USER MOD reduce.3.24.130724 H: found=0, std=0, add=2300, rem=0, adj=56 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER HYDROLASE/HYDROLASE INHIBITOR 24-JAN-08 3C27 TITLE CYANOFLUOROPHENYLACETAMIDES AS ORALLY EFFICACIOUS THROMBIN INHIBITORS COMPND MOL_ID: 1; COMPND 2 MOLECULE: THROMBIN LIGHT CHAIN; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: UNP RESIDUES 334-359; COMPND 5 EC: 3.4.21.5; COMPND 6 MOL_ID: 2; COMPND 7 MOLECULE: THROMBIN HEAVY CHAIN; COMPND 8 CHAIN: B; COMPND 9 FRAGMENT: UNP RESIDUES 364-622; COMPND 0 EC: 3.4.21.5; COMPND 1 ENGINEERED: YES; COMPND 2 MOL_ID: 3; COMPND 3 MOLECULE: HIRUDIN-3A; COMPND 4 CHAIN: H; COMPND 5 FRAGMENT: UNP RESIDUES 55-65; COMPND 6 SYNONYM: HIRUDIN IIIA; COMPND 7 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 MOL_ID: 2; SOURCE 6 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 7 ORGANISM_COMMON: HUMAN; SOURCE 8 ORGANISM_TAXID: 9606; SOURCE 9 GENE: F2; SOURCE 0 MOL_ID: 3; SOURCE 1 ORGANISM_SCIENTIFIC: HIRUDO MEDICINALIS; SOURCE 2 ORGANISM_COMMON: MEDICINAL LEECH; SOURCE 3 ORGANISM_TAXID: 6421 KEYWDS THROMBIN, SERINE PROTEASE, ACUTE PHASE, BLOOD COAGULATION, GAMMA- KEYWDS 2 CARBOXYGLUTAMIC ACID, GLYCOPROTEIN, HYDROLASE, KRINGLE, PROTEASE, KEYWDS 3 SECRETED, ZYMOGEN, PROTEASE INHIBITOR, SERINE PROTEASE INHIBITOR, KEYWDS 4 SULFATION, HYDROLASE-HYDROLASE INHIBITOR COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR J.C.SPURLINO,M.MCMILLAN,F.LEWANDOWSKI,C.MILLIGAN REVDAT 2 13-JUL-11 3C27 1 VERSN REVDAT 1 17-FEB-09 3C27 0 JRNL AUTH K.D.KREUTER,L.LEE,T.LU,E.C.GIARDINO,S.PATEL,H.HAUNG,G.XU, JRNL AUTH 2 M.FITZGERALD,M.MOHAN,C.CRYSLER,S.EISENNAGEL,M.DASGUPTA, JRNL AUTH 3 M.MCMILLAN,J.C.SPURLINO,N.HEUBERT,B.E.MARYANOFF,B.E.TOMCZUK, JRNL AUTH 4 B.P.DAMIANO,M.R.PLAYER JRNL TITL CYANOFLUOROPHENYLACETAMIDES AS ORALLY EFFICACIOUS THROMBIN JRNL TITL 2 INHIBITORS JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. 2.18 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX (PHENIX.REFINE) REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VICENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE- REMARK 3 : KUNSTLEVE,LI-WEI HUNG,ROBERT IMMORMINO, REMARK 3 : TOM IOERGER,AIRLIE MCCOY,ERIK MCKEE,NIGEL REMARK 3 : MORIARTY,REETAL PAI,RANDY READ,JANE REMARK 3 : RICHARDSON,DAVID RICHARDSON,TOD ROMO,JIM REMARK 3 : SACCHETTINI,NICHOLAS SAUTER,JACOB SMITH, REMARK 3 : LAURENT STORONI,TOM TERWILLIGER,PETER REMARK 3 : ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : ML REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.18 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 50.08 REMARK 3 MIN(FOBS/SIGMA_FOBS) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : 97.2 REMARK 3 NUMBER OF REFLECTIONS : 18406 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.176 REMARK 3 R VALUE (WORKING SET) : 0.174 REMARK 3 FREE R VALUE : 0.215 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.100 REMARK 3 FREE R VALUE TEST SET COUNT : 938 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS). REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE REMARK 3 1 50.0880 - 4.1730 0.51 2580 133 0.1490 0.1780 REMARK 3 2 4.1730 - 3.3120 0.50 2498 132 0.1490 0.1480 REMARK 3 3 3.3120 - 2.8940 0.50 2530 143 0.1980 0.2850 REMARK 3 4 2.8940 - 2.6290 0.51 2535 126 0.1990 0.2360 REMARK 3 5 2.6290 - 2.4410 0.51 2540 127 0.1980 0.2340 REMARK 3 6 2.4410 - 2.2970 0.51 2511 146 0.1920 0.2680 REMARK 3 7 2.2970 - 2.1820 0.45 2274 131 0.1920 0.2730 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : FLAT BULK SOLVENT MODEL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : 0.35 REMARK 3 B_SOL : 45.63 REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : NULL REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : NULL REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 24.22 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 28.82 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.55800 REMARK 3 B22 (A**2) : 2.98800 REMARK 3 B33 (A**2) : -2.43100 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : -4.51300 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : 0.009 2408 REMARK 3 ANGLE : 1.232 3245 REMARK 3 CHIRALITY : 0.080 332 REMARK 3 PLANARITY : 0.006 419 REMARK 3 DIHEDRAL : 20.355 927 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 NCS DETAILS REMARK 3 NUMBER OF NCS GROUPS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 3C27 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 15-AUG-08. REMARK 100 THE RCSB ID CODE IS RCSB046248. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 07-JUN-02 REMARK 200 TEMPERATURE (KELVIN) : NULL REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : ROTATING ANODE REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : MACSCIENCE REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.54 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : BRUKER SMART 6000 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : NULL REMARK 200 DATA SCALING SOFTWARE : NULL REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 18406 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.182 REMARK 200 RESOLUTION RANGE LOW (A) : 50.075 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : NULL 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) : NULL REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL REMARK 200 COMPLETENESS FOR SHELL (%) : NULL 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: NULL REMARK 200 SOFTWARE USED: NULL REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 53.97 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.67 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: NULL REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 1 2 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,Y,-Z REMARK 290 3555 X+1/2,Y+1/2,Z 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 0.00000 REMARK 290 SMTRY2 2 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 3 1.000000 0.000000 0.000000 35.42700 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 36.01300 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 35.42700 REMARK 290 SMTRY2 4 0.000000 1.000000 0.000000 36.01300 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: TRIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TRIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 3230 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 12600 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -17.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, H 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 THR B 182A REMARK 465 TRP B 182B REMARK 465 THR B 182C REMARK 465 ALA B 182D REMARK 465 ASN B 182E REMARK 465 VAL B 182F REMARK 465 GLY B 182G REMARK 465 LYS B 182H REMARK 465 GLY B 288 REMARK 465 GLU B 289 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 ARG B 106 CG CD NE CZ NH1 NH2 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 PHE A 15 -91.70 -128.58 REMARK 500 TYR B 83 83.63 -154.97 REMARK 500 ASN B 89 79.07 -157.84 REMARK 500 HIS B 102 -63.40 -125.48 REMARK 500 ASN B 131 16.54 -142.49 REMARK 500 SER B 256 -80.99 -118.78 REMARK 500 GLU H 297 -56.11 -11.11 REMARK 500 LEU H 299 41.70 -85.56 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: NON-CIS, NON-TRANS REMARK 500 REMARK 500 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH REMARK 500 CIS AND TRANS CONFORMATION. CIS BONDS, IF ANY, ARE LISTED REMARK 500 ON CISPEP RECORDS. TRANS IS DEFINED AS 180 +/- 30 AND REMARK 500 CIS IS DEFINED AS 0 +/- 30 DEGREES. REMARK 500 MODEL OMEGA REMARK 500 GLU H 296 GLU H 297 137.68 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 DKK B 5000 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR CHAIN H OF HIRUDIN-3A REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 2R2M RELATED DB: PDB REMARK 900 SAME PROTEIN COMPLEXED WITH INHIBITOR I50 DBREF 3C27 A 7 32 UNP P00734 THRB_HUMAN 334 359 DBREF 3C27 B 37 289 UNP P00734 THRB_HUMAN 364 622 DBREF 3C27 H 290 300 UNP P28507 HIR3A_HIRME 55 65 SEQRES 1 A 26 ALA ASP CYS GLY LEU ARG PRO LEU PHE GLU LYS LYS SER SEQRES 2 A 26 LEU GLU ASP LYS THR GLU ARG GLU LEU LEU GLU SER TYR SEQRES 1 B 259 ILE VAL GLU GLY SER ASP ALA GLU ILE GLY MET SER PRO SEQRES 2 B 259 TRP GLN VAL MET LEU PHE ARG LYS SER PRO GLN GLU LEU SEQRES 3 B 259 LEU CYS GLY ALA SER LEU ILE SER ASP ARG TRP VAL LEU SEQRES 4 B 259 THR ALA ALA HIS CYS LEU LEU TYR PRO PRO TRP ASP LYS SEQRES 5 B 259 ASN PHE THR GLU ASN ASP LEU LEU VAL ARG ILE GLY LYS SEQRES 6 B 259 HIS SER ARG THR ARG TYR GLU ARG ASN ILE GLU LYS ILE SEQRES 7 B 259 SER MET LEU GLU LYS ILE TYR ILE HIS PRO ARG TYR ASN SEQRES 8 B 259 TRP ARG GLU ASN LEU ASP ARG ASP ILE ALA LEU MET LYS SEQRES 9 B 259 LEU LYS LYS PRO VAL ALA PHE SER ASP TYR ILE HIS PRO SEQRES 10 B 259 VAL CYS LEU PRO ASP ARG GLU THR ALA ALA SER LEU LEU SEQRES 11 B 259 GLN ALA GLY TYR LYS GLY ARG VAL THR GLY TRP GLY ASN SEQRES 12 B 259 LEU LYS GLU THR TRP THR ALA ASN VAL GLY LYS GLY GLN SEQRES 13 B 259 PRO SER VAL LEU GLN VAL VAL ASN LEU PRO ILE VAL GLU SEQRES 14 B 259 ARG PRO VAL CYS LYS ASP SER THR ARG ILE ARG ILE THR SEQRES 15 B 259 ASP ASN MET PHE CYS ALA GLY TYR LYS PRO ASP GLU GLY SEQRES 16 B 259 LYS ARG GLY ASP ALA CYS GLU GLY ASP SER GLY GLY PRO SEQRES 17 B 259 PHE VAL MET LYS SER PRO PHE ASN ASN ARG TRP TYR GLN SEQRES 18 B 259 MET GLY ILE VAL SER TRP GLY GLU GLY CYS ASP ARG ASP SEQRES 19 B 259 GLY LYS TYR GLY PHE TYR THR HIS VAL PHE ARG LEU LYS SEQRES 20 B 259 LYS TRP ILE GLN LYS VAL ILE ASP GLN PHE GLY GLU SEQRES 1 H 11 ASP PHE GLU GLU ILE PRO GLU GLU TYR LEU GLN HET DKK B5000 31 HETNAM DKK N-[2-(CARBAMIMIDAMIDOOXY)ETHYL]-2-{6-CYANO-3-[(2,2- HETNAM 2 DKK DIFLUORO-2-PYRIDIN-2-YLETHYL)AMINO]-2- HETNAM 3 DKK FLUOROPHENYL}ACETAMIDE FORMUL 4 DKK C19 H20 F3 N7 O2 FORMUL 5 HOH *116(H2 O) HELIX 1 1 PHE A 15 SER A 19 5 5 HELIX 2 2 THR A 24 TYR A 32 1 9 HELIX 3 3 ALA B 77 CYS B 80 5 4 HELIX 4 4 PRO B 84 ASP B 87 5 4 HELIX 5 5 THR B 91 ASN B 93 5 3 HELIX 6 6 ASP B 158 LEU B 166 1 9 HELIX 7 7 GLU B 199 SER B 206 1 8 HELIX 8 8 LEU B 276 PHE B 287 1 12 HELIX 9 9 PRO H 295 LEU H 299 5 5 SHEET 1 A 7 SER B 41 ASP B 42 0 SHEET 2 A 7 GLN B 191 PRO B 196 -1 O VAL B 192 N SER B 41 SHEET 3 A 7 LYS B 171 GLY B 176 -1 N GLY B 172 O LEU B 195 SHEET 4 A 7 PRO B 238 LYS B 242 -1 O VAL B 240 N ARG B 173 SHEET 5 A 7 TRP B 249 TRP B 257 -1 O TYR B 250 N MET B 241 SHEET 6 A 7 GLY B 268 HIS B 272 -1 O PHE B 269 N TRP B 257 SHEET 7 A 7 MET B 215 ALA B 218 -1 N PHE B 216 O TYR B 270 SHEET 1 B 7 GLN B 51 ARG B 56 0 SHEET 2 B 7 GLU B 61 LEU B 68 -1 O LEU B 63 N LEU B 54 SHEET 3 B 7 TRP B 73 THR B 76 -1 O LEU B 75 N SER B 67 SHEET 4 B 7 ALA B 137 LEU B 141 -1 O ALA B 137 N THR B 76 SHEET 5 B 7 LYS B 113 ILE B 122 -1 N GLU B 118 O LYS B 140 SHEET 6 B 7 LEU B 95 ILE B 99 -1 N ILE B 99 O LYS B 113 SHEET 7 B 7 GLN B 51 ARG B 56 -1 N PHE B 55 O LEU B 96 SHEET 1 C 2 LEU B 82 TYR B 83 0 SHEET 2 C 2 LYS B 88 ASN B 89 -1 O LYS B 88 N TYR B 83 SSBOND *** CYS A 9 CYS B 155 1555 1555 2.02 SSBOND *** CYS B 64 CYS B 80 1555 1555 2.03 SSBOND *** CYS B 203 CYS B 217 1555 1555 1.99 SSBOND *** CYS B 231 CYS B 261 1555 1555 2.03 CISPEP 1 SER B 58 PRO B 59 0 -3.54 SITE *** AC1 17 HIS B 79 TYR B 83 GLU B 130 ASP B 229 SITE *** AC1 17 ALA B 230 CYS B 231 SER B 235 VAL B 255 SITE *** AC1 17 SER B 256 TRP B 257 GLY B 258 GLU B 259 SITE *** AC1 17 GLY B 260 CYS B 261 HOH B5019 HOH B5039 SITE *** AC1 17 HOH B5044 SITE *** AC2 12 PHE B 55 LYS B 57 GLN B 60 LEU B 62 SITE *** AC2 12 LEU B 96 ARG B 104 THR B 105 ARG B 106 SITE *** AC2 12 TYR B 107 HOH B5068 HOH H 49 HOH H 73 CRYST1 70.854 72.026 72.987 90.00 100.50 90.00 C 1 2 1 4 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.014114 0.000000 0.002617 0.00000 SCALE2 0.000000 0.013884 0.000000 0.00000 SCALE3 0.000000 0.000000 0.013935 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 NoAdj-H: B5000 DKK HN2 : B5000 DKK N2 : B5000 DKK C1 :(short bond) USER MOD Set 1.1: B 243 SER OG : rot 51:sc= 1.04 USER MOD Set 1.2: B 246 ASN : amide:sc= -0.251 K(o=1.2,f=-3.5!) USER MOD Set 1.3: B 250 TYR OH : rot 30:sc= 0.405 USER MOD Set 2.1: B 79 HIS : no HE2:sc= 0.107 K(o=2.4,f=-12!) USER MOD Set 2.2: B 235 SER OG : rot -142:sc= 2.34 USER MOD Set 3.1: B 171 LYS NZ :NH3+ 164:sc= 1.55 (180deg=1.29) USER MOD Set 3.2: B 220 TYR OH : rot -15:sc= 1.28 USER MOD Set 4.1: B 212 THR OG1 : rot -176:sc= 1.46 USER MOD Set 4.2: B 215 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 5.1: B 116 MET CE :methyl 175:sc= -2.36! (180deg=-1.83!) USER MOD Set 5.2: B 142 LYS NZ :NH3+ 162:sc= -0.533 (180deg=-1.5!) USER MOD Set 6.1: B 67 SER OG : rot 158:sc= 2.3 USER MOD Set 6.2: B 251 GLN : amide:sc= 2.26 K(o=4.6,f=2.4) USER MOD Set 7.1: B 48 SER OG : rot 17:sc= 0.967 USER MOD Set 7.2: B 51 GLN : amide:sc= 1.09 K(o=4.3,f=-1.8) USER MOD Set 7.3: B 175 THR OG1 : rot 84:sc= 2.21 USER MOD Set 8.1: A 32 TYR OH : rot 28:sc= 0.461 USER MOD Set 8.2: B 241 MET CE :methyl -115:sc= -0.222 (180deg=-1.33) USER MOD Set 9.1: A 24 THR OG1 : rot -169:sc= 0.331 USER MOD Set 9.2: B 194 ASN : amide:sc= 0.306 K(o=0.64,f=-2.6!) USER MOD Single : A 17 LYS NZ :NH3+ 156:sc= -0.586! (180deg=-2.22!) USER MOD Single : A 18 LYS NZ :NH3+ -130:sc= 0.874 (180deg=-0.14) USER MOD Single : A 19 SER OG : rot -58:sc= 0.0774 USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot -49:sc= 1.83 USER MOD Single : B 41 SER OG : rot 100:sc= 0.221 USER MOD Single : B 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 53 MET CE :methyl -141:sc= 0 (180deg=-0.491) USER MOD Single : B 57 LYS NZ :NH3+ 136:sc= -0.203 (180deg=-2.2!) USER MOD Single : B 58 SER OG : rot 23:sc= 0.0203 USER MOD Single : B 60 GLN : amide:sc= -1.91! K(o=-1.9!,f=-1.4) USER MOD Single : B 70 SER OG : rot 170:sc= 0.0576 USER MOD Single : B 76 THR OG1 : rot 98:sc= 0.484 USER MOD Single : B 83 TYR OH : rot 180:sc= 1.14 USER MOD Single : B 88 LYS NZ :NH3+ 166:sc= 1.58 (180deg=1.28) USER MOD Single : B 89 ASN : amide:sc= -0.196 K(o=-0.2,f=-1.8) USER MOD Single : B 91 THR OG1 : rot 180:sc= 0 USER MOD Single : B 93 ASN : amide:sc= -0.144 K(o=-0.14,f=-1.7!) USER MOD Single : B 101 LYS NZ :NH3+ 162:sc= 2.75 (180deg=2.25) USER MOD Single : B 102 HIS : no HD1:sc= -1.27 K(o=-1.3,f=-4.9!) USER MOD Single : B 103 SER OG : rot 150:sc= 0.0454 USER MOD Single : B 105 THR OG1 : rot -75:sc= 0.915 USER MOD Single : B 107 TYR OH : rot 180:sc= -0.168 USER MOD Single : B 110 ASN : amide:sc= 0.698 K(o=0.7,f=-0.94) USER MOD Single : B 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 115 SER OG : rot 180:sc= 0 USER MOD Single : B 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 121 TYR OH : rot 129:sc= 0.131 USER MOD Single : B 123 HIS : no HD1:sc= -0.145 K(o=-0.15,f=-8!) USER MOD Single : B 126 TYR OH : rot 174:sc= 0.811 USER MOD Single : B 127 ASN : amide:sc= 0.0402 K(o=0.04,f=-3.6!) USER MOD Single : B 131 ASN : amide:sc= 0.751 K(o=0.75,f=-5.4!) USER MOD Single : B 139 MET CE :methyl -155:sc= -2.77! (180deg=-4.09!) USER MOD Single : B 140 LYS NZ :NH3+ 178:sc= -1.07! (180deg=-1.08!) USER MOD Single : B 143 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 148 SER OG : rot -172:sc= 1.25 USER MOD Single : B 150 TYR OH : rot 180:sc= 0 USER MOD Single : B 152 HIS : no HD1:sc= 1.23 K(o=1.4,f=-8.8!) USER MOD Single : B 161 THR OG1 : rot 63:sc= 0.196 USER MOD Single : B 164 SER OG : rot -175:sc= 0.827 USER MOD Single : B 167 GLN : amide:sc= 0 X(o=0,f=-0.084) USER MOD Single : B 170 TYR OH : rot 180:sc= 0 USER MOD Single : B 179 ASN : amide:sc= -0.412 K(o=-0.41,f=-1.1) USER MOD Single : B 181 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 186 GLN : amide:sc= -0.143 K(o=-0.14,f=-1.7!) USER MOD Single : B 188 SER OG : rot 180:sc= 0 USER MOD Single : B 191 GLN : amide:sc= 1.66 K(o=1.7,f=0.029) USER MOD Single : B 204 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 206 SER OG : rot -62:sc= 1.66 USER MOD Single : B 207 THR OG1 : rot 100:sc= 0.525 USER MOD Single : B 214 ASN : amide:sc= 0.604 K(o=0.6,f=-0.1) USER MOD Single : B 221 LYS NZ :NH3+ 155:sc= 0.00288 (180deg=0) USER MOD Single : B 226 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 242 LYS NZ :NH3+ -165:sc= 2.61 (180deg=2.42) USER MOD Single : B 247 ASN : amide:sc= -0.0179 K(o=-0.018,f=-1) USER MOD Single : B 252 MET CE :methyl 160:sc= -2.95! (180deg=-3.36) USER MOD Single : B 256 SER OG : rot 48:sc= 1.71 USER MOD Single : B 266 LYS NZ :NH3+ -108:sc= -0.08 (180deg=-2.4!) USER MOD Single : B 267 TYR OH : rot -13:sc= 0.796 USER MOD Single : B 270 TYR OH : rot -150:sc= 0.573 USER MOD Single : B 271 THR OG1 : rot -173:sc= 0.897 USER MOD Single : B 272 HIS : no HD1:sc= -0.418 K(o=-0.42,f=-3.5!) USER MOD Single : B 277 LYS NZ :NH3+ 169:sc= 0.268 (180deg=0.232) USER MOD Single : B 278 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 281 GLN : amide:sc= -0.295 X(o=-0.29,f=-0.29) USER MOD Single : B 282 LYS NZ :NH3+ 172:sc=-0.00644 (180deg=-0.0568) USER MOD Single : B 286 GLN : amide:sc= -1.13! K(o=-1.1!,f=-0.0058) USER MOD Single : H 298 TYR OH : rot 180:sc= 1.05 USER MOD Single : H 300 GLN : amide:sc= -0.194 X(o=-0.19,f=-0.27) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 7 14.298 18.004 20.426 1.00 44.78 N ATOM 2 CA ALA A 7 13.786 19.250 19.869 1.00 47.31 C ATOM 3 C ALA A 7 12.266 19.273 19.976 1.00 48.29 C ATOM 4 O ALA A 7 11.693 19.725 20.973 1.00 47.24 O ATOM 5 CB ALA A 7 14.210 19.381 18.413 1.00 51.31 C ATOM 0 HA ALA A 7 14.150 19.997 20.369 1.00 47.31 H new ATOM 0 HB1 ALA A 7 13.866 20.212 18.049 1.00 51.31 H new ATOM 0 HB2 ALA A 7 15.178 19.380 18.356 1.00 51.31 H new ATOM 0 HB3 ALA A 7 13.856 18.635 17.904 1.00 51.31 H new ATOM 6 N ASP A 8 11.622 18.778 18.927 1.00 46.32 N ATOM 7 CA ASP A 8 10.196 18.518 18.956 1.00 41.70 C ATOM 8 C ASP A 8 9.935 17.034 19.285 1.00 34.35 C ATOM 9 O ASP A 8 8.867 16.490 18.975 1.00 30.57 O ATOM 10 CB ASP A 8 9.590 18.859 17.599 1.00 43.68 C ATOM 11 CG ASP A 8 8.115 19.092 17.684 1.00 51.34 C ATOM 12 OD1 ASP A 8 7.641 19.319 18.825 1.00 52.88 O ATOM 13 OD2 ASP A 8 7.437 19.048 16.628 1.00 54.37 O ATOM 0 H ASP A 8 12.002 18.584 18.180 1.00 46.32 H new ATOM 0 HA ASP A 8 9.786 19.068 19.641 1.00 41.70 H new ATOM 0 HB2 ASP A 8 10.021 19.652 17.243 1.00 43.68 H new ATOM 0 HB3 ASP A 8 9.767 18.136 16.976 1.00 43.68 H new ATOM 14 N CYS A 9 10.906 16.391 19.928 1.00 23.46 N ATOM 15 CA CYS A 9 10.855 14.946 20.113 1.00 25.06 C ATOM 16 C CYS A 9 9.663 14.492 20.959 1.00 19.79 C ATOM 17 O CYS A 9 9.210 15.210 21.863 1.00 17.78 O ATOM 18 CB CYS A 9 12.184 14.418 20.682 1.00 19.05 C ATOM 19 SG CYS A 9 12.554 14.912 22.390 1.00 19.96 S ATOM 0 H CYS A 9 11.600 16.772 20.263 1.00 23.46 H new ATOM 0 HA CYS A 9 10.723 14.558 19.234 1.00 25.06 H new ATOM 0 HB2 CYS A 9 12.175 13.449 20.637 1.00 19.05 H new ATOM 0 HB3 CYS A 9 12.906 14.722 20.110 1.00 19.05 H new ATOM 20 N GLY A 10 9.166 13.298 20.647 1.00 18.45 N ATOM 21 CA GLY A 10 8.184 12.612 21.479 1.00 14.67 C ATOM 22 C GLY A 10 6.777 13.186 21.416 1.00 17.98 C ATOM 23 O GLY A 10 5.900 12.756 22.164 1.00 20.81 O ATOM 0 H GLY A 10 9.391 12.861 19.941 1.00 18.45 H new ATOM 0 HA2 GLY A 10 8.151 11.679 21.215 1.00 14.67 H new ATOM 0 HA3 GLY A 10 8.487 12.635 22.400 1.00 14.67 H new ATOM 24 N LEU A 11 6.554 14.145 20.520 1.00 16.89 N ATOM 25 CA LEU A 11 5.239 14.724 20.332 1.00 18.96 C ATOM 26 C LEU A 11 4.730 14.338 18.947 1.00 21.07 C ATOM 27 O LEU A 11 5.203 14.850 17.944 1.00 21.42 O ATOM 28 CB LEU A 11 5.286 16.236 20.486 1.00 19.06 C ATOM 29 CG LEU A 11 5.698 16.810 21.842 1.00 24.26 C ATOM 30 CD1 LEU A 11 5.717 18.334 21.772 1.00 28.07 C ATOM 31 CD2 LEU A 11 4.775 16.328 22.984 1.00 19.36 C ATOM 0 H LEU A 11 7.162 14.474 20.008 1.00 16.89 H new ATOM 0 HA LEU A 11 4.634 14.382 21.009 1.00 18.96 H new ATOM 0 HB2 LEU A 11 5.898 16.583 19.819 1.00 19.06 H new ATOM 0 HB3 LEU A 11 4.406 16.583 20.272 1.00 19.06 H new ATOM 0 HG LEU A 11 6.589 16.485 22.044 1.00 24.26 H new ATOM 0 HD11 LEU A 11 5.979 18.694 22.634 1.00 28.07 H new ATOM 0 HD12 LEU A 11 6.352 18.619 21.096 1.00 28.07 H new ATOM 0 HD13 LEU A 11 4.832 18.659 21.541 1.00 28.07 H new ATOM 0 HD21 LEU A 11 5.070 16.714 23.824 1.00 19.36 H new ATOM 0 HD22 LEU A 11 3.864 16.607 22.803 1.00 19.36 H new ATOM 0 HD23 LEU A 11 4.811 15.360 23.043 1.00 19.36 H new ATOM 32 N ARG A 12 3.768 13.423 18.907 1.00 17.25 N ATOM 33 CA ARG A 12 3.248 12.904 17.642 1.00 18.70 C ATOM 34 C ARG A 12 2.318 13.867 16.888 1.00 17.17 C ATOM 35 O ARG A 12 1.344 14.358 17.441 1.00 19.87 O ATOM 36 CB ARG A 12 2.526 11.583 17.905 1.00 15.44 C ATOM 37 CG ARG A 12 3.429 10.547 18.605 1.00 15.27 C ATOM 38 CD ARG A 12 2.619 9.385 19.105 1.00 15.44 C ATOM 39 NE ARG A 12 1.646 9.779 20.129 1.00 13.89 N ATOM 40 CZ ARG A 12 0.756 8.939 20.658 1.00 16.64 C ATOM 41 NH1 ARG A 12 -0.083 9.358 21.587 1.00 14.20 N ATOM 42 NH2 ARG A 12 0.722 7.659 20.275 1.00 18.50 N ATOM 0 H ARG A 12 3.399 13.086 19.607 1.00 17.25 H new ATOM 0 HA ARG A 12 4.015 12.780 17.062 1.00 18.70 H new ATOM 0 HB2 ARG A 12 1.743 11.749 18.454 1.00 15.44 H new ATOM 0 HB3 ARG A 12 2.210 11.217 17.064 1.00 15.44 H new ATOM 0 HG2 ARG A 12 4.107 10.232 17.987 1.00 15.27 H new ATOM 0 HG3 ARG A 12 3.894 10.965 19.346 1.00 15.27 H new ATOM 0 HD2 ARG A 12 2.152 8.975 18.360 1.00 15.44 H new ATOM 0 HD3 ARG A 12 3.215 8.713 19.471 1.00 15.44 H new ATOM 0 HE ARG A 12 1.650 10.594 20.403 1.00 13.89 H new ATOM 0 HH11 ARG A 12 -0.057 10.175 21.853 1.00 14.20 H new ATOM 0 HH12 ARG A 12 -0.656 8.814 21.926 1.00 14.20 H new ATOM 0 HH21 ARG A 12 1.277 7.372 19.684 1.00 18.50 H new ATOM 0 HH22 ARG A 12 0.146 7.122 20.620 1.00 18.50 H new ATOM 43 N PRO A 13 2.600 14.104 15.602 1.00 20.65 N ATOM 44 CA PRO A 13 1.743 14.957 14.762 1.00 18.00 C ATOM 45 C PRO A 13 0.260 14.596 14.829 1.00 18.65 C ATOM 46 O PRO A 13 -0.563 15.496 14.916 1.00 24.20 O ATOM 47 CB PRO A 13 2.293 14.719 13.352 1.00 22.55 C ATOM 48 CG PRO A 13 3.736 14.434 13.571 1.00 22.26 C ATOM 49 CD PRO A 13 3.796 13.639 14.873 1.00 22.14 C ATOM 0 HA PRO A 13 1.771 15.882 15.053 1.00 18.00 H new ATOM 0 HB2 PRO A 13 1.846 13.976 12.917 1.00 22.55 H new ATOM 0 HB3 PRO A 13 2.167 15.496 12.786 1.00 22.55 H new ATOM 0 HG2 PRO A 13 4.108 13.926 12.833 1.00 22.26 H new ATOM 0 HG3 PRO A 13 4.249 15.255 13.638 1.00 22.26 H new ATOM 0 HD2 PRO A 13 3.769 12.683 14.711 1.00 22.14 H new ATOM 0 HD3 PRO A 13 4.611 13.820 15.367 1.00 22.14 H new ATOM 50 N LEU A 14 -0.089 13.316 14.846 1.00 17.25 N ATOM 51 CA LEU A 14 -1.509 12.959 14.812 1.00 21.51 C ATOM 52 C LEU A 14 -2.152 12.818 16.186 1.00 20.70 C ATOM 53 O LEU A 14 -3.337 12.533 16.283 1.00 20.65 O ATOM 54 CB LEU A 14 -1.745 11.691 13.988 1.00 16.07 C ATOM 55 CG LEU A 14 -1.345 11.885 12.533 1.00 19.68 C ATOM 56 CD1 LEU A 14 -1.434 10.559 11.752 1.00 18.48 C ATOM 57 CD2 LEU A 14 -2.210 12.968 11.903 1.00 22.69 C ATOM 0 H LEU A 14 0.459 12.654 14.876 1.00 17.25 H new ATOM 0 HA LEU A 14 -1.946 13.711 14.383 1.00 21.51 H new ATOM 0 HB2 LEU A 14 -1.237 10.958 14.369 1.00 16.07 H new ATOM 0 HB3 LEU A 14 -2.681 11.443 14.036 1.00 16.07 H new ATOM 0 HG LEU A 14 -0.419 12.173 12.496 1.00 19.68 H new ATOM 0 HD11 LEU A 14 -1.175 10.709 10.829 1.00 18.48 H new ATOM 0 HD12 LEU A 14 -0.839 9.906 12.153 1.00 18.48 H new ATOM 0 HD13 LEU A 14 -2.345 10.226 11.782 1.00 18.48 H new ATOM 0 HD21 LEU A 14 -1.953 13.089 10.976 1.00 22.69 H new ATOM 0 HD22 LEU A 14 -3.142 12.704 11.947 1.00 22.69 H new ATOM 0 HD23 LEU A 14 -2.087 13.801 12.384 1.00 22.69 H new ATOM 58 N PHE A 15 -1.373 13.016 17.243 1.00 20.96 N ATOM 59 CA PHE A 15 -1.915 12.876 18.587 1.00 17.97 C ATOM 60 C PHE A 15 -1.615 14.096 19.465 1.00 20.81 C ATOM 61 O PHE A 15 -2.392 15.041 19.445 1.00 20.88 O ATOM 62 CB PHE A 15 -1.460 11.548 19.202 1.00 18.72 C ATOM 63 CG PHE A 15 -1.995 10.338 18.458 1.00 22.56 C ATOM 64 CD1 PHE A 15 -3.254 9.818 18.760 1.00 20.00 C ATOM 65 CD2 PHE A 15 -1.262 9.753 17.433 1.00 18.70 C ATOM 66 CE1 PHE A 15 -3.760 8.733 18.072 1.00 21.96 C ATOM 67 CE2 PHE A 15 -1.770 8.660 16.729 1.00 21.28 C ATOM 68 CZ PHE A 15 -3.013 8.151 17.046 1.00 20.51 C ATOM 0 H PHE A 15 -0.541 13.229 17.205 1.00 20.96 H new ATOM 0 HA PHE A 15 -2.883 12.847 18.530 1.00 17.97 H new ATOM 0 HB2 PHE A 15 -0.491 11.515 19.208 1.00 18.72 H new ATOM 0 HB3 PHE A 15 -1.751 11.508 20.126 1.00 18.72 H new ATOM 0 HD1 PHE A 15 -3.760 10.208 19.435 1.00 20.00 H new ATOM 0 HD2 PHE A 15 -0.425 10.093 17.214 1.00 18.70 H new ATOM 0 HE1 PHE A 15 -4.596 8.391 18.292 1.00 21.96 H new ATOM 0 HE2 PHE A 15 -1.270 8.274 16.046 1.00 21.28 H new ATOM 0 HZ PHE A 15 -3.352 7.423 16.578 1.00 20.51 H new ATOM 69 N GLU A 16 -0.502 14.091 20.212 1.00 21.93 N ATOM 70 CA GLU A 16 -0.194 15.199 21.128 1.00 21.85 C ATOM 71 C GLU A 16 -0.343 16.563 20.456 1.00 24.69 C ATOM 72 O GLU A 16 -0.867 17.497 21.057 1.00 21.20 O ATOM 73 CB GLU A 16 1.219 15.089 21.735 1.00 18.21 C ATOM 74 CG GLU A 16 1.368 14.003 22.829 1.00 17.95 C ATOM 75 CD GLU A 16 1.441 12.592 22.249 1.00 18.98 C ATOM 76 OE1 GLU A 16 1.787 12.475 21.056 1.00 14.46 O ATOM 77 OE2 GLU A 16 1.139 11.608 22.979 1.00 18.39 O ATOM 0 H GLU A 16 0.083 13.461 20.203 1.00 21.93 H new ATOM 0 HA GLU A 16 -0.845 15.127 21.843 1.00 21.85 H new ATOM 0 HB2 GLU A 16 1.851 14.903 21.023 1.00 18.21 H new ATOM 0 HB3 GLU A 16 1.463 15.948 22.113 1.00 18.21 H new ATOM 0 HG2 GLU A 16 2.169 14.178 23.347 1.00 17.95 H new ATOM 0 HG3 GLU A 16 0.617 14.059 23.440 1.00 17.95 H new ATOM 78 N LYS A 17 0.144 16.684 19.224 1.00 22.72 N ATOM 79 CA LYS A 17 0.117 17.965 18.529 1.00 22.35 C ATOM 80 C LYS A 17 -1.309 18.412 18.187 1.00 25.21 C ATOM 81 O LYS A 17 -1.537 19.576 17.901 1.00 27.70 O ATOM 82 CB LYS A 17 0.945 17.899 17.243 1.00 28.69 C ATOM 83 CG LYS A 17 2.405 17.526 17.455 1.00 30.42 C ATOM 84 CD LYS A 17 3.233 18.708 17.908 1.00 36.35 C ATOM 85 CE LYS A 17 4.657 18.542 17.424 1.00 46.47 C ATOM 86 NZ LYS A 17 4.646 18.103 15.990 1.00 47.23 N ATOM 0 H LYS A 17 0.493 16.039 18.775 1.00 22.72 H new ATOM 0 HA LYS A 17 0.501 18.617 19.136 1.00 22.35 H new ATOM 0 HB2 LYS A 17 0.541 17.252 16.644 1.00 28.69 H new ATOM 0 HB3 LYS A 17 0.904 18.761 16.800 1.00 28.69 H new ATOM 0 HG2 LYS A 17 2.464 16.819 18.116 1.00 30.42 H new ATOM 0 HG3 LYS A 17 2.771 17.174 16.629 1.00 30.42 H new ATOM 0 HD2 LYS A 17 2.857 19.531 17.560 1.00 36.35 H new ATOM 0 HD3 LYS A 17 3.216 18.775 18.876 1.00 36.35 H new ATOM 0 HE2 LYS A 17 5.139 19.379 17.513 1.00 46.47 H new ATOM 0 HE3 LYS A 17 5.121 17.888 17.970 1.00 46.47 H new ATOM 0 HZ1 LYS A 17 5.414 18.332 15.603 1.00 47.23 H new ATOM 0 HZ2 LYS A 17 4.546 17.220 15.951 1.00 47.23 H new ATOM 0 HZ3 LYS A 17 3.971 18.497 15.564 1.00 47.23 H new ATOM 87 N LYS A 18 -2.259 17.485 18.198 1.00 22.75 N ATOM 88 CA LYS A 18 -3.660 17.816 17.937 1.00 28.58 C ATOM 89 C LYS A 18 -4.481 17.707 19.219 1.00 22.34 C ATOM 90 O LYS A 18 -5.703 17.897 19.213 1.00 20.57 O ATOM 91 CB LYS A 18 -4.261 16.865 16.901 1.00 25.79 C ATOM 92 CG LYS A 18 -3.849 17.115 15.465 1.00 30.29 C ATOM 93 CD LYS A 18 -4.441 15.999 14.592 1.00 26.79 C ATOM 94 CE LYS A 18 -4.751 16.480 13.201 1.00 36.66 C ATOM 95 NZ LYS A 18 -5.566 15.464 12.475 1.00 39.87 N ATOM 0 H LYS A 18 -2.115 16.652 18.355 1.00 22.75 H new ATOM 0 HA LYS A 18 -3.686 18.725 17.600 1.00 28.58 H new ATOM 0 HB2 LYS A 18 -4.015 15.957 17.138 1.00 25.79 H new ATOM 0 HB3 LYS A 18 -5.228 16.920 16.957 1.00 25.79 H new ATOM 0 HG2 LYS A 18 -4.168 17.982 15.168 1.00 30.29 H new ATOM 0 HG3 LYS A 18 -2.882 17.127 15.388 1.00 30.29 H new ATOM 0 HD2 LYS A 18 -3.816 15.259 14.546 1.00 26.79 H new ATOM 0 HD3 LYS A 18 -5.251 15.661 15.005 1.00 26.79 H new ATOM 0 HE2 LYS A 18 -5.232 17.321 13.242 1.00 36.66 H new ATOM 0 HE3 LYS A 18 -3.927 16.648 12.718 1.00 36.66 H new ATOM 0 HZ1 LYS A 18 -5.200 15.303 11.680 1.00 39.87 H new ATOM 0 HZ2 LYS A 18 -5.591 14.710 12.948 1.00 39.87 H new ATOM 0 HZ3 LYS A 18 -6.394 15.772 12.364 1.00 39.87 H new ATOM 96 N SER A 19 -3.802 17.399 20.313 1.00 19.96 N ATOM 97 CA SER A 19 -4.474 17.089 21.566 1.00 22.87 C ATOM 98 C SER A 19 -5.463 15.924 21.391 1.00 26.18 C ATOM 99 O SER A 19 -6.588 15.969 21.877 1.00 26.27 O ATOM 100 CB SER A 19 -5.168 18.323 22.136 1.00 23.81 C ATOM 101 OG SER A 19 -5.502 18.108 23.486 1.00 27.52 O ATOM 0 H SER A 19 -2.944 17.364 20.352 1.00 19.96 H new ATOM 0 HA SER A 19 -3.799 16.809 22.204 1.00 22.87 H new ATOM 0 HB2 SER A 19 -4.586 19.095 22.058 1.00 23.81 H new ATOM 0 HB3 SER A 19 -5.969 18.518 21.624 1.00 23.81 H new ATOM 0 HG SER A 19 -5.997 17.432 23.548 1.00 27.52 H new ATOM 102 N LEU A 20 -5.038 14.886 20.676 1.00 19.71 N ATOM 103 CA LEU A 20 -5.824 13.669 20.559 1.00 20.85 C ATOM 104 C LEU A 20 -5.050 12.564 21.275 1.00 22.03 C ATOM 105 O LEU A 20 -3.822 12.567 21.292 1.00 17.77 O ATOM 106 CB LEU A 20 -6.054 13.296 19.085 1.00 20.13 C ATOM 107 CG LEU A 20 -6.979 14.198 18.256 1.00 23.43 C ATOM 108 CD1 LEU A 20 -6.940 13.817 16.780 1.00 26.89 C ATOM 109 CD2 LEU A 20 -8.415 14.146 18.780 1.00 25.38 C ATOM 0 H LEU A 20 -4.292 14.870 20.249 1.00 19.71 H new ATOM 0 HA LEU A 20 -6.699 13.794 20.958 1.00 20.85 H new ATOM 0 HB2 LEU A 20 -5.190 13.271 18.645 1.00 20.13 H new ATOM 0 HB3 LEU A 20 -6.413 12.395 19.058 1.00 20.13 H new ATOM 0 HG LEU A 20 -6.655 15.108 18.345 1.00 23.43 H new ATOM 0 HD11 LEU A 20 -7.531 14.400 16.279 1.00 26.89 H new ATOM 0 HD12 LEU A 20 -6.034 13.911 16.445 1.00 26.89 H new ATOM 0 HD13 LEU A 20 -7.229 12.897 16.675 1.00 26.89 H new ATOM 0 HD21 LEU A 20 -8.978 14.723 18.240 1.00 25.38 H new ATOM 0 HD22 LEU A 20 -8.745 13.235 18.730 1.00 25.38 H new ATOM 0 HD23 LEU A 20 -8.434 14.447 19.702 1.00 25.38 H new ATOM 110 N GLU A 21 -5.773 11.622 21.858 1.00 20.16 N ATOM 111 CA GLU A 21 -5.159 10.557 22.624 1.00 26.61 C ATOM 112 C GLU A 21 -5.335 9.294 21.839 1.00 23.54 C ATOM 113 O GLU A 21 -6.406 9.093 21.274 1.00 20.96 O ATOM 114 CB GLU A 21 -5.901 10.375 23.939 1.00 23.49 C ATOM 115 CG GLU A 21 -5.787 11.545 24.870 1.00 39.58 C ATOM 116 CD GLU A 21 -6.079 11.149 26.303 1.00 43.55 C ATOM 117 OE1 GLU A 21 -6.725 10.094 26.519 1.00 46.91 O ATOM 118 OE2 GLU A 21 -5.650 11.888 27.209 1.00 53.93 O ATOM 0 H GLU A 21 -6.631 11.583 21.820 1.00 20.16 H new ATOM 0 HA GLU A 21 -4.227 10.763 22.795 1.00 26.61 H new ATOM 0 HB2 GLU A 21 -6.839 10.213 23.751 1.00 23.49 H new ATOM 0 HB3 GLU A 21 -5.560 9.584 24.385 1.00 23.49 H new ATOM 0 HG2 GLU A 21 -4.894 11.919 24.813 1.00 39.58 H new ATOM 0 HG3 GLU A 21 -6.404 12.240 24.594 1.00 39.58 H new ATOM 119 N ASP A 22 -4.317 8.433 21.825 1.00 19.56 N ATOM 120 CA ASP A 22 -4.480 7.094 21.257 1.00 19.54 C ATOM 121 C ASP A 22 -5.279 6.181 22.203 1.00 22.66 C ATOM 122 O ASP A 22 -5.465 6.504 23.376 1.00 22.62 O ATOM 123 CB ASP A 22 -3.122 6.490 20.820 1.00 17.71 C ATOM 124 CG ASP A 22 -2.255 6.021 21.989 1.00 21.07 C ATOM 125 OD1 ASP A 22 -2.742 5.297 22.879 1.00 23.03 O ATOM 126 OD2 ASP A 22 -1.053 6.353 21.998 1.00 23.96 O ATOM 0 H ASP A 22 -3.533 8.601 22.135 1.00 19.56 H new ATOM 0 HA ASP A 22 -5.007 7.171 20.446 1.00 19.54 H new ATOM 0 HB2 ASP A 22 -3.286 5.740 20.228 1.00 17.71 H new ATOM 0 HB3 ASP A 22 -2.631 7.153 20.309 1.00 17.71 H new ATOM 127 N LYS A 23 -5.755 5.051 21.686 1.00 22.93 N ATOM 128 CA LYS A 23 -6.643 4.160 22.437 1.00 27.75 C ATOM 129 C LYS A 23 -6.155 3.609 23.792 1.00 24.01 C ATOM 130 O LYS A 23 -6.984 3.317 24.644 1.00 25.93 O ATOM 131 CB LYS A 23 -7.077 2.971 21.572 1.00 29.49 C ATOM 132 CG LYS A 23 -8.041 3.299 20.458 1.00 40.74 C ATOM 133 CD LYS A 23 -8.312 2.034 19.628 1.00 48.80 C ATOM 134 CE LYS A 23 -8.752 2.363 18.196 1.00 51.70 C ATOM 135 NZ LYS A 23 -8.750 1.137 17.330 1.00 47.05 N ATOM 0 H LYS A 23 -5.574 4.778 20.891 1.00 22.93 H new ATOM 0 HA LYS A 23 -7.372 4.758 22.663 1.00 27.75 H new ATOM 0 HB2 LYS A 23 -6.285 2.566 21.185 1.00 29.49 H new ATOM 0 HB3 LYS A 23 -7.485 2.304 22.147 1.00 29.49 H new ATOM 0 HG2 LYS A 23 -8.871 3.641 20.825 1.00 40.74 H new ATOM 0 HG3 LYS A 23 -7.673 3.996 19.893 1.00 40.74 H new ATOM 0 HD2 LYS A 23 -7.510 1.489 19.601 1.00 48.80 H new ATOM 0 HD3 LYS A 23 -9.000 1.505 20.062 1.00 48.80 H new ATOM 0 HE2 LYS A 23 -9.641 2.751 18.210 1.00 51.70 H new ATOM 0 HE3 LYS A 23 -8.158 3.030 17.818 1.00 51.70 H new ATOM 0 HZ1 LYS A 23 -9.008 1.355 16.507 1.00 47.05 H new ATOM 0 HZ2 LYS A 23 -7.929 0.794 17.302 1.00 47.05 H new ATOM 0 HZ3 LYS A 23 -9.311 0.534 17.667 1.00 47.05 H new ATOM 136 N THR A 24 -4.853 3.399 23.995 1.00 22.11 N ATOM 137 CA THR A 24 -4.427 2.723 25.245 1.00 21.01 C ATOM 138 C THR A 24 -3.434 3.542 26.036 1.00 23.35 C ATOM 139 O THR A 24 -2.885 3.089 27.037 1.00 30.73 O ATOM 140 CB THR A 24 -3.823 1.344 25.000 1.00 22.14 C ATOM 141 OG1 THR A 24 -2.628 1.476 24.222 1.00 20.75 O ATOM 142 CG2 THR A 24 -4.808 0.443 24.275 1.00 22.03 C ATOM 0 H THR A 24 -4.221 3.624 23.457 1.00 22.11 H new ATOM 0 HA THR A 24 -5.245 2.623 25.757 1.00 21.01 H new ATOM 0 HB THR A 24 -3.614 0.942 25.858 1.00 22.14 H new ATOM 0 HG1 THR A 24 -2.378 0.718 23.961 1.00 20.75 H new ATOM 0 HG21 THR A 24 -4.404 -0.427 24.130 1.00 22.03 H new ATOM 0 HG22 THR A 24 -5.610 0.342 24.812 1.00 22.03 H new ATOM 0 HG23 THR A 24 -5.040 0.838 23.420 1.00 22.03 H new ATOM 143 N GLU A 25 -3.221 4.762 25.576 1.00 20.42 N ATOM 144 CA GLU A 25 -2.303 5.699 26.193 1.00 19.82 C ATOM 145 C GLU A 25 -2.612 5.849 27.674 1.00 24.44 C ATOM 146 O GLU A 25 -1.717 5.849 28.513 1.00 25.13 O ATOM 147 CB GLU A 25 -2.507 7.007 25.471 1.00 27.21 C ATOM 148 CG GLU A 25 -1.649 8.103 25.864 1.00 30.64 C ATOM 149 CD GLU A 25 -1.971 9.332 25.048 1.00 22.46 C ATOM 150 OE1 GLU A 25 -2.347 9.211 23.850 1.00 20.60 O ATOM 151 OE2 GLU A 25 -1.802 10.425 25.600 1.00 28.00 O ATOM 0 H GLU A 25 -3.616 5.076 24.879 1.00 20.42 H new ATOM 0 HA GLU A 25 -1.384 5.397 26.127 1.00 19.82 H new ATOM 0 HB2 GLU A 25 -2.385 6.852 24.521 1.00 27.21 H new ATOM 0 HB3 GLU A 25 -3.428 7.283 25.597 1.00 27.21 H new ATOM 0 HG2 GLU A 25 -1.767 8.293 26.808 1.00 30.64 H new ATOM 0 HG3 GLU A 25 -0.719 7.857 25.738 1.00 30.64 H new ATOM 152 N ARG A 26 -3.900 5.959 27.978 1.00 25.60 N ATOM 153 CA ARG A 26 -4.407 6.112 29.341 1.00 30.84 C ATOM 154 C ARG A 26 -3.920 5.039 30.317 1.00 27.41 C ATOM 155 O ARG A 26 -3.704 5.316 31.492 1.00 25.13 O ATOM 156 CB ARG A 26 -5.937 6.096 29.306 1.00 35.86 C ATOM 157 CG ARG A 26 -6.599 6.455 30.627 1.00 45.11 C ATOM 158 CD ARG A 26 -6.278 7.892 31.006 1.00 50.81 C ATOM 159 NE ARG A 26 -6.651 8.821 29.944 1.00 60.98 N ATOM 160 CZ ARG A 26 -7.828 9.443 29.874 1.00 67.04 C ATOM 161 NH1 ARG A 26 -8.089 10.273 28.866 1.00 58.20 N ATOM 162 NH2 ARG A 26 -8.747 9.236 30.814 1.00 60.78 N ATOM 0 H ARG A 26 -4.521 5.947 27.383 1.00 25.60 H new ATOM 0 HA ARG A 26 -4.061 6.957 29.669 1.00 30.84 H new ATOM 0 HB2 ARG A 26 -6.241 6.717 28.625 1.00 35.86 H new ATOM 0 HB3 ARG A 26 -6.234 5.213 29.037 1.00 35.86 H new ATOM 0 HG2 ARG A 26 -7.560 6.340 30.556 1.00 45.11 H new ATOM 0 HG3 ARG A 26 -6.292 5.854 31.324 1.00 45.11 H new ATOM 0 HD2 ARG A 26 -6.748 8.125 31.822 1.00 50.81 H new ATOM 0 HD3 ARG A 26 -5.330 7.975 31.192 1.00 50.81 H new ATOM 0 HE ARG A 26 -6.075 8.977 29.324 1.00 60.98 H new ATOM 0 HH11 ARG A 26 -7.497 10.409 28.257 1.00 58.20 H new ATOM 0 HH12 ARG A 26 -8.849 10.673 28.824 1.00 58.20 H new ATOM 0 HH21 ARG A 26 -8.582 8.701 31.467 1.00 60.78 H new ATOM 0 HH22 ARG A 26 -9.506 9.637 30.769 1.00 60.78 H new ATOM 163 N GLU A 27 -3.778 3.812 29.826 1.00 26.90 N ATOM 164 CA GLU A 27 -3.306 2.696 30.636 1.00 28.07 C ATOM 165 C GLU A 27 -1.899 2.959 31.194 1.00 27.09 C ATOM 166 O GLU A 27 -1.578 2.600 32.331 1.00 23.25 O ATOM 167 CB GLU A 27 -3.342 1.399 29.814 1.00 29.39 C ATOM 168 CG GLU A 27 -2.971 0.140 30.606 1.00 35.52 C ATOM 169 CD GLU A 27 -2.710 -1.075 29.710 1.00 32.78 C ATOM 170 OE1 GLU A 27 -3.004 -0.988 28.498 1.00 27.28 O ATOM 171 OE2 GLU A 27 -2.212 -2.109 30.218 1.00 27.71 O ATOM 0 H GLU A 27 -3.954 3.603 29.010 1.00 26.90 H new ATOM 0 HA GLU A 27 -3.900 2.599 31.397 1.00 28.07 H new ATOM 0 HB2 GLU A 27 -4.232 1.286 29.446 1.00 29.39 H new ATOM 0 HB3 GLU A 27 -2.734 1.487 29.063 1.00 29.39 H new ATOM 0 HG2 GLU A 27 -2.180 0.320 31.137 1.00 35.52 H new ATOM 0 HG3 GLU A 27 -3.687 -0.069 31.226 1.00 35.52 H new ATOM 172 N LEU A 28 -1.060 3.607 30.396 1.00 26.34 N ATOM 173 CA LEU A 28 0.295 3.914 30.837 1.00 24.17 C ATOM 174 C LEU A 28 0.263 4.943 31.966 1.00 23.87 C ATOM 175 O LEU A 28 0.889 4.764 33.009 1.00 21.45 O ATOM 176 CB LEU A 28 1.135 4.455 29.668 1.00 20.90 C ATOM 177 CG LEU A 28 1.803 3.524 28.642 1.00 25.59 C ATOM 178 CD1 LEU A 28 1.131 2.167 28.499 1.00 19.85 C ATOM 179 CD2 LEU A 28 1.852 4.233 27.296 1.00 25.88 C ATOM 0 H LEU A 28 -1.252 3.876 29.602 1.00 26.34 H new ATOM 0 HA LEU A 28 0.701 3.095 31.162 1.00 24.17 H new ATOM 0 HB2 LEU A 28 0.562 5.057 29.168 1.00 20.90 H new ATOM 0 HB3 LEU A 28 1.841 4.994 30.057 1.00 20.90 H new ATOM 0 HG LEU A 28 2.696 3.335 28.971 1.00 25.59 H new ATOM 0 HD11 LEU A 28 1.606 1.639 27.838 1.00 19.85 H new ATOM 0 HD12 LEU A 28 1.147 1.706 29.353 1.00 19.85 H new ATOM 0 HD13 LEU A 28 0.212 2.289 28.215 1.00 19.85 H new ATOM 0 HD21 LEU A 28 2.272 3.654 26.640 1.00 25.88 H new ATOM 0 HD22 LEU A 28 0.950 4.445 27.009 1.00 25.88 H new ATOM 0 HD23 LEU A 28 2.365 5.052 27.380 1.00 25.88 H new ATOM 180 N LEU A 29 -0.454 6.037 31.742 1.00 21.78 N ATOM 181 CA LEU A 29 -0.461 7.135 32.699 1.00 22.63 C ATOM 182 C LEU A 29 -1.119 6.724 34.017 1.00 24.13 C ATOM 183 O LEU A 29 -0.736 7.187 35.085 1.00 25.33 O ATOM 184 CB LEU A 29 -1.108 8.372 32.070 1.00 24.00 C ATOM 185 CG LEU A 29 -0.393 8.656 30.727 1.00 34.99 C ATOM 186 CD1 LEU A 29 -1.351 9.162 29.639 1.00 42.72 C ATOM 187 CD2 LEU A 29 0.857 9.573 30.862 1.00 24.71 C ATOM 0 H LEU A 29 -0.942 6.163 31.045 1.00 21.78 H new ATOM 0 HA LEU A 29 0.454 7.367 32.921 1.00 22.63 H new ATOM 0 HB2 LEU A 29 -2.055 8.222 31.925 1.00 24.00 H new ATOM 0 HB3 LEU A 29 -1.029 9.135 32.664 1.00 24.00 H new ATOM 0 HG LEU A 29 -0.061 7.792 30.438 1.00 34.99 H new ATOM 0 HD11 LEU A 29 -0.855 9.324 28.821 1.00 42.72 H new ATOM 0 HD12 LEU A 29 -2.036 8.495 29.475 1.00 42.72 H new ATOM 0 HD13 LEU A 29 -1.768 9.987 29.933 1.00 42.72 H new ATOM 0 HD21 LEU A 29 1.255 9.709 29.988 1.00 24.71 H new ATOM 0 HD22 LEU A 29 0.592 10.429 31.233 1.00 24.71 H new ATOM 0 HD23 LEU A 29 1.505 9.153 31.449 1.00 24.71 H new ATOM 188 N GLU A 30 -2.079 5.813 33.943 1.00 23.66 N ATOM 189 CA GLU A 30 -2.726 5.346 35.152 1.00 28.05 C ATOM 190 C GLU A 30 -1.792 4.493 35.999 1.00 27.85 C ATOM 191 O GLU A 30 -1.990 4.369 37.201 1.00 27.57 O ATOM 192 CB GLU A 30 -4.017 4.596 34.821 1.00 27.60 C ATOM 193 CG GLU A 30 -5.183 5.552 34.580 1.00 34.04 C ATOM 194 CD GLU A 30 -6.391 4.869 33.975 1.00 37.96 C ATOM 195 OE1 GLU A 30 -6.316 3.652 33.686 1.00 40.30 O ATOM 196 OE2 GLU A 30 -7.416 5.558 33.784 1.00 46.62 O ATOM 0 H GLU A 30 -2.365 5.459 33.213 1.00 23.66 H new ATOM 0 HA GLU A 30 -2.957 6.125 35.681 1.00 28.05 H new ATOM 0 HB2 GLU A 30 -3.880 4.048 34.032 1.00 27.60 H new ATOM 0 HB3 GLU A 30 -4.237 3.994 35.549 1.00 27.60 H new ATOM 0 HG2 GLU A 30 -5.437 5.963 35.421 1.00 34.04 H new ATOM 0 HG3 GLU A 30 -4.893 6.266 33.992 1.00 34.04 H new ATOM 197 N SER A 31 -0.768 3.916 35.375 1.00 27.74 N ATOM 198 CA SER A 31 0.162 3.041 36.090 1.00 26.16 C ATOM 199 C SER A 31 1.247 3.844 36.837 1.00 27.42 C ATOM 200 O SER A 31 1.966 3.285 37.663 1.00 29.03 O ATOM 201 CB SER A 31 0.811 2.040 35.124 1.00 21.30 C ATOM 202 OG SER A 31 1.820 2.663 34.328 1.00 21.63 O ATOM 0 H SER A 31 -0.593 4.017 34.539 1.00 27.74 H new ATOM 0 HA SER A 31 -0.351 2.553 36.753 1.00 26.16 H new ATOM 0 HB2 SER A 31 1.200 1.308 35.627 1.00 21.30 H new ATOM 0 HB3 SER A 31 0.131 1.658 34.547 1.00 21.30 H new ATOM 0 HG SER A 31 1.514 3.368 33.989 1.00 21.63 H new ATOM 203 N TYR A 32 1.371 5.138 36.528 1.00 24.99 N ATOM 204 CA TYR A 32 2.416 5.972 37.130 1.00 27.46 C ATOM 205 C TYR A 32 1.976 6.568 38.462 1.00 35.20 C ATOM 206 O TYR A 32 1.877 5.891 39.494 1.00 36.90 O ATOM 207 CB TYR A 32 2.845 7.114 36.190 1.00 26.13 C ATOM 208 CG TYR A 32 3.251 6.675 34.794 1.00 27.08 C ATOM 209 CD1 TYR A 32 3.928 5.470 34.593 1.00 20.89 C ATOM 210 CD2 TYR A 32 2.978 7.476 33.671 1.00 23.00 C ATOM 211 CE1 TYR A 32 4.307 5.066 33.327 1.00 24.39 C ATOM 212 CE2 TYR A 32 3.372 7.076 32.398 1.00 23.09 C ATOM 213 CZ TYR A 32 4.036 5.864 32.229 1.00 23.47 C ATOM 214 OH TYR A 32 4.422 5.420 30.957 1.00 25.03 O ATOM 215 OXT TYR A 32 1.704 7.766 38.518 1.00 34.82 O ATOM 0 H TYR A 32 0.861 5.551 35.973 1.00 24.99 H new ATOM 0 HA TYR A 32 3.171 5.383 37.284 1.00 27.46 H new ATOM 0 HB2 TYR A 32 2.113 7.746 36.116 1.00 26.13 H new ATOM 0 HB3 TYR A 32 3.589 7.587 36.595 1.00 26.13 H new ATOM 0 HD1 TYR A 32 4.127 4.930 35.324 1.00 20.89 H new ATOM 0 HD2 TYR A 32 2.529 8.283 33.781 1.00 23.00 H new ATOM 0 HE1 TYR A 32 4.746 4.254 33.212 1.00 24.39 H new ATOM 0 HE2 TYR A 32 3.192 7.616 31.663 1.00 23.09 H new ATOM 0 HH TYR A 32 4.434 4.580 30.945 1.00 25.03 H new TER 216 TYR A 32 ATOM 217 N ILE B 37 5.141 -9.325 18.208 1.00 20.76 N ATOM 218 CA ILE B 37 4.421 -9.033 19.442 1.00 18.70 C ATOM 219 C ILE B 37 3.353 -10.081 19.703 1.00 24.88 C ATOM 220 O ILE B 37 2.516 -10.350 18.846 1.00 25.56 O ATOM 221 CB ILE B 37 3.764 -7.635 19.419 1.00 19.29 C ATOM 222 CG1 ILE B 37 4.798 -6.536 19.094 1.00 21.71 C ATOM 223 CG2 ILE B 37 3.008 -7.345 20.755 1.00 19.26 C ATOM 224 CD1 ILE B 37 5.810 -6.252 20.219 1.00 17.57 C ATOM 0 HA ILE B 37 5.078 -9.048 20.155 1.00 18.70 H new ATOM 0 HB ILE B 37 3.105 -7.627 18.708 1.00 19.29 H new ATOM 0 HG12 ILE B 37 5.285 -6.793 18.295 1.00 21.71 H new ATOM 0 HG13 ILE B 37 4.325 -5.715 18.886 1.00 21.71 H new ATOM 0 HG21 ILE B 37 2.606 -6.463 20.715 1.00 19.26 H new ATOM 0 HG22 ILE B 37 2.315 -8.011 20.886 1.00 19.26 H new ATOM 0 HG23 ILE B 37 3.634 -7.381 21.495 1.00 19.26 H new ATOM 0 HD11 ILE B 37 6.421 -5.553 19.936 1.00 17.57 H new ATOM 0 HD12 ILE B 37 5.337 -5.965 21.015 1.00 17.57 H new ATOM 0 HD13 ILE B 37 6.311 -7.059 20.415 1.00 17.57 H new ATOM 225 N VAL B 38 3.390 -10.672 20.895 1.00 29.64 N ATOM 226 CA VAL B 38 2.397 -11.663 21.298 1.00 23.69 C ATOM 227 C VAL B 38 1.351 -11.007 22.204 1.00 25.58 C ATOM 228 O VAL B 38 1.701 -10.228 23.100 1.00 27.83 O ATOM 229 CB VAL B 38 3.058 -12.856 22.021 1.00 28.87 C ATOM 230 CG1 VAL B 38 2.027 -13.943 22.320 1.00 25.72 C ATOM 231 CG2 VAL B 38 4.220 -13.411 21.188 1.00 23.73 C ATOM 0 H VAL B 38 3.989 -10.510 21.490 1.00 29.64 H new ATOM 0 HA VAL B 38 1.964 -12.004 20.500 1.00 23.69 H new ATOM 0 HB VAL B 38 3.416 -12.544 22.867 1.00 28.87 H new ATOM 0 HG11 VAL B 38 2.459 -14.683 22.774 1.00 25.72 H new ATOM 0 HG12 VAL B 38 1.329 -13.580 22.887 1.00 25.72 H new ATOM 0 HG13 VAL B 38 1.637 -14.257 21.489 1.00 25.72 H new ATOM 0 HG21 VAL B 38 4.625 -14.159 21.655 1.00 23.73 H new ATOM 0 HG22 VAL B 38 3.888 -13.709 20.327 1.00 23.73 H new ATOM 0 HG23 VAL B 38 4.884 -12.716 21.055 1.00 23.73 H new ATOM 232 N GLU B 39 0.073 -11.303 21.950 1.00 29.99 N ATOM 233 CA GLU B 39 -1.059 -10.731 22.702 1.00 28.98 C ATOM 234 C GLU B 39 -1.140 -9.214 22.599 1.00 26.85 C ATOM 235 O GLU B 39 -1.543 -8.550 23.540 1.00 30.62 O ATOM 236 CB GLU B 39 -1.018 -11.151 24.185 1.00 30.62 C ATOM 237 CG GLU B 39 -1.209 -12.643 24.422 1.00 36.48 C ATOM 238 CD GLU B 39 -2.519 -13.174 23.850 1.00 46.35 C ATOM 239 OE1 GLU B 39 -3.550 -12.473 23.961 1.00 45.28 O ATOM 240 OE2 GLU B 39 -2.511 -14.294 23.288 1.00 52.62 O ATOM 0 H GLU B 39 -0.167 -11.848 21.329 1.00 29.99 H new ATOM 0 HA GLU B 39 -1.858 -11.093 22.288 1.00 28.98 H new ATOM 0 HB2 GLU B 39 -0.166 -10.881 24.563 1.00 30.62 H new ATOM 0 HB3 GLU B 39 -1.708 -10.667 24.666 1.00 30.62 H new ATOM 0 HG2 GLU B 39 -0.468 -13.126 24.023 1.00 36.48 H new ATOM 0 HG3 GLU B 39 -1.183 -12.820 25.375 1.00 36.48 H new ATOM 241 N GLY B 40 -0.737 -8.667 21.459 1.00 24.91 N ATOM 242 CA GLY B 40 -0.848 -7.241 21.230 1.00 26.39 C ATOM 243 C GLY B 40 -2.093 -6.899 20.425 1.00 27.85 C ATOM 244 O GLY B 40 -2.990 -7.725 20.276 1.00 23.37 O ATOM 0 H GLY B 40 -0.396 -9.109 20.805 1.00 24.91 H new ATOM 0 HA2 GLY B 40 -0.874 -6.777 22.081 1.00 26.39 H new ATOM 0 HA3 GLY B 40 -0.061 -6.926 20.759 1.00 26.39 H new ATOM 245 N SER B 41 -2.140 -5.673 19.916 1.00 24.98 N ATOM 246 CA SER B 41 -3.247 -5.176 19.104 1.00 27.66 C ATOM 247 C SER B 41 -2.655 -4.390 17.962 1.00 27.43 C ATOM 248 O SER B 41 -1.492 -3.959 18.036 1.00 24.49 O ATOM 249 CB SER B 41 -4.145 -4.239 19.904 1.00 28.17 C ATOM 250 OG SER B 41 -4.343 -4.732 21.218 1.00 47.48 O ATOM 0 H SER B 41 -1.516 -5.093 20.035 1.00 24.98 H new ATOM 0 HA SER B 41 -3.778 -5.928 18.798 1.00 27.66 H new ATOM 0 HB2 SER B 41 -3.746 -3.356 19.942 1.00 28.17 H new ATOM 0 HB3 SER B 41 -5.001 -4.144 19.457 1.00 28.17 H new ATOM 0 HG SER B 41 -3.832 -4.329 21.749 1.00 47.48 H new ATOM 251 N ASP B 42 -3.454 -4.210 16.911 1.00 25.21 N ATOM 252 CA ASP B 42 -3.073 -3.374 15.775 1.00 24.78 C ATOM 253 C ASP B 42 -2.833 -1.952 16.248 1.00 25.34 C ATOM 254 O ASP B 42 -3.684 -1.374 16.909 1.00 28.37 O ATOM 255 CB ASP B 42 -4.188 -3.350 14.727 1.00 29.81 C ATOM 256 CG ASP B 42 -4.355 -4.679 13.997 1.00 28.61 C ATOM 257 OD1 ASP B 42 -3.616 -5.646 14.275 1.00 27.13 O ATOM 258 OD2 ASP B 42 -5.244 -4.746 13.129 1.00 34.76 O ATOM 0 H ASP B 42 -4.232 -4.569 16.837 1.00 25.21 H new ATOM 0 HA ASP B 42 -2.266 -3.743 15.383 1.00 24.78 H new ATOM 0 HB2 ASP B 42 -5.025 -3.117 15.159 1.00 29.81 H new ATOM 0 HB3 ASP B 42 -4.000 -2.653 14.079 1.00 29.81 H new ATOM 259 N ALA B 43 -1.676 -1.390 15.913 1.00 24.79 N ATOM 260 CA ALA B 43 -1.396 -0.002 16.226 1.00 21.27 C ATOM 261 C ALA B 43 -2.343 0.901 15.423 1.00 23.73 C ATOM 262 O ALA B 43 -2.875 0.479 14.414 1.00 19.65 O ATOM 263 CB ALA B 43 0.043 0.319 15.897 1.00 24.20 C ATOM 0 H ALA B 43 -1.041 -1.800 15.503 1.00 24.79 H new ATOM 0 HA ALA B 43 -1.537 0.153 17.173 1.00 21.27 H new ATOM 0 HB1 ALA B 43 0.224 1.248 16.108 1.00 24.20 H new ATOM 0 HB2 ALA B 43 0.629 -0.251 16.419 1.00 24.20 H new ATOM 0 HB3 ALA B 43 0.201 0.166 14.952 1.00 24.20 H new ATOM 264 N GLU B 44 -2.555 2.133 15.882 1.00 26.29 N ATOM 265 CA GLU B 44 -3.269 3.137 15.089 1.00 22.82 C ATOM 266 C GLU B 44 -2.282 3.829 14.155 1.00 21.04 C ATOM 267 O GLU B 44 -1.081 3.867 14.434 1.00 16.66 O ATOM 268 CB GLU B 44 -3.940 4.177 15.994 1.00 19.18 C ATOM 269 CG GLU B 44 -4.902 3.582 17.019 1.00 30.18 C ATOM 270 CD GLU B 44 -5.350 4.586 18.078 1.00 30.73 C ATOM 271 OE1 GLU B 44 -6.116 5.508 17.748 1.00 32.70 O ATOM 272 OE2 GLU B 44 -4.943 4.443 19.246 1.00 30.18 O ATOM 0 H GLU B 44 -2.293 2.410 16.653 1.00 26.29 H new ATOM 0 HA GLU B 44 -3.961 2.693 14.574 1.00 22.82 H new ATOM 0 HB2 GLU B 44 -3.252 4.676 16.462 1.00 19.18 H new ATOM 0 HB3 GLU B 44 -4.423 4.810 15.440 1.00 19.18 H new ATOM 0 HG2 GLU B 44 -5.683 3.237 16.559 1.00 30.18 H new ATOM 0 HG3 GLU B 44 -4.474 2.829 17.456 1.00 30.18 H new ATOM 273 N ILE B 45 -2.788 4.369 13.046 1.00 20.66 N ATOM 274 CA ILE B 45 -1.947 5.099 12.106 1.00 19.94 C ATOM 275 C ILE B 45 -1.260 6.265 12.834 1.00 22.30 C ATOM 276 O ILE B 45 -1.921 7.038 13.525 1.00 23.51 O ATOM 277 CB ILE B 45 -2.781 5.643 10.918 1.00 20.63 C ATOM 278 CG1 ILE B 45 -3.379 4.488 10.108 1.00 25.13 C ATOM 279 CG2 ILE B 45 -1.950 6.580 10.048 1.00 19.28 C ATOM 280 CD1 ILE B 45 -2.443 3.929 9.059 1.00 33.26 C ATOM 0 H ILE B 45 -3.617 4.322 12.822 1.00 20.66 H new ATOM 0 HA ILE B 45 -1.279 4.490 11.754 1.00 19.94 H new ATOM 0 HB ILE B 45 -3.518 6.165 11.272 1.00 20.63 H new ATOM 0 HG12 ILE B 45 -3.633 3.776 10.715 1.00 25.13 H new ATOM 0 HG13 ILE B 45 -4.191 4.794 9.675 1.00 25.13 H new ATOM 0 HG21 ILE B 45 -2.493 6.906 9.313 1.00 19.28 H new ATOM 0 HG22 ILE B 45 -1.644 7.330 10.581 1.00 19.28 H new ATOM 0 HG23 ILE B 45 -1.184 6.100 9.695 1.00 19.28 H new ATOM 0 HD11 ILE B 45 -2.882 3.205 8.586 1.00 33.26 H new ATOM 0 HD12 ILE B 45 -2.206 4.629 8.430 1.00 33.26 H new ATOM 0 HD13 ILE B 45 -1.640 3.594 9.487 1.00 33.26 H new ATOM 281 N GLY B 46 0.059 6.385 12.691 1.00 20.76 N ATOM 282 CA GLY B 46 0.807 7.460 13.334 1.00 18.41 C ATOM 283 C GLY B 46 0.993 7.345 14.850 1.00 22.35 C ATOM 284 O GLY B 46 1.481 8.275 15.503 1.00 16.21 O ATOM 0 H GLY B 46 0.541 5.849 12.222 1.00 20.76 H new ATOM 0 HA2 GLY B 46 1.684 7.509 12.923 1.00 18.41 H new ATOM 0 HA3 GLY B 46 0.358 8.299 13.145 1.00 18.41 H new ATOM 285 N MET B 47 0.586 6.213 15.415 1.00 19.26 N ATOM 286 CA MET B 47 0.717 5.962 16.851 1.00 20.26 C ATOM 287 C MET B 47 2.187 5.892 17.342 1.00 17.88 C ATOM 288 O MET B 47 2.517 6.213 18.492 1.00 14.73 O ATOM 289 CB MET B 47 0.037 4.641 17.176 1.00 19.54 C ATOM 290 CG MET B 47 -0.315 4.478 18.639 1.00 25.18 C ATOM 291 SD MET B 47 -0.673 2.754 18.938 1.00 26.15 S ATOM 292 CE MET B 47 -1.848 2.848 20.285 1.00 30.99 C ATOM 0 H MET B 47 0.225 5.566 14.978 1.00 19.26 H new ATOM 0 HA MET B 47 0.302 6.711 17.306 1.00 20.26 H new ATOM 0 HB2 MET B 47 -0.772 4.565 16.647 1.00 19.54 H new ATOM 0 HB3 MET B 47 0.620 3.913 16.909 1.00 19.54 H new ATOM 0 HG2 MET B 47 0.420 4.773 19.199 1.00 25.18 H new ATOM 0 HG3 MET B 47 -1.082 5.027 18.866 1.00 25.18 H new ATOM 0 HE1 MET B 47 -2.121 1.953 20.540 1.00 30.99 H new ATOM 0 HE2 MET B 47 -1.435 3.288 21.045 1.00 30.99 H new ATOM 0 HE3 MET B 47 -2.625 3.354 20.002 1.00 30.99 H new ATOM 293 N SER B 48 3.070 5.468 16.453 1.00 15.84 N ATOM 294 CA SER B 48 4.445 5.234 16.830 1.00 17.18 C ATOM 295 C SER B 48 5.333 5.690 15.670 1.00 17.30 C ATOM 296 O SER B 48 5.960 4.877 14.987 1.00 18.22 O ATOM 297 CB SER B 48 4.604 3.738 17.178 1.00 20.12 C ATOM 298 OG SER B 48 5.938 3.398 17.487 1.00 25.57 O ATOM 0 H SER B 48 2.890 5.311 15.627 1.00 15.84 H new ATOM 0 HA SER B 48 4.711 5.738 17.615 1.00 17.18 H new ATOM 0 HB2 SER B 48 4.034 3.521 17.933 1.00 20.12 H new ATOM 0 HB3 SER B 48 4.300 3.200 16.430 1.00 20.12 H new ATOM 0 HG SER B 48 6.374 4.096 17.654 1.00 25.57 H new ATOM 299 N PRO B 49 5.373 7.010 15.431 1.00 17.04 N ATOM 300 CA PRO B 49 6.024 7.558 14.233 1.00 16.88 C ATOM 301 C PRO B 49 7.550 7.484 14.285 1.00 16.74 C ATOM 302 O PRO B 49 8.192 7.856 13.315 1.00 17.15 O ATOM 303 CB PRO B 49 5.591 9.034 14.256 1.00 18.05 C ATOM 304 CG PRO B 49 5.483 9.331 15.739 1.00 14.95 C ATOM 305 CD PRO B 49 4.812 8.076 16.283 1.00 15.52 C ATOM 0 HA PRO B 49 5.772 7.063 13.438 1.00 16.88 H new ATOM 0 HB2 PRO B 49 6.242 9.607 13.821 1.00 18.05 H new ATOM 0 HB3 PRO B 49 4.746 9.168 13.800 1.00 18.05 H new ATOM 0 HG2 PRO B 49 6.353 9.478 16.142 1.00 14.95 H new ATOM 0 HG3 PRO B 49 4.954 10.126 15.910 1.00 14.95 H new ATOM 0 HD2 PRO B 49 5.019 7.934 17.220 1.00 15.52 H new ATOM 0 HD3 PRO B 49 3.846 8.124 16.210 1.00 15.52 H new ATOM 306 N TRP B 50 8.122 7.034 15.403 1.00 16.79 N ATOM 307 CA TRP B 50 9.566 6.819 15.498 1.00 13.60 C ATOM 308 C TRP B 50 9.961 5.367 15.167 1.00 14.74 C ATOM 309 O TRP B 50 11.149 5.028 15.137 1.00 18.51 O ATOM 310 CB TRP B 50 10.049 7.204 16.900 1.00 16.10 C ATOM 311 CG TRP B 50 9.028 6.845 17.943 1.00 13.96 C ATOM 312 CD1 TRP B 50 8.749 5.591 18.433 1.00 14.60 C ATOM 313 CD2 TRP B 50 8.114 7.739 18.579 1.00 13.94 C ATOM 314 NE1 TRP B 50 7.724 5.665 19.360 1.00 17.72 N ATOM 315 CE2 TRP B 50 7.318 6.971 19.465 1.00 17.24 C ATOM 316 CE3 TRP B 50 7.894 9.121 18.501 1.00 18.87 C ATOM 317 CZ2 TRP B 50 6.329 7.546 20.273 1.00 18.07 C ATOM 318 CZ3 TRP B 50 6.908 9.691 19.315 1.00 16.58 C ATOM 319 CH2 TRP B 50 6.146 8.901 20.187 1.00 14.61 C ATOM 0 H TRP B 50 7.688 6.846 16.121 1.00 16.79 H new ATOM 0 HA TRP B 50 9.997 7.384 14.838 1.00 13.60 H new ATOM 0 HB2 TRP B 50 10.885 6.751 17.093 1.00 16.10 H new ATOM 0 HB3 TRP B 50 10.228 8.157 16.933 1.00 16.10 H new ATOM 0 HD1 TRP B 50 9.184 4.809 18.179 1.00 14.60 H new ATOM 0 HE1 TRP B 50 7.396 5.002 19.798 1.00 17.72 H new ATOM 0 HE3 TRP B 50 8.393 9.649 17.920 1.00 18.87 H new ATOM 0 HZ2 TRP B 50 5.815 7.026 20.848 1.00 18.07 H new ATOM 0 HZ3 TRP B 50 6.756 10.608 19.277 1.00 16.58 H new ATOM 0 HH2 TRP B 50 5.501 9.306 20.720 1.00 14.61 H new ATOM 320 N GLN B 51 8.967 4.519 14.932 1.00 13.15 N ATOM 321 CA GLN B 51 9.192 3.107 14.624 1.00 17.44 C ATOM 322 C GLN B 51 9.852 2.935 13.257 1.00 18.25 C ATOM 323 O GLN B 51 9.425 3.517 12.253 1.00 17.48 O ATOM 324 CB GLN B 51 7.876 2.325 14.683 1.00 14.38 C ATOM 325 CG GLN B 51 7.991 0.845 14.357 1.00 15.54 C ATOM 326 CD GLN B 51 8.631 0.027 15.468 1.00 19.54 C ATOM 327 OE1 GLN B 51 8.384 0.261 16.645 1.00 20.08 O ATOM 328 NE2 GLN B 51 9.441 -0.959 15.089 1.00 17.86 N ATOM 0 H GLN B 51 8.137 4.745 14.946 1.00 13.15 H new ATOM 0 HA GLN B 51 9.796 2.751 15.295 1.00 17.44 H new ATOM 0 HB2 GLN B 51 7.500 2.418 15.572 1.00 14.38 H new ATOM 0 HB3 GLN B 51 7.247 2.730 14.066 1.00 14.38 H new ATOM 0 HG2 GLN B 51 7.106 0.492 14.174 1.00 15.54 H new ATOM 0 HG3 GLN B 51 8.512 0.739 13.546 1.00 15.54 H new ATOM 0 HE21 GLN B 51 9.592 -1.094 14.253 1.00 17.86 H new ATOM 0 HE22 GLN B 51 9.814 -1.461 15.680 1.00 17.86 H new ATOM 329 N VAL B 52 10.906 2.138 13.230 1.00 16.48 N ATOM 330 CA VAL B 52 11.693 1.946 12.020 1.00 14.78 C ATOM 331 C VAL B 52 11.709 0.467 11.749 1.00 17.04 C ATOM 332 O VAL B 52 11.786 -0.339 12.688 1.00 16.22 O ATOM 333 CB VAL B 52 13.145 2.425 12.234 1.00 16.33 C ATOM 334 CG1 VAL B 52 14.055 2.012 11.064 1.00 17.88 C ATOM 335 CG2 VAL B 52 13.173 3.940 12.496 1.00 15.07 C ATOM 0 H VAL B 52 11.187 1.693 13.910 1.00 16.48 H new ATOM 0 HA VAL B 52 11.311 2.450 11.285 1.00 14.78 H new ATOM 0 HB VAL B 52 13.503 1.986 13.021 1.00 16.33 H new ATOM 0 HG11 VAL B 52 14.957 2.327 11.229 1.00 17.88 H new ATOM 0 HG12 VAL B 52 14.060 1.045 10.983 1.00 17.88 H new ATOM 0 HG13 VAL B 52 13.722 2.403 10.241 1.00 17.88 H new ATOM 0 HG21 VAL B 52 14.089 4.229 12.629 1.00 15.07 H new ATOM 0 HG22 VAL B 52 12.794 4.407 11.735 1.00 15.07 H new ATOM 0 HG23 VAL B 52 12.653 4.141 13.290 1.00 15.07 H new ATOM 336 N MET B 53 11.622 0.093 10.477 1.00 17.85 N ATOM 337 CA MET B 53 11.765 -1.306 10.103 1.00 17.95 C ATOM 338 C MET B 53 13.158 -1.529 9.512 1.00 20.87 C ATOM 339 O MET B 53 13.587 -0.807 8.611 1.00 18.25 O ATOM 340 CB MET B 53 10.686 -1.742 9.103 1.00 17.85 C ATOM 341 CG MET B 53 11.001 -3.102 8.445 1.00 22.30 C ATOM 342 SD MET B 53 9.829 -3.610 7.144 1.00 24.91 S ATOM 343 CE MET B 53 8.317 -3.819 8.102 1.00 19.47 C ATOM 0 H MET B 53 11.482 0.630 9.820 1.00 17.85 H new ATOM 0 HA MET B 53 11.654 -1.848 10.900 1.00 17.95 H new ATOM 0 HB2 MET B 53 9.831 -1.797 9.558 1.00 17.85 H new ATOM 0 HB3 MET B 53 10.597 -1.066 8.413 1.00 17.85 H new ATOM 0 HG2 MET B 53 11.892 -3.064 8.063 1.00 22.30 H new ATOM 0 HG3 MET B 53 11.016 -3.785 9.134 1.00 22.30 H new ATOM 0 HE1 MET B 53 7.832 -4.594 7.777 1.00 19.47 H new ATOM 0 HE2 MET B 53 8.541 -3.947 9.037 1.00 19.47 H new ATOM 0 HE3 MET B 53 7.763 -3.029 8.009 1.00 19.47 H new ATOM 344 N LEU B 54 13.880 -2.504 10.056 1.00 19.30 N ATOM 345 CA LEU B 54 15.176 -2.879 9.487 1.00 27.48 C ATOM 346 C LEU B 54 14.933 -3.934 8.431 1.00 22.88 C ATOM 347 O LEU B 54 14.418 -5.005 8.727 1.00 24.31 O ATOM 348 CB LEU B 54 16.148 -3.384 10.560 1.00 24.04 C ATOM 349 CG LEU B 54 17.291 -2.451 10.968 1.00 32.33 C ATOM 350 CD1 LEU B 54 16.882 -0.970 10.941 1.00 30.60 C ATOM 351 CD2 LEU B 54 17.880 -2.847 12.331 1.00 27.32 C ATOM 0 H LEU B 54 13.643 -2.958 10.747 1.00 19.30 H new ATOM 0 HA LEU B 54 15.593 -2.098 9.092 1.00 27.48 H new ATOM 0 HB2 LEU B 54 15.634 -3.594 11.355 1.00 24.04 H new ATOM 0 HB3 LEU B 54 16.537 -4.215 10.245 1.00 24.04 H new ATOM 0 HG LEU B 54 17.987 -2.558 10.301 1.00 32.33 H new ATOM 0 HD11 LEU B 54 17.636 -0.421 11.206 1.00 30.60 H new ATOM 0 HD12 LEU B 54 16.605 -0.727 10.044 1.00 30.60 H new ATOM 0 HD13 LEU B 54 16.146 -0.826 11.556 1.00 30.60 H new ATOM 0 HD21 LEU B 54 18.600 -2.239 12.562 1.00 27.32 H new ATOM 0 HD22 LEU B 54 17.188 -2.800 13.009 1.00 27.32 H new ATOM 0 HD23 LEU B 54 18.225 -3.753 12.284 1.00 27.32 H new ATOM 352 N PHE B 55 15.291 -3.615 7.195 1.00 27.37 N ATOM 353 CA PHE B 55 14.909 -4.448 6.056 1.00 29.96 C ATOM 354 C PHE B 55 16.114 -4.975 5.286 1.00 31.24 C ATOM 355 O PHE B 55 16.947 -4.200 4.814 1.00 32.19 O ATOM 356 CB PHE B 55 14.001 -3.658 5.114 1.00 25.08 C ATOM 357 CG PHE B 55 13.245 -4.514 4.139 1.00 31.39 C ATOM 358 CD1 PHE B 55 13.533 -4.465 2.777 1.00 31.56 C ATOM 359 CD2 PHE B 55 12.241 -5.361 4.577 1.00 29.26 C ATOM 360 CE1 PHE B 55 12.824 -5.240 1.875 1.00 34.98 C ATOM 361 CE2 PHE B 55 11.535 -6.143 3.680 1.00 34.78 C ATOM 362 CZ PHE B 55 11.823 -6.082 2.331 1.00 34.26 C ATOM 0 H PHE B 55 15.755 -2.921 6.991 1.00 27.37 H new ATOM 0 HA PHE B 55 14.434 -5.216 6.411 1.00 29.96 H new ATOM 0 HB2 PHE B 55 13.367 -3.148 5.642 1.00 25.08 H new ATOM 0 HB3 PHE B 55 14.539 -3.019 4.621 1.00 25.08 H new ATOM 0 HD1 PHE B 55 14.209 -3.905 2.470 1.00 31.56 H new ATOM 0 HD2 PHE B 55 12.039 -5.405 5.484 1.00 29.26 H new ATOM 0 HE1 PHE B 55 13.019 -5.195 0.967 1.00 34.98 H new ATOM 0 HE2 PHE B 55 10.865 -6.711 3.986 1.00 34.78 H new ATOM 0 HZ PHE B 55 11.345 -6.606 1.729 1.00 34.26 H new ATOM 363 N ARG B 56 16.199 -6.296 5.165 1.00 30.57 N ATOM 364 CA ARG B 56 17.304 -6.937 4.457 1.00 36.99 C ATOM 365 C ARG B 56 17.117 -6.825 2.943 1.00 36.71 C ATOM 366 O ARG B 56 16.032 -7.085 2.437 1.00 36.71 O ATOM 367 CB ARG B 56 17.387 -8.405 4.863 1.00 38.73 C ATOM 368 CG ARG B 56 18.555 -9.161 4.270 1.00 45.47 C ATOM 369 CD ARG B 56 18.628 -10.549 4.883 1.00 44.52 C ATOM 370 NE ARG B 56 19.778 -11.300 4.389 1.00 50.31 N ATOM 371 CZ ARG B 56 20.106 -12.512 4.818 1.00 45.77 C ATOM 372 NH1 ARG B 56 21.161 -13.131 4.315 1.00 53.41 N ATOM 373 NH2 ARG B 56 19.375 -13.102 5.753 1.00 39.72 N ATOM 0 H ARG B 56 15.621 -6.844 5.489 1.00 30.57 H new ATOM 0 HA ARG B 56 18.129 -6.486 4.696 1.00 36.99 H new ATOM 0 HB2 ARG B 56 17.441 -8.458 5.830 1.00 38.73 H new ATOM 0 HB3 ARG B 56 16.565 -8.847 4.600 1.00 38.73 H new ATOM 0 HG2 ARG B 56 18.454 -9.227 3.308 1.00 45.47 H new ATOM 0 HG3 ARG B 56 19.381 -8.680 4.436 1.00 45.47 H new ATOM 0 HD2 ARG B 56 18.681 -10.474 5.849 1.00 44.52 H new ATOM 0 HD3 ARG B 56 17.813 -11.035 4.681 1.00 44.52 H new ATOM 0 HE ARG B 56 20.271 -10.936 3.786 1.00 50.31 H new ATOM 0 HH11 ARG B 56 21.636 -12.748 3.709 1.00 53.41 H new ATOM 0 HH12 ARG B 56 21.372 -13.917 4.594 1.00 53.41 H new ATOM 0 HH21 ARG B 56 18.689 -12.699 6.081 1.00 39.72 H new ATOM 0 HH22 ARG B 56 19.586 -13.888 6.032 1.00 39.72 H new ATOM 374 N LYS B 57 18.174 -6.422 2.238 1.00 35.49 N ATOM 375 CA LYS B 57 18.128 -6.236 0.785 1.00 41.72 C ATOM 376 C LYS B 57 17.855 -7.539 0.020 1.00 43.70 C ATOM 377 O LYS B 57 16.959 -7.594 -0.822 1.00 41.92 O ATOM 378 CB LYS B 57 19.414 -5.584 0.276 1.00 37.77 C ATOM 379 CG LYS B 57 19.514 -4.082 0.512 1.00 37.45 C ATOM 380 CD LYS B 57 20.789 -3.524 -0.125 1.00 39.25 C ATOM 381 CE LYS B 57 20.926 -2.023 0.050 1.00 48.44 C ATOM 382 NZ LYS B 57 22.290 -1.529 -0.292 1.00 46.33 N ATOM 0 H LYS B 57 18.940 -6.248 2.589 1.00 35.49 H new ATOM 0 HA LYS B 57 17.379 -5.644 0.612 1.00 41.72 H new ATOM 0 HB2 LYS B 57 20.170 -6.016 0.704 1.00 37.77 H new ATOM 0 HB3 LYS B 57 19.491 -5.754 -0.676 1.00 37.77 H new ATOM 0 HG2 LYS B 57 18.737 -3.638 0.137 1.00 37.45 H new ATOM 0 HG3 LYS B 57 19.514 -3.898 1.464 1.00 37.45 H new ATOM 0 HD2 LYS B 57 21.560 -3.963 0.267 1.00 39.25 H new ATOM 0 HD3 LYS B 57 20.792 -3.737 -1.071 1.00 39.25 H new ATOM 0 HE2 LYS B 57 20.273 -1.574 -0.510 1.00 48.44 H new ATOM 0 HE3 LYS B 57 20.721 -1.788 0.968 1.00 48.44 H new ATOM 0 HZ1 LYS B 57 22.224 -0.787 -0.780 1.00 46.33 H new ATOM 0 HZ2 LYS B 57 22.738 -1.352 0.456 1.00 46.33 H new ATOM 0 HZ3 LYS B 57 22.724 -2.152 -0.757 1.00 46.33 H new ATOM 383 N SER B 58 18.620 -8.587 0.318 1.00 47.19 N ATOM 384 CA SER B 58 18.384 -9.901 -0.293 1.00 46.09 C ATOM 385 C SER B 58 18.867 -11.056 0.576 1.00 40.55 C ATOM 386 O SER B 58 20.014 -11.067 1.024 1.00 41.17 O ATOM 387 CB SER B 58 19.029 -9.986 -1.678 1.00 52.62 C ATOM 388 OG SER B 58 20.431 -9.796 -1.596 1.00 59.22 O ATOM 0 H SER B 58 19.280 -8.562 0.869 1.00 47.19 H new ATOM 0 HA SER B 58 17.422 -9.988 -0.380 1.00 46.09 H new ATOM 0 HB2 SER B 58 18.839 -10.850 -2.075 1.00 52.62 H new ATOM 0 HB3 SER B 58 18.641 -9.315 -2.261 1.00 52.62 H new ATOM 0 HG SER B 58 20.695 -9.985 -0.821 1.00 59.22 H new ATOM 389 N PRO B 59 17.979 -12.028 0.829 1.00 42.13 N ATOM 390 CA PRO B 59 16.586 -11.976 0.376 1.00 43.60 C ATOM 391 C PRO B 59 15.845 -10.831 1.068 1.00 47.86 C ATOM 392 O PRO B 59 16.249 -10.413 2.158 1.00 47.98 O ATOM 393 CB PRO B 59 16.023 -13.323 0.854 1.00 49.78 C ATOM 394 CG PRO B 59 16.900 -13.691 2.019 1.00 49.49 C ATOM 395 CD PRO B 59 18.263 -13.286 1.538 1.00 47.72 C ATOM 0 HA PRO B 59 16.498 -11.830 -0.579 1.00 43.60 H new ATOM 0 HB2 PRO B 59 15.093 -13.245 1.120 1.00 49.78 H new ATOM 0 HB3 PRO B 59 16.063 -13.993 0.154 1.00 49.78 H new ATOM 0 HG2 PRO B 59 16.646 -13.217 2.826 1.00 49.49 H new ATOM 0 HG3 PRO B 59 16.855 -14.639 2.220 1.00 49.49 H new ATOM 0 HD2 PRO B 59 18.883 -13.156 2.273 1.00 47.72 H new ATOM 0 HD3 PRO B 59 18.654 -13.953 0.952 1.00 47.72 H new ATOM 396 N GLN B 60 14.785 -10.327 0.443 1.00 40.99 N ATOM 397 CA GLN B 60 14.000 -9.255 1.034 1.00 42.58 C ATOM 398 C GLN B 60 13.218 -9.795 2.217 1.00 47.40 C ATOM 399 O GLN B 60 12.315 -10.613 2.047 1.00 44.33 O ATOM 400 CB GLN B 60 13.060 -8.618 0.005 1.00 42.35 C ATOM 401 CG GLN B 60 13.805 -7.903 -1.118 1.00 47.59 C ATOM 402 CD GLN B 60 12.958 -6.883 -1.868 1.00 53.86 C ATOM 403 OE1 GLN B 60 13.440 -6.234 -2.798 1.00 56.70 O ATOM 404 NE2 GLN B 60 11.692 -6.735 -1.465 1.00 55.91 N ATOM 0 H GLN B 60 14.505 -10.594 -0.325 1.00 40.99 H new ATOM 0 HA GLN B 60 14.604 -8.560 1.340 1.00 42.58 H new ATOM 0 HB2 GLN B 60 12.492 -9.306 -0.377 1.00 42.35 H new ATOM 0 HB3 GLN B 60 12.477 -7.986 0.454 1.00 42.35 H new ATOM 0 HG2 GLN B 60 14.581 -7.455 -0.746 1.00 47.59 H new ATOM 0 HG3 GLN B 60 14.134 -8.563 -1.748 1.00 47.59 H new ATOM 0 HE21 GLN B 60 11.391 -7.206 -0.812 1.00 55.91 H new ATOM 0 HE22 GLN B 60 11.179 -6.169 -1.859 1.00 55.91 H new ATOM 405 N GLU B 61 13.586 -9.348 3.416 1.00 44.29 N ATOM 406 CA GLU B 61 12.890 -9.759 4.629 1.00 38.85 C ATOM 407 C GLU B 61 13.057 -8.765 5.790 1.00 37.02 C ATOM 408 O GLU B 61 14.007 -7.979 5.841 1.00 32.25 O ATOM 409 CB GLU B 61 13.348 -11.154 5.057 1.00 42.15 C ATOM 410 CG GLU B 61 14.829 -11.247 5.333 1.00 44.65 C ATOM 411 CD GLU B 61 15.294 -12.666 5.611 1.00 48.36 C ATOM 412 OE1 GLU B 61 14.511 -13.609 5.379 1.00 51.73 O ATOM 413 OE2 GLU B 61 16.451 -12.836 6.055 1.00 48.66 O ATOM 0 H GLU B 61 14.239 -8.804 3.547 1.00 44.29 H new ATOM 0 HA GLU B 61 11.945 -9.776 4.412 1.00 38.85 H new ATOM 0 HB2 GLU B 61 12.861 -11.415 5.854 1.00 42.15 H new ATOM 0 HB3 GLU B 61 13.116 -11.790 4.362 1.00 42.15 H new ATOM 0 HG2 GLU B 61 15.317 -10.895 4.572 1.00 44.65 H new ATOM 0 HG3 GLU B 61 15.047 -10.686 6.094 1.00 44.65 H new ATOM 414 N LEU B 62 12.108 -8.816 6.716 1.00 36.06 N ATOM 415 CA LEU B 62 12.160 -8.052 7.948 1.00 35.74 C ATOM 416 C LEU B 62 13.312 -8.574 8.795 1.00 31.48 C ATOM 417 O LEU B 62 13.393 -9.772 9.041 1.00 32.10 O ATOM 418 CB LEU B 62 10.839 -8.217 8.706 1.00 35.07 C ATOM 419 CG LEU B 62 10.735 -7.781 10.177 1.00 34.04 C ATOM 420 CD1 LEU B 62 10.932 -6.274 10.315 1.00 28.57 C ATOM 421 CD2 LEU B 62 9.379 -8.203 10.764 1.00 30.10 C ATOM 0 H LEU B 62 11.404 -9.305 6.642 1.00 36.06 H new ATOM 0 HA LEU B 62 12.296 -7.111 7.754 1.00 35.74 H new ATOM 0 HB2 LEU B 62 10.161 -7.730 8.212 1.00 35.07 H new ATOM 0 HB3 LEU B 62 10.599 -9.156 8.666 1.00 35.07 H new ATOM 0 HG LEU B 62 11.440 -8.223 10.675 1.00 34.04 H new ATOM 0 HD11 LEU B 62 10.862 -6.023 11.249 1.00 28.57 H new ATOM 0 HD12 LEU B 62 11.809 -6.030 9.979 1.00 28.57 H new ATOM 0 HD13 LEU B 62 10.250 -5.810 9.804 1.00 28.57 H new ATOM 0 HD21 LEU B 62 9.326 -7.923 11.691 1.00 30.10 H new ATOM 0 HD22 LEU B 62 8.664 -7.786 10.259 1.00 30.10 H new ATOM 0 HD23 LEU B 62 9.290 -9.168 10.713 1.00 30.10 H new ATOM 422 N LEU B 63 14.203 -7.683 9.222 1.00 25.26 N ATOM 423 CA LEU B 63 15.321 -8.075 10.074 1.00 27.98 C ATOM 424 C LEU B 63 15.037 -7.790 11.544 1.00 28.47 C ATOM 425 O LEU B 63 15.340 -8.604 12.404 1.00 28.48 O ATOM 426 CB LEU B 63 16.598 -7.337 9.683 1.00 26.37 C ATOM 427 CG LEU B 63 17.436 -7.861 8.523 1.00 40.50 C ATOM 428 CD1 LEU B 63 18.830 -7.278 8.661 1.00 41.06 C ATOM 429 CD2 LEU B 63 17.484 -9.402 8.465 1.00 37.52 C ATOM 0 H LEU B 63 14.178 -6.845 9.029 1.00 25.26 H new ATOM 0 HA LEU B 63 15.438 -9.030 9.948 1.00 27.98 H new ATOM 0 HB2 LEU B 63 16.354 -6.421 9.476 1.00 26.37 H new ATOM 0 HB3 LEU B 63 17.170 -7.308 10.466 1.00 26.37 H new ATOM 0 HG LEU B 63 17.026 -7.584 7.689 1.00 40.50 H new ATOM 0 HD11 LEU B 63 19.387 -7.596 7.933 1.00 41.06 H new ATOM 0 HD12 LEU B 63 18.780 -6.310 8.631 1.00 41.06 H new ATOM 0 HD13 LEU B 63 19.215 -7.555 9.507 1.00 41.06 H new ATOM 0 HD21 LEU B 63 18.028 -9.681 7.712 1.00 37.52 H new ATOM 0 HD22 LEU B 63 17.870 -9.745 9.286 1.00 37.52 H new ATOM 0 HD23 LEU B 63 16.585 -9.750 8.360 1.00 37.52 H new ATOM 430 N CYS B 64 14.462 -6.624 11.821 1.00 24.79 N ATOM 431 CA CYS B 64 14.400 -6.110 13.179 1.00 18.66 C ATOM 432 C CYS B 64 13.617 -4.809 13.183 1.00 20.52 C ATOM 433 O CYS B 64 13.361 -4.219 12.125 1.00 17.71 O ATOM 434 CB CYS B 64 15.819 -5.828 13.696 1.00 17.44 C ATOM 435 SG CYS B 64 16.564 -7.153 14.705 1.00 21.58 S ATOM 0 H CYS B 64 14.100 -6.114 11.231 1.00 24.79 H new ATOM 0 HA CYS B 64 13.969 -6.767 13.748 1.00 18.66 H new ATOM 0 HB2 CYS B 64 16.396 -5.659 12.935 1.00 17.44 H new ATOM 0 HB3 CYS B 64 15.799 -5.014 14.223 1.00 17.44 H new ATOM 436 N GLY B 65 13.227 -4.373 14.377 1.00 18.24 N ATOM 437 CA GLY B 65 12.727 -3.024 14.572 1.00 15.48 C ATOM 438 C GLY B 65 13.877 -2.097 14.928 1.00 14.38 C ATOM 439 O GLY B 65 15.031 -2.526 15.101 1.00 17.22 O ATOM 0 H GLY B 65 13.246 -4.851 15.092 1.00 18.24 H new ATOM 0 HA2 GLY B 65 12.287 -2.713 13.765 1.00 15.48 H new ATOM 0 HA3 GLY B 65 12.062 -3.015 15.279 1.00 15.48 H new ATOM 440 N ALA B 66 13.563 -0.818 15.053 1.00 9.48 N ATOM 441 CA ALA B 66 14.555 0.175 15.390 1.00 14.44 C ATOM 442 C ALA B 66 13.730 1.404 15.694 1.00 17.74 C ATOM 443 O ALA B 66 12.500 1.326 15.635 1.00 14.32 O ATOM 444 CB ALA B 66 15.517 0.413 14.225 1.00 12.36 C ATOM 0 H ALA B 66 12.769 -0.505 14.944 1.00 9.48 H new ATOM 0 HA ALA B 66 15.120 -0.088 16.133 1.00 14.44 H new ATOM 0 HB1 ALA B 66 16.172 1.083 14.477 1.00 12.36 H new ATOM 0 HB2 ALA B 66 15.971 -0.416 14.006 1.00 12.36 H new ATOM 0 HB3 ALA B 66 15.019 0.723 13.452 1.00 12.36 H new ATOM 445 N SER B 67 14.387 2.510 16.042 1.00 13.81 N ATOM 446 CA SER B 67 13.689 3.738 16.355 1.00 13.04 C ATOM 447 C SER B 67 14.478 4.944 15.853 1.00 17.48 C ATOM 448 O SER B 67 15.702 4.922 15.798 1.00 17.26 O ATOM 449 CB SER B 67 13.420 3.861 17.857 1.00 15.38 C ATOM 450 OG SER B 67 14.640 3.996 18.559 1.00 16.65 O ATOM 0 H SER B 67 15.243 2.562 16.101 1.00 13.81 H new ATOM 0 HA SER B 67 12.832 3.715 15.901 1.00 13.04 H new ATOM 0 HB2 SER B 67 12.853 4.629 18.029 1.00 15.38 H new ATOM 0 HB3 SER B 67 12.942 3.078 18.172 1.00 15.38 H new ATOM 0 HG SER B 67 14.496 4.357 19.304 1.00 16.65 H new ATOM 451 N LEU B 68 13.747 5.990 15.493 1.00 13.97 N ATOM 452 CA LEU B 68 14.313 7.211 14.962 1.00 16.70 C ATOM 453 C LEU B 68 14.482 8.204 16.102 1.00 18.86 C ATOM 454 O LEU B 68 13.528 8.499 16.823 1.00 18.42 O ATOM 455 CB LEU B 68 13.364 7.778 13.904 1.00 21.98 C ATOM 456 CG LEU B 68 13.857 8.945 13.057 1.00 24.94 C ATOM 457 CD1 LEU B 68 14.964 8.448 12.160 1.00 23.68 C ATOM 458 CD2 LEU B 68 12.702 9.551 12.246 1.00 21.84 C ATOM 0 H LEU B 68 12.889 6.006 15.554 1.00 13.97 H new ATOM 0 HA LEU B 68 15.176 7.039 14.554 1.00 16.70 H new ATOM 0 HB2 LEU B 68 13.122 7.056 13.304 1.00 21.98 H new ATOM 0 HB3 LEU B 68 12.551 8.058 14.353 1.00 21.98 H new ATOM 0 HG LEU B 68 14.201 9.650 13.627 1.00 24.94 H new ATOM 0 HD11 LEU B 68 15.290 9.179 11.613 1.00 23.68 H new ATOM 0 HD12 LEU B 68 15.690 8.102 12.703 1.00 23.68 H new ATOM 0 HD13 LEU B 68 14.625 7.743 11.587 1.00 23.68 H new ATOM 0 HD21 LEU B 68 13.033 10.291 11.714 1.00 21.84 H new ATOM 0 HD22 LEU B 68 12.328 8.874 11.660 1.00 21.84 H new ATOM 0 HD23 LEU B 68 12.014 9.871 12.851 1.00 21.84 H new ATOM 459 N ILE B 69 15.705 8.689 16.304 1.00 16.21 N ATOM 460 CA ILE B 69 15.979 9.572 17.436 1.00 17.17 C ATOM 461 C ILE B 69 16.413 10.967 16.980 1.00 19.99 C ATOM 462 O ILE B 69 16.538 11.865 17.791 1.00 14.62 O ATOM 463 CB ILE B 69 17.028 8.971 18.420 1.00 22.59 C ATOM 464 CG1 ILE B 69 18.354 8.682 17.702 1.00 20.40 C ATOM 465 CG2 ILE B 69 16.465 7.721 19.127 1.00 15.33 C ATOM 466 CD1 ILE B 69 19.458 8.134 18.626 1.00 19.50 C ATOM 0 H ILE B 69 16.384 8.521 15.803 1.00 16.21 H new ATOM 0 HA ILE B 69 15.141 9.657 17.917 1.00 17.17 H new ATOM 0 HB ILE B 69 17.215 9.629 19.108 1.00 22.59 H new ATOM 0 HG12 ILE B 69 18.194 8.043 16.990 1.00 20.40 H new ATOM 0 HG13 ILE B 69 18.670 9.498 17.284 1.00 20.40 H new ATOM 0 HG21 ILE B 69 17.133 7.364 19.733 1.00 15.33 H new ATOM 0 HG22 ILE B 69 15.670 7.963 19.628 1.00 15.33 H new ATOM 0 HG23 ILE B 69 16.238 7.049 18.465 1.00 15.33 H new ATOM 0 HD11 ILE B 69 20.263 7.975 18.109 1.00 19.50 H new ATOM 0 HD12 ILE B 69 19.645 8.780 19.325 1.00 19.50 H new ATOM 0 HD13 ILE B 69 19.162 7.302 19.026 1.00 19.50 H new ATOM 467 N SER B 70 16.638 11.133 15.674 1.00 22.13 N ATOM 468 CA SER B 70 16.814 12.457 15.061 1.00 28.08 C ATOM 469 C SER B 70 16.595 12.292 13.563 1.00 27.32 C ATOM 470 O SER B 70 16.268 11.198 13.121 1.00 23.46 O ATOM 471 CB SER B 70 18.217 13.003 15.310 1.00 24.42 C ATOM 472 OG SER B 70 19.154 12.303 14.510 1.00 26.51 O ATOM 0 H SER B 70 16.693 10.481 15.116 1.00 22.13 H new ATOM 0 HA SER B 70 16.183 13.084 15.449 1.00 28.08 H new ATOM 0 HB2 SER B 70 18.246 13.950 15.103 1.00 24.42 H new ATOM 0 HB3 SER B 70 18.447 12.911 16.248 1.00 24.42 H new ATOM 0 HG SER B 70 19.898 12.692 14.544 1.00 26.51 H new ATOM 473 N ASP B 71 16.787 13.355 12.782 1.00 27.15 N ATOM 474 CA ASP B 71 16.571 13.256 11.332 1.00 32.32 C ATOM 475 C ASP B 71 17.617 12.373 10.647 1.00 31.73 C ATOM 476 O ASP B 71 17.475 12.019 9.480 1.00 34.76 O ATOM 477 CB ASP B 71 16.503 14.644 10.666 1.00 31.65 C ATOM 478 CG ASP B 71 17.815 15.407 10.752 1.00 33.70 C ATOM 479 OD1 ASP B 71 18.817 14.829 11.201 1.00 35.61 O ATOM 480 OD2 ASP B 71 17.846 16.593 10.371 1.00 39.48 O ATOM 0 H ASP B 71 17.037 14.129 13.061 1.00 27.15 H new ATOM 0 HA ASP B 71 15.709 12.827 11.215 1.00 32.32 H new ATOM 0 HB2 ASP B 71 16.256 14.539 9.734 1.00 31.65 H new ATOM 0 HB3 ASP B 71 15.803 15.166 11.088 1.00 31.65 H new ATOM 481 N ARG B 72 18.646 11.985 11.392 1.00 27.34 N ATOM 482 CA ARG B 72 19.778 11.285 10.804 1.00 28.17 C ATOM 483 C ARG B 72 20.255 10.014 11.553 1.00 31.59 C ATOM 484 O ARG B 72 21.097 9.269 11.048 1.00 28.82 O ATOM 485 CB ARG B 72 20.933 12.275 10.678 1.00 33.63 C ATOM 486 CG ARG B 72 21.857 11.957 9.550 1.00 42.61 C ATOM 487 CD ARG B 72 23.032 12.917 9.500 1.00 54.93 C ATOM 488 NE ARG B 72 24.173 12.269 8.856 1.00 63.56 N ATOM 489 CZ ARG B 72 24.136 11.760 7.629 1.00 52.28 C ATOM 490 NH1 ARG B 72 23.012 11.834 6.932 1.00 45.02 N ATOM 491 NH2 ARG B 72 25.210 11.173 7.107 1.00 49.94 N ATOM 0 H ARG B 72 18.707 12.118 12.239 1.00 27.34 H new ATOM 0 HA ARG B 72 19.472 10.954 9.945 1.00 28.17 H new ATOM 0 HB2 ARG B 72 20.574 13.168 10.553 1.00 33.63 H new ATOM 0 HB3 ARG B 72 21.436 12.285 11.508 1.00 33.63 H new ATOM 0 HG2 ARG B 72 22.184 11.049 9.646 1.00 42.61 H new ATOM 0 HG3 ARG B 72 21.371 11.996 8.712 1.00 42.61 H new ATOM 0 HD2 ARG B 72 22.786 13.718 9.011 1.00 54.93 H new ATOM 0 HD3 ARG B 72 23.272 13.195 10.398 1.00 54.93 H new ATOM 0 HE ARG B 72 24.910 12.214 9.296 1.00 63.56 H new ATOM 0 HH11 ARG B 72 22.318 12.208 7.274 1.00 45.02 H new ATOM 0 HH12 ARG B 72 22.977 11.508 6.137 1.00 45.02 H new ATOM 0 HH21 ARG B 72 25.936 11.120 7.564 1.00 49.94 H new ATOM 0 HH22 ARG B 72 25.178 10.846 6.312 1.00 49.94 H new ATOM 492 N TRP B 73 19.742 9.784 12.761 1.00 27.30 N ATOM 493 CA TRP B 73 20.206 8.671 13.590 1.00 24.06 C ATOM 494 C TRP B 73 19.097 7.688 13.955 1.00 27.16 C ATOM 495 O TRP B 73 17.971 8.077 14.307 1.00 21.19 O ATOM 496 CB TRP B 73 20.877 9.182 14.864 1.00 22.33 C ATOM 497 CG TRP B 73 22.202 9.811 14.627 1.00 26.48 C ATOM 498 CD1 TRP B 73 22.457 11.142 14.453 1.00 31.74 C ATOM 499 CD2 TRP B 73 23.467 9.141 14.519 1.00 25.32 C ATOM 500 NE1 TRP B 73 23.806 11.343 14.256 1.00 34.08 N ATOM 501 CE2 TRP B 73 24.446 10.132 14.293 1.00 30.92 C ATOM 502 CE3 TRP B 73 23.866 7.802 14.593 1.00 27.82 C ATOM 503 CZ2 TRP B 73 25.802 9.826 14.150 1.00 30.60 C ATOM 504 CZ3 TRP B 73 25.217 7.499 14.441 1.00 27.83 C ATOM 505 CH2 TRP B 73 26.164 8.509 14.220 1.00 30.75 C ATOM 0 H TRP B 73 19.123 10.262 13.120 1.00 27.30 H new ATOM 0 HA TRP B 73 20.851 8.189 13.049 1.00 24.06 H new ATOM 0 HB2 TRP B 73 20.293 9.828 15.292 1.00 22.33 H new ATOM 0 HB3 TRP B 73 20.984 8.443 15.483 1.00 22.33 H new ATOM 0 HD1 TRP B 73 21.814 11.814 14.466 1.00 31.74 H new ATOM 0 HE1 TRP B 73 24.185 12.105 14.130 1.00 34.08 H new ATOM 0 HE3 TRP B 73 23.242 7.128 14.741 1.00 27.82 H new ATOM 0 HZ2 TRP B 73 26.435 10.493 14.012 1.00 30.60 H new ATOM 0 HZ3 TRP B 73 25.495 6.613 14.487 1.00 27.83 H new ATOM 0 HH2 TRP B 73 27.059 8.278 14.119 1.00 30.75 H new ATOM 506 N VAL B 74 19.436 6.406 13.872 1.00 21.83 N ATOM 507 CA VAL B 74 18.511 5.342 14.175 1.00 19.85 C ATOM 508 C VAL B 74 19.112 4.469 15.262 1.00 22.05 C ATOM 509 O VAL B 74 20.293 4.127 15.223 1.00 19.40 O ATOM 510 CB VAL B 74 18.153 4.512 12.914 1.00 21.65 C ATOM 511 CG1 VAL B 74 17.481 3.203 13.292 1.00 20.71 C ATOM 512 CG2 VAL B 74 17.237 5.329 11.993 1.00 22.31 C ATOM 0 H VAL B 74 20.217 6.135 13.636 1.00 21.83 H new ATOM 0 HA VAL B 74 17.679 5.726 14.492 1.00 19.85 H new ATOM 0 HB VAL B 74 18.976 4.303 12.445 1.00 21.65 H new ATOM 0 HG11 VAL B 74 17.268 2.704 12.488 1.00 20.71 H new ATOM 0 HG12 VAL B 74 18.080 2.680 13.847 1.00 20.71 H new ATOM 0 HG13 VAL B 74 16.665 3.388 13.783 1.00 20.71 H new ATOM 0 HG21 VAL B 74 17.017 4.805 11.207 1.00 22.31 H new ATOM 0 HG22 VAL B 74 16.422 5.558 12.467 1.00 22.31 H new ATOM 0 HG23 VAL B 74 17.692 6.142 11.722 1.00 22.31 H new ATOM 513 N LEU B 75 18.290 4.125 16.244 1.00 19.69 N ATOM 514 CA LEU B 75 18.746 3.350 17.383 1.00 16.07 C ATOM 515 C LEU B 75 18.164 1.950 17.315 1.00 13.15 C ATOM 516 O LEU B 75 16.982 1.800 17.051 1.00 15.51 O ATOM 517 CB LEU B 75 18.287 4.037 18.653 1.00 17.51 C ATOM 518 CG LEU B 75 18.717 3.424 19.969 1.00 18.41 C ATOM 519 CD1 LEU B 75 20.230 3.458 20.081 1.00 16.55 C ATOM 520 CD2 LEU B 75 18.070 4.266 21.060 1.00 21.74 C ATOM 0 H LEU B 75 17.456 4.334 16.267 1.00 19.69 H new ATOM 0 HA LEU B 75 19.714 3.287 17.375 1.00 16.07 H new ATOM 0 HB2 LEU B 75 18.605 4.953 18.630 1.00 17.51 H new ATOM 0 HB3 LEU B 75 17.318 4.073 18.641 1.00 17.51 H new ATOM 0 HG LEU B 75 18.444 2.496 20.044 1.00 18.41 H new ATOM 0 HD11 LEU B 75 20.501 3.065 20.925 1.00 16.55 H new ATOM 0 HD12 LEU B 75 20.620 2.954 19.350 1.00 16.55 H new ATOM 0 HD13 LEU B 75 20.537 4.377 20.040 1.00 16.55 H new ATOM 0 HD21 LEU B 75 18.315 3.913 21.930 1.00 21.74 H new ATOM 0 HD22 LEU B 75 18.376 5.183 20.986 1.00 21.74 H new ATOM 0 HD23 LEU B 75 17.105 4.239 20.961 1.00 21.74 H new ATOM 521 N THR B 76 18.997 0.929 17.530 1.00 13.46 N ATOM 522 CA THR B 76 18.537 -0.449 17.512 1.00 14.87 C ATOM 523 C THR B 76 19.384 -1.328 18.445 1.00 12.16 C ATOM 524 O THR B 76 20.226 -0.838 19.182 1.00 15.05 O ATOM 525 CB THR B 76 18.573 -1.031 16.083 1.00 14.58 C ATOM 526 OG1 THR B 76 17.798 -2.219 16.038 1.00 16.30 O ATOM 527 CG2 THR B 76 20.006 -1.363 15.661 1.00 17.17 C ATOM 0 H THR B 76 19.837 1.021 17.689 1.00 13.46 H new ATOM 0 HA THR B 76 17.620 -0.448 17.827 1.00 14.87 H new ATOM 0 HB THR B 76 18.213 -0.366 15.476 1.00 14.58 H new ATOM 0 HG1 THR B 76 17.036 -2.045 15.730 1.00 16.30 H new ATOM 0 HG21 THR B 76 20.003 -1.726 14.762 1.00 17.17 H new ATOM 0 HG22 THR B 76 20.545 -0.557 15.681 1.00 17.17 H new ATOM 0 HG23 THR B 76 20.380 -2.017 16.272 1.00 17.17 H new ATOM 528 N ALA B 77 19.140 -2.628 18.410 1.00 15.36 N ATOM 529 CA ALA B 77 19.863 -3.587 19.256 1.00 17.58 C ATOM 530 C ALA B 77 21.063 -4.135 18.479 1.00 18.90 C ATOM 531 O ALA B 77 20.961 -4.351 17.261 1.00 14.47 O ATOM 532 CB ALA B 77 18.934 -4.723 19.681 1.00 13.02 C ATOM 0 H ALA B 77 18.551 -2.988 17.897 1.00 15.36 H new ATOM 0 HA ALA B 77 20.178 -3.140 20.057 1.00 17.58 H new ATOM 0 HB1 ALA B 77 19.422 -5.349 20.238 1.00 13.02 H new ATOM 0 HB2 ALA B 77 18.186 -4.360 20.181 1.00 13.02 H new ATOM 0 HB3 ALA B 77 18.603 -5.182 18.893 1.00 13.02 H new ATOM 533 N ALA B 78 22.190 -4.331 19.174 1.00 16.13 N ATOM 534 CA ALA B 78 23.409 -4.886 18.550 1.00 17.31 C ATOM 535 C ALA B 78 23.175 -6.281 17.939 1.00 16.68 C ATOM 536 O ALA B 78 23.695 -6.604 16.874 1.00 19.98 O ATOM 537 CB ALA B 78 24.576 -4.935 19.562 1.00 14.64 C ATOM 0 H ALA B 78 22.273 -4.150 20.011 1.00 16.13 H new ATOM 0 HA ALA B 78 23.645 -4.287 17.824 1.00 17.31 H new ATOM 0 HB1 ALA B 78 25.363 -5.302 19.131 1.00 14.64 H new ATOM 0 HB2 ALA B 78 24.769 -4.038 19.877 1.00 14.64 H new ATOM 0 HB3 ALA B 78 24.329 -5.496 20.314 1.00 14.64 H new ATOM 538 N HIS B 79 22.379 -7.100 18.607 1.00 15.07 N ATOM 539 CA HIS B 79 22.199 -8.474 18.167 1.00 19.69 C ATOM 540 C HIS B 79 21.460 -8.554 16.827 1.00 21.67 C ATOM 541 O HIS B 79 21.516 -9.571 16.141 1.00 18.50 O ATOM 542 CB HIS B 79 21.539 -9.327 19.252 1.00 18.18 C ATOM 543 CG HIS B 79 20.048 -9.214 19.299 1.00 21.79 C ATOM 544 ND1 HIS B 79 19.394 -8.392 20.192 1.00 19.40 N ATOM 545 CD2 HIS B 79 19.082 -9.846 18.588 1.00 14.54 C ATOM 546 CE1 HIS B 79 18.091 -8.508 20.020 1.00 17.97 C ATOM 547 NE2 HIS B 79 17.874 -9.382 19.052 1.00 19.84 N ATOM 0 H HIS B 79 21.937 -6.883 19.312 1.00 15.07 H new ATOM 0 HA HIS B 79 23.081 -8.848 18.014 1.00 19.69 H new ATOM 0 HB2 HIS B 79 21.778 -10.256 19.109 1.00 18.18 H new ATOM 0 HB3 HIS B 79 21.900 -9.071 20.115 1.00 18.18 H new ATOM 0 HD1 HIS B 79 19.776 -7.883 20.771 1.00 19.40 H new ATOM 0 HD2 HIS B 79 19.212 -10.474 17.914 1.00 14.54 H new ATOM 0 HE1 HIS B 79 17.436 -8.052 20.498 1.00 17.97 H new ATOM 548 N CYS B 80 20.806 -7.454 16.457 1.00 21.34 N ATOM 549 CA CYS B 80 20.183 -7.308 15.149 1.00 19.24 C ATOM 550 C CYS B 80 21.216 -7.329 14.021 1.00 24.80 C ATOM 551 O CYS B 80 20.933 -7.797 12.912 1.00 23.16 O ATOM 552 CB CYS B 80 19.410 -5.995 15.096 1.00 17.59 C ATOM 553 SG CYS B 80 17.811 -6.058 15.872 1.00 19.14 S ATOM 0 H CYS B 80 20.712 -6.767 16.965 1.00 21.34 H new ATOM 0 HA CYS B 80 19.583 -8.060 15.022 1.00 19.24 H new ATOM 0 HB2 CYS B 80 19.939 -5.303 15.523 1.00 17.59 H new ATOM 0 HB3 CYS B 80 19.298 -5.735 14.168 1.00 17.59 H new ATOM 554 N LEU B 81 22.410 -6.815 14.308 1.00 23.26 N ATOM 555 CA LEU B 81 23.461 -6.710 13.298 1.00 21.87 C ATOM 556 C LEU B 81 24.538 -7.761 13.481 1.00 28.35 C ATOM 557 O LEU B 81 25.047 -8.332 12.516 1.00 30.91 O ATOM 558 CB LEU B 81 24.093 -5.323 13.348 1.00 22.77 C ATOM 559 CG LEU B 81 23.025 -4.227 13.304 1.00 27.70 C ATOM 560 CD1 LEU B 81 23.557 -2.843 13.714 1.00 28.20 C ATOM 561 CD2 LEU B 81 22.371 -4.203 11.923 1.00 25.31 C ATOM 0 H LEU B 81 22.632 -6.520 15.085 1.00 23.26 H new ATOM 0 HA LEU B 81 23.046 -6.858 12.434 1.00 21.87 H new ATOM 0 HB2 LEU B 81 24.619 -5.233 14.158 1.00 22.77 H new ATOM 0 HB3 LEU B 81 24.702 -5.215 12.601 1.00 22.77 H new ATOM 0 HG LEU B 81 22.353 -4.445 13.968 1.00 27.70 H new ATOM 0 HD11 LEU B 81 22.839 -2.193 13.667 1.00 28.20 H new ATOM 0 HD12 LEU B 81 23.897 -2.883 14.621 1.00 28.20 H new ATOM 0 HD13 LEU B 81 24.271 -2.579 13.113 1.00 28.20 H new ATOM 0 HD21 LEU B 81 21.695 -3.508 11.897 1.00 25.31 H new ATOM 0 HD22 LEU B 81 23.045 -4.023 11.249 1.00 25.31 H new ATOM 0 HD23 LEU B 81 21.958 -5.062 11.745 1.00 25.31 H new ATOM 562 N LEU B 82 24.877 -8.025 14.730 1.00 20.69 N ATOM 563 CA LEU B 82 26.024 -8.847 15.021 1.00 19.36 C ATOM 564 C LEU B 82 25.695 -9.882 16.081 1.00 22.60 C ATOM 565 O LEU B 82 25.405 -9.527 17.234 1.00 20.57 O ATOM 566 CB LEU B 82 27.174 -7.954 15.477 1.00 22.28 C ATOM 567 CG LEU B 82 28.437 -8.659 16.002 1.00 28.20 C ATOM 568 CD1 LEU B 82 29.107 -9.476 14.896 1.00 24.53 C ATOM 569 CD2 LEU B 82 29.397 -7.629 16.565 1.00 17.46 C ATOM 0 H LEU B 82 24.454 -7.736 15.421 1.00 20.69 H new ATOM 0 HA LEU B 82 26.285 -9.325 14.218 1.00 19.36 H new ATOM 0 HB2 LEU B 82 27.431 -7.389 14.732 1.00 22.28 H new ATOM 0 HB3 LEU B 82 26.843 -7.368 16.176 1.00 22.28 H new ATOM 0 HG LEU B 82 28.182 -9.273 16.708 1.00 28.20 H new ATOM 0 HD11 LEU B 82 29.899 -9.911 15.249 1.00 24.53 H new ATOM 0 HD12 LEU B 82 28.488 -10.148 14.570 1.00 24.53 H new ATOM 0 HD13 LEU B 82 29.359 -8.888 14.167 1.00 24.53 H new ATOM 0 HD21 LEU B 82 30.193 -8.075 16.896 1.00 17.46 H new ATOM 0 HD22 LEU B 82 29.644 -7.002 15.868 1.00 17.46 H new ATOM 0 HD23 LEU B 82 28.969 -7.151 17.292 1.00 17.46 H new ATOM 570 N TYR B 83 25.720 -11.154 15.681 1.00 21.67 N ATOM 571 CA TYR B 83 25.563 -12.260 16.617 1.00 24.64 C ATOM 572 C TYR B 83 26.220 -13.532 16.072 1.00 23.92 C ATOM 573 O TYR B 83 25.560 -14.387 15.488 1.00 21.97 O ATOM 574 CB TYR B 83 24.090 -12.484 16.977 1.00 21.27 C ATOM 575 CG TYR B 83 23.896 -13.445 18.128 1.00 21.60 C ATOM 576 CD1 TYR B 83 24.355 -13.127 19.402 1.00 23.96 C ATOM 577 CD2 TYR B 83 23.265 -14.672 17.943 1.00 22.02 C ATOM 578 CE1 TYR B 83 24.200 -13.997 20.464 1.00 21.95 C ATOM 579 CE2 TYR B 83 23.095 -15.553 19.005 1.00 28.28 C ATOM 580 CZ TYR B 83 23.571 -15.207 20.261 1.00 24.55 C ATOM 581 OH TYR B 83 23.430 -16.065 21.309 1.00 24.03 O ATOM 0 H TYR B 83 25.828 -11.396 14.863 1.00 21.67 H new ATOM 0 HA TYR B 83 26.020 -12.025 17.440 1.00 24.64 H new ATOM 0 HB2 TYR B 83 23.686 -11.632 17.203 1.00 21.27 H new ATOM 0 HB3 TYR B 83 23.621 -12.823 16.198 1.00 21.27 H new ATOM 0 HD1 TYR B 83 24.776 -12.310 19.542 1.00 23.96 H new ATOM 0 HD2 TYR B 83 22.953 -14.905 17.098 1.00 22.02 H new ATOM 0 HE1 TYR B 83 24.517 -13.769 21.308 1.00 21.95 H new ATOM 0 HE2 TYR B 83 22.666 -16.368 18.874 1.00 28.28 H new ATOM 0 HH TYR B 83 23.032 -16.759 21.052 1.00 24.03 H new ATOM 582 N PRO B 84 27.538 -13.660 16.279 1.00 25.76 N ATOM 583 CA PRO B 84 28.354 -14.760 15.733 1.00 27.32 C ATOM 584 C PRO B 84 27.829 -16.196 15.956 1.00 27.89 C ATOM 585 O PRO B 84 28.011 -17.031 15.077 1.00 30.83 O ATOM 586 CB PRO B 84 29.716 -14.558 16.424 1.00 30.77 C ATOM 587 CG PRO B 84 29.766 -13.069 16.687 1.00 23.88 C ATOM 588 CD PRO B 84 28.349 -12.714 17.072 1.00 21.42 C ATOM 0 HA PRO B 84 28.363 -14.708 14.764 1.00 27.32 H new ATOM 0 HB2 PRO B 84 29.777 -15.068 17.247 1.00 30.77 H new ATOM 0 HB3 PRO B 84 30.449 -14.845 15.857 1.00 30.77 H new ATOM 0 HG2 PRO B 84 30.391 -12.855 17.398 1.00 23.88 H new ATOM 0 HG3 PRO B 84 30.053 -12.579 15.900 1.00 23.88 H new ATOM 0 HD2 PRO B 84 28.198 -12.823 18.024 1.00 21.42 H new ATOM 0 HD3 PRO B 84 28.139 -11.792 16.855 1.00 21.42 H new ATOM 589 N PRO B 85 27.197 -16.493 17.102 1.00 24.58 N ATOM 590 CA PRO B 85 26.658 -17.850 17.262 1.00 27.23 C ATOM 591 C PRO B 85 25.625 -18.282 16.200 1.00 29.71 C ATOM 592 O PRO B 85 25.329 -19.480 16.090 1.00 26.91 O ATOM 593 CB PRO B 85 25.985 -17.792 18.636 1.00 26.24 C ATOM 594 CG PRO B 85 26.685 -16.689 19.343 1.00 25.57 C ATOM 595 CD PRO B 85 26.986 -15.677 18.307 1.00 22.94 C ATOM 0 HA PRO B 85 27.369 -18.503 17.166 1.00 27.23 H new ATOM 0 HB2 PRO B 85 25.035 -17.615 18.557 1.00 26.24 H new ATOM 0 HB3 PRO B 85 26.078 -18.632 19.111 1.00 26.24 H new ATOM 0 HG2 PRO B 85 26.128 -16.315 20.044 1.00 25.57 H new ATOM 0 HG3 PRO B 85 27.498 -17.007 19.766 1.00 25.57 H new ATOM 0 HD2 PRO B 85 26.254 -15.050 18.193 1.00 22.94 H new ATOM 0 HD3 PRO B 85 27.773 -15.156 18.531 1.00 22.94 H new ATOM 596 N TRP B 86 25.058 -17.327 15.465 1.00 30.10 N ATOM 597 CA TRP B 86 24.140 -17.636 14.373 1.00 27.25 C ATOM 598 C TRP B 86 24.705 -17.134 13.061 1.00 32.79 C ATOM 599 O TRP B 86 23.960 -16.919 12.098 1.00 31.64 O ATOM 600 CB TRP B 86 22.774 -16.987 14.583 1.00 28.31 C ATOM 601 CG TRP B 86 22.044 -17.434 15.819 1.00 32.88 C ATOM 602 CD1 TRP B 86 22.358 -18.491 16.625 1.00 32.37 C ATOM 603 CD2 TRP B 86 20.859 -16.843 16.375 1.00 31.98 C ATOM 604 NE1 TRP B 86 21.449 -18.588 17.655 1.00 36.32 N ATOM 605 CE2 TRP B 86 20.521 -17.586 17.525 1.00 33.30 C ATOM 606 CE3 TRP B 86 20.055 -15.753 16.012 1.00 37.39 C ATOM 607 CZ2 TRP B 86 19.410 -17.278 18.315 1.00 33.89 C ATOM 608 CZ3 TRP B 86 18.943 -15.451 16.798 1.00 24.77 C ATOM 609 CH2 TRP B 86 18.638 -16.207 17.938 1.00 32.25 C ATOM 0 H TRP B 86 25.194 -16.486 15.585 1.00 30.10 H new ATOM 0 HA TRP B 86 24.033 -18.600 14.354 1.00 27.25 H new ATOM 0 HB2 TRP B 86 22.890 -16.025 14.622 1.00 28.31 H new ATOM 0 HB3 TRP B 86 22.219 -17.175 13.810 1.00 28.31 H new ATOM 0 HD1 TRP B 86 23.081 -19.062 16.497 1.00 32.37 H new ATOM 0 HE1 TRP B 86 21.461 -19.180 18.278 1.00 36.32 H new ATOM 0 HE3 TRP B 86 20.259 -15.242 15.262 1.00 37.39 H new ATOM 0 HZ2 TRP B 86 19.201 -17.781 19.069 1.00 33.89 H new ATOM 0 HZ3 TRP B 86 18.396 -14.737 16.562 1.00 24.77 H new ATOM 0 HH2 TRP B 86 17.896 -15.978 18.450 1.00 32.25 H new ATOM 610 N ASP B 87 26.017 -16.925 13.028 1.00 29.47 N ATOM 611 CA ASP B 87 26.666 -16.393 11.838 1.00 34.19 C ATOM 612 C ASP B 87 25.960 -15.141 11.353 1.00 33.57 C ATOM 613 O ASP B 87 25.770 -14.947 10.152 1.00 34.28 O ATOM 614 CB ASP B 87 26.681 -17.437 10.726 1.00 34.95 C ATOM 615 CG ASP B 87 27.622 -18.576 11.028 1.00 45.49 C ATOM 616 OD1 ASP B 87 28.854 -18.351 10.949 1.00 45.00 O ATOM 617 OD2 ASP B 87 27.125 -19.681 11.354 1.00 44.84 O ATOM 0 H ASP B 87 26.548 -17.085 13.685 1.00 29.47 H new ATOM 0 HA ASP B 87 27.579 -16.166 12.073 1.00 34.19 H new ATOM 0 HB2 ASP B 87 25.785 -17.785 10.599 1.00 34.95 H new ATOM 0 HB3 ASP B 87 26.942 -17.016 9.892 1.00 34.95 H new ATOM 618 N LYS B 88 25.566 -14.292 12.290 1.00 29.62 N ATOM 619 CA LYS B 88 24.964 -13.028 11.913 1.00 28.72 C ATOM 620 C LYS B 88 25.992 -11.903 11.987 1.00 27.38 C ATOM 621 O LYS B 88 26.584 -11.645 13.040 1.00 25.22 O ATOM 622 CB LYS B 88 23.738 -12.736 12.777 1.00 30.78 C ATOM 623 CG LYS B 88 22.938 -11.543 12.291 1.00 32.52 C ATOM 624 CD LYS B 88 21.797 -11.231 13.228 1.00 32.29 C ATOM 625 CE LYS B 88 20.711 -12.293 13.150 1.00 37.17 C ATOM 626 NZ LYS B 88 19.499 -11.792 13.842 1.00 36.26 N ATOM 0 H LYS B 88 25.637 -14.426 13.136 1.00 29.62 H new ATOM 0 HA LYS B 88 24.662 -13.088 10.993 1.00 28.72 H new ATOM 0 HB2 LYS B 88 23.165 -13.519 12.791 1.00 30.78 H new ATOM 0 HB3 LYS B 88 24.023 -12.577 13.690 1.00 30.78 H new ATOM 0 HG2 LYS B 88 23.519 -10.770 12.216 1.00 32.52 H new ATOM 0 HG3 LYS B 88 22.591 -11.723 11.403 1.00 32.52 H new ATOM 0 HD2 LYS B 88 22.130 -11.172 14.137 1.00 32.29 H new ATOM 0 HD3 LYS B 88 21.421 -10.365 13.006 1.00 32.29 H new ATOM 0 HE2 LYS B 88 20.508 -12.498 12.224 1.00 37.17 H new ATOM 0 HE3 LYS B 88 21.017 -13.116 13.562 1.00 37.17 H new ATOM 0 HZ1 LYS B 88 18.803 -12.306 13.632 1.00 36.26 H new ATOM 0 HZ2 LYS B 88 19.629 -11.814 14.722 1.00 36.26 H new ATOM 0 HZ3 LYS B 88 19.336 -10.955 13.587 1.00 36.26 H new ATOM 627 N ASN B 89 26.210 -11.233 10.859 1.00 28.24 N ATOM 628 CA ASN B 89 27.138 -10.113 10.817 1.00 25.85 C ATOM 629 C ASN B 89 26.849 -9.177 9.645 1.00 37.15 C ATOM 630 O ASN B 89 27.533 -9.233 8.618 1.00 39.22 O ATOM 631 CB ASN B 89 28.586 -10.628 10.756 1.00 33.35 C ATOM 632 CG ASN B 89 29.608 -9.521 10.921 1.00 37.41 C ATOM 633 OD1 ASN B 89 29.251 -8.350 11.087 1.00 41.59 O ATOM 634 ND2 ASN B 89 30.889 -9.881 10.869 1.00 43.31 N ATOM 0 H ASN B 89 25.830 -11.412 10.109 1.00 28.24 H new ATOM 0 HA ASN B 89 27.018 -9.599 11.631 1.00 25.85 H new ATOM 0 HB2 ASN B 89 28.719 -11.292 11.451 1.00 33.35 H new ATOM 0 HB3 ASN B 89 28.731 -11.073 9.907 1.00 33.35 H new ATOM 0 HD21 ASN B 89 31.506 -9.288 10.952 1.00 43.31 H new ATOM 0 HD22 ASN B 89 31.099 -10.707 10.752 1.00 43.31 H new ATOM 635 N PHE B 90 25.843 -8.313 9.787 1.00 32.27 N ATOM 636 CA PHE B 90 25.460 -7.431 8.676 1.00 34.96 C ATOM 637 C PHE B 90 26.298 -6.156 8.620 1.00 33.83 C ATOM 638 O PHE B 90 26.736 -5.641 9.656 1.00 32.61 O ATOM 639 CB PHE B 90 23.978 -7.062 8.746 1.00 31.12 C ATOM 640 CG PHE B 90 23.049 -8.238 8.666 1.00 31.69 C ATOM 641 CD1 PHE B 90 22.940 -8.978 7.497 1.00 30.75 C ATOM 642 CD2 PHE B 90 22.259 -8.585 9.754 1.00 29.39 C ATOM 643 CE1 PHE B 90 22.077 -10.058 7.420 1.00 30.51 C ATOM 644 CE2 PHE B 90 21.390 -9.657 9.685 1.00 29.60 C ATOM 645 CZ PHE B 90 21.300 -10.400 8.509 1.00 34.83 C ATOM 0 H PHE B 90 25.376 -8.220 10.503 1.00 32.27 H new ATOM 0 HA PHE B 90 25.629 -7.936 7.865 1.00 34.96 H new ATOM 0 HB2 PHE B 90 23.812 -6.587 9.575 1.00 31.12 H new ATOM 0 HB3 PHE B 90 23.772 -6.450 8.022 1.00 31.12 H new ATOM 0 HD1 PHE B 90 23.453 -8.746 6.757 1.00 30.75 H new ATOM 0 HD2 PHE B 90 22.316 -8.090 10.539 1.00 29.39 H new ATOM 0 HE1 PHE B 90 22.021 -10.553 6.635 1.00 30.51 H new ATOM 0 HE2 PHE B 90 20.867 -9.882 10.420 1.00 29.60 H new ATOM 0 HZ PHE B 90 20.718 -11.124 8.458 1.00 34.83 H new ATOM 646 N THR B 91 26.532 -5.662 7.406 1.00 29.76 N ATOM 647 CA THR B 91 27.217 -4.383 7.215 1.00 32.28 C ATOM 648 C THR B 91 26.243 -3.334 6.685 1.00 31.95 C ATOM 649 O THR B 91 25.116 -3.660 6.307 1.00 27.99 O ATOM 650 CB THR B 91 28.380 -4.497 6.207 1.00 32.32 C ATOM 651 OG1 THR B 91 27.852 -4.678 4.881 1.00 41.82 O ATOM 652 CG2 THR B 91 29.260 -5.661 6.554 1.00 33.96 C ATOM 0 H THR B 91 26.301 -6.054 6.676 1.00 29.76 H new ATOM 0 HA THR B 91 27.568 -4.123 8.081 1.00 32.28 H new ATOM 0 HB THR B 91 28.905 -3.682 6.244 1.00 32.32 H new ATOM 0 HG1 THR B 91 28.486 -4.738 4.333 1.00 41.82 H new ATOM 0 HG21 THR B 91 29.986 -5.721 5.913 1.00 33.96 H new ATOM 0 HG22 THR B 91 29.625 -5.537 7.444 1.00 33.96 H new ATOM 0 HG23 THR B 91 28.739 -6.479 6.529 1.00 33.96 H new ATOM 653 N GLU B 92 26.692 -2.081 6.662 1.00 32.39 N ATOM 654 CA GLU B 92 25.919 -0.971 6.105 1.00 38.40 C ATOM 655 C GLU B 92 25.183 -1.331 4.817 1.00 38.44 C ATOM 656 O GLU B 92 24.014 -0.988 4.643 1.00 36.86 O ATOM 657 CB GLU B 92 26.825 0.233 5.825 1.00 33.37 C ATOM 658 CG GLU B 92 27.327 0.955 7.067 1.00 39.32 C ATOM 659 CD GLU B 92 28.476 0.225 7.735 1.00 37.13 C ATOM 660 OE1 GLU B 92 28.982 -0.755 7.148 1.00 39.54 O ATOM 661 OE2 GLU B 92 28.874 0.631 8.843 1.00 37.77 O ATOM 0 H GLU B 92 27.460 -1.849 6.972 1.00 32.39 H new ATOM 0 HA GLU B 92 25.255 -0.753 6.778 1.00 38.40 H new ATOM 0 HB2 GLU B 92 27.590 -0.067 5.309 1.00 33.37 H new ATOM 0 HB3 GLU B 92 26.340 0.865 5.272 1.00 33.37 H new ATOM 0 HG2 GLU B 92 27.613 1.850 6.825 1.00 39.32 H new ATOM 0 HG3 GLU B 92 26.597 1.052 7.699 1.00 39.32 H new ATOM 662 N ASN B 93 25.873 -2.012 3.912 1.00 34.76 N ATOM 663 CA ASN B 93 25.316 -2.276 2.590 1.00 42.60 C ATOM 664 C ASN B 93 24.395 -3.487 2.489 1.00 41.26 C ATOM 665 O ASN B 93 23.850 -3.762 1.417 1.00 32.93 O ATOM 666 CB ASN B 93 26.428 -2.350 1.541 1.00 43.88 C ATOM 667 CG ASN B 93 26.889 -0.976 1.097 1.00 57.28 C ATOM 668 OD1 ASN B 93 26.232 0.033 1.378 1.00 58.54 O ATOM 669 ND2 ASN B 93 28.019 -0.925 0.398 1.00 64.12 N ATOM 0 H ASN B 93 26.662 -2.329 4.041 1.00 34.76 H new ATOM 0 HA ASN B 93 24.738 -1.518 2.413 1.00 42.60 H new ATOM 0 HB2 ASN B 93 27.182 -2.840 1.905 1.00 43.88 H new ATOM 0 HB3 ASN B 93 26.111 -2.848 0.771 1.00 43.88 H new ATOM 0 HD21 ASN B 93 28.320 -0.168 0.122 1.00 64.12 H new ATOM 0 HD22 ASN B 93 28.449 -1.649 0.222 1.00 64.12 H new ATOM 670 N ASP B 94 24.213 -4.207 3.595 1.00 31.42 N ATOM 671 CA ASP B 94 23.252 -5.308 3.615 1.00 30.28 C ATOM 672 C ASP B 94 21.813 -4.825 3.872 1.00 34.98 C ATOM 673 O ASP B 94 20.841 -5.554 3.619 1.00 37.00 O ATOM 674 CB ASP B 94 23.656 -6.363 4.656 1.00 34.97 C ATOM 675 CG ASP B 94 24.947 -7.091 4.285 1.00 36.85 C ATOM 676 OD1 ASP B 94 25.214 -7.256 3.077 1.00 38.99 O ATOM 677 OD2 ASP B 94 25.698 -7.491 5.199 1.00 38.66 O ATOM 0 H ASP B 94 24.630 -4.077 4.336 1.00 31.42 H new ATOM 0 HA ASP B 94 23.267 -5.712 2.733 1.00 30.28 H new ATOM 0 HB2 ASP B 94 23.767 -5.935 5.519 1.00 34.97 H new ATOM 0 HB3 ASP B 94 22.940 -7.010 4.750 1.00 34.97 H new ATOM 678 N LEU B 95 21.679 -3.588 4.348 1.00 29.20 N ATOM 679 CA LEU B 95 20.424 -3.144 4.964 1.00 35.54 C ATOM 680 C LEU B 95 19.771 -1.894 4.376 1.00 32.34 C ATOM 681 O LEU B 95 20.419 -1.026 3.793 1.00 36.87 O ATOM 682 CB LEU B 95 20.636 -2.915 6.470 1.00 37.49 C ATOM 683 CG LEU B 95 21.452 -4.035 7.104 1.00 37.53 C ATOM 684 CD1 LEU B 95 21.852 -3.722 8.540 1.00 31.01 C ATOM 685 CD2 LEU B 95 20.669 -5.331 6.992 1.00 35.21 C ATOM 0 H LEU B 95 22.298 -2.992 4.325 1.00 29.20 H new ATOM 0 HA LEU B 95 19.807 -3.868 4.774 1.00 35.54 H new ATOM 0 HB2 LEU B 95 21.088 -2.068 6.608 1.00 37.49 H new ATOM 0 HB3 LEU B 95 19.775 -2.852 6.912 1.00 37.49 H new ATOM 0 HG LEU B 95 22.289 -4.127 6.623 1.00 37.53 H new ATOM 0 HD11 LEU B 95 22.368 -4.460 8.901 1.00 31.01 H new ATOM 0 HD12 LEU B 95 22.389 -2.914 8.558 1.00 31.01 H new ATOM 0 HD13 LEU B 95 21.055 -3.592 9.077 1.00 31.01 H new ATOM 0 HD21 LEU B 95 21.178 -6.053 7.393 1.00 35.21 H new ATOM 0 HD22 LEU B 95 19.822 -5.238 7.455 1.00 35.21 H new ATOM 0 HD23 LEU B 95 20.506 -5.531 6.057 1.00 35.21 H new ATOM 686 N LEU B 96 18.462 -1.827 4.566 1.00 29.48 N ATOM 687 CA LEU B 96 17.679 -0.639 4.303 1.00 34.14 C ATOM 688 C LEU B 96 16.908 -0.326 5.581 1.00 31.09 C ATOM 689 O LEU B 96 16.480 -1.241 6.296 1.00 28.20 O ATOM 690 CB LEU B 96 16.690 -0.907 3.167 1.00 34.92 C ATOM 691 CG LEU B 96 16.998 -0.365 1.772 1.00 43.66 C ATOM 692 CD1 LEU B 96 18.485 -0.175 1.545 1.00 44.06 C ATOM 693 CD2 LEU B 96 16.378 -1.270 0.725 1.00 43.40 C ATOM 0 H LEU B 96 17.996 -2.488 4.858 1.00 29.48 H new ATOM 0 HA LEU B 96 18.250 0.101 4.044 1.00 34.14 H new ATOM 0 HB2 LEU B 96 16.585 -1.868 3.091 1.00 34.92 H new ATOM 0 HB3 LEU B 96 15.830 -0.548 3.437 1.00 34.92 H new ATOM 0 HG LEU B 96 16.603 0.517 1.694 1.00 43.66 H new ATOM 0 HD11 LEU B 96 18.635 0.169 0.651 1.00 44.06 H new ATOM 0 HD12 LEU B 96 18.834 0.454 2.196 1.00 44.06 H new ATOM 0 HD13 LEU B 96 18.939 -1.027 1.643 1.00 44.06 H new ATOM 0 HD21 LEU B 96 16.575 -0.924 -0.160 1.00 43.40 H new ATOM 0 HD22 LEU B 96 16.745 -2.164 0.811 1.00 43.40 H new ATOM 0 HD23 LEU B 96 15.417 -1.302 0.853 1.00 43.40 H new ATOM 694 N VAL B 97 16.738 0.957 5.881 1.00 27.57 N ATOM 695 CA VAL B 97 15.785 1.332 6.916 1.00 33.56 C ATOM 696 C VAL B 97 14.523 1.877 6.259 1.00 27.64 C ATOM 697 O VAL B 97 14.585 2.623 5.280 1.00 27.73 O ATOM 698 CB VAL B 97 16.373 2.307 7.986 1.00 28.80 C ATOM 699 CG1 VAL B 97 17.647 1.742 8.551 1.00 33.38 C ATOM 700 CG2 VAL B 97 16.614 3.668 7.408 1.00 33.41 C ATOM 0 H VAL B 97 17.153 1.611 5.507 1.00 27.57 H new ATOM 0 HA VAL B 97 15.562 0.534 7.420 1.00 33.56 H new ATOM 0 HB VAL B 97 15.724 2.401 8.700 1.00 28.80 H new ATOM 0 HG11 VAL B 97 18.006 2.352 9.214 1.00 33.38 H new ATOM 0 HG12 VAL B 97 17.465 0.885 8.966 1.00 33.38 H new ATOM 0 HG13 VAL B 97 18.293 1.624 7.837 1.00 33.38 H new ATOM 0 HG21 VAL B 97 16.978 4.251 8.093 1.00 33.41 H new ATOM 0 HG22 VAL B 97 17.243 3.601 6.673 1.00 33.41 H new ATOM 0 HG23 VAL B 97 15.777 4.035 7.084 1.00 33.41 H new ATOM 701 N ARG B 98 13.377 1.456 6.778 1.00 23.21 N ATOM 702 CA ARG B 98 12.102 1.892 6.247 1.00 24.66 C ATOM 703 C ARG B 98 11.304 2.607 7.338 1.00 21.14 C ATOM 704 O ARG B 98 10.911 2.006 8.332 1.00 20.42 O ATOM 705 CB ARG B 98 11.344 0.704 5.650 1.00 20.72 C ATOM 706 CG ARG B 98 12.122 0.020 4.526 1.00 24.50 C ATOM 707 CD ARG B 98 11.439 -1.247 4.054 1.00 22.54 C ATOM 708 NE ARG B 98 10.179 -0.966 3.381 1.00 22.90 N ATOM 709 CZ ARG B 98 9.427 -1.895 2.803 1.00 28.02 C ATOM 710 NH1 ARG B 98 8.297 -1.549 2.199 1.00 25.14 N ATOM 711 NH2 ARG B 98 9.806 -3.173 2.841 1.00 23.87 N ATOM 0 H ARG B 98 13.320 0.914 7.443 1.00 23.21 H new ATOM 0 HA ARG B 98 12.245 2.527 5.528 1.00 24.66 H new ATOM 0 HB2 ARG B 98 11.157 0.059 6.350 1.00 20.72 H new ATOM 0 HB3 ARG B 98 10.488 1.008 5.309 1.00 20.72 H new ATOM 0 HG2 ARG B 98 12.217 0.633 3.780 1.00 24.50 H new ATOM 0 HG3 ARG B 98 13.017 -0.192 4.835 1.00 24.50 H new ATOM 0 HD2 ARG B 98 12.028 -1.726 3.450 1.00 22.54 H new ATOM 0 HD3 ARG B 98 11.277 -1.829 4.813 1.00 22.54 H new ATOM 0 HE ARG B 98 9.906 -0.151 3.356 1.00 22.90 H new ATOM 0 HH11 ARG B 98 8.053 -0.724 2.183 1.00 25.14 H new ATOM 0 HH12 ARG B 98 7.809 -2.149 1.824 1.00 25.14 H new ATOM 0 HH21 ARG B 98 10.536 -3.393 3.239 1.00 23.87 H new ATOM 0 HH22 ARG B 98 9.321 -3.777 2.467 1.00 23.87 H new ATOM 712 N ILE B 99 11.098 3.902 7.135 1.00 21.97 N ATOM 713 CA ILE B 99 10.498 4.769 8.125 1.00 24.26 C ATOM 714 C ILE B 99 9.091 5.198 7.724 1.00 24.68 C ATOM 715 O ILE B 99 8.837 5.510 6.557 1.00 22.95 O ATOM 716 CB ILE B 99 11.380 6.021 8.346 1.00 25.57 C ATOM 717 CG1 ILE B 99 12.860 5.641 8.243 1.00 25.09 C ATOM 718 CG2 ILE B 99 11.077 6.689 9.691 1.00 25.05 C ATOM 719 CD1 ILE B 99 13.813 6.788 8.555 1.00 29.15 C ATOM 0 H ILE B 99 11.308 4.304 6.404 1.00 21.97 H new ATOM 0 HA ILE B 99 10.434 4.265 8.951 1.00 24.26 H new ATOM 0 HB ILE B 99 11.174 6.667 7.652 1.00 25.57 H new ATOM 0 HG12 ILE B 99 13.040 4.908 8.852 1.00 25.09 H new ATOM 0 HG13 ILE B 99 13.040 5.317 7.347 1.00 25.09 H new ATOM 0 HG21 ILE B 99 11.644 7.468 9.800 1.00 25.05 H new ATOM 0 HG22 ILE B 99 10.146 6.961 9.715 1.00 25.05 H new ATOM 0 HG23 ILE B 99 11.249 6.061 10.410 1.00 25.05 H new ATOM 0 HD11 ILE B 99 14.729 6.480 8.471 1.00 29.15 H new ATOM 0 HD12 ILE B 99 13.659 7.515 7.932 1.00 29.15 H new ATOM 0 HD13 ILE B 99 13.659 7.100 9.460 1.00 29.15 H new ATOM 720 N GLY B 100 8.183 5.209 8.702 1.00 21.10 N ATOM 721 CA GLY B 100 6.842 5.739 8.508 1.00 20.76 C ATOM 722 C GLY B 100 5.854 4.671 8.094 1.00 17.69 C ATOM 723 O GLY B 100 4.807 4.981 7.548 1.00 21.37 O ATOM 0 H GLY B 100 8.332 4.909 9.494 1.00 21.10 H new ATOM 0 HA2 GLY B 100 6.539 6.155 9.330 1.00 20.76 H new ATOM 0 HA3 GLY B 100 6.866 6.433 7.831 1.00 20.76 H new ATOM 724 N LYS B 101 6.189 3.413 8.369 1.00 18.66 N ATOM 725 CA LYS B 101 5.393 2.278 7.917 1.00 19.85 C ATOM 726 C LYS B 101 4.281 1.874 8.871 1.00 22.06 C ATOM 727 O LYS B 101 4.362 2.094 10.096 1.00 18.15 O ATOM 728 CB LYS B 101 6.283 1.043 7.661 1.00 18.09 C ATOM 729 CG LYS B 101 7.255 1.173 6.502 1.00 19.24 C ATOM 730 CD LYS B 101 7.895 -0.191 6.175 1.00 21.58 C ATOM 731 CE LYS B 101 6.867 -1.243 5.691 1.00 25.74 C ATOM 732 NZ LYS B 101 5.831 -0.706 4.744 1.00 22.82 N ATOM 0 H LYS B 101 6.885 3.194 8.824 1.00 18.66 H new ATOM 0 HA LYS B 101 4.977 2.584 7.096 1.00 19.85 H new ATOM 0 HB2 LYS B 101 6.788 0.854 8.467 1.00 18.09 H new ATOM 0 HB3 LYS B 101 5.710 0.278 7.499 1.00 18.09 H new ATOM 0 HG2 LYS B 101 6.791 1.514 5.721 1.00 19.24 H new ATOM 0 HG3 LYS B 101 7.947 1.816 6.724 1.00 19.24 H new ATOM 0 HD2 LYS B 101 8.572 -0.069 5.491 1.00 21.58 H new ATOM 0 HD3 LYS B 101 8.347 -0.528 6.964 1.00 21.58 H new ATOM 0 HE2 LYS B 101 7.342 -1.968 5.256 1.00 25.74 H new ATOM 0 HE3 LYS B 101 6.419 -1.621 6.464 1.00 25.74 H new ATOM 0 HZ1 LYS B 101 5.447 -1.381 4.310 1.00 22.82 H new ATOM 0 HZ2 LYS B 101 5.213 -0.259 5.202 1.00 22.82 H new ATOM 0 HZ3 LYS B 101 6.219 -0.159 4.158 1.00 22.82 H new ATOM 733 N HIS B 102 3.267 1.225 8.300 1.00 18.77 N ATOM 734 CA HIS B 102 2.192 0.648 9.083 1.00 21.10 C ATOM 735 C HIS B 102 2.061 -0.823 8.729 1.00 23.82 C ATOM 736 O HIS B 102 2.249 -1.715 9.576 1.00 20.18 O ATOM 737 CB HIS B 102 0.875 1.379 8.804 1.00 19.49 C ATOM 738 CG HIS B 102 -0.260 0.905 9.651 1.00 24.17 C ATOM 739 ND1 HIS B 102 -0.290 1.082 11.019 1.00 22.02 N ATOM 740 CD2 HIS B 102 -1.401 0.251 9.328 1.00 19.86 C ATOM 741 CE1 HIS B 102 -1.403 0.557 11.502 1.00 19.55 C ATOM 742 NE2 HIS B 102 -2.096 0.054 10.497 1.00 22.02 N ATOM 0 H HIS B 102 3.188 1.110 7.451 1.00 18.77 H new ATOM 0 HA HIS B 102 2.394 0.740 10.027 1.00 21.10 H new ATOM 0 HB2 HIS B 102 1.004 2.329 8.950 1.00 19.49 H new ATOM 0 HB3 HIS B 102 0.642 1.265 7.869 1.00 19.49 H new ATOM 0 HD2 HIS B 102 -1.664 -0.014 8.476 1.00 19.86 H new ATOM 0 HE1 HIS B 102 -1.655 0.544 12.397 1.00 19.55 H new ATOM 0 HE2 HIS B 102 -2.860 -0.335 10.563 1.00 22.02 H new ATOM 743 N SER B 103 1.718 -1.067 7.468 1.00 21.84 N ATOM 744 CA SER B 103 1.668 -2.415 6.910 1.00 20.11 C ATOM 745 C SER B 103 3.072 -3.026 6.953 1.00 20.86 C ATOM 746 O SER B 103 4.055 -2.351 6.635 1.00 24.25 O ATOM 747 CB SER B 103 1.181 -2.339 5.454 1.00 23.47 C ATOM 748 OG SER B 103 1.352 -3.567 4.780 1.00 28.28 O ATOM 0 H SER B 103 1.506 -0.450 6.908 1.00 21.84 H new ATOM 0 HA SER B 103 1.059 -2.966 7.426 1.00 20.11 H new ATOM 0 HB2 SER B 103 0.244 -2.089 5.439 1.00 23.47 H new ATOM 0 HB3 SER B 103 1.668 -1.643 4.986 1.00 23.47 H new ATOM 0 HG SER B 103 0.756 -3.650 4.193 1.00 28.28 H new ATOM 749 N ARG B 104 3.165 -4.289 7.360 1.00 20.49 N ATOM 750 CA ARG B 104 4.440 -5.007 7.376 1.00 24.92 C ATOM 751 C ARG B 104 5.040 -5.248 5.975 1.00 28.54 C ATOM 752 O ARG B 104 6.231 -5.022 5.758 1.00 28.00 O ATOM 753 CB ARG B 104 4.275 -6.352 8.075 1.00 25.94 C ATOM 754 CG ARG B 104 5.539 -7.231 8.065 1.00 22.81 C ATOM 755 CD ARG B 104 5.322 -8.471 8.911 1.00 28.82 C ATOM 756 NE ARG B 104 4.240 -9.314 8.411 1.00 29.87 N ATOM 757 CZ ARG B 104 4.414 -10.344 7.581 1.00 40.88 C ATOM 758 NH1 ARG B 104 3.371 -11.064 7.169 1.00 40.01 N ATOM 759 NH2 ARG B 104 5.633 -10.660 7.160 1.00 38.57 N ATOM 0 H ARG B 104 2.495 -4.753 7.634 1.00 20.49 H new ATOM 0 HA ARG B 104 5.058 -4.434 7.857 1.00 24.92 H new ATOM 0 HB2 ARG B 104 4.010 -6.196 8.995 1.00 25.94 H new ATOM 0 HB3 ARG B 104 3.552 -6.839 7.650 1.00 25.94 H new ATOM 0 HG2 ARG B 104 5.756 -7.486 7.155 1.00 22.81 H new ATOM 0 HG3 ARG B 104 6.294 -6.727 8.406 1.00 22.81 H new ATOM 0 HD2 ARG B 104 6.143 -8.987 8.938 1.00 28.82 H new ATOM 0 HD3 ARG B 104 5.124 -8.205 9.823 1.00 28.82 H new ATOM 0 HE ARG B 104 3.439 -9.135 8.668 1.00 29.87 H new ATOM 0 HH11 ARG B 104 2.579 -10.866 7.438 1.00 40.01 H new ATOM 0 HH12 ARG B 104 3.490 -11.727 6.634 1.00 40.01 H new ATOM 0 HH21 ARG B 104 6.311 -10.201 7.422 1.00 38.57 H new ATOM 0 HH22 ARG B 104 5.744 -11.324 6.625 1.00 38.57 H new ATOM 760 N THR B 105 4.220 -5.709 5.032 1.00 23.44 N ATOM 761 CA THR B 105 4.735 -6.194 3.744 1.00 29.90 C ATOM 762 C THR B 105 4.548 -5.234 2.565 1.00 31.08 C ATOM 763 O THR B 105 5.355 -5.221 1.630 1.00 28.86 O ATOM 764 CB THR B 105 4.117 -7.547 3.381 1.00 31.04 C ATOM 765 OG1 THR B 105 2.694 -7.414 3.320 1.00 27.39 O ATOM 766 CG2 THR B 105 4.467 -8.582 4.433 1.00 33.50 C ATOM 0 H THR B 105 3.365 -5.751 5.114 1.00 23.44 H new ATOM 0 HA THR B 105 5.691 -6.274 3.886 1.00 29.90 H new ATOM 0 HB THR B 105 4.466 -7.832 2.522 1.00 31.04 H new ATOM 0 HG1 THR B 105 2.384 -7.362 4.099 1.00 27.39 H new ATOM 0 HG21 THR B 105 4.071 -9.434 4.193 1.00 33.50 H new ATOM 0 HG22 THR B 105 5.431 -8.677 4.485 1.00 33.50 H new ATOM 0 HG23 THR B 105 4.123 -8.297 5.294 1.00 33.50 H new ATOM 767 N ARG B 106 3.538 -4.376 2.638 1.00 24.40 N ATOM 768 CA ARG B 106 3.211 -3.434 1.572 1.00 31.61 C ATOM 769 C ARG B 106 4.260 -2.394 1.365 1.00 32.55 C ATOM 770 O ARG B 106 4.858 -1.971 2.278 1.00 29.31 O ATOM 771 CB ARG B 106 1.841 -2.756 1.747 1.00 34.29 C ATOM 0 H ARG B 106 3.014 -4.323 3.318 1.00 24.40 H new ATOM 0 HA ARG B 106 3.169 -3.989 0.777 1.00 31.61 H new ATOM 772 N TYR B 107 4.492 -1.995 0.138 1.00 32.06 N ATOM 773 CA TYR B 107 5.308 -0.812 -0.090 1.00 30.46 C ATOM 774 C TYR B 107 4.383 0.389 -0.012 1.00 32.47 C ATOM 775 O TYR B 107 3.536 0.602 -0.885 1.00 32.12 O ATOM 776 CB TYR B 107 6.022 -0.850 -1.438 1.00 31.95 C ATOM 777 CG TYR B 107 6.659 0.474 -1.770 1.00 28.01 C ATOM 778 CD1 TYR B 107 7.564 1.058 -0.901 1.00 30.47 C ATOM 779 CD2 TYR B 107 6.341 1.150 -2.937 1.00 33.42 C ATOM 780 CE1 TYR B 107 8.144 2.278 -1.183 1.00 33.34 C ATOM 781 CE2 TYR B 107 6.917 2.385 -3.234 1.00 30.87 C ATOM 782 CZ TYR B 107 7.813 2.943 -2.351 1.00 38.78 C ATOM 783 OH TYR B 107 8.400 4.158 -2.632 1.00 37.86 O ATOM 0 H TYR B 107 4.196 -2.381 -0.571 1.00 32.06 H new ATOM 0 HA TYR B 107 6.006 -0.766 0.582 1.00 30.46 H new ATOM 0 HB2 TYR B 107 6.702 -1.542 -1.425 1.00 31.95 H new ATOM 0 HB3 TYR B 107 5.389 -1.088 -2.133 1.00 31.95 H new ATOM 0 HD1 TYR B 107 7.786 0.620 -0.111 1.00 30.47 H new ATOM 0 HD2 TYR B 107 5.733 0.774 -3.532 1.00 33.42 H new ATOM 0 HE1 TYR B 107 8.755 2.652 -0.590 1.00 33.34 H new ATOM 0 HE2 TYR B 107 6.697 2.828 -4.022 1.00 30.87 H new ATOM 0 HH TYR B 107 8.111 4.446 -3.366 1.00 37.86 H new ATOM 784 N GLU B 108 4.525 1.169 1.050 1.00 30.32 N ATOM 785 CA GLU B 108 3.522 2.181 1.350 1.00 30.02 C ATOM 786 C GLU B 108 3.822 3.486 0.620 1.00 26.49 C ATOM 787 O GLU B 108 4.410 4.424 1.167 1.00 27.02 O ATOM 788 CB GLU B 108 3.346 2.312 2.860 1.00 22.41 C ATOM 789 CG GLU B 108 2.600 1.105 3.390 1.00 24.79 C ATOM 790 CD GLU B 108 2.666 0.971 4.904 1.00 28.19 C ATOM 791 OE1 GLU B 108 3.771 0.738 5.426 1.00 21.19 O ATOM 792 OE2 GLU B 108 1.604 1.087 5.557 1.00 24.35 O ATOM 0 H GLU B 108 5.183 1.131 1.602 1.00 30.32 H new ATOM 0 HA GLU B 108 2.658 1.904 1.008 1.00 30.02 H new ATOM 0 HB2 GLU B 108 4.212 2.384 3.291 1.00 22.41 H new ATOM 0 HB3 GLU B 108 2.857 3.123 3.069 1.00 22.41 H new ATOM 0 HG2 GLU B 108 1.671 1.162 3.117 1.00 24.79 H new ATOM 0 HG3 GLU B 108 2.966 0.303 2.985 1.00 24.79 H new ATOM 793 N ARG B 109 3.422 3.496 -0.648 1.00 26.66 N ATOM 794 CA ARG B 109 3.774 4.538 -1.604 1.00 30.54 C ATOM 795 C ARG B 109 3.285 5.895 -1.133 1.00 23.95 C ATOM 796 O ARG B 109 2.155 6.025 -0.689 1.00 24.04 O ATOM 797 CB ARG B 109 3.172 4.185 -2.976 1.00 31.00 C ATOM 798 CG ARG B 109 3.633 5.061 -4.123 1.00 30.71 C ATOM 799 CD ARG B 109 3.305 4.422 -5.495 1.00 30.58 C ATOM 800 NE ARG B 109 1.985 3.787 -5.531 1.00 34.07 N ATOM 801 CZ ARG B 109 0.894 4.336 -6.057 1.00 29.77 C ATOM 802 NH1 ARG B 109 -0.255 3.670 -6.028 1.00 28.19 N ATOM 803 NH2 ARG B 109 0.949 5.545 -6.610 1.00 30.79 N ATOM 0 H ARG B 109 2.925 2.880 -0.984 1.00 26.66 H new ATOM 0 HA ARG B 109 4.740 4.589 -1.680 1.00 30.54 H new ATOM 0 HB2 ARG B 109 3.391 3.263 -3.183 1.00 31.00 H new ATOM 0 HB3 ARG B 109 2.206 4.239 -2.914 1.00 31.00 H new ATOM 0 HG2 ARG B 109 3.206 5.930 -4.059 1.00 30.71 H new ATOM 0 HG3 ARG B 109 4.589 5.209 -4.054 1.00 30.71 H new ATOM 0 HD2 ARG B 109 3.349 5.105 -6.183 1.00 30.58 H new ATOM 0 HD3 ARG B 109 3.982 3.761 -5.708 1.00 30.58 H new ATOM 0 HE ARG B 109 1.910 3.002 -5.187 1.00 34.07 H new ATOM 0 HH11 ARG B 109 -0.290 2.889 -5.671 1.00 28.19 H new ATOM 0 HH12 ARG B 109 -0.964 4.020 -6.367 1.00 28.19 H new ATOM 0 HH21 ARG B 109 1.693 5.976 -6.629 1.00 30.79 H new ATOM 0 HH22 ARG B 109 0.241 5.896 -6.949 1.00 30.79 H new ATOM 804 N ASN B 110 4.161 6.888 -1.216 1.00 21.98 N ATOM 805 CA ASN B 110 3.895 8.251 -0.747 1.00 27.21 C ATOM 806 C ASN B 110 3.826 8.420 0.782 1.00 28.19 C ATOM 807 O ASN B 110 3.584 9.524 1.273 1.00 24.88 O ATOM 808 CB ASN B 110 2.619 8.834 -1.383 1.00 26.25 C ATOM 809 CG ASN B 110 2.731 9.023 -2.891 1.00 32.48 C ATOM 810 OD1 ASN B 110 3.745 8.685 -3.502 1.00 32.64 O ATOM 811 ND2 ASN B 110 1.665 9.553 -3.500 1.00 31.87 N ATOM 0 H ASN B 110 4.946 6.790 -1.554 1.00 21.98 H new ATOM 0 HA ASN B 110 4.674 8.749 -1.040 1.00 27.21 H new ATOM 0 HB2 ASN B 110 1.872 8.246 -1.191 1.00 26.25 H new ATOM 0 HB3 ASN B 110 2.420 9.689 -0.970 1.00 26.25 H new ATOM 0 HD21 ASN B 110 1.670 9.670 -4.352 1.00 31.87 H new ATOM 0 HD22 ASN B 110 0.974 9.777 -3.040 1.00 31.87 H new ATOM 812 N ILE B 111 4.018 7.335 1.527 1.00 26.04 N ATOM 813 CA ILE B 111 3.919 7.382 2.985 1.00 27.56 C ATOM 814 C ILE B 111 5.268 7.062 3.632 1.00 27.37 C ATOM 815 O ILE B 111 5.862 7.911 4.309 1.00 26.41 O ATOM 816 CB ILE B 111 2.793 6.443 3.515 1.00 25.39 C ATOM 817 CG1 ILE B 111 1.427 7.018 3.139 1.00 23.22 C ATOM 818 CG2 ILE B 111 2.884 6.279 5.038 1.00 22.09 C ATOM 819 CD1 ILE B 111 0.256 6.055 3.313 1.00 25.65 C ATOM 0 H ILE B 111 4.207 6.559 1.208 1.00 26.04 H new ATOM 0 HA ILE B 111 3.675 8.287 3.236 1.00 27.56 H new ATOM 0 HB ILE B 111 2.905 5.570 3.108 1.00 25.39 H new ATOM 0 HG12 ILE B 111 1.263 7.807 3.679 1.00 23.22 H new ATOM 0 HG13 ILE B 111 1.456 7.308 2.214 1.00 23.22 H new ATOM 0 HG21 ILE B 111 2.175 5.692 5.343 1.00 22.09 H new ATOM 0 HG22 ILE B 111 3.744 5.895 5.272 1.00 22.09 H new ATOM 0 HG23 ILE B 111 2.791 7.146 5.463 1.00 22.09 H new ATOM 0 HD11 ILE B 111 -0.568 6.497 3.054 1.00 25.65 H new ATOM 0 HD12 ILE B 111 0.393 5.274 2.754 1.00 25.65 H new ATOM 0 HD13 ILE B 111 0.197 5.781 4.242 1.00 25.65 H new ATOM 820 N GLU B 112 5.766 5.851 3.404 1.00 19.37 N ATOM 821 CA GLU B 112 7.092 5.495 3.905 1.00 26.80 C ATOM 822 C GLU B 112 8.271 6.135 3.166 1.00 27.58 C ATOM 823 O GLU B 112 8.198 6.489 1.979 1.00 24.98 O ATOM 824 CB GLU B 112 7.284 3.975 3.991 1.00 23.71 C ATOM 825 CG GLU B 112 7.076 3.199 2.697 1.00 23.66 C ATOM 826 CD GLU B 112 7.601 1.779 2.809 1.00 22.77 C ATOM 827 OE1 GLU B 112 8.819 1.626 3.023 1.00 26.53 O ATOM 828 OE2 GLU B 112 6.811 0.820 2.710 1.00 24.26 O ATOM 0 H GLU B 112 5.361 5.229 2.969 1.00 19.37 H new ATOM 0 HA GLU B 112 7.106 5.876 4.797 1.00 26.80 H new ATOM 0 HB2 GLU B 112 8.182 3.798 4.312 1.00 23.71 H new ATOM 0 HB3 GLU B 112 6.671 3.627 4.658 1.00 23.71 H new ATOM 0 HG2 GLU B 112 6.131 3.180 2.478 1.00 23.66 H new ATOM 0 HG3 GLU B 112 7.526 3.655 1.969 1.00 23.66 H new ATOM 829 N LYS B 113 9.356 6.308 3.910 1.00 22.45 N ATOM 830 CA LYS B 113 10.627 6.706 3.342 1.00 26.45 C ATOM 831 C LYS B 113 11.615 5.553 3.534 1.00 31.89 C ATOM 832 O LYS B 113 11.643 4.880 4.586 1.00 25.09 O ATOM 833 CB LYS B 113 11.136 7.988 3.997 1.00 23.66 C ATOM 834 CG LYS B 113 10.242 9.192 3.750 1.00 34.51 C ATOM 835 CD LYS B 113 10.198 9.543 2.254 1.00 41.02 C ATOM 836 CE LYS B 113 9.146 10.631 1.947 1.00 49.26 C ATOM 837 NZ LYS B 113 7.751 10.092 1.736 1.00 44.59 N ATOM 0 H LYS B 113 9.372 6.196 4.763 1.00 22.45 H new ATOM 0 HA LYS B 113 10.526 6.895 2.396 1.00 26.45 H new ATOM 0 HB2 LYS B 113 11.216 7.844 4.953 1.00 23.66 H new ATOM 0 HB3 LYS B 113 12.026 8.181 3.664 1.00 23.66 H new ATOM 0 HG2 LYS B 113 9.345 9.005 4.069 1.00 34.51 H new ATOM 0 HG3 LYS B 113 10.570 9.952 4.255 1.00 34.51 H new ATOM 0 HD2 LYS B 113 11.073 9.850 1.969 1.00 41.02 H new ATOM 0 HD3 LYS B 113 9.996 8.745 1.741 1.00 41.02 H new ATOM 0 HE2 LYS B 113 9.130 11.268 2.678 1.00 49.26 H new ATOM 0 HE3 LYS B 113 9.419 11.117 1.153 1.00 49.26 H new ATOM 0 HZ1 LYS B 113 7.195 10.765 1.564 1.00 44.59 H new ATOM 0 HZ2 LYS B 113 7.752 9.526 1.049 1.00 44.59 H new ATOM 0 HZ3 LYS B 113 7.483 9.667 2.470 1.00 44.59 H new ATOM 838 N ILE B 114 12.405 5.308 2.500 1.00 28.12 N ATOM 839 CA ILE B 114 13.404 4.251 2.556 1.00 34.26 C ATOM 840 C ILE B 114 14.765 4.928 2.578 1.00 33.47 C ATOM 841 O ILE B 114 14.976 5.925 1.893 1.00 35.95 O ATOM 842 CB ILE B 114 13.252 3.253 1.386 1.00 34.53 C ATOM 843 CG1 ILE B 114 11.869 2.589 1.445 1.00 33.23 C ATOM 844 CG2 ILE B 114 14.339 2.196 1.434 1.00 39.74 C ATOM 845 CD1 ILE B 114 11.650 1.445 0.458 1.00 37.27 C ATOM 0 H ILE B 114 12.380 5.741 1.757 1.00 28.12 H new ATOM 0 HA ILE B 114 13.291 3.713 3.355 1.00 34.26 H new ATOM 0 HB ILE B 114 13.339 3.741 0.552 1.00 34.53 H new ATOM 0 HG12 ILE B 114 11.726 2.253 2.344 1.00 33.23 H new ATOM 0 HG13 ILE B 114 11.194 3.267 1.286 1.00 33.23 H new ATOM 0 HG21 ILE B 114 14.226 1.581 0.693 1.00 39.74 H new ATOM 0 HG22 ILE B 114 15.208 2.622 1.370 1.00 39.74 H new ATOM 0 HG23 ILE B 114 14.279 1.708 2.270 1.00 39.74 H new ATOM 0 HD11 ILE B 114 10.754 1.090 0.568 1.00 37.27 H new ATOM 0 HD12 ILE B 114 11.758 1.774 -0.448 1.00 37.27 H new ATOM 0 HD13 ILE B 114 12.299 0.744 0.626 1.00 37.27 H new ATOM 846 N SER B 115 15.671 4.437 3.414 1.00 29.26 N ATOM 847 CA SER B 115 16.973 5.080 3.522 1.00 31.56 C ATOM 848 C SER B 115 18.098 4.077 3.517 1.00 35.98 C ATOM 849 O SER B 115 17.927 2.908 3.882 1.00 33.11 O ATOM 850 CB SER B 115 17.071 5.934 4.781 1.00 33.26 C ATOM 851 OG SER B 115 16.087 6.948 4.771 1.00 41.90 O ATOM 0 H SER B 115 15.557 3.749 3.917 1.00 29.26 H new ATOM 0 HA SER B 115 17.060 5.650 2.742 1.00 31.56 H new ATOM 0 HB2 SER B 115 16.959 5.376 5.566 1.00 33.26 H new ATOM 0 HB3 SER B 115 17.953 6.333 4.840 1.00 33.26 H new ATOM 0 HG SER B 115 16.152 7.409 5.470 1.00 41.90 H new ATOM 852 N MET B 116 19.261 4.546 3.095 1.00 40.33 N ATOM 853 CA MET B 116 20.448 3.725 3.158 1.00 39.19 C ATOM 854 C MET B 116 21.292 4.151 4.339 1.00 36.62 C ATOM 855 O MET B 116 21.177 5.287 4.847 1.00 32.51 O ATOM 856 CB MET B 116 21.239 3.813 1.856 1.00 40.55 C ATOM 857 CG MET B 116 20.599 3.038 0.721 1.00 46.07 C ATOM 858 SD MET B 116 21.519 3.266 -0.802 1.00 54.76 S ATOM 859 CE MET B 116 21.555 5.054 -0.876 1.00 46.15 C ATOM 0 H MET B 116 19.381 5.333 2.771 1.00 40.33 H new ATOM 0 HA MET B 116 20.188 2.798 3.277 1.00 39.19 H new ATOM 0 HB2 MET B 116 21.324 4.744 1.598 1.00 40.55 H new ATOM 0 HB3 MET B 116 22.136 3.477 2.005 1.00 40.55 H new ATOM 0 HG2 MET B 116 20.566 2.095 0.946 1.00 46.07 H new ATOM 0 HG3 MET B 116 19.683 3.333 0.598 1.00 46.07 H new ATOM 0 HE1 MET B 116 22.101 5.336 -1.627 1.00 46.15 H new ATOM 0 HE2 MET B 116 20.653 5.392 -0.988 1.00 46.15 H new ATOM 0 HE3 MET B 116 21.931 5.405 -0.054 1.00 46.15 H new ATOM 860 N LEU B 117 22.141 3.227 4.771 1.00 32.17 N ATOM 861 CA LEU B 117 22.988 3.451 5.925 1.00 33.21 C ATOM 862 C LEU B 117 24.328 3.979 5.499 1.00 34.00 C ATOM 863 O LEU B 117 24.942 3.466 4.559 1.00 32.41 O ATOM 864 CB LEU B 117 23.184 2.143 6.677 1.00 35.16 C ATOM 865 CG LEU B 117 21.833 1.575 7.066 1.00 34.95 C ATOM 866 CD1 LEU B 117 22.002 0.213 7.684 1.00 40.65 C ATOM 867 CD2 LEU B 117 21.195 2.557 8.023 1.00 37.27 C ATOM 0 H LEU B 117 22.240 2.456 4.403 1.00 32.17 H new ATOM 0 HA LEU B 117 22.559 4.103 6.501 1.00 33.21 H new ATOM 0 HB2 LEU B 117 23.665 1.509 6.122 1.00 35.16 H new ATOM 0 HB3 LEU B 117 23.723 2.292 7.469 1.00 35.16 H new ATOM 0 HG LEU B 117 21.261 1.458 6.292 1.00 34.95 H new ATOM 0 HD11 LEU B 117 21.133 -0.141 7.929 1.00 40.65 H new ATOM 0 HD12 LEU B 117 22.425 -0.382 7.045 1.00 40.65 H new ATOM 0 HD13 LEU B 117 22.557 0.284 8.476 1.00 40.65 H new ATOM 0 HD21 LEU B 117 20.325 2.225 8.295 1.00 37.27 H new ATOM 0 HD22 LEU B 117 21.760 2.661 8.805 1.00 37.27 H new ATOM 0 HD23 LEU B 117 21.091 3.416 7.584 1.00 37.27 H new ATOM 868 N GLU B 118 24.776 5.008 6.201 1.00 31.08 N ATOM 869 CA GLU B 118 26.122 5.502 6.030 1.00 29.25 C ATOM 870 C GLU B 118 27.095 4.743 6.945 1.00 35.78 C ATOM 871 O GLU B 118 28.157 4.299 6.498 1.00 33.36 O ATOM 872 CB GLU B 118 26.172 6.998 6.307 1.00 30.11 C ATOM 873 CG GLU B 118 27.575 7.537 6.450 1.00 38.68 C ATOM 874 CD GLU B 118 27.612 9.040 6.402 1.00 53.77 C ATOM 875 OE1 GLU B 118 27.147 9.605 5.384 1.00 57.76 O ATOM 876 OE2 GLU B 118 28.103 9.656 7.377 1.00 59.72 O ATOM 0 H GLU B 118 24.310 5.434 6.785 1.00 31.08 H new ATOM 0 HA GLU B 118 26.395 5.352 5.111 1.00 29.25 H new ATOM 0 HB2 GLU B 118 25.724 7.468 5.586 1.00 30.11 H new ATOM 0 HB3 GLU B 118 25.676 7.186 7.119 1.00 30.11 H new ATOM 0 HG2 GLU B 118 27.953 7.232 7.290 1.00 38.68 H new ATOM 0 HG3 GLU B 118 28.132 7.178 5.741 1.00 38.68 H new ATOM 877 N LYS B 119 26.736 4.580 8.218 1.00 32.61 N ATOM 878 CA LYS B 119 27.639 3.933 9.172 1.00 32.55 C ATOM 879 C LYS B 119 26.910 3.290 10.359 1.00 33.97 C ATOM 880 O LYS B 119 26.033 3.898 10.966 1.00 34.84 O ATOM 881 CB LYS B 119 28.656 4.954 9.694 1.00 33.97 C ATOM 882 CG LYS B 119 30.117 4.497 9.640 1.00 40.30 C ATOM 883 CD LYS B 119 30.333 3.131 10.269 1.00 44.91 C ATOM 884 CE LYS B 119 31.746 2.607 9.994 1.00 53.93 C ATOM 885 NZ LYS B 119 31.971 1.246 10.577 1.00 53.43 N ATOM 0 H LYS B 119 25.983 4.833 8.547 1.00 32.61 H new ATOM 0 HA LYS B 119 28.084 3.217 8.691 1.00 32.55 H new ATOM 0 HB2 LYS B 119 28.567 5.771 9.179 1.00 33.97 H new ATOM 0 HB3 LYS B 119 28.433 5.172 10.612 1.00 33.97 H new ATOM 0 HG2 LYS B 119 30.409 4.472 8.715 1.00 40.30 H new ATOM 0 HG3 LYS B 119 30.672 5.149 10.096 1.00 40.30 H new ATOM 0 HD2 LYS B 119 30.188 3.187 11.226 1.00 44.91 H new ATOM 0 HD3 LYS B 119 29.680 2.505 9.919 1.00 44.91 H new ATOM 0 HE2 LYS B 119 31.896 2.575 9.036 1.00 53.93 H new ATOM 0 HE3 LYS B 119 32.396 3.226 10.363 1.00 53.93 H new ATOM 0 HZ1 LYS B 119 32.800 0.979 10.396 1.00 53.43 H new ATOM 0 HZ2 LYS B 119 31.856 1.278 11.459 1.00 53.43 H new ATOM 0 HZ3 LYS B 119 31.391 0.672 10.223 1.00 53.43 H new ATOM 886 N ILE B 120 27.298 2.065 10.691 1.00 32.60 N ATOM 887 CA ILE B 120 26.789 1.348 11.861 1.00 32.63 C ATOM 888 C ILE B 120 27.814 1.415 12.993 1.00 30.61 C ATOM 889 O ILE B 120 29.007 1.279 12.758 1.00 29.98 O ATOM 890 CB ILE B 120 26.552 -0.141 11.531 1.00 31.21 C ATOM 891 CG1 ILE B 120 25.289 -0.331 10.689 1.00 32.24 C ATOM 892 CG2 ILE B 120 26.472 -0.973 12.801 1.00 33.60 C ATOM 893 CD1 ILE B 120 25.080 -1.772 10.233 1.00 35.29 C ATOM 0 H ILE B 120 27.874 1.617 10.237 1.00 32.60 H new ATOM 0 HA ILE B 120 25.953 1.764 12.124 1.00 32.63 H new ATOM 0 HB ILE B 120 27.310 -0.448 11.009 1.00 31.21 H new ATOM 0 HG12 ILE B 120 24.518 -0.046 11.204 1.00 32.24 H new ATOM 0 HG13 ILE B 120 25.338 0.245 9.910 1.00 32.24 H new ATOM 0 HG21 ILE B 120 26.323 -1.903 12.570 1.00 33.60 H new ATOM 0 HG22 ILE B 120 27.303 -0.892 13.294 1.00 33.60 H new ATOM 0 HG23 ILE B 120 25.738 -0.655 13.350 1.00 33.60 H new ATOM 0 HD11 ILE B 120 24.268 -1.830 9.706 1.00 35.29 H new ATOM 0 HD12 ILE B 120 25.836 -2.054 9.694 1.00 35.29 H new ATOM 0 HD13 ILE B 120 25.004 -2.349 11.009 1.00 35.29 H new ATOM 894 N TYR B 121 27.349 1.631 14.219 1.00 31.31 N ATOM 895 CA TYR B 121 28.222 1.622 15.392 1.00 23.97 C ATOM 896 C TYR B 121 27.658 0.670 16.438 1.00 24.82 C ATOM 897 O TYR B 121 26.536 0.849 16.905 1.00 25.60 O ATOM 898 CB TYR B 121 28.347 3.021 15.989 1.00 25.15 C ATOM 899 CG TYR B 121 28.838 4.079 15.023 1.00 31.07 C ATOM 900 CD1 TYR B 121 27.940 4.856 14.306 1.00 33.14 C ATOM 901 CD2 TYR B 121 30.196 4.296 14.824 1.00 32.96 C ATOM 902 CE1 TYR B 121 28.376 5.822 13.418 1.00 37.45 C ATOM 903 CE2 TYR B 121 30.644 5.263 13.940 1.00 42.17 C ATOM 904 CZ TYR B 121 29.725 6.025 13.241 1.00 41.98 C ATOM 905 OH TYR B 121 30.144 6.986 12.350 1.00 49.25 O ATOM 0 H TYR B 121 26.522 1.787 14.396 1.00 31.31 H new ATOM 0 HA TYR B 121 29.104 1.326 15.117 1.00 23.97 H new ATOM 0 HB2 TYR B 121 27.481 3.291 16.333 1.00 25.15 H new ATOM 0 HB3 TYR B 121 28.954 2.984 16.745 1.00 25.15 H new ATOM 0 HD1 TYR B 121 27.027 4.725 14.425 1.00 33.14 H new ATOM 0 HD2 TYR B 121 30.814 3.783 15.292 1.00 32.96 H new ATOM 0 HE1 TYR B 121 27.760 6.332 12.943 1.00 37.45 H new ATOM 0 HE2 TYR B 121 31.556 5.399 13.817 1.00 42.17 H new ATOM 0 HH TYR B 121 30.701 7.491 12.724 1.00 49.25 H new ATOM 906 N ILE B 122 28.433 -0.344 16.805 1.00 24.68 N ATOM 907 CA ILE B 122 28.021 -1.304 17.822 1.00 20.13 C ATOM 908 C ILE B 122 28.721 -0.914 19.118 1.00 27.15 C ATOM 909 O ILE B 122 29.871 -0.472 19.089 1.00 24.71 O ATOM 910 CB ILE B 122 28.469 -2.717 17.452 1.00 18.23 C ATOM 911 CG1 ILE B 122 28.153 -3.009 15.980 1.00 29.48 C ATOM 912 CG2 ILE B 122 27.851 -3.746 18.372 1.00 18.37 C ATOM 913 CD1 ILE B 122 26.717 -3.307 15.680 1.00 25.81 C ATOM 0 H ILE B 122 29.211 -0.495 16.472 1.00 24.68 H new ATOM 0 HA ILE B 122 27.055 -1.294 17.905 1.00 20.13 H new ATOM 0 HB ILE B 122 29.430 -2.774 17.568 1.00 18.23 H new ATOM 0 HG12 ILE B 122 28.427 -2.246 15.448 1.00 29.48 H new ATOM 0 HG13 ILE B 122 28.691 -3.763 15.693 1.00 29.48 H new ATOM 0 HG21 ILE B 122 28.151 -4.632 18.115 1.00 18.37 H new ATOM 0 HG22 ILE B 122 28.120 -3.566 19.286 1.00 18.37 H new ATOM 0 HG23 ILE B 122 26.884 -3.701 18.305 1.00 18.37 H new ATOM 0 HD11 ILE B 122 26.613 -3.478 14.731 1.00 25.81 H new ATOM 0 HD12 ILE B 122 26.437 -4.089 16.181 1.00 25.81 H new ATOM 0 HD13 ILE B 122 26.169 -2.548 15.933 1.00 25.81 H new ATOM 914 N HIS B 123 28.057 -1.068 20.258 1.00 21.74 N ATOM 915 CA HIS B 123 28.748 -0.753 21.503 1.00 21.08 C ATOM 916 C HIS B 123 29.999 -1.617 21.593 1.00 22.16 C ATOM 917 O HIS B 123 29.943 -2.823 21.344 1.00 17.91 O ATOM 918 CB HIS B 123 27.861 -0.968 22.730 1.00 22.48 C ATOM 919 CG HIS B 123 28.415 -0.360 23.982 1.00 24.83 C ATOM 920 ND1 HIS B 123 29.528 -0.860 24.622 1.00 25.22 N ATOM 921 CD2 HIS B 123 28.015 0.710 24.709 1.00 26.36 C ATOM 922 CE1 HIS B 123 29.786 -0.131 25.693 1.00 23.58 C ATOM 923 NE2 HIS B 123 28.879 0.825 25.773 1.00 24.83 N ATOM 0 H HIS B 123 27.245 -1.340 20.334 1.00 21.74 H new ATOM 0 HA HIS B 123 28.985 0.188 21.495 1.00 21.08 H new ATOM 0 HB2 HIS B 123 26.984 -0.591 22.556 1.00 22.48 H new ATOM 0 HB3 HIS B 123 27.738 -1.920 22.868 1.00 22.48 H new ATOM 0 HD2 HIS B 123 27.291 1.264 24.524 1.00 26.36 H new ATOM 0 HE1 HIS B 123 30.487 -0.268 26.289 1.00 23.58 H new ATOM 0 HE2 HIS B 123 28.835 1.422 26.390 1.00 24.83 H new ATOM 924 N PRO B 124 31.142 -0.993 21.928 1.00 22.65 N ATOM 925 CA PRO B 124 32.427 -1.685 22.072 1.00 27.56 C ATOM 926 C PRO B 124 32.374 -2.884 23.020 1.00 26.67 C ATOM 927 O PRO B 124 33.102 -3.842 22.798 1.00 21.90 O ATOM 928 CB PRO B 124 33.355 -0.588 22.637 1.00 27.59 C ATOM 929 CG PRO B 124 32.428 0.547 23.034 1.00 30.56 C ATOM 930 CD PRO B 124 31.311 0.461 22.062 1.00 25.57 C ATOM 0 HA PRO B 124 32.721 -2.063 21.229 1.00 27.56 H new ATOM 0 HB2 PRO B 124 33.859 -0.913 23.400 1.00 27.59 H new ATOM 0 HB3 PRO B 124 34.000 -0.298 21.973 1.00 27.59 H new ATOM 0 HG2 PRO B 124 32.113 0.445 23.946 1.00 30.56 H new ATOM 0 HG3 PRO B 124 32.877 1.405 22.983 1.00 30.56 H new ATOM 0 HD2 PRO B 124 30.507 0.892 22.392 1.00 25.57 H new ATOM 0 HD3 PRO B 124 31.531 0.881 21.216 1.00 25.57 H new ATOM 931 N ARG B 125 31.521 -2.845 24.039 1.00 21.06 N ATOM 932 CA ARG B 125 31.541 -3.895 25.061 1.00 25.77 C ATOM 933 C ARG B 125 30.267 -4.726 25.047 1.00 22.91 C ATOM 934 O ARG B 125 29.914 -5.379 26.026 1.00 23.44 O ATOM 935 CB ARG B 125 31.785 -3.289 26.444 1.00 24.98 C ATOM 936 CG ARG B 125 33.034 -2.407 26.495 1.00 27.14 C ATOM 937 CD ARG B 125 33.311 -1.895 27.907 1.00 32.81 C ATOM 938 NE ARG B 125 33.656 -2.995 28.805 1.00 35.67 N ATOM 939 CZ ARG B 125 33.556 -2.944 30.131 1.00 38.92 C ATOM 940 NH1 ARG B 125 33.888 -4.000 30.866 1.00 31.40 N ATOM 941 NH2 ARG B 125 33.105 -1.844 30.721 1.00 37.26 N ATOM 0 H ARG B 125 30.931 -2.231 24.159 1.00 21.06 H new ATOM 0 HA ARG B 125 32.274 -4.495 24.852 1.00 25.77 H new ATOM 0 HB2 ARG B 125 31.012 -2.763 26.703 1.00 24.98 H new ATOM 0 HB3 ARG B 125 31.872 -4.003 27.094 1.00 24.98 H new ATOM 0 HG2 ARG B 125 33.799 -2.912 26.178 1.00 27.14 H new ATOM 0 HG3 ARG B 125 32.923 -1.654 25.894 1.00 27.14 H new ATOM 0 HD2 ARG B 125 34.037 -1.252 27.885 1.00 32.81 H new ATOM 0 HD3 ARG B 125 32.530 -1.430 28.245 1.00 32.81 H new ATOM 0 HE ARG B 125 33.943 -3.725 28.453 1.00 35.67 H new ATOM 0 HH11 ARG B 125 34.168 -4.718 30.485 1.00 31.40 H new ATOM 0 HH12 ARG B 125 33.823 -3.965 31.723 1.00 31.40 H new ATOM 0 HH21 ARG B 125 32.877 -1.164 30.246 1.00 37.26 H new ATOM 0 HH22 ARG B 125 33.040 -1.811 31.578 1.00 37.26 H new ATOM 942 N TYR B 126 29.567 -4.662 23.924 1.00 23.69 N ATOM 943 CA TYR B 126 28.487 -5.585 23.631 1.00 19.85 C ATOM 944 C TYR B 126 28.938 -7.013 23.933 1.00 21.17 C ATOM 945 O TYR B 126 29.898 -7.501 23.344 1.00 22.88 O ATOM 946 CB TYR B 126 28.100 -5.421 22.164 1.00 19.28 C ATOM 947 CG TYR B 126 27.197 -6.493 21.602 1.00 18.18 C ATOM 948 CD1 TYR B 126 26.128 -6.997 22.335 1.00 15.87 C ATOM 949 CD2 TYR B 126 27.384 -6.963 20.305 1.00 16.94 C ATOM 950 CE1 TYR B 126 25.296 -7.969 21.804 1.00 16.75 C ATOM 951 CE2 TYR B 126 26.563 -7.932 19.774 1.00 17.56 C ATOM 952 CZ TYR B 126 25.519 -8.420 20.506 1.00 15.98 C ATOM 953 OH TYR B 126 24.722 -9.391 19.952 1.00 20.09 O ATOM 0 H TYR B 126 29.707 -4.078 23.308 1.00 23.69 H new ATOM 0 HA TYR B 126 27.713 -5.397 24.184 1.00 19.85 H new ATOM 0 HB2 TYR B 126 27.662 -4.562 22.056 1.00 19.28 H new ATOM 0 HB3 TYR B 126 28.912 -5.394 21.633 1.00 19.28 H new ATOM 0 HD1 TYR B 126 25.969 -6.677 23.194 1.00 15.87 H new ATOM 0 HD2 TYR B 126 28.075 -6.616 19.788 1.00 16.94 H new ATOM 0 HE1 TYR B 126 24.596 -8.316 22.309 1.00 16.75 H new ATOM 0 HE2 TYR B 126 26.720 -8.255 18.916 1.00 17.56 H new ATOM 0 HH TYR B 126 24.924 -9.492 19.143 1.00 20.09 H new ATOM 954 N ASN B 127 28.246 -7.679 24.851 1.00 19.06 N ATOM 955 CA ASN B 127 28.605 -9.042 25.236 1.00 20.36 C ATOM 956 C ASN B 127 27.735 -10.095 24.549 1.00 21.66 C ATOM 957 O ASN B 127 26.814 -10.646 25.156 1.00 22.16 O ATOM 958 CB ASN B 127 28.532 -9.206 26.758 1.00 21.22 C ATOM 959 CG ASN B 127 29.227 -10.488 27.256 1.00 29.67 C ATOM 960 OD1 ASN B 127 29.455 -11.423 26.486 1.00 25.91 O ATOM 961 ND2 ASN B 127 29.561 -10.527 28.558 1.00 23.04 N ATOM 0 H ASN B 127 27.563 -7.360 25.265 1.00 19.06 H new ATOM 0 HA ASN B 127 29.517 -9.187 24.940 1.00 20.36 H new ATOM 0 HB2 ASN B 127 28.942 -8.436 27.182 1.00 21.22 H new ATOM 0 HB3 ASN B 127 27.602 -9.220 27.033 1.00 21.22 H new ATOM 0 HD21 ASN B 127 29.949 -11.223 28.882 1.00 23.04 H new ATOM 0 HD22 ASN B 127 29.387 -9.856 29.067 1.00 23.04 H new ATOM 962 N TRP B 128 28.019 -10.375 23.282 1.00 20.10 N ATOM 963 CA TRP B 128 27.255 -11.390 22.563 1.00 19.12 C ATOM 964 C TRP B 128 27.631 -12.794 22.995 1.00 25.16 C ATOM 965 O TRP B 128 26.903 -13.758 22.718 1.00 27.35 O ATOM 966 CB TRP B 128 27.465 -11.261 21.063 1.00 21.14 C ATOM 967 CG TRP B 128 28.903 -11.257 20.630 1.00 22.62 C ATOM 968 CD1 TRP B 128 29.671 -10.161 20.353 1.00 21.77 C ATOM 969 CD2 TRP B 128 29.741 -12.403 20.403 1.00 22.93 C ATOM 970 NE1 TRP B 128 30.932 -10.551 19.977 1.00 22.51 N ATOM 971 CE2 TRP B 128 30.999 -11.921 19.986 1.00 25.90 C ATOM 972 CE3 TRP B 128 29.547 -13.786 20.513 1.00 21.74 C ATOM 973 CZ2 TRP B 128 32.065 -12.773 19.680 1.00 31.43 C ATOM 974 CZ3 TRP B 128 30.602 -14.636 20.204 1.00 25.27 C ATOM 975 CH2 TRP B 128 31.850 -14.124 19.797 1.00 29.25 C ATOM 0 H TRP B 128 28.641 -9.995 22.825 1.00 20.10 H new ATOM 0 HA TRP B 128 26.321 -11.240 22.778 1.00 19.12 H new ATOM 0 HB2 TRP B 128 27.008 -11.994 20.620 1.00 21.14 H new ATOM 0 HB3 TRP B 128 27.046 -10.441 20.759 1.00 21.14 H new ATOM 0 HD1 TRP B 128 29.381 -9.279 20.411 1.00 21.77 H new ATOM 0 HE1 TRP B 128 31.577 -10.021 19.769 1.00 22.51 H new ATOM 0 HE3 TRP B 128 28.727 -14.129 20.788 1.00 21.74 H new ATOM 0 HZ2 TRP B 128 32.888 -12.437 19.408 1.00 31.43 H new ATOM 0 HZ3 TRP B 128 30.483 -15.556 20.267 1.00 25.27 H new ATOM 0 HH2 TRP B 128 32.543 -14.714 19.604 1.00 29.25 H new ATOM 976 N ARG B 129 28.770 -12.906 23.671 1.00 22.52 N ATOM 977 CA ARG B 129 29.298 -14.206 24.077 1.00 28.94 C ATOM 978 C ARG B 129 28.521 -14.778 25.222 1.00 27.10 C ATOM 979 O ARG B 129 28.373 -15.990 25.326 1.00 25.73 O ATOM 980 CB ARG B 129 30.761 -14.101 24.511 1.00 26.95 C ATOM 981 CG ARG B 129 31.725 -14.037 23.369 1.00 30.23 C ATOM 982 CD ARG B 129 33.142 -14.079 23.893 1.00 36.86 C ATOM 983 NE ARG B 129 34.074 -14.266 22.791 1.00 44.42 N ATOM 984 CZ ARG B 129 34.427 -15.454 22.305 1.00 39.33 C ATOM 985 NH1 ARG B 129 35.288 -15.503 21.299 1.00 44.80 N ATOM 986 NH2 ARG B 129 33.941 -16.586 22.831 1.00 26.45 N ATOM 0 H ARG B 129 29.256 -12.237 23.906 1.00 22.52 H new ATOM 0 HA ARG B 129 29.222 -14.785 23.303 1.00 28.94 H new ATOM 0 HB2 ARG B 129 30.871 -13.310 25.061 1.00 26.95 H new ATOM 0 HB3 ARG B 129 30.981 -14.865 25.067 1.00 26.95 H new ATOM 0 HG2 ARG B 129 31.573 -14.780 22.764 1.00 30.23 H new ATOM 0 HG3 ARG B 129 31.583 -13.223 22.860 1.00 30.23 H new ATOM 0 HD2 ARG B 129 33.346 -13.255 24.363 1.00 36.86 H new ATOM 0 HD3 ARG B 129 33.237 -14.802 24.533 1.00 36.86 H new ATOM 0 HE ARG B 129 34.418 -13.565 22.431 1.00 44.42 H new ATOM 0 HH11 ARG B 129 35.609 -14.775 20.972 1.00 44.80 H new ATOM 0 HH12 ARG B 129 35.526 -16.263 20.974 1.00 44.80 H new ATOM 0 HH21 ARG B 129 33.392 -16.552 23.492 1.00 26.45 H new ATOM 0 HH22 ARG B 129 34.177 -17.347 22.507 1.00 26.45 H new ATOM 987 N GLU B 130 28.041 -13.907 26.097 1.00 26.41 N ATOM 988 CA GLU B 130 27.429 -14.374 27.335 1.00 26.36 C ATOM 989 C GLU B 130 25.925 -14.068 27.447 1.00 29.07 C ATOM 990 O GLU B 130 25.104 -14.989 27.423 1.00 25.86 O ATOM 991 CB GLU B 130 28.175 -13.797 28.542 1.00 30.05 C ATOM 992 CG GLU B 130 27.846 -14.501 29.844 1.00 30.96 C ATOM 993 CD GLU B 130 28.325 -13.729 31.072 1.00 41.33 C ATOM 994 OE1 GLU B 130 29.254 -12.888 30.945 1.00 40.36 O ATOM 995 OE2 GLU B 130 27.765 -13.974 32.169 1.00 40.87 O ATOM 0 H GLU B 130 28.058 -13.053 25.998 1.00 26.41 H new ATOM 0 HA GLU B 130 27.505 -15.341 27.323 1.00 26.36 H new ATOM 0 HB2 GLU B 130 29.130 -13.856 28.382 1.00 30.05 H new ATOM 0 HB3 GLU B 130 27.959 -12.855 28.627 1.00 30.05 H new ATOM 0 HG2 GLU B 130 26.887 -14.631 29.903 1.00 30.96 H new ATOM 0 HG3 GLU B 130 28.252 -15.382 29.842 1.00 30.96 H new ATOM 996 N ASN B 131 25.562 -12.785 27.541 1.00 25.11 N ATOM 997 CA ASN B 131 24.207 -12.420 27.978 1.00 22.27 C ATOM 998 C ASN B 131 23.586 -11.210 27.273 1.00 22.40 C ATOM 999 O ASN B 131 22.612 -10.648 27.772 1.00 17.16 O ATOM 1000 CB ASN B 131 24.221 -12.165 29.491 1.00 17.82 C ATOM 1001 CG ASN B 131 25.245 -11.107 29.884 1.00 20.34 C ATOM 1002 OD1 ASN B 131 26.002 -10.619 29.042 1.00 19.81 O ATOM 1003 ND2 ASN B 131 25.276 -10.754 31.152 1.00 20.55 N ATOM 0 H ASN B 131 26.075 -12.119 27.360 1.00 25.11 H new ATOM 0 HA ASN B 131 23.647 -13.174 27.735 1.00 22.27 H new ATOM 0 HB2 ASN B 131 23.339 -11.882 29.778 1.00 17.82 H new ATOM 0 HB3 ASN B 131 24.419 -12.993 29.956 1.00 17.82 H new ATOM 0 HD21 ASN B 131 25.839 -10.162 31.420 1.00 20.55 H new ATOM 0 HD22 ASN B 131 24.733 -11.115 31.712 1.00 20.55 H new ATOM 1004 N LEU B 132 24.149 -10.813 26.130 1.00 21.59 N ATOM 1005 CA LEU B 132 23.658 -9.653 25.367 1.00 25.06 C ATOM 1006 C LEU B 132 23.716 -8.346 26.177 1.00 24.36 C ATOM 1007 O LEU B 132 22.939 -7.394 25.946 1.00 20.70 O ATOM 1008 CB LEU B 132 22.243 -9.880 24.803 1.00 17.00 C ATOM 1009 CG LEU B 132 22.031 -11.056 23.841 1.00 24.43 C ATOM 1010 CD1 LEU B 132 20.719 -10.894 23.045 1.00 19.25 C ATOM 1011 CD2 LEU B 132 23.207 -11.229 22.905 1.00 19.02 C ATOM 0 H LEU B 132 24.826 -11.206 25.773 1.00 21.59 H new ATOM 0 HA LEU B 132 24.264 -9.558 24.616 1.00 25.06 H new ATOM 0 HB2 LEU B 132 21.639 -9.997 25.553 1.00 17.00 H new ATOM 0 HB3 LEU B 132 21.972 -9.069 24.345 1.00 17.00 H new ATOM 0 HG LEU B 132 21.962 -11.860 24.380 1.00 24.43 H new ATOM 0 HD11 LEU B 132 20.609 -11.649 22.446 1.00 19.25 H new ATOM 0 HD12 LEU B 132 19.970 -10.858 23.660 1.00 19.25 H new ATOM 0 HD13 LEU B 132 20.753 -10.074 22.529 1.00 19.25 H new ATOM 0 HD21 LEU B 132 23.041 -11.979 22.312 1.00 19.02 H new ATOM 0 HD22 LEU B 132 23.325 -10.422 22.380 1.00 19.02 H new ATOM 0 HD23 LEU B 132 24.010 -11.398 23.422 1.00 19.02 H new ATOM 1012 N ASP B 133 24.633 -8.310 27.133 1.00 20.40 N ATOM 1013 CA ASP B 133 24.906 -7.092 27.890 1.00 20.01 C ATOM 1014 C ASP B 133 25.311 -5.983 26.920 1.00 21.49 C ATOM 1015 O ASP B 133 26.087 -6.220 25.981 1.00 19.64 O ATOM 1016 CB ASP B 133 26.042 -7.358 28.884 1.00 20.71 C ATOM 1017 CG ASP B 133 26.205 -6.240 29.908 1.00 25.72 C ATOM 1018 OD1 ASP B 133 25.218 -5.547 30.203 1.00 21.01 O ATOM 1019 OD2 ASP B 133 27.328 -6.054 30.411 1.00 29.67 O ATOM 0 H ASP B 133 25.114 -8.985 27.362 1.00 20.40 H new ATOM 0 HA ASP B 133 24.114 -6.819 28.378 1.00 20.01 H new ATOM 0 HB2 ASP B 133 25.872 -8.193 29.347 1.00 20.71 H new ATOM 0 HB3 ASP B 133 26.873 -7.468 28.397 1.00 20.71 H new ATOM 1020 N ARG B 134 24.771 -4.789 27.145 1.00 16.86 N ATOM 1021 CA ARG B 134 24.988 -3.639 26.269 1.00 19.61 C ATOM 1022 C ARG B 134 24.531 -3.900 24.833 1.00 17.63 C ATOM 1023 O ARG B 134 25.274 -3.653 23.890 1.00 19.75 O ATOM 1024 CB ARG B 134 26.456 -3.205 26.300 1.00 23.75 C ATOM 1025 CG ARG B 134 27.006 -3.018 27.715 1.00 26.22 C ATOM 1026 CD ARG B 134 28.454 -2.534 27.693 1.00 24.78 C ATOM 1027 NE ARG B 134 28.976 -2.364 29.051 1.00 34.32 N ATOM 1028 CZ ARG B 134 29.545 -3.338 29.760 1.00 34.87 C ATOM 1029 NH1 ARG B 134 29.989 -3.086 30.985 1.00 41.51 N ATOM 1030 NH2 ARG B 134 29.667 -4.567 29.248 1.00 33.37 N ATOM 0 H ARG B 134 24.262 -4.621 27.818 1.00 16.86 H new ATOM 0 HA ARG B 134 24.439 -2.916 26.612 1.00 19.61 H new ATOM 0 HB2 ARG B 134 26.992 -3.868 25.837 1.00 23.75 H new ATOM 0 HB3 ARG B 134 26.550 -2.373 25.811 1.00 23.75 H new ATOM 0 HG2 ARG B 134 26.457 -2.378 28.195 1.00 26.22 H new ATOM 0 HG3 ARG B 134 26.951 -3.857 28.198 1.00 26.22 H new ATOM 0 HD2 ARG B 134 29.003 -3.171 27.210 1.00 24.78 H new ATOM 0 HD3 ARG B 134 28.509 -1.692 27.215 1.00 24.78 H new ATOM 0 HE ARG B 134 28.911 -1.587 29.413 1.00 34.32 H new ATOM 0 HH11 ARG B 134 29.909 -2.297 31.318 1.00 41.51 H new ATOM 0 HH12 ARG B 134 30.357 -3.712 31.446 1.00 41.51 H new ATOM 0 HH21 ARG B 134 29.377 -4.733 28.456 1.00 33.37 H new ATOM 0 HH22 ARG B 134 30.035 -5.191 29.711 1.00 33.37 H new ATOM 1031 N ASP B 135 23.311 -4.409 24.686 1.00 15.72 N ATOM 1032 CA ASP B 135 22.753 -4.761 23.385 1.00 18.74 C ATOM 1033 C ASP B 135 22.239 -3.484 22.728 1.00 14.78 C ATOM 1034 O ASP B 135 21.069 -3.152 22.827 1.00 16.34 O ATOM 1035 CB ASP B 135 21.630 -5.791 23.569 1.00 19.03 C ATOM 1036 CG ASP B 135 21.148 -6.393 22.251 1.00 19.81 C ATOM 1037 OD1 ASP B 135 21.831 -6.240 21.211 1.00 18.00 O ATOM 1038 OD2 ASP B 135 20.080 -7.032 22.269 1.00 16.12 O ATOM 0 H ASP B 135 22.780 -4.561 25.345 1.00 15.72 H new ATOM 0 HA ASP B 135 23.427 -5.161 22.814 1.00 18.74 H new ATOM 0 HB2 ASP B 135 21.943 -6.503 24.148 1.00 19.03 H new ATOM 0 HB3 ASP B 135 20.881 -5.369 24.018 1.00 19.03 H new ATOM 1039 N ILE B 136 23.142 -2.728 22.120 1.00 14.15 N ATOM 1040 CA ILE B 136 22.778 -1.431 21.561 1.00 16.75 C ATOM 1041 C ILE B 136 23.659 -1.111 20.360 1.00 18.29 C ATOM 1042 O ILE B 136 24.832 -1.467 20.326 1.00 21.40 O ATOM 1043 CB ILE B 136 22.854 -0.287 22.613 1.00 16.30 C ATOM 1044 CG1 ILE B 136 22.250 1.001 22.058 1.00 18.38 C ATOM 1045 CG2 ILE B 136 24.295 -0.055 23.080 1.00 21.20 C ATOM 1046 CD1 ILE B 136 22.075 2.095 23.109 1.00 18.78 C ATOM 0 H ILE B 136 23.968 -2.945 22.020 1.00 14.15 H new ATOM 0 HA ILE B 136 21.853 -1.490 21.275 1.00 16.75 H new ATOM 0 HB ILE B 136 22.333 -0.560 23.385 1.00 16.30 H new ATOM 0 HG12 ILE B 136 22.817 1.335 21.346 1.00 18.38 H new ATOM 0 HG13 ILE B 136 21.387 0.801 21.663 1.00 18.38 H new ATOM 0 HG21 ILE B 136 24.312 0.662 23.734 1.00 21.20 H new ATOM 0 HG22 ILE B 136 24.640 -0.867 23.482 1.00 21.20 H new ATOM 0 HG23 ILE B 136 24.847 0.188 22.320 1.00 21.20 H new ATOM 0 HD11 ILE B 136 21.689 2.883 22.695 1.00 18.78 H new ATOM 0 HD12 ILE B 136 21.486 1.778 23.811 1.00 18.78 H new ATOM 0 HD13 ILE B 136 22.939 2.320 23.489 1.00 18.78 H new ATOM 1047 N ALA B 137 23.066 -0.463 19.366 1.00 18.01 N ATOM 1048 CA ALA B 137 23.783 -0.034 18.184 1.00 20.13 C ATOM 1049 C ALA B 137 23.151 1.259 17.665 1.00 22.87 C ATOM 1050 O ALA B 137 21.954 1.503 17.876 1.00 22.01 O ATOM 1051 CB ALA B 137 23.756 -1.124 17.120 1.00 16.49 C ATOM 0 H ALA B 137 22.230 -0.260 19.362 1.00 18.01 H new ATOM 0 HA ALA B 137 24.712 0.133 18.406 1.00 20.13 H new ATOM 0 HB1 ALA B 137 24.240 -0.822 16.335 1.00 16.49 H new ATOM 0 HB2 ALA B 137 24.174 -1.927 17.468 1.00 16.49 H new ATOM 0 HB3 ALA B 137 22.837 -1.318 16.878 1.00 16.49 H new ATOM 1052 N LEU B 138 23.966 2.091 17.016 1.00 22.55 N ATOM 1053 CA LEU B 138 23.501 3.305 16.363 1.00 17.29 C ATOM 1054 C LEU B 138 23.732 3.190 14.860 1.00 26.40 C ATOM 1055 O LEU B 138 24.695 2.539 14.424 1.00 26.19 O ATOM 1056 CB LEU B 138 24.243 4.513 16.905 1.00 18.90 C ATOM 1057 CG LEU B 138 23.670 5.035 18.209 1.00 27.42 C ATOM 1058 CD1 LEU B 138 24.674 5.907 18.936 1.00 26.22 C ATOM 1059 CD2 LEU B 138 22.375 5.798 17.897 1.00 21.46 C ATOM 0 H LEU B 138 24.813 1.961 16.944 1.00 22.55 H new ATOM 0 HA LEU B 138 22.554 3.417 16.540 1.00 17.29 H new ATOM 0 HB2 LEU B 138 25.175 4.279 17.039 1.00 18.90 H new ATOM 0 HB3 LEU B 138 24.221 5.222 16.243 1.00 18.90 H new ATOM 0 HG LEU B 138 23.470 4.294 18.802 1.00 27.42 H new ATOM 0 HD11 LEU B 138 24.284 6.228 19.765 1.00 26.22 H new ATOM 0 HD12 LEU B 138 25.470 5.389 19.133 1.00 26.22 H new ATOM 0 HD13 LEU B 138 24.911 6.663 18.377 1.00 26.22 H new ATOM 0 HD21 LEU B 138 21.994 6.140 18.721 1.00 21.46 H new ATOM 0 HD22 LEU B 138 22.571 6.538 17.301 1.00 21.46 H new ATOM 0 HD23 LEU B 138 21.741 5.200 17.472 1.00 21.46 H new ATOM 1060 N MET B 139 22.850 3.808 14.070 1.00 21.25 N ATOM 1061 CA MET B 139 22.979 3.787 12.616 1.00 23.14 C ATOM 1062 C MET B 139 22.795 5.185 12.035 1.00 26.85 C ATOM 1063 O MET B 139 21.753 5.816 12.211 1.00 26.46 O ATOM 1064 CB MET B 139 21.970 2.826 12.001 1.00 24.26 C ATOM 1065 CG MET B 139 21.919 1.457 12.711 1.00 26.93 C ATOM 1066 SD MET B 139 20.669 0.398 11.982 1.00 34.27 S ATOM 1067 CE MET B 139 21.629 -0.489 10.782 1.00 41.13 C ATOM 0 H MET B 139 22.169 4.245 14.360 1.00 21.25 H new ATOM 0 HA MET B 139 23.873 3.479 12.399 1.00 23.14 H new ATOM 0 HB2 MET B 139 21.089 3.231 12.029 1.00 24.26 H new ATOM 0 HB3 MET B 139 22.190 2.690 11.066 1.00 24.26 H new ATOM 0 HG2 MET B 139 22.786 1.026 12.652 1.00 26.93 H new ATOM 0 HG3 MET B 139 21.729 1.585 13.654 1.00 26.93 H new ATOM 0 HE1 MET B 139 21.050 -0.796 10.067 1.00 41.13 H new ATOM 0 HE2 MET B 139 22.311 0.096 10.417 1.00 41.13 H new ATOM 0 HE3 MET B 139 22.051 -1.253 11.206 1.00 41.13 H new ATOM 1068 N LYS B 140 23.825 5.676 11.363 1.00 23.70 N ATOM 1069 CA LYS B 140 23.754 6.976 10.723 1.00 28.81 C ATOM 1070 C LYS B 140 23.206 6.776 9.316 1.00 28.43 C ATOM 1071 O LYS B 140 23.705 5.939 8.569 1.00 22.75 O ATOM 1072 CB LYS B 140 25.139 7.612 10.685 1.00 30.80 C ATOM 1073 CG LYS B 140 25.198 9.040 10.165 1.00 34.90 C ATOM 1074 CD LYS B 140 26.637 9.550 10.255 1.00 42.21 C ATOM 1075 CE LYS B 140 26.740 11.049 9.989 1.00 53.43 C ATOM 1076 NZ LYS B 140 26.119 11.874 11.075 1.00 49.26 N ATOM 0 H LYS B 140 24.577 5.270 11.266 1.00 23.70 H new ATOM 0 HA LYS B 140 23.171 7.572 11.218 1.00 28.81 H new ATOM 0 HB2 LYS B 140 25.508 7.597 11.582 1.00 30.80 H new ATOM 0 HB3 LYS B 140 25.715 7.060 10.132 1.00 30.80 H new ATOM 0 HG2 LYS B 140 24.888 9.074 9.246 1.00 34.90 H new ATOM 0 HG3 LYS B 140 24.609 9.609 10.684 1.00 34.90 H new ATOM 0 HD2 LYS B 140 26.992 9.355 11.136 1.00 42.21 H new ATOM 0 HD3 LYS B 140 27.188 9.072 9.615 1.00 42.21 H new ATOM 0 HE2 LYS B 140 27.674 11.294 9.896 1.00 53.43 H new ATOM 0 HE3 LYS B 140 26.308 11.254 9.145 1.00 53.43 H new ATOM 0 HZ1 LYS B 140 26.229 12.738 10.891 1.00 49.26 H new ATOM 0 HZ2 LYS B 140 25.250 11.690 11.128 1.00 49.26 H new ATOM 0 HZ3 LYS B 140 26.509 11.685 11.852 1.00 49.26 H new ATOM 1077 N LEU B 141 22.158 7.523 8.975 1.00 27.46 N ATOM 1078 CA LEU B 141 21.561 7.460 7.640 1.00 31.22 C ATOM 1079 C LEU B 141 22.389 8.236 6.619 1.00 28.36 C ATOM 1080 O LEU B 141 23.015 9.229 6.957 1.00 28.26 O ATOM 1081 CB LEU B 141 20.137 8.021 7.672 1.00 32.84 C ATOM 1082 CG LEU B 141 19.206 7.390 8.716 1.00 29.55 C ATOM 1083 CD1 LEU B 141 17.826 8.061 8.718 1.00 29.62 C ATOM 1084 CD2 LEU B 141 19.092 5.906 8.452 1.00 29.61 C ATOM 0 H LEU B 141 21.774 8.078 9.507 1.00 27.46 H new ATOM 0 HA LEU B 141 21.541 6.528 7.372 1.00 31.22 H new ATOM 0 HB2 LEU B 141 20.185 8.975 7.838 1.00 32.84 H new ATOM 0 HB3 LEU B 141 19.740 7.905 6.795 1.00 32.84 H new ATOM 0 HG LEU B 141 19.586 7.528 9.598 1.00 29.55 H new ATOM 0 HD11 LEU B 141 17.263 7.641 9.387 1.00 29.62 H new ATOM 0 HD12 LEU B 141 17.925 9.004 8.925 1.00 29.62 H new ATOM 0 HD13 LEU B 141 17.417 7.963 7.844 1.00 29.62 H new ATOM 0 HD21 LEU B 141 18.504 5.504 9.111 1.00 29.61 H new ATOM 0 HD22 LEU B 141 18.729 5.762 7.564 1.00 29.61 H new ATOM 0 HD23 LEU B 141 19.970 5.498 8.512 1.00 29.61 H new ATOM 1085 N LYS B 142 22.386 7.785 5.371 1.00 30.81 N ATOM 1086 CA LYS B 142 23.078 8.506 4.303 1.00 32.44 C ATOM 1087 C LYS B 142 22.639 9.971 4.227 1.00 37.60 C ATOM 1088 O LYS B 142 23.469 10.872 4.079 1.00 30.89 O ATOM 1089 CB LYS B 142 22.809 7.836 2.963 1.00 39.27 C ATOM 1090 CG LYS B 142 23.677 6.639 2.689 1.00 41.79 C ATOM 1091 CD LYS B 142 24.937 7.039 1.951 1.00 43.25 C ATOM 1092 CE LYS B 142 25.576 5.824 1.313 1.00 48.74 C ATOM 1093 NZ LYS B 142 24.561 5.049 0.533 1.00 53.72 N ATOM 0 H LYS B 142 21.990 7.064 5.119 1.00 30.81 H new ATOM 0 HA LYS B 142 24.026 8.482 4.505 1.00 32.44 H new ATOM 0 HB2 LYS B 142 21.879 7.563 2.930 1.00 39.27 H new ATOM 0 HB3 LYS B 142 22.939 8.486 2.255 1.00 39.27 H new ATOM 0 HG2 LYS B 142 23.911 6.207 3.525 1.00 41.79 H new ATOM 0 HG3 LYS B 142 23.183 5.990 2.164 1.00 41.79 H new ATOM 0 HD2 LYS B 142 24.726 7.697 1.270 1.00 43.25 H new ATOM 0 HD3 LYS B 142 25.561 7.456 2.565 1.00 43.25 H new ATOM 0 HE2 LYS B 142 26.299 6.101 0.729 1.00 48.74 H new ATOM 0 HE3 LYS B 142 25.966 5.259 1.998 1.00 48.74 H new ATOM 0 HZ1 LYS B 142 24.976 4.506 -0.037 1.00 53.72 H new ATOM 0 HZ2 LYS B 142 24.062 4.568 1.091 1.00 53.72 H new ATOM 0 HZ3 LYS B 142 24.041 5.612 0.080 1.00 53.72 H new ATOM 1094 N LYS B 143 21.328 10.198 4.317 1.00 35.96 N ATOM 1095 CA LYS B 143 20.760 11.545 4.243 1.00 40.54 C ATOM 1096 C LYS B 143 19.668 11.714 5.285 1.00 35.58 C ATOM 1097 O LYS B 143 18.959 10.760 5.594 1.00 32.73 O ATOM 1098 CB LYS B 143 20.144 11.807 2.867 1.00 34.72 C ATOM 1099 CG LYS B 143 21.048 11.509 1.701 1.00 44.62 C ATOM 1100 CD LYS B 143 20.348 11.827 0.390 1.00 59.91 C ATOM 1101 CE LYS B 143 21.301 11.685 -0.790 1.00 70.36 C ATOM 1102 NZ LYS B 143 20.648 12.046 -2.081 1.00 77.87 N ATOM 0 H LYS B 143 20.744 9.576 4.423 1.00 35.96 H new ATOM 0 HA LYS B 143 21.482 12.173 4.403 1.00 40.54 H new ATOM 0 HB2 LYS B 143 19.339 11.273 2.780 1.00 34.72 H new ATOM 0 HB3 LYS B 143 19.873 12.737 2.820 1.00 34.72 H new ATOM 0 HG2 LYS B 143 21.862 12.031 1.774 1.00 44.62 H new ATOM 0 HG3 LYS B 143 21.308 10.575 1.717 1.00 44.62 H new ATOM 0 HD2 LYS B 143 19.591 11.232 0.272 1.00 59.91 H new ATOM 0 HD3 LYS B 143 19.997 12.731 0.419 1.00 59.91 H new ATOM 0 HE2 LYS B 143 22.075 12.253 -0.650 1.00 70.36 H new ATOM 0 HE3 LYS B 143 21.624 10.771 -0.836 1.00 70.36 H new ATOM 0 HZ1 LYS B 143 21.232 11.952 -2.746 1.00 77.87 H new ATOM 0 HZ2 LYS B 143 19.951 11.511 -2.221 1.00 77.87 H new ATOM 0 HZ3 LYS B 143 20.371 12.891 -2.048 1.00 77.87 H new ATOM 1103 N PRO B 144 19.521 12.936 5.810 1.00 32.85 N ATOM 1104 CA PRO B 144 18.461 13.254 6.765 1.00 35.25 C ATOM 1105 C PRO B 144 17.099 12.885 6.183 1.00 39.34 C ATOM 1106 O PRO B 144 16.884 12.992 4.964 1.00 33.45 O ATOM 1107 CB PRO B 144 18.595 14.778 6.949 1.00 35.02 C ATOM 1108 CG PRO B 144 19.401 15.240 5.758 1.00 39.51 C ATOM 1109 CD PRO B 144 20.353 14.114 5.516 1.00 40.84 C ATOM 0 HA PRO B 144 18.534 12.769 7.602 1.00 35.25 H new ATOM 0 HB2 PRO B 144 17.726 15.208 6.974 1.00 35.02 H new ATOM 0 HB3 PRO B 144 19.042 14.994 7.782 1.00 35.02 H new ATOM 0 HG2 PRO B 144 18.836 15.401 4.986 1.00 39.51 H new ATOM 0 HG3 PRO B 144 19.869 16.069 5.944 1.00 39.51 H new ATOM 0 HD2 PRO B 144 20.682 14.107 4.603 1.00 40.84 H new ATOM 0 HD3 PRO B 144 21.129 14.164 6.096 1.00 40.84 H new ATOM 1110 N VAL B 145 16.202 12.397 7.036 1.00 36.46 N ATOM 1111 CA VAL B 145 14.852 12.061 6.600 1.00 31.60 C ATOM 1112 C VAL B 145 13.955 13.252 6.935 1.00 32.41 C ATOM 1113 O VAL B 145 14.159 13.920 7.957 1.00 33.65 O ATOM 1114 CB VAL B 145 14.342 10.763 7.272 1.00 37.57 C ATOM 1115 CG1 VAL B 145 14.017 11.010 8.735 1.00 37.33 C ATOM 1116 CG2 VAL B 145 13.117 10.222 6.549 1.00 42.55 C ATOM 0 H VAL B 145 16.356 12.254 7.870 1.00 36.46 H new ATOM 0 HA VAL B 145 14.842 11.889 5.645 1.00 31.60 H new ATOM 0 HB VAL B 145 15.049 10.101 7.217 1.00 37.57 H new ATOM 0 HG11 VAL B 145 13.699 10.188 9.139 1.00 37.33 H new ATOM 0 HG12 VAL B 145 14.815 11.310 9.198 1.00 37.33 H new ATOM 0 HG13 VAL B 145 13.329 11.690 8.803 1.00 37.33 H new ATOM 0 HG21 VAL B 145 12.815 9.410 6.986 1.00 42.55 H new ATOM 0 HG22 VAL B 145 12.408 10.884 6.573 1.00 42.55 H new ATOM 0 HG23 VAL B 145 13.345 10.026 5.627 1.00 42.55 H new ATOM 1117 N ALA B 146 12.992 13.545 6.062 1.00 33.68 N ATOM 1118 CA ALA B 146 12.012 14.601 6.336 1.00 34.31 C ATOM 1119 C ALA B 146 10.907 14.063 7.231 1.00 28.48 C ATOM 1120 O ALA B 146 10.353 12.990 6.963 1.00 27.43 O ATOM 1121 CB ALA B 146 11.416 15.155 5.041 1.00 28.67 C ATOM 0 H ALA B 146 12.887 13.147 5.307 1.00 33.68 H new ATOM 0 HA ALA B 146 12.469 15.327 6.790 1.00 34.31 H new ATOM 0 HB1 ALA B 146 10.773 15.850 5.252 1.00 28.67 H new ATOM 0 HB2 ALA B 146 12.124 15.526 4.492 1.00 28.67 H new ATOM 0 HB3 ALA B 146 10.973 14.441 4.557 1.00 28.67 H new ATOM 1122 N PHE B 147 10.613 14.808 8.296 1.00 27.52 N ATOM 1123 CA PHE B 147 9.544 14.460 9.226 1.00 28.07 C ATOM 1124 C PHE B 147 8.188 14.701 8.580 1.00 27.34 C ATOM 1125 O PHE B 147 8.060 15.533 7.680 1.00 31.42 O ATOM 1126 CB PHE B 147 9.670 15.257 10.531 1.00 27.21 C ATOM 1127 CG PHE B 147 10.967 15.031 11.258 1.00 23.44 C ATOM 1128 CD1 PHE B 147 11.649 13.825 11.133 1.00 27.35 C ATOM 1129 CD2 PHE B 147 11.500 16.010 12.070 1.00 23.42 C ATOM 1130 CE1 PHE B 147 12.843 13.605 11.800 1.00 24.73 C ATOM 1131 CE2 PHE B 147 12.699 15.793 12.742 1.00 27.50 C ATOM 1132 CZ PHE B 147 13.367 14.592 12.606 1.00 24.17 C ATOM 0 H PHE B 147 11.031 15.532 8.499 1.00 27.52 H new ATOM 0 HA PHE B 147 9.623 13.518 9.443 1.00 28.07 H new ATOM 0 HB2 PHE B 147 9.581 16.202 10.333 1.00 27.21 H new ATOM 0 HB3 PHE B 147 8.935 15.020 11.117 1.00 27.21 H new ATOM 0 HD1 PHE B 147 11.297 13.155 10.592 1.00 27.35 H new ATOM 0 HD2 PHE B 147 11.055 16.821 12.169 1.00 23.42 H new ATOM 0 HE1 PHE B 147 13.289 12.795 11.704 1.00 24.73 H new ATOM 0 HE2 PHE B 147 13.052 16.460 13.285 1.00 27.50 H new ATOM 0 HZ PHE B 147 14.168 14.450 13.057 1.00 24.17 H new ATOM 1133 N SER B 148 7.184 13.953 9.023 1.00 27.48 N ATOM 1134 CA SER B 148 5.829 14.080 8.489 1.00 27.54 C ATOM 1135 C SER B 148 4.838 13.654 9.575 1.00 24.18 C ATOM 1136 O SER B 148 5.222 13.488 10.728 1.00 24.76 O ATOM 1137 CB SER B 148 5.660 13.192 7.263 1.00 22.72 C ATOM 1138 OG SER B 148 5.629 11.831 7.656 1.00 20.22 O ATOM 0 H SER B 148 7.266 13.359 9.639 1.00 27.48 H new ATOM 0 HA SER B 148 5.666 15.000 8.227 1.00 27.54 H new ATOM 0 HB2 SER B 148 4.840 13.422 6.798 1.00 22.72 H new ATOM 0 HB3 SER B 148 6.390 13.341 6.642 1.00 22.72 H new ATOM 0 HG SER B 148 5.641 11.342 6.973 1.00 20.22 H new ATOM 1139 N ASP B 149 3.576 13.465 9.201 1.00 23.61 N ATOM 1140 CA ASP B 149 2.583 12.944 10.131 1.00 23.30 C ATOM 1141 C ASP B 149 2.946 11.536 10.608 1.00 20.35 C ATOM 1142 O ASP B 149 2.490 11.112 11.670 1.00 21.30 O ATOM 1143 CB ASP B 149 1.204 12.876 9.476 1.00 22.53 C ATOM 1144 CG ASP B 149 0.524 14.240 9.362 1.00 30.98 C ATOM 1145 OD1 ASP B 149 1.007 15.221 9.964 1.00 26.97 O ATOM 1146 OD2 ASP B 149 -0.506 14.325 8.655 1.00 34.43 O ATOM 0 H ASP B 149 3.275 13.633 8.413 1.00 23.61 H new ATOM 0 HA ASP B 149 2.567 13.552 10.887 1.00 23.30 H new ATOM 0 HB2 ASP B 149 1.292 12.490 8.591 1.00 22.53 H new ATOM 0 HB3 ASP B 149 0.637 12.280 9.990 1.00 22.53 H new ATOM 1147 N TYR B 150 3.734 10.808 9.814 1.00 18.62 N ATOM 1148 CA TYR B 150 3.978 9.377 10.060 1.00 22.66 C ATOM 1149 C TYR B 150 5.402 9.075 10.548 1.00 19.45 C ATOM 1150 O TYR B 150 5.739 7.926 10.858 1.00 21.06 O ATOM 1151 CB TYR B 150 3.666 8.564 8.784 1.00 19.82 C ATOM 1152 CG TYR B 150 2.343 8.967 8.160 1.00 27.06 C ATOM 1153 CD1 TYR B 150 1.131 8.553 8.718 1.00 22.87 C ATOM 1154 CD2 TYR B 150 2.306 9.784 7.026 1.00 24.50 C ATOM 1155 CE1 TYR B 150 -0.079 8.937 8.164 1.00 26.11 C ATOM 1156 CE2 TYR B 150 1.102 10.178 6.462 1.00 26.36 C ATOM 1157 CZ TYR B 150 -0.082 9.756 7.034 1.00 31.00 C ATOM 1158 OH TYR B 150 -1.269 10.136 6.468 1.00 31.04 O ATOM 0 H TYR B 150 4.140 11.122 9.124 1.00 18.62 H new ATOM 0 HA TYR B 150 3.382 9.112 10.778 1.00 22.66 H new ATOM 0 HB2 TYR B 150 4.379 8.691 8.139 1.00 19.82 H new ATOM 0 HB3 TYR B 150 3.645 7.619 9.001 1.00 19.82 H new ATOM 0 HD1 TYR B 150 1.137 8.011 9.474 1.00 22.87 H new ATOM 0 HD2 TYR B 150 3.104 10.069 6.643 1.00 24.50 H new ATOM 0 HE1 TYR B 150 -0.880 8.652 8.541 1.00 26.11 H new ATOM 0 HE2 TYR B 150 1.092 10.721 5.707 1.00 26.36 H new ATOM 0 HH TYR B 150 -1.118 10.624 5.801 1.00 31.04 H new ATOM 1159 N ILE B 151 6.221 10.120 10.600 1.00 17.98 N ATOM 1160 CA ILE B 151 7.655 10.007 10.782 1.00 20.07 C ATOM 1161 C ILE B 151 8.067 11.122 11.713 1.00 21.57 C ATOM 1162 O ILE B 151 7.922 12.303 11.374 1.00 22.74 O ATOM 1163 CB ILE B 151 8.400 10.188 9.424 1.00 23.64 C ATOM 1164 CG1 ILE B 151 8.007 9.082 8.431 1.00 19.26 C ATOM 1165 CG2 ILE B 151 9.906 10.234 9.634 1.00 20.74 C ATOM 1166 CD1 ILE B 151 8.739 9.176 7.110 1.00 18.51 C ATOM 0 H ILE B 151 5.948 10.932 10.528 1.00 17.98 H new ATOM 0 HA ILE B 151 7.879 9.133 11.138 1.00 20.07 H new ATOM 0 HB ILE B 151 8.129 11.037 9.041 1.00 23.64 H new ATOM 0 HG12 ILE B 151 8.186 8.217 8.832 1.00 19.26 H new ATOM 0 HG13 ILE B 151 7.052 9.127 8.268 1.00 19.26 H new ATOM 0 HG21 ILE B 151 10.349 10.347 8.778 1.00 20.74 H new ATOM 0 HG22 ILE B 151 10.129 10.979 10.214 1.00 20.74 H new ATOM 0 HG23 ILE B 151 10.201 9.406 10.044 1.00 20.74 H new ATOM 0 HD11 ILE B 151 8.451 8.455 6.528 1.00 18.51 H new ATOM 0 HD12 ILE B 151 8.542 10.028 6.691 1.00 18.51 H new ATOM 0 HD13 ILE B 151 9.694 9.105 7.263 1.00 18.51 H new ATOM 1167 N HIS B 152 8.584 10.757 12.883 1.00 16.01 N ATOM 1168 CA HIS B 152 8.874 11.741 13.922 1.00 17.01 C ATOM 1169 C HIS B 152 9.703 11.094 15.043 1.00 17.48 C ATOM 1170 O HIS B 152 9.439 9.955 15.427 1.00 16.70 O ATOM 1171 CB HIS B 152 7.564 12.323 14.472 1.00 18.69 C ATOM 1172 CG HIS B 152 7.750 13.578 15.256 1.00 21.61 C ATOM 1173 ND1 HIS B 152 7.805 14.822 14.664 1.00 22.63 N ATOM 1174 CD2 HIS B 152 7.919 13.781 16.586 1.00 23.06 C ATOM 1175 CE1 HIS B 152 7.998 15.739 15.598 1.00 30.47 C ATOM 1176 NE2 HIS B 152 8.068 15.133 16.772 1.00 27.11 N ATOM 0 H HIS B 152 8.774 9.946 13.095 1.00 16.01 H new ATOM 0 HA HIS B 152 9.393 12.466 13.541 1.00 17.01 H new ATOM 0 HB2 HIS B 152 6.962 12.499 13.732 1.00 18.69 H new ATOM 0 HB3 HIS B 152 7.136 11.659 15.035 1.00 18.69 H new ATOM 0 HD2 HIS B 152 7.932 13.127 17.248 1.00 23.06 H new ATOM 0 HE1 HIS B 152 8.072 16.655 15.454 1.00 30.47 H new ATOM 0 HE2 HIS B 152 8.188 15.523 17.529 1.00 27.11 H new ATOM 1177 N PRO B 153 10.715 11.811 15.564 1.00 15.67 N ATOM 1178 CA PRO B 153 11.654 11.118 16.438 1.00 19.31 C ATOM 1179 C PRO B 153 11.114 11.046 17.869 1.00 20.34 C ATOM 1180 O PRO B 153 10.300 11.877 18.280 1.00 14.32 O ATOM 1181 CB PRO B 153 12.911 12.004 16.389 1.00 15.32 C ATOM 1182 CG PRO B 153 12.476 13.319 15.673 1.00 21.84 C ATOM 1183 CD PRO B 153 10.998 13.256 15.502 1.00 17.89 C ATOM 0 HA PRO B 153 11.818 10.203 16.162 1.00 19.31 H new ATOM 0 HB2 PRO B 153 13.243 12.187 17.282 1.00 15.32 H new ATOM 0 HB3 PRO B 153 13.628 11.565 15.905 1.00 15.32 H new ATOM 0 HG2 PRO B 153 12.728 14.095 16.198 1.00 21.84 H new ATOM 0 HG3 PRO B 153 12.917 13.403 14.813 1.00 21.84 H new ATOM 0 HD2 PRO B 153 10.535 13.742 16.202 1.00 17.89 H new ATOM 0 HD3 PRO B 153 10.718 13.640 14.657 1.00 17.89 H new ATOM 1184 N VAL B 154 11.570 10.039 18.601 1.00 13.39 N ATOM 1185 CA VAL B 154 11.162 9.826 19.979 1.00 14.72 C ATOM 1186 C VAL B 154 12.253 10.517 20.824 1.00 20.09 C ATOM 1187 O VAL B 154 13.361 10.742 20.329 1.00 17.94 O ATOM 1188 CB VAL B 154 11.108 8.305 20.244 1.00 14.35 C ATOM 1189 CG1 VAL B 154 12.519 7.718 20.080 1.00 14.75 C ATOM 1190 CG2 VAL B 154 10.494 7.962 21.629 1.00 20.11 C ATOM 0 H VAL B 154 12.130 9.455 18.308 1.00 13.39 H new ATOM 0 HA VAL B 154 10.286 10.185 20.190 1.00 14.72 H new ATOM 0 HB VAL B 154 10.515 7.899 19.592 1.00 14.35 H new ATOM 0 HG11 VAL B 154 12.493 6.762 20.245 1.00 14.75 H new ATOM 0 HG12 VAL B 154 12.835 7.882 19.178 1.00 14.75 H new ATOM 0 HG13 VAL B 154 13.121 8.139 20.714 1.00 14.75 H new ATOM 0 HG21 VAL B 154 10.482 6.999 21.748 1.00 20.11 H new ATOM 0 HG22 VAL B 154 11.029 8.367 22.330 1.00 20.11 H new ATOM 0 HG23 VAL B 154 9.588 8.305 21.675 1.00 20.11 H new ATOM 1191 N CYS B 155 11.963 10.875 22.073 1.00 16.64 N ATOM 1192 CA CYS B 155 12.993 11.469 22.919 1.00 16.20 C ATOM 1193 C CYS B 155 13.860 10.425 23.640 1.00 18.91 C ATOM 1194 O CYS B 155 13.433 9.299 23.895 1.00 18.14 O ATOM 1195 CB CYS B 155 12.372 12.401 23.982 1.00 20.88 C ATOM 1196 SG CYS B 155 11.270 13.672 23.337 1.00 17.09 S ATOM 0 H CYS B 155 11.192 10.785 22.443 1.00 16.64 H new ATOM 0 HA CYS B 155 13.561 11.973 22.316 1.00 16.20 H new ATOM 0 HB2 CYS B 155 11.880 11.859 24.619 1.00 20.88 H new ATOM 0 HB3 CYS B 155 13.089 12.833 24.472 1.00 20.88 H new ATOM 1197 N LEU B 156 15.080 10.821 23.980 1.00 20.07 N ATOM 1198 CA LEU B 156 15.941 10.016 24.828 1.00 19.19 C ATOM 1199 C LEU B 156 15.850 10.590 26.227 1.00 20.87 C ATOM 1200 O LEU B 156 15.868 11.804 26.395 1.00 20.49 O ATOM 1201 CB LEU B 156 17.389 10.070 24.357 1.00 17.83 C ATOM 1202 CG LEU B 156 17.737 9.389 23.040 1.00 26.78 C ATOM 1203 CD1 LEU B 156 19.248 9.423 22.834 1.00 21.99 C ATOM 1204 CD2 LEU B 156 17.204 7.950 23.022 1.00 24.25 C ATOM 0 H LEU B 156 15.430 11.564 23.725 1.00 20.07 H new ATOM 0 HA LEU B 156 15.657 9.089 24.799 1.00 19.19 H new ATOM 0 HB2 LEU B 156 17.644 11.003 24.286 1.00 17.83 H new ATOM 0 HB3 LEU B 156 17.942 9.677 25.050 1.00 17.83 H new ATOM 0 HG LEU B 156 17.314 9.866 22.309 1.00 26.78 H new ATOM 0 HD11 LEU B 156 19.470 8.989 21.995 1.00 21.99 H new ATOM 0 HD12 LEU B 156 19.551 10.344 22.812 1.00 21.99 H new ATOM 0 HD13 LEU B 156 19.685 8.957 23.564 1.00 21.99 H new ATOM 0 HD21 LEU B 156 17.433 7.530 22.178 1.00 24.25 H new ATOM 0 HD22 LEU B 156 17.602 7.448 23.751 1.00 24.25 H new ATOM 0 HD23 LEU B 156 16.240 7.961 23.126 1.00 24.25 H new ATOM 1205 N PRO B 157 15.785 9.714 27.238 1.00 25.35 N ATOM 1206 CA PRO B 157 15.579 10.151 28.620 1.00 20.80 C ATOM 1207 C PRO B 157 16.824 10.865 29.164 1.00 29.78 C ATOM 1208 O PRO B 157 17.945 10.563 28.762 1.00 26.82 O ATOM 1209 CB PRO B 157 15.397 8.830 29.365 1.00 23.14 C ATOM 1210 CG PRO B 157 16.251 7.855 28.556 1.00 26.68 C ATOM 1211 CD PRO B 157 15.940 8.247 27.135 1.00 20.01 C ATOM 0 HA PRO B 157 14.839 10.771 28.710 1.00 20.80 H new ATOM 0 HB2 PRO B 157 15.698 8.893 30.285 1.00 23.14 H new ATOM 0 HB3 PRO B 157 14.467 8.557 29.389 1.00 23.14 H new ATOM 0 HG2 PRO B 157 17.195 7.949 28.758 1.00 26.68 H new ATOM 0 HG3 PRO B 157 16.013 6.932 28.736 1.00 26.68 H new ATOM 0 HD2 PRO B 157 16.655 8.001 26.527 1.00 20.01 H new ATOM 0 HD3 PRO B 157 15.132 7.820 26.811 1.00 20.01 H new ATOM 1212 N ASP B 158 16.615 11.816 30.065 1.00 34.28 N ATOM 1213 CA ASP B 158 17.696 12.376 30.859 1.00 35.13 C ATOM 1214 C ASP B 158 17.657 11.627 32.180 1.00 34.90 C ATOM 1215 O ASP B 158 16.776 10.791 32.374 1.00 32.03 O ATOM 1216 CB ASP B 158 17.457 13.864 31.074 1.00 35.76 C ATOM 1217 CG ASP B 158 16.028 14.163 31.466 1.00 40.59 C ATOM 1218 OD1 ASP B 158 15.643 13.829 32.607 1.00 45.71 O ATOM 1219 OD2 ASP B 158 15.284 14.724 30.630 1.00 50.53 O ATOM 0 H ASP B 158 15.842 12.154 30.232 1.00 34.28 H new ATOM 0 HA ASP B 158 18.559 12.284 30.426 1.00 35.13 H new ATOM 0 HB2 ASP B 158 18.055 14.189 31.765 1.00 35.76 H new ATOM 0 HB3 ASP B 158 17.675 14.346 30.261 1.00 35.76 H new ATOM 1220 N ARG B 159 18.587 11.922 33.089 1.00 37.85 N ATOM 1221 CA ARG B 159 18.662 11.192 34.356 1.00 33.73 C ATOM 1222 C ARG B 159 17.373 11.295 35.179 1.00 35.52 C ATOM 1223 O ARG B 159 16.916 10.311 35.768 1.00 35.51 O ATOM 1224 CB ARG B 159 19.852 11.664 35.200 1.00 41.04 C ATOM 1225 CG ARG B 159 19.883 11.048 36.598 1.00 46.35 C ATOM 1226 CD ARG B 159 21.239 11.243 37.282 1.00 57.92 C ATOM 1227 NE ARG B 159 22.333 10.726 36.457 1.00 67.52 N ATOM 1228 CZ ARG B 159 22.772 9.465 36.480 1.00 67.66 C ATOM 1229 NH1 ARG B 159 23.769 9.095 35.679 1.00 55.95 N ATOM 1230 NH2 ARG B 159 22.218 8.571 37.298 1.00 62.90 N ATOM 0 H ARG B 159 19.180 12.537 32.993 1.00 37.85 H new ATOM 0 HA ARG B 159 18.786 10.260 34.119 1.00 33.73 H new ATOM 0 HB2 ARG B 159 20.676 11.444 34.738 1.00 41.04 H new ATOM 0 HB3 ARG B 159 19.821 12.630 35.280 1.00 41.04 H new ATOM 0 HG2 ARG B 159 19.187 11.448 37.142 1.00 46.35 H new ATOM 0 HG3 ARG B 159 19.686 10.100 36.537 1.00 46.35 H new ATOM 0 HD2 ARG B 159 21.382 12.186 37.458 1.00 57.92 H new ATOM 0 HD3 ARG B 159 21.238 10.792 38.141 1.00 57.92 H new ATOM 0 HE ARG B 159 22.721 11.274 35.919 1.00 67.52 H new ATOM 0 HH11 ARG B 159 24.129 9.668 35.148 1.00 55.95 H new ATOM 0 HH12 ARG B 159 24.053 8.283 35.693 1.00 55.95 H new ATOM 0 HH21 ARG B 159 21.573 8.804 37.816 1.00 62.90 H new ATOM 0 HH22 ARG B 159 22.506 7.761 37.308 1.00 62.90 H new ATOM 1231 N GLU B 160 16.790 12.488 35.210 1.00 34.09 N ATOM 1232 CA GLU B 160 15.591 12.742 35.999 1.00 33.43 C ATOM 1233 C GLU B 160 14.400 11.951 35.464 1.00 32.89 C ATOM 1234 O GLU B 160 13.651 11.327 36.225 1.00 28.32 O ATOM 1235 CB GLU B 160 15.283 14.242 35.999 1.00 38.28 C ATOM 1236 CG GLU B 160 16.350 15.108 36.677 1.00 41.93 C ATOM 1237 CD GLU B 160 17.717 15.099 35.966 1.00 49.26 C ATOM 1238 OE1 GLU B 160 17.778 15.463 34.764 1.00 42.00 O ATOM 1239 OE2 GLU B 160 18.737 14.749 36.628 1.00 48.34 O ATOM 0 H GLU B 160 17.078 13.172 34.775 1.00 34.09 H new ATOM 0 HA GLU B 160 15.753 12.449 36.909 1.00 33.43 H new ATOM 0 HB2 GLU B 160 15.176 14.539 35.082 1.00 38.28 H new ATOM 0 HB3 GLU B 160 14.434 14.387 36.445 1.00 38.28 H new ATOM 0 HG2 GLU B 160 16.028 16.022 36.725 1.00 41.93 H new ATOM 0 HG3 GLU B 160 16.469 14.801 37.589 1.00 41.93 H new ATOM 1240 N THR B 161 14.229 11.966 34.147 1.00 30.61 N ATOM 1241 CA THR B 161 13.145 11.208 33.537 1.00 33.02 C ATOM 1242 C THR B 161 13.292 9.720 33.875 1.00 27.11 C ATOM 1243 O THR B 161 12.343 9.082 34.334 1.00 25.67 O ATOM 1244 CB THR B 161 13.086 11.428 32.003 1.00 33.11 C ATOM 1245 OG1 THR B 161 12.952 12.834 31.734 1.00 38.47 O ATOM 1246 CG2 THR B 161 11.893 10.682 31.402 1.00 25.72 C ATOM 0 H THR B 161 14.723 12.403 33.595 1.00 30.61 H new ATOM 0 HA THR B 161 12.306 11.530 33.903 1.00 33.02 H new ATOM 0 HB THR B 161 13.902 11.088 31.603 1.00 33.11 H new ATOM 0 HG1 THR B 161 13.629 13.240 32.021 1.00 38.47 H new ATOM 0 HG21 THR B 161 11.869 10.829 30.443 1.00 25.72 H new ATOM 0 HG22 THR B 161 11.981 9.733 31.581 1.00 25.72 H new ATOM 0 HG23 THR B 161 11.072 11.011 31.800 1.00 25.72 H new ATOM 1247 N ALA B 162 14.491 9.186 33.673 1.00 24.96 N ATOM 1248 CA ALA B 162 14.752 7.788 33.963 1.00 23.91 C ATOM 1249 C ALA B 162 14.450 7.475 35.419 1.00 29.39 C ATOM 1250 O ALA B 162 13.788 6.480 35.714 1.00 28.98 O ATOM 1251 CB ALA B 162 16.190 7.431 33.631 1.00 21.83 C ATOM 0 H ALA B 162 15.167 9.620 33.367 1.00 24.96 H new ATOM 0 HA ALA B 162 14.167 7.250 33.407 1.00 23.91 H new ATOM 0 HB1 ALA B 162 16.346 6.495 33.831 1.00 21.83 H new ATOM 0 HB2 ALA B 162 16.354 7.592 32.689 1.00 21.83 H new ATOM 0 HB3 ALA B 162 16.790 7.978 34.161 1.00 21.83 H new ATOM 1252 N ALA B 163 14.925 8.324 36.332 1.00 25.75 N ATOM 1253 CA ALA B 163 14.728 8.059 37.762 1.00 34.05 C ATOM 1254 C ALA B 163 13.245 8.019 38.062 1.00 28.85 C ATOM 1255 O ALA B 163 12.744 7.128 38.735 1.00 34.51 O ATOM 1256 CB ALA B 163 15.401 9.136 38.611 1.00 30.67 C ATOM 0 H ALA B 163 15.356 9.046 36.151 1.00 25.75 H new ATOM 0 HA ALA B 163 15.131 7.204 37.981 1.00 34.05 H new ATOM 0 HB1 ALA B 163 15.259 8.943 39.551 1.00 30.67 H new ATOM 0 HB2 ALA B 163 16.353 9.148 38.424 1.00 30.67 H new ATOM 0 HB3 ALA B 163 15.019 10.002 38.398 1.00 30.67 H new ATOM 1257 N SER B 164 12.547 9.001 37.519 1.00 32.63 N ATOM 1258 CA SER B 164 11.123 9.164 37.737 1.00 34.39 C ATOM 1259 C SER B 164 10.268 8.024 37.148 1.00 32.59 C ATOM 1260 O SER B 164 9.302 7.576 37.764 1.00 32.77 O ATOM 1261 CB SER B 164 10.700 10.513 37.148 1.00 34.92 C ATOM 1262 OG SER B 164 9.424 10.894 37.620 1.00 49.71 O ATOM 0 H SER B 164 12.892 9.600 37.007 1.00 32.63 H new ATOM 0 HA SER B 164 10.965 9.134 38.694 1.00 34.39 H new ATOM 0 HB2 SER B 164 11.352 11.191 37.384 1.00 34.92 H new ATOM 0 HB3 SER B 164 10.687 10.457 36.180 1.00 34.92 H new ATOM 0 HG SER B 164 9.181 11.599 37.233 1.00 49.71 H new ATOM 1263 N LEU B 165 10.630 7.538 35.968 1.00 25.43 N ATOM 1264 CA LEU B 165 9.720 6.665 35.224 1.00 26.50 C ATOM 1265 C LEU B 165 10.059 5.182 35.279 1.00 25.69 C ATOM 1266 O LEU B 165 9.179 4.334 35.136 1.00 24.53 O ATOM 1267 CB LEU B 165 9.615 7.118 33.757 1.00 24.32 C ATOM 1268 CG LEU B 165 8.841 8.419 33.520 1.00 25.59 C ATOM 1269 CD1 LEU B 165 8.663 8.644 32.033 1.00 25.76 C ATOM 1270 CD2 LEU B 165 7.489 8.353 34.189 1.00 28.92 C ATOM 0 H LEU B 165 11.383 7.695 35.583 1.00 25.43 H new ATOM 0 HA LEU B 165 8.866 6.757 35.674 1.00 26.50 H new ATOM 0 HB2 LEU B 165 10.512 7.225 33.403 1.00 24.32 H new ATOM 0 HB3 LEU B 165 9.191 6.411 33.246 1.00 24.32 H new ATOM 0 HG LEU B 165 9.344 9.156 33.900 1.00 25.59 H new ATOM 0 HD11 LEU B 165 8.173 9.468 31.887 1.00 25.76 H new ATOM 0 HD12 LEU B 165 9.533 8.706 31.608 1.00 25.76 H new ATOM 0 HD13 LEU B 165 8.169 7.902 31.650 1.00 25.76 H new ATOM 0 HD21 LEU B 165 7.009 9.181 34.032 1.00 28.92 H new ATOM 0 HD22 LEU B 165 6.982 7.612 33.822 1.00 28.92 H new ATOM 0 HD23 LEU B 165 7.606 8.223 35.143 1.00 28.92 H new ATOM 1271 N LEU B 166 11.337 4.864 35.450 1.00 29.77 N ATOM 1272 CA LEU B 166 11.757 3.465 35.459 1.00 29.20 C ATOM 1273 C LEU B 166 11.541 2.827 36.823 1.00 32.22 C ATOM 1274 O LEU B 166 12.479 2.675 37.594 1.00 25.82 O ATOM 1275 CB LEU B 166 13.223 3.348 35.063 1.00 29.13 C ATOM 1276 CG LEU B 166 13.457 3.268 33.560 1.00 33.48 C ATOM 1277 CD1 LEU B 166 14.930 3.071 33.245 1.00 30.30 C ATOM 1278 CD2 LEU B 166 12.630 2.136 32.984 1.00 26.58 C ATOM 0 H LEU B 166 11.971 5.434 35.561 1.00 29.77 H new ATOM 0 HA LEU B 166 11.210 2.992 34.812 1.00 29.20 H new ATOM 0 HB2 LEU B 166 13.705 4.112 35.415 1.00 29.13 H new ATOM 0 HB3 LEU B 166 13.599 2.558 35.482 1.00 29.13 H new ATOM 0 HG LEU B 166 13.182 4.105 33.154 1.00 33.48 H new ATOM 0 HD11 LEU B 166 15.052 3.023 32.284 1.00 30.30 H new ATOM 0 HD12 LEU B 166 15.439 3.817 33.599 1.00 30.30 H new ATOM 0 HD13 LEU B 166 15.241 2.247 33.651 1.00 30.30 H new ATOM 0 HD21 LEU B 166 12.777 2.082 32.027 1.00 26.58 H new ATOM 0 HD22 LEU B 166 12.893 1.299 33.398 1.00 26.58 H new ATOM 0 HD23 LEU B 166 11.690 2.301 33.158 1.00 26.58 H new ATOM 1279 N GLN B 167 10.299 2.458 37.112 1.00 28.91 N ATOM 1280 CA GLN B 167 9.963 1.864 38.389 1.00 28.90 C ATOM 1281 C GLN B 167 9.030 0.681 38.193 1.00 30.33 C ATOM 1282 O GLN B 167 8.182 0.692 37.289 1.00 22.97 O ATOM 1283 CB GLN B 167 9.319 2.903 39.302 1.00 26.26 C ATOM 1284 CG GLN B 167 10.341 3.836 39.953 1.00 39.81 C ATOM 1285 CD GLN B 167 9.689 4.921 40.801 1.00 48.30 C ATOM 1286 OE1 GLN B 167 8.741 4.660 41.555 1.00 49.29 O ATOM 1287 NE2 GLN B 167 10.194 6.148 40.680 1.00 48.33 N ATOM 0 H GLN B 167 9.634 2.546 36.574 1.00 28.91 H new ATOM 0 HA GLN B 167 10.779 1.547 38.807 1.00 28.90 H new ATOM 0 HB2 GLN B 167 8.687 3.430 38.789 1.00 26.26 H new ATOM 0 HB3 GLN B 167 8.814 2.450 39.995 1.00 26.26 H new ATOM 0 HG2 GLN B 167 10.942 3.315 40.508 1.00 39.81 H new ATOM 0 HG3 GLN B 167 10.881 4.251 39.262 1.00 39.81 H new ATOM 0 HE21 GLN B 167 10.853 6.291 40.146 1.00 48.33 H new ATOM 0 HE22 GLN B 167 9.861 6.797 41.136 1.00 48.33 H new ATOM 1288 N ALA B 168 9.201 -0.331 39.044 1.00 20.59 N ATOM 1289 CA ALA B 168 8.357 -1.517 39.045 1.00 23.02 C ATOM 1290 C ALA B 168 6.900 -1.124 39.056 1.00 23.94 C ATOM 1291 O ALA B 168 6.505 -0.237 39.810 1.00 26.06 O ATOM 1292 CB ALA B 168 8.679 -2.400 40.261 1.00 26.47 C ATOM 0 H ALA B 168 9.819 -0.345 39.642 1.00 20.59 H new ATOM 0 HA ALA B 168 8.535 -2.024 38.237 1.00 23.02 H new ATOM 0 HB1 ALA B 168 8.111 -3.186 40.250 1.00 26.47 H new ATOM 0 HB2 ALA B 168 9.609 -2.674 40.225 1.00 26.47 H new ATOM 0 HB3 ALA B 168 8.521 -1.899 41.076 1.00 26.47 H new ATOM 1293 N GLY B 169 6.103 -1.769 38.206 1.00 25.68 N ATOM 1294 CA GLY B 169 4.686 -1.454 38.116 1.00 27.44 C ATOM 1295 C GLY B 169 4.319 -0.438 37.032 1.00 22.63 C ATOM 1296 O GLY B 169 3.270 -0.526 36.409 1.00 23.75 O ATOM 0 H GLY B 169 6.366 -2.392 37.674 1.00 25.68 H new ATOM 0 HA2 GLY B 169 4.196 -2.274 37.951 1.00 27.44 H new ATOM 0 HA3 GLY B 169 4.389 -1.113 38.974 1.00 27.44 H new ATOM 1297 N TYR B 170 5.178 0.542 36.817 1.00 21.61 N ATOM 1298 CA TYR B 170 4.958 1.511 35.748 1.00 22.81 C ATOM 1299 C TYR B 170 4.989 0.798 34.380 1.00 25.64 C ATOM 1300 O TYR B 170 5.838 -0.088 34.138 1.00 19.60 O ATOM 1301 CB TYR B 170 6.033 2.594 35.802 1.00 21.54 C ATOM 1302 CG TYR B 170 5.904 3.585 36.939 1.00 24.35 C ATOM 1303 CD1 TYR B 170 5.241 3.265 38.130 1.00 27.92 C ATOM 1304 CD2 TYR B 170 6.483 4.843 36.833 1.00 28.41 C ATOM 1305 CE1 TYR B 170 5.145 4.199 39.171 1.00 22.25 C ATOM 1306 CE2 TYR B 170 6.394 5.763 37.846 1.00 28.31 C ATOM 1307 CZ TYR B 170 5.727 5.449 39.009 1.00 29.42 C ATOM 1308 OH TYR B 170 5.674 6.416 39.995 1.00 30.09 O ATOM 0 H TYR B 170 5.895 0.668 37.275 1.00 21.61 H new ATOM 0 HA TYR B 170 4.089 1.925 35.866 1.00 22.81 H new ATOM 0 HB2 TYR B 170 6.900 2.164 35.865 1.00 21.54 H new ATOM 0 HB3 TYR B 170 6.020 3.083 34.964 1.00 21.54 H new ATOM 0 HD1 TYR B 170 4.860 2.423 38.232 1.00 27.92 H new ATOM 0 HD2 TYR B 170 6.942 5.067 36.056 1.00 28.41 H new ATOM 0 HE1 TYR B 170 4.698 3.985 39.958 1.00 22.25 H new ATOM 0 HE2 TYR B 170 6.785 6.601 37.747 1.00 28.31 H new ATOM 0 HH TYR B 170 6.075 7.106 39.733 1.00 30.09 H new ATOM 1309 N LYS B 171 4.075 1.184 33.490 1.00 20.08 N ATOM 1310 CA LYS B 171 3.962 0.511 32.197 1.00 23.80 C ATOM 1311 C LYS B 171 4.622 1.270 31.049 1.00 20.62 C ATOM 1312 O LYS B 171 4.531 2.497 30.951 1.00 18.78 O ATOM 1313 CB LYS B 171 2.503 0.235 31.832 1.00 27.81 C ATOM 1314 CG LYS B 171 1.824 -0.820 32.675 1.00 28.08 C ATOM 1315 CD LYS B 171 0.371 -0.970 32.264 1.00 25.52 C ATOM 1316 CE LYS B 171 -0.364 -1.890 33.225 1.00 32.98 C ATOM 1317 NZ LYS B 171 -1.805 -1.993 32.885 1.00 32.66 N ATOM 0 H LYS B 171 3.517 1.826 33.613 1.00 20.08 H new ATOM 0 HA LYS B 171 4.440 -0.325 32.312 1.00 23.80 H new ATOM 0 HB2 LYS B 171 2.002 1.062 31.908 1.00 27.81 H new ATOM 0 HB3 LYS B 171 2.462 -0.037 30.902 1.00 27.81 H new ATOM 0 HG2 LYS B 171 2.284 -1.668 32.575 1.00 28.08 H new ATOM 0 HG3 LYS B 171 1.878 -0.577 33.613 1.00 28.08 H new ATOM 0 HD2 LYS B 171 -0.058 -0.100 32.249 1.00 25.52 H new ATOM 0 HD3 LYS B 171 0.319 -1.327 31.363 1.00 25.52 H new ATOM 0 HE2 LYS B 171 0.039 -2.772 33.202 1.00 32.98 H new ATOM 0 HE3 LYS B 171 -0.267 -1.557 34.131 1.00 32.98 H new ATOM 0 HZ1 LYS B 171 -2.159 -2.696 33.300 1.00 32.66 H new ATOM 0 HZ2 LYS B 171 -2.225 -1.253 33.145 1.00 32.66 H new ATOM 0 HZ3 LYS B 171 -1.896 -2.091 32.005 1.00 32.66 H new ATOM 1318 N GLY B 172 5.298 0.520 30.189 1.00 15.60 N ATOM 1319 CA GLY B 172 5.799 1.058 28.946 1.00 17.34 C ATOM 1320 C GLY B 172 5.100 0.358 27.794 1.00 14.40 C ATOM 1321 O GLY B 172 4.276 -0.518 28.005 1.00 17.92 O ATOM 0 H GLY B 172 5.476 -0.312 30.314 1.00 15.60 H new ATOM 0 HA2 GLY B 172 5.639 2.014 28.905 1.00 17.34 H new ATOM 0 HA3 GLY B 172 6.758 0.928 28.886 1.00 17.34 H new ATOM 1322 N ARG B 173 5.454 0.741 26.578 1.00 15.29 N ATOM 1323 CA ARG B 173 4.806 0.267 25.358 1.00 13.66 C ATOM 1324 C ARG B 173 5.856 -0.268 24.383 1.00 18.34 C ATOM 1325 O ARG B 173 6.891 0.392 24.135 1.00 18.27 O ATOM 1326 CB ARG B 173 4.072 1.430 24.683 1.00 15.45 C ATOM 1327 CG ARG B 173 3.473 1.120 23.316 1.00 14.39 C ATOM 1328 CD ARG B 173 2.641 2.323 22.775 1.00 17.72 C ATOM 1329 NE ARG B 173 1.385 2.484 23.509 1.00 16.95 N ATOM 1330 CZ ARG B 173 0.538 3.500 23.361 1.00 22.17 C ATOM 1331 NH1 ARG B 173 -0.583 3.547 24.094 1.00 21.08 N ATOM 1332 NH2 ARG B 173 0.799 4.465 22.483 1.00 19.94 N ATOM 0 H ARG B 173 6.093 1.297 26.431 1.00 15.29 H new ATOM 0 HA ARG B 173 4.181 -0.437 25.591 1.00 13.66 H new ATOM 0 HB2 ARG B 173 3.360 1.728 25.271 1.00 15.45 H new ATOM 0 HB3 ARG B 173 4.691 2.171 24.588 1.00 15.45 H new ATOM 0 HG2 ARG B 173 4.183 0.908 22.690 1.00 14.39 H new ATOM 0 HG3 ARG B 173 2.907 0.335 23.379 1.00 14.39 H new ATOM 0 HD2 ARG B 173 3.164 3.137 22.845 1.00 17.72 H new ATOM 0 HD3 ARG B 173 2.451 2.188 21.833 1.00 17.72 H new ATOM 0 HE ARG B 173 1.178 1.875 24.080 1.00 16.95 H new ATOM 0 HH11 ARG B 173 -0.754 2.921 24.659 1.00 21.08 H new ATOM 0 HH12 ARG B 173 -1.131 4.203 24.000 1.00 21.08 H new ATOM 0 HH21 ARG B 173 1.516 4.433 22.010 1.00 19.94 H new ATOM 0 HH22 ARG B 173 0.250 5.121 22.389 1.00 19.94 H new ATOM 1333 N VAL B 174 5.581 -1.445 23.823 1.00 14.17 N ATOM 1334 CA VAL B 174 6.435 -2.037 22.813 1.00 16.50 C ATOM 1335 C VAL B 174 5.659 -2.207 21.517 1.00 17.69 C ATOM 1336 O VAL B 174 4.470 -2.570 21.524 1.00 19.53 O ATOM 1337 CB VAL B 174 7.010 -3.427 23.261 1.00 16.20 C ATOM 1338 CG1 VAL B 174 7.883 -4.025 22.168 1.00 15.84 C ATOM 1339 CG2 VAL B 174 7.794 -3.288 24.547 1.00 18.32 C ATOM 0 H VAL B 174 4.891 -1.919 24.023 1.00 14.17 H new ATOM 0 HA VAL B 174 7.184 -1.435 22.680 1.00 16.50 H new ATOM 0 HB VAL B 174 6.265 -4.027 23.419 1.00 16.20 H new ATOM 0 HG11 VAL B 174 8.229 -4.882 22.462 1.00 15.84 H new ATOM 0 HG12 VAL B 174 7.355 -4.149 21.364 1.00 15.84 H new ATOM 0 HG13 VAL B 174 8.622 -3.426 21.980 1.00 15.84 H new ATOM 0 HG21 VAL B 174 8.142 -4.155 24.809 1.00 18.32 H new ATOM 0 HG22 VAL B 174 8.531 -2.672 24.412 1.00 18.32 H new ATOM 0 HG23 VAL B 174 7.213 -2.948 25.245 1.00 18.32 H new ATOM 1340 N THR B 175 6.340 -1.951 20.409 1.00 15.52 N ATOM 1341 CA THR B 175 5.736 -2.049 19.086 1.00 17.15 C ATOM 1342 C THR B 175 6.634 -2.888 18.188 1.00 15.26 C ATOM 1343 O THR B 175 7.831 -2.946 18.404 1.00 15.08 O ATOM 1344 CB THR B 175 5.551 -0.651 18.446 1.00 17.25 C ATOM 1345 OG1 THR B 175 6.725 0.138 18.676 1.00 20.03 O ATOM 1346 CG2 THR B 175 4.352 0.075 19.043 1.00 16.49 C ATOM 0 H THR B 175 7.167 -1.715 20.402 1.00 15.52 H new ATOM 0 HA THR B 175 4.863 -2.462 19.180 1.00 17.15 H new ATOM 0 HB THR B 175 5.402 -0.773 17.495 1.00 17.25 H new ATOM 0 HG1 THR B 175 7.301 -0.040 18.091 1.00 20.03 H new ATOM 0 HG21 THR B 175 4.260 0.946 18.625 1.00 16.49 H new ATOM 0 HG22 THR B 175 3.548 -0.445 18.887 1.00 16.49 H new ATOM 0 HG23 THR B 175 4.484 0.187 19.997 1.00 16.49 H new ATOM 1347 N GLY B 176 6.057 -3.536 17.179 1.00 18.54 N ATOM 1348 CA GLY B 176 6.851 -4.243 16.190 1.00 18.01 C ATOM 1349 C GLY B 176 6.059 -5.134 15.241 1.00 15.84 C ATOM 1350 O GLY B 176 4.912 -5.481 15.481 1.00 19.33 O ATOM 0 H GLY B 176 5.207 -3.576 17.053 1.00 18.54 H new ATOM 0 HA2 GLY B 176 7.343 -3.592 15.665 1.00 18.01 H new ATOM 0 HA3 GLY B 176 7.507 -4.789 16.652 1.00 18.01 H new ATOM 1351 N TRP B 177 6.714 -5.548 14.170 1.00 17.55 N ATOM 1352 CA TRP B 177 6.095 -6.425 13.177 1.00 22.22 C ATOM 1353 C TRP B 177 6.481 -7.878 13.389 1.00 23.18 C ATOM 1354 O TRP B 177 6.348 -8.696 12.479 1.00 22.98 O ATOM 1355 CB TRP B 177 6.520 -5.991 11.776 1.00 20.35 C ATOM 1356 CG TRP B 177 5.963 -4.659 11.380 1.00 20.05 C ATOM 1357 CD1 TRP B 177 4.709 -4.415 10.896 1.00 19.86 C ATOM 1358 CD2 TRP B 177 6.635 -3.392 11.410 1.00 18.87 C ATOM 1359 NE1 TRP B 177 4.552 -3.076 10.641 1.00 18.70 N ATOM 1360 CE2 TRP B 177 5.722 -2.425 10.938 1.00 22.17 C ATOM 1361 CE3 TRP B 177 7.921 -2.982 11.800 1.00 18.49 C ATOM 1362 CZ2 TRP B 177 6.050 -1.063 10.836 1.00 18.68 C ATOM 1363 CZ3 TRP B 177 8.244 -1.642 11.700 1.00 20.53 C ATOM 1364 CH2 TRP B 177 7.313 -0.695 11.217 1.00 20.45 C ATOM 0 H TRP B 177 7.528 -5.332 13.993 1.00 17.55 H new ATOM 0 HA TRP B 177 5.133 -6.351 13.276 1.00 22.22 H new ATOM 0 HB2 TRP B 177 7.488 -5.956 11.734 1.00 20.35 H new ATOM 0 HB3 TRP B 177 6.232 -6.660 11.135 1.00 20.35 H new ATOM 0 HD1 TRP B 177 4.056 -5.063 10.759 1.00 19.86 H new ATOM 0 HE1 TRP B 177 3.836 -2.705 10.343 1.00 18.70 H new ATOM 0 HE3 TRP B 177 8.541 -3.598 12.118 1.00 18.49 H new ATOM 0 HZ2 TRP B 177 5.436 -0.438 10.523 1.00 18.68 H new ATOM 0 HZ3 TRP B 177 9.092 -1.358 11.956 1.00 20.53 H new ATOM 0 HH2 TRP B 177 7.564 0.199 11.156 1.00 20.45 H new ATOM 1365 N GLY B 178 6.974 -8.188 14.587 1.00 21.02 N ATOM 1366 CA GLY B 178 7.448 -9.519 14.901 1.00 21.56 C ATOM 1367 C GLY B 178 6.362 -10.587 14.962 1.00 30.63 C ATOM 1368 O GLY B 178 5.166 -10.296 14.869 1.00 25.12 O ATOM 0 H GLY B 178 7.040 -7.628 15.236 1.00 21.02 H new ATOM 0 HA2 GLY B 178 8.104 -9.780 14.236 1.00 21.56 H new ATOM 0 HA3 GLY B 178 7.906 -9.492 15.756 1.00 21.56 H new ATOM 1369 N ASN B 179 6.799 -11.835 15.104 1.00 26.98 N ATOM 1370 CA ASN B 179 5.906 -12.959 15.321 1.00 29.75 C ATOM 1371 C ASN B 179 4.832 -12.709 16.371 1.00 30.89 C ATOM 1372 O ASN B 179 5.078 -12.065 17.411 1.00 29.67 O ATOM 1373 CB ASN B 179 6.708 -14.181 15.737 1.00 32.17 C ATOM 1374 CG ASN B 179 7.667 -14.640 14.665 1.00 33.38 C ATOM 1375 OD1 ASN B 179 7.685 -14.109 13.555 1.00 38.02 O ATOM 1376 ND2 ASN B 179 8.474 -15.638 14.995 1.00 40.91 N ATOM 0 H ASN B 179 7.631 -12.051 15.076 1.00 26.98 H new ATOM 0 HA ASN B 179 5.452 -13.098 14.475 1.00 29.75 H new ATOM 0 HB2 ASN B 179 7.205 -13.978 16.545 1.00 32.17 H new ATOM 0 HB3 ASN B 179 6.099 -14.905 15.953 1.00 32.17 H new ATOM 0 HD21 ASN B 179 9.040 -15.940 14.423 1.00 40.91 H new ATOM 0 HD22 ASN B 179 8.431 -15.983 15.781 1.00 40.91 H new ATOM 1377 N LEU B 180 3.650 -13.251 16.096 1.00 29.44 N ATOM 1378 CA LEU B 180 2.493 -13.121 16.981 1.00 31.94 C ATOM 1379 C LEU B 180 2.453 -14.206 18.068 1.00 27.96 C ATOM 1380 O LEU B 180 1.673 -14.116 19.020 1.00 31.63 O ATOM 1381 CB LEU B 180 1.205 -13.171 16.151 1.00 29.87 C ATOM 1382 CG LEU B 180 1.084 -12.108 15.057 1.00 33.87 C ATOM 1383 CD1 LEU B 180 -0.015 -12.468 14.054 1.00 31.71 C ATOM 1384 CD2 LEU B 180 0.840 -10.726 15.682 1.00 30.23 C ATOM 0 H LEU B 180 3.494 -13.709 15.385 1.00 29.44 H new ATOM 0 HA LEU B 180 2.570 -12.267 17.434 1.00 31.94 H new ATOM 0 HB2 LEU B 180 1.139 -14.046 15.738 1.00 29.87 H new ATOM 0 HB3 LEU B 180 0.448 -13.082 16.751 1.00 29.87 H new ATOM 0 HG LEU B 180 1.921 -12.076 14.568 1.00 33.87 H new ATOM 0 HD11 LEU B 180 -0.070 -11.779 13.373 1.00 31.71 H new ATOM 0 HD12 LEU B 180 0.193 -13.319 13.637 1.00 31.71 H new ATOM 0 HD13 LEU B 180 -0.866 -12.535 14.516 1.00 31.71 H new ATOM 0 HD21 LEU B 180 0.765 -10.062 14.979 1.00 30.23 H new ATOM 0 HD22 LEU B 180 0.019 -10.744 16.198 1.00 30.23 H new ATOM 0 HD23 LEU B 180 1.582 -10.498 16.264 1.00 30.23 H new ATOM 1385 N LYS B 181 3.271 -15.240 17.907 1.00 23.36 N ATOM 1386 CA LYS B 181 3.355 -16.314 18.899 1.00 33.23 C ATOM 1387 C LYS B 181 4.717 -16.997 18.810 1.00 30.35 C ATOM 1388 O LYS B 181 5.440 -16.827 17.834 1.00 29.33 O ATOM 1389 CB LYS B 181 2.222 -17.325 18.713 1.00 37.21 C ATOM 1390 CG LYS B 181 1.976 -17.724 17.267 1.00 45.43 C ATOM 1391 CD LYS B 181 0.832 -18.725 17.153 1.00 55.37 C ATOM 1392 CE LYS B 181 0.674 -19.234 15.717 1.00 65.94 C ATOM 1393 NZ LYS B 181 -0.521 -20.121 15.560 1.00 63.66 N ATOM 0 H LYS B 181 3.789 -15.342 17.228 1.00 23.36 H new ATOM 0 HA LYS B 181 3.258 -15.927 19.783 1.00 33.23 H new ATOM 0 HB2 LYS B 181 2.425 -18.122 19.228 1.00 37.21 H new ATOM 0 HB3 LYS B 181 1.405 -16.951 19.079 1.00 37.21 H new ATOM 0 HG2 LYS B 181 1.771 -16.934 16.742 1.00 45.43 H new ATOM 0 HG3 LYS B 181 2.784 -18.110 16.894 1.00 45.43 H new ATOM 0 HD2 LYS B 181 0.995 -19.474 17.747 1.00 55.37 H new ATOM 0 HD3 LYS B 181 0.005 -18.308 17.443 1.00 55.37 H new ATOM 0 HE2 LYS B 181 0.595 -18.478 15.114 1.00 65.94 H new ATOM 0 HE3 LYS B 181 1.472 -19.721 15.458 1.00 65.94 H new ATOM 0 HZ1 LYS B 181 -0.578 -20.395 14.715 1.00 63.66 H new ATOM 0 HZ2 LYS B 181 -0.439 -20.827 16.096 1.00 63.66 H new ATOM 0 HZ3 LYS B 181 -1.257 -19.669 15.775 1.00 63.66 H new ATOM 1394 N GLU B 182 5.079 -17.748 19.840 1.00 31.78 N ATOM 1395 CA GLU B 182 6.413 -18.342 19.906 1.00 38.05 C ATOM 1396 C GLU B 182 6.658 -19.373 18.791 1.00 40.65 C ATOM 1397 O GLU B 182 7.741 -19.407 18.198 1.00 32.43 O ATOM 1398 CB GLU B 182 6.655 -18.965 21.284 1.00 33.05 C ATOM 1399 CG GLU B 182 8.109 -19.263 21.557 1.00 36.73 C ATOM 1400 CD GLU B 182 8.318 -20.022 22.855 1.00 36.55 C ATOM 1401 OE1 GLU B 182 7.728 -19.645 23.893 1.00 35.40 O ATOM 1402 OE2 GLU B 182 9.080 -21.005 22.827 1.00 44.33 O ATOM 0 H GLU B 182 4.572 -17.928 20.511 1.00 31.78 H new ATOM 0 HA GLU B 182 7.050 -17.624 19.767 1.00 38.05 H new ATOM 0 HB2 GLU B 182 6.321 -18.363 21.967 1.00 33.05 H new ATOM 0 HB3 GLU B 182 6.144 -19.786 21.355 1.00 33.05 H new ATOM 0 HG2 GLU B 182 8.473 -19.781 20.822 1.00 36.73 H new ATOM 0 HG3 GLU B 182 8.605 -18.430 21.590 1.00 36.73 H new ATOM 1403 N GLY B 185 0.676 -16.271 11.542 1.00 45.59 N ATOM 1404 CA GLY B 185 1.780 -16.208 12.489 1.00 41.26 C ATOM 1405 C GLY B 185 2.538 -14.884 12.463 1.00 42.47 C ATOM 1406 O GLY B 185 3.309 -14.568 13.370 1.00 35.11 O ATOM 0 HA2 GLY B 185 1.437 -16.357 13.384 1.00 41.26 H new ATOM 0 HA3 GLY B 185 2.400 -16.930 12.299 1.00 41.26 H new ATOM 1407 N GLN B 186 2.326 -14.102 11.413 1.00 41.00 N ATOM 1408 CA GLN B 186 2.930 -12.778 11.319 1.00 40.66 C ATOM 1409 C GLN B 186 1.850 -11.746 11.004 1.00 42.43 C ATOM 1410 O GLN B 186 0.895 -12.051 10.279 1.00 37.28 O ATOM 1411 CB GLN B 186 4.035 -12.780 10.277 1.00 41.12 C ATOM 1412 CG GLN B 186 5.186 -13.696 10.670 1.00 50.09 C ATOM 1413 CD GLN B 186 5.931 -14.269 9.477 1.00 58.87 C ATOM 1414 OE1 GLN B 186 5.460 -14.196 8.339 1.00 66.82 O ATOM 1415 NE2 GLN B 186 7.100 -14.854 9.735 1.00 64.80 N ATOM 0 H GLN B 186 1.834 -14.319 10.742 1.00 41.00 H new ATOM 0 HA GLN B 186 3.334 -12.539 12.168 1.00 40.66 H new ATOM 0 HB2 GLN B 186 3.673 -13.064 9.423 1.00 41.12 H new ATOM 0 HB3 GLN B 186 4.368 -11.877 10.157 1.00 41.12 H new ATOM 0 HG2 GLN B 186 5.809 -13.202 11.226 1.00 50.09 H new ATOM 0 HG3 GLN B 186 4.841 -14.425 11.209 1.00 50.09 H new ATOM 0 HE21 GLN B 186 7.396 -14.886 10.542 1.00 64.80 H new ATOM 0 HE22 GLN B 186 7.558 -15.200 9.095 1.00 64.80 H new ATOM 1416 N PRO B 187 1.972 -10.534 11.582 1.00 36.76 N ATOM 1417 CA PRO B 187 0.876 -9.554 11.518 1.00 30.95 C ATOM 1418 C PRO B 187 0.875 -8.857 10.164 1.00 25.93 C ATOM 1419 O PRO B 187 1.910 -8.808 9.492 1.00 26.79 O ATOM 1420 CB PRO B 187 1.251 -8.550 12.627 1.00 22.73 C ATOM 1421 CG PRO B 187 2.753 -8.560 12.584 1.00 26.14 C ATOM 1422 CD PRO B 187 3.094 -10.035 12.400 1.00 32.24 C ATOM 0 HA PRO B 187 -0.003 -9.948 11.631 1.00 30.95 H new ATOM 0 HB2 PRO B 187 0.891 -7.667 12.451 1.00 22.73 H new ATOM 0 HB3 PRO B 187 0.913 -8.826 13.493 1.00 22.73 H new ATOM 0 HG2 PRO B 187 3.093 -8.021 11.853 1.00 26.14 H new ATOM 0 HG3 PRO B 187 3.136 -8.204 13.401 1.00 26.14 H new ATOM 0 HD2 PRO B 187 3.946 -10.154 11.952 1.00 32.24 H new ATOM 0 HD3 PRO B 187 3.153 -10.499 13.250 1.00 32.24 H new ATOM 1423 N SER B 188 -0.267 -8.319 9.757 1.00 26.89 N ATOM 1424 CA SER B 188 -0.291 -7.544 8.525 1.00 27.18 C ATOM 1425 C SER B 188 0.071 -6.097 8.833 1.00 24.29 C ATOM 1426 O SER B 188 0.578 -5.375 7.979 1.00 28.07 O ATOM 1427 CB SER B 188 -1.646 -7.641 7.818 1.00 30.60 C ATOM 1428 OG SER B 188 -2.715 -7.407 8.712 1.00 41.93 O ATOM 0 H SER B 188 -1.020 -8.387 10.166 1.00 26.89 H new ATOM 0 HA SER B 188 0.366 -7.913 7.914 1.00 27.18 H new ATOM 0 HB2 SER B 188 -1.681 -6.996 7.094 1.00 30.60 H new ATOM 0 HB3 SER B 188 -1.742 -8.520 7.420 1.00 30.60 H new ATOM 0 HG SER B 188 -3.444 -7.465 8.299 1.00 41.93 H new ATOM 1429 N VAL B 189 -0.162 -5.698 10.073 1.00 22.24 N ATOM 1430 CA VAL B 189 0.027 -4.314 10.495 1.00 24.97 C ATOM 1431 C VAL B 189 0.863 -4.257 11.798 1.00 23.09 C ATOM 1432 O VAL B 189 0.923 -5.240 12.544 1.00 20.48 O ATOM 1433 CB VAL B 189 -1.363 -3.638 10.664 1.00 26.12 C ATOM 1434 CG1 VAL B 189 -1.386 -2.669 11.820 1.00 29.71 C ATOM 1435 CG2 VAL B 189 -1.808 -2.980 9.361 1.00 27.07 C ATOM 0 H VAL B 189 -0.435 -6.222 10.698 1.00 22.24 H new ATOM 0 HA VAL B 189 0.522 -3.826 9.819 1.00 24.97 H new ATOM 0 HB VAL B 189 -2.003 -4.335 10.878 1.00 26.12 H new ATOM 0 HG11 VAL B 189 -2.267 -2.270 11.891 1.00 29.71 H new ATOM 0 HG12 VAL B 189 -1.178 -3.140 12.642 1.00 29.71 H new ATOM 0 HG13 VAL B 189 -0.728 -1.972 11.672 1.00 29.71 H new ATOM 0 HG21 VAL B 189 -2.676 -2.565 9.488 1.00 27.07 H new ATOM 0 HG22 VAL B 189 -1.162 -2.305 9.102 1.00 27.07 H new ATOM 0 HG23 VAL B 189 -1.870 -3.652 8.664 1.00 27.07 H new ATOM 1436 N LEU B 190 1.511 -3.118 12.046 1.00 19.93 N ATOM 1437 CA LEU B 190 2.290 -2.907 13.254 1.00 22.50 C ATOM 1438 C LEU B 190 1.462 -3.243 14.497 1.00 19.67 C ATOM 1439 O LEU B 190 0.307 -2.828 14.614 1.00 22.71 O ATOM 1440 CB LEU B 190 2.794 -1.466 13.321 1.00 22.35 C ATOM 1441 CG LEU B 190 3.725 -1.119 14.501 1.00 22.41 C ATOM 1442 CD1 LEU B 190 5.147 -1.661 14.259 1.00 15.84 C ATOM 1443 CD2 LEU B 190 3.757 0.412 14.700 1.00 18.48 C ATOM 0 H LEU B 190 1.508 -2.445 11.511 1.00 19.93 H new ATOM 0 HA LEU B 190 3.057 -3.500 13.229 1.00 22.50 H new ATOM 0 HB2 LEU B 190 3.264 -1.269 12.495 1.00 22.35 H new ATOM 0 HB3 LEU B 190 2.025 -0.876 13.357 1.00 22.35 H new ATOM 0 HG LEU B 190 3.381 -1.539 15.305 1.00 22.41 H new ATOM 0 HD11 LEU B 190 5.714 -1.431 15.012 1.00 15.84 H new ATOM 0 HD12 LEU B 190 5.114 -2.626 14.162 1.00 15.84 H new ATOM 0 HD13 LEU B 190 5.510 -1.268 13.450 1.00 15.84 H new ATOM 0 HD21 LEU B 190 4.342 0.630 15.442 1.00 18.48 H new ATOM 0 HD22 LEU B 190 4.087 0.837 13.893 1.00 18.48 H new ATOM 0 HD23 LEU B 190 2.862 0.733 14.890 1.00 18.48 H new ATOM 1444 N GLN B 191 2.061 -4.018 15.400 1.00 16.59 N ATOM 1445 CA GLN B 191 1.421 -4.444 16.637 1.00 21.11 C ATOM 1446 C GLN B 191 1.928 -3.630 17.826 1.00 22.42 C ATOM 1447 O GLN B 191 3.070 -3.157 17.832 1.00 17.64 O ATOM 1448 CB GLN B 191 1.697 -5.925 16.886 1.00 19.46 C ATOM 1449 CG GLN B 191 1.180 -6.823 15.772 1.00 19.75 C ATOM 1450 CD GLN B 191 -0.323 -6.781 15.677 1.00 23.28 C ATOM 1451 OE1 GLN B 191 -1.013 -7.170 16.615 1.00 19.16 O ATOM 1452 NE2 GLN B 191 -0.845 -6.284 14.549 1.00 21.79 N ATOM 0 H GLN B 191 2.863 -4.314 15.307 1.00 16.59 H new ATOM 0 HA GLN B 191 0.466 -4.299 16.545 1.00 21.11 H new ATOM 0 HB2 GLN B 191 2.653 -6.058 16.985 1.00 19.46 H new ATOM 0 HB3 GLN B 191 1.286 -6.189 17.724 1.00 19.46 H new ATOM 0 HG2 GLN B 191 1.566 -6.546 14.927 1.00 19.75 H new ATOM 0 HG3 GLN B 191 1.469 -7.735 15.930 1.00 19.75 H new ATOM 0 HE21 GLN B 191 -0.327 -6.022 13.914 1.00 21.79 H new ATOM 0 HE22 GLN B 191 -1.698 -6.227 14.459 1.00 21.79 H new ATOM 1453 N VAL B 192 1.072 -3.483 18.830 1.00 21.11 N ATOM 1454 CA VAL B 192 1.403 -2.711 20.023 1.00 21.65 C ATOM 1455 C VAL B 192 0.998 -3.496 21.271 1.00 19.47 C ATOM 1456 O VAL B 192 -0.016 -4.179 21.277 1.00 18.45 O ATOM 1457 CB VAL B 192 0.700 -1.313 20.021 1.00 21.58 C ATOM 1458 CG1 VAL B 192 -0.800 -1.473 20.015 1.00 25.21 C ATOM 1459 CG2 VAL B 192 1.125 -0.476 21.220 1.00 17.16 C ATOM 0 H VAL B 192 0.284 -3.827 18.840 1.00 21.11 H new ATOM 0 HA VAL B 192 2.361 -2.559 20.026 1.00 21.65 H new ATOM 0 HB VAL B 192 0.974 -0.850 19.214 1.00 21.58 H new ATOM 0 HG11 VAL B 192 -1.219 -0.598 20.014 1.00 25.21 H new ATOM 0 HG12 VAL B 192 -1.070 -1.962 19.222 1.00 25.21 H new ATOM 0 HG13 VAL B 192 -1.077 -1.962 20.806 1.00 25.21 H new ATOM 0 HG21 VAL B 192 0.674 0.382 21.192 1.00 17.16 H new ATOM 0 HG22 VAL B 192 0.887 -0.939 22.039 1.00 17.16 H new ATOM 0 HG23 VAL B 192 2.085 -0.338 21.194 1.00 17.16 H new ATOM 1460 N VAL B 193 1.788 -3.382 22.331 1.00 21.84 N ATOM 1461 CA VAL B 193 1.421 -3.956 23.621 1.00 18.85 C ATOM 1462 C VAL B 193 2.023 -3.110 24.741 1.00 23.00 C ATOM 1463 O VAL B 193 3.134 -2.598 24.597 1.00 22.59 O ATOM 1464 CB VAL B 193 1.868 -5.436 23.735 1.00 21.56 C ATOM 1465 CG1 VAL B 193 3.400 -5.542 23.756 1.00 18.63 C ATOM 1466 CG2 VAL B 193 1.242 -6.112 24.962 1.00 23.24 C ATOM 0 H VAL B 193 2.545 -2.974 22.325 1.00 21.84 H new ATOM 0 HA VAL B 193 0.454 -3.948 23.701 1.00 18.85 H new ATOM 0 HB VAL B 193 1.548 -5.908 22.950 1.00 21.56 H new ATOM 0 HG11 VAL B 193 3.659 -6.474 23.828 1.00 18.63 H new ATOM 0 HG12 VAL B 193 3.762 -5.168 22.937 1.00 18.63 H new ATOM 0 HG13 VAL B 193 3.748 -5.051 24.516 1.00 18.63 H new ATOM 0 HG21 VAL B 193 1.537 -7.035 25.009 1.00 23.24 H new ATOM 0 HG22 VAL B 193 1.517 -5.643 25.765 1.00 23.24 H new ATOM 0 HG23 VAL B 193 0.275 -6.086 24.888 1.00 23.24 H new ATOM 1467 N ASN B 194 1.276 -2.962 25.837 1.00 21.23 N ATOM 1468 CA ASN B 194 1.698 -2.220 27.009 1.00 18.91 C ATOM 1469 C ASN B 194 2.061 -3.193 28.137 1.00 23.40 C ATOM 1470 O ASN B 194 1.327 -4.143 28.415 1.00 26.27 O ATOM 1471 CB ASN B 194 0.566 -1.273 27.452 1.00 19.26 C ATOM 1472 CG ASN B 194 0.182 -0.262 26.367 1.00 25.63 C ATOM 1473 OD1 ASN B 194 1.033 0.187 25.584 1.00 17.63 O ATOM 1474 ND2 ASN B 194 -1.102 0.112 26.326 1.00 24.84 N ATOM 0 H ASN B 194 0.490 -3.302 25.914 1.00 21.23 H new ATOM 0 HA ASN B 194 2.483 -1.691 26.795 1.00 18.91 H new ATOM 0 HB2 ASN B 194 -0.214 -1.797 27.691 1.00 19.26 H new ATOM 0 HB3 ASN B 194 0.842 -0.796 28.250 1.00 19.26 H new ATOM 0 HD21 ASN B 194 -1.365 0.685 25.741 1.00 24.84 H new ATOM 0 HD22 ASN B 194 -1.665 -0.220 26.885 1.00 24.84 H new ATOM 1475 N LEU B 195 3.188 -2.966 28.793 1.00 18.67 N ATOM 1476 CA LEU B 195 3.686 -3.923 29.785 1.00 23.55 C ATOM 1477 C LEU B 195 4.306 -3.205 30.959 1.00 21.24 C ATOM 1478 O LEU B 195 4.937 -2.162 30.783 1.00 22.47 O ATOM 1479 CB LEU B 195 4.754 -4.839 29.173 1.00 20.19 C ATOM 1480 CG LEU B 195 4.338 -5.750 28.015 1.00 28.53 C ATOM 1481 CD1 LEU B 195 5.592 -6.324 27.348 1.00 29.38 C ATOM 1482 CD2 LEU B 195 3.408 -6.872 28.477 1.00 22.74 C ATOM 0 H LEU B 195 3.681 -2.270 28.684 1.00 18.67 H new ATOM 0 HA LEU B 195 2.927 -4.449 30.080 1.00 23.55 H new ATOM 0 HB2 LEU B 195 5.484 -4.280 28.864 1.00 20.19 H new ATOM 0 HB3 LEU B 195 5.106 -5.400 29.881 1.00 20.19 H new ATOM 0 HG LEU B 195 3.841 -5.220 27.372 1.00 28.53 H new ATOM 0 HD11 LEU B 195 5.332 -6.902 26.614 1.00 29.38 H new ATOM 0 HD12 LEU B 195 6.140 -5.598 27.010 1.00 29.38 H new ATOM 0 HD13 LEU B 195 6.099 -6.836 27.998 1.00 29.38 H new ATOM 0 HD21 LEU B 195 3.167 -7.426 27.718 1.00 22.74 H new ATOM 0 HD22 LEU B 195 3.860 -7.414 29.142 1.00 22.74 H new ATOM 0 HD23 LEU B 195 2.606 -6.489 28.864 1.00 22.74 H new ATOM 1483 N PRO B 196 4.152 -3.768 32.165 1.00 20.57 N ATOM 1484 CA PRO B 196 4.792 -3.191 33.352 1.00 16.23 C ATOM 1485 C PRO B 196 6.274 -3.568 33.501 1.00 20.14 C ATOM 1486 O PRO B 196 6.649 -4.705 33.192 1.00 18.33 O ATOM 1487 CB PRO B 196 4.010 -3.821 34.521 1.00 19.46 C ATOM 1488 CG PRO B 196 3.078 -4.854 33.908 1.00 23.38 C ATOM 1489 CD PRO B 196 3.411 -5.006 32.470 1.00 23.65 C ATOM 0 HA PRO B 196 4.773 -2.222 33.309 1.00 16.23 H new ATOM 0 HB2 PRO B 196 4.614 -4.235 35.157 1.00 19.46 H new ATOM 0 HB3 PRO B 196 3.508 -3.146 35.004 1.00 19.46 H new ATOM 0 HG2 PRO B 196 3.171 -5.704 34.366 1.00 23.38 H new ATOM 0 HG3 PRO B 196 2.154 -4.576 34.011 1.00 23.38 H new ATOM 0 HD2 PRO B 196 3.950 -5.796 32.308 1.00 23.65 H new ATOM 0 HD3 PRO B 196 2.614 -5.090 31.924 1.00 23.65 H new ATOM 1490 N ILE B 197 7.078 -2.623 33.990 1.00 18.35 N ATOM 1491 CA ILE B 197 8.436 -2.872 34.438 1.00 20.90 C ATOM 1492 C ILE B 197 8.362 -3.838 35.620 1.00 23.06 C ATOM 1493 O ILE B 197 7.480 -3.719 36.461 1.00 18.72 O ATOM 1494 CB ILE B 197 9.106 -1.574 34.946 1.00 22.13 C ATOM 1495 CG1 ILE B 197 9.163 -0.502 33.853 1.00 19.82 C ATOM 1496 CG2 ILE B 197 10.502 -1.863 35.501 1.00 22.38 C ATOM 1497 CD1 ILE B 197 9.744 -1.027 32.597 1.00 30.69 C ATOM 0 H ILE B 197 6.837 -1.801 34.070 1.00 18.35 H new ATOM 0 HA ILE B 197 8.951 -3.226 33.696 1.00 20.90 H new ATOM 0 HB ILE B 197 8.558 -1.226 35.667 1.00 22.13 H new ATOM 0 HG12 ILE B 197 8.269 -0.168 33.681 1.00 19.82 H new ATOM 0 HG13 ILE B 197 9.691 0.249 34.164 1.00 19.82 H new ATOM 0 HG21 ILE B 197 10.904 -1.037 35.813 1.00 22.38 H new ATOM 0 HG22 ILE B 197 10.434 -2.489 36.239 1.00 22.38 H new ATOM 0 HG23 ILE B 197 11.055 -2.247 34.803 1.00 22.38 H new ATOM 0 HD11 ILE B 197 9.764 -0.323 31.930 1.00 30.69 H new ATOM 0 HD12 ILE B 197 10.647 -1.339 32.764 1.00 30.69 H new ATOM 0 HD13 ILE B 197 9.202 -1.763 32.273 1.00 30.69 H new ATOM 1498 N VAL B 198 9.287 -4.784 35.694 1.00 21.44 N ATOM 1499 CA VAL B 198 9.248 -5.785 36.768 1.00 23.87 C ATOM 1500 C VAL B 198 10.418 -5.572 37.750 1.00 20.23 C ATOM 1501 O VAL B 198 11.499 -5.141 37.352 1.00 22.53 O ATOM 1502 CB VAL B 198 9.201 -7.214 36.177 1.00 20.82 C ATOM 1503 CG1 VAL B 198 9.370 -8.294 37.237 1.00 23.89 C ATOM 1504 CG2 VAL B 198 7.902 -7.407 35.419 1.00 22.26 C ATOM 0 H VAL B 198 9.941 -4.870 35.143 1.00 21.44 H new ATOM 0 HA VAL B 198 8.433 -5.673 37.282 1.00 23.87 H new ATOM 0 HB VAL B 198 9.952 -7.305 35.570 1.00 20.82 H new ATOM 0 HG11 VAL B 198 9.333 -9.168 36.818 1.00 23.89 H new ATOM 0 HG12 VAL B 198 10.227 -8.183 37.678 1.00 23.89 H new ATOM 0 HG13 VAL B 198 8.658 -8.220 37.891 1.00 23.89 H new ATOM 0 HG21 VAL B 198 7.873 -8.303 35.049 1.00 22.26 H new ATOM 0 HG22 VAL B 198 7.153 -7.283 36.023 1.00 22.26 H new ATOM 0 HG23 VAL B 198 7.847 -6.759 34.700 1.00 22.26 H new ATOM 1505 N GLU B 199 10.191 -5.837 39.033 1.00 24.71 N ATOM 1506 CA GLU B 199 11.245 -5.700 40.043 1.00 25.09 C ATOM 1507 C GLU B 199 12.477 -6.539 39.660 1.00 23.11 C ATOM 1508 O GLU B 199 12.344 -7.668 39.181 1.00 20.48 O ATOM 1509 CB GLU B 199 10.749 -6.138 41.433 1.00 31.35 C ATOM 1510 CG GLU B 199 9.497 -5.437 41.937 1.00 37.36 C ATOM 1511 CD GLU B 199 8.192 -6.145 41.543 1.00 46.70 C ATOM 1512 OE1 GLU B 199 8.111 -6.711 40.427 1.00 38.70 O ATOM 1513 OE2 GLU B 199 7.234 -6.118 42.354 1.00 59.91 O ATOM 0 H GLU B 199 9.433 -6.098 39.343 1.00 24.71 H new ATOM 0 HA GLU B 199 11.489 -4.762 40.078 1.00 25.09 H new ATOM 0 HB2 GLU B 199 10.579 -7.093 41.412 1.00 31.35 H new ATOM 0 HB3 GLU B 199 11.462 -5.991 42.074 1.00 31.35 H new ATOM 0 HG2 GLU B 199 9.540 -5.370 42.904 1.00 37.36 H new ATOM 0 HG3 GLU B 199 9.481 -4.531 41.591 1.00 37.36 H new ATOM 1514 N ARG B 200 13.661 -5.980 39.896 1.00 18.86 N ATOM 1515 CA ARG B 200 14.943 -6.611 39.552 1.00 25.84 C ATOM 1516 C ARG B 200 15.132 -8.061 40.069 1.00 26.93 C ATOM 1517 O ARG B 200 15.538 -8.939 39.296 1.00 25.55 O ATOM 1518 CB ARG B 200 16.123 -5.684 39.940 1.00 32.12 C ATOM 1519 CG ARG B 200 17.542 -6.206 39.597 1.00 42.66 C ATOM 1520 CD ARG B 200 18.546 -5.053 39.317 1.00 42.98 C ATOM 1521 NE ARG B 200 18.004 -4.102 38.335 1.00 47.44 N ATOM 1522 CZ ARG B 200 18.313 -4.075 37.035 1.00 37.60 C ATOM 1523 NH1 ARG B 200 17.733 -3.173 36.238 1.00 38.02 N ATOM 1524 NH2 ARG B 200 19.197 -4.934 36.525 1.00 26.70 N ATOM 0 H ARG B 200 13.748 -5.209 40.267 1.00 18.86 H new ATOM 0 HA ARG B 200 14.930 -6.720 38.588 1.00 25.84 H new ATOM 0 HB2 ARG B 200 15.997 -4.829 39.499 1.00 32.12 H new ATOM 0 HB3 ARG B 200 16.081 -5.520 40.895 1.00 32.12 H new ATOM 0 HG2 ARG B 200 17.871 -6.747 40.332 1.00 42.66 H new ATOM 0 HG3 ARG B 200 17.492 -6.784 38.820 1.00 42.66 H new ATOM 0 HD2 ARG B 200 18.747 -4.588 40.144 1.00 42.98 H new ATOM 0 HD3 ARG B 200 19.381 -5.421 38.988 1.00 42.98 H new ATOM 0 HE ARG B 200 17.443 -3.516 38.620 1.00 47.44 H new ATOM 0 HH11 ARG B 200 17.165 -2.615 36.562 1.00 38.02 H new ATOM 0 HH12 ARG B 200 17.928 -3.151 35.401 1.00 38.02 H new ATOM 0 HH21 ARG B 200 19.576 -5.514 37.034 1.00 26.70 H new ATOM 0 HH22 ARG B 200 19.388 -4.907 35.687 1.00 26.70 H new ATOM 1525 N PRO B 201 14.814 -8.318 41.358 1.00 24.63 N ATOM 1526 CA PRO B 201 14.908 -9.656 41.976 1.00 26.02 C ATOM 1527 C PRO B 201 14.047 -10.700 41.278 1.00 23.82 C ATOM 1528 O PRO B 201 14.463 -11.850 41.136 1.00 25.78 O ATOM 1529 CB PRO B 201 14.369 -9.426 43.397 1.00 25.22 C ATOM 1530 CG PRO B 201 14.645 -7.967 43.668 1.00 27.98 C ATOM 1531 CD PRO B 201 14.417 -7.291 42.342 1.00 28.86 C ATOM 0 HA PRO B 201 15.815 -9.998 41.932 1.00 26.02 H new ATOM 0 HB2 PRO B 201 13.421 -9.623 43.452 1.00 25.22 H new ATOM 0 HB3 PRO B 201 14.816 -9.997 44.042 1.00 25.22 H new ATOM 0 HG2 PRO B 201 14.052 -7.616 44.351 1.00 27.98 H new ATOM 0 HG3 PRO B 201 15.552 -7.831 43.983 1.00 27.98 H new ATOM 0 HD2 PRO B 201 13.490 -7.028 42.230 1.00 28.86 H new ATOM 0 HD3 PRO B 201 14.952 -6.487 42.254 1.00 28.86 H new ATOM 1532 N VAL B 202 12.851 -10.291 40.861 1.00 23.97 N ATOM 1533 CA VAL B 202 11.969 -11.140 40.083 1.00 21.65 C ATOM 1534 C VAL B 202 12.575 -11.400 38.699 1.00 24.94 C ATOM 1535 O VAL B 202 12.488 -12.511 38.185 1.00 23.08 O ATOM 1536 CB VAL B 202 10.567 -10.509 39.949 1.00 26.35 C ATOM 1537 CG1 VAL B 202 9.634 -11.426 39.163 1.00 16.93 C ATOM 1538 CG2 VAL B 202 9.999 -10.210 41.334 1.00 23.83 C ATOM 0 H VAL B 202 12.532 -9.509 41.025 1.00 23.97 H new ATOM 0 HA VAL B 202 11.872 -11.986 40.548 1.00 21.65 H new ATOM 0 HB VAL B 202 10.644 -9.676 39.458 1.00 26.35 H new ATOM 0 HG11 VAL B 202 8.760 -11.013 39.090 1.00 16.93 H new ATOM 0 HG12 VAL B 202 9.997 -11.573 38.276 1.00 16.93 H new ATOM 0 HG13 VAL B 202 9.552 -12.276 39.623 1.00 16.93 H new ATOM 0 HG21 VAL B 202 9.118 -9.814 41.244 1.00 23.83 H new ATOM 0 HG22 VAL B 202 9.932 -11.034 41.841 1.00 23.83 H new ATOM 0 HG23 VAL B 202 10.585 -9.592 41.798 1.00 23.83 H new ATOM 1539 N CYS B 203 13.195 -10.382 38.099 1.00 22.97 N ATOM 1540 CA CYS B 203 13.891 -10.585 36.819 1.00 20.27 C ATOM 1541 C CYS B 203 15.033 -11.589 36.961 1.00 22.93 C ATOM 1542 O CYS B 203 15.154 -12.508 36.151 1.00 20.01 O ATOM 1543 CB CYS B 203 14.425 -9.278 36.259 1.00 18.58 C ATOM 1544 SG CYS B 203 13.156 -8.017 35.845 1.00 22.51 S ATOM 0 H CYS B 203 13.227 -9.580 38.407 1.00 22.97 H new ATOM 0 HA CYS B 203 13.237 -10.941 36.198 1.00 20.27 H new ATOM 0 HB2 CYS B 203 15.040 -8.895 36.904 1.00 18.58 H new ATOM 0 HB3 CYS B 203 14.938 -9.473 35.459 1.00 18.58 H new ATOM 1545 N LYS B 204 15.853 -11.411 38.001 1.00 22.09 N ATOM 1546 CA LYS B 204 16.967 -12.307 38.268 1.00 24.37 C ATOM 1547 C LYS B 204 16.523 -13.763 38.504 1.00 20.50 C ATOM 1548 O LYS B 204 17.081 -14.691 37.915 1.00 22.53 O ATOM 1549 CB LYS B 204 17.811 -11.791 39.444 1.00 29.06 C ATOM 1550 CG LYS B 204 18.846 -10.746 39.027 1.00 39.94 C ATOM 1551 CD LYS B 204 19.668 -10.209 40.190 1.00 40.63 C ATOM 1552 CE LYS B 204 20.456 -8.957 39.770 1.00 49.33 C ATOM 1553 NZ LYS B 204 21.101 -8.234 40.920 1.00 54.19 N ATOM 0 H LYS B 204 15.774 -10.768 38.566 1.00 22.09 H new ATOM 0 HA LYS B 204 17.516 -12.314 37.469 1.00 24.37 H new ATOM 0 HB2 LYS B 204 17.223 -11.407 40.113 1.00 29.06 H new ATOM 0 HB3 LYS B 204 18.265 -12.539 39.862 1.00 29.06 H new ATOM 0 HG2 LYS B 204 19.444 -11.137 38.371 1.00 39.94 H new ATOM 0 HG3 LYS B 204 18.392 -10.007 38.592 1.00 39.94 H new ATOM 0 HD2 LYS B 204 19.083 -9.994 40.933 1.00 40.63 H new ATOM 0 HD3 LYS B 204 20.281 -10.893 40.501 1.00 40.63 H new ATOM 0 HE2 LYS B 204 21.142 -9.215 39.135 1.00 49.33 H new ATOM 0 HE3 LYS B 204 19.858 -8.348 39.310 1.00 49.33 H new ATOM 0 HZ1 LYS B 204 21.540 -7.522 40.615 1.00 54.19 H new ATOM 0 HZ2 LYS B 204 20.474 -7.972 41.495 1.00 54.19 H new ATOM 0 HZ3 LYS B 204 21.671 -8.780 41.332 1.00 54.19 H new ATOM 1554 N ASP B 205 15.516 -13.947 39.355 1.00 22.26 N ATOM 1555 CA ASP B 205 15.026 -15.276 39.745 1.00 21.98 C ATOM 1556 C ASP B 205 14.234 -16.037 38.667 1.00 23.42 C ATOM 1557 O ASP B 205 13.844 -17.193 38.879 1.00 24.93 O ATOM 1558 CB ASP B 205 14.165 -15.163 41.011 1.00 26.34 C ATOM 1559 CG ASP B 205 14.998 -14.968 42.273 1.00 26.96 C ATOM 1560 OD1 ASP B 205 16.240 -14.969 42.170 1.00 23.68 O ATOM 1561 OD2 ASP B 205 14.403 -14.820 43.361 1.00 35.46 O ATOM 0 H ASP B 205 15.091 -13.299 39.728 1.00 22.26 H new ATOM 0 HA ASP B 205 15.828 -15.799 39.898 1.00 21.98 H new ATOM 0 HB2 ASP B 205 13.551 -14.418 40.915 1.00 26.34 H new ATOM 0 HB3 ASP B 205 13.626 -15.964 41.104 1.00 26.34 H new ATOM 1562 N SER B 206 13.978 -15.400 37.527 1.00 23.30 N ATOM 1563 CA SER B 206 13.236 -16.050 36.435 1.00 23.01 C ATOM 1564 C SER B 206 14.146 -16.767 35.438 1.00 22.18 C ATOM 1565 O SER B 206 13.677 -17.487 34.560 1.00 27.26 O ATOM 1566 CB SER B 206 12.387 -15.030 35.670 1.00 25.06 C ATOM 1567 OG SER B 206 13.208 -14.161 34.891 1.00 23.84 O ATOM 0 H SER B 206 14.223 -14.592 37.361 1.00 23.30 H new ATOM 0 HA SER B 206 12.670 -16.713 36.860 1.00 23.01 H new ATOM 0 HB2 SER B 206 11.762 -15.494 35.092 1.00 25.06 H new ATOM 0 HB3 SER B 206 11.861 -14.508 36.296 1.00 25.06 H new ATOM 0 HG SER B 206 13.719 -13.729 35.398 1.00 23.84 H new ATOM 1568 N THR B 207 15.447 -16.558 35.547 1.00 20.80 N ATOM 1569 CA THR B 207 16.338 -17.030 34.486 1.00 26.62 C ATOM 1570 C THR B 207 17.701 -17.488 35.023 1.00 21.91 C ATOM 1571 O THR B 207 18.085 -17.145 36.137 1.00 23.61 O ATOM 1572 CB THR B 207 16.532 -15.927 33.417 1.00 26.64 C ATOM 1573 OG1 THR B 207 17.455 -16.369 32.413 1.00 21.09 O ATOM 1574 CG2 THR B 207 17.040 -14.620 34.071 1.00 19.81 C ATOM 0 H THR B 207 15.832 -16.158 36.204 1.00 20.80 H new ATOM 0 HA THR B 207 15.913 -17.803 34.083 1.00 26.62 H new ATOM 0 HB THR B 207 15.675 -15.749 32.999 1.00 26.64 H new ATOM 0 HG1 THR B 207 17.030 -16.636 31.740 1.00 21.09 H new ATOM 0 HG21 THR B 207 17.156 -13.940 33.389 1.00 19.81 H new ATOM 0 HG22 THR B 207 16.394 -14.313 34.726 1.00 19.81 H new ATOM 0 HG23 THR B 207 17.889 -14.786 34.509 1.00 19.81 H new ATOM 1575 N ARG B 208 18.427 -18.260 34.227 1.00 19.13 N ATOM 1576 CA ARG B 208 19.781 -18.663 34.595 1.00 24.04 C ATOM 1577 C ARG B 208 20.806 -17.720 34.005 1.00 22.33 C ATOM 1578 O ARG B 208 21.968 -17.759 34.382 1.00 23.68 O ATOM 1579 CB ARG B 208 20.082 -20.089 34.132 1.00 28.90 C ATOM 1580 CG ARG B 208 19.001 -21.103 34.525 1.00 34.16 C ATOM 1581 CD ARG B 208 19.308 -22.486 33.948 1.00 38.43 C ATOM 1582 NE ARG B 208 20.518 -23.059 34.534 1.00 41.36 N ATOM 1583 CZ ARG B 208 20.822 -24.356 34.510 1.00 44.93 C ATOM 1584 NH1 ARG B 208 21.948 -24.778 35.078 1.00 45.82 N ATOM 1585 NH2 ARG B 208 19.997 -25.234 33.930 1.00 37.44 N ATOM 0 H ARG B 208 18.156 -18.563 33.469 1.00 19.13 H new ATOM 0 HA ARG B 208 19.835 -18.629 35.563 1.00 24.04 H new ATOM 0 HB2 ARG B 208 20.183 -20.093 33.167 1.00 28.90 H new ATOM 0 HB3 ARG B 208 20.931 -20.371 34.508 1.00 28.90 H new ATOM 0 HG2 ARG B 208 18.941 -21.158 35.492 1.00 34.16 H new ATOM 0 HG3 ARG B 208 18.137 -20.800 34.204 1.00 34.16 H new ATOM 0 HD2 ARG B 208 18.557 -23.079 34.110 1.00 38.43 H new ATOM 0 HD3 ARG B 208 19.414 -22.419 32.986 1.00 38.43 H new ATOM 0 HE ARG B 208 21.070 -22.524 34.920 1.00 41.36 H new ATOM 0 HH11 ARG B 208 22.475 -24.215 35.458 1.00 45.82 H new ATOM 0 HH12 ARG B 208 22.149 -25.614 35.065 1.00 45.82 H new ATOM 0 HH21 ARG B 208 19.265 -24.963 33.569 1.00 37.44 H new ATOM 0 HH22 ARG B 208 20.199 -26.070 33.918 1.00 37.44 H new ATOM 1586 N ILE B 209 20.373 -16.889 33.060 1.00 23.10 N ATOM 1587 CA ILE B 209 21.236 -15.889 32.427 1.00 26.58 C ATOM 1588 C ILE B 209 21.659 -14.854 33.458 1.00 22.87 C ATOM 1589 O ILE B 209 20.856 -14.444 34.308 1.00 19.11 O ATOM 1590 CB ILE B 209 20.489 -15.146 31.268 1.00 21.10 C ATOM 1591 CG1 ILE B 209 19.967 -16.160 30.252 1.00 22.41 C ATOM 1592 CG2 ILE B 209 21.398 -14.146 30.584 1.00 21.64 C ATOM 1593 CD1 ILE B 209 21.075 -16.804 29.428 1.00 27.01 C ATOM 0 H ILE B 209 19.565 -16.888 32.765 1.00 23.10 H new ATOM 0 HA ILE B 209 22.008 -16.351 32.065 1.00 26.58 H new ATOM 0 HB ILE B 209 19.742 -14.660 31.651 1.00 21.10 H new ATOM 0 HG12 ILE B 209 19.474 -16.853 30.719 1.00 22.41 H new ATOM 0 HG13 ILE B 209 19.342 -15.720 29.655 1.00 22.41 H new ATOM 0 HG21 ILE B 209 20.912 -13.701 29.872 1.00 21.64 H new ATOM 0 HG22 ILE B 209 21.699 -13.488 31.230 1.00 21.64 H new ATOM 0 HG23 ILE B 209 22.165 -14.608 30.211 1.00 21.64 H new ATOM 0 HD11 ILE B 209 20.688 -17.436 28.802 1.00 27.01 H new ATOM 0 HD12 ILE B 209 21.555 -16.118 28.938 1.00 27.01 H new ATOM 0 HD13 ILE B 209 21.689 -17.269 30.018 1.00 27.01 H new ATOM 1594 N ARG B 210 22.914 -14.428 33.385 1.00 18.46 N ATOM 1595 CA ARG B 210 23.395 -13.374 34.282 1.00 29.06 C ATOM 1596 C ARG B 210 22.908 -11.976 33.853 1.00 25.44 C ATOM 1597 O ARG B 210 23.249 -11.489 32.759 1.00 25.13 O ATOM 1598 CB ARG B 210 24.921 -13.399 34.391 1.00 25.98 C ATOM 1599 CG ARG B 210 25.478 -12.355 35.350 1.00 30.28 C ATOM 1600 CD ARG B 210 26.993 -12.420 35.399 1.00 30.05 C ATOM 1601 NE ARG B 210 27.591 -12.156 34.090 1.00 31.60 N ATOM 1602 CZ ARG B 210 27.954 -10.948 33.672 1.00 30.32 C ATOM 1603 NH1 ARG B 210 28.495 -10.791 32.473 1.00 33.97 N ATOM 1604 NH2 ARG B 210 27.785 -9.897 34.461 1.00 30.27 N ATOM 0 H ARG B 210 23.500 -14.729 32.832 1.00 18.46 H new ATOM 0 HA ARG B 210 23.018 -13.557 35.157 1.00 29.06 H new ATOM 0 HB2 ARG B 210 25.203 -14.280 34.684 1.00 25.98 H new ATOM 0 HB3 ARG B 210 25.303 -13.256 33.511 1.00 25.98 H new ATOM 0 HG2 ARG B 210 25.197 -11.470 35.069 1.00 30.28 H new ATOM 0 HG3 ARG B 210 25.115 -12.500 36.238 1.00 30.28 H new ATOM 0 HD2 ARG B 210 27.324 -11.773 36.042 1.00 30.05 H new ATOM 0 HD3 ARG B 210 27.269 -13.296 35.710 1.00 30.05 H new ATOM 0 HE ARG B 210 27.715 -12.822 33.560 1.00 31.60 H new ATOM 0 HH11 ARG B 210 28.613 -11.472 31.962 1.00 33.97 H new ATOM 0 HH12 ARG B 210 28.729 -10.008 32.206 1.00 33.97 H new ATOM 0 HH21 ARG B 210 27.441 -9.997 35.243 1.00 30.27 H new ATOM 0 HH22 ARG B 210 28.020 -9.115 34.191 1.00 30.27 H new ATOM 1605 N ILE B 211 22.100 -11.358 34.715 1.00 18.46 N ATOM 1606 CA ILE B 211 21.492 -10.046 34.462 1.00 22.47 C ATOM 1607 C ILE B 211 22.418 -8.917 34.933 1.00 25.58 C ATOM 1608 O ILE B 211 23.051 -9.031 35.972 1.00 25.98 O ATOM 1609 CB ILE B 211 20.134 -9.933 35.194 1.00 24.74 C ATOM 1610 CG1 ILE B 211 19.281 -11.171 34.915 1.00 26.35 C ATOM 1611 CG2 ILE B 211 19.374 -8.702 34.757 1.00 25.99 C ATOM 1612 CD1 ILE B 211 19.097 -11.442 33.451 1.00 21.03 C ATOM 0 H ILE B 211 21.885 -11.694 35.477 1.00 18.46 H new ATOM 0 HA ILE B 211 21.352 -9.961 33.506 1.00 22.47 H new ATOM 0 HB ILE B 211 20.318 -9.864 36.144 1.00 24.74 H new ATOM 0 HG12 ILE B 211 19.695 -11.943 35.332 1.00 26.35 H new ATOM 0 HG13 ILE B 211 18.411 -11.058 35.329 1.00 26.35 H new ATOM 0 HG21 ILE B 211 18.529 -8.658 35.231 1.00 25.99 H new ATOM 0 HG22 ILE B 211 19.898 -7.910 34.956 1.00 25.99 H new ATOM 0 HG23 ILE B 211 19.207 -8.747 33.803 1.00 25.99 H new ATOM 0 HD11 ILE B 211 18.551 -12.235 33.335 1.00 21.03 H new ATOM 0 HD12 ILE B 211 18.659 -10.684 33.034 1.00 21.03 H new ATOM 0 HD13 ILE B 211 19.963 -11.583 33.036 1.00 21.03 H new ATOM 1613 N THR B 212 22.501 -7.832 34.171 1.00 22.37 N ATOM 1614 CA THR B 212 23.365 -6.711 34.537 1.00 18.62 C ATOM 1615 C THR B 212 22.503 -5.474 34.765 1.00 22.84 C ATOM 1616 O THR B 212 21.302 -5.504 34.512 1.00 18.58 O ATOM 1617 CB THR B 212 24.368 -6.376 33.403 1.00 22.27 C ATOM 1618 OG1 THR B 212 23.668 -5.774 32.299 1.00 18.56 O ATOM 1619 CG2 THR B 212 25.086 -7.640 32.919 1.00 20.14 C ATOM 0 H THR B 212 22.066 -7.723 33.437 1.00 22.37 H new ATOM 0 HA THR B 212 23.854 -6.961 35.336 1.00 18.62 H new ATOM 0 HB THR B 212 25.028 -5.757 33.752 1.00 22.27 H new ATOM 0 HG1 THR B 212 24.202 -5.648 31.663 1.00 18.56 H new ATOM 0 HG21 THR B 212 25.707 -7.408 32.211 1.00 20.14 H new ATOM 0 HG22 THR B 212 25.572 -8.039 33.658 1.00 20.14 H new ATOM 0 HG23 THR B 212 24.434 -8.274 32.582 1.00 20.14 H new ATOM 1620 N ASP B 213 23.138 -4.396 35.222 1.00 18.26 N ATOM 1621 CA ASP B 213 22.520 -3.078 35.356 1.00 23.29 C ATOM 1622 C ASP B 213 22.153 -2.425 34.001 1.00 23.23 C ATOM 1623 O ASP B 213 21.434 -1.431 33.964 1.00 17.95 O ATOM 1624 CB ASP B 213 23.450 -2.138 36.151 1.00 24.92 C ATOM 1625 CG ASP B 213 23.609 -2.551 37.631 1.00 30.44 C ATOM 1626 OD1 ASP B 213 22.765 -3.303 38.155 1.00 26.01 O ATOM 1627 OD2 ASP B 213 24.580 -2.101 38.275 1.00 36.11 O ATOM 0 H ASP B 213 23.962 -4.412 35.469 1.00 18.26 H new ATOM 0 HA ASP B 213 21.687 -3.215 35.833 1.00 23.29 H new ATOM 0 HB2 ASP B 213 24.323 -2.124 35.729 1.00 24.92 H new ATOM 0 HB3 ASP B 213 23.100 -1.234 36.109 1.00 24.92 H new ATOM 1628 N ASN B 214 22.651 -2.975 32.895 1.00 20.47 N ATOM 1629 CA ASN B 214 22.313 -2.441 31.563 1.00 19.82 C ATOM 1630 C ASN B 214 21.066 -3.079 30.977 1.00 15.90 C ATOM 1631 O ASN B 214 20.773 -2.937 29.797 1.00 21.12 O ATOM 1632 CB ASN B 214 23.499 -2.598 30.610 1.00 18.47 C ATOM 1633 CG ASN B 214 24.786 -2.086 31.220 1.00 23.64 C ATOM 1634 OD1 ASN B 214 24.836 -0.951 31.694 1.00 24.12 O ATOM 1635 ND2 ASN B 214 25.830 -2.927 31.236 1.00 23.88 N ATOM 0 H ASN B 214 23.182 -3.652 32.887 1.00 20.47 H new ATOM 0 HA ASN B 214 22.118 -1.498 31.676 1.00 19.82 H new ATOM 0 HB2 ASN B 214 23.603 -3.533 30.375 1.00 18.47 H new ATOM 0 HB3 ASN B 214 23.318 -2.117 29.787 1.00 18.47 H new ATOM 0 HD21 ASN B 214 26.575 -2.681 31.588 1.00 23.88 H new ATOM 0 HD22 ASN B 214 25.755 -3.713 30.894 1.00 23.88 H new ATOM 1636 N MET B 215 20.345 -3.808 31.811 1.00 17.13 N ATOM 1637 CA MET B 215 19.101 -4.442 31.395 1.00 22.08 C ATOM 1638 C MET B 215 18.010 -4.125 32.400 1.00 19.60 C ATOM 1639 O MET B 215 18.306 -3.865 33.567 1.00 20.62 O ATOM 1640 CB MET B 215 19.243 -5.969 31.363 1.00 18.00 C ATOM 1641 CG MET B 215 20.433 -6.505 30.639 1.00 21.83 C ATOM 1642 SD MET B 215 20.571 -8.268 30.986 1.00 19.60 S ATOM 1643 CE MET B 215 22.101 -8.598 30.092 1.00 20.47 C ATOM 0 H MET B 215 20.559 -3.951 32.632 1.00 17.13 H new ATOM 0 HA MET B 215 18.884 -4.107 30.511 1.00 22.08 H new ATOM 0 HB2 MET B 215 19.271 -6.292 32.277 1.00 18.00 H new ATOM 0 HB3 MET B 215 18.445 -6.341 30.956 1.00 18.00 H new ATOM 0 HG2 MET B 215 20.342 -6.356 29.685 1.00 21.83 H new ATOM 0 HG3 MET B 215 21.237 -6.042 30.923 1.00 21.83 H new ATOM 0 HE1 MET B 215 22.330 -9.537 30.178 1.00 20.47 H new ATOM 0 HE2 MET B 215 21.982 -8.379 29.155 1.00 20.47 H new ATOM 0 HE3 MET B 215 22.816 -8.056 30.462 1.00 20.47 H new ATOM 1644 N PHE B 216 16.760 -4.159 31.938 1.00 17.57 N ATOM 1645 CA PHE B 216 15.598 -4.305 32.819 1.00 17.61 C ATOM 1646 C PHE B 216 14.650 -5.319 32.178 1.00 18.27 C ATOM 1647 O PHE B 216 14.773 -5.621 30.983 1.00 14.64 O ATOM 1648 CB PHE B 216 14.918 -2.953 33.159 1.00 15.24 C ATOM 1649 CG PHE B 216 14.274 -2.230 31.965 1.00 20.40 C ATOM 1650 CD1 PHE B 216 12.973 -2.532 31.562 1.00 15.93 C ATOM 1651 CD2 PHE B 216 14.959 -1.216 31.289 1.00 18.39 C ATOM 1652 CE1 PHE B 216 12.374 -1.863 30.499 1.00 20.96 C ATOM 1653 CE2 PHE B 216 14.362 -0.531 30.211 1.00 19.58 C ATOM 1654 CZ PHE B 216 13.071 -0.850 29.819 1.00 16.31 C ATOM 0 H PHE B 216 16.561 -4.098 31.104 1.00 17.57 H new ATOM 0 HA PHE B 216 15.885 -4.638 33.684 1.00 17.61 H new ATOM 0 HB2 PHE B 216 14.236 -3.110 33.831 1.00 15.24 H new ATOM 0 HB3 PHE B 216 15.579 -2.365 33.557 1.00 15.24 H new ATOM 0 HD1 PHE B 216 12.497 -3.192 32.012 1.00 15.93 H new ATOM 0 HD2 PHE B 216 15.821 -0.990 31.554 1.00 18.39 H new ATOM 0 HE1 PHE B 216 11.510 -2.087 30.238 1.00 20.96 H new ATOM 0 HE2 PHE B 216 14.834 0.134 29.763 1.00 19.58 H new ATOM 0 HZ PHE B 216 12.670 -0.398 29.112 1.00 16.31 H new ATOM 1655 N CYS B 217 13.724 -5.872 32.957 1.00 16.09 N ATOM 1656 CA CYS B 217 12.758 -6.788 32.353 1.00 18.08 C ATOM 1657 C CYS B 217 11.348 -6.283 32.549 1.00 17.67 C ATOM 1658 O CYS B 217 11.075 -5.493 33.452 1.00 20.20 O ATOM 1659 CB CYS B 217 12.927 -8.252 32.824 1.00 16.87 C ATOM 1660 SG CYS B 217 12.046 -8.732 34.355 1.00 21.08 S ATOM 0 H CYS B 217 13.637 -5.739 33.802 1.00 16.09 H new ATOM 0 HA CYS B 217 12.942 -6.804 31.401 1.00 18.08 H new ATOM 0 HB2 CYS B 217 12.630 -8.836 32.109 1.00 16.87 H new ATOM 0 HB3 CYS B 217 13.873 -8.421 32.954 1.00 16.87 H new ATOM 1661 N ALA B 218 10.467 -6.703 31.653 1.00 18.70 N ATOM 1662 CA ALA B 218 9.089 -6.241 31.661 1.00 20.21 C ATOM 1663 C ALA B 218 8.147 -7.370 31.236 1.00 20.29 C ATOM 1664 O ALA B 218 8.536 -8.265 30.493 1.00 16.91 O ATOM 1665 CB ALA B 218 8.934 -5.037 30.746 1.00 18.41 C ATOM 0 H ALA B 218 10.650 -7.262 31.025 1.00 18.70 H new ATOM 0 HA ALA B 218 8.854 -5.972 32.563 1.00 20.21 H new ATOM 0 HB1 ALA B 218 8.012 -4.737 30.759 1.00 18.41 H new ATOM 0 HB2 ALA B 218 9.511 -4.320 31.053 1.00 18.41 H new ATOM 0 HB3 ALA B 218 9.181 -5.284 29.841 1.00 18.41 H new ATOM 1666 N GLY B 219 6.908 -7.316 31.717 1.00 21.77 N ATOM 1667 CA GLY B 219 5.927 -8.347 31.443 1.00 18.02 C ATOM 1668 C GLY B 219 5.027 -8.551 32.643 1.00 23.23 C ATOM 1669 O GLY B 219 5.300 -8.056 33.736 1.00 22.49 O ATOM 0 H GLY B 219 6.617 -6.676 32.212 1.00 21.77 H new ATOM 0 HA2 GLY B 219 5.395 -8.099 30.671 1.00 18.02 H new ATOM 0 HA3 GLY B 219 6.376 -9.178 31.223 1.00 18.02 H new ATOM 1670 N TYR B 220 3.946 -9.289 32.440 1.00 24.32 N ATOM 1671 CA TYR B 220 3.059 -9.613 33.537 1.00 27.43 C ATOM 1672 C TYR B 220 3.521 -10.877 34.275 1.00 28.31 C ATOM 1673 O TYR B 220 4.052 -11.803 33.664 1.00 26.09 O ATOM 1674 CB TYR B 220 1.633 -9.767 33.018 1.00 28.12 C ATOM 1675 CG TYR B 220 1.037 -8.464 32.569 1.00 30.08 C ATOM 1676 CD1 TYR B 220 0.625 -7.510 33.499 1.00 30.22 C ATOM 1677 CD2 TYR B 220 0.901 -8.169 31.209 1.00 25.94 C ATOM 1678 CE1 TYR B 220 0.070 -6.297 33.083 1.00 30.09 C ATOM 1679 CE2 TYR B 220 0.348 -6.971 30.788 1.00 25.94 C ATOM 1680 CZ TYR B 220 -0.065 -6.037 31.723 1.00 31.71 C ATOM 1681 OH TYR B 220 -0.604 -4.836 31.300 1.00 30.73 O ATOM 0 H TYR B 220 3.711 -9.609 31.677 1.00 24.32 H new ATOM 0 HA TYR B 220 3.081 -8.885 34.178 1.00 27.43 H new ATOM 0 HB2 TYR B 220 1.628 -10.393 32.277 1.00 28.12 H new ATOM 0 HB3 TYR B 220 1.078 -10.149 33.716 1.00 28.12 H new ATOM 0 HD1 TYR B 220 0.721 -7.683 34.408 1.00 30.22 H new ATOM 0 HD2 TYR B 220 1.187 -8.788 30.576 1.00 25.94 H new ATOM 0 HE1 TYR B 220 -0.207 -5.669 33.710 1.00 30.09 H new ATOM 0 HE2 TYR B 220 0.254 -6.794 29.880 1.00 25.94 H new ATOM 0 HH TYR B 220 -0.987 -4.458 31.945 1.00 30.73 H new ATOM 1682 N LYS B 221 3.342 -10.885 35.593 1.00 31.78 N ATOM 1683 CA LYS B 221 3.525 -12.096 36.397 1.00 38.92 C ATOM 1684 C LYS B 221 2.452 -13.102 35.959 1.00 38.07 C ATOM 1685 O LYS B 221 1.425 -12.709 35.385 1.00 33.32 O ATOM 1686 CB LYS B 221 3.366 -11.795 37.896 1.00 31.88 C ATOM 1687 CG LYS B 221 3.893 -10.441 38.350 1.00 33.76 C ATOM 1688 CD LYS B 221 5.340 -10.484 38.772 1.00 34.95 C ATOM 1689 CE LYS B 221 5.855 -9.088 39.142 1.00 38.01 C ATOM 1690 NZ LYS B 221 5.569 -8.697 40.558 1.00 41.98 N ATOM 0 H LYS B 221 3.112 -10.192 36.047 1.00 31.78 H new ATOM 0 HA LYS B 221 4.418 -12.449 36.261 1.00 38.92 H new ATOM 0 HB2 LYS B 221 2.425 -11.851 38.124 1.00 31.88 H new ATOM 0 HB3 LYS B 221 3.822 -12.488 38.399 1.00 31.88 H new ATOM 0 HG2 LYS B 221 3.791 -9.801 37.628 1.00 33.76 H new ATOM 0 HG3 LYS B 221 3.354 -10.122 39.091 1.00 33.76 H new ATOM 0 HD2 LYS B 221 5.440 -11.079 39.531 1.00 34.95 H new ATOM 0 HD3 LYS B 221 5.878 -10.849 38.052 1.00 34.95 H new ATOM 0 HE2 LYS B 221 6.813 -9.055 38.993 1.00 38.01 H new ATOM 0 HE3 LYS B 221 5.453 -8.436 38.547 1.00 38.01 H new ATOM 0 HZ1 LYS B 221 6.164 -8.091 40.825 1.00 41.98 H new ATOM 0 HZ2 LYS B 221 4.750 -8.352 40.611 1.00 41.98 H new ATOM 0 HZ3 LYS B 221 5.622 -9.415 41.081 1.00 41.98 H new ATOM 1691 N PRO B 222 2.675 -14.399 36.229 1.00 39.82 N ATOM 1692 CA PRO B 222 1.680 -15.396 35.818 1.00 41.96 C ATOM 1693 C PRO B 222 0.378 -15.250 36.606 1.00 38.33 C ATOM 1694 O PRO B 222 -0.667 -15.707 36.142 1.00 43.48 O ATOM 1695 CB PRO B 222 2.358 -16.735 36.147 1.00 40.71 C ATOM 1696 CG PRO B 222 3.804 -16.412 36.365 1.00 35.33 C ATOM 1697 CD PRO B 222 3.820 -15.018 36.914 1.00 36.83 C ATOM 0 HA PRO B 222 1.432 -15.307 34.884 1.00 41.96 H new ATOM 0 HB2 PRO B 222 1.968 -17.138 36.938 1.00 40.71 H new ATOM 0 HB3 PRO B 222 2.248 -17.369 35.421 1.00 40.71 H new ATOM 0 HG2 PRO B 222 4.213 -17.037 36.984 1.00 35.33 H new ATOM 0 HG3 PRO B 222 4.304 -16.467 35.536 1.00 35.33 H new ATOM 0 HD2 PRO B 222 3.714 -15.007 37.878 1.00 36.83 H new ATOM 0 HD3 PRO B 222 4.652 -14.560 36.715 1.00 36.83 H new ATOM 1698 N ASP B 223 0.445 -14.604 37.769 1.00 35.39 N ATOM 1699 CA ASP B 223 -0.737 -14.412 38.606 1.00 46.92 C ATOM 1700 C ASP B 223 -1.589 -13.241 38.119 1.00 50.57 C ATOM 1701 O ASP B 223 -2.782 -13.169 38.422 1.00 51.09 O ATOM 1702 CB ASP B 223 -0.345 -14.194 40.078 1.00 47.02 C ATOM 1703 CG ASP B 223 -0.057 -12.724 40.406 1.00 58.50 C ATOM 1704 OD1 ASP B 223 -0.965 -11.876 40.233 1.00 59.14 O ATOM 1705 OD2 ASP B 223 1.072 -12.414 40.855 1.00 57.00 O ATOM 0 H ASP B 223 1.168 -14.268 38.092 1.00 35.39 H new ATOM 0 HA ASP B 223 -1.265 -15.223 38.538 1.00 46.92 H new ATOM 0 HB2 ASP B 223 -1.060 -14.514 40.649 1.00 47.02 H new ATOM 0 HB3 ASP B 223 0.440 -14.726 40.281 1.00 47.02 H new ATOM 1706 N GLU B 224 -0.971 -12.333 37.368 1.00 43.20 N ATOM 1707 CA GLU B 224 -1.608 -11.076 36.993 1.00 41.81 C ATOM 1708 C GLU B 224 -2.701 -11.246 35.947 1.00 43.52 C ATOM 1709 O GLU B 224 -3.491 -10.332 35.702 1.00 54.47 O ATOM 1710 CB GLU B 224 -0.558 -10.038 36.558 1.00 39.26 C ATOM 1711 CG GLU B 224 0.114 -9.324 37.734 1.00 42.06 C ATOM 1712 CD GLU B 224 1.355 -8.518 37.341 1.00 41.38 C ATOM 1713 OE1 GLU B 224 1.949 -8.801 36.281 1.00 39.58 O ATOM 1714 OE2 GLU B 224 1.754 -7.610 38.108 1.00 41.12 O ATOM 0 H GLU B 224 -0.173 -12.429 37.063 1.00 43.20 H new ATOM 0 HA GLU B 224 -2.055 -10.743 37.787 1.00 41.81 H new ATOM 0 HB2 GLU B 224 0.122 -10.479 36.025 1.00 39.26 H new ATOM 0 HB3 GLU B 224 -0.982 -9.378 35.987 1.00 39.26 H new ATOM 0 HG2 GLU B 224 -0.529 -8.729 38.150 1.00 42.06 H new ATOM 0 HG3 GLU B 224 0.364 -9.982 38.401 1.00 42.06 H new ATOM 1715 N GLY B 225 -2.758 -12.416 35.331 1.00 42.14 N ATOM 1716 CA GLY B 225 -3.846 -12.714 34.421 1.00 47.38 C ATOM 1717 C GLY B 225 -3.967 -11.850 33.176 1.00 49.05 C ATOM 1718 O GLY B 225 -5.000 -11.861 32.505 1.00 54.40 O ATOM 0 H GLY B 225 -2.181 -13.046 35.426 1.00 42.14 H new ATOM 0 HA2 GLY B 225 -3.757 -13.638 34.138 1.00 47.38 H new ATOM 0 HA3 GLY B 225 -4.678 -12.647 34.915 1.00 47.38 H new ATOM 1719 N LYS B 226 -2.925 -11.091 32.860 1.00 49.00 N ATOM 1720 CA LYS B 226 -2.829 -10.456 31.547 1.00 36.84 C ATOM 1721 C LYS B 226 -1.527 -10.937 30.935 1.00 33.97 C ATOM 1722 O LYS B 226 -0.619 -11.329 31.660 1.00 36.10 O ATOM 1723 CB LYS B 226 -2.858 -8.933 31.656 1.00 36.77 C ATOM 1724 CG LYS B 226 -4.079 -8.406 32.371 1.00 43.00 C ATOM 1725 CD LYS B 226 -4.044 -6.891 32.487 1.00 50.93 C ATOM 1726 CE LYS B 226 -4.053 -6.238 31.109 1.00 52.46 C ATOM 1727 NZ LYS B 226 -4.296 -4.763 31.178 1.00 49.79 N ATOM 0 H LYS B 226 -2.265 -10.930 33.387 1.00 49.00 H new ATOM 0 HA LYS B 226 -3.587 -10.697 30.992 1.00 36.84 H new ATOM 0 HB2 LYS B 226 -2.063 -8.634 32.124 1.00 36.77 H new ATOM 0 HB3 LYS B 226 -2.823 -8.551 30.765 1.00 36.77 H new ATOM 0 HG2 LYS B 226 -4.878 -8.677 31.892 1.00 43.00 H new ATOM 0 HG3 LYS B 226 -4.132 -8.799 33.256 1.00 43.00 H new ATOM 0 HD2 LYS B 226 -4.809 -6.585 32.999 1.00 50.93 H new ATOM 0 HD3 LYS B 226 -3.250 -6.619 32.973 1.00 50.93 H new ATOM 0 HE2 LYS B 226 -3.204 -6.403 30.670 1.00 52.46 H new ATOM 0 HE3 LYS B 226 -4.740 -6.651 30.563 1.00 52.46 H new ATOM 0 HZ1 LYS B 226 -4.293 -4.423 30.356 1.00 49.79 H new ATOM 0 HZ2 LYS B 226 -5.085 -4.609 31.560 1.00 49.79 H new ATOM 0 HZ3 LYS B 226 -3.654 -4.378 31.660 1.00 49.79 H new ATOM 1728 N ARG B 227 -1.441 -10.928 29.612 1.00 29.10 N ATOM 1729 CA ARG B 227 -0.262 -11.439 28.923 1.00 29.99 C ATOM 1730 C ARG B 227 0.382 -10.382 28.018 1.00 25.95 C ATOM 1731 O ARG B 227 -0.058 -9.237 27.956 1.00 28.05 O ATOM 1732 CB ARG B 227 -0.633 -12.656 28.072 1.00 32.85 C ATOM 1733 CG ARG B 227 -1.391 -13.729 28.815 1.00 36.98 C ATOM 1734 CD ARG B 227 -1.475 -14.985 27.981 1.00 36.22 C ATOM 1735 NE ARG B 227 -0.184 -15.655 27.927 1.00 38.23 N ATOM 1736 CZ ARG B 227 0.333 -16.351 28.934 1.00 36.60 C ATOM 1737 NH1 ARG B 227 1.520 -16.922 28.798 1.00 35.70 N ATOM 1738 NH2 ARG B 227 -0.334 -16.465 30.079 1.00 34.66 N ATOM 0 H ARG B 227 -2.057 -10.629 29.091 1.00 29.10 H new ATOM 0 HA ARG B 227 0.379 -11.688 29.607 1.00 29.99 H new ATOM 0 HB2 ARG B 227 -1.168 -12.360 27.319 1.00 32.85 H new ATOM 0 HB3 ARG B 227 0.179 -13.042 27.708 1.00 32.85 H new ATOM 0 HG2 ARG B 227 -0.950 -13.921 29.657 1.00 36.98 H new ATOM 0 HG3 ARG B 227 -2.284 -13.415 29.028 1.00 36.98 H new ATOM 0 HD2 ARG B 227 -2.140 -15.584 28.356 1.00 36.22 H new ATOM 0 HD3 ARG B 227 -1.767 -14.763 27.083 1.00 36.22 H new ATOM 0 HE ARG B 227 0.271 -15.597 27.200 1.00 38.23 H new ATOM 0 HH11 ARG B 227 1.954 -16.842 28.060 1.00 35.70 H new ATOM 0 HH12 ARG B 227 1.857 -17.373 29.448 1.00 35.70 H new ATOM 0 HH21 ARG B 227 -1.102 -16.088 30.169 1.00 34.66 H new ATOM 0 HH22 ARG B 227 0.002 -16.916 30.730 1.00 34.66 H new ATOM 1739 N GLY B 228 1.427 -10.786 27.310 1.00 23.81 N ATOM 1740 CA GLY B 228 2.063 -9.922 26.338 1.00 26.46 C ATOM 1741 C GLY B 228 3.568 -10.025 26.407 1.00 23.16 C ATOM 1742 O GLY B 228 4.145 -10.199 27.488 1.00 22.10 O ATOM 0 H GLY B 228 1.784 -11.565 27.381 1.00 23.81 H new ATOM 0 HA2 GLY B 228 1.762 -10.159 25.447 1.00 26.46 H new ATOM 0 HA3 GLY B 228 1.793 -9.004 26.494 1.00 26.46 H new ATOM 1743 N ASP B 229 4.207 -9.919 25.246 1.00 20.88 N ATOM 1744 CA ASP B 229 5.661 -9.984 25.164 1.00 22.31 C ATOM 1745 C ASP B 229 6.044 -9.556 23.761 1.00 19.77 C ATOM 1746 O ASP B 229 5.220 -9.611 22.858 1.00 20.29 O ATOM 1747 CB ASP B 229 6.142 -11.420 25.436 1.00 20.36 C ATOM 1748 CG ASP B 229 7.635 -11.512 25.739 1.00 24.55 C ATOM 1749 OD1 ASP B 229 8.318 -10.472 25.772 1.00 20.19 O ATOM 1750 OD2 ASP B 229 8.124 -12.647 25.958 1.00 21.38 O ATOM 0 H ASP B 229 3.813 -9.808 24.490 1.00 20.88 H new ATOM 0 HA ASP B 229 6.073 -9.406 25.825 1.00 22.31 H new ATOM 0 HB2 ASP B 229 5.644 -11.784 26.184 1.00 20.36 H new ATOM 0 HB3 ASP B 229 5.941 -11.973 24.665 1.00 20.36 H new ATOM 1751 N ALA B 230 7.276 -9.081 23.602 1.00 18.45 N ATOM 1752 CA ALA B 230 7.900 -9.015 22.297 1.00 20.07 C ATOM 1753 C ALA B 230 8.259 -10.442 21.885 1.00 21.30 C ATOM 1754 O ALA B 230 8.081 -11.393 22.650 1.00 21.33 O ATOM 1755 CB ALA B 230 9.139 -8.134 22.329 1.00 19.95 C ATOM 0 H ALA B 230 7.766 -8.791 24.246 1.00 18.45 H new ATOM 0 HA ALA B 230 7.290 -8.621 21.654 1.00 20.07 H new ATOM 0 HB1 ALA B 230 9.539 -8.105 21.446 1.00 19.95 H new ATOM 0 HB2 ALA B 230 8.891 -7.236 22.601 1.00 19.95 H new ATOM 0 HB3 ALA B 230 9.779 -8.498 22.961 1.00 19.95 H new ATOM 1756 N CYS B 231 8.738 -10.600 20.662 1.00 23.98 N ATOM 1757 CA CYS B 231 9.083 -11.924 20.177 1.00 23.82 C ATOM 1758 C CYS B 231 10.057 -11.740 19.030 1.00 23.72 C ATOM 1759 O CYS B 231 10.561 -10.629 18.810 1.00 21.36 O ATOM 1760 CB CYS B 231 7.818 -12.687 19.736 1.00 20.92 C ATOM 1761 SG CYS B 231 7.995 -14.530 19.644 1.00 26.02 S ATOM 0 H CYS B 231 8.870 -9.961 20.102 1.00 23.98 H new ATOM 0 HA CYS B 231 9.493 -12.456 20.877 1.00 23.82 H new ATOM 0 HB2 CYS B 231 7.100 -12.476 20.353 1.00 20.92 H new ATOM 0 HB3 CYS B 231 7.548 -12.359 18.864 1.00 20.92 H new ATOM 1762 N GLU B 232 10.331 -12.827 18.314 1.00 30.27 N ATOM 1763 CA GLU B 232 11.238 -12.798 17.177 1.00 27.84 C ATOM 1764 C GLU B 232 10.767 -11.727 16.186 1.00 25.97 C ATOM 1765 O GLU B 232 9.569 -11.609 15.944 1.00 27.60 O ATOM 1766 CB GLU B 232 11.244 -14.175 16.513 1.00 34.67 C ATOM 1767 CG GLU B 232 12.385 -14.406 15.536 1.00 44.67 C ATOM 1768 CD GLU B 232 12.672 -15.888 15.318 1.00 66.10 C ATOM 1769 OE1 GLU B 232 12.758 -16.639 16.324 1.00 61.43 O ATOM 1770 OE2 GLU B 232 12.818 -16.294 14.141 1.00 65.21 O ATOM 0 H GLU B 232 9.995 -13.602 18.476 1.00 30.27 H new ATOM 0 HA GLU B 232 12.138 -12.582 17.467 1.00 27.84 H new ATOM 0 HB2 GLU B 232 11.285 -14.854 17.205 1.00 34.67 H new ATOM 0 HB3 GLU B 232 10.404 -14.298 16.044 1.00 34.67 H new ATOM 0 HG2 GLU B 232 12.168 -13.993 14.686 1.00 44.67 H new ATOM 0 HG3 GLU B 232 13.185 -13.969 15.868 1.00 44.67 H new ATOM 1771 N GLY B 233 11.692 -10.935 15.637 1.00 22.13 N ATOM 1772 CA GLY B 233 11.322 -9.886 14.686 1.00 23.15 C ATOM 1773 C GLY B 233 11.077 -8.520 15.334 1.00 19.12 C ATOM 1774 O GLY B 233 11.142 -7.488 14.672 1.00 20.31 O ATOM 0 H GLY B 233 12.534 -10.989 15.802 1.00 22.13 H new ATOM 0 HA2 GLY B 233 12.026 -9.799 14.024 1.00 23.15 H new ATOM 0 HA3 GLY B 233 10.520 -10.158 14.213 1.00 23.15 H new ATOM 1775 N ASP B 234 10.788 -8.526 16.631 1.00 16.20 N ATOM 1776 CA ASP B 234 10.587 -7.306 17.417 1.00 16.90 C ATOM 1777 C ASP B 234 11.890 -6.695 17.936 1.00 16.72 C ATOM 1778 O ASP B 234 11.931 -5.512 18.280 1.00 14.12 O ATOM 1779 CB ASP B 234 9.632 -7.584 18.585 1.00 14.88 C ATOM 1780 CG ASP B 234 8.233 -7.949 18.111 1.00 20.35 C ATOM 1781 OD1 ASP B 234 7.786 -7.337 17.114 1.00 16.28 O ATOM 1782 OD2 ASP B 234 7.582 -8.835 18.723 1.00 20.43 O ATOM 0 H ASP B 234 10.701 -9.249 17.089 1.00 16.20 H new ATOM 0 HA ASP B 234 10.197 -6.652 16.816 1.00 16.90 H new ATOM 0 HB2 ASP B 234 9.987 -8.307 19.126 1.00 14.88 H new ATOM 0 HB3 ASP B 234 9.584 -6.800 19.155 1.00 14.88 H new ATOM 1783 N SER B 235 12.943 -7.511 17.981 1.00 17.61 N ATOM 1784 CA SER B 235 14.266 -7.110 18.448 1.00 16.95 C ATOM 1785 C SER B 235 14.637 -5.761 17.909 1.00 18.16 C ATOM 1786 O SER B 235 14.342 -5.468 16.742 1.00 13.14 O ATOM 1787 CB SER B 235 15.345 -8.103 17.981 1.00 19.88 C ATOM 1788 OG SER B 235 15.193 -9.374 18.573 1.00 24.63 O ATOM 0 H SER B 235 12.905 -8.334 17.734 1.00 17.61 H new ATOM 0 HA SER B 235 14.225 -7.090 19.417 1.00 16.95 H new ATOM 0 HB2 SER B 235 15.305 -8.191 17.016 1.00 19.88 H new ATOM 0 HB3 SER B 235 16.222 -7.750 18.198 1.00 19.88 H new ATOM 0 HG SER B 235 15.949 -9.692 18.752 1.00 24.63 H new ATOM 1789 N GLY B 236 15.320 -4.968 18.743 1.00 10.89 N ATOM 1790 CA GLY B 236 15.781 -3.649 18.344 1.00 11.75 C ATOM 1791 C GLY B 236 14.697 -2.583 18.345 1.00 13.84 C ATOM 1792 O GLY B 236 14.980 -1.397 18.134 1.00 16.07 O ATOM 0 H GLY B 236 15.524 -5.185 19.550 1.00 10.89 H new ATOM 0 HA2 GLY B 236 16.493 -3.372 18.941 1.00 11.75 H new ATOM 0 HA3 GLY B 236 16.163 -3.706 17.454 1.00 11.75 H new ATOM 1793 N GLY B 237 13.451 -2.986 18.577 1.00 11.08 N ATOM 1794 CA GLY B 237 12.370 -2.013 18.666 1.00 11.17 C ATOM 1795 C GLY B 237 12.366 -1.238 19.982 1.00 17.10 C ATOM 1796 O GLY B 237 13.064 -1.596 20.938 1.00 13.59 O ATOM 0 H GLY B 237 13.214 -3.806 18.684 1.00 11.08 H new ATOM 0 HA2 GLY B 237 12.445 -1.387 17.929 1.00 11.17 H new ATOM 0 HA3 GLY B 237 11.521 -2.471 18.564 1.00 11.17 H new ATOM 1797 N PRO B 238 11.583 -0.155 20.036 1.00 15.01 N ATOM 1798 CA PRO B 238 11.559 0.742 21.200 1.00 13.10 C ATOM 1799 C PRO B 238 10.632 0.286 22.332 1.00 16.30 C ATOM 1800 O PRO B 238 9.506 -0.125 22.062 1.00 16.66 O ATOM 1801 CB PRO B 238 10.992 2.038 20.609 1.00 14.56 C ATOM 1802 CG PRO B 238 10.102 1.552 19.474 1.00 14.11 C ATOM 1803 CD PRO B 238 10.890 0.425 18.868 1.00 13.34 C ATOM 0 HA PRO B 238 12.439 0.799 21.603 1.00 13.10 H new ATOM 0 HB2 PRO B 238 10.488 2.540 21.268 1.00 14.56 H new ATOM 0 HB3 PRO B 238 11.696 2.621 20.286 1.00 14.56 H new ATOM 0 HG2 PRO B 238 9.240 1.250 19.800 1.00 14.11 H new ATOM 0 HG3 PRO B 238 9.930 2.255 18.828 1.00 14.11 H new ATOM 0 HD2 PRO B 238 10.315 -0.223 18.433 1.00 13.34 H new ATOM 0 HD3 PRO B 238 11.516 0.743 18.199 1.00 13.34 H new ATOM 1804 N PHE B 239 11.109 0.340 23.576 1.00 15.06 N ATOM 1805 CA PHE B 239 10.221 0.302 24.736 1.00 18.42 C ATOM 1806 C PHE B 239 10.051 1.758 25.188 1.00 14.91 C ATOM 1807 O PHE B 239 11.005 2.380 25.630 1.00 16.36 O ATOM 1808 CB PHE B 239 10.817 -0.574 25.841 1.00 13.85 C ATOM 1809 CG PHE B 239 10.031 -0.566 27.131 1.00 15.22 C ATOM 1810 CD1 PHE B 239 10.092 0.527 27.996 1.00 17.52 C ATOM 1811 CD2 PHE B 239 9.271 -1.661 27.501 1.00 16.23 C ATOM 1812 CE1 PHE B 239 9.379 0.541 29.194 1.00 19.93 C ATOM 1813 CE2 PHE B 239 8.552 -1.660 28.697 1.00 19.83 C ATOM 1814 CZ PHE B 239 8.617 -0.555 29.550 1.00 21.50 C ATOM 0 H PHE B 239 11.945 0.399 23.769 1.00 15.06 H new ATOM 0 HA PHE B 239 9.360 -0.089 24.520 1.00 18.42 H new ATOM 0 HB2 PHE B 239 10.879 -1.486 25.518 1.00 13.85 H new ATOM 0 HB3 PHE B 239 11.722 -0.275 26.024 1.00 13.85 H new ATOM 0 HD1 PHE B 239 10.618 1.260 27.769 1.00 17.52 H new ATOM 0 HD2 PHE B 239 9.239 -2.407 26.946 1.00 16.23 H new ATOM 0 HE1 PHE B 239 9.416 1.285 29.751 1.00 19.93 H new ATOM 0 HE2 PHE B 239 8.030 -2.395 28.926 1.00 19.83 H new ATOM 0 HZ PHE B 239 8.149 -0.557 30.354 1.00 21.50 H new ATOM 1815 N VAL B 240 8.858 2.322 25.009 1.00 15.33 N ATOM 1816 CA VAL B 240 8.653 3.743 25.280 1.00 14.05 C ATOM 1817 C VAL B 240 7.686 3.992 26.433 1.00 15.71 C ATOM 1818 O VAL B 240 6.841 3.150 26.720 1.00 14.59 O ATOM 1819 CB VAL B 240 8.169 4.519 24.029 1.00 18.90 C ATOM 1820 CG1 VAL B 240 9.168 4.364 22.869 1.00 16.89 C ATOM 1821 CG2 VAL B 240 6.766 4.055 23.600 1.00 15.70 C ATOM 0 H VAL B 240 8.159 1.903 24.733 1.00 15.33 H new ATOM 0 HA VAL B 240 9.527 4.077 25.537 1.00 14.05 H new ATOM 0 HB VAL B 240 8.117 5.459 24.264 1.00 18.90 H new ATOM 0 HG11 VAL B 240 8.847 4.856 22.097 1.00 16.89 H new ATOM 0 HG12 VAL B 240 10.033 4.712 23.137 1.00 16.89 H new ATOM 0 HG13 VAL B 240 9.255 3.425 22.640 1.00 16.89 H new ATOM 0 HG21 VAL B 240 6.485 4.554 22.817 1.00 15.70 H new ATOM 0 HG22 VAL B 240 6.788 3.109 23.389 1.00 15.70 H new ATOM 0 HG23 VAL B 240 6.139 4.210 24.323 1.00 15.70 H new ATOM 1822 N MET B 241 7.825 5.155 27.077 1.00 13.85 N ATOM 1823 CA MET B 241 6.924 5.607 28.141 1.00 16.22 C ATOM 1824 C MET B 241 6.551 7.066 27.902 1.00 14.50 C ATOM 1825 O MET B 241 7.350 7.847 27.390 1.00 17.59 O ATOM 1826 CB MET B 241 7.579 5.471 29.543 1.00 14.22 C ATOM 1827 CG MET B 241 8.076 4.055 29.864 1.00 16.57 C ATOM 1828 SD MET B 241 8.869 3.848 31.483 1.00 24.36 S ATOM 1829 CE MET B 241 7.403 3.863 32.552 1.00 18.46 C ATOM 0 H MET B 241 8.457 5.712 26.904 1.00 13.85 H new ATOM 0 HA MET B 241 6.133 5.046 28.121 1.00 16.22 H new ATOM 0 HB2 MET B 241 8.326 6.087 29.602 1.00 14.22 H new ATOM 0 HB3 MET B 241 6.936 5.739 30.218 1.00 14.22 H new ATOM 0 HG2 MET B 241 7.323 3.446 29.811 1.00 16.57 H new ATOM 0 HG3 MET B 241 8.706 3.788 29.177 1.00 16.57 H new ATOM 0 HE1 MET B 241 7.430 4.643 33.127 1.00 18.46 H new ATOM 0 HE2 MET B 241 6.603 3.893 32.004 1.00 18.46 H new ATOM 0 HE3 MET B 241 7.391 3.060 33.097 1.00 18.46 H new ATOM 1830 N LYS B 242 5.342 7.450 28.282 1.00 17.16 N ATOM 1831 CA LYS B 242 4.946 8.845 28.096 1.00 19.46 C ATOM 1832 C LYS B 242 5.109 9.611 29.401 1.00 18.11 C ATOM 1833 O LYS B 242 4.536 9.236 30.412 1.00 21.54 O ATOM 1834 CB LYS B 242 3.518 8.945 27.548 1.00 18.96 C ATOM 1835 CG LYS B 242 2.940 10.360 27.497 1.00 16.38 C ATOM 1836 CD LYS B 242 1.784 10.450 26.508 1.00 19.42 C ATOM 1837 CE LYS B 242 1.138 11.854 26.577 1.00 20.60 C ATOM 1838 NZ LYS B 242 0.192 12.084 25.467 1.00 15.80 N ATOM 0 H LYS B 242 4.749 6.940 28.639 1.00 17.16 H new ATOM 0 HA LYS B 242 5.529 9.251 27.436 1.00 19.46 H new ATOM 0 HB2 LYS B 242 3.503 8.572 26.653 1.00 18.96 H new ATOM 0 HB3 LYS B 242 2.937 8.393 28.095 1.00 18.96 H new ATOM 0 HG2 LYS B 242 2.634 10.619 28.380 1.00 16.38 H new ATOM 0 HG3 LYS B 242 3.635 10.987 27.243 1.00 16.38 H new ATOM 0 HD2 LYS B 242 2.103 10.276 25.609 1.00 19.42 H new ATOM 0 HD3 LYS B 242 1.122 9.771 26.710 1.00 19.42 H new ATOM 0 HE2 LYS B 242 0.673 11.954 27.423 1.00 20.60 H new ATOM 0 HE3 LYS B 242 1.833 12.530 26.554 1.00 20.60 H new ATOM 0 HZ1 LYS B 242 0.008 12.953 25.408 1.00 15.80 H new ATOM 0 HZ2 LYS B 242 0.556 11.806 24.704 1.00 15.80 H new ATOM 0 HZ3 LYS B 242 -0.560 11.632 25.619 1.00 15.80 H new ATOM 1839 N SER B 243 5.922 10.660 29.378 1.00 15.65 N ATOM 1840 CA SER B 243 6.146 11.483 30.566 1.00 16.71 C ATOM 1841 C SER B 243 4.876 12.195 31.028 1.00 22.39 C ATOM 1842 O SER B 243 4.260 12.948 30.269 1.00 20.34 O ATOM 1843 CB SER B 243 7.243 12.516 30.299 1.00 17.80 C ATOM 1844 OG SER B 243 7.304 13.454 31.357 1.00 25.16 O ATOM 0 H SER B 243 6.357 10.915 28.681 1.00 15.65 H new ATOM 0 HA SER B 243 6.424 10.883 31.276 1.00 16.71 H new ATOM 0 HB2 SER B 243 8.099 12.070 30.204 1.00 17.80 H new ATOM 0 HB3 SER B 243 7.068 12.974 29.462 1.00 17.80 H new ATOM 0 HG SER B 243 7.344 13.047 32.091 1.00 25.16 H new ATOM 1845 N PRO B 244 4.469 11.959 32.281 1.00 24.40 N ATOM 1846 CA PRO B 244 3.302 12.682 32.794 1.00 23.33 C ATOM 1847 C PRO B 244 3.629 14.168 33.064 1.00 24.81 C ATOM 1848 O PRO B 244 2.722 14.983 33.201 1.00 26.71 O ATOM 1849 CB PRO B 244 2.994 11.945 34.114 1.00 25.48 C ATOM 1850 CG PRO B 244 4.328 11.402 34.539 1.00 25.05 C ATOM 1851 CD PRO B 244 4.952 10.942 33.234 1.00 21.57 C ATOM 0 HA PRO B 244 2.560 12.691 32.169 1.00 23.33 H new ATOM 0 HB2 PRO B 244 2.626 12.546 34.780 1.00 25.48 H new ATOM 0 HB3 PRO B 244 2.346 11.235 33.983 1.00 25.48 H new ATOM 0 HG2 PRO B 244 4.868 12.080 34.974 1.00 25.05 H new ATOM 0 HG3 PRO B 244 4.232 10.669 35.167 1.00 25.05 H new ATOM 0 HD2 PRO B 244 5.921 10.922 33.283 1.00 21.57 H new ATOM 0 HD3 PRO B 244 4.662 10.049 32.989 1.00 21.57 H new ATOM 1852 N PHE B 245 4.910 14.513 33.128 1.00 24.46 N ATOM 1853 CA PHE B 245 5.330 15.888 33.411 1.00 23.39 C ATOM 1854 C PHE B 245 5.282 16.805 32.195 1.00 26.21 C ATOM 1855 O PHE B 245 4.923 17.981 32.318 1.00 18.86 O ATOM 1856 CB PHE B 245 6.747 15.897 34.013 1.00 25.51 C ATOM 1857 CG PHE B 245 6.904 14.951 35.161 1.00 30.98 C ATOM 1858 CD1 PHE B 245 6.407 15.284 36.420 1.00 29.66 C ATOM 1859 CD2 PHE B 245 7.511 13.715 34.981 1.00 28.87 C ATOM 1860 CE1 PHE B 245 6.533 14.404 37.490 1.00 29.62 C ATOM 1861 CE2 PHE B 245 7.639 12.826 36.043 1.00 33.10 C ATOM 1862 CZ PHE B 245 7.145 13.173 37.299 1.00 36.18 C ATOM 0 H PHE B 245 5.560 13.962 33.010 1.00 24.46 H new ATOM 0 HA PHE B 245 4.690 16.240 34.049 1.00 23.39 H new ATOM 0 HB2 PHE B 245 7.387 15.667 33.322 1.00 25.51 H new ATOM 0 HB3 PHE B 245 6.960 16.795 34.310 1.00 25.51 H new ATOM 0 HD1 PHE B 245 5.986 16.104 36.546 1.00 29.66 H new ATOM 0 HD2 PHE B 245 7.835 13.479 34.142 1.00 28.87 H new ATOM 0 HE1 PHE B 245 6.209 14.639 38.329 1.00 29.62 H new ATOM 0 HE2 PHE B 245 8.053 12.003 35.915 1.00 33.10 H new ATOM 0 HZ PHE B 245 7.225 12.579 38.010 1.00 36.18 H new ATOM 1863 N ASN B 246 5.669 16.290 31.026 1.00 24.62 N ATOM 1864 CA ASN B 246 5.712 17.154 29.850 1.00 23.27 C ATOM 1865 C ASN B 246 5.017 16.569 28.617 1.00 24.67 C ATOM 1866 O ASN B 246 5.083 17.158 27.541 1.00 22.30 O ATOM 1867 CB ASN B 246 7.150 17.592 29.538 1.00 22.03 C ATOM 1868 CG ASN B 246 8.049 16.425 29.107 1.00 22.48 C ATOM 1869 OD1 ASN B 246 7.580 15.310 28.873 1.00 23.71 O ATOM 1870 ND2 ASN B 246 9.346 16.686 29.008 1.00 20.49 N ATOM 0 H ASN B 246 5.902 15.473 30.896 1.00 24.62 H new ATOM 0 HA ASN B 246 5.194 17.941 30.082 1.00 23.27 H new ATOM 0 HB2 ASN B 246 7.135 18.259 28.834 1.00 22.03 H new ATOM 0 HB3 ASN B 246 7.532 18.016 30.323 1.00 22.03 H new ATOM 0 HD21 ASN B 246 9.893 16.065 28.773 1.00 20.49 H new ATOM 0 HD22 ASN B 246 9.640 17.476 29.179 1.00 20.49 H new ATOM 1871 N ASN B 247 4.349 15.424 28.800 1.00 24.22 N ATOM 1872 CA ASN B 247 3.549 14.752 27.754 1.00 17.20 C ATOM 1873 C ASN B 247 4.324 14.226 26.548 1.00 21.28 C ATOM 1874 O ASN B 247 3.740 13.907 25.500 1.00 22.12 O ATOM 1875 CB ASN B 247 2.392 15.633 27.290 1.00 29.13 C ATOM 1876 CG ASN B 247 1.353 15.840 28.374 1.00 33.89 C ATOM 1877 OD1 ASN B 247 1.361 15.157 29.408 1.00 39.73 O ATOM 1878 ND2 ASN B 247 0.460 16.794 28.156 1.00 47.82 N ATOM 0 H ASN B 247 4.346 15.004 29.551 1.00 24.22 H new ATOM 0 HA ASN B 247 3.213 13.959 28.200 1.00 17.20 H new ATOM 0 HB2 ASN B 247 2.738 16.494 27.008 1.00 29.13 H new ATOM 0 HB3 ASN B 247 1.971 15.229 26.515 1.00 29.13 H new ATOM 0 HD21 ASN B 247 -0.145 16.959 28.744 1.00 47.82 H new ATOM 0 HD22 ASN B 247 0.485 17.248 27.426 1.00 47.82 H new ATOM 1879 N ARG B 248 5.632 14.088 26.726 1.00 17.68 N ATOM 1880 CA ARG B 248 6.510 13.593 25.679 1.00 21.86 C ATOM 1881 C ARG B 248 6.777 12.105 25.821 1.00 18.39 C ATOM 1882 O ARG B 248 6.881 11.573 26.936 1.00 15.55 O ATOM 1883 CB ARG B 248 7.847 14.334 25.712 1.00 19.64 C ATOM 1884 CG ARG B 248 7.813 15.672 25.057 1.00 23.89 C ATOM 1885 CD ARG B 248 9.147 16.364 25.198 1.00 24.71 C ATOM 1886 NE ARG B 248 8.969 17.804 25.072 1.00 27.05 N ATOM 1887 CZ ARG B 248 9.221 18.495 23.970 1.00 34.76 C ATOM 1888 NH1 ARG B 248 9.028 19.810 23.965 1.00 33.16 N ATOM 1889 NH2 ARG B 248 9.668 17.876 22.878 1.00 34.69 N ATOM 0 H ARG B 248 6.035 14.280 27.461 1.00 17.68 H new ATOM 0 HA ARG B 248 6.059 13.749 24.835 1.00 21.86 H new ATOM 0 HB2 ARG B 248 8.124 14.443 26.635 1.00 19.64 H new ATOM 0 HB3 ARG B 248 8.520 13.788 25.277 1.00 19.64 H new ATOM 0 HG2 ARG B 248 7.592 15.573 24.118 1.00 23.89 H new ATOM 0 HG3 ARG B 248 7.116 16.216 25.457 1.00 23.89 H new ATOM 0 HD2 ARG B 248 9.542 16.152 26.058 1.00 24.71 H new ATOM 0 HD3 ARG B 248 9.760 16.044 24.518 1.00 24.71 H new ATOM 0 HE ARG B 248 8.681 18.234 25.759 1.00 27.05 H new ATOM 0 HH11 ARG B 248 8.742 20.205 24.673 1.00 33.16 H new ATOM 0 HH12 ARG B 248 9.189 20.266 23.254 1.00 33.16 H new ATOM 0 HH21 ARG B 248 9.794 17.025 22.887 1.00 34.69 H new ATOM 0 HH22 ARG B 248 9.831 18.327 22.164 1.00 34.69 H new ATOM 1890 N TRP B 249 6.912 11.451 24.677 1.00 13.68 N ATOM 1891 CA TRP B 249 7.294 10.055 24.640 1.00 17.11 C ATOM 1892 C TRP B 249 8.804 9.909 24.691 1.00 13.16 C ATOM 1893 O TRP B 249 9.525 10.557 23.942 1.00 17.42 O ATOM 1894 CB TRP B 249 6.759 9.402 23.373 1.00 13.53 C ATOM 1895 CG TRP B 249 5.278 9.219 23.401 1.00 16.93 C ATOM 1896 CD1 TRP B 249 4.338 10.082 22.912 1.00 16.38 C ATOM 1897 CD2 TRP B 249 4.562 8.101 23.931 1.00 15.32 C ATOM 1898 NE1 TRP B 249 3.091 9.577 23.114 1.00 12.47 N ATOM 1899 CE2 TRP B 249 3.190 8.359 23.731 1.00 16.31 C ATOM 1900 CE3 TRP B 249 4.945 6.911 24.571 1.00 15.02 C ATOM 1901 CZ2 TRP B 249 2.186 7.464 24.133 1.00 15.25 C ATOM 1902 CZ3 TRP B 249 3.946 6.014 24.974 1.00 14.75 C ATOM 1903 CH2 TRP B 249 2.582 6.304 24.752 1.00 19.86 C ATOM 0 H TRP B 249 6.785 11.805 23.904 1.00 13.68 H new ATOM 0 HA TRP B 249 6.913 9.614 25.416 1.00 17.11 H new ATOM 0 HB2 TRP B 249 7.000 9.946 22.607 1.00 13.53 H new ATOM 0 HB3 TRP B 249 7.186 8.539 23.253 1.00 13.53 H new ATOM 0 HD1 TRP B 249 4.524 10.895 22.501 1.00 16.38 H new ATOM 0 HE1 TRP B 249 2.356 9.962 22.889 1.00 12.47 H new ATOM 0 HE3 TRP B 249 5.843 6.722 24.724 1.00 15.02 H new ATOM 0 HZ2 TRP B 249 1.287 7.650 23.986 1.00 15.25 H new ATOM 0 HZ3 TRP B 249 4.184 5.218 25.393 1.00 14.75 H new ATOM 0 HH2 TRP B 249 1.937 5.695 25.032 1.00 19.86 H new ATOM 1904 N TYR B 250 9.273 9.036 25.569 1.00 16.34 N ATOM 1905 CA TYR B 250 10.699 8.804 25.750 1.00 14.96 C ATOM 1906 C TYR B 250 10.981 7.341 25.575 1.00 16.33 C ATOM 1907 O TYR B 250 10.242 6.505 26.104 1.00 16.12 O ATOM 1908 CB TYR B 250 11.127 9.179 27.166 1.00 18.30 C ATOM 1909 CG TYR B 250 11.199 10.657 27.440 1.00 20.59 C ATOM 1910 CD1 TYR B 250 12.395 11.346 27.292 1.00 16.03 C ATOM 1911 CD2 TYR B 250 10.078 11.358 27.869 1.00 18.71 C ATOM 1912 CE1 TYR B 250 12.482 12.701 27.556 1.00 19.45 C ATOM 1913 CE2 TYR B 250 10.149 12.725 28.134 1.00 20.65 C ATOM 1914 CZ TYR B 250 11.355 13.390 27.972 1.00 24.04 C ATOM 1915 OH TYR B 250 11.432 14.746 28.241 1.00 27.23 O ATOM 0 H TYR B 250 8.772 8.559 26.080 1.00 16.34 H new ATOM 0 HA TYR B 250 11.181 9.342 25.102 1.00 14.96 H new ATOM 0 HB2 TYR B 250 10.506 8.778 27.794 1.00 18.30 H new ATOM 0 HB3 TYR B 250 11.998 8.789 27.340 1.00 18.30 H new ATOM 0 HD1 TYR B 250 13.153 10.887 27.010 1.00 16.03 H new ATOM 0 HD2 TYR B 250 9.271 10.910 27.981 1.00 18.71 H new ATOM 0 HE1 TYR B 250 13.292 13.146 27.455 1.00 19.45 H new ATOM 0 HE2 TYR B 250 9.393 13.187 28.417 1.00 20.65 H new ATOM 0 HH TYR B 250 12.024 15.094 27.758 1.00 27.23 H new ATOM 1916 N GLN B 251 12.060 7.020 24.866 1.00 13.57 N ATOM 1917 CA GLN B 251 12.477 5.629 24.765 1.00 19.32 C ATOM 1918 C GLN B 251 13.318 5.198 25.979 1.00 16.48 C ATOM 1919 O GLN B 251 14.421 5.688 26.156 1.00 17.69 O ATOM 1920 CB GLN B 251 13.262 5.377 23.468 1.00 16.42 C ATOM 1921 CG GLN B 251 13.629 3.913 23.299 1.00 16.38 C ATOM 1922 CD GLN B 251 14.188 3.597 21.922 1.00 17.72 C ATOM 1923 OE1 GLN B 251 14.210 4.454 21.035 1.00 14.19 O ATOM 1924 NE2 GLN B 251 14.640 2.359 21.740 1.00 12.69 N ATOM 0 H GLN B 251 12.555 7.582 24.444 1.00 13.57 H new ATOM 0 HA GLN B 251 11.669 5.093 24.750 1.00 19.32 H new ATOM 0 HB2 GLN B 251 12.732 5.666 22.709 1.00 16.42 H new ATOM 0 HB3 GLN B 251 14.070 5.914 23.471 1.00 16.42 H new ATOM 0 HG2 GLN B 251 14.283 3.669 23.972 1.00 16.38 H new ATOM 0 HG3 GLN B 251 12.843 3.367 23.457 1.00 16.38 H new ATOM 0 HE21 GLN B 251 14.607 1.790 22.384 1.00 12.69 H new ATOM 0 HE22 GLN B 251 14.965 2.128 20.978 1.00 12.69 H new ATOM 1925 N MET B 252 12.812 4.269 26.791 1.00 15.42 N ATOM 1926 CA MET B 252 13.532 3.839 27.995 1.00 14.64 C ATOM 1927 C MET B 252 14.325 2.573 27.735 1.00 17.72 C ATOM 1928 O MET B 252 15.327 2.308 28.425 1.00 17.31 O ATOM 1929 CB MET B 252 12.559 3.564 29.139 1.00 14.79 C ATOM 1930 CG MET B 252 11.628 4.724 29.376 1.00 22.75 C ATOM 1931 SD MET B 252 12.598 6.202 29.657 1.00 26.50 S ATOM 1932 CE MET B 252 13.411 5.794 31.183 1.00 20.81 C ATOM 0 H MET B 252 12.057 3.876 26.665 1.00 15.42 H new ATOM 0 HA MET B 252 14.135 4.559 28.237 1.00 14.64 H new ATOM 0 HB2 MET B 252 12.040 2.769 28.938 1.00 14.79 H new ATOM 0 HB3 MET B 252 13.058 3.379 29.950 1.00 14.79 H new ATOM 0 HG2 MET B 252 11.044 4.847 28.611 1.00 22.75 H new ATOM 0 HG3 MET B 252 11.059 4.546 30.141 1.00 22.75 H new ATOM 0 HE1 MET B 252 14.194 6.356 31.293 1.00 20.81 H new ATOM 0 HE2 MET B 252 12.802 5.940 31.924 1.00 20.81 H new ATOM 0 HE3 MET B 252 13.682 4.863 31.167 1.00 20.81 H new ATOM 1933 N GLY B 253 13.872 1.797 26.745 1.00 12.12 N ATOM 1934 CA GLY B 253 14.400 0.459 26.514 1.00 13.64 C ATOM 1935 C GLY B 253 14.497 0.076 25.046 1.00 14.85 C ATOM 1936 O GLY B 253 13.888 0.726 24.169 1.00 15.51 O ATOM 0 H GLY B 253 13.255 2.034 26.195 1.00 12.12 H new ATOM 0 HA2 GLY B 253 15.282 0.396 26.914 1.00 13.64 H new ATOM 0 HA3 GLY B 253 13.835 -0.184 26.970 1.00 13.64 H new ATOM 1937 N ILE B 254 15.275 -0.970 24.773 1.00 12.75 N ATOM 1938 CA ILE B 254 15.349 -1.549 23.424 1.00 16.54 C ATOM 1939 C ILE B 254 15.046 -3.019 23.545 1.00 13.04 C ATOM 1940 O ILE B 254 15.644 -3.685 24.372 1.00 15.79 O ATOM 1941 CB ILE B 254 16.748 -1.400 22.796 1.00 15.28 C ATOM 1942 CG1 ILE B 254 17.133 0.074 22.656 1.00 14.86 C ATOM 1943 CG2 ILE B 254 16.827 -2.072 21.429 1.00 13.68 C ATOM 1944 CD1 ILE B 254 18.655 0.244 22.406 1.00 14.55 C ATOM 0 H ILE B 254 15.771 -1.363 25.355 1.00 12.75 H new ATOM 0 HA ILE B 254 14.717 -1.082 22.856 1.00 16.54 H new ATOM 0 HB ILE B 254 17.372 -1.840 23.395 1.00 15.28 H new ATOM 0 HG12 ILE B 254 16.637 0.471 21.923 1.00 14.86 H new ATOM 0 HG13 ILE B 254 16.881 0.553 23.461 1.00 14.86 H new ATOM 0 HG21 ILE B 254 17.719 -1.959 21.064 1.00 13.68 H new ATOM 0 HG22 ILE B 254 16.633 -3.018 21.522 1.00 13.68 H new ATOM 0 HG23 ILE B 254 16.179 -1.667 20.831 1.00 13.68 H new ATOM 0 HD11 ILE B 254 18.866 1.187 22.322 1.00 14.55 H new ATOM 0 HD12 ILE B 254 19.149 -0.132 23.151 1.00 14.55 H new ATOM 0 HD13 ILE B 254 18.902 -0.216 21.589 1.00 14.55 H new ATOM 1945 N VAL B 255 14.096 -3.514 22.759 1.00 13.03 N ATOM 1946 CA VAL B 255 13.777 -4.939 22.754 1.00 15.06 C ATOM 1947 C VAL B 255 15.098 -5.705 22.581 1.00 14.85 C ATOM 1948 O VAL B 255 15.837 -5.485 21.625 1.00 16.02 O ATOM 1949 CB VAL B 255 12.760 -5.309 21.623 1.00 16.23 C ATOM 1950 CG1 VAL B 255 12.482 -6.833 21.602 1.00 17.09 C ATOM 1951 CG2 VAL B 255 11.454 -4.524 21.769 1.00 14.38 C ATOM 0 H VAL B 255 13.623 -3.041 22.219 1.00 13.03 H new ATOM 0 HA VAL B 255 13.347 -5.181 23.589 1.00 15.06 H new ATOM 0 HB VAL B 255 13.163 -5.062 20.776 1.00 16.23 H new ATOM 0 HG11 VAL B 255 11.851 -7.037 20.895 1.00 17.09 H new ATOM 0 HG12 VAL B 255 13.311 -7.311 21.443 1.00 17.09 H new ATOM 0 HG13 VAL B 255 12.110 -7.106 22.455 1.00 17.09 H new ATOM 0 HG21 VAL B 255 10.845 -4.773 21.056 1.00 14.38 H new ATOM 0 HG22 VAL B 255 11.048 -4.727 22.626 1.00 14.38 H new ATOM 0 HG23 VAL B 255 11.640 -3.573 21.717 1.00 14.38 H new ATOM 1952 N SER B 256 15.409 -6.575 23.526 1.00 14.83 N ATOM 1953 CA SER B 256 16.692 -7.259 23.526 1.00 13.76 C ATOM 1954 C SER B 256 16.492 -8.761 23.413 1.00 16.32 C ATOM 1955 O SER B 256 16.586 -9.316 22.314 1.00 21.78 O ATOM 1956 CB SER B 256 17.502 -6.883 24.780 1.00 13.28 C ATOM 1957 OG SER B 256 18.809 -7.429 24.770 1.00 16.17 O ATOM 0 H SER B 256 14.891 -6.785 24.179 1.00 14.83 H new ATOM 0 HA SER B 256 17.202 -6.973 22.752 1.00 13.76 H new ATOM 0 HB2 SER B 256 17.560 -5.917 24.846 1.00 13.28 H new ATOM 0 HB3 SER B 256 17.032 -7.194 25.569 1.00 13.28 H new ATOM 0 HG SER B 256 19.167 -7.287 24.023 1.00 16.17 H new ATOM 1958 N TRP B 257 16.184 -9.427 24.526 1.00 13.48 N ATOM 1959 CA TRP B 257 16.101 -10.887 24.516 1.00 17.67 C ATOM 1960 C TRP B 257 15.054 -11.429 25.455 1.00 18.58 C ATOM 1961 O TRP B 257 14.546 -10.726 26.333 1.00 20.13 O ATOM 1962 CB TRP B 257 17.464 -11.542 24.848 1.00 14.30 C ATOM 1963 CG TRP B 257 17.984 -11.217 26.233 1.00 17.85 C ATOM 1964 CD1 TRP B 257 18.727 -10.131 26.583 1.00 18.39 C ATOM 1965 CD2 TRP B 257 17.801 -11.981 27.441 1.00 17.67 C ATOM 1966 NE1 TRP B 257 19.025 -10.166 27.921 1.00 15.50 N ATOM 1967 CE2 TRP B 257 18.482 -11.295 28.474 1.00 22.70 C ATOM 1968 CE3 TRP B 257 17.147 -13.180 27.747 1.00 16.71 C ATOM 1969 CZ2 TRP B 257 18.518 -11.766 29.804 1.00 16.82 C ATOM 1970 CZ3 TRP B 257 17.183 -13.645 29.062 1.00 21.19 C ATOM 1971 CH2 TRP B 257 17.862 -12.936 30.071 1.00 20.77 C ATOM 0 H TRP B 257 16.022 -9.059 25.286 1.00 13.48 H new ATOM 0 HA TRP B 257 15.841 -11.118 23.611 1.00 17.67 H new ATOM 0 HB2 TRP B 257 17.379 -12.504 24.762 1.00 14.30 H new ATOM 0 HB3 TRP B 257 18.118 -11.255 24.192 1.00 14.30 H new ATOM 0 HD1 TRP B 257 18.995 -9.460 25.997 1.00 18.39 H new ATOM 0 HE1 TRP B 257 19.481 -9.573 28.346 1.00 15.50 H new ATOM 0 HE3 TRP B 257 16.698 -13.657 27.087 1.00 16.71 H new ATOM 0 HZ2 TRP B 257 18.969 -11.300 30.471 1.00 16.82 H new ATOM 0 HZ3 TRP B 257 16.750 -14.439 29.276 1.00 21.19 H new ATOM 0 HH2 TRP B 257 17.865 -13.271 30.939 1.00 20.77 H new ATOM 1972 N GLY B 258 14.750 -12.705 25.264 1.00 18.50 N ATOM 1973 CA GLY B 258 13.877 -13.441 26.156 1.00 21.46 C ATOM 1974 C GLY B 258 14.089 -14.926 25.925 1.00 22.71 C ATOM 1975 O GLY B 258 14.863 -15.325 25.058 1.00 22.58 O ATOM 0 H GLY B 258 15.049 -13.170 24.605 1.00 18.50 H new ATOM 0 HA2 GLY B 258 14.069 -13.213 27.079 1.00 21.46 H new ATOM 0 HA3 GLY B 258 12.951 -13.204 25.992 1.00 21.46 H new ATOM 1976 N GLU B 259 13.420 -15.749 26.716 1.00 23.22 N ATOM 1977 CA GLU B 259 13.454 -17.186 26.499 1.00 30.58 C ATOM 1978 C GLU B 259 12.076 -17.586 26.021 1.00 24.50 C ATOM 1979 O GLU B 259 11.113 -17.557 26.787 1.00 30.07 O ATOM 1980 CB GLU B 259 13.841 -17.912 27.792 1.00 27.80 C ATOM 1981 CG GLU B 259 15.128 -17.375 28.412 1.00 27.68 C ATOM 1982 CD GLU B 259 15.346 -17.851 29.853 1.00 31.89 C ATOM 1983 OE1 GLU B 259 15.680 -19.039 30.051 1.00 39.52 O ATOM 1984 OE2 GLU B 259 15.193 -17.031 30.781 1.00 28.06 O ATOM 0 H GLU B 259 12.940 -15.497 27.384 1.00 23.22 H new ATOM 0 HA GLU B 259 14.120 -17.431 25.838 1.00 30.58 H new ATOM 0 HB2 GLU B 259 13.118 -17.827 28.434 1.00 27.80 H new ATOM 0 HB3 GLU B 259 13.947 -18.858 27.607 1.00 27.80 H new ATOM 0 HG2 GLU B 259 15.882 -17.651 27.868 1.00 27.68 H new ATOM 0 HG3 GLU B 259 15.108 -16.405 28.397 1.00 27.68 H new ATOM 1985 N GLY B 260 11.980 -17.937 24.744 1.00 23.63 N ATOM 1986 CA GLY B 260 10.685 -18.073 24.108 1.00 31.16 C ATOM 1987 C GLY B 260 10.009 -16.710 24.033 1.00 30.03 C ATOM 1988 O GLY B 260 10.683 -15.677 24.074 1.00 27.23 O ATOM 0 H GLY B 260 12.652 -18.100 24.233 1.00 23.63 H new ATOM 0 HA2 GLY B 260 10.789 -18.443 23.217 1.00 31.16 H new ATOM 0 HA3 GLY B 260 10.131 -18.692 24.609 1.00 31.16 H new ATOM 1989 N CYS B 261 8.683 -16.711 23.924 1.00 24.68 N ATOM 1990 CA CYS B 261 7.892 -15.488 23.903 1.00 25.01 C ATOM 1991 C CYS B 261 6.645 -15.700 24.724 1.00 26.66 C ATOM 1992 O CYS B 261 5.953 -16.707 24.561 1.00 28.33 O ATOM 1993 CB CYS B 261 7.490 -15.124 22.473 1.00 20.69 C ATOM 1994 SG CYS B 261 8.886 -15.064 21.388 1.00 23.26 S ATOM 0 H CYS B 261 8.215 -17.429 23.860 1.00 24.68 H new ATOM 0 HA CYS B 261 8.425 -14.765 24.269 1.00 25.01 H new ATOM 0 HB2 CYS B 261 6.851 -15.775 22.142 1.00 20.69 H new ATOM 0 HB3 CYS B 261 7.044 -14.263 22.473 1.00 20.69 H new ATOM 1995 N ASP B 262 6.359 -14.750 25.606 1.00 22.31 N ATOM 1996 CA ASP B 262 5.141 -14.791 26.410 1.00 28.10 C ATOM 1997 C ASP B 262 4.975 -16.107 27.179 1.00 25.79 C ATOM 1998 O ASP B 262 3.860 -16.605 27.329 1.00 26.59 O ATOM 1999 CB ASP B 262 3.897 -14.502 25.549 1.00 24.11 C ATOM 2000 CG ASP B 262 2.662 -14.158 26.388 1.00 27.81 C ATOM 2001 OD1 ASP B 262 2.791 -13.423 27.400 1.00 28.36 O ATOM 2002 OD2 ASP B 262 1.555 -14.612 26.031 1.00 27.04 O ATOM 0 H ASP B 262 6.860 -14.068 25.756 1.00 22.31 H new ATOM 0 HA ASP B 262 5.230 -14.089 27.074 1.00 28.10 H new ATOM 0 HB2 ASP B 262 4.089 -13.766 24.947 1.00 24.11 H new ATOM 0 HB3 ASP B 262 3.703 -15.276 24.998 1.00 24.11 H new ATOM 2003 N ARG B 263 6.077 -16.666 27.670 1.00 25.77 N ATOM 2004 CA ARG B 263 5.978 -17.818 28.575 1.00 33.58 C ATOM 2005 C ARG B 263 5.652 -17.374 29.989 1.00 30.98 C ATOM 2006 O ARG B 263 6.159 -16.354 30.450 1.00 27.08 O ATOM 2007 CB ARG B 263 7.269 -18.628 28.589 1.00 28.07 C ATOM 2008 CG ARG B 263 7.533 -19.348 27.288 1.00 34.98 C ATOM 2009 CD ARG B 263 8.676 -20.324 27.449 1.00 36.37 C ATOM 2010 NE ARG B 263 9.116 -20.819 26.156 1.00 34.24 N ATOM 2011 CZ ARG B 263 10.301 -21.371 25.939 1.00 42.34 C ATOM 2012 NH1 ARG B 263 10.621 -21.786 24.718 1.00 43.11 N ATOM 2013 NH2 ARG B 263 11.167 -21.506 26.939 1.00 43.72 N ATOM 0 H ARG B 263 6.878 -16.403 27.499 1.00 25.77 H new ATOM 0 HA ARG B 263 5.260 -18.378 28.242 1.00 33.58 H new ATOM 0 HB2 ARG B 263 8.013 -18.036 28.781 1.00 28.07 H new ATOM 0 HB3 ARG B 263 7.229 -19.277 29.309 1.00 28.07 H new ATOM 0 HG2 ARG B 263 6.734 -19.820 27.005 1.00 34.98 H new ATOM 0 HG3 ARG B 263 7.744 -18.705 26.593 1.00 34.98 H new ATOM 0 HD2 ARG B 263 9.416 -19.891 27.903 1.00 36.37 H new ATOM 0 HD3 ARG B 263 8.397 -21.067 28.007 1.00 36.37 H new ATOM 0 HE ARG B 263 8.575 -20.750 25.491 1.00 34.24 H new ATOM 0 HH11 ARG B 263 10.060 -21.696 24.072 1.00 43.11 H new ATOM 0 HH12 ARG B 263 11.389 -22.145 24.573 1.00 43.11 H new ATOM 0 HH21 ARG B 263 10.958 -21.235 27.728 1.00 43.72 H new ATOM 0 HH22 ARG B 263 11.936 -21.864 26.797 1.00 43.72 H new ATOM 2014 N ASP B 264 4.810 -18.141 30.675 1.00 31.88 N ATOM 2015 CA ASP B 264 4.532 -17.879 32.085 1.00 33.71 C ATOM 2016 C ASP B 264 5.817 -17.937 32.888 1.00 31.72 C ATOM 2017 O ASP B 264 6.616 -18.865 32.722 1.00 28.74 O ATOM 2018 CB ASP B 264 3.549 -18.908 32.641 1.00 38.32 C ATOM 2019 CG ASP B 264 2.156 -18.751 32.070 1.00 43.05 C ATOM 2020 OD1 ASP B 264 1.679 -17.601 31.958 1.00 41.55 O ATOM 2021 OD2 ASP B 264 1.534 -19.782 31.742 1.00 50.50 O ATOM 0 H ASP B 264 4.391 -18.815 30.345 1.00 31.88 H new ATOM 0 HA ASP B 264 4.141 -16.994 32.156 1.00 33.71 H new ATOM 0 HB2 ASP B 264 3.876 -19.800 32.446 1.00 38.32 H new ATOM 0 HB3 ASP B 264 3.510 -18.824 33.607 1.00 38.32 H new ATOM 2022 N GLY B 265 6.013 -16.939 33.749 1.00 33.19 N ATOM 2023 CA GLY B 265 7.138 -16.920 34.670 1.00 30.04 C ATOM 2024 C GLY B 265 8.443 -16.531 33.996 1.00 33.37 C ATOM 2025 O GLY B 265 9.521 -16.627 34.600 1.00 29.19 O ATOM 0 H GLY B 265 5.495 -16.256 33.812 1.00 33.19 H new ATOM 0 HA2 GLY B 265 6.952 -16.296 35.389 1.00 30.04 H new ATOM 0 HA3 GLY B 265 7.236 -17.797 35.073 1.00 30.04 H new ATOM 2026 N LYS B 266 8.346 -16.113 32.735 1.00 26.17 N ATOM 2027 CA LYS B 266 9.482 -15.556 32.014 1.00 23.07 C ATOM 2028 C LYS B 266 9.172 -14.106 31.613 1.00 28.46 C ATOM 2029 O LYS B 266 8.010 -13.717 31.508 1.00 26.07 O ATOM 2030 CB LYS B 266 9.783 -16.390 30.777 1.00 28.27 C ATOM 2031 CG LYS B 266 10.197 -17.825 31.099 1.00 33.19 C ATOM 2032 CD LYS B 266 11.585 -17.876 31.714 1.00 26.66 C ATOM 2033 CE LYS B 266 12.131 -19.303 31.720 1.00 28.46 C ATOM 2034 NZ LYS B 266 13.614 -19.305 31.881 1.00 37.49 N ATOM 0 H LYS B 266 7.619 -16.145 32.276 1.00 26.17 H new ATOM 0 HA LYS B 266 10.262 -15.569 32.590 1.00 23.07 H new ATOM 0 HB2 LYS B 266 8.998 -16.407 30.208 1.00 28.27 H new ATOM 0 HB3 LYS B 266 10.491 -15.962 30.271 1.00 28.27 H new ATOM 0 HG2 LYS B 266 9.556 -18.219 31.711 1.00 33.19 H new ATOM 0 HG3 LYS B 266 10.181 -18.358 30.289 1.00 33.19 H new ATOM 0 HD2 LYS B 266 12.184 -17.299 31.215 1.00 26.66 H new ATOM 0 HD3 LYS B 266 11.553 -17.535 32.621 1.00 26.66 H new ATOM 0 HE2 LYS B 266 11.723 -19.806 32.442 1.00 28.46 H new ATOM 0 HE3 LYS B 266 11.891 -19.749 30.892 1.00 28.46 H new ATOM 0 HZ1 LYS B 266 13.996 -19.535 31.111 1.00 37.49 H new ATOM 0 HZ2 LYS B 266 13.888 -18.492 32.117 1.00 37.49 H new ATOM 0 HZ3 LYS B 266 13.844 -19.890 32.512 1.00 37.49 H new ATOM 2035 N TYR B 267 10.210 -13.312 31.379 1.00 26.31 N ATOM 2036 CA TYR B 267 10.022 -11.897 31.099 1.00 26.67 C ATOM 2037 C TYR B 267 10.822 -11.434 29.875 1.00 24.28 C ATOM 2038 O TYR B 267 11.826 -12.047 29.506 1.00 21.61 O ATOM 2039 CB TYR B 267 10.363 -11.063 32.350 1.00 20.08 C ATOM 2040 CG TYR B 267 9.496 -11.454 33.524 1.00 27.50 C ATOM 2041 CD1 TYR B 267 9.907 -12.437 34.415 1.00 23.09 C ATOM 2042 CD2 TYR B 267 8.246 -10.873 33.714 1.00 26.20 C ATOM 2043 CE1 TYR B 267 9.106 -12.820 35.470 1.00 30.30 C ATOM 2044 CE2 TYR B 267 7.438 -11.243 34.765 1.00 24.23 C ATOM 2045 CZ TYR B 267 7.867 -12.226 35.639 1.00 34.56 C ATOM 2046 OH TYR B 267 7.068 -12.613 36.698 1.00 33.14 O ATOM 0 H TYR B 267 11.029 -13.573 31.378 1.00 26.31 H new ATOM 0 HA TYR B 267 9.088 -11.758 30.878 1.00 26.67 H new ATOM 0 HB2 TYR B 267 11.297 -11.188 32.580 1.00 20.08 H new ATOM 0 HB3 TYR B 267 10.242 -10.120 32.156 1.00 20.08 H new ATOM 0 HD1 TYR B 267 10.735 -12.843 34.298 1.00 23.09 H new ATOM 0 HD2 TYR B 267 7.951 -10.222 33.119 1.00 26.20 H new ATOM 0 HE1 TYR B 267 9.396 -13.474 36.065 1.00 30.30 H new ATOM 0 HE2 TYR B 267 6.611 -10.836 34.887 1.00 24.23 H new ATOM 0 HH TYR B 267 7.376 -13.316 37.039 1.00 33.14 H new ATOM 2047 N GLY B 268 10.359 -10.359 29.243 1.00 15.97 N ATOM 2048 CA GLY B 268 11.125 -9.745 28.187 1.00 17.18 C ATOM 2049 C GLY B 268 12.238 -8.929 28.811 1.00 17.27 C ATOM 2050 O GLY B 268 12.038 -8.286 29.850 1.00 13.60 O ATOM 0 H GLY B 268 9.608 -9.978 29.415 1.00 15.97 H new ATOM 0 HA2 GLY B 268 11.493 -10.423 27.600 1.00 17.18 H new ATOM 0 HA3 GLY B 268 10.556 -9.178 27.644 1.00 17.18 H new ATOM 2051 N PHE B 269 13.417 -8.979 28.200 1.00 16.84 N ATOM 2052 CA PHE B 269 14.520 -8.137 28.639 1.00 16.91 C ATOM 2053 C PHE B 269 14.810 -7.011 27.640 1.00 15.69 C ATOM 2054 O PHE B 269 14.801 -7.205 26.426 1.00 17.56 O ATOM 2055 CB PHE B 269 15.772 -8.972 28.970 1.00 15.94 C ATOM 2056 CG PHE B 269 15.678 -9.712 30.287 1.00 17.03 C ATOM 2057 CD1 PHE B 269 15.043 -10.951 30.364 1.00 16.98 C ATOM 2058 CD2 PHE B 269 16.202 -9.158 31.453 1.00 15.72 C ATOM 2059 CE1 PHE B 269 14.941 -11.630 31.581 1.00 19.40 C ATOM 2060 CE2 PHE B 269 16.110 -9.840 32.689 1.00 15.01 C ATOM 2061 CZ PHE B 269 15.489 -11.066 32.753 1.00 17.29 C ATOM 0 H PHE B 269 13.597 -9.491 27.533 1.00 16.84 H new ATOM 0 HA PHE B 269 14.248 -7.706 29.464 1.00 16.91 H new ATOM 0 HB2 PHE B 269 15.921 -9.613 28.258 1.00 15.94 H new ATOM 0 HB3 PHE B 269 16.545 -8.387 28.991 1.00 15.94 H new ATOM 0 HD1 PHE B 269 14.683 -11.330 29.595 1.00 16.98 H new ATOM 0 HD2 PHE B 269 16.619 -8.327 31.418 1.00 15.72 H new ATOM 0 HE1 PHE B 269 14.512 -12.454 31.619 1.00 19.40 H new ATOM 0 HE2 PHE B 269 16.469 -9.460 33.458 1.00 15.01 H new ATOM 0 HZ PHE B 269 15.431 -11.520 33.563 1.00 17.29 H new ATOM 2062 N TYR B 270 15.102 -5.836 28.185 1.00 16.88 N ATOM 2063 CA TYR B 270 15.282 -4.621 27.421 1.00 10.97 C ATOM 2064 C TYR B 270 16.612 -3.990 27.747 1.00 17.40 C ATOM 2065 O TYR B 270 17.014 -3.938 28.911 1.00 15.30 O ATOM 2066 CB TYR B 270 14.137 -3.638 27.766 1.00 11.10 C ATOM 2067 CG TYR B 270 12.840 -4.220 27.331 1.00 17.14 C ATOM 2068 CD1 TYR B 270 12.156 -5.124 28.145 1.00 14.48 C ATOM 2069 CD2 TYR B 270 12.351 -3.978 26.055 1.00 15.18 C ATOM 2070 CE1 TYR B 270 11.000 -5.713 27.722 1.00 17.77 C ATOM 2071 CE2 TYR B 270 11.184 -4.559 25.629 1.00 15.24 C ATOM 2072 CZ TYR B 270 10.514 -5.430 26.461 1.00 15.22 C ATOM 2073 OH TYR B 270 9.355 -6.029 26.023 1.00 18.39 O ATOM 0 H TYR B 270 15.202 -5.726 29.032 1.00 16.88 H new ATOM 0 HA TYR B 270 15.264 -4.830 26.474 1.00 10.97 H new ATOM 0 HB2 TYR B 270 14.122 -3.465 28.720 1.00 11.10 H new ATOM 0 HB3 TYR B 270 14.285 -2.786 27.326 1.00 11.10 H new ATOM 0 HD1 TYR B 270 12.493 -5.328 28.988 1.00 14.48 H new ATOM 0 HD2 TYR B 270 12.820 -3.415 25.482 1.00 15.18 H new ATOM 0 HE1 TYR B 270 10.543 -6.301 28.279 1.00 17.77 H new ATOM 0 HE2 TYR B 270 10.847 -4.366 24.784 1.00 15.24 H new ATOM 0 HH TYR B 270 9.386 -6.123 25.189 1.00 18.39 H new ATOM 2074 N THR B 271 17.283 -3.474 26.724 1.00 15.14 N ATOM 2075 CA THR B 271 18.484 -2.707 26.956 1.00 15.47 C ATOM 2076 C THR B 271 18.113 -1.414 27.708 1.00 15.92 C ATOM 2077 O THR B 271 17.162 -0.729 27.356 1.00 15.23 O ATOM 2078 CB THR B 271 19.172 -2.384 25.623 1.00 14.72 C ATOM 2079 OG1 THR B 271 19.387 -3.605 24.910 1.00 15.59 O ATOM 2080 CG2 THR B 271 20.508 -1.666 25.848 1.00 18.20 C ATOM 0 H THR B 271 17.058 -3.558 25.898 1.00 15.14 H new ATOM 0 HA THR B 271 19.105 -3.222 27.494 1.00 15.47 H new ATOM 0 HB THR B 271 18.602 -1.791 25.109 1.00 14.72 H new ATOM 0 HG1 THR B 271 19.850 -3.453 24.226 1.00 15.59 H new ATOM 0 HG21 THR B 271 20.921 -1.474 24.991 1.00 18.20 H new ATOM 0 HG22 THR B 271 20.353 -0.836 26.325 1.00 18.20 H new ATOM 0 HG23 THR B 271 21.097 -2.233 26.370 1.00 18.20 H new ATOM 2081 N HIS B 272 18.866 -1.094 28.748 1.00 14.25 N ATOM 2082 CA HIS B 272 18.597 0.087 29.563 1.00 19.25 C ATOM 2083 C HIS B 272 19.230 1.295 28.895 1.00 22.26 C ATOM 2084 O HIS B 272 20.440 1.529 29.034 1.00 21.94 O ATOM 2085 CB HIS B 272 19.192 -0.095 30.964 1.00 18.40 C ATOM 2086 CG HIS B 272 18.769 0.948 31.954 1.00 21.59 C ATOM 2087 ND1 HIS B 272 18.844 2.298 31.690 1.00 25.34 N ATOM 2088 CD2 HIS B 272 18.320 0.841 33.232 1.00 23.06 C ATOM 2089 CE1 HIS B 272 18.442 2.977 32.751 1.00 26.84 C ATOM 2090 NE2 HIS B 272 18.117 2.117 33.701 1.00 21.81 N ATOM 0 H HIS B 272 19.547 -1.552 29.004 1.00 14.25 H new ATOM 0 HA HIS B 272 17.639 0.215 29.645 1.00 19.25 H new ATOM 0 HB2 HIS B 272 18.937 -0.968 31.301 1.00 18.40 H new ATOM 0 HB3 HIS B 272 20.160 -0.088 30.896 1.00 18.40 H new ATOM 0 HD2 HIS B 272 18.177 0.051 33.702 1.00 23.06 H new ATOM 0 HE1 HIS B 272 18.396 3.903 32.818 1.00 26.84 H new ATOM 0 HE2 HIS B 272 17.826 2.322 34.484 1.00 21.81 H new ATOM 2091 N VAL B 273 18.415 2.060 28.176 1.00 15.89 N ATOM 2092 CA VAL B 273 18.919 3.140 27.337 1.00 19.01 C ATOM 2093 C VAL B 273 19.632 4.243 28.125 1.00 18.64 C ATOM 2094 O VAL B 273 20.718 4.682 27.748 1.00 22.27 O ATOM 2095 CB VAL B 273 17.783 3.761 26.460 1.00 19.41 C ATOM 2096 CG1 VAL B 273 18.253 5.027 25.795 1.00 16.26 C ATOM 2097 CG2 VAL B 273 17.304 2.756 25.423 1.00 15.28 C ATOM 0 H VAL B 273 17.560 1.968 28.161 1.00 15.89 H new ATOM 0 HA VAL B 273 19.581 2.729 26.759 1.00 19.01 H new ATOM 0 HB VAL B 273 17.038 3.984 27.039 1.00 19.41 H new ATOM 0 HG11 VAL B 273 17.535 5.396 25.257 1.00 16.26 H new ATOM 0 HG12 VAL B 273 18.513 5.671 26.472 1.00 16.26 H new ATOM 0 HG13 VAL B 273 19.014 4.831 25.227 1.00 16.26 H new ATOM 0 HG21 VAL B 273 16.600 3.154 24.887 1.00 15.28 H new ATOM 0 HG22 VAL B 273 18.045 2.505 24.849 1.00 15.28 H new ATOM 0 HG23 VAL B 273 16.961 1.967 25.871 1.00 15.28 H new ATOM 2098 N PHE B 274 19.038 4.715 29.207 1.00 18.20 N ATOM 2099 CA PHE B 274 19.697 5.810 29.891 1.00 23.71 C ATOM 2100 C PHE B 274 21.090 5.425 30.389 1.00 22.42 C ATOM 2101 O PHE B 274 22.006 6.225 30.314 1.00 19.81 O ATOM 2102 CB PHE B 274 18.888 6.381 31.041 1.00 27.81 C ATOM 2103 CG PHE B 274 19.640 7.416 31.795 1.00 28.74 C ATOM 2104 CD1 PHE B 274 19.926 8.640 31.196 1.00 29.68 C ATOM 2105 CD2 PHE B 274 20.152 7.142 33.059 1.00 30.39 C ATOM 2106 CE1 PHE B 274 20.662 9.603 31.866 1.00 32.08 C ATOM 2107 CE2 PHE B 274 20.891 8.102 33.738 1.00 30.32 C ATOM 2108 CZ PHE B 274 21.143 9.331 33.143 1.00 36.03 C ATOM 0 H PHE B 274 18.298 4.437 29.546 1.00 18.20 H new ATOM 0 HA PHE B 274 19.781 6.504 29.218 1.00 23.71 H new ATOM 0 HB2 PHE B 274 18.067 6.766 30.697 1.00 27.81 H new ATOM 0 HB3 PHE B 274 18.634 5.664 31.643 1.00 27.81 H new ATOM 0 HD1 PHE B 274 19.619 8.813 30.335 1.00 29.68 H new ATOM 0 HD2 PHE B 274 19.999 6.313 33.451 1.00 30.39 H new ATOM 0 HE1 PHE B 274 20.833 10.425 31.466 1.00 32.08 H new ATOM 0 HE2 PHE B 274 21.217 7.922 34.590 1.00 30.32 H new ATOM 0 HZ PHE B 274 21.635 9.975 33.600 1.00 36.03 H new ATOM 2109 N ARG B 275 21.240 4.193 30.874 1.00 21.59 N ATOM 2110 CA ARG B 275 22.530 3.707 31.341 1.00 26.04 C ATOM 2111 C ARG B 275 23.611 3.782 30.272 1.00 30.60 C ATOM 2112 O ARG B 275 24.781 3.861 30.608 1.00 33.05 O ATOM 2113 CB ARG B 275 22.418 2.254 31.818 1.00 27.84 C ATOM 2114 CG ARG B 275 21.739 2.081 33.167 1.00 32.34 C ATOM 2115 CD ARG B 275 22.727 2.172 34.294 1.00 31.39 C ATOM 2116 NE ARG B 275 23.815 1.218 34.115 1.00 43.42 N ATOM 2117 CZ ARG B 275 24.841 1.083 34.951 1.00 44.87 C ATOM 2118 NH1 ARG B 275 25.790 0.179 34.704 1.00 37.31 N ATOM 2119 NH2 ARG B 275 24.915 1.849 36.032 1.00 48.77 N ATOM 0 H ARG B 275 20.600 3.622 30.940 1.00 21.59 H new ATOM 0 HA ARG B 275 22.787 4.288 32.074 1.00 26.04 H new ATOM 0 HB2 ARG B 275 21.927 1.745 31.154 1.00 27.84 H new ATOM 0 HB3 ARG B 275 23.308 1.872 31.866 1.00 27.84 H new ATOM 0 HG2 ARG B 275 21.057 2.762 33.277 1.00 32.34 H new ATOM 0 HG3 ARG B 275 21.290 1.222 33.197 1.00 32.34 H new ATOM 0 HD2 ARG B 275 23.086 3.072 34.342 1.00 31.39 H new ATOM 0 HD3 ARG B 275 22.278 2.001 35.137 1.00 31.39 H new ATOM 0 HE ARG B 275 23.792 0.708 33.423 1.00 43.42 H new ATOM 0 HH11 ARG B 275 25.739 -0.317 34.004 1.00 37.31 H new ATOM 0 HH12 ARG B 275 26.453 0.093 35.245 1.00 37.31 H new ATOM 0 HH21 ARG B 275 24.301 2.430 36.190 1.00 48.77 H new ATOM 0 HH22 ARG B 275 25.577 1.764 36.575 1.00 48.77 H new ATOM 2120 N LEU B 276 23.231 3.714 28.994 1.00 27.00 N ATOM 2121 CA LEU B 276 24.210 3.709 27.914 1.00 20.65 C ATOM 2122 C LEU B 276 24.213 5.056 27.201 1.00 26.55 C ATOM 2123 O LEU B 276 24.705 5.176 26.074 1.00 24.69 O ATOM 2124 CB LEU B 276 23.920 2.572 26.921 1.00 27.36 C ATOM 2125 CG LEU B 276 23.771 1.167 27.540 1.00 28.24 C ATOM 2126 CD1 LEU B 276 23.345 0.119 26.517 1.00 27.41 C ATOM 2127 CD2 LEU B 276 25.059 0.734 28.228 1.00 28.48 C ATOM 0 H LEU B 276 22.412 3.670 28.735 1.00 27.00 H new ATOM 0 HA LEU B 276 25.089 3.558 28.296 1.00 20.65 H new ATOM 0 HB2 LEU B 276 23.104 2.784 26.441 1.00 27.36 H new ATOM 0 HB3 LEU B 276 24.636 2.545 26.267 1.00 27.36 H new ATOM 0 HG LEU B 276 23.064 1.232 28.201 1.00 28.24 H new ATOM 0 HD11 LEU B 276 23.265 -0.744 26.952 1.00 27.41 H new ATOM 0 HD12 LEU B 276 22.489 0.369 26.135 1.00 27.41 H new ATOM 0 HD13 LEU B 276 24.010 0.065 25.813 1.00 27.41 H new ATOM 0 HD21 LEU B 276 24.941 -0.150 28.609 1.00 28.48 H new ATOM 0 HD22 LEU B 276 25.781 0.713 27.580 1.00 28.48 H new ATOM 0 HD23 LEU B 276 25.276 1.363 28.934 1.00 28.48 H new ATOM 2128 N LYS B 277 23.676 6.077 27.859 1.00 24.06 N ATOM 2129 CA LYS B 277 23.480 7.349 27.177 1.00 29.67 C ATOM 2130 C LYS B 277 24.778 8.088 26.872 1.00 34.53 C ATOM 2131 O LYS B 277 24.872 8.771 25.834 1.00 30.42 O ATOM 2132 CB LYS B 277 22.507 8.269 27.915 1.00 27.11 C ATOM 2133 CG LYS B 277 21.807 9.211 26.940 1.00 34.39 C ATOM 2134 CD LYS B 277 21.261 10.440 27.622 1.00 37.88 C ATOM 2135 CE LYS B 277 20.455 11.279 26.640 1.00 39.71 C ATOM 2136 NZ LYS B 277 19.804 12.432 27.333 1.00 42.61 N ATOM 0 H LYS B 277 23.424 6.056 28.681 1.00 24.06 H new ATOM 0 HA LYS B 277 23.083 7.107 26.325 1.00 29.67 H new ATOM 0 HB2 LYS B 277 21.848 7.737 28.387 1.00 27.11 H new ATOM 0 HB3 LYS B 277 22.986 8.785 28.582 1.00 27.11 H new ATOM 0 HG2 LYS B 277 22.431 9.479 26.248 1.00 34.39 H new ATOM 0 HG3 LYS B 277 21.082 8.739 26.501 1.00 34.39 H new ATOM 0 HD2 LYS B 277 20.701 10.180 28.370 1.00 37.88 H new ATOM 0 HD3 LYS B 277 21.990 10.967 27.984 1.00 37.88 H new ATOM 0 HE2 LYS B 277 21.036 11.606 25.936 1.00 39.71 H new ATOM 0 HE3 LYS B 277 19.779 10.727 26.217 1.00 39.71 H new ATOM 0 HZ1 LYS B 277 19.474 12.995 26.728 1.00 42.61 H new ATOM 0 HZ2 LYS B 277 19.144 12.134 27.851 1.00 42.61 H new ATOM 0 HZ3 LYS B 277 20.405 12.855 27.834 1.00 42.61 H new ATOM 2137 N LYS B 278 25.775 7.942 27.747 1.00 25.10 N ATOM 2138 CA LYS B 278 27.049 8.609 27.511 1.00 31.47 C ATOM 2139 C LYS B 278 27.748 8.007 26.292 1.00 31.97 C ATOM 2140 O LYS B 278 28.392 8.726 25.518 1.00 29.68 O ATOM 2141 CB LYS B 278 27.952 8.611 28.758 1.00 39.25 C ATOM 2142 CG LYS B 278 28.370 7.238 29.275 1.00 52.19 C ATOM 2143 CD LYS B 278 29.074 7.334 30.634 1.00 56.86 C ATOM 2144 CE LYS B 278 29.521 5.956 31.124 1.00 65.52 C ATOM 2145 NZ LYS B 278 30.173 6.009 32.466 1.00 72.60 N ATOM 0 H LYS B 278 25.734 7.472 28.466 1.00 25.10 H new ATOM 0 HA LYS B 278 26.863 9.542 27.320 1.00 31.47 H new ATOM 0 HB2 LYS B 278 28.753 9.120 28.556 1.00 39.25 H new ATOM 0 HB3 LYS B 278 27.490 9.080 29.471 1.00 39.25 H new ATOM 0 HG2 LYS B 278 27.588 6.670 29.355 1.00 52.19 H new ATOM 0 HG3 LYS B 278 28.962 6.817 28.633 1.00 52.19 H new ATOM 0 HD2 LYS B 278 29.844 7.920 30.562 1.00 56.86 H new ATOM 0 HD3 LYS B 278 28.475 7.732 31.284 1.00 56.86 H new ATOM 0 HE2 LYS B 278 28.752 5.366 31.164 1.00 65.52 H new ATOM 0 HE3 LYS B 278 30.139 5.573 30.482 1.00 65.52 H new ATOM 0 HZ1 LYS B 278 30.416 5.189 32.711 1.00 72.60 H new ATOM 0 HZ2 LYS B 278 30.892 6.532 32.426 1.00 72.60 H new ATOM 0 HZ3 LYS B 278 29.600 6.338 33.062 1.00 72.60 H new ATOM 2146 N TRP B 279 27.604 6.698 26.097 1.00 27.58 N ATOM 2147 CA TRP B 279 28.121 6.102 24.869 1.00 29.66 C ATOM 2148 C TRP B 279 27.388 6.644 23.650 1.00 29.58 C ATOM 2149 O TRP B 279 28.001 6.896 22.618 1.00 28.87 O ATOM 2150 CB TRP B 279 28.036 4.580 24.856 1.00 26.52 C ATOM 2151 CG TRP B 279 28.462 4.049 23.524 1.00 26.88 C ATOM 2152 CD1 TRP B 279 29.748 3.949 23.053 1.00 26.84 C ATOM 2153 CD2 TRP B 279 27.611 3.575 22.471 1.00 27.12 C ATOM 2154 NE1 TRP B 279 29.747 3.429 21.782 1.00 26.25 N ATOM 2155 CE2 TRP B 279 28.453 3.194 21.395 1.00 25.44 C ATOM 2156 CE3 TRP B 279 26.224 3.427 22.330 1.00 24.27 C ATOM 2157 CZ2 TRP B 279 27.950 2.675 20.195 1.00 25.76 C ATOM 2158 CZ3 TRP B 279 25.726 2.919 21.132 1.00 23.76 C ATOM 2159 CH2 TRP B 279 26.589 2.547 20.084 1.00 25.09 C ATOM 0 H TRP B 279 27.223 6.154 26.643 1.00 27.58 H new ATOM 0 HA TRP B 279 29.059 6.348 24.835 1.00 29.66 H new ATOM 0 HB2 TRP B 279 28.601 4.212 25.554 1.00 26.52 H new ATOM 0 HB3 TRP B 279 27.128 4.299 25.048 1.00 26.52 H new ATOM 0 HD1 TRP B 279 30.509 4.197 23.526 1.00 26.84 H new ATOM 0 HE1 TRP B 279 30.446 3.275 21.305 1.00 26.25 H new ATOM 0 HE3 TRP B 279 25.649 3.663 23.021 1.00 24.27 H new ATOM 0 HZ2 TRP B 279 28.517 2.427 19.501 1.00 25.76 H new ATOM 0 HZ3 TRP B 279 24.807 2.824 21.023 1.00 23.76 H new ATOM 0 HH2 TRP B 279 26.228 2.206 19.298 1.00 25.09 H new ATOM 2160 N ILE B 280 26.074 6.810 23.773 1.00 26.94 N ATOM 2161 CA ILE B 280 25.280 7.350 22.676 1.00 28.45 C ATOM 2162 C ILE B 280 25.704 8.782 22.336 1.00 31.03 C ATOM 2163 O ILE B 280 25.907 9.120 21.168 1.00 31.19 O ATOM 2164 CB ILE B 280 23.772 7.331 23.002 1.00 27.50 C ATOM 2165 CG1 ILE B 280 23.240 5.900 22.961 1.00 24.36 C ATOM 2166 CG2 ILE B 280 22.995 8.208 22.033 1.00 23.00 C ATOM 2167 CD1 ILE B 280 21.837 5.779 23.504 1.00 29.79 C ATOM 0 H ILE B 280 25.625 6.617 24.481 1.00 26.94 H new ATOM 0 HA ILE B 280 25.441 6.779 21.909 1.00 28.45 H new ATOM 0 HB ILE B 280 23.651 7.686 23.896 1.00 27.50 H new ATOM 0 HG12 ILE B 280 23.256 5.580 22.045 1.00 24.36 H new ATOM 0 HG13 ILE B 280 23.831 5.325 23.473 1.00 24.36 H new ATOM 0 HG21 ILE B 280 22.052 8.181 22.257 1.00 23.00 H new ATOM 0 HG22 ILE B 280 23.315 9.122 22.095 1.00 23.00 H new ATOM 0 HG23 ILE B 280 23.122 7.882 21.128 1.00 23.00 H new ATOM 0 HD11 ILE B 280 21.549 4.854 23.455 1.00 29.79 H new ATOM 0 HD12 ILE B 280 21.821 6.073 24.428 1.00 29.79 H new ATOM 0 HD13 ILE B 280 21.238 6.332 22.979 1.00 29.79 H new ATOM 2168 N GLN B 281 25.842 9.619 23.358 1.00 32.66 N ATOM 2169 CA GLN B 281 26.173 11.018 23.140 1.00 35.36 C ATOM 2170 C GLN B 281 27.560 11.134 22.533 1.00 36.44 C ATOM 2171 O GLN B 281 27.805 11.957 21.657 1.00 34.04 O ATOM 2172 CB GLN B 281 26.132 11.791 24.450 1.00 39.50 C ATOM 2173 CG GLN B 281 25.872 13.277 24.241 1.00 52.52 C ATOM 2174 CD GLN B 281 24.525 13.533 23.577 1.00 58.69 C ATOM 2175 OE1 GLN B 281 23.473 13.207 24.137 1.00 60.10 O ATOM 2176 NE2 GLN B 281 24.552 14.119 22.378 1.00 54.56 N ATOM 0 H GLN B 281 25.748 9.396 24.183 1.00 32.66 H new ATOM 0 HA GLN B 281 25.517 11.394 22.532 1.00 35.36 H new ATOM 0 HB2 GLN B 281 25.439 11.421 25.019 1.00 39.50 H new ATOM 0 HB3 GLN B 281 26.974 11.675 24.917 1.00 39.50 H new ATOM 0 HG2 GLN B 281 25.902 13.733 25.097 1.00 52.52 H new ATOM 0 HG3 GLN B 281 26.578 13.654 23.694 1.00 52.52 H new ATOM 0 HE21 GLN B 281 25.305 14.331 22.020 1.00 54.56 H new ATOM 0 HE22 GLN B 281 23.817 14.284 21.963 1.00 54.56 H new ATOM 2177 N LYS B 282 28.459 10.292 23.022 1.00 35.22 N ATOM 2178 CA LYS B 282 29.824 10.221 22.535 1.00 38.15 C ATOM 2179 C LYS B 282 29.853 9.947 21.029 1.00 37.66 C ATOM 2180 O LYS B 282 30.424 10.721 20.258 1.00 39.57 O ATOM 2181 CB LYS B 282 30.587 9.144 23.314 1.00 39.75 C ATOM 2182 CG LYS B 282 32.041 8.956 22.913 1.00 56.29 C ATOM 2183 CD LYS B 282 32.680 7.820 23.714 1.00 64.15 C ATOM 2184 CE LYS B 282 34.134 7.591 23.312 1.00 69.93 C ATOM 2185 NZ LYS B 282 34.995 8.769 23.631 1.00 68.28 N ATOM 0 H LYS B 282 28.289 9.737 23.657 1.00 35.22 H new ATOM 0 HA LYS B 282 30.259 11.076 22.678 1.00 38.15 H new ATOM 0 HB2 LYS B 282 30.554 9.365 24.258 1.00 39.75 H new ATOM 0 HB3 LYS B 282 30.125 8.298 23.204 1.00 39.75 H new ATOM 0 HG2 LYS B 282 32.097 8.761 21.965 1.00 56.29 H new ATOM 0 HG3 LYS B 282 32.532 9.779 23.063 1.00 56.29 H new ATOM 0 HD2 LYS B 282 32.635 8.027 24.661 1.00 64.15 H new ATOM 0 HD3 LYS B 282 32.174 7.004 23.577 1.00 64.15 H new ATOM 0 HE2 LYS B 282 34.476 6.808 23.771 1.00 69.93 H new ATOM 0 HE3 LYS B 282 34.180 7.406 22.361 1.00 69.93 H new ATOM 0 HZ1 LYS B 282 35.849 8.559 23.492 1.00 68.28 H new ATOM 0 HZ2 LYS B 282 34.769 9.453 23.108 1.00 68.28 H new ATOM 0 HZ3 LYS B 282 34.881 8.998 24.483 1.00 68.28 H new ATOM 2186 N VAL B 283 29.219 8.858 20.607 1.00 34.04 N ATOM 2187 CA VAL B 283 29.148 8.530 19.186 1.00 31.50 C ATOM 2188 C VAL B 283 28.561 9.667 18.354 1.00 34.32 C ATOM 2189 O VAL B 283 29.027 9.952 17.251 1.00 39.69 O ATOM 2190 CB VAL B 283 28.305 7.258 18.926 1.00 33.53 C ATOM 2191 CG1 VAL B 283 27.959 7.128 17.434 1.00 27.87 C ATOM 2192 CG2 VAL B 283 29.036 6.022 19.426 1.00 32.20 C ATOM 0 H VAL B 283 28.824 8.297 21.125 1.00 34.04 H new ATOM 0 HA VAL B 283 30.066 8.376 18.915 1.00 31.50 H new ATOM 0 HB VAL B 283 27.473 7.337 19.419 1.00 33.53 H new ATOM 0 HG11 VAL B 283 27.432 6.326 17.293 1.00 27.87 H new ATOM 0 HG12 VAL B 283 27.450 7.904 17.151 1.00 27.87 H new ATOM 0 HG13 VAL B 283 28.777 7.072 16.916 1.00 27.87 H new ATOM 0 HG21 VAL B 283 28.495 5.235 19.256 1.00 32.20 H new ATOM 0 HG22 VAL B 283 29.884 5.938 18.962 1.00 32.20 H new ATOM 0 HG23 VAL B 283 29.196 6.104 20.379 1.00 32.20 H new ATOM 2193 N ILE B 284 27.528 10.315 18.868 1.00 33.56 N ATOM 2194 CA ILE B 284 26.775 11.244 18.040 1.00 39.12 C ATOM 2195 C ILE B 284 27.506 12.565 17.793 1.00 44.89 C ATOM 2196 O ILE B 284 27.613 13.015 16.655 1.00 42.27 O ATOM 2197 CB ILE B 284 25.362 11.482 18.588 1.00 42.08 C ATOM 2198 CG1 ILE B 284 24.441 10.359 18.108 1.00 35.14 C ATOM 2199 CG2 ILE B 284 24.835 12.847 18.139 1.00 40.00 C ATOM 2200 CD1 ILE B 284 23.060 10.412 18.712 1.00 33.96 C ATOM 0 H ILE B 284 27.250 10.235 19.678 1.00 33.56 H new ATOM 0 HA ILE B 284 26.691 10.814 17.175 1.00 39.12 H new ATOM 0 HB ILE B 284 25.388 11.479 19.558 1.00 42.08 H new ATOM 0 HG12 ILE B 284 24.365 10.403 17.142 1.00 35.14 H new ATOM 0 HG13 ILE B 284 24.847 9.504 18.322 1.00 35.14 H new ATOM 0 HG21 ILE B 284 23.942 12.982 18.493 1.00 40.00 H new ATOM 0 HG22 ILE B 284 25.422 13.545 18.469 1.00 40.00 H new ATOM 0 HG23 ILE B 284 24.806 12.880 17.170 1.00 40.00 H new ATOM 0 HD11 ILE B 284 22.528 9.677 18.369 1.00 33.96 H new ATOM 0 HD12 ILE B 284 23.126 10.340 19.677 1.00 33.96 H new ATOM 0 HD13 ILE B 284 22.637 11.253 18.479 1.00 33.96 H new ATOM 2201 N ASP B 285 28.027 13.184 18.842 1.00 43.80 N ATOM 2202 CA ASP B 285 28.712 14.451 18.636 1.00 52.05 C ATOM 2203 C ASP B 285 30.174 14.262 18.195 1.00 51.92 C ATOM 2204 O ASP B 285 30.877 15.230 17.910 1.00 55.23 O ATOM 2205 CB ASP B 285 28.573 15.366 19.856 1.00 54.05 C ATOM 2206 CG ASP B 285 29.081 14.728 21.119 1.00 56.70 C ATOM 2207 OD1 ASP B 285 29.998 13.882 21.003 1.00 56.20 O ATOM 2208 OD2 ASP B 285 28.568 15.074 22.216 1.00 52.71 O ATOM 0 H ASP B 285 27.998 12.901 19.654 1.00 43.80 H new ATOM 0 HA ASP B 285 28.272 14.900 17.897 1.00 52.05 H new ATOM 0 HB2 ASP B 285 29.060 16.189 19.695 1.00 54.05 H new ATOM 0 HB3 ASP B 285 27.640 15.606 19.971 1.00 54.05 H new ATOM 2209 N GLN B 286 30.613 13.009 18.111 1.00 47.92 N ATOM 2210 CA GLN B 286 31.920 12.692 17.536 1.00 48.74 C ATOM 2211 C GLN B 286 31.853 12.362 16.037 1.00 51.05 C ATOM 2212 O GLN B 286 32.789 12.652 15.293 1.00 51.14 O ATOM 2213 CB GLN B 286 32.579 11.540 18.296 1.00 47.72 C ATOM 2214 CG GLN B 286 33.667 10.827 17.515 1.00 52.66 C ATOM 2215 CD GLN B 286 34.479 9.877 18.378 1.00 62.91 C ATOM 2216 OE1 GLN B 286 35.528 9.383 17.958 1.00 66.33 O ATOM 2217 NE2 GLN B 286 34.001 9.621 19.596 1.00 63.84 N ATOM 0 H GLN B 286 30.168 12.325 18.382 1.00 47.92 H new ATOM 0 HA GLN B 286 32.460 13.493 17.627 1.00 48.74 H new ATOM 0 HB2 GLN B 286 32.958 11.883 19.120 1.00 47.72 H new ATOM 0 HB3 GLN B 286 31.897 10.896 18.544 1.00 47.72 H new ATOM 0 HG2 GLN B 286 33.264 10.331 16.785 1.00 52.66 H new ATOM 0 HG3 GLN B 286 34.259 11.485 17.118 1.00 52.66 H new ATOM 0 HE21 GLN B 286 33.266 9.984 19.854 1.00 63.84 H new ATOM 0 HE22 GLN B 286 34.428 9.093 20.123 1.00 63.84 H new ATOM 2218 N PHE B 287 30.746 11.766 15.599 1.00 47.27 N ATOM 2219 CA PHE B 287 30.574 11.393 14.193 1.00 46.37 C ATOM 2220 C PHE B 287 29.355 12.064 13.560 1.00 46.18 C ATOM 2221 O PHE B 287 28.993 11.752 12.421 1.00 48.10 O ATOM 2222 CB PHE B 287 30.453 9.871 14.034 1.00 46.53 C ATOM 2223 CG PHE B 287 31.639 9.102 14.554 1.00 48.72 C ATOM 2224 CD1 PHE B 287 31.605 8.512 15.812 1.00 50.65 C ATOM 2225 CD2 PHE B 287 32.784 8.956 13.780 1.00 50.33 C ATOM 2226 CE1 PHE B 287 32.698 7.793 16.295 1.00 49.26 C ATOM 2227 CE2 PHE B 287 33.879 8.244 14.254 1.00 50.59 C ATOM 2228 CZ PHE B 287 33.835 7.662 15.512 1.00 52.29 C ATOM 0 H PHE B 287 30.078 11.567 16.102 1.00 47.27 H new ATOM 0 HA PHE B 287 31.368 11.705 13.730 1.00 46.37 H new ATOM 0 HB2 PHE B 287 29.656 9.570 14.497 1.00 46.53 H new ATOM 0 HB3 PHE B 287 30.331 9.662 13.095 1.00 46.53 H new ATOM 0 HD1 PHE B 287 30.843 8.598 16.339 1.00 50.65 H new ATOM 0 HD2 PHE B 287 32.818 9.340 12.934 1.00 50.33 H new ATOM 0 HE1 PHE B 287 32.664 7.403 17.139 1.00 49.26 H new ATOM 0 HE2 PHE B 287 34.641 8.158 13.728 1.00 50.59 H new ATOM 0 HZ PHE B 287 34.567 7.185 15.830 1.00 52.29 H new TER 2229 PHE B 287 ATOM 2230 N ASP H 290 6.158 -12.737 -0.209 1.00 54.87 N ATOM 2231 CA ASP H 290 5.364 -12.142 0.862 1.00 50.96 C ATOM 2232 C ASP H 290 5.488 -10.619 0.859 1.00 44.74 C ATOM 2233 O ASP H 290 4.493 -9.898 0.952 1.00 42.87 O ATOM 2234 CB ASP H 290 5.803 -12.699 2.222 1.00 60.77 C ATOM 2235 CG ASP H 290 4.875 -12.278 3.362 1.00 61.30 C ATOM 2236 OD1 ASP H 290 3.742 -11.813 3.078 1.00 57.37 O ATOM 2237 OD2 ASP H 290 5.279 -12.420 4.543 1.00 60.48 O ATOM 0 HA ASP H 290 4.434 -12.373 0.708 1.00 50.96 H new ATOM 0 HB2 ASP H 290 5.833 -13.667 2.176 1.00 60.77 H new ATOM 0 HB3 ASP H 290 6.704 -12.396 2.415 1.00 60.77 H new ATOM 2238 N PHE H 291 6.719 -10.134 0.753 1.00 40.92 N ATOM 2239 CA PHE H 291 6.954 -8.704 0.754 1.00 33.87 C ATOM 2240 C PHE H 291 6.771 -8.097 -0.632 1.00 38.42 C ATOM 2241 O PHE H 291 7.355 -8.563 -1.607 1.00 44.66 O ATOM 2242 CB PHE H 291 8.348 -8.385 1.288 1.00 37.95 C ATOM 2243 CG PHE H 291 8.446 -8.444 2.787 1.00 40.96 C ATOM 2244 CD1 PHE H 291 8.180 -7.318 3.559 1.00 34.18 C ATOM 2245 CD2 PHE H 291 8.806 -9.622 3.426 1.00 40.41 C ATOM 2246 CE1 PHE H 291 8.267 -7.367 4.949 1.00 34.96 C ATOM 2247 CE2 PHE H 291 8.894 -9.681 4.817 1.00 43.04 C ATOM 2248 CZ PHE H 291 8.621 -8.554 5.577 1.00 35.33 C ATOM 0 H PHE H 291 7.427 -10.617 0.680 1.00 40.92 H new ATOM 0 HA PHE H 291 6.292 -8.306 1.341 1.00 33.87 H new ATOM 0 HB2 PHE H 291 8.984 -9.010 0.905 1.00 37.95 H new ATOM 0 HB3 PHE H 291 8.606 -7.499 0.989 1.00 37.95 H new ATOM 0 HD1 PHE H 291 7.941 -6.522 3.142 1.00 34.18 H new ATOM 0 HD2 PHE H 291 8.991 -10.381 2.921 1.00 40.41 H new ATOM 0 HE1 PHE H 291 8.089 -6.607 5.455 1.00 34.96 H new ATOM 0 HE2 PHE H 291 9.136 -10.476 5.234 1.00 43.04 H new ATOM 0 HZ PHE H 291 8.675 -8.593 6.505 1.00 35.33 H new ATOM 2249 N GLU H 292 5.966 -7.046 -0.711 1.00 31.98 N ATOM 2250 CA GLU H 292 5.835 -6.302 -1.947 1.00 34.98 C ATOM 2251 C GLU H 292 7.195 -5.731 -2.338 1.00 45.22 C ATOM 2252 O GLU H 292 7.954 -5.251 -1.479 1.00 39.59 O ATOM 2253 CB GLU H 292 4.805 -5.194 -1.801 1.00 31.22 C ATOM 2254 CG GLU H 292 4.675 -4.315 -3.038 1.00 39.10 C ATOM 2255 CD GLU H 292 3.568 -3.294 -2.893 1.00 44.49 C ATOM 2256 OE1 GLU H 292 2.866 -3.333 -1.852 1.00 41.43 O ATOM 2257 OE2 GLU H 292 3.400 -2.461 -3.811 1.00 44.77 O ATOM 0 H GLU H 292 5.489 -6.750 -0.060 1.00 31.98 H new ATOM 0 HA GLU H 292 5.528 -6.898 -2.648 1.00 34.98 H new ATOM 0 HB2 GLU H 292 3.942 -5.589 -1.602 1.00 31.22 H new ATOM 0 HB3 GLU H 292 5.044 -4.639 -1.043 1.00 31.22 H new ATOM 0 HG2 GLU H 292 5.516 -3.859 -3.200 1.00 39.10 H new ATOM 0 HG3 GLU H 292 4.501 -4.872 -3.813 1.00 39.10 H new ATOM 2258 N GLU H 293 7.516 -5.800 -3.630 1.00 36.58 N ATOM 2259 CA GLU H 293 8.816 -5.343 -4.081 1.00 39.72 C ATOM 2260 C GLU H 293 8.875 -3.853 -3.839 1.00 44.02 C ATOM 2261 O GLU H 293 7.850 -3.179 -3.874 1.00 38.87 O ATOM 2262 CB GLU H 293 9.049 -5.678 -5.556 1.00 50.03 C ATOM 2263 CG GLU H 293 8.220 -4.854 -6.535 1.00 54.67 C ATOM 2264 CD GLU H 293 8.824 -4.829 -7.936 1.00 73.38 C ATOM 2265 OE1 GLU H 293 9.819 -5.556 -8.175 1.00 78.70 O ATOM 2266 OE2 GLU H 293 8.306 -4.081 -8.798 1.00 71.44 O ATOM 0 H GLU H 293 7.001 -6.104 -4.248 1.00 36.58 H new ATOM 0 HA GLU H 293 9.520 -5.794 -3.589 1.00 39.72 H new ATOM 0 HB2 GLU H 293 9.989 -5.550 -5.760 1.00 50.03 H new ATOM 0 HB3 GLU H 293 8.853 -6.618 -5.696 1.00 50.03 H new ATOM 0 HG2 GLU H 293 7.322 -5.218 -6.580 1.00 54.67 H new ATOM 0 HG3 GLU H 293 8.142 -3.946 -6.203 1.00 54.67 H new ATOM 2267 N ILE H 294 10.066 -3.342 -3.562 1.00 45.16 N ATOM 2268 CA ILE H 294 10.239 -1.913 -3.378 1.00 45.61 C ATOM 2269 C ILE H 294 10.807 -1.317 -4.669 1.00 51.86 C ATOM 2270 O ILE H 294 11.373 -2.045 -5.480 1.00 53.12 O ATOM 2271 CB ILE H 294 11.169 -1.627 -2.184 1.00 46.13 C ATOM 2272 CG1 ILE H 294 12.530 -2.293 -2.393 1.00 47.69 C ATOM 2273 CG2 ILE H 294 10.540 -2.130 -0.885 1.00 41.73 C ATOM 2274 CD1 ILE H 294 13.455 -2.166 -1.203 1.00 52.28 C ATOM 0 H ILE H 294 10.785 -3.806 -3.477 1.00 45.16 H new ATOM 0 HA ILE H 294 9.382 -1.503 -3.183 1.00 45.61 H new ATOM 0 HB ILE H 294 11.296 -0.667 -2.121 1.00 46.13 H new ATOM 0 HG12 ILE H 294 12.395 -3.233 -2.589 1.00 47.69 H new ATOM 0 HG13 ILE H 294 12.958 -1.900 -3.169 1.00 47.69 H new ATOM 0 HG21 ILE H 294 11.136 -1.943 -0.143 1.00 41.73 H new ATOM 0 HG22 ILE H 294 9.693 -1.680 -0.740 1.00 41.73 H new ATOM 0 HG23 ILE H 294 10.391 -3.087 -0.947 1.00 41.73 H new ATOM 0 HD11 ILE H 294 14.297 -2.607 -1.399 1.00 52.28 H new ATOM 0 HD12 ILE H 294 13.617 -1.228 -1.018 1.00 52.28 H new ATOM 0 HD13 ILE H 294 13.045 -2.582 -0.428 1.00 52.28 H new ATOM 2275 N PRO H 295 10.621 -0.001 -4.887 1.00 55.00 N ATOM 2276 CA PRO H 295 11.248 0.660 -6.041 1.00 57.40 C ATOM 2277 C PRO H 295 12.765 0.479 -5.916 1.00 64.69 C ATOM 2278 O PRO H 295 13.251 0.284 -4.805 1.00 63.30 O ATOM 2279 CB PRO H 295 10.821 2.126 -5.881 1.00 53.60 C ATOM 2280 CG PRO H 295 10.517 2.266 -4.406 1.00 53.58 C ATOM 2281 CD PRO H 295 9.869 0.955 -4.055 1.00 49.69 C ATOM 0 HA PRO H 295 10.993 0.313 -6.910 1.00 57.40 H new ATOM 0 HB2 PRO H 295 11.526 2.732 -6.156 1.00 53.60 H new ATOM 0 HB3 PRO H 295 10.043 2.330 -6.424 1.00 53.60 H new ATOM 0 HG2 PRO H 295 11.323 2.416 -3.888 1.00 53.58 H new ATOM 0 HG3 PRO H 295 9.925 3.015 -4.233 1.00 53.58 H new ATOM 0 HD2 PRO H 295 9.950 0.753 -3.110 1.00 49.69 H new ATOM 0 HD3 PRO H 295 8.922 0.952 -4.266 1.00 49.69 H new ATOM 2282 N GLU H 296 13.504 0.543 -7.021 1.00 66.89 N ATOM 2283 CA GLU H 296 14.759 -0.217 -7.119 1.00 66.60 C ATOM 2284 C GLU H 296 16.055 0.606 -7.123 1.00 63.95 C ATOM 2285 O GLU H 296 17.162 0.088 -6.958 1.00 63.22 O ATOM 2286 CB GLU H 296 14.594 -1.243 -8.238 1.00 67.03 C ATOM 2287 CG GLU H 296 14.424 -0.436 -9.553 1.00 72.77 C ATOM 2288 CD GLU H 296 14.178 -1.256 -10.819 1.00 79.20 C ATOM 2289 OE1 GLU H 296 14.091 -2.507 -10.763 1.00 78.98 O ATOM 2290 OE2 GLU H 296 14.062 -0.614 -11.890 1.00 80.53 O ATOM 0 H GLU H 296 13.306 1.010 -7.715 1.00 66.89 H new ATOM 0 HA GLU H 296 14.905 -0.692 -6.286 1.00 66.60 H new ATOM 0 HB2 GLU H 296 15.367 -1.826 -8.288 1.00 67.03 H new ATOM 0 HB3 GLU H 296 13.822 -1.808 -8.077 1.00 67.03 H new ATOM 0 HG2 GLU H 296 13.683 0.180 -9.440 1.00 72.77 H new ATOM 0 HG3 GLU H 296 15.221 0.101 -9.687 1.00 72.77 H new ATOM 2291 N GLU H 297 15.865 1.901 -7.314 1.00 61.41 N ATOM 2292 CA GLU H 297 16.569 2.917 -6.567 1.00 63.66 C ATOM 2293 C GLU H 297 17.328 2.309 -5.372 1.00 68.19 C ATOM 2294 O GLU H 297 18.548 2.452 -5.254 1.00 72.16 O ATOM 2295 CB GLU H 297 15.515 3.906 -6.030 1.00 67.86 C ATOM 2296 CG GLU H 297 14.760 4.743 -7.081 1.00 68.61 C ATOM 2297 CD GLU H 297 13.742 3.954 -7.926 1.00 71.21 C ATOM 2298 OE1 GLU H 297 14.038 2.814 -8.342 1.00 65.43 O ATOM 2299 OE2 GLU H 297 12.646 4.497 -8.206 1.00 69.56 O ATOM 0 H GLU H 297 15.313 2.216 -7.893 1.00 61.41 H new ATOM 0 HA GLU H 297 17.215 3.352 -7.145 1.00 63.66 H new ATOM 0 HB2 GLU H 297 14.863 3.405 -5.515 1.00 67.86 H new ATOM 0 HB3 GLU H 297 15.955 4.515 -5.416 1.00 67.86 H new ATOM 0 HG2 GLU H 297 14.296 5.464 -6.629 1.00 68.61 H new ATOM 0 HG3 GLU H 297 15.408 5.152 -7.676 1.00 68.61 H new ATOM 2300 N TYR H 298 16.592 1.602 -4.512 1.00 66.20 N ATOM 2301 CA TYR H 298 17.061 1.214 -3.174 1.00 67.21 C ATOM 2302 C TYR H 298 17.813 -0.111 -3.039 1.00 67.99 C ATOM 2303 O TYR H 298 18.495 -0.336 -2.035 1.00 68.09 O ATOM 2304 CB TYR H 298 15.880 1.219 -2.200 1.00 60.41 C ATOM 2305 CG TYR H 298 15.121 2.515 -2.254 1.00 57.90 C ATOM 2306 CD1 TYR H 298 15.722 3.702 -1.853 1.00 54.31 C ATOM 2307 CD2 TYR H 298 13.816 2.562 -2.725 1.00 55.26 C ATOM 2308 CE1 TYR H 298 15.041 4.899 -1.909 1.00 50.99 C ATOM 2309 CE2 TYR H 298 13.126 3.759 -2.788 1.00 58.91 C ATOM 2310 CZ TYR H 298 13.744 4.923 -2.379 1.00 52.45 C ATOM 2311 OH TYR H 298 13.062 6.113 -2.440 1.00 53.70 O ATOM 0 H TYR H 298 15.796 1.330 -4.690 1.00 66.20 H new ATOM 0 HA TYR H 298 17.731 1.884 -2.966 1.00 67.21 H new ATOM 0 HB2 TYR H 298 15.283 0.485 -2.412 1.00 60.41 H new ATOM 0 HB3 TYR H 298 16.204 1.070 -1.298 1.00 60.41 H new ATOM 0 HD1 TYR H 298 16.598 3.689 -1.542 1.00 54.31 H new ATOM 0 HD2 TYR H 298 13.400 1.778 -3.002 1.00 55.26 H new ATOM 0 HE1 TYR H 298 15.453 5.685 -1.632 1.00 50.99 H new ATOM 0 HE2 TYR H 298 12.252 3.779 -3.104 1.00 58.91 H new ATOM 0 HH TYR H 298 12.290 5.979 -2.744 1.00 53.70 H new ATOM 2312 N LEU H 299 17.689 -0.994 -4.024 1.00 67.73 N ATOM 2313 CA LEU H 299 18.359 -2.289 -3.934 1.00 69.47 C ATOM 2314 C LEU H 299 19.802 -2.192 -4.441 1.00 75.32 C ATOM 2315 O LEU H 299 20.293 -3.079 -5.147 1.00 78.98 O ATOM 2316 CB LEU H 299 17.566 -3.376 -4.674 1.00 72.38 C ATOM 2317 CG LEU H 299 16.124 -3.610 -4.204 1.00 64.76 C ATOM 2318 CD1 LEU H 299 15.253 -2.411 -4.528 1.00 67.75 C ATOM 2319 CD2 LEU H 299 15.534 -4.874 -4.814 1.00 64.18 C ATOM 0 H LEU H 299 17.231 -0.868 -4.741 1.00 67.73 H new ATOM 0 HA LEU H 299 18.395 -2.547 -3.000 1.00 69.47 H new ATOM 0 HB2 LEU H 299 17.545 -3.148 -5.617 1.00 72.38 H new ATOM 0 HB3 LEU H 299 18.051 -4.212 -4.595 1.00 72.38 H new ATOM 0 HG LEU H 299 16.147 -3.728 -3.241 1.00 64.76 H new ATOM 0 HD11 LEU H 299 14.347 -2.577 -4.224 1.00 67.75 H new ATOM 0 HD12 LEU H 299 15.605 -1.625 -4.081 1.00 67.75 H new ATOM 0 HD13 LEU H 299 15.250 -2.263 -5.487 1.00 67.75 H new ATOM 0 HD21 LEU H 299 14.625 -4.992 -4.498 1.00 64.18 H new ATOM 0 HD22 LEU H 299 15.532 -4.796 -5.781 1.00 64.18 H new ATOM 0 HD23 LEU H 299 16.069 -5.640 -4.553 1.00 64.18 H new ATOM 2320 N GLN H 300 20.468 -1.102 -4.062 1.00 75.96 N ATOM 2321 CA GLN H 300 21.863 -0.857 -4.418 1.00 78.24 C ATOM 2322 C GLN H 300 22.825 -1.407 -3.367 1.00 77.29 C ATOM 2323 O GLN H 300 23.153 -2.596 -3.366 1.00 79.27 O ATOM 2324 CB GLN H 300 22.104 0.643 -4.604 1.00 74.28 C ATOM 2325 CG GLN H 300 21.380 1.221 -5.803 1.00 79.73 C ATOM 2326 CD GLN H 300 21.759 0.515 -7.088 1.00 80.97 C ATOM 2327 OE1 GLN H 300 22.939 0.279 -7.353 1.00 83.86 O ATOM 2328 NE2 GLN H 300 20.760 0.172 -7.894 1.00 79.24 N ATOM 0 H GLN H 300 20.118 -0.478 -3.586 1.00 75.96 H new ATOM 0 HA GLN H 300 22.036 -1.322 -5.252 1.00 78.24 H new ATOM 0 HB2 GLN H 300 21.818 1.112 -3.804 1.00 74.28 H new ATOM 0 HB3 GLN H 300 23.056 0.802 -4.701 1.00 74.28 H new ATOM 0 HG2 GLN H 300 20.422 1.151 -5.666 1.00 79.73 H new ATOM 0 HG3 GLN H 300 21.587 2.166 -5.881 1.00 79.73 H new ATOM 0 HE21 GLN H 300 19.949 0.354 -7.675 1.00 79.24 H new ATOM 0 HE22 GLN H 300 20.925 -0.232 -8.635 1.00 79.24 H new TER 2329 GLN H 300 HETATM 2330 C1 DKK B5000 11.234 -11.841 24.024 1.00 20.60 C HETATM 2331 O5 DKK B5000 13.047 -11.005 22.769 1.00 20.00 O HETATM 2332 C7 DKK B5000 13.811 -11.475 20.545 1.00 21.14 C HETATM 2333 C9 DKK B5000 16.145 -12.477 20.392 1.00 23.73 C HETATM 2334 C11 DKK B5000 17.640 -12.309 20.736 1.00 24.05 C HETATM 2335 C12 DKK B5000 18.196 -13.585 21.385 1.00 19.75 C HETATM 2336 C13 DKK B5000 19.438 -14.092 20.914 1.00 27.88 C HETATM 2337 C14 DKK B5000 19.994 -15.252 21.473 1.00 23.00 C HETATM 2338 C15 DKK B5000 19.309 -15.916 22.506 1.00 28.17 C HETATM 2339 C16 DKK B5000 18.054 -15.415 22.984 1.00 22.92 C HETATM 2340 C19 DKK B5000 20.155 -13.338 19.789 1.00 25.03 C HETATM 2341 C22 DKK B5000 18.071 -17.274 24.617 1.00 26.91 C HETATM 2342 C30 DKK B5000 20.942 -13.918 26.168 1.00 22.57 C HETATM 2343 C31 DKK B5000 19.824 -14.725 26.289 1.00 22.36 C HETATM 2344 N2 DKK B5000 11.165 -10.700 24.556 1.00 19.54 N HETATM 2345 N3 DKK B5000 10.421 -12.953 24.508 1.00 23.30 N HETATM 2346 N4 DKK B5000 12.199 -12.108 22.976 1.00 19.71 N HETATM 2347 C6 DKK B5000 13.077 -10.474 21.460 1.00 25.37 C HETATM 2348 N8 DKK B5000 15.251 -11.394 20.794 1.00 21.33 N HETATM 2349 O10 DKK B5000 15.696 -13.555 20.110 1.00 23.20 O HETATM 2350 C17 DKK B5000 17.510 -14.240 22.420 1.00 18.96 C HETATM 2351 F18 DKK B5000 16.316 -13.756 22.861 1.00 19.70 F HETATM 2352 N20 DKK B5000 20.685 -12.782 18.958 1.00 22.33 N HETATM 2353 N21 DKK B5000 17.367 -16.126 24.065 1.00 21.51 N HETATM 2354 C23 DKK B5000 18.615 -16.955 26.029 1.00 27.00 C HETATM 2355 F24 DKK B5000 17.726 -16.250 26.779 1.00 24.08 F HETATM 2356 F25 DKK B5000 18.869 -18.135 26.655 1.00 36.12 F HETATM 2357 C26 DKK B5000 19.880 -16.098 25.906 1.00 20.93 C HETATM 2358 N27 DKK B5000 21.037 -16.625 25.379 1.00 23.18 N HETATM 2359 C28 DKK B5000 22.164 -15.809 25.250 1.00 23.37 C HETATM 2360 C29 DKK B5000 22.123 -14.443 25.639 1.00 18.52 C HETATM 0 HN3A DKK B5000 10.481 -13.725 24.133 1.00 23.30 H new HETATM 0 HN21 DKK B5000 16.596 -15.880 24.355 1.00 21.51 H new HETATM 0 H22A DKK B5000 17.472 -18.036 24.661 1.00 26.91 H new HETATM 0 H11A DKK B5000 18.141 -12.106 19.931 1.00 24.05 H new HETATM 0 HN8 DKK B5000 15.575 -10.699 21.183 1.00 21.33 H new HETATM 0 HN4 DKK B5000 12.247 -12.846 22.537 1.00 19.71 H new HETATM 0 HN3 DKK B5000 9.882 -12.836 25.168 1.00 23.30 H new HETATM 0 H7A DKK B5000 13.493 -12.376 20.714 1.00 21.14 H new HETATM 0 H7 DKK B5000 13.622 -11.277 19.614 1.00 21.14 H new HETATM 0 H6A DKK B5000 12.175 -10.321 21.137 1.00 25.37 H new HETATM 0 H6 DKK B5000 13.530 -9.616 21.454 1.00 25.37 H new HETATM 0 H31 DKK B5000 18.997 -14.355 26.636 1.00 22.36 H new HETATM 0 H30 DKK B5000 20.905 -12.991 26.450 1.00 22.57 H new HETATM 0 H29 DKK B5000 22.907 -13.881 25.538 1.00 18.52 H new HETATM 0 H28 DKK B5000 22.985 -16.180 24.890 1.00 23.37 H new HETATM 0 H22 DKK B5000 18.804 -17.522 24.032 1.00 26.91 H new HETATM 0 H15 DKK B5000 19.688 -16.718 22.898 1.00 28.17 H new HETATM 0 H14 DKK B5000 20.843 -15.593 21.150 1.00 23.00 H new HETATM 0 H11 DKK B5000 17.755 -11.558 21.339 1.00 24.05 H new HETATM 2361 O HOH A 33 -1.924 11.829 22.917 1.00 21.35 O HETATM 2362 O HOH A 34 -6.314 6.163 26.161 1.00 25.53 O HETATM 2363 O HOH A 35 -4.954 10.715 15.070 1.00 25.90 O HETATM 2364 O HOH A 36 -2.688 0.709 33.991 1.00 28.41 O HETATM 2365 O HOH A 37 -8.681 11.975 21.962 1.00 31.95 O HETATM 2366 O HOH A 38 -6.052 12.876 13.405 1.00 33.00 O HETATM 2367 O HOH A 39 -8.689 15.113 13.655 1.00 38.75 O HETATM 2368 O HOH A 40 -3.227 15.755 10.442 1.00 45.23 O HETATM 2369 O HOH A 41 -0.471 17.682 12.818 1.00 40.59 O HETATM 2370 O HOH A 42 -2.642 19.818 13.174 1.00 41.21 O HETATM 2371 O HOH A 43 1.412 4.532 41.541 1.00 38.40 O HETATM 2372 O HOH B5001 10.161 -3.730 16.958 1.00 11.87 O HETATM 2373 O HOH B5002 7.797 5.489 11.569 1.00 17.95 O HETATM 2374 O HOH B5003 6.626 -10.609 28.739 1.00 22.40 O HETATM 2375 O HOH B5004 9.588 -5.189 14.356 1.00 14.82 O HETATM 2376 O HOH B5005 12.724 -14.513 32.108 1.00 17.49 O HETATM 2377 O HOH B5006 6.798 1.347 21.308 1.00 17.64 O HETATM 2378 O HOH B5007 1.805 10.832 14.365 1.00 16.84 O HETATM 2379 O HOH B5008 8.356 -8.428 27.515 1.00 18.59 O HETATM 2380 O HOH B5009 20.526 -6.819 26.900 1.00 18.96 O HETATM 2381 O HOH B5010 8.788 -15.967 27.200 1.00 26.35 O HETATM 2382 O HOH B5011 16.687 3.899 30.329 1.00 17.77 O HETATM 2383 O HOH B5012 8.485 2.375 9.671 1.00 16.39 O HETATM 2384 O HOH B5013 1.799 4.708 10.764 1.00 22.23 O HETATM 2385 O HOH B5014 2.999 4.149 13.810 1.00 17.04 O HETATM 2386 O HOH B5015 18.712 -16.657 38.332 1.00 19.63 O HETATM 2387 O HOH B5016 3.194 -10.657 30.012 1.00 23.79 O HETATM 2388 O HOH B5017 11.038 -14.868 39.029 1.00 23.94 O HETATM 2389 O HOH B5018 15.121 1.256 19.266 1.00 16.31 O HETATM 2390 O HOH B5019 12.423 -8.214 24.991 1.00 17.51 O HETATM 2391 O HOH B5020 4.591 -7.501 36.340 1.00 25.49 O HETATM 2392 O HOH B5021 22.016 -4.559 27.752 1.00 14.58 O HETATM 2393 O HOH B5022 7.791 -14.910 38.072 1.00 30.00 O HETATM 2394 O HOH B5023 12.543 -14.689 29.253 1.00 30.91 O HETATM 2395 O HOH B5024 6.016 -11.764 31.619 1.00 22.64 O HETATM 2396 O HOH B5025 6.882 15.382 12.319 1.00 22.06 O HETATM 2397 O HOH B5026 5.717 10.261 5.417 1.00 26.91 O HETATM 2398 O HOH B5027 5.945 -14.012 30.519 1.00 18.41 O HETATM 2399 O HOH B5028 4.099 -7.980 15.810 1.00 18.49 O HETATM 2400 O HOH B5029 16.328 13.029 22.716 1.00 27.57 O HETATM 2401 O HOH B5030 15.576 12.210 20.261 1.00 27.84 O HETATM 2402 O HOH B5031 17.012 -12.415 43.145 1.00 35.34 O HETATM 2403 O HOH B5032 5.348 3.870 12.356 1.00 22.67 O HETATM 2404 O HOH B5033 28.881 2.781 28.008 1.00 33.14 O HETATM 2405 O HOH B5034 3.827 6.241 11.463 1.00 21.38 O HETATM 2406 O HOH B5035 33.102 -9.873 12.386 1.00 40.87 O HETATM 2407 O HOH B5036 -0.775 -13.172 19.645 1.00 31.99 O HETATM 2408 O HOH B5037 1.952 4.954 7.954 1.00 21.52 O HETATM 2409 O HOH B5038 4.623 -14.405 33.239 1.00 27.55 O HETATM 2410 O HOH B5039 20.499 -12.416 16.231 1.00 27.23 O HETATM 2411 O HOH B5040 5.871 3.541 20.354 1.00 19.58 O HETATM 2412 O HOH B5041 -0.862 1.399 4.158 1.00 26.61 O HETATM 2413 O HOH B5042 7.225 -13.492 28.589 1.00 25.94 O HETATM 2414 O HOH B5043 28.962 -8.174 30.564 1.00 29.50 O HETATM 2415 O HOH B5044 12.900 -14.747 22.342 1.00 26.68 O HETATM 2416 O HOH B5045 25.230 -15.757 23.333 1.00 26.74 O HETATM 2417 O HOH B5046 30.778 -0.811 15.277 1.00 35.69 O HETATM 2418 O HOH B5047 13.509 -4.766 35.803 1.00 21.41 O HETATM 2419 O HOH B5048 20.859 13.633 32.307 1.00 37.96 O HETATM 2420 O HOH B5049 3.391 5.100 21.134 1.00 21.59 O HETATM 2421 O HOH B5050 -6.199 -5.362 16.873 1.00 38.91 O HETATM 2422 O HOH B5051 19.226 -15.571 40.428 1.00 22.19 O HETATM 2423 O HOH B5052 24.479 -17.974 33.930 1.00 37.78 O HETATM 2424 O HOH B5053 9.752 -13.921 27.701 1.00 31.80 O HETATM 2425 O HOH B5054 19.233 7.295 2.231 1.00 40.90 O HETATM 2426 O HOH B5055 11.062 18.294 30.858 1.00 31.36 O HETATM 2427 O HOH B5056 1.305 2.724 12.632 1.00 29.14 O HETATM 2428 O HOH B5057 25.713 6.423 30.480 1.00 34.47 O HETATM 2429 O HOH B5058 -5.744 4.054 12.825 1.00 30.90 O HETATM 2430 O HOH B5059 7.529 -11.065 10.819 1.00 40.12 O HETATM 2431 O HOH B5060 20.036 -14.901 36.804 1.00 27.48 O HETATM 2432 O HOH B5061 15.468 -16.498 45.761 1.00 35.43 O HETATM 2433 O HOH B5062 5.465 -5.353 37.564 1.00 25.77 O HETATM 2434 O HOH B5063 32.098 3.345 19.976 1.00 35.73 O HETATM 2435 O HOH B5064 17.393 -19.645 31.987 1.00 32.55 O HETATM 2436 O HOH B5065 21.966 -12.265 37.500 1.00 31.30 O HETATM 2437 O HOH B5066 9.911 14.356 31.830 1.00 22.39 O HETATM 2438 O HOH B5067 -2.522 -3.308 23.193 1.00 38.29 O HETATM 2439 O HOH B5068 7.646 -4.162 0.899 1.00 28.25 O HETATM 2440 O HOH B5069 1.201 -16.757 24.407 1.00 33.41 O HETATM 2441 O HOH B5070 3.189 7.787 -6.277 1.00 28.50 O HETATM 2442 O HOH B5071 -1.906 -7.743 26.344 1.00 33.70 O HETATM 2443 O HOH B5072 2.488 14.234 6.518 1.00 28.57 O HETATM 2444 O HOH B5073 21.566 -5.953 38.250 1.00 33.43 O HETATM 2445 O HOH B5074 0.067 -8.976 18.871 1.00 28.33 O HETATM 2446 O HOH B5075 0.271 -13.559 33.020 1.00 35.01 O HETATM 2447 O HOH B5076 -0.163 14.379 34.287 1.00 39.22 O HETATM 2448 O HOH B5077 1.242 -7.206 5.657 1.00 32.13 O HETATM 2449 O HOH B5078 24.656 -15.433 31.608 1.00 26.92 O HETATM 2450 O HOH B5079 16.828 16.164 14.262 1.00 32.84 O HETATM 2451 O HOH B5080 18.818 -9.243 12.394 1.00 32.89 O HETATM 2452 O HOH B5081 1.167 -1.692 36.869 1.00 39.12 O HETATM 2453 O HOH B5082 11.609 -0.431 40.991 1.00 40.80 O HETATM 2454 O HOH B5083 11.637 -13.178 42.996 1.00 34.27 O HETATM 2455 O HOH B5084 14.753 -10.874 16.533 1.00 28.32 O HETATM 2456 O HOH B5085 17.009 9.560 4.351 1.00 40.45 O HETATM 2457 O HOH B5086 20.125 -0.436 36.216 1.00 31.17 O HETATM 2458 O HOH B5087 28.376 -1.508 32.999 1.00 39.31 O HETATM 2459 O HOH B5088 -1.574 -3.812 25.461 1.00 31.26 O HETATM 2460 O HOH B5089 -1.614 -4.523 28.771 1.00 37.85 O HETATM 2461 O HOH B5090 12.047 -18.974 38.935 1.00 31.80 O HETATM 2462 O HOH B5091 17.545 -22.585 30.886 1.00 46.93 O HETATM 2463 O HOH B5092 16.056 16.339 23.659 1.00 46.28 O HETATM 2464 O HOH B5093 1.193 10.637 1.882 1.00 37.44 O HETATM 2465 O HOH B5094 14.899 16.437 16.599 1.00 47.31 O HETATM 2466 O HOH B5095 2.200 -14.873 31.815 1.00 32.97 O HETATM 2467 O HOH B5096 14.828 14.475 25.015 1.00 38.59 O HETATM 2468 O HOH B5097 -6.337 6.715 15.467 1.00 40.72 O HETATM 2469 O HOH B5098 -2.307 -10.688 18.886 1.00 37.79 O HETATM 2470 O HOH B5099 22.779 -19.054 36.747 1.00 37.16 O HETATM 2471 O HOH B5100 28.891 -7.312 34.285 1.00 37.13 O HETATM 2472 O HOH B5101 30.201 -16.398 13.108 1.00 42.28 O HETATM 2473 O HOH B5102 3.712 -13.584 29.903 1.00 26.34 O HETATM 2474 O HOH B5103 18.604 17.192 31.872 1.00 43.41 O HETATM 2475 O HOH H 49 12.079 6.978 0.129 1.00 32.40 O HETATM 2476 O HOH H 73 7.143 -1.229 -5.750 1.00 44.61 O CONECT 19 1196 CONECT 435 553 CONECT 553 435 CONECT 1196 19 CONECT 1544 1660 CONECT 1660 1544 CONECT 1761 1994 CONECT 1994 1761 CONECT 2330 2344 2345 2346 CONECT 2331 2346 2347 CONECT 2332 2347 2348 CONECT 2333 2334 2348 2349 CONECT 2334 2333 2335 CONECT 2335 2334 2336 2350 CONECT 2336 2335 2337 2340 CONECT 2337 2336 2338 CONECT 2338 2337 2339 CONECT 2339 2338 2350 2353 CONECT 2340 2336 2352 CONECT 2341 2353 2354 CONECT 2342 2343 2360 CONECT 2343 2342 2357 CONECT 2344 2330 CONECT 2345 2330 CONECT 2346 2330 2331 CONECT 2347 2331 2332 CONECT 2348 2332 2333 CONECT 2349 2333 CONECT 2350 2335 2339 2351 CONECT 2351 2350 CONECT 2352 2340 CONECT 2353 2339 2341 CONECT 2354 2341 2355 2356 2357 CONECT 2355 2354 CONECT 2356 2354 CONECT 2357 2343 2354 2358 CONECT 2358 2357 2359 CONECT 2359 2358 2360 CONECT 2360 2342 2359 END