.00 44.10 H new ATOM 0 HB2 PHE A 856 -25.150 -24.174 54.237 1.00 43.12 H new ATOM 0 HB3 PHE A 856 -25.663 -25.647 54.198 1.00 43.12 H new ATOM 0 HD1 PHE A 856 -22.584 -23.891 54.623 1.00 42.72 H new ATOM 0 HD2 PHE A 856 -24.579 -27.244 55.551 1.00 41.68 H new ATOM 0 HE1 PHE A 856 -20.845 -24.538 56.022 1.00 41.06 H new ATOM 0 HE2 PHE A 856 -22.842 -27.894 56.950 1.00 41.05 H new ATOM 0 HZ PHE A 856 -20.974 -26.540 57.189 1.00 39.24 H new ATOM 1541 N TYR A 857 -25.464 -27.301 51.911 1.00 42.77 N ATOM 1542 CA TYR A 857 -25.417 -28.698 51.530 1.00 42.40 C ATOM 1543 C TYR A 857 -24.631 -28.887 50.239 1.00 41.53 C ATOM 1544 O TYR A 857 -23.737 -29.729 50.171 1.00 41.03 O ATOM 1545 CB TYR A 857 -26.828 -29.247 51.349 1.00 45.47 C ATOM 1546 CG TYR A 857 -26.838 -30.695 50.935 1.00 47.86 C ATOM 1547 CD1 TYR A 857 -26.442 -31.697 51.821 1.00 48.38 C ATOM 1548 CD2 TYR A 857 -27.193 -31.061 49.638 1.00 49.75 C ATOM 1549 CE1 TYR A 857 -26.397 -33.031 51.423 1.00 51.17 C ATOM 1550 CE2 TYR A 857 -27.152 -32.392 49.228 1.00 52.34 C ATOM 1551 CZ TYR A 857 -26.752 -33.371 50.123 1.00 52.04 C ATOM 1552 OH TYR A 857 -26.702 -34.683 49.705 1.00 54.77 O ATOM 0 H TYR A 857 -26.255 -26.969 51.964 1.00 42.77 H new ATOM 0 HA TYR A 857 -24.970 -29.183 52.241 1.00 42.40 H new ATOM 0 HB2 TYR A 857 -27.319 -29.148 52.180 1.00 45.47 H new ATOM 0 HB3 TYR A 857 -27.293 -28.720 50.681 1.00 45.47 H new ATOM 0 HD1 TYR A 857 -26.204 -31.471 52.691 1.00 48.38 H new ATOM 0 HD2 TYR A 857 -27.462 -30.405 49.036 1.00 49.75 H new ATOM 0 HE1 TYR A 857 -26.131 -33.690 52.023 1.00 51.17 H new ATOM 0 HE2 TYR A 857 -27.392 -32.622 48.359 1.00 52.34 H new ATOM 0 HH TYR A 857 -26.944 -34.731 48.902 1.00 54.77 H new ATOM 1553 N GLN A 858 -24.962 -28.092 49.224 1.00 41.51 N ATOM 1554 CA GLN A 858 -24.302 -28.171 47.917 1.00 42.94 C ATOM 1555 C GLN A 858 -22.802 -27.902 47.963 1.00 40.74 C ATOM 1556 O GLN A 858 -22.026 -28.592 47.309 1.00 40.00 O ATOM 1557 CB GLN A 858 -24.934 -27.183 46.927 1.00 44.28 C ATOM 1558 CG GLN A 858 -26.412 -27.396 46.677 1.00 47.30 C ATOM 1559 CD GLN A 858 -26.961 -26.471 45.602 1.00 50.27 C ATOM 1560 OE1 GLN A 858 -26.844 -25.245 45.694 1.00 50.45 O ATOM 1561 NE2 GLN A 858 -27.567 -27.057 44.574 1.00 52.17 N ATOM 0 H GLN A 858 -25.575 -27.491 49.271 1.00 41.51 H new ATOM 0 HA GLN A 858 -24.430 -29.088 47.627 1.00 42.94 H new ATOM 0 HB2 GLN A 858 -24.801 -26.281 47.259 1.00 44.28 H new ATOM 0 HB3 GLN A 858 -24.463 -27.246 46.081 1.00 44.28 H new ATOM 0 HG2 GLN A 858 -26.563 -28.317 46.414 1.00 47.30 H new ATOM 0 HG3 GLN A 858 -26.900 -27.253 47.503 1.00 47.30 H new ATOM 0 HE21 GLN A 858 -27.630 -27.914 44.544 1.00 52.17 H new ATOM 0 HE22 GLN A 858 -27.896 -26.579 43.939 1.00 52.17 H new ATOM 1562 N LEU A 859 -22.401 -26.890 48.724 1.00 39.92 N ATOM 1563 CA LEU A 859 -20.993 -26.534 48.829 1.00 37.86 C ATOM 1564 C LEU A 859 -20.173 -27.573 49.568 1.00 36.53 C ATOM 1565 O LEU A 859 -19.087 -27.930 49.125 1.00 35.58 O ATOM 1566 CB LEU A 859 -20.837 -25.169 49.499 1.00 38.34 C ATOM 1567 CG LEU A 859 -21.448 -24.004 48.711 1.00 40.47 C ATOM 1568 CD1 LEU A 859 -21.005 -22.670 49.317 1.00 40.04 C ATOM 1569 CD2 LEU A 859 -21.014 -24.094 47.260 1.00 39.33 C ATOM 0 H LEU A 859 -22.930 -26.396 49.188 1.00 39.92 H new ATOM 0 HA LEU A 859 -20.649 -26.495 47.923 1.00 37.86 H new ATOM 0 HB2 LEU A 859 -21.248 -25.203 50.377 1.00 38.34 H new ATOM 0 HB3 LEU A 859 -19.893 -24.993 49.635 1.00 38.34 H new ATOM 0 HG LEU A 859 -22.415 -24.056 48.757 1.00 40.47 H new ATOM 0 HD11 LEU A 859 -21.396 -21.940 48.813 1.00 40.04 H new ATOM 0 HD12 LEU A 859 -21.300 -22.620 50.240 1.00 40.04 H new ATOM 0 HD13 LEU A 859 -20.038 -22.604 49.283 1.00 40.04 H new ATOM 0 HD21 LEU A 859 -21.400 -23.358 46.760 1.00 39.33 H new ATOM 0 HD22 LEU A 859 -20.047 -24.048 47.208 1.00 39.33 H new ATOM 0 HD23 LEU A 859 -21.318 -24.934 46.883 1.00 39.33 H new ATOM 1570 N THR A 860 -20.688 -28.066 50.689 1.00 35.56 N ATOM 1571 CA THR A 860 -19.968 -29.080 51.448 1.00 36.23 C ATOM 1572 C THR A 860 -19.817 -30.318 50.573 1.00 36.11 C ATOM 1573 O THR A 860 -18.774 -30.976 50.589 1.00 36.13 O ATOM 1574 CB THR A 860 -20.701 -29.433 52.771 1.00 36.23 C ATOM 1575 OG1 THR A 860 -22.072 -29.751 52.501 1.00 39.10 O ATOM 1576 CG2 THR A 860 -20.647 -28.246 53.736 1.00 34.63 C ATOM 0 H THR A 860 -21.444 -27.830 51.024 1.00 35.56 H new ATOM 0 HA THR A 860 -19.096 -28.734 51.693 1.00 36.23 H new ATOM 0 HB THR A 860 -20.261 -30.198 53.173 1.00 36.23 H new ATOM 0 HG1 THR A 860 -22.196 -30.574 52.614 1.00 39.10 H new ATOM 0 HG21 THR A 860 -21.107 -28.476 54.558 1.00 34.63 H new ATOM 0 HG22 THR A 860 -19.722 -28.031 53.933 1.00 34.63 H new ATOM 0 HG23 THR A 860 -21.078 -27.478 53.329 1.00 34.63 H new ATOM 1577 N LYS A 861 -20.855 -30.627 49.798 1.00 35.24 N ATOM 1578 CA LYS A 861 -20.799 -31.764 48.885 1.00 36.70 C ATOM 1579 C LYS A 861 -19.701 -31.488 47.855 1.00 36.54 C ATOM 1580 O LYS A 861 -18.920 -32.372 47.496 1.00 38.33 O ATOM 1581 CB LYS A 861 -22.141 -31.942 48.162 1.00 40.09 C ATOM 1582 CG LYS A 861 -23.145 -32.818 48.891 1.00 40.11 C ATOM 1583 CD LYS A 861 -22.697 -34.274 48.891 1.00 42.15 C ATOM 1584 CE LYS A 861 -23.607 -35.130 49.755 1.00 43.28 C ATOM 1585 NZ LYS A 861 -23.139 -36.546 49.815 1.00 42.93 N ATOM 0 H LYS A 861 -21.597 -30.193 49.786 1.00 35.24 H new ATOM 0 HA LYS A 861 -20.611 -32.575 49.383 1.00 36.70 H new ATOM 0 HB2 LYS A 861 -22.536 -31.068 48.020 1.00 40.09 H new ATOM 0 HB3 LYS A 861 -21.974 -32.323 47.286 1.00 40.09 H new ATOM 0 HG2 LYS A 861 -23.248 -32.507 49.804 1.00 40.11 H new ATOM 0 HG3 LYS A 861 -24.014 -32.743 48.466 1.00 40.11 H new ATOM 0 HD2 LYS A 861 -22.696 -34.614 47.983 1.00 42.15 H new ATOM 0 HD3 LYS A 861 -21.786 -34.334 49.218 1.00 42.15 H new ATOM 0 HE2 LYS A 861 -23.642 -34.762 50.652 1.00 43.28 H new ATOM 0 HE3 LYS A 861 -24.510 -35.102 49.401 1.00 43.28 H new ATOM 0 HZ1 LYS A 861 -23.691 -37.020 50.327 1.00 42.93 H new ATOM 0 HZ2 LYS A 861 -23.127 -36.890 48.994 1.00 42.93 H new ATOM 0 HZ3 LYS A 861 -22.319 -36.573 50.159 1.00 42.93 H new ATOM 1586 N LEU A 862 -19.646 -30.251 47.379 1.00 34.80 N ATOM 1587 CA LEU A 862 -18.642 -29.868 46.398 1.00 35.68 C ATOM 1588 C LEU A 862 -17.233 -29.981 46.989 1.00 34.96 C ATOM 1589 O LEU A 862 -16.327 -30.513 46.354 1.00 34.98 O ATOM 1590 CB LEU A 862 -18.891 -28.440 45.924 1.00 34.56 C ATOM 1591 CG LEU A 862 -17.904 -27.974 44.852 1.00 35.41 C ATOM 1592 CD1 LEU A 862 -18.079 -28.828 43.599 1.00 34.54 C ATOM 1593 CD2 LEU A 862 -18.130 -26.510 44.553 1.00 31.69 C ATOM 0 H LEU A 862 -20.181 -29.619 47.611 1.00 34.80 H new ATOM 0 HA LEU A 862 -18.709 -30.473 45.642 1.00 35.68 H new ATOM 0 HB2 LEU A 862 -19.793 -28.376 45.573 1.00 34.56 H new ATOM 0 HB3 LEU A 862 -18.839 -27.840 46.685 1.00 34.56 H new ATOM 0 HG LEU A 862 -16.994 -28.079 45.170 1.00 35.41 H new ATOM 0 HD11 LEU A 862 -17.454 -28.535 42.917 1.00 34.54 H new ATOM 0 HD12 LEU A 862 -17.908 -29.758 43.815 1.00 34.54 H new ATOM 0 HD13 LEU A 862 -18.986 -28.735 43.268 1.00 34.54 H new ATOM 0 HD21 LEU A 862 -17.503 -26.218 43.873 1.00 31.69 H new ATOM 0 HD22 LEU A 862 -19.037 -26.381 44.233 1.00 31.69 H new ATOM 0 HD23 LEU A 862 -17.996 -25.990 45.361 1.00 31.69 H new ATOM 1594 N LEU A 863 -17.056 -29.476 48.207 1.00 34.91 N ATOM 1595 CA LEU A 863 -15.759 -29.544 48.876 1.00 33.64 C ATOM 1596 C LEU A 863 -15.301 -30.986 49.058 1.00 32.63 C ATOM 1597 O LEU A 863 -14.114 -31.284 48.912 1.00 31.54 O ATOM 1598 CB LEU A 863 -15.822 -28.847 50.233 1.00 31.54 C ATOM 1599 CG LEU A 863 -15.846 -27.320 50.120 1.00 34.32 C ATOM 1600 CD1 LEU A 863 -16.043 -26.691 51.502 1.00 33.25 C ATOM 1601 CD2 LEU A 863 -14.535 -26.850 49.485 1.00 32.23 C ATOM 0 H LEU A 863 -17.674 -29.090 48.664 1.00 34.91 H new ATOM 0 HA LEU A 863 -15.114 -29.089 48.312 1.00 33.64 H new ATOM 0 HB2 LEU A 863 -16.614 -29.144 50.707 1.00 31.54 H new ATOM 0 HB3 LEU A 863 -15.056 -29.115 50.765 1.00 31.54 H new ATOM 0 HG LEU A 863 -16.587 -27.041 49.560 1.00 34.32 H new ATOM 0 HD11 LEU A 863 -16.057 -25.725 51.419 1.00 33.25 H new ATOM 0 HD12 LEU A 863 -16.884 -26.995 51.879 1.00 33.25 H new ATOM 0 HD13 LEU A 863 -15.314 -26.955 52.085 1.00 33.25 H new ATOM 0 HD21 LEU A 863 -14.540 -25.883 49.409 1.00 32.23 H new ATOM 0 HD22 LEU A 863 -13.789 -27.126 50.040 1.00 32.23 H new ATOM 0 HD23 LEU A 863 -14.444 -27.243 48.603 1.00 32.23 H new ATOM 1602 N ASP A 864 -16.246 -31.870 49.381 1.00 30.69 N ATOM 1603 CA ASP A 864 -15.946 -33.285 49.561 1.00 29.92 C ATOM 1604 C ASP A 864 -15.438 -33.920 48.273 1.00 28.49 C ATOM 1605 O ASP A 864 -14.522 -34.736 48.309 1.00 27.75 O ATOM 1606 CB ASP A 864 -17.187 -34.062 50.037 1.00 32.56 C ATOM 1607 CG ASP A 864 -17.478 -33.871 51.528 1.00 37.07 C ATOM 1608 OD1 ASP A 864 -16.695 -33.182 52.218 1.00 32.62 O ATOM 1609 OD2 ASP A 864 -18.498 -34.421 52.011 1.00 38.07 O ATOM 0 H ASP A 864 -17.073 -31.665 49.501 1.00 30.69 H new ATOM 0 HA ASP A 864 -15.252 -33.335 50.236 1.00 29.92 H new ATOM 0 HB2 ASP A 864 -17.958 -33.776 49.523 1.00 32.56 H new ATOM 0 HB3 ASP A 864 -17.060 -35.006 49.856 1.00 32.56 H new ATOM 1610 N SER A 865 -16.024 -33.545 47.134 1.00 29.24 N ATOM 1611 CA SER A 865 -15.623 -34.121 45.849 1.00 29.06 C ATOM 1612 C SER A 865 -14.174 -33.822 45.447 1.00 30.62 C ATOM 1613 O SER A 865 -13.595 -34.520 44.616 1.00 30.29 O ATOM 1614 CB SER A 865 -16.569 -33.666 44.739 1.00 26.75 C ATOM 1615 OG SER A 865 -16.442 -32.282 44.488 1.00 30.16 O ATOM 0 H SER A 865 -16.653 -32.961 47.084 1.00 29.24 H new ATOM 0 HA SER A 865 -15.679 -35.082 45.969 1.00 29.06 H new ATOM 0 HB2 SER A 865 -16.380 -34.162 43.927 1.00 26.75 H new ATOM 0 HB3 SER A 865 -17.484 -33.868 44.989 1.00 26.75 H new ATOM 0 HG SER A 865 -16.245 -31.885 45.201 1.00 30.16 H new ATOM 1616 N VAL A 866 -13.587 -32.788 46.033 1.00 31.09 N ATOM 1617 CA VAL A 866 -12.196 -32.456 45.730 1.00 31.66 C ATOM 1618 C VAL A 866 -11.269 -33.543 46.279 1.00 31.11 C ATOM 1619 O VAL A 866 -10.249 -33.870 45.673 1.00 29.75 O ATOM 1620 CB VAL A 866 -11.775 -31.110 46.384 1.00 30.60 C ATOM 1621 CG1 VAL A 866 -10.277 -30.869 46.173 1.00 32.14 C ATOM 1622 CG2 VAL A 866 -12.577 -29.977 45.799 1.00 28.20 C ATOM 0 H VAL A 866 -13.968 -32.269 46.603 1.00 31.09 H new ATOM 0 HA VAL A 866 -12.123 -32.386 44.765 1.00 31.66 H new ATOM 0 HB VAL A 866 -11.951 -31.154 47.337 1.00 30.60 H new ATOM 0 HG11 VAL A 866 -10.023 -30.028 46.584 1.00 32.14 H new ATOM 0 HG12 VAL A 866 -9.773 -31.592 46.578 1.00 32.14 H new ATOM 0 HG13 VAL A 866 -10.085 -30.835 45.223 1.00 32.14 H new ATOM 0 HG21 VAL A 866 -12.308 -29.142 46.213 1.00 28.20 H new ATOM 0 HG22 VAL A 866 -12.420 -29.929 44.843 1.00 28.20 H new ATOM 0 HG23 VAL A 866 -13.521 -30.129 45.964 1.00 28.20 H new ATOM 1623 N GLN A 867 -11.652 -34.112 47.420 1.00 30.81 N ATOM 1624 CA GLN A 867 -10.830 -35.112 48.091 1.00 31.03 C ATOM 1625 C GLN A 867 -10.510 -36.373 47.293 1.00 31.34 C ATOM 1626 O GLN A 867 -9.360 -36.794 47.239 1.00 31.01 O ATOM 1627 CB GLN A 867 -11.455 -35.465 49.447 1.00 30.42 C ATOM 1628 CG GLN A 867 -11.515 -34.287 50.433 1.00 29.30 C ATOM 1629 CD GLN A 867 -10.156 -33.618 50.663 1.00 32.04 C ATOM 1630 OE1 GLN A 867 -9.106 -34.266 50.604 1.00 30.77 O ATOM 1631 NE2 GLN A 867 -10.179 -32.317 50.942 1.00 28.48 N ATOM 0 H GLN A 867 -12.390 -33.930 47.823 1.00 30.81 H new ATOM 0 HA GLN A 867 -9.964 -34.691 48.204 1.00 31.03 H new ATOM 0 HB2 GLN A 867 -12.354 -35.799 49.301 1.00 30.42 H new ATOM 0 HB3 GLN A 867 -10.946 -36.186 49.849 1.00 30.42 H new ATOM 0 HG2 GLN A 867 -12.141 -33.626 50.099 1.00 29.30 H new ATOM 0 HG3 GLN A 867 -11.861 -34.602 51.283 1.00 29.30 H new ATOM 0 HE21 GLN A 867 -10.929 -31.897 50.975 1.00 28.48 H new ATOM 0 HE22 GLN A 867 -9.444 -31.896 51.089 1.00 28.48 H new ATOM 1632 N PRO A 868 -11.522 -37.006 46.679 1.00 31.65 N ATOM 1633 CA PRO A 868 -11.239 -38.215 45.898 1.00 31.65 C ATOM 1634 C PRO A 868 -10.308 -37.898 44.717 1.00 30.60 C ATOM 1635 O PRO A 868 -9.451 -38.703 44.350 1.00 31.33 O ATOM 1636 CB PRO A 868 -12.632 -38.665 45.451 1.00 30.11 C ATOM 1637 CG PRO A 868 -13.492 -38.223 46.594 1.00 32.24 C ATOM 1638 CD PRO A 868 -12.975 -36.823 46.840 1.00 31.44 C ATOM 0 HA PRO A 868 -10.772 -38.906 46.394 1.00 31.65 H new ATOM 0 HB2 PRO A 868 -12.897 -38.248 44.616 1.00 30.11 H new ATOM 0 HB3 PRO A 868 -12.676 -39.624 45.315 1.00 30.11 H new ATOM 0 HG2 PRO A 868 -14.434 -38.229 46.365 1.00 32.24 H new ATOM 0 HG3 PRO A 868 -13.386 -38.793 47.372 1.00 32.24 H new ATOM 0 HD2 PRO A 868 -13.334 -36.185 46.203 1.00 31.44 H new ATOM 0 HD3 PRO A 868 -13.205 -36.500 47.725 1.00 31.44 H new ATOM 1639 N ILE A 869 -10.492 -36.720 44.129 1.00 30.29 N ATOM 1640 CA ILE A 869 -9.666 -36.265 43.007 1.00 30.37 C ATOM 1641 C ILE A 869 -8.203 -36.095 43.449 1.00 30.82 C ATOM 1642 O ILE A 869 -7.282 -36.569 42.778 1.00 32.36 O ATOM 1643 CB ILE A 869 -10.191 -34.919 42.457 1.00 28.55 C ATOM 1644 CG1 ILE A 869 -11.647 -35.094 42.003 1.00 28.62 C ATOM 1645 CG2 ILE A 869 -9.318 -34.440 41.310 1.00 28.52 C ATOM 1646 CD1 ILE A 869 -12.250 -33.888 41.362 1.00 25.42 C ATOM 0 H ILE A 869 -11.099 -36.159 44.367 1.00 30.29 H new ATOM 0 HA ILE A 869 -9.714 -36.937 42.309 1.00 30.37 H new ATOM 0 HB ILE A 869 -10.157 -34.247 43.155 1.00 28.55 H new ATOM 0 HG12 ILE A 869 -11.691 -35.834 41.377 1.00 28.62 H new ATOM 0 HG13 ILE A 869 -12.185 -35.340 42.772 1.00 28.62 H new ATOM 0 HG21 ILE A 869 -9.658 -33.596 40.975 1.00 28.52 H new ATOM 0 HG22 ILE A 869 -8.408 -34.320 41.624 1.00 28.52 H new ATOM 0 HG23 ILE A 869 -9.329 -35.098 40.598 1.00 28.52 H new ATOM 0 HD11 ILE A 869 -13.165 -34.081 41.106 1.00 25.42 H new ATOM 0 HD12 ILE A 869 -12.239 -33.148 41.989 1.00 25.42 H new ATOM 0 HD13 ILE A 869 -11.738 -33.650 40.574 1.00 25.42 H new ATOM 1647 N ALA A 870 -7.998 -35.433 44.585 1.00 29.71 N ATOM 1648 CA ALA A 870 -6.653 -35.222 45.113 1.00 30.10 C ATOM 1649 C ALA A 870 -5.988 -36.565 45.413 1.00 29.80 C ATOM 1650 O ALA A 870 -4.801 -36.751 45.152 1.00 32.66 O ATOM 1651 CB ALA A 870 -6.716 -34.364 46.373 1.00 28.47 C ATOM 0 H ALA A 870 -8.627 -35.097 45.066 1.00 29.71 H new ATOM 0 HA ALA A 870 -6.122 -34.758 44.447 1.00 30.10 H new ATOM 0 HB1 ALA A 870 -5.819 -34.228 46.718 1.00 28.47 H new ATOM 0 HB2 ALA A 870 -7.114 -33.505 46.160 1.00 28.47 H new ATOM 0 HB3 ALA A 870 -7.255 -34.812 47.043 1.00 28.47 H new ATOM 1652 N ARG A 871 -6.759 -37.503 45.952 1.00 29.44 N ATOM 1653 CA ARG A 871 -6.253 -38.840 46.268 1.00 29.60 C ATOM 1654 C ARG A 871 -5.643 -39.514 45.021 1.00 30.31 C ATOM 1655 O ARG A 871 -4.511 -40.031 45.059 1.00 26.90 O ATOM 1656 CB ARG A 871 -7.396 -39.691 46.821 1.00 31.70 C ATOM 1657 CG ARG A 871 -7.091 -41.175 46.924 1.00 37.56 C ATOM 1658 CD ARG A 871 -6.201 -41.489 48.104 1.00 40.82 C ATOM 1659 NE ARG A 871 -5.844 -42.906 48.142 1.00 45.87 N ATOM 1660 CZ ARG A 871 -5.470 -43.554 49.241 1.00 45.31 C ATOM 1661 NH1 ARG A 871 -5.412 -42.919 50.404 1.00 44.37 N ATOM 1662 NH2 ARG A 871 -5.124 -44.832 49.170 1.00 47.31 N ATOM 0 H ARG A 871 -7.589 -37.386 46.146 1.00 29.44 H new ATOM 0 HA ARG A 871 -5.552 -38.759 46.933 1.00 29.60 H new ATOM 0 HB2 ARG A 871 -7.632 -39.360 47.702 1.00 31.70 H new ATOM 0 HB3 ARG A 871 -8.175 -39.572 46.255 1.00 31.70 H new ATOM 0 HG2 ARG A 871 -7.921 -41.670 47.005 1.00 37.56 H new ATOM 0 HG3 ARG A 871 -6.661 -41.474 46.107 1.00 37.56 H new ATOM 0 HD2 ARG A 871 -5.395 -40.952 48.055 1.00 40.82 H new ATOM 0 HD3 ARG A 871 -6.654 -41.246 48.927 1.00 40.82 H new ATOM 0 HE ARG A 871 -5.878 -43.349 47.406 1.00 45.87 H new ATOM 0 HH11 ARG A 871 -5.617 -42.085 50.449 1.00 44.37 H new ATOM 0 HH12 ARG A 871 -5.170 -43.341 51.113 1.00 44.37 H new ATOM 0 HH21 ARG A 871 -5.142 -45.241 48.414 1.00 47.31 H new ATOM 0 HH22 ARG A 871 -4.882 -45.252 49.880 1.00 47.31 H new ATOM 1663 N GLU A 872 -6.398 -39.503 43.920 1.00 30.55 N ATOM 1664 CA GLU A 872 -5.940 -40.087 42.656 1.00 31.71 C ATOM 1665 C GLU A 872 -4.658 -39.430 42.157 1.00 31.52 C ATOM 1666 O GLU A 872 -3.747 -40.108 41.692 1.00 33.80 O ATOM 1667 CB GLU A 872 -7.009 -39.943 41.572 1.00 33.31 C ATOM 1668 CG GLU A 872 -8.233 -40.820 41.753 1.00 38.92 C ATOM 1669 CD GLU A 872 -9.107 -40.826 40.511 1.00 44.81 C ATOM 1670 OE1 GLU A 872 -8.622 -41.278 39.445 1.00 45.97 O ATOM 1671 OE2 GLU A 872 -10.271 -40.369 40.593 1.00 47.18 O ATOM 0 H GLU A 872 -7.185 -39.159 43.885 1.00 30.55 H new ATOM 0 HA GLU A 872 -5.767 -41.025 42.833 1.00 31.71 H new ATOM 0 HB2 GLU A 872 -7.294 -39.016 41.540 1.00 33.31 H new ATOM 0 HB3 GLU A 872 -6.607 -40.146 40.713 1.00 33.31 H new ATOM 0 HG2 GLU A 872 -7.955 -41.726 41.958 1.00 38.92 H new ATOM 0 HG3 GLU A 872 -8.749 -40.504 42.511 1.00 38.92 H new ATOM 1672 N LEU A 873 -4.597 -38.104 42.243 1.00 30.31 N ATOM 1673 CA LEU A 873 -3.419 -37.370 41.803 1.00 27.11 C ATOM 1674 C LEU A 873 -2.258 -37.653 42.744 1.00 26.41 C ATOM 1675 O LEU A 873 -1.101 -37.677 42.319 1.00 23.97 O ATOM 1676 CB LEU A 873 -3.724 -35.866 41.742 1.00 24.45 C ATOM 1677 CG LEU A 873 -4.704 -35.467 40.628 1.00 27.19 C ATOM 1678 CD1 LEU A 873 -5.107 -34.005 40.769 1.00 27.61 C ATOM 1679 CD2 LEU A 873 -4.065 -35.711 39.262 1.00 25.43 C ATOM 0 H LEU A 873 -5.230 -37.611 42.554 1.00 30.31 H new ATOM 0 HA LEU A 873 -3.172 -37.662 40.912 1.00 27.11 H new ATOM 0 HB2 LEU A 873 -4.089 -35.585 42.596 1.00 24.45 H new ATOM 0 HB3 LEU A 873 -2.893 -35.382 41.616 1.00 24.45 H new ATOM 0 HG LEU A 873 -5.503 -36.012 40.705 1.00 27.19 H new ATOM 0 HD11 LEU A 873 -5.725 -33.770 40.059 1.00 27.61 H new ATOM 0 HD12 LEU A 873 -5.535 -33.869 41.629 1.00 27.61 H new ATOM 0 HD13 LEU A 873 -4.318 -33.444 40.709 1.00 27.61 H new ATOM 0 HD21 LEU A 873 -4.688 -35.457 38.563 1.00 25.43 H new ATOM 0 HD22 LEU A 873 -3.257 -35.180 39.183 1.00 25.43 H new ATOM 0 HD23 LEU A 873 -3.843 -36.651 39.171 1.00 25.43 H new ATOM 1680 N HIS A 874 -2.565 -37.870 44.022 1.00 26.24 N ATOM 1681 CA HIS A 874 -1.518 -38.192 44.991 1.00 28.91 C ATOM 1682 C HIS A 874 -0.890 -39.530 44.613 1.00 30.32 C ATOM 1683 O HIS A 874 0.334 -39.682 44.618 1.00 28.74 O ATOM 1684 CB HIS A 874 -2.077 -38.329 46.410 1.00 28.40 C ATOM 1685 CG HIS A 874 -2.336 -37.028 47.096 1.00 30.98 C ATOM 1686 ND1 HIS A 874 -1.402 -36.015 47.150 1.00 32.15 N ATOM 1687 CD2 HIS A 874 -3.404 -36.594 47.806 1.00 30.05 C ATOM 1688 CE1 HIS A 874 -1.883 -35.015 47.866 1.00 32.15 C ATOM 1689 NE2 HIS A 874 -3.096 -35.341 48.276 1.00 32.96 N ATOM 0 H HIS A 874 -3.361 -37.836 44.345 1.00 26.24 H new ATOM 0 HA HIS A 874 -0.870 -37.470 44.975 1.00 28.91 H new ATOM 0 HB2 HIS A 874 -2.905 -38.834 46.373 1.00 28.40 H new ATOM 0 HB3 HIS A 874 -1.453 -38.846 46.944 1.00 28.40 H new ATOM 0 HD1 HIS A 874 -0.628 -36.032 46.776 1.00 32.15 H new ATOM 0 HD2 HIS A 874 -4.197 -37.058 47.949 1.00 30.05 H new ATOM 0 HE1 HIS A 874 -1.443 -34.217 48.050 1.00 32.15 H new ATOM 1690 N GLN A 875 -1.741 -40.504 44.301 1.00 31.75 N ATOM 1691 CA GLN A 875 -1.263 -41.830 43.934 1.00 32.89 C ATOM 1692 C GLN A 875 -0.472 -41.725 42.641 1.00 33.59 C ATOM 1693 O GLN A 875 0.627 -42.276 42.523 1.00 33.67 O ATOM 1694 CB GLN A 875 -2.436 -42.797 43.752 1.00 34.41 C ATOM 1695 CG GLN A 875 -1.999 -44.231 43.474 1.00 38.47 C ATOM 1696 CD GLN A 875 -1.135 -44.799 44.595 1.00 38.09 C ATOM 1697 OE1 GLN A 875 -1.596 -44.964 45.723 1.00 40.01 O ATOM 1698 NE2 GLN A 875 0.124 -45.087 44.288 1.00 36.16 N ATOM 0 H GLN A 875 -2.597 -40.416 44.296 1.00 31.75 H new ATOM 0 HA GLN A 875 -0.697 -42.173 44.643 1.00 32.89 H new ATOM 0 HB2 GLN A 875 -2.986 -42.782 44.551 1.00 34.41 H new ATOM 0 HB3 GLN A 875 -2.992 -42.487 43.020 1.00 34.41 H new ATOM 0 HG2 GLN A 875 -2.784 -44.790 43.358 1.00 38.47 H new ATOM 0 HG3 GLN A 875 -1.504 -44.261 42.640 1.00 38.47 H new ATOM 0 HE21 GLN A 875 0.412 -44.958 43.488 1.00 36.16 H new ATOM 0 HE22 GLN A 875 0.652 -45.402 44.889 1.00 36.16 H new ATOM 1699 N PHE A 876 -1.024 -40.989 41.681 1.00 32.55 N ATOM 1700 CA PHE A 876 -0.366 -40.812 40.393 1.00 32.57 C ATOM 1701 C PHE A 876 0.983 -40.100 40.484 1.00 31.96 C ATOM 1702 O PHE A 876 1.957 -40.529 39.858 1.00 32.48 O ATOM 1703 CB PHE A 876 -1.288 -40.059 39.424 1.00 32.48 C ATOM 1704 CG PHE A 876 -0.725 -39.923 38.036 1.00 34.61 C ATOM 1705 CD1 PHE A 876 0.160 -38.895 37.725 1.00 33.28 C ATOM 1706 CD2 PHE A 876 -1.057 -40.844 37.044 1.00 35.66 C ATOM 1707 CE1 PHE A 876 0.709 -38.784 36.444 1.00 35.71 C ATOM 1708 CE2 PHE A 876 -0.512 -40.743 35.756 1.00 36.85 C ATOM 1709 CZ PHE A 876 0.375 -39.707 35.459 1.00 35.79 C ATOM 0 H PHE A 876 -1.779 -40.584 41.756 1.00 32.55 H new ATOM 0 HA PHE A 876 -0.185 -41.705 40.059 1.00 32.57 H new ATOM 0 HB2 PHE A 876 -2.139 -40.521 39.375 1.00 32.48 H new ATOM 0 HB3 PHE A 876 -1.465 -39.175 39.780 1.00 32.48 H new ATOM 0 HD1 PHE A 876 0.389 -38.274 38.378 1.00 33.28 H new ATOM 0 HD2 PHE A 876 -1.648 -41.535 37.239 1.00 35.66 H new ATOM 0 HE1 PHE A 876 1.299 -38.091 36.250 1.00 35.71 H new ATOM 0 HE2 PHE A 876 -0.741 -41.364 35.102 1.00 36.85 H new ATOM 0 HZ PHE A 876 0.741 -39.634 34.607 1.00 35.79 H new ATOM 1710 N THR A 877 1.069 -39.014 41.247 1.00 29.95 N ATOM 1711 CA THR A 877 2.359 -38.334 41.314 1.00 30.72 C ATOM 1712 C THR A 877 3.380 -39.154 42.097 1.00 29.46 C ATOM 1713 O THR A 877 4.579 -39.085 41.822 1.00 28.75 O ATOM 1714 CB THR A 877 2.263 -36.912 41.930 1.00 28.76 C ATOM 1715 OG1 THR A 877 3.496 -36.223 41.692 1.00 28.64 O ATOM 1716 CG2 THR A 877 2.025 -36.971 43.424 1.00 29.32 C ATOM 0 H THR A 877 0.432 -38.669 41.710 1.00 29.95 H new ATOM 0 HA THR A 877 2.653 -38.241 40.394 1.00 30.72 H new ATOM 0 HB THR A 877 1.517 -36.450 41.517 1.00 28.76 H new ATOM 0 HG1 THR A 877 3.464 -35.842 40.944 1.00 28.64 H new ATOM 0 HG21 THR A 877 1.970 -36.070 43.779 1.00 29.32 H new ATOM 0 HG22 THR A 877 1.194 -37.439 43.601 1.00 29.32 H new ATOM 0 HG23 THR A 877 2.758 -37.442 43.850 1.00 29.32 H new ATOM 1717 N PHE A 878 2.900 -39.920 43.073 1.00 29.41 N ATOM 1718 CA PHE A 878 3.773 -40.772 43.876 1.00 31.75 C ATOM 1719 C PHE A 878 4.420 -41.828 42.979 1.00 32.11 C ATOM 1720 O PHE A 878 5.642 -41.977 42.963 1.00 31.64 O ATOM 1721 CB PHE A 878 2.979 -41.484 44.977 1.00 33.76 C ATOM 1722 CG PHE A 878 3.756 -42.578 45.673 1.00 35.76 C ATOM 1723 CD1 PHE A 878 4.712 -42.271 46.640 1.00 34.78 C ATOM 1724 CD2 PHE A 878 3.552 -43.916 45.333 1.00 32.70 C ATOM 1725 CE1 PHE A 878 5.457 -43.286 47.258 1.00 33.07 C ATOM 1726 CE2 PHE A 878 4.288 -44.928 45.940 1.00 33.82 C ATOM 1727 CZ PHE A 878 5.243 -44.613 46.906 1.00 30.64 C ATOM 0 H PHE A 878 2.068 -39.961 43.287 1.00 29.41 H new ATOM 0 HA PHE A 878 4.451 -40.212 44.285 1.00 31.75 H new ATOM 0 HB2 PHE A 878 2.696 -40.830 45.635 1.00 33.76 H new ATOM 0 HB3 PHE A 878 2.175 -41.865 44.591 1.00 33.76 H new ATOM 0 HD1 PHE A 878 4.857 -41.384 46.878 1.00 34.78 H new ATOM 0 HD2 PHE A 878 2.915 -44.134 44.692 1.00 32.70 H new ATOM 0 HE1 PHE A 878 6.093 -43.071 47.902 1.00 33.07 H new ATOM 0 HE2 PHE A 878 4.143 -45.815 45.702 1.00 33.82 H new ATOM 0 HZ PHE A 878 5.735 -45.289 47.313 1.00 30.64 H new ATOM 1728 N ASP A 879 3.593 -42.567 42.242 1.00 32.18 N ATOM 1729 CA ASP A 879 4.115 -43.599 41.352 1.00 34.18 C ATOM 1730 C ASP A 879 5.067 -42.986 40.332 1.00 32.94 C ATOM 1731 O ASP A 879 6.062 -43.599 39.958 1.00 31.70 O ATOM 1732 CB ASP A 879 2.976 -44.327 40.622 1.00 33.98 C ATOM 1733 CG ASP A 879 2.027 -45.032 41.573 1.00 41.11 C ATOM 1734 OD1 ASP A 879 2.503 -45.604 42.582 1.00 43.43 O ATOM 1735 OD2 ASP A 879 0.802 -45.024 41.308 1.00 44.74 O ATOM 0 H ASP A 879 2.737 -42.488 42.243 1.00 32.18 H new ATOM 0 HA ASP A 879 4.596 -44.244 41.894 1.00 34.18 H new ATOM 0 HB2 ASP A 879 2.478 -43.688 40.089 1.00 33.98 H new ATOM 0 HB3 ASP A 879 3.353 -44.976 40.008 1.00 33.98 H new ATOM 1736 N LEU A 880 4.758 -41.773 39.880 1.00 32.39 N ATOM 1737 CA LEU A 880 5.609 -41.106 38.905 1.00 34.33 C ATOM 1738 C LEU A 880 6.964 -40.732 39.509 1.00 34.37 C ATOM 1739 O LEU A 880 7.989 -40.831 38.842 1.00 34.54 O ATOM 1740 CB LEU A 880 4.917 -39.854 38.348 1.00 33.82 C ATOM 1741 CG LEU A 880 5.691 -39.056 37.290 1.00 35.72 C ATOM 1742 CD1 LEU A 880 6.301 -39.997 36.249 1.00 36.24 C ATOM 1743 CD2 LEU A 880 4.757 -38.057 36.628 1.00 36.38 C ATOM 0 H LEU A 880 4.066 -41.324 40.124 1.00 32.39 H new ATOM 0 HA LEU A 880 5.764 -41.729 38.178 1.00 34.33 H new ATOM 0 HB2 LEU A 880 4.067 -40.122 37.964 1.00 33.82 H new ATOM 0 HB3 LEU A 880 4.719 -39.261 39.090 1.00 33.82 H new ATOM 0 HG LEU A 880 6.416 -38.575 37.719 1.00 35.72 H new ATOM 0 HD11 LEU A 880 6.786 -39.478 35.588 1.00 36.24 H new ATOM 0 HD12 LEU A 880 6.910 -40.613 36.686 1.00 36.24 H new ATOM 0 HD13 LEU A 880 5.595 -40.497 35.811 1.00 36.24 H new ATOM 0 HD21 LEU A 880 5.245 -37.552 35.959 1.00 36.38 H new ATOM 0 HD22 LEU A 880 4.024 -38.531 36.204 1.00 36.38 H new ATOM 0 HD23 LEU A 880 4.405 -37.450 37.298 1.00 36.38 H new ATOM 1744 N LEU A 881 6.969 -40.289 40.762 1.00 33.90 N ATOM 1745 CA LEU A 881 8.224 -39.933 41.416 1.00 34.00 C ATOM 1746 C LEU A 881 9.123 -41.176 41.463 1.00 34.90 C ATOM 1747 O LEU A 881 10.295 -41.127 41.086 1.00 31.34 O ATOM 1748 CB LEU A 881 7.971 -39.434 42.841 1.00 32.92 C ATOM 1749 CG LEU A 881 9.244 -39.196 43.671 1.00 33.67 C ATOM 1750 CD1 LEU A 881 10.053 -38.058 43.061 1.00 31.86 C ATOM 1751 CD2 LEU A 881 8.883 -38.880 45.110 1.00 31.58 C ATOM 0 H LEU A 881 6.266 -40.188 41.247 1.00 33.90 H new ATOM 0 HA LEU A 881 8.653 -39.222 40.915 1.00 34.00 H new ATOM 0 HB2 LEU A 881 7.468 -38.606 42.797 1.00 32.92 H new ATOM 0 HB3 LEU A 881 7.414 -40.080 43.303 1.00 32.92 H new ATOM 0 HG LEU A 881 9.783 -40.003 43.662 1.00 33.67 H new ATOM 0 HD11 LEU A 881 10.854 -37.912 43.588 1.00 31.86 H new ATOM 0 HD12 LEU A 881 10.302 -38.288 42.152 1.00 31.86 H new ATOM 0 HD13 LEU A 881 9.519 -37.248 43.054 1.00 31.86 H new ATOM 0 HD21 LEU A 881 9.693 -38.732 45.622 1.00 31.58 H new ATOM 0 HD22 LEU A 881 8.333 -38.081 45.138 1.00 31.58 H new ATOM 0 HD23 LEU A 881 8.391 -39.624 45.491 1.00 31.58 H new ATOM 1752 N ILE A 882 8.552 -42.287 41.918 1.00 35.88 N ATOM 1753 CA ILE A 882 9.279 -43.549 42.027 1.00 39.28 C ATOM 1754 C ILE A 882 10.018 -43.955 40.747 1.00 41.36 C ATOM 1755 O ILE A 882 11.139 -44.445 40.815 1.00 42.62 O ATOM 1756 CB ILE A 882 8.329 -44.704 42.440 1.00 38.67 C ATOM 1757 CG1 ILE A 882 7.750 -44.427 43.829 1.00 39.10 C ATOM 1758 CG2 ILE A 882 9.081 -46.032 42.440 1.00 40.36 C ATOM 1759 CD1 ILE A 882 8.807 -44.180 44.903 1.00 37.28 C ATOM 0 H ILE A 882 7.732 -42.331 42.173 1.00 35.88 H new ATOM 0 HA ILE A 882 9.948 -43.394 42.712 1.00 39.28 H new ATOM 0 HB ILE A 882 7.603 -44.759 41.799 1.00 38.67 H new ATOM 0 HG12 ILE A 882 7.167 -43.654 43.778 1.00 39.10 H new ATOM 0 HG13 ILE A 882 7.200 -45.180 44.096 1.00 39.10 H new ATOM 0 HG21 ILE A 882 8.478 -46.746 42.699 1.00 40.36 H new ATOM 0 HG22 ILE A 882 9.427 -46.208 41.551 1.00 40.36 H new ATOM 0 HG23 ILE A 882 9.818 -45.987 43.070 1.00 40.36 H new ATOM 0 HD11 ILE A 882 8.372 -44.012 45.753 1.00 37.28 H new ATOM 0 HD12 ILE A 882 9.378 -44.960 44.981 1.00 37.28 H new ATOM 0 HD13 ILE A 882 9.344 -43.410 44.658 1.00 37.28 H new ATOM 1760 N LYS A 883 9.405 -43.754 39.586 1.00 44.38 N ATOM 1761 CA LYS A 883 10.067 -44.126 38.337 1.00 47.73 C ATOM 1762 C LYS A 883 10.258 -42.979 37.349 1.00 48.52 C ATOM 1763 O LYS A 883 10.302 -43.194 36.137 1.00 49.29 O ATOM 1764 CB LYS A 883 9.314 -45.283 37.670 1.00 46.94 C ATOM 1765 CG LYS A 883 7.806 -45.124 37.626 1.00 49.89 C ATOM 1766 CD LYS A 883 7.335 -44.276 36.457 1.00 50.22 C ATOM 1767 CE LYS A 883 5.813 -44.189 36.437 1.00 50.83 C ATOM 1768 NZ LYS A 883 5.177 -45.530 36.582 1.00 50.50 N ATOM 0 H LYS A 883 8.621 -43.411 39.497 1.00 44.38 H new ATOM 0 HA LYS A 883 10.963 -44.401 38.587 1.00 47.73 H new ATOM 0 HB2 LYS A 883 9.642 -45.384 36.763 1.00 46.94 H new ATOM 0 HB3 LYS A 883 9.526 -46.104 38.142 1.00 46.94 H new ATOM 0 HG2 LYS A 883 7.394 -46.001 37.570 1.00 49.89 H new ATOM 0 HG3 LYS A 883 7.504 -44.721 38.455 1.00 49.89 H new ATOM 0 HD2 LYS A 883 7.714 -43.386 36.523 1.00 50.22 H new ATOM 0 HD3 LYS A 883 7.653 -44.659 35.624 1.00 50.22 H new ATOM 0 HE2 LYS A 883 5.513 -43.610 37.155 1.00 50.83 H new ATOM 0 HE3 LYS A 883 5.524 -43.782 35.605 1.00 50.83 H new ATOM 0 HZ1 LYS A 883 4.389 -45.532 36.168 1.00 50.50 H new ATOM 0 HZ2 LYS A 883 5.704 -46.149 36.220 1.00 50.50 H new ATOM 0 HZ3 LYS A 883 5.058 -45.710 37.445 1.00 50.50 H new ATOM 1769 N SER A 884 10.399 -41.767 37.880 1.00 49.48 N ATOM 1770 CA SER A 884 10.585 -40.567 37.066 1.00 50.90 C ATOM 1771 C SER A 884 11.846 -40.633 36.212 1.00 52.58 C ATOM 1772 O SER A 884 11.867 -40.157 35.077 1.00 52.04 O ATOM 1773 CB SER A 884 10.670 -39.335 37.966 1.00 50.69 C ATOM 1774 OG SER A 884 11.837 -39.384 38.772 1.00 50.45 O ATOM 0 H SER A 884 10.389 -41.616 38.727 1.00 49.48 H new ATOM 0 HA SER A 884 9.820 -40.508 36.473 1.00 50.90 H new ATOM 0 HB2 SER A 884 10.680 -38.532 37.423 1.00 50.69 H new ATOM 0 HB3 SER A 884 9.883 -39.286 38.531 1.00 50.69 H new ATOM 0 HG SER A 884 11.870 -38.701 39.259 1.00 50.45 H new ATOM 1775 N HIS A 885 12.897 -41.212 36.778 1.00 55.55 N ATOM 1776 CA HIS A 885 14.184 -41.346 36.103 1.00 58.08 C ATOM 1777 C HIS A 885 14.102 -42.202 34.845 1.00 58.29 C ATOM 1778 O HIS A 885 14.900 -42.041 33.922 1.00 58.04 O ATOM 1779 CB HIS A 885 15.197 -41.944 37.078 1.00 60.52 C ATOM 1780 CG HIS A 885 14.610 -42.987 37.977 1.00 63.64 C ATOM 1781 ND1 HIS A 885 14.221 -44.229 37.521 1.00 65.33 N ATOM 1782 CD2 HIS A 885 14.290 -42.953 39.293 1.00 65.61 C ATOM 1783 CE1 HIS A 885 13.686 -44.914 38.517 1.00 65.45 C ATOM 1784 NE2 HIS A 885 13.715 -44.162 39.603 1.00 65.32 N ATOM 0 H HIS A 885 12.885 -41.542 37.572 1.00 55.55 H new ATOM 0 HA HIS A 885 14.464 -40.461 35.820 1.00 58.08 H new ATOM 0 HB2 HIS A 885 15.929 -42.334 36.575 1.00 60.52 H new ATOM 0 HB3 HIS A 885 15.573 -41.233 37.620 1.00 60.52 H new ATOM 0 HD2 HIS A 885 14.433 -42.244 39.877 1.00 65.61 H new ATOM 0 HE1 HIS A 885 13.347 -45.778 38.463 1.00 65.45 H new ATOM 0 HE2 HIS A 885 13.422 -44.392 40.378 1.00 65.32 H new ATOM 1785 N MET A 886 13.131 -43.108 34.815 1.00 58.57 N ATOM 1786 CA MET A 886 12.936 -43.999 33.678 1.00 59.10 C ATOM 1787 C MET A 886 12.117 -43.362 32.561 1.00 57.65 C ATOM 1788 O MET A 886 12.168 -43.813 31.418 1.00 57.51 O ATOM 1789 CB MET A 886 12.224 -45.277 34.122 1.00 63.50 C ATOM 1790 CG MET A 886 12.994 -46.147 35.090 1.00 68.69 C ATOM 1791 SD MET A 886 11.975 -47.549 35.600 1.00 76.01 S ATOM 1792 CE MET A 886 12.012 -48.569 34.111 1.00 73.71 C ATOM 0 H MET A 886 12.567 -43.223 35.454 1.00 58.57 H new ATOM 0 HA MET A 886 13.821 -44.196 33.334 1.00 59.10 H new ATOM 0 HB2 MET A 886 11.380 -45.033 34.532 1.00 63.50 H new ATOM 0 HB3 MET A 886 12.015 -45.803 33.334 1.00 63.50 H new ATOM 0 HG2 MET A 886 13.810 -46.465 34.673 1.00 68.69 H new ATOM 0 HG3 MET A 886 13.256 -45.628 35.866 1.00 68.69 H new ATOM 0 HE1 MET A 886 11.700 -49.463 34.323 1.00 73.71 H new ATOM 0 HE2 MET A 886 11.436 -48.178 33.436 1.00 73.71 H new ATOM 0 HE3 MET A 886 12.920 -48.616 33.773 1.00 73.71 H new ATOM 1793 N VAL A 887 11.356 -42.323 32.888 1.00 55.41 N ATOM 1794 CA VAL A 887 10.521 -41.667 31.890 1.00 53.35 C ATOM 1795 C VAL A 887 10.894 -40.217 31.641 1.00 51.44 C ATOM 1796 O VAL A 887 10.107 -39.460 31.081 1.00 52.54 O ATOM 1797 CB VAL A 887 9.034 -41.729 32.284 1.00 53.79 C ATOM 1798 CG1 VAL A 887 8.563 -43.176 32.302 1.00 52.69 C ATOM 1799 CG2 VAL A 887 8.834 -41.075 33.650 1.00 53.67 C ATOM 0 H VAL A 887 11.309 -41.984 33.677 1.00 55.41 H new ATOM 0 HA VAL A 887 10.677 -42.159 31.068 1.00 53.35 H new ATOM 0 HB VAL A 887 8.506 -41.244 31.631 1.00 53.79 H new ATOM 0 HG11 VAL A 887 7.626 -43.208 32.551 1.00 52.69 H new ATOM 0 HG12 VAL A 887 8.677 -43.565 31.421 1.00 52.69 H new ATOM 0 HG13 VAL A 887 9.086 -43.679 32.946 1.00 52.69 H new ATOM 0 HG21 VAL A 887 7.896 -41.116 33.894 1.00 53.67 H new ATOM 0 HG22 VAL A 887 9.362 -41.545 34.314 1.00 53.67 H new ATOM 0 HG23 VAL A 887 9.117 -40.148 33.610 1.00 53.67 H new ATOM 1800 N SER A 888 12.092 -39.834 32.067 1.00 49.56 N ATOM 1801 CA SER A 888 12.592 -38.476 31.870 1.00 46.36 C ATOM 1802 C SER A 888 11.707 -37.365 32.431 1.00 45.36 C ATOM 1803 O SER A 888 11.584 -36.300 31.826 1.00 44.12 O ATOM 1804 CB SER A 888 12.825 -38.229 30.383 1.00 45.88 C ATOM 1805 OG SER A 888 13.687 -39.212 29.856 1.00 48.64 O ATOM 0 H SER A 888 12.640 -40.354 32.479 1.00 49.56 H new ATOM 0 HA SER A 888 13.418 -38.433 32.377 1.00 46.36 H new ATOM 0 HB2 SER A 888 11.979 -38.244 29.909 1.00 45.88 H new ATOM 0 HB3 SER A 888 13.209 -37.348 30.251 1.00 45.88 H new ATOM 0 HG SER A 888 13.808 -39.069 29.037 1.00 48.64 H new ATOM 1806 N VAL A 889 11.091 -37.612 33.583 1.00 44.50 N ATOM 1807 CA VAL A 889 10.250 -36.608 34.216 1.00 43.43 C ATOM 1808 C VAL A 889 11.033 -35.983 35.367 1.00 43.68 C ATOM 1809 O VAL A 889 11.583 -36.683 36.221 1.00 43.73 O ATOM 1810 CB VAL A 889 8.929 -37.218 34.748 1.00 43.48 C ATOM 1811 CG1 VAL A 889 8.190 -36.193 35.605 1.00 43.24 C ATOM 1812 CG2 VAL A 889 8.045 -37.646 33.577 1.00 39.16 C ATOM 0 H VAL A 889 11.148 -38.355 34.013 1.00 44.50 H new ATOM 0 HA VAL A 889 10.013 -35.937 33.557 1.00 43.43 H new ATOM 0 HB VAL A 889 9.137 -37.995 35.291 1.00 43.48 H new ATOM 0 HG11 VAL A 889 7.364 -36.581 35.934 1.00 43.24 H new ATOM 0 HG12 VAL A 889 8.748 -35.936 36.356 1.00 43.24 H new ATOM 0 HG13 VAL A 889 7.987 -35.410 35.070 1.00 43.24 H new ATOM 0 HG21 VAL A 889 7.220 -38.027 33.916 1.00 39.16 H new ATOM 0 HG22 VAL A 889 7.842 -36.874 33.026 1.00 39.16 H new ATOM 0 HG23 VAL A 889 8.512 -38.309 33.044 1.00 39.16 H new ATOM 1813 N ASP A 890 11.088 -34.658 35.378 1.00 44.11 N ATOM 1814 CA ASP A 890 11.816 -33.940 36.412 1.00 44.47 C ATOM 1815 C ASP A 890 10.924 -33.420 37.530 1.00 42.87 C ATOM 1816 O ASP A 890 9.903 -32.780 37.278 1.00 41.41 O ATOM 1817 CB ASP A 890 12.579 -32.771 35.786 1.00 47.04 C ATOM 1818 CG ASP A 890 13.723 -33.232 34.903 1.00 50.04 C ATOM 1819 OD1 ASP A 890 14.142 -32.451 34.023 1.00 50.69 O ATOM 1820 OD2 ASP A 890 14.210 -34.369 35.097 1.00 51.24 O ATOM 0 H ASP A 890 10.709 -34.155 34.793 1.00 44.11 H new ATOM 0 HA ASP A 890 12.428 -34.577 36.813 1.00 44.47 H new ATOM 0 HB2 ASP A 890 11.966 -32.232 35.262 1.00 47.04 H new ATOM 0 HB3 ASP A 890 12.927 -32.201 36.490 1.00 47.04 H new ATOM 1821 N PHE A 891 11.316 -33.717 38.765 1.00 40.52 N ATOM 1822 CA PHE A 891 10.588 -33.252 39.937 1.00 39.01 C ATOM 1823 C PHE A 891 11.457 -32.233 40.665 1.00 38.12 C ATOM 1824 O PHE A 891 12.582 -32.541 41.053 1.00 38.74 O ATOM 1825 CB PHE A 891 10.281 -34.403 40.903 1.00 36.69 C ATOM 1826 CG PHE A 891 9.126 -35.277 40.481 1.00 36.79 C ATOM 1827 CD1 PHE A 891 9.283 -36.239 39.484 1.00 32.52 C ATOM 1828 CD2 PHE A 891 7.887 -35.156 41.107 1.00 33.84 C ATOM 1829 CE1 PHE A 891 8.223 -37.071 39.121 1.00 31.71 C ATOM 1830 CE2 PHE A 891 6.819 -35.983 40.752 1.00 32.98 C ATOM 1831 CZ PHE A 891 6.989 -36.944 39.758 1.00 30.94 C ATOM 0 H PHE A 891 12.010 -34.192 38.945 1.00 40.52 H new ATOM 0 HA PHE A 891 9.748 -32.864 39.645 1.00 39.01 H new ATOM 0 HB2 PHE A 891 11.074 -34.955 40.994 1.00 36.69 H new ATOM 0 HB3 PHE A 891 10.090 -34.034 41.779 1.00 36.69 H new ATOM 0 HD1 PHE A 891 10.104 -36.327 39.056 1.00 32.52 H new ATOM 0 HD2 PHE A 891 7.770 -34.515 41.771 1.00 33.84 H new ATOM 0 HE1 PHE A 891 8.339 -37.710 38.455 1.00 31.71 H new ATOM 0 HE2 PHE A 891 5.997 -35.892 41.178 1.00 32.98 H new ATOM 0 HZ PHE A 891 6.282 -37.499 39.520 1.00 30.94 H new ATOM 1832 N PRO A 892 10.953 -30.999 40.841 1.00 37.93 N ATOM 1833 CA PRO A 892 11.725 -29.968 41.540 1.00 37.21 C ATOM 1834 C PRO A 892 11.979 -30.356 43.000 1.00 37.03 C ATOM 1835 O PRO A 892 11.364 -31.284 43.525 1.00 35.82 O ATOM 1836 CB PRO A 892 10.840 -28.731 41.411 1.00 36.73 C ATOM 1837 CG PRO A 892 10.179 -28.943 40.091 1.00 36.52 C ATOM 1838 CD PRO A 892 9.789 -30.403 40.163 1.00 35.67 C ATOM 0 HA PRO A 892 12.611 -29.830 41.171 1.00 37.21 H new ATOM 0 HB2 PRO A 892 10.195 -28.672 42.133 1.00 36.73 H new ATOM 0 HB3 PRO A 892 11.360 -27.912 41.427 1.00 36.73 H new ATOM 0 HG2 PRO A 892 9.407 -28.367 39.975 1.00 36.52 H new ATOM 0 HG3 PRO A 892 10.780 -28.764 39.351 1.00 36.52 H new ATOM 0 HD2 PRO A 892 8.970 -30.535 40.665 1.00 35.67 H new ATOM 0 HD3 PRO A 892 9.647 -30.785 39.283 1.00 35.67 H new ATOM 1839 N GLU A 893 12.882 -29.623 43.642 1.00 37.54 N ATOM 1840 CA GLU A 893 13.280 -29.854 45.029 1.00 37.66 C ATOM 1841 C GLU A 893 12.159 -30.091 46.043 1.00 36.31 C ATOM 1842 O GLU A 893 12.068 -31.169 46.639 1.00 37.52 O ATOM 1843 CB GLU A 893 14.143 -28.678 45.502 1.00 39.48 C ATOM 1844 CG GLU A 893 14.639 -28.799 46.930 1.00 43.97 C ATOM 1845 CD GLU A 893 15.221 -27.497 47.458 1.00 46.60 C ATOM 1846 OE1 GLU A 893 15.446 -27.398 48.686 1.00 48.75 O ATOM 1847 OE2 GLU A 893 15.451 -26.576 46.646 1.00 49.00 O ATOM 0 H GLU A 893 13.291 -28.961 43.276 1.00 37.54 H new ATOM 0 HA GLU A 893 13.763 -30.695 45.005 1.00 37.66 H new ATOM 0 HB2 GLU A 893 14.908 -28.594 44.912 1.00 39.48 H new ATOM 0 HB3 GLU A 893 13.629 -27.860 45.418 1.00 39.48 H new ATOM 0 HG2 GLU A 893 13.906 -29.077 47.501 1.00 43.97 H new ATOM 0 HG3 GLU A 893 15.314 -29.494 46.977 1.00 43.97 H new ATOM 1848 N MET A 894 11.321 -29.078 46.251 1.00 35.28 N ATOM 1849 CA MET A 894 10.225 -29.164 47.213 1.00 35.33 C ATOM 1850 C MET A 894 9.174 -30.212 46.862 1.00 35.25 C ATOM 1851 O MET A 894 8.584 -30.823 47.752 1.00 35.37 O ATOM 1852 CB MET A 894 9.552 -27.800 47.370 1.00 37.17 C ATOM 1853 CG MET A 894 10.494 -26.704 47.848 1.00 40.94 C ATOM 1854 SD MET A 894 9.613 -25.213 48.367 1.00 43.41 S ATOM 1855 CE MET A 894 9.263 -24.455 46.777 1.00 43.48 C ATOM 0 H MET A 894 11.371 -28.324 45.840 1.00 35.28 H new ATOM 0 HA MET A 894 10.628 -29.445 48.049 1.00 35.33 H new ATOM 0 HB2 MET A 894 9.169 -27.537 46.518 1.00 37.17 H new ATOM 0 HB3 MET A 894 8.818 -27.881 47.999 1.00 37.17 H new ATOM 0 HG2 MET A 894 11.024 -27.037 48.589 1.00 40.94 H new ATOM 0 HG3 MET A 894 11.112 -26.479 47.135 1.00 40.94 H new ATOM 0 HE1 MET A 894 9.139 -23.500 46.894 1.00 43.48 H new ATOM 0 HE2 MET A 894 10.005 -24.613 46.173 1.00 43.48 H new ATOM 0 HE3 MET A 894 8.455 -24.842 46.405 1.00 43.48 H new ATOM 1856 N MET A 895 8.932 -30.412 45.571 1.00 34.25 N ATOM 1857 CA MET A 895 7.962 -31.405 45.137 1.00 34.12 C ATOM 1858 C MET A 895 8.461 -32.803 45.498 1.00 32.04 C ATOM 1859 O MET A 895 7.751 -33.581 46.134 1.00 29.97 O ATOM 1860 CB MET A 895 7.736 -31.306 43.621 1.00 34.50 C ATOM 1861 CG MET A 895 6.964 -30.065 43.172 1.00 37.95 C ATOM 1862 SD MET A 895 5.204 -30.063 43.663 1.00 40.97 S ATOM 1863 CE MET A 895 5.304 -29.305 45.270 1.00 41.51 C ATOM 0 H MET A 895 9.319 -29.984 44.933 1.00 34.25 H new ATOM 0 HA MET A 895 7.119 -31.238 45.587 1.00 34.12 H new ATOM 0 HB2 MET A 895 8.598 -31.315 43.176 1.00 34.50 H new ATOM 0 HB3 MET A 895 7.256 -32.095 43.325 1.00 34.50 H new ATOM 0 HG2 MET A 895 7.394 -29.278 43.541 1.00 37.95 H new ATOM 0 HG3 MET A 895 7.020 -29.993 42.206 1.00 37.95 H new ATOM 0 HE1 MET A 895 5.081 -29.959 45.951 1.00 41.51 H new ATOM 0 HE2 MET A 895 6.205 -28.979 45.419 1.00 41.51 H new ATOM 0 HE3 MET A 895 4.681 -28.563 45.318 1.00 41.51 H new ATOM 1864 N ALA A 896 9.693 -33.109 45.103 1.00 31.07 N ATOM 1865 CA ALA A 896 10.275 -34.420 45.372 1.00 32.22 C ATOM 1866 C ALA A 896 10.241 -34.772 46.863 1.00 32.69 C ATOM 1867 O ALA A 896 9.861 -35.882 47.244 1.00 34.52 O ATOM 1868 CB ALA A 896 11.703 -34.460 44.855 1.00 32.15 C ATOM 0 H ALA A 896 10.210 -32.570 44.677 1.00 31.07 H new ATOM 0 HA ALA A 896 9.739 -35.083 44.909 1.00 32.22 H new ATOM 0 HB1 ALA A 896 12.088 -35.332 45.035 1.00 32.15 H new ATOM 0 HB2 ALA A 896 11.706 -34.297 43.899 1.00 32.15 H new ATOM 0 HB3 ALA A 896 12.228 -33.777 45.301 1.00 32.15 H new ATOM 1869 N GLU A 897 10.623 -33.814 47.701 1.00 34.28 N ATOM 1870 CA GLU A 897 10.644 -34.018 49.144 1.00 35.46 C ATOM 1871 C GLU A 897 9.261 -34.284 49.727 1.00 34.26 C ATOM 1872 O GLU A 897 9.058 -35.260 50.449 1.00 33.19 O ATOM 1873 CB GLU A 897 11.259 -32.797 49.836 1.00 38.86 C ATOM 1874 CG GLU A 897 11.088 -32.804 51.340 1.00 45.24 C ATOM 1875 CD GLU A 897 11.540 -31.510 51.982 1.00 50.00 C ATOM 1876 OE1 GLU A 897 12.767 -31.301 52.095 1.00 50.82 O ATOM 1877 OE2 GLU A 897 10.667 -30.698 52.364 1.00 53.01 O ATOM 0 H GLU A 897 10.876 -33.031 47.450 1.00 34.28 H new ATOM 0 HA GLU A 897 11.183 -34.808 49.306 1.00 35.46 H new ATOM 0 HB2 GLU A 897 12.205 -32.758 49.626 1.00 38.86 H new ATOM 0 HB3 GLU A 897 10.855 -31.992 49.476 1.00 38.86 H new ATOM 0 HG2 GLU A 897 10.155 -32.960 51.556 1.00 45.24 H new ATOM 0 HG3 GLU A 897 11.593 -33.542 51.716 1.00 45.24 H new ATOM 1878 N ILE A 898 8.313 -33.409 49.416 1.00 33.47 N ATOM 1879 CA ILE A 898 6.958 -33.550 49.929 1.00 33.29 C ATOM 1880 C ILE A 898 6.285 -34.831 49.463 1.00 31.93 C ATOM 1881 O ILE A 898 5.610 -35.507 50.237 1.00 32.87 O ATOM 1882 CB ILE A 898 6.070 -32.340 49.511 1.00 32.75 C ATOM 1883 CG1 ILE A 898 6.463 -31.100 50.321 1.00 33.20 C ATOM 1884 CG2 ILE A 898 4.600 -32.653 49.743 1.00 32.01 C ATOM 1885 CD1 ILE A 898 5.643 -29.857 49.989 1.00 30.20 C ATOM 0 H ILE A 898 8.434 -32.725 48.908 1.00 33.47 H new ATOM 0 HA ILE A 898 7.043 -33.582 50.895 1.00 33.29 H new ATOM 0 HB ILE A 898 6.209 -32.168 48.567 1.00 32.75 H new ATOM 0 HG12 ILE A 898 6.366 -31.298 51.266 1.00 33.20 H new ATOM 0 HG13 ILE A 898 7.401 -30.908 50.167 1.00 33.20 H new ATOM 0 HG21 ILE A 898 4.061 -31.891 49.478 1.00 32.01 H new ATOM 0 HG22 ILE A 898 4.347 -33.427 49.216 1.00 32.01 H new ATOM 0 HG23 ILE A 898 4.453 -32.841 50.683 1.00 32.01 H new ATOM 0 HD11 ILE A 898 5.944 -29.115 50.536 1.00 30.20 H new ATOM 0 HD12 ILE A 898 5.757 -29.635 49.052 1.00 30.20 H new ATOM 0 HD13 ILE A 898 4.706 -30.030 50.168 1.00 30.20 H new ATOM 1886 N ILE A 899 6.478 -35.170 48.198 1.00 31.97 N ATOM 1887 CA ILE A 899 5.851 -36.350 47.634 1.00 32.07 C ATOM 1888 C ILE A 899 6.375 -37.674 48.184 1.00 35.03 C ATOM 1889 O ILE A 899 5.657 -38.673 48.183 1.00 36.96 O ATOM 1890 CB ILE A 899 5.949 -36.308 46.088 1.00 32.43 C ATOM 1891 CG1 ILE A 899 5.124 -35.117 45.580 1.00 30.50 C ATOM 1892 CG2 ILE A 899 5.440 -37.619 45.470 1.00 30.37 C ATOM 1893 CD1 ILE A 899 5.228 -34.857 44.090 1.00 30.44 C ATOM 0 H ILE A 899 6.970 -34.728 47.649 1.00 31.97 H new ATOM 0 HA ILE A 899 4.921 -36.320 47.909 1.00 32.07 H new ATOM 0 HB ILE A 899 6.877 -36.204 45.825 1.00 32.43 H new ATOM 0 HG12 ILE A 899 4.192 -35.267 45.805 1.00 30.50 H new ATOM 0 HG13 ILE A 899 5.406 -34.319 46.055 1.00 30.50 H new ATOM 0 HG21 ILE A 899 5.510 -37.570 44.504 1.00 30.37 H new ATOM 0 HG22 ILE A 899 5.975 -38.360 45.796 1.00 30.37 H new ATOM 0 HG23 ILE A 899 4.513 -37.756 45.720 1.00 30.37 H new ATOM 0 HD11 ILE A 899 4.679 -34.092 43.856 1.00 30.44 H new ATOM 0 HD12 ILE A 899 6.152 -34.675 43.857 1.00 30.44 H new ATOM 0 HD13 ILE A 899 4.920 -35.637 43.603 1.00 30.44 H new ATOM 1894 N SER A 900 7.604 -37.680 48.690 1.00 36.89 N ATOM 1895 CA SER A 900 8.193 -38.906 49.230 1.00 37.32 C ATOM 1896 C SER A 900 8.127 -38.980 50.756 1.00 37.68 C ATOM 1897 O SER A 900 8.303 -40.054 51.341 1.00 36.90 O ATOM 1898 CB SER A 900 9.654 -39.026 48.795 1.00 37.22 C ATOM 1899 OG SER A 900 10.426 -37.964 49.335 1.00 40.55 O ATOM 0 H SER A 900 8.114 -36.989 48.731 1.00 36.89 H new ATOM 0 HA SER A 900 7.667 -39.639 48.875 1.00 37.32 H new ATOM 0 HB2 SER A 900 10.015 -39.877 49.089 1.00 37.22 H new ATOM 0 HB3 SER A 900 9.710 -39.013 47.827 1.00 37.22 H new ATOM 0 HG SER A 900 10.363 -37.290 48.837 1.00 40.55 H new ATOM 1900 N VAL A 901 7.883 -37.846 51.406 1.00 36.03 N ATOM 1901 CA VAL A 901 7.818 -37.850 52.861 1.00 34.54 C ATOM 1902 C VAL A 901 6.407 -37.655 53.377 1.00 34.38 C ATOM 1903 O VAL A 901 5.993 -38.326 54.317 1.00 35.39 O ATOM 1904 CB VAL A 901 8.699 -36.742 53.485 1.00 34.15 C ATOM 1905 CG1 VAL A 901 8.570 -36.777 55.004 1.00 31.14 C ATOM 1906 CG2 VAL A 901 10.153 -36.920 53.067 1.00 32.28 C ATOM 0 H VAL A 901 7.755 -37.082 51.033 1.00 36.03 H new ATOM 0 HA VAL A 901 8.145 -38.724 53.124 1.00 34.54 H new ATOM 0 HB VAL A 901 8.396 -35.878 53.164 1.00 34.15 H new ATOM 0 HG11 VAL A 901 9.123 -36.081 55.392 1.00 31.14 H new ATOM 0 HG12 VAL A 901 7.644 -36.630 55.254 1.00 31.14 H new ATOM 0 HG13 VAL A 901 8.860 -37.642 55.334 1.00 31.14 H new ATOM 0 HG21 VAL A 901 10.693 -36.219 53.465 1.00 32.28 H new ATOM 0 HG22 VAL A 901 10.473 -37.785 53.369 1.00 32.28 H new ATOM 0 HG23 VAL A 901 10.221 -36.870 52.101 1.00 32.28 H new ATOM 1907 N GLN A 902 5.668 -36.743 52.759 1.00 33.12 N ATOM 1908 CA GLN A 902 4.314 -36.442 53.211 1.00 32.84 C ATOM 1909 C GLN A 902 3.210 -37.200 52.495 1.00 31.33 C ATOM 1910 O GLN A 902 2.315 -37.750 53.129 1.00 31.70 O ATOM 1911 CB GLN A 902 4.035 -34.938 53.078 1.00 33.65 C ATOM 1912 CG GLN A 902 5.074 -34.013 53.699 1.00 35.50 C ATOM 1913 CD GLN A 902 5.321 -34.303 55.157 1.00 39.78 C ATOM 1914 OE1 GLN A 902 4.419 -34.726 55.880 1.00 44.77 O ATOM 1915 NE2 GLN A 902 6.546 -34.060 55.609 1.00 41.56 N ATOM 0 H GLN A 902 5.930 -36.288 52.078 1.00 33.12 H new ATOM 0 HA GLN A 902 4.293 -36.734 54.136 1.00 32.84 H new ATOM 0 HB2 GLN A 902 3.957 -34.723 52.135 1.00 33.65 H new ATOM 0 HB3 GLN A 902 3.175 -34.749 53.484 1.00 33.65 H new ATOM 0 HG2 GLN A 902 5.908 -34.098 53.211 1.00 35.50 H new ATOM 0 HG3 GLN A 902 4.781 -33.093 53.602 1.00 35.50 H new ATOM 0 HE21 GLN A 902 7.151 -33.765 55.074 1.00 41.56 H new ATOM 0 HE22 GLN A 902 6.734 -34.198 56.437 1.00 41.56 H new ATOM 1916 N VAL A 903 3.257 -37.211 51.169 1.00 31.37 N ATOM 1917 CA VAL A 903 2.227 -37.890 50.396 1.00 30.80 C ATOM 1918 C VAL A 903 2.034 -39.360 50.804 1.00 29.58 C ATOM 1919 O VAL A 903 0.899 -39.815 50.933 1.00 31.38 O ATOM 1920 CB VAL A 903 2.516 -37.773 48.879 1.00 29.97 C ATOM 1921 CG1 VAL A 903 1.385 -38.394 48.071 1.00 27.16 C ATOM 1922 CG2 VAL A 903 2.654 -36.305 48.501 1.00 30.05 C ATOM 0 H VAL A 903 3.872 -36.834 50.701 1.00 31.37 H new ATOM 0 HA VAL A 903 1.391 -37.440 50.595 1.00 30.80 H new ATOM 0 HB VAL A 903 3.340 -38.245 48.682 1.00 29.97 H new ATOM 0 HG11 VAL A 903 1.581 -38.313 47.124 1.00 27.16 H new ATOM 0 HG12 VAL A 903 1.298 -39.332 48.303 1.00 27.16 H new ATOM 0 HG13 VAL A 903 0.555 -37.934 48.270 1.00 27.16 H new ATOM 0 HG21 VAL A 903 2.835 -36.231 47.551 1.00 30.05 H new ATOM 0 HG22 VAL A 903 1.830 -35.838 48.710 1.00 30.05 H new ATOM 0 HG23 VAL A 903 3.385 -35.909 49.001 1.00 30.05 H new ATOM 1923 N PRO A 904 3.131 -40.112 51.037 1.00 29.43 N ATOM 1924 CA PRO A 904 2.964 -41.521 51.429 1.00 30.23 C ATOM 1925 C PRO A 904 2.109 -41.662 52.687 1.00 31.89 C ATOM 1926 O PRO A 904 1.283 -42.564 52.784 1.00 33.18 O ATOM 1927 CB PRO A 904 4.402 -41.995 51.634 1.00 29.83 C ATOM 1928 CG PRO A 904 5.172 -41.162 50.639 1.00 27.10 C ATOM 1929 CD PRO A 904 4.562 -39.788 50.868 1.00 29.32 C ATOM 0 HA PRO A 904 2.491 -42.051 50.768 1.00 30.23 H new ATOM 0 HB2 PRO A 904 4.705 -41.843 52.543 1.00 29.83 H new ATOM 0 HB3 PRO A 904 4.497 -42.944 51.459 1.00 29.83 H new ATOM 0 HG2 PRO A 904 6.126 -41.173 50.813 1.00 27.10 H new ATOM 0 HG3 PRO A 904 5.047 -41.471 49.728 1.00 27.10 H new ATOM 0 HD2 PRO A 904 4.931 -39.353 51.653 1.00 29.32 H new ATOM 0 HD3 PRO A 904 4.713 -39.194 50.117 1.00 29.32 H new ATOM 1930 N LYS A 905 2.307 -40.757 53.643 1.00 32.49 N ATOM 1931 CA LYS A 905 1.539 -40.766 54.879 1.00 33.52 C ATOM 1932 C LYS A 905 0.056 -40.723 54.562 1.00 34.54 C ATOM 1933 O LYS A 905 -0.769 -41.235 55.313 1.00 35.57 O ATOM 1934 CB LYS A 905 1.891 -39.553 55.738 1.00 35.19 C ATOM 1935 CG LYS A 905 3.310 -39.536 56.257 1.00 37.90 C ATOM 1936 CD LYS A 905 3.489 -38.381 57.213 1.00 38.90 C ATOM 1937 CE LYS A 905 4.845 -38.408 57.870 1.00 40.53 C ATOM 1938 NZ LYS A 905 4.982 -37.284 58.838 1.00 44.97 N ATOM 0 H LYS A 905 2.888 -40.125 53.591 1.00 32.49 H new ATOM 0 HA LYS A 905 1.754 -41.578 55.365 1.00 33.52 H new ATOM 0 HB2 LYS A 905 1.741 -38.749 55.217 1.00 35.19 H new ATOM 0 HB3 LYS A 905 1.283 -39.520 56.493 1.00 35.19 H new ATOM 0 HG2 LYS A 905 3.509 -40.372 56.706 1.00 37.90 H new ATOM 0 HG3 LYS A 905 3.933 -39.455 55.518 1.00 37.90 H new ATOM 0 HD2 LYS A 905 3.377 -37.544 56.735 1.00 38.90 H new ATOM 0 HD3 LYS A 905 2.798 -38.414 57.893 1.00 38.90 H new ATOM 0 HE2 LYS A 905 4.971 -39.253 58.329 1.00 40.53 H new ATOM 0 HE3 LYS A 905 5.538 -38.346 57.195 1.00 40.53 H new ATOM 0 HZ1 LYS A 905 5.787 -37.314 59.217 1.00 44.97 H new ATOM 0 HZ2 LYS A 905 4.885 -36.510 58.410 1.00 44.97 H new ATOM 0 HZ3 LYS A 905 4.356 -37.355 59.467 1.00 44.97 H new ATOM 1939 N ILE A 906 -0.284 -40.092 53.447 1.00 36.26 N ATOM 1940 CA ILE A 906 -1.675 -39.993 53.049 1.00 35.55 C ATOM 1941 C ILE A 906 -2.129 -41.299 52.413 1.00 36.34 C ATOM 1942 O ILE A 906 -3.180 -41.845 52.759 1.00 36.95 O ATOM 1943 CB ILE A 906 -1.889 -38.843 52.032 1.00 35.01 C ATOM 1944 CG1 ILE A 906 -1.578 -37.496 52.695 1.00 33.15 C ATOM 1945 CG2 ILE A 906 -3.320 -38.875 51.506 1.00 31.54 C ATOM 1946 CD1 ILE A 906 -1.722 -36.293 51.770 1.00 32.38 C ATOM 0 H ILE A 906 0.274 -39.717 52.911 1.00 36.26 H new ATOM 0 HA ILE A 906 -2.196 -39.809 53.846 1.00 35.55 H new ATOM 0 HB ILE A 906 -1.286 -38.960 51.281 1.00 35.01 H new ATOM 0 HG12 ILE A 906 -2.168 -37.378 53.456 1.00 33.15 H new ATOM 0 HG13 ILE A 906 -0.672 -37.519 53.040 1.00 33.15 H new ATOM 0 HG21 ILE A 906 -3.448 -38.153 50.870 1.00 31.54 H new ATOM 0 HG22 ILE A 906 -3.485 -39.724 51.068 1.00 31.54 H new ATOM 0 HG23 ILE A 906 -3.939 -38.768 52.245 1.00 31.54 H new ATOM 0 HD11 ILE A 906 -1.510 -35.482 52.258 1.00 32.38 H new ATOM 0 HD12 ILE A 906 -1.114 -36.387 51.020 1.00 32.38 H new ATOM 0 HD13 ILE A 906 -2.634 -36.244 51.442 1.00 32.38 H new ATOM 1947 N LEU A 907 -1.325 -41.790 51.479 1.00 33.81 N ATOM 1948 CA LEU A 907 -1.638 -43.017 50.766 1.00 32.56 C ATOM 1949 C LEU A 907 -1.724 -44.242 51.670 1.00 33.07 C ATOM 1950 O LEU A 907 -2.502 -45.151 51.393 1.00 32.58 O ATOM 1951 CB LEU A 907 -0.608 -43.247 49.660 1.00 29.85 C ATOM 1952 CG LEU A 907 -0.593 -42.128 48.617 1.00 29.09 C ATOM 1953 CD1 LEU A 907 0.544 -42.328 47.628 1.00 28.62 C ATOM 1954 CD2 LEU A 907 -1.936 -42.103 47.901 1.00 29.42 C ATOM 0 H LEU A 907 -0.585 -41.422 51.242 1.00 33.81 H new ATOM 0 HA LEU A 907 -2.522 -42.901 50.384 1.00 32.56 H new ATOM 0 HB2 LEU A 907 0.274 -43.325 50.057 1.00 29.85 H new ATOM 0 HB3 LEU A 907 -0.796 -44.091 49.220 1.00 29.85 H new ATOM 0 HG LEU A 907 -0.448 -41.277 49.059 1.00 29.09 H new ATOM 0 HD11 LEU A 907 0.536 -41.610 46.976 1.00 28.62 H new ATOM 0 HD12 LEU A 907 1.390 -42.325 48.102 1.00 28.62 H new ATOM 0 HD13 LEU A 907 0.432 -43.178 47.173 1.00 28.62 H new ATOM 0 HD21 LEU A 907 -1.936 -41.396 47.237 1.00 29.42 H new ATOM 0 HD22 LEU A 907 -2.086 -42.956 47.464 1.00 29.42 H new ATOM 0 HD23 LEU A 907 -2.643 -41.941 48.545 1.00 29.42 H new ATOM 1955 N SER A 908 -0.937 -44.257 52.747 1.00 32.13 N ATOM 1956 CA SER A 908 -0.932 -45.380 53.688 1.00 32.54 C ATOM 1957 C SER A 908 -1.973 -45.240 54.811 1.00 33.92 C ATOM 1958 O SER A 908 -1.956 -46.012 55.771 1.00 34.48 O ATOM 1959 CB SER A 908 0.459 -45.546 54.313 1.00 28.89 C ATOM 1960 OG SER A 908 0.721 -44.510 55.244 1.00 25.26 O ATOM 0 H SER A 908 -0.395 -43.622 52.952 1.00 32.13 H new ATOM 0 HA SER A 908 -1.169 -46.165 53.169 1.00 32.54 H new ATOM 0 HB2 SER A 908 0.518 -46.407 54.756 1.00 28.89 H new ATOM 0 HB3 SER A 908 1.134 -45.538 53.616 1.00 28.89 H new ATOM 0 HG SER A 908 0.931 -43.809 54.832 1.00 25.26 H new ATOM 1961 N GLY A 909 -2.857 -44.249 54.698 1.00 33.48 N ATOM 1962 CA GLY A 909 -3.905 -44.060 55.693 1.00 33.52 C ATOM 1963 C GLY A 909 -3.569 -43.332 56.990 1.00 32.31 C ATOM 1964 O GLY A 909 -4.433 -43.183 57.857 1.00 32.91 O ATOM 0 H GLY A 909 -2.865 -43.679 54.054 1.00 33.48 H new ATOM 0 HA2 GLY A 909 -4.631 -43.578 55.266 1.00 33.52 H new ATOM 0 HA3 GLY A 909 -4.246 -44.937 55.929 1.00 33.52 H new ATOM 1965 N LYS A 910 -2.328 -42.880 57.137 1.00 32.97 N ATOM 1966 CA LYS A 910 -1.911 -42.172 58.344 1.00 33.93 C ATOM 1967 C LYS A 910 -2.497 -40.762 58.429 1.00 34.41 C ATOM 1968 O LYS A 910 -2.695 -40.226 59.521 1.00 35.47 O ATOM 1969 CB LYS A 910 -0.396 -42.067 58.393 1.00 35.52 C ATOM 1970 CG LYS A 910 0.340 -43.332 58.759 1.00 38.54 C ATOM 1971 CD LYS A 910 1.814 -42.977 58.858 1.00 41.67 C ATOM 1972 CE LYS A 910 2.642 -44.047 59.498 1.00 41.31 C ATOM 1973 NZ LYS A 910 4.047 -43.555 59.606 1.00 45.01 N ATOM 0 H LYS A 910 -1.709 -42.973 56.547 1.00 32.97 H new ATOM 0 HA LYS A 910 -2.245 -42.687 59.095 1.00 33.93 H new ATOM 0 HB2 LYS A 910 -0.081 -41.770 57.525 1.00 35.52 H new ATOM 0 HB3 LYS A 910 -0.157 -41.378 59.032 1.00 35.52 H new ATOM 0 HG2 LYS A 910 0.015 -43.686 59.602 1.00 38.54 H new ATOM 0 HG3 LYS A 910 0.197 -44.018 58.089 1.00 38.54 H new ATOM 0 HD2 LYS A 910 2.158 -42.800 57.968 1.00 41.67 H new ATOM 0 HD3 LYS A 910 1.909 -42.157 59.367 1.00 41.67 H new ATOM 0 HE2 LYS A 910 2.292 -44.264 60.376 1.00 41.31 H new ATOM 0 HE3 LYS A 910 2.609 -44.860 58.970 1.00 41.31 H new ATOM 0 HZ1 LYS A 910 4.553 -44.181 59.985 1.00 45.01 H new ATOM 0 HZ2 LYS A 910 4.361 -43.372 58.794 1.00 45.01 H new ATOM 0 HZ3 LYS A 910 4.066 -42.817 60.104 1.00 45.01 H new ATOM 1974 N VAL A 911 -2.753 -40.172 57.266 1.00 33.88 N ATOM 1975 CA VAL A 911 -3.318 -38.831 57.152 1.00 32.85 C ATOM 1976 C VAL A 911 -4.565 -38.940 56.283 1.00 30.83 C ATOM 1977 O VAL A 911 -4.512 -39.492 55.189 1.00 28.70 O ATOM 1978 CB VAL A 911 -2.310 -37.867 56.488 1.00 32.26 C ATOM 1979 CG1 VAL A 911 -2.971 -36.532 56.193 1.00 31.31 C ATOM 1980 CG2 VAL A 911 -1.115 -37.674 57.398 1.00 33.37 C ATOM 0 H VAL A 911 -2.601 -40.546 56.507 1.00 33.88 H new ATOM 0 HA VAL A 911 -3.529 -38.482 58.032 1.00 32.85 H new ATOM 0 HB VAL A 911 -2.010 -38.251 55.649 1.00 32.26 H new ATOM 0 HG11 VAL A 911 -2.328 -35.937 55.777 1.00 31.31 H new ATOM 0 HG12 VAL A 911 -3.721 -36.668 55.593 1.00 31.31 H new ATOM 0 HG13 VAL A 911 -3.287 -36.137 57.021 1.00 31.31 H new ATOM 0 HG21 VAL A 911 -0.483 -37.068 56.979 1.00 33.37 H new ATOM 0 HG22 VAL A 911 -1.409 -37.300 58.243 1.00 33.37 H new ATOM 0 HG23 VAL A 911 -0.686 -38.530 57.555 1.00 33.37 H new ATOM 1981 N LYS A 912 -5.681 -38.416 56.775 1.00 30.88 N ATOM 1982 CA LYS A 912 -6.934 -38.498 56.048 1.00 33.64 C ATOM 1983 C LYS A 912 -7.674 -37.174 55.916 1.00 34.66 C ATOM 1984 O LYS A 912 -7.523 -36.271 56.741 1.00 33.29 O ATOM 1985 CB LYS A 912 -7.879 -39.488 56.729 1.00 34.67 C ATOM 1986 CG LYS A 912 -7.411 -40.920 56.766 1.00 40.50 C ATOM 1987 CD LYS A 912 -8.508 -41.796 57.375 1.00 44.38 C ATOM 1988 CE LYS A 912 -8.134 -43.268 57.339 1.00 48.12 C ATOM 1989 NZ LYS A 912 -9.239 -44.112 57.872 1.00 51.32 N ATOM 0 H LYS A 912 -5.731 -38.008 57.531 1.00 30.88 H new ATOM 0 HA LYS A 912 -6.684 -38.787 55.156 1.00 33.64 H new ATOM 0 HB2 LYS A 912 -8.030 -39.191 57.640 1.00 34.67 H new ATOM 0 HB3 LYS A 912 -8.735 -39.457 56.275 1.00 34.67 H new ATOM 0 HG2 LYS A 912 -7.199 -41.225 55.870 1.00 40.50 H new ATOM 0 HG3 LYS A 912 -6.598 -40.992 57.290 1.00 40.50 H new ATOM 0 HD2 LYS A 912 -8.668 -41.524 58.292 1.00 44.38 H new ATOM 0 HD3 LYS A 912 -9.337 -41.660 56.891 1.00 44.38 H new ATOM 0 HE2 LYS A 912 -7.932 -43.532 56.428 1.00 48.12 H new ATOM 0 HE3 LYS A 912 -7.330 -43.414 57.862 1.00 48.12 H new ATOM 0 HZ1 LYS A 912 -9.000 -44.969 57.842 1.00 51.32 H new ATOM 0 HZ2 LYS A 912 -9.409 -43.881 58.715 1.00 51.32 H new ATOM 0 HZ3 LYS A 912 -9.970 -43.991 57.378 1.00 51.32 H new ATOM 1990 N PRO A 913 -8.496 -37.054 54.866 1.00 34.61 N ATOM 1991 CA PRO A 913 -9.276 -35.842 54.622 1.00 35.37 C ATOM 1992 C PRO A 913 -10.457 -35.808 55.592 1.00 36.14 C ATOM 1993 O PRO A 913 -10.858 -36.835 56.136 1.00 31.51 O ATOM 1994 CB PRO A 913 -9.750 -36.014 53.176 1.00 37.64 C ATOM 1995 CG PRO A 913 -8.734 -36.967 52.571 1.00 36.44 C ATOM 1996 CD PRO A 913 -8.514 -37.939 53.688 1.00 34.42 C ATOM 0 HA PRO A 913 -8.783 -35.016 54.750 1.00 35.37 H new ATOM 0 HB2 PRO A 913 -10.648 -36.379 53.137 1.00 37.64 H new ATOM 0 HB3 PRO A 913 -9.768 -35.167 52.704 1.00 37.64 H new ATOM 0 HG2 PRO A 913 -9.074 -37.402 51.773 1.00 36.44 H new ATOM 0 HG3 PRO A 913 -7.915 -36.512 52.319 1.00 36.44 H new ATOM 0 HD2 PRO A 913 -9.223 -38.598 53.740 1.00 34.42 H new ATOM 0 HD3 PRO A 913 -7.681 -38.426 53.587 1.00 34.42 H new ATOM 1997 N ILE A 914 -10.999 -34.618 55.817 1.00 36.75 N ATOM 1998 CA ILE A 914 -12.151 -34.466 56.685 1.00 35.77 C ATOM 1999 C ILE A 914 -13.338 -34.294 55.751 1.00 37.17 C ATOM 2000 O ILE A 914 -13.414 -33.319 55.011 1.00 37.58 O ATOM 2001 CB ILE A 914 -12.028 -33.225 57.590 1.00 35.66 C ATOM 2002 CG1 ILE A 914 -10.811 -33.370 58.513 1.00 36.22 C ATOM 2003 CG2 ILE A 914 -13.283 -33.073 58.443 1.00 35.96 C ATOM 2004 CD1 ILE A 914 -10.518 -32.125 59.344 1.00 37.74 C ATOM 0 H ILE A 914 -10.711 -33.884 55.473 1.00 36.75 H new ATOM 0 HA ILE A 914 -12.239 -35.232 57.274 1.00 35.77 H new ATOM 0 HB ILE A 914 -11.921 -32.441 57.028 1.00 35.66 H new ATOM 0 HG12 ILE A 914 -10.956 -34.121 59.110 1.00 36.22 H new ATOM 0 HG13 ILE A 914 -10.031 -33.581 57.976 1.00 36.22 H new ATOM 0 HG21 ILE A 914 -13.197 -32.290 59.009 1.00 35.96 H new ATOM 0 HG22 ILE A 914 -14.056 -32.971 57.866 1.00 35.96 H new ATOM 0 HG23 ILE A 914 -13.395 -33.861 58.997 1.00 35.96 H new ATOM 0 HD11 ILE A 914 -9.741 -32.284 59.902 1.00 37.74 H new ATOM 0 HD12 ILE A 914 -10.344 -31.375 58.754 1.00 37.74 H new ATOM 0 HD13 ILE A 914 -11.283 -31.923 59.905 1.00 37.74 H new ATOM 2005 N TYR A 915 -14.242 -35.265 55.754 1.00 37.73 N ATOM 2006 CA TYR A 915 -15.421 -35.193 54.901 1.00 39.62 C ATOM 2007 C TYR A 915 -16.613 -34.679 55.706 1.00 39.67 C ATOM 2008 O TYR A 915 -16.769 -35.022 56.876 1.00 40.21 O ATOM 2009 CB TYR A 915 -15.764 -36.574 54.316 1.00 38.76 C ATOM 2010 CG TYR A 915 -14.803 -37.091 53.256 1.00 39.43 C ATOM 2011 CD1 TYR A 915 -13.753 -37.955 53.585 1.00 39.33 C ATOM 2012 CD2 TYR A 915 -14.957 -36.726 51.919 1.00 39.74 C ATOM 2013 CE1 TYR A 915 -12.882 -38.443 52.599 1.00 39.45 C ATOM 2014 CE2 TYR A 915 -14.100 -37.205 50.933 1.00 40.43 C ATOM 2015 CZ TYR A 915 -13.066 -38.063 51.277 1.00 41.31 C ATOM 2016 OH TYR A 915 -12.237 -38.543 50.292 1.00 41.71 O ATOM 0 H TYR A 915 -14.192 -35.972 56.241 1.00 37.73 H new ATOM 0 HA TYR A 915 -15.227 -34.584 54.171 1.00 39.62 H new ATOM 0 HB2 TYR A 915 -15.797 -37.217 55.042 1.00 38.76 H new ATOM 0 HB3 TYR A 915 -16.654 -36.534 53.932 1.00 38.76 H new ATOM 0 HD1 TYR A 915 -13.630 -38.210 54.471 1.00 39.33 H new ATOM 0 HD2 TYR A 915 -15.647 -36.150 51.681 1.00 39.74 H new ATOM 0 HE1 TYR A 915 -12.187 -39.016 52.830 1.00 39.45 H new ATOM 0 HE2 TYR A 915 -14.220 -36.951 50.047 1.00 40.43 H new ATOM 0 HH TYR A 915 -12.471 -38.227 49.550 1.00 41.71 H new ATOM 2017 N PHE A 916 -17.436 -33.844 55.075 1.00 39.50 N ATOM 2018 CA PHE A 916 -18.628 -33.308 55.711 1.00 41.02 C ATOM 2019 C PHE A 916 -19.667 -34.419 55.792 1.00 44.02 C ATOM 2020 O PHE A 916 -20.272 -34.657 56.837 1.00 44.86 O ATOM 2021 CB PHE A 916 -19.188 -32.138 54.898 1.00 39.59 C ATOM 2022 CG PHE A 916 -18.456 -30.852 55.121 1.00 36.67 C ATOM 2023 CD1 PHE A 916 -17.398 -30.484 54.300 1.00 34.00 C ATOM 2024 CD2 PHE A 916 -18.784 -30.040 56.207 1.00 35.87 C ATOM 2025 CE1 PHE A 916 -16.667 -29.324 54.555 1.00 34.78 C ATOM 2026 CE2 PHE A 916 -18.061 -28.880 56.471 1.00 36.17 C ATOM 2027 CZ PHE A 916 -16.997 -28.522 55.641 1.00 34.65 C ATOM 0 H PHE A 916 -17.316 -33.575 54.267 1.00 39.50 H new ATOM 0 HA PHE A 916 -18.407 -32.984 56.598 1.00 41.02 H new ATOM 0 HB2 PHE A 916 -19.153 -32.363 53.955 1.00 39.59 H new ATOM 0 HB3 PHE A 916 -20.123 -32.013 55.125 1.00 39.59 H new ATOM 0 HD1 PHE A 916 -17.174 -31.017 53.572 1.00 34.00 H new ATOM 0 HD2 PHE A 916 -19.493 -30.276 56.760 1.00 35.87 H new ATOM 0 HE1 PHE A 916 -15.960 -29.088 53.999 1.00 34.78 H new ATOM 0 HE2 PHE A 916 -18.286 -28.345 57.198 1.00 36.17 H new ATOM 0 HZ PHE A 916 -16.510 -27.749 55.814 1.00 34.65 H new ATOM 2028 N HIS A 917 -19.858 -35.088 54.661 1.00 46.66 N ATOM 2029 CA HIS A 917 -20.791 -36.197 54.531 1.00 48.89 C ATOM 2030 C HIS A 917 -19.870 -37.407 54.418 1.00 53.23 C ATOM 2031 O HIS A 917 -18.693 -37.255 54.087 1.00 55.28 O ATOM 2032 CB HIS A 917 -21.605 -36.025 53.249 1.00 45.09 C ATOM 2033 CG HIS A 917 -22.118 -34.633 53.044 1.00 39.29 C ATOM 2034 ND1 HIS A 917 -23.257 -34.159 53.657 1.00 39.58 N ATOM 2035 CD2 HIS A 917 -21.626 -33.600 52.320 1.00 38.21 C ATOM 2036 CE1 HIS A 917 -23.445 -32.895 53.320 1.00 36.87 C ATOM 2037 NE2 HIS A 917 -22.469 -32.532 52.510 1.00 37.71 N ATOM 0 H HIS A 917 -19.439 -34.905 53.933 1.00 46.66 H new ATOM 0 HA HIS A 917 -21.424 -36.269 55.263 1.00 48.89 H new ATOM 0 HB2 HIS A 917 -21.054 -36.273 52.490 1.00 45.09 H new ATOM 0 HB3 HIS A 917 -22.356 -36.639 53.267 1.00 45.09 H new ATOM 0 HD1 HIS A 917 -23.767 -34.615 54.178 1.00 39.58 H new ATOM 0 HD2 HIS A 917 -20.860 -33.611 51.792 1.00 38.21 H new ATOM 0 HE1 HIS A 917 -24.146 -32.354 53.605 1.00 36.87 H new ATOM 2038 N THR A 918 -20.375 -38.604 54.687 1.00 56.81 N ATOM 2039 CA THR A 918 -19.509 -39.777 54.603 1.00 59.84 C ATOM 2040 C THR A 918 -19.761 -40.665 53.387 1.00 60.88 C ATOM 2041 O THR A 918 -20.780 -40.457 52.693 1.00 62.22 O ATOM 2042 CB THR A 918 -19.597 -40.622 55.897 1.00 60.71 C ATOM 2043 OG1 THR A 918 -20.961 -40.709 56.329 1.00 62.60 O ATOM 2044 CG2 THR A 918 -18.758 -39.987 56.999 1.00 61.23 C ATOM 0 H THR A 918 -21.190 -38.759 54.913 1.00 56.81 H new ATOM 0 HA THR A 918 -18.613 -39.420 54.496 1.00 59.84 H new ATOM 0 HB THR A 918 -19.258 -41.511 55.711 1.00 60.71 H new ATOM 0 HG1 THR A 918 -21.004 -41.169 57.030 1.00 62.60 H new ATOM 0 HG21 THR A 918 -18.821 -40.524 57.804 1.00 61.23 H new ATOM 0 HG22 THR A 918 -17.832 -39.939 56.714 1.00 61.23 H new ATOM 0 HG23 THR A 918 -19.086 -39.093 57.181 1.00 61.23 H new TER 2045 THR A 918 ATOM 2046 N SER B 99 14.969 -27.759 54.917 1.00 59.02 N ATOM 2047 CA SER B 99 14.879 -27.660 53.429 1.00 58.46 C ATOM 2048 C SER B 99 14.351 -26.289 53.014 1.00 57.53 C ATOM 2049 O SER B 99 14.046 -25.449 53.867 1.00 56.57 O ATOM 2050 CB SER B 99 13.953 -28.754 52.897 1.00 59.03 C ATOM 2051 OG SER B 99 12.682 -28.678 53.519 1.00 60.69 O ATOM 0 HA SER B 99 15.766 -27.776 53.055 1.00 58.46 H new ATOM 0 HB2 SER B 99 13.854 -28.662 51.936 1.00 59.03 H new ATOM 0 HB3 SER B 99 14.347 -29.625 53.060 1.00 59.03 H new ATOM 0 HG SER B 99 12.768 -28.371 54.296 1.00 60.69 H new ATOM 2052 N ARG B 100 14.244 -26.059 51.707 1.00 56.18 N ATOM 2053 CA ARG B 100 13.746 -24.779 51.222 1.00 54.28 C ATOM 2054 C ARG B 100 12.323 -24.542 51.735 1.00 52.40 C ATOM 2055 O ARG B 100 11.960 -23.414 52.086 1.00 52.22 O ATOM 2056 CB ARG B 100 13.742 -24.721 49.689 1.00 55.11 C ATOM 2057 CG ARG B 100 13.406 -23.322 49.165 1.00 56.52 C ATOM 2058 CD ARG B 100 13.006 -23.277 47.692 1.00 56.74 C ATOM 2059 NE ARG B 100 12.454 -21.963 47.357 1.00 55.59 N ATOM 2060 CZ ARG B 100 11.847 -21.658 46.213 1.00 55.18 C ATOM 2061 NH1 ARG B 100 11.702 -22.571 45.261 1.00 54.06 N ATOM 2062 NH2 ARG B 100 11.368 -20.436 46.026 1.00 54.76 N ATOM 0 H ARG B 100 14.452 -26.624 51.093 1.00 56.18 H new ATOM 0 HA ARG B 100 14.340 -24.088 51.555 1.00 54.28 H new ATOM 0 HB2 ARG B 100 14.612 -24.990 49.354 1.00 55.11 H new ATOM 0 HB3 ARG B 100 13.096 -25.358 49.344 1.00 55.11 H new ATOM 0 HG2 ARG B 100 12.682 -22.955 49.696 1.00 56.52 H new ATOM 0 HG3 ARG B 100 14.175 -22.746 49.297 1.00 56.52 H new ATOM 0 HD2 ARG B 100 13.778 -23.462 47.135 1.00 56.74 H new ATOM 0 HD3 ARG B 100 12.350 -23.967 47.507 1.00 56.74 H new ATOM 0 HE ARG B 100 12.528 -21.340 47.945 1.00 55.59 H new ATOM 0 HH11 ARG B 100 12.002 -23.368 45.381 1.00 54.06 H new ATOM 0 HH12 ARG B 100 11.308 -22.365 44.525 1.00 54.06 H new ATOM 0 HH21 ARG B 100 11.450 -19.843 46.643 1.00 54.76 H new ATOM 0 HH22 ARG B 100 10.975 -20.236 45.287 1.00 54.76 H new ATOM 2063 N PHE B 101 11.521 -25.605 51.779 1.00 49.38 N ATOM 2064 CA PHE B 101 10.147 -25.487 52.253 1.00 45.86 C ATOM 2065 C PHE B 101 10.169 -25.085 53.721 1.00 46.09 C ATOM 2066 O PHE B 101 9.504 -24.128 54.127 1.00 47.15 O ATOM 2067 CB PHE B 101 9.397 -26.812 52.089 1.00 41.85 C ATOM 2068 CG PHE B 101 7.953 -26.735 52.501 1.00 37.81 C ATOM 2069 CD1 PHE B 101 7.013 -26.133 51.673 1.00 35.57 C ATOM 2070 CD2 PHE B 101 7.544 -27.210 53.743 1.00 35.33 C ATOM 2071 CE1 PHE B 101 5.690 -26.003 52.078 1.00 32.87 C ATOM 2072 CE2 PHE B 101 6.228 -27.082 54.155 1.00 33.23 C ATOM 2073 CZ PHE B 101 5.297 -26.477 53.321 1.00 32.30 C ATOM 0 H PHE B 101 11.753 -26.398 51.540 1.00 49.38 H new ATOM 0 HA PHE B 101 9.686 -24.814 51.728 1.00 45.86 H new ATOM 0 HB2 PHE B 101 9.447 -27.092 51.162 1.00 41.85 H new ATOM 0 HB3 PHE B 101 9.841 -27.495 52.616 1.00 41.85 H new ATOM 0 HD1 PHE B 101 7.272 -25.814 50.839 1.00 35.57 H new ATOM 0 HD2 PHE B 101 8.163 -27.619 54.304 1.00 35.33 H new ATOM 0 HE1 PHE B 101 5.069 -25.599 51.516 1.00 32.87 H new ATOM 0 HE2 PHE B 101 5.968 -27.401 54.989 1.00 33.23 H new ATOM 0 HZ PHE B 101 4.413 -26.390 53.595 1.00 32.30 H new ATOM 2074 N ALA B 102 10.949 -25.814 54.512 1.00 46.51 N ATOM 2075 CA ALA B 102 11.076 -25.530 55.936 1.00 47.53 C ATOM 2076 C ALA B 102 11.608 -24.118 56.188 1.00 48.00 C ATOM 2077 O ALA B 102 11.221 -23.469 57.156 1.00 47.06 O ATOM 2078 CB ALA B 102 11.993 -26.552 56.587 1.00 47.24 C ATOM 0 H ALA B 102 11.417 -26.483 54.240 1.00 46.51 H new ATOM 0 HA ALA B 102 10.191 -25.587 56.329 1.00 47.53 H new ATOM 0 HB1 ALA B 102 12.074 -26.358 57.534 1.00 47.24 H new ATOM 0 HB2 ALA B 102 11.622 -27.441 56.470 1.00 47.24 H new ATOM 0 HB3 ALA B 102 12.869 -26.511 56.173 1.00 47.24 H new ATOM 2079 N ASP B 103 12.493 -23.643 55.316 1.00 50.18 N ATOM 2080 CA ASP B 103 13.065 -22.307 55.471 1.00 52.78 C ATOM 2081 C ASP B 103 11.998 -21.218 55.415 1.00 54.61 C ATOM 2082 O ASP B 103 12.216 -20.090 55.873 1.00 54.24 O ATOM 2083 CB ASP B 103 14.120 -22.048 54.392 1.00 53.88 C ATOM 2084 CG ASP B 103 15.363 -22.907 54.572 1.00 57.38 C ATOM 2085 OD1 ASP B 103 15.972 -22.867 55.664 1.00 57.64 O ATOM 2086 OD2 ASP B 103 15.737 -23.621 53.619 1.00 59.71 O ATOM 0 H ASP B 103 12.775 -24.077 54.629 1.00 50.18 H new ATOM 0 HA ASP B 103 13.480 -22.275 56.347 1.00 52.78 H new ATOM 0 HB2 ASP B 103 13.734 -22.222 53.519 1.00 53.88 H new ATOM 0 HB3 ASP B 103 14.373 -21.112 54.409 1.00 53.88 H new ATOM 2087 N PHE B 104 10.843 -21.559 54.854 1.00 55.63 N ATOM 2088 CA PHE B 104 9.744 -20.611 54.743 1.00 56.03 C ATOM 2089 C PHE B 104 9.120 -20.306 56.100 1.00 56.10 C ATOM 2090 O PHE B 104 8.433 -19.301 56.264 1.00 55.60 O ATOM 2091 CB PHE B 104 8.673 -21.158 53.801 1.00 56.49 C ATOM 2092 CG PHE B 104 9.057 -21.115 52.348 1.00 56.65 C ATOM 2093 CD1 PHE B 104 9.382 -19.910 51.737 1.00 56.14 C ATOM 2094 CD2 PHE B 104 9.057 -22.272 51.580 1.00 56.54 C ATOM 2095 CE1 PHE B 104 9.698 -19.860 50.377 1.00 55.47 C ATOM 2096 CE2 PHE B 104 9.371 -22.227 50.224 1.00 56.68 C ATOM 2097 CZ PHE B 104 9.691 -21.018 49.623 1.00 53.86 C ATOM 0 H PHE B 104 10.676 -22.338 54.530 1.00 55.63 H new ATOM 0 HA PHE B 104 10.107 -19.785 54.386 1.00 56.03 H new ATOM 0 HB2 PHE B 104 8.477 -22.076 54.047 1.00 56.49 H new ATOM 0 HB3 PHE B 104 7.856 -20.650 53.925 1.00 56.49 H new ATOM 0 HD1 PHE B 104 9.389 -19.127 52.239 1.00 56.14 H new ATOM 0 HD2 PHE B 104 8.845 -23.086 51.976 1.00 56.54 H new ATOM 0 HE1 PHE B 104 9.913 -19.047 49.979 1.00 55.47 H new ATOM 0 HE2 PHE B 104 9.366 -23.009 49.720 1.00 56.68 H new ATOM 0 HZ PHE B 104 9.900 -20.987 48.717 1.00 53.86 H new ATOM 2098 N PHE B 105 9.359 -21.178 57.070 1.00 57.86 N ATOM 2099 CA PHE B 105 8.812 -20.997 58.411 1.00 61.09 C ATOM 2100 C PHE B 105 9.957 -20.960 59.401 1.00 64.42 C ATOM 2101 O PHE B 105 9.751 -20.877 60.611 1.00 65.07 O ATOM 2102 CB PHE B 105 7.883 -22.159 58.774 1.00 58.55 C ATOM 2103 CG PHE B 105 6.772 -22.376 57.795 1.00 56.37 C ATOM 2104 CD1 PHE B 105 7.037 -22.859 56.518 1.00 54.50 C ATOM 2105 CD2 PHE B 105 5.456 -22.090 58.148 1.00 55.14 C ATOM 2106 CE1 PHE B 105 6.009 -23.054 55.607 1.00 55.11 C ATOM 2107 CE2 PHE B 105 4.421 -22.282 57.243 1.00 54.55 C ATOM 2108 CZ PHE B 105 4.698 -22.765 55.969 1.00 54.99 C ATOM 0 H PHE B 105 9.838 -21.886 56.973 1.00 57.86 H new ATOM 0 HA PHE B 105 8.307 -20.170 58.438 1.00 61.09 H new ATOM 0 HB2 PHE B 105 8.407 -22.972 58.840 1.00 58.55 H new ATOM 0 HB3 PHE B 105 7.502 -21.995 59.651 1.00 58.55 H new ATOM 0 HD1 PHE B 105 7.913 -23.053 56.272 1.00 54.50 H new ATOM 0 HD2 PHE B 105 5.268 -21.767 59.000 1.00 55.14 H new ATOM 0 HE1 PHE B 105 6.196 -23.378 54.755 1.00 55.11 H new ATOM 0 HE2 PHE B 105 3.545 -22.088 57.488 1.00 54.55 H new ATOM 0 HZ PHE B 105 4.007 -22.895 55.360 1.00 54.99 H new ATOM 2109 N ARG B 106 11.169 -21.022 58.866 1.00 68.24 N ATOM 2110 CA ARG B 106 12.370 -21.030 59.682 1.00 71.90 C ATOM 2111 C ARG B 106 13.384 -20.041 59.110 1.00 72.81 C ATOM 2112 O ARG B 106 14.483 -20.476 58.698 1.00 73.23 O ATOM 2113 CB ARG B 106 12.935 -22.453 59.695 1.00 73.82 C ATOM 2114 CG ARG B 106 14.089 -22.711 60.647 1.00 77.22 C ATOM 2115 CD ARG B 106 14.491 -24.175 60.538 1.00 79.46 C ATOM 2116 NE ARG B 106 14.759 -24.542 59.148 1.00 81.20 N ATOM 2117 CZ ARG B 106 14.736 -25.786 58.678 1.00 82.99 C ATOM 2118 NH1 ARG B 106 14.454 -26.799 59.488 1.00 83.53 N ATOM 2119 NH2 ARG B 106 14.988 -26.016 57.396 1.00 83.50 N ATOM 0 H ARG B 106 11.317 -21.061 58.020 1.00 68.24 H new ATOM 0 HA ARG B 106 12.168 -20.759 60.591 1.00 71.90 H new ATOM 0 HB2 ARG B 106 12.215 -23.064 59.917 1.00 73.82 H new ATOM 0 HB3 ARG B 106 13.227 -22.673 58.796 1.00 73.82 H new ATOM 0 HG2 ARG B 106 14.841 -22.138 60.428 1.00 77.22 H new ATOM 0 HG3 ARG B 106 13.828 -22.500 61.557 1.00 77.22 H new ATOM 0 HD2 ARG B 106 15.281 -24.338 61.077 1.00 79.46 H new ATOM 0 HD3 ARG B 106 13.784 -24.736 60.894 1.00 79.46 H new ATOM 0 HE ARG B 106 14.944 -23.909 58.596 1.00 81.20 H new ATOM 0 HH11 ARG B 106 14.286 -26.652 60.318 1.00 83.53 H new ATOM 0 HH12 ARG B 106 14.440 -27.603 59.182 1.00 83.53 H new ATOM 0 HH21 ARG B 106 15.166 -25.361 56.869 1.00 83.50 H new ATOM 0 HH22 ARG B 106 14.973 -26.821 57.092 1.00 83.50 H new TER 2120 ARG B 106 HETATM 2121 S SO4 A 201 5.000 -39.584 24.696 1.00 70.07 S HETATM 2122 O1 SO4 A 201 4.225 -38.690 25.610 1.00 71.32 O HETATM 2123 O2 SO4 A 201 5.695 -38.729 23.682 1.00 69.87 O HETATM 2124 O3 SO4 A 201 4.050 -40.522 24.013 1.00 71.17 O HETATM 2125 O4 SO4 A 201 5.966 -40.420 25.468 1.00 70.55 O HETATM 2126 C1 DHT A 200 -0.122 -27.923 39.350 1.00 27.87 C HETATM 2127 C2 DHT A 200 -0.885 -26.660 39.771 1.00 29.56 C HETATM 2128 C3 DHT A 200 -2.347 -26.814 39.247 1.00 30.40 C HETATM 2129 O3 DHT A 200 -2.842 -25.882 38.627 1.00 27.36 O HETATM 2130 C4 DHT A 200 -3.061 -28.110 39.523 1.00 28.33 C HETATM 2131 C5 DHT A 200 -2.234 -29.337 39.046 1.00 29.06 C HETATM 2132 C6 DHT A 200 -2.950 -30.699 39.340 1.00 28.98 C HETATM 2133 C7 DHT A 200 -2.087 -31.864 38.823 1.00 29.10 C HETATM 2134 C8 DHT A 200 -0.654 -31.889 39.459 1.00 28.87 C HETATM 2135 C9 DHT A 200 0.051 -30.517 39.175 1.00 29.22 C HETATM 2136 C10 DHT A 200 -0.775 -29.282 39.719 1.00 29.66 C HETATM 2137 C11 DHT A 200 1.498 -30.580 39.782 1.00 28.31 C HETATM 2138 C12 DHT A 200 2.379 -31.748 39.343 1.00 27.20 C HETATM 2139 C13 DHT A 200 1.672 -33.120 39.483 1.00 30.00 C HETATM 2140 C14 DHT A 200 0.225 -33.028 38.881 1.00 29.73 C HETATM 2141 C15 DHT A 200 -0.270 -34.481 39.053 1.00 32.95 C HETATM 2142 C16 DHT A 200 0.958 -35.297 38.565 1.00 30.95 C HETATM 2143 C17 DHT A 200 2.154 -34.299 38.629 1.00 30.59 C HETATM 2144 O17 DHT A 200 3.306 -34.971 39.172 1.00 29.41 O HETATM 2145 C18 DHT A 200 1.647 -33.522 41.024 1.00 27.77 C HETATM 2146 C19 DHT A 200 -0.881 -29.405 41.297 1.00 25.13 C HETATM 0 H193 DHT A 200 0.006 -29.356 41.686 1.00 25.13 H new HETATM 0 H192 DHT A 200 -1.425 -28.680 41.642 1.00 25.13 H new HETATM 0 H191 DHT A 200 -1.289 -30.254 41.529 1.00 25.13 H new HETATM 0 H183 DHT A 200 2.556 -33.583 41.358 1.00 27.77 H new HETATM 0 H182 DHT A 200 1.163 -32.848 41.527 1.00 27.77 H new HETATM 0 H181 DHT A 200 1.207 -34.380 41.128 1.00 27.77 H new HETATM 0 H162 DHT A 200 1.114 -36.069 39.131 1.00 30.95 H new HETATM 0 H161 DHT A 200 0.824 -35.628 37.663 1.00 30.95 H new HETATM 0 H152 DHT A 200 -0.497 -34.681 39.975 1.00 32.95 H new HETATM 0 H151 DHT A 200 -1.061 -34.661 38.521 1.00 32.95 H new HETATM 0 H122 DHT A 200 2.644 -31.618 38.419 1.00 27.20 H new HETATM 0 H121 DHT A 200 3.191 -31.752 39.873 1.00 27.20 H new HETATM 0 H112 DHT A 200 1.956 -29.755 39.558 1.00 28.31 H new HETATM 0 H111 DHT A 200 1.419 -30.607 40.748 1.00 28.31 H new HETATM 0 HO7 DHT A 200 3.969 -34.456 39.145 1.00 29.41 H new HETATM 0 H9 DHT A 200 0.104 -30.376 38.217 1.00 29.22 H new HETATM 0 H8 DHT A 200 -0.756 -32.044 40.411 1.00 28.87 H new HETATM 0 H72 DHT A 200 -2.536 -32.703 39.014 1.00 29.10 H new HETATM 0 H71 DHT A 200 -2.007 -31.798 37.859 1.00 29.10 H new HETATM 0 H62 DHT A 200 -3.101 -30.795 40.293 1.00 28.98 H new HETATM 0 H61 DHT A 200 -3.820 -30.715 38.912 1.00 28.98 H new HETATM 0 H5 DHT A 200 -2.148 -29.288 38.081 1.00 29.06 H new HETATM 0 H42 DHT A 200 -3.235 -28.187 40.474 1.00 28.33 H new HETATM 0 H41 DHT A 200 -3.922 -28.107 39.076 1.00 28.33 H new HETATM 0 H22 DHT A 200 -0.875 -26.559 40.736 1.00 29.56 H new HETATM 0 H21 DHT A 200 -0.469 -25.867 39.398 1.00 29.56 H new HETATM 0 H17 DHT A 200 2.428 -33.970 37.759 1.00 30.59 H new HETATM 0 H14 DHT A 200 0.188 -32.745 37.954 1.00 29.73 H new HETATM 0 H12 DHT A 200 0.001 -27.897 38.388 1.00 27.87 H new HETATM 0 H11 DHT A 200 0.761 -27.892 39.750 1.00 27.87 H new HETATM 2147 O HOH A 1 -7.850 -15.927 49.091 1.00 23.65 O HETATM 2148 O HOH A 2 -8.984 -18.360 49.402 1.00 26.01 O HETATM 2149 O HOH A 3 4.975 -17.007 37.196 1.00 52.12 O HETATM 2150 O HOH A 4 -2.296 -19.030 37.578 1.00 27.84 O HETATM 2151 O HOH A 5 -1.122 -21.242 37.230 1.00 25.06 O HETATM 2152 O HOH A 6 -0.884 -24.167 26.692 1.00 27.58 O HETATM 2153 O HOH A 7 8.919 -29.389 29.938 1.00 31.92 O HETATM 2154 O HOH A 8 -4.019 -23.919 41.151 1.00 27.01 O HETATM 2155 O HOH A 9 -5.752 -46.997 52.817 1.00 68.95 O HETATM 2156 O HOH A 10 -1.796 -25.987 65.825 1.00 28.89 O HETATM 2157 O HOH A 11 -4.422 -32.348 49.098 1.00 29.55 O HETATM 2158 O HOH A 12 -1.349 -32.307 49.006 1.00 38.64 O HETATM 2159 O HOH A 13 -6.844 -32.410 49.597 1.00 37.42 O HETATM 2160 O HOH A 14 -21.640 -15.140 47.550 1.00 32.09 O HETATM 2161 O HOH A 15 -2.764 -33.031 70.326 1.00 47.23 O HETATM 2162 O HOH A 16 -13.728 -30.511 55.339 1.00 37.91 O HETATM 2163 O HOH A 17 -13.769 -28.969 53.232 1.00 46.12 O HETATM 2164 O HOH A 18 -12.723 -31.058 51.180 1.00 30.88 O HETATM 2165 O HOH A 19 -14.885 -36.281 42.953 1.00 40.48 O HETATM 2166 O HOH A 20 -2.899 -47.690 51.856 1.00 28.85 O HETATM 2167 O HOH A 21 0.650 -47.312 57.356 1.00 42.49 O HETATM 2168 O HOH A 22 -5.919 -41.099 53.391 1.00 30.91 O HETATM 2169 O HOH A 23 -14.040 -37.323 57.584 1.00 30.64 O HETATM 2170 O HOH A 24 -10.244 -30.178 24.199 1.00 41.00 O HETATM 2171 O HOH A 25 5.121 -46.422 43.342 1.00 26.62 O HETATM 2172 O HOH A 26 -9.695 -41.295 45.191 1.00 38.69 O HETATM 2173 O HOH A 27 -13.979 -32.657 52.723 1.00 43.42 O HETATM 2174 O HOH A 28 -7.640 -36.361 49.556 1.00 36.10 O HETATM 2175 O HOH A 29 -1.280 -11.316 38.219 1.00 41.07 O HETATM 2176 O HOH A 30 3.873 -28.959 24.100 1.00 38.15 O HETATM 2177 O HOH A 31 12.126 -25.655 24.993 1.00 45.57 O HETATM 2178 O HOH A 32 -4.984 -20.701 47.334 1.00 43.56 O HETATM 2179 O HOH A 33 8.748 -19.081 32.884 1.00 54.65 O HETATM 2180 O HOH A 34 8.772 -32.692 53.371 1.00 56.16 O HETATM 2181 O HOH A 35 -18.607 -8.318 58.248 1.00 52.59 O HETATM 2182 O HOH A 36 -4.289 -44.798 45.549 1.00 40.21 O HETATM 2183 O HOH A 37 -19.075 -34.943 47.430 1.00 36.85 O HETATM 2184 O HOH A 38 -4.102 -42.158 39.878 1.00 43.21 O HETATM 2185 O HOH A 39 8.952 -40.361 28.988 1.00 38.73 O HETATM 2186 O HOH A 40 -1.446 -39.946 62.142 1.00 54.79 O HETATM 2187 O HOH A 41 0.568 -45.688 47.120 1.00 52.61 O HETATM 2188 O HOH A 43 -6.753 -21.021 66.697 1.00 48.83 O HETATM 2189 O HOH A 44 -2.794 -21.976 43.388 1.00 45.12 O HETATM 2190 O HOH A 45 -2.599 -44.218 32.474 1.00 50.35 O HETATM 2191 O HOH A 46 -15.843 -40.404 44.143 1.00 47.96 O HETATM 2192 O HOH A 47 2.101 -39.998 26.441 1.00 39.76 O HETATM 2193 O HOH A 48 -13.982 -38.648 28.531 1.00 53.52 O HETATM 2194 O HOH A 49 5.866 -19.986 28.833 1.00 53.84 O HETATM 2195 O HOH A 50 -7.800 -30.470 51.933 1.00 36.29 O HETATM 2196 O HOH A 51 7.927 -38.665 27.150 1.00 39.91 O HETATM 2197 O HOH A 52 -10.591 -41.365 47.808 1.00 38.49 O HETATM 2198 O HOH A 53 -1.609 -44.055 39.504 1.00 42.25 O HETATM 2199 O HOH A 54 2.723 -48.193 43.655 1.00 53.53 O HETATM 2200 O HOH A 55 -17.657 -14.435 55.642 1.00 44.72 O HETATM 2201 O HOH A 56 -11.912 -16.044 60.928 1.00 47.50 O HETATM 2202 O HOH A 57 -10.124 -16.713 62.959 1.00 49.97 O HETATM 2203 O HOH A 58 -9.906 -6.836 49.529 1.00 41.84 O HETATM 2204 O HOH A 59 -13.857 -10.841 46.176 1.00 41.15 O HETATM 2205 O HOH A 60 -5.464 -11.751 43.126 1.00 49.52 O HETATM 2206 O HOH A 61 -12.715 -14.786 43.584 1.00 42.56 O HETATM 2207 O HOH A 62 10.167 -19.080 38.866 1.00 57.11 O HETATM 2208 O HOH A 63 -2.062 -15.165 59.028 1.00 40.75 O HETATM 2209 O HOH A 64 2.041 -32.019 62.827 1.00 44.93 O HETATM 2210 O HOH A 65 4.824 -32.921 58.785 1.00 57.98 O HETATM 2211 O HOH A 66 8.600 -30.597 57.217 1.00 44.77 O HETATM 2212 O HOH A 67 -5.436 -29.623 56.579 1.00 39.99 O HETATM 2213 O HOH A 68 -9.991 -16.954 37.543 1.00 39.57 O HETATM 2214 O HOH A 69 -3.942 -25.994 24.490 1.00 46.56 O HETATM 2215 O HOH A 70 -0.604 -41.953 25.831 1.00 59.81 O HETATM 2216 O HOH A 71 -30.305 -19.285 37.952 1.00 45.80 O HETATM 2217 O HOH A 72 -4.614 -29.864 71.650 1.00 48.20 O HETATM 2218 O HOH B 42 12.855 -24.780 44.635 1.00 51.45 O HETATM 2219 O HOH B 73 11.549 -18.086 47.659 1.00 51.21 O HETATM 2220 O HOH B 74 12.422 -28.078 50.474 1.00 52.21 O CONECT 2121 2122 2123 2124 2125 CONECT 2122 2121 CONECT 2123 2121 CONECT 2124 2121 CONECT 2125 2121 CONECT 2126 2127 2136 CONECT 2127 2126 2128 CONECT 2128 2127 2129 2130 CONECT 2129 2128 CONECT 2130 2128 2131 CONECT 2131 2130 2132 2136 CONECT 2132 2131 2133 CONECT 2133 2132 2134 CONECT 2134 2133 2135 2140 CONECT 2135 2134 2136 2137 CONECT 2136 2126 2131 2135 2146 CONECT 2137 2135 2138 CONECT 2138 2137 2139 CONECT 2139 2138 2140 2143 2145 CONECT 2140 2134 2139 2141 CONECT 2141 2140 2142 CONECT 2142 2141 2143 CONECT 2143 2139 2142 2144 CONECT 2144 2143 CONECT 2145 2139 CONECT 2146 2136 END