HEADER DEVELOPMENTAL SIGNALING MOLECULE 15-AUG-97 1AT0 TITLE 17-KDA FRAGMENT OF HEDGEHOG C-TERMINAL AUTOPROCESSING TITLE 2 DOMAIN COMPND MOL_ID: 1; COMPND 2 MOLECULE: 17-HEDGEHOG; COMPND 3 CHAIN: NULL; COMPND 4 FRAGMENT: 17-KDA FRAGMENT OF C-TERMINAL DOMAIN; COMPND 5 ENGINEERED: SELENOMETHIONYL-SUBSTITUTED PROTEIN WAS COMPND 6 EXPRESSED SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER; SOURCE 3 ORGANISM_COMMON: FRUIT FLY; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 5 EXPRESSION_SYSTEM_STRAIN: B834 (DE3) PLYSS; SOURCE 6 EXPRESSION_SYSTEM_PLASMID: PRSET B KEYWDS DEVELOPMENTAL SIGNALING MOLECULE, CHOLESTEROL TRANSFER EXPDTA X-RAY DIFFRACTION AUTHOR T.M.T.HALL,J.A.PORTER,K.E.YOUNG,E.V.KOONIN,P.A.BEACHY, AUTHOR 2 D.J.LEAHY REVDAT 1 12-NOV-97 1AT0 0 JRNL AUTH T.M.HALL,J.A.PORTER,K.E.YOUNG,E.V.KOONIN, JRNL AUTH 2 P.A.BEACHY,D.J.LEAHY JRNL TITL CRYSTAL STRUCTURE OF A HEDGEHOG AUTOPROCESSING JRNL TITL 2 DOMAIN: HOMOLOGY BETWEEN HEDGEHOG AND SELF-SPLICING JRNL TITL 3 PROTEINS JRNL REF CELL(CAMBRIDGE,MASS.) V. 91 85 1997 JRNL REFN ASTM CELLB5 US ISSN 0092-8674 0998 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 1.9 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.8 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.9 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 6.0 REMARK 3 DATA CUTOFF (SIGMA(F)) : 2.0 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 100.0 REMARK 3 NUMBER OF REFLECTIONS : 13163 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : ALL BUT LAST ROUND REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING SET) : 0.2176 REMARK 3 FREE R VALUE : 0.2754 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 10.0 REMARK 3 FREE R VALUE TEST SET COUNT : 1289 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.0077 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 8 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 1.90 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.98 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 96.75 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 1277 REMARK 3 BIN R VALUE (WORKING SET) : 0.2932 REMARK 3 BIN FREE R VALUE : 0.3155 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 9.9159 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 150 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.0258 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1744 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 126 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 21.5 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM SIGMAA (A) : NULL REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM C-V SIGMAA (A) : NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.008 REMARK 3 BOND ANGLES (DEGREES) : 1.956 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 25.382 REMARK 3 IMPROPER ANGLES (DEGREES) : 1.135 REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : 2.072 ; 1.5 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 3.000 ; 2.0 REMARK 3 SIDE-CHAIN BOND (A**2) : 4.354 ; 2.0 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 6.532 ; 2.5 REMARK 3 REMARK 3 NCS MODEL : NULL REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : PARAMCSDX_MOD.PRO REMARK 3 PARAMETER FILE 2 : PARAM19.SOL REMARK 3 PARAMETER FILE 3 : PARAM19.ION REMARK 3 PARAMETER FILE 4 : PARAM19X.SE REMARK 3 TOPOLOGY FILE 1 : TOPHCSDX_SE.PRO REMARK 3 TOPOLOGY FILE 2 : TOPH19.ION REMARK 3 TOPOLOGY FILE 3 : TOPH19.SOL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1AT0 COMPLIES WITH FORMAT V. 2.2, 16-DEC-1996 REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : NOV-1996 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 5.8 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : NSLS REMARK 200 BEAMLINE : X4A REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.9919 REMARK 200 MONOCHROMATOR : SILICON CRYSTAL REMARK 200 OPTICS : MIRROR REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : FUJI REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 26790 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.9 REMARK 200 RESOLUTION RANGE LOW (A) : 100. REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 2. REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 100. REMARK 200 DATA REDUNDANCY : 10.3 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 0.092 REMARK 200 FOR THE DATA SET : 19.9 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.9 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.98 REMARK 200 COMPLETENESS FOR SHELL (%) : 99.9 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : 0.529 REMARK 200 FOR SHELL : 4.2 REMARK 200 REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: SEMET MAD REMARK 200 SOFTWARE USED: MLPHARE REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: DATA WERE COLLECTED AT 0.9919, 0.9793, 0.9791, AND REMARK 200 0.9686 ANGSTROM. VALUES FOR DATA COLLECTION AND DATA REMARK 200 QUALITY ARE FOR 0.9919. REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 59. REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): NULL REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 20% PEG 3350 80 MM AMMONIUM REMARK 280 SULFATE 10 MM SODIUM CACODYLATE, PH 5.8 REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: I 21 3 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 1/2-X,-Y,1/2+Z REMARK 290 3555 -X,1/2+Y,1/2-Z REMARK 290 4555 1/2+X,1/2-Y,-Z REMARK 290 5555 Z,X,Y REMARK 290 6555 1/2+Z,1/2-X,-Y REMARK 290 7555 1/2-Z,-X,1/2+Y REMARK 290 8555 -Z,1/2+X,1/2-Y REMARK 290 9555 Y,Z,X REMARK 290 10555 -Y,1/2+Z,1/2-X REMARK 290 11555 1/2+Y,1/2-Z,-X REMARK 290 12555 1/2-Y,-Z,1/2+X REMARK 290 13555 1/2+X,1/2+Y,1/2+Z REMARK 290 14555 -X,1/2-Y,Z REMARK 290 15555 1/2-X,Y,-Z REMARK 290 16555 X,-Y,1/2-Z REMARK 290 17555 1/2+Z,1/2+X,1/2+Y REMARK 290 18555 Z,-X,1/2-Y REMARK 290 19555 -Z,1/2-X,Y REMARK 290 20555 1/2-Z,X,-Y REMARK 290 21555 1/2+Y,1/2+Z,1/2+X REMARK 290 22555 1/2-Y,Z,-X REMARK 290 23555 Y,-Z,1/2-X REMARK 290 24555 -Y,1/2-Z,X 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 50.77173 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 50.77173 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 50.77173 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 50.77173 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 50.77173 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 50.77173 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY2 5 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY1 6 0.000000 0.000000 1.000000 50.77173 REMARK 290 SMTRY2 6 -1.000000 0.000000 0.000000 50.77173 REMARK 290 SMTRY3 6 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY1 7 0.000000 0.000000 -1.000000 50.77173 REMARK 290 SMTRY2 7 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 1.000000 0.000000 50.77173 REMARK 290 SMTRY1 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY2 8 1.000000 0.000000 0.000000 50.77173 REMARK 290 SMTRY3 8 0.000000 -1.000000 0.000000 50.77173 REMARK 290 SMTRY1 9 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 9 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY3 9 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 10 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 10 0.000000 0.000000 1.000000 50.77173 REMARK 290 SMTRY3 10 -1.000000 0.000000 0.000000 50.77173 REMARK 290 SMTRY1 11 0.000000 1.000000 0.000000 50.77173 REMARK 290 SMTRY2 11 0.000000 0.000000 -1.000000 50.77173 REMARK 290 SMTRY3 11 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 12 0.000000 -1.000000 0.000000 50.77173 REMARK 290 SMTRY2 12 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY3 12 1.000000 0.000000 0.000000 50.77173 REMARK 290 SMTRY1 13 1.000000 0.000000 0.000000 50.77173 REMARK 290 SMTRY2 13 0.000000 1.000000 0.000000 50.77173 REMARK 290 SMTRY3 13 0.000000 0.000000 1.000000 50.77173 REMARK 290 SMTRY1 14 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 14 0.000000 -1.000000 0.000000 50.77173 REMARK 290 SMTRY3 14 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 15 -1.000000 0.000000 0.000000 50.77173 REMARK 290 SMTRY2 15 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 15 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 16 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 16 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 16 0.000000 0.000000 -1.000000 50.77173 REMARK 290 SMTRY1 17 0.000000 0.000000 1.000000 50.77173 REMARK 290 SMTRY2 17 1.000000 0.000000 0.000000 50.77173 REMARK 290 SMTRY3 17 0.000000 1.000000 0.000000 50.77173 REMARK 290 SMTRY1 18 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY2 18 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 18 0.000000 -1.000000 0.000000 50.77173 REMARK 290 SMTRY1 19 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY2 19 -1.000000 0.000000 0.000000 50.77173 REMARK 290 SMTRY3 19 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY1 20 0.000000 0.000000 -1.000000 50.77173 REMARK 290 SMTRY2 20 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 20 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY1 21 0.000000 1.000000 0.000000 50.77173 REMARK 290 SMTRY2 21 0.000000 0.000000 1.000000 50.77173 REMARK 290 SMTRY3 21 1.000000 0.000000 0.000000 50.77173 REMARK 290 SMTRY1 22 0.000000 -1.000000 0.000000 50.77173 REMARK 290 SMTRY2 22 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY3 22 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY1 23 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 23 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY3 23 -1.000000 0.000000 0.000000 50.77173 REMARK 290 SMTRY1 24 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 24 0.000000 0.000000 -1.000000 50.77173 REMARK 290 SMTRY3 24 1.000000 0.000000 0.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: ACT REMARK 800 SITE_DESCRIPTION: AUTOPROCESSING ACTIVE SITE. REMARK 999 REMARK 999 SEQUENCE REMARK 999 1AT0 PIR A46400 1 - 257 NOT IN ATOMS LIST REMARK 999 1AT0 PIR A46400 403 - 471 NOT IN ATOMS LIST DBREF 1AT0 258 402 PIR A46400 A46400 258 402 SEQADV 1AT0 MSE 287 PIR A46400 MET 287 MODIFIED RESIDUE SEQADV 1AT0 MSE 302 PIR A46400 MET 302 MODIFIED RESIDUE SEQADV 1AT0 MSE 309 PIR A46400 MET 309 MODIFIED RESIDUE SEQRES 1 145 CYS PHE THR PRO GLU SER THR ALA LEU LEU GLU SER GLY SEQRES 2 145 VAL ARG LYS PRO LEU GLY GLU LEU SER ILE GLY ASP ARG SEQRES 3 145 VAL LEU SER MSE THR ALA ASN GLY GLN ALA VAL TYR SER SEQRES 4 145 GLU VAL ILE LEU PHE MSE ASP ARG ASN LEU GLU GLN MSE SEQRES 5 145 GLN ASN PHE VAL GLN LEU HIS THR ASP GLY GLY ALA VAL SEQRES 6 145 LEU THR VAL THR PRO ALA HIS LEU VAL SER VAL TRP GLN SEQRES 7 145 PRO GLU SER GLN LYS LEU THR PHE VAL PHE ALA ASP ARG SEQRES 8 145 ILE GLU GLU LYS ASN GLN VAL LEU VAL ARG ASP VAL GLU SEQRES 9 145 THR GLY GLU LEU ARG PRO GLN ARG VAL VAL LYS VAL GLY SEQRES 10 145 SER VAL ARG SER LYS GLY VAL VAL ALA PRO LEU THR ARG SEQRES 11 145 GLU GLY THR ILE VAL VAL ASN SER VAL ALA ALA SER CYS SEQRES 12 145 TYR ALA MODRES 1AT0 MSE 287 MET SELENOMETHIONINE MODRES 1AT0 MSE 302 MET SELENOMETHIONINE MODRES 1AT0 MSE 309 MET SELENOMETHIONINE HET MSE 287 9 HET MSE 302 9 HET MSE 309 9 HETNAM MSE SELENOMETHIONINE FORMUL 1 MSE 3(C5 H11 N1 O2 SE1) FORMUL 2 HOH *126(H2 O1) HELIX 1 1 LEU 275 GLU 277 5 3 HELIX 2 2 ALA 346 ARG 348 5 3 SHEET 1 A 2 THR 264 LEU 266 0 SHEET 2 A 2 ARG 272 PRO 274 -1 N LYS 273 O ALA 265 SHEET 1 B 2 ARG 283 SER 286 0 SHEET 2 B 2 VAL 294 GLU 297 -1 N SER 296 O VAL 284 SHEET 1 C 3 VAL 322 THR 326 0 SHEET 2 C 3 GLN 310 THR 317 -1 N LEU 315 O LEU 323 SHEET 3 C 3 VAL 370 SER 378 -1 N SER 378 O GLN 310 SHEET 1 D 2 LEU 330 GLN 335 0 SHEET 2 D 2 LYS 340 PHE 345 -1 N VAL 344 O VAL 331 SHEET 1 E 2 GLN 354 ARG 358 0 SHEET 2 E 2 LEU 365 ARG 369 -1 N GLN 368 O VAL 355 SHEET 1 F 2 THR 390 VAL 393 0 SHEET 2 F 2 VAL 396 SER 399 -1 N ALA 398 O ILE 391 SHEET 1 G 2 VAL 298 ASN 305 0 SHEET 2 G 2 VAL 381 THR 386 -1 N LEU 385 O ILE 299 LINK N MSE 287 C SER 286 LINK C MSE 287 N THR 288 LINK N MSE 302 C PHE 301 LINK C MSE 302 N ASP 303 LINK N MSE 309 C GLN 308 LINK C MSE 309 N GLN 310 SITE 1 ACT 4 CYS 258 HIS 329 ASP 303 THR 326 CRYST1 101.540 101.540 101.540 90.00 90.00 90.00 I 21 3 24 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 0.009848 0.000000 0.000000 0.00000 SCALE2 0.000000 0.009848 0.000000 0.00000 SCALE3 0.000000 0.000000 0.009848 0.00000 ATOM 1 N CYS 258 32.691 67.372 56.966 1.00 21.25 N ATOM 2 CA CYS 258 34.075 67.203 56.447 1.00 19.88 C ATOM 3 C CYS 258 35.016 66.724 57.539 1.00 18.08 C ATOM 4 O CYS 258 34.662 66.739 58.725 1.00 16.82 O ATOM 5 CB CYS 258 34.589 68.530 55.890 1.00 20.29 C ATOM 6 SG CYS 258 33.511 69.253 54.650 1.00 32.21 S ATOM 7 1H CYS 258 32.733 67.912 57.869 1.00 15.00 H ATOM 8 2H CYS 258 32.222 67.997 56.275 1.00 15.00 H ATOM 9 3H CYS 258 32.117 66.543 57.043 1.00 15.00 H ATOM 10 N PHE 259 36.190 66.270 57.113 1.00 16.37 N ATOM 11 CA PHE 259 37.248 65.794 57.995 1.00 16.29 C ATOM 12 C PHE 259 38.444 66.685 57.647 1.00 19.49 C ATOM 13 O PHE 259 38.347 67.525 56.744 1.00 23.12 O ATOM 14 CB PHE 259 37.614 64.341 57.674 1.00 17.09 C ATOM 15 CG PHE 259 36.432 63.407 57.574 1.00 20.39 C ATOM 16 CD1 PHE 259 35.940 62.764 58.701 1.00 18.13 C ATOM 17 CD2 PHE 259 35.836 63.145 56.338 1.00 17.18 C ATOM 18 CE1 PHE 259 34.871 61.872 58.602 1.00 19.58 C ATOM 19 CE2 PHE 259 34.775 62.260 56.228 1.00 14.80 C ATOM 20 CZ PHE 259 34.289 61.620 57.363 1.00 18.59 C ATOM 21 H PHE 259 36.428 66.256 56.164 1.00 15.00 H ATOM 22 N THR 260 39.571 66.496 58.325 1.00 17.87 N ATOM 23 CA THR 260 40.760 67.305 58.048 1.00 20.55 C ATOM 24 C THR 260 41.590 66.631 56.958 1.00 19.27 C ATOM 25 O THR 260 41.387 65.456 56.662 1.00 20.59 O ATOM 26 CB THR 260 41.660 67.452 59.305 1.00 20.24 C ATOM 27 OG1 THR 260 42.271 66.192 59.607 1.00 26.39 O ATOM 28 CG2 THR 260 40.844 67.911 60.515 1.00 20.52 C ATOM 29 H THR 260 39.650 65.800 59.004 1.00 15.00 H ATOM 30 HG1 THR 260 42.846 66.328 60.371 1.00 15.00 H ATOM 31 N PRO 261 42.533 67.365 56.340 1.00 20.40 N ATOM 32 CA PRO 261 43.377 66.783 55.290 1.00 21.81 C ATOM 33 C PRO 261 44.297 65.708 55.880 1.00 23.34 C ATOM 34 O PRO 261 44.707 64.764 55.194 1.00 24.47 O ATOM 35 CB PRO 261 44.190 67.985 54.809 1.00 21.29 C ATOM 36 CG PRO 261 43.305 69.137 55.082 1.00 18.22 C ATOM 37 CD PRO 261 42.773 68.812 56.445 1.00 18.92 C ATOM 38 N GLU 262 44.621 65.871 57.158 1.00 25.10 N ATOM 39 CA GLU 262 45.483 64.947 57.873 1.00 24.16 C ATOM 40 C GLU 262 44.742 63.693 58.319 1.00 26.07 C ATOM 41 O GLU 262 45.374 62.694 58.672 1.00 26.52 O ATOM 42 CB GLU 262 46.107 65.637 59.083 1.00 29.79 C ATOM 43 CG GLU 262 46.977 66.844 58.746 1.00 30.63 C ATOM 44 CD GLU 262 46.187 68.028 58.218 1.00 33.48 C ATOM 45 OE1 GLU 262 45.075 68.304 58.731 1.00 30.96 O ATOM 46 OE2 GLU 262 46.680 68.685 57.279 1.00 37.68 O ATOM 47 H GLU 262 44.286 66.659 57.642 1.00 15.00 H ATOM 48 N SER 263 43.410 63.753 58.352 1.00 24.97 N ATOM 49 CA SER 263 42.613 62.588 58.731 1.00 22.46 C ATOM 50 C SER 263 42.987 61.476 57.753 1.00 21.46 C ATOM 51 O SER 263 43.402 61.750 56.618 1.00 18.69 O ATOM 52 CB SER 263 41.111 62.892 58.639 1.00 21.58 C ATOM 53 OG SER 263 40.697 63.865 59.588 1.00 22.13 O ATOM 54 H SER 263 42.929 64.577 58.134 1.00 15.00 H ATOM 55 HG SER 263 39.731 63.831 59.625 1.00 15.00 H ATOM 56 N THR 264 42.851 60.225 58.175 1.00 19.36 N ATOM 57 CA THR 264 43.226 59.133 57.301 1.00 20.04 C ATOM 58 C THR 264 42.145 58.123 56.955 1.00 19.98 C ATOM 59 O THR 264 41.260 57.815 57.760 1.00 20.64 O ATOM 60 CB THR 264 44.425 58.362 57.883 1.00 23.91 C ATOM 61 OG1 THR 264 44.081 57.853 59.180 1.00 27.11 O ATOM 62 CG2 THR 264 45.645 59.270 58.001 1.00 22.42 C ATOM 63 H THR 264 42.506 60.020 59.070 1.00 15.00 H ATOM 64 HG1 THR 264 44.905 57.592 59.605 1.00 15.00 H ATOM 65 N ALA 265 42.233 57.615 55.736 1.00 17.64 N ATOM 66 CA ALA 265 41.332 56.586 55.255 1.00 16.63 C ATOM 67 C ALA 265 42.197 55.327 55.190 1.00 18.56 C ATOM 68 O ALA 265 43.429 55.401 55.308 1.00 17.97 O ATOM 69 CB ALA 265 40.815 56.941 53.870 1.00 16.74 C ATOM 70 H ALA 265 42.931 57.929 55.131 1.00 15.00 H ATOM 71 N LEU 266 41.564 54.171 55.056 1.00 18.13 N ATOM 72 CA LEU 266 42.312 52.929 54.960 1.00 22.36 C ATOM 73 C LEU 266 42.034 52.323 53.598 1.00 23.40 C ATOM 74 O LEU 266 40.894 51.949 53.302 1.00 23.70 O ATOM 75 CB LEU 266 41.912 51.944 56.062 1.00 23.32 C ATOM 76 CG LEU 266 42.586 50.572 55.930 1.00 25.47 C ATOM 77 CD1 LEU 266 44.095 50.727 55.985 1.00 25.15 C ATOM 78 CD2 LEU 266 42.101 49.635 57.019 1.00 28.72 C ATOM 79 H LEU 266 40.589 54.141 54.985 1.00 15.00 H ATOM 80 N LEU 267 43.065 52.252 52.761 1.00 20.87 N ATOM 81 CA LEU 267 42.907 51.686 51.433 1.00 20.23 C ATOM 82 C LEU 267 42.842 50.166 51.506 1.00 19.23 C ATOM 83 O LEU 267 43.386 49.553 52.431 1.00 19.93 O ATOM 84 CB LEU 267 44.036 52.141 50.503 1.00 20.46 C ATOM 85 CG LEU 267 44.347 53.641 50.399 1.00 22.09 C ATOM 86 CD1 LEU 267 45.155 53.893 49.139 1.00 22.52 C ATOM 87 CD2 LEU 267 43.081 54.467 50.366 1.00 20.88 C ATOM 88 H LEU 267 43.934 52.592 53.044 1.00 15.00 H ATOM 89 N GLU 268 42.142 49.567 50.547 1.00 21.83 N ATOM 90 CA GLU 268 41.982 48.118 50.472 1.00 23.08 C ATOM 91 C GLU 268 43.342 47.444 50.467 1.00 25.29 C ATOM 92 O GLU 268 43.500 46.343 50.984 1.00 27.31 O ATOM 93 CB GLU 268 41.196 47.745 49.215 1.00 23.00 C ATOM 94 CG GLU 268 40.807 46.271 49.103 1.00 27.40 C ATOM 95 CD GLU 268 39.817 46.016 47.973 1.00 33.99 C ATOM 96 OE1 GLU 268 40.015 46.562 46.866 1.00 35.93 O ATOM 97 OE2 GLU 268 38.820 45.287 48.187 1.00 34.03 O ATOM 98 H GLU 268 41.717 50.122 49.857 1.00 15.00 H ATOM 99 N SER 269 44.333 48.145 49.928 1.00 28.55 N ATOM 100 CA SER 269 45.701 47.650 49.847 1.00 28.98 C ATOM 101 C SER 269 46.324 47.410 51.220 1.00 29.95 C ATOM 102 O SER 269 47.335 46.716 51.335 1.00 31.02 O ATOM 103 CB SER 269 46.558 48.638 49.055 1.00 23.26 C ATOM 104 OG SER 269 46.601 49.915 49.669 1.00 26.06 O ATOM 105 H SER 269 44.132 49.019 49.524 1.00 15.00 H ATOM 106 HG SER 269 46.951 50.572 49.048 1.00 15.00 H ATOM 107 N GLY 270 45.726 47.999 52.251 1.00 32.64 N ATOM 108 CA GLY 270 46.225 47.838 53.605 1.00 34.82 C ATOM 109 C GLY 270 46.968 49.056 54.124 1.00 36.62 C ATOM 110 O GLY 270 47.502 49.032 55.235 1.00 40.64 O ATOM 111 H GLY 270 44.943 48.558 52.091 1.00 15.00 H ATOM 112 N VAL 271 46.964 50.136 53.352 1.00 36.14 N ATOM 113 CA VAL 271 47.663 51.352 53.742 1.00 37.84 C ATOM 114 C VAL 271 46.765 52.532 54.089 1.00 37.70 C ATOM 115 O VAL 271 45.748 52.766 53.442 1.00 36.99 O ATOM 116 CB VAL 271 48.631 51.802 52.638 1.00 43.09 C ATOM 117 CG1 VAL 271 49.642 50.718 52.379 1.00 44.86 C ATOM 118 CG2 VAL 271 47.870 52.143 51.363 1.00 41.27 C ATOM 119 H VAL 271 46.474 50.136 52.503 1.00 15.00 H ATOM 120 N ARG 272 47.154 53.270 55.122 1.00 37.35 N ATOM 121 CA ARG 272 46.411 54.441 55.556 1.00 36.19 C ATOM 122 C ARG 272 46.805 55.566 54.614 1.00 35.40 C ATOM 123 O ARG 272 47.960 55.657 54.200 1.00 37.35 O ATOM 124 CB ARG 272 46.776 54.802 56.998 1.00 37.30 C ATOM 125 CG ARG 272 46.393 53.737 58.016 1.00 38.27 C ATOM 126 CD ARG 272 46.814 54.123 59.432 1.00 44.20 C ATOM 127 NE ARG 272 48.269 54.172 59.608 1.00 49.54 N ATOM 128 CZ ARG 272 49.014 53.169 60.078 1.00 49.37 C ATOM 129 NH1 ARG 272 48.453 52.012 60.426 1.00 48.95 N ATOM 130 NH2 ARG 272 50.325 53.328 60.217 1.00 49.69 N ATOM 131 H ARG 272 47.994 53.059 55.570 1.00 15.00 H ATOM 132 HE ARG 272 48.685 55.039 59.376 1.00 15.00 H ATOM 133 1HH1 ARG 272 47.469 51.846 60.344 1.00 0.00 H ATOM 134 2HH1 ARG 272 49.024 51.248 60.782 1.00 0.00 H ATOM 135 1HH2 ARG 272 50.793 54.178 59.982 1.00 0.00 H ATOM 136 2HH2 ARG 272 50.888 52.566 60.581 1.00 0.00 H ATOM 137 N LYS 273 45.856 56.423 54.271 1.00 30.62 N ATOM 138 CA LYS 273 46.144 57.516 53.363 1.00 28.99 C ATOM 139 C LYS 273 45.471 58.796 53.832 1.00 26.24 C ATOM 140 O LYS 273 44.285 58.795 54.162 1.00 27.23 O ATOM 141 CB LYS 273 45.665 57.152 51.953 1.00 30.67 C ATOM 142 CG LYS 273 46.108 58.118 50.872 1.00 32.59 C ATOM 143 CD LYS 273 45.901 57.517 49.503 1.00 35.72 C ATOM 144 CE LYS 273 46.590 58.344 48.437 1.00 42.59 C ATOM 145 NZ LYS 273 48.040 58.550 48.747 1.00 51.04 N ATOM 146 H LYS 273 44.950 56.324 54.627 1.00 15.00 H ATOM 147 1HZ LYS 273 48.568 57.652 48.789 1.00 15.00 H ATOM 148 2HZ LYS 273 48.487 59.058 47.961 1.00 15.00 H ATOM 149 3HZ LYS 273 48.235 59.091 49.615 1.00 15.00 H ATOM 150 N PRO 274 46.235 59.897 53.922 1.00 25.61 N ATOM 151 CA PRO 274 45.658 61.169 54.361 1.00 24.33 C ATOM 152 C PRO 274 44.570 61.585 53.374 1.00 25.71 C ATOM 153 O PRO 274 44.718 61.397 52.158 1.00 23.69 O ATOM 154 CB PRO 274 46.857 62.119 54.310 1.00 26.53 C ATOM 155 CG PRO 274 48.020 61.207 54.603 1.00 25.65 C ATOM 156 CD PRO 274 47.692 60.020 53.735 1.00 24.64 C ATOM 157 N LEU 275 43.482 62.148 53.890 1.00 23.68 N ATOM 158 CA LEU 275 42.383 62.564 53.033 1.00 20.99 C ATOM 159 C LEU 275 42.823 63.618 52.029 1.00 21.28 C ATOM 160 O LEU 275 42.281 63.682 50.928 1.00 25.11 O ATOM 161 CB LEU 275 41.176 63.046 53.849 1.00 20.14 C ATOM 162 CG LEU 275 40.461 62.023 54.744 1.00 19.14 C ATOM 163 CD1 LEU 275 39.085 62.536 55.065 1.00 19.12 C ATOM 164 CD2 LEU 275 40.345 60.670 54.077 1.00 18.47 C ATOM 165 H LEU 275 43.430 62.300 54.854 1.00 15.00 H ATOM 166 N GLY 276 43.822 64.420 52.391 1.00 22.21 N ATOM 167 CA GLY 276 44.324 65.437 51.479 1.00 21.75 C ATOM 168 C GLY 276 45.059 64.826 50.290 1.00 25.51 C ATOM 169 O GLY 276 45.297 65.500 49.279 1.00 25.29 O ATOM 170 H GLY 276 44.218 64.326 53.285 1.00 15.00 H ATOM 171 N GLU 277 45.429 63.550 50.415 1.00 24.31 N ATOM 172 CA GLU 277 46.131 62.819 49.359 1.00 23.38 C ATOM 173 C GLU 277 45.217 61.807 48.672 1.00 22.66 C ATOM 174 O GLU 277 45.629 61.126 47.723 1.00 21.36 O ATOM 175 CB GLU 277 47.316 62.048 49.934 1.00 24.58 C ATOM 176 CG GLU 277 48.425 62.876 50.531 1.00 26.32 C ATOM 177 CD GLU 277 49.593 62.011 50.958 1.00 30.04 C ATOM 178 OE1 GLU 277 49.766 60.904 50.392 1.00 36.01 O ATOM 179 OE2 GLU 277 50.346 62.431 51.853 1.00 31.50 O ATOM 180 H GLU 277 45.253 63.069 51.247 1.00 15.00 H ATOM 181 N LEU 278 44.007 61.656 49.195 1.00 19.27 N ATOM 182 CA LEU 278 43.039 60.720 48.644 1.00 17.63 C ATOM 183 C LEU 278 42.658 61.104 47.205 1.00 16.83 C ATOM 184 O LEU 278 42.534 62.287 46.879 1.00 15.27 O ATOM 185 CB LEU 278 41.802 60.703 49.537 1.00 14.47 C ATOM 186 CG LEU 278 40.949 59.448 49.541 1.00 16.79 C ATOM 187 CD1 LEU 278 41.747 58.277 50.079 1.00 18.62 C ATOM 188 CD2 LEU 278 39.736 59.705 50.410 1.00 17.99 C ATOM 189 H LEU 278 43.748 62.201 49.967 1.00 15.00 H ATOM 190 N SER 279 42.474 60.098 46.354 1.00 17.16 N ATOM 191 CA SER 279 42.121 60.319 44.957 1.00 18.79 C ATOM 192 C SER 279 40.865 59.550 44.584 1.00 19.44 C ATOM 193 O SER 279 40.601 58.468 45.118 1.00 18.00 O ATOM 194 CB SER 279 43.260 59.845 44.046 1.00 18.13 C ATOM 195 OG SER 279 44.508 60.399 44.437 1.00 20.02 O ATOM 196 H SER 279 42.559 59.159 46.641 1.00 15.00 H ATOM 197 HG SER 279 44.487 60.403 45.401 1.00 15.00 H ATOM 198 N ILE 280 40.085 60.116 43.670 1.00 18.06 N ATOM 199 CA ILE 280 38.878 59.468 43.188 1.00 16.81 C ATOM 200 C ILE 280 39.341 58.147 42.587 1.00 18.36 C ATOM 201 O ILE 280 40.346 58.107 41.875 1.00 19.35 O ATOM 202 CB ILE 280 38.181 60.335 42.113 1.00 20.60 C ATOM 203 CG1 ILE 280 37.554 61.567 42.776 1.00 16.18 C ATOM 204 CG2 ILE 280 37.148 59.511 41.338 1.00 18.89 C ATOM 205 CD1 ILE 280 37.031 62.604 41.800 1.00 25.13 C ATOM 206 H ILE 280 40.343 60.987 43.305 1.00 15.00 H ATOM 207 N GLY 281 38.647 57.065 42.923 1.00 17.91 N ATOM 208 CA GLY 281 39.030 55.759 42.423 1.00 17.83 C ATOM 209 C GLY 281 39.608 54.893 43.531 1.00 17.85 C ATOM 210 O GLY 281 39.462 53.672 43.500 1.00 21.75 O ATOM 211 H GLY 281 37.871 57.130 43.510 1.00 15.00 H ATOM 212 N ASP 282 40.258 55.513 44.512 1.00 16.22 N ATOM 213 CA ASP 282 40.832 54.772 45.635 1.00 18.64 C ATOM 214 C ASP 282 39.714 54.014 46.348 1.00 18.28 C ATOM 215 O ASP 282 38.616 54.544 46.520 1.00 19.93 O ATOM 216 CB ASP 282 41.508 55.729 46.634 1.00 15.79 C ATOM 217 CG ASP 282 42.766 56.383 46.082 1.00 20.67 C ATOM 218 OD1 ASP 282 43.220 56.027 44.971 1.00 23.42 O ATOM 219 OD2 ASP 282 43.315 57.271 46.765 1.00 20.55 O ATOM 220 H ASP 282 40.380 56.485 44.506 1.00 15.00 H ATOM 221 N ARG 283 39.970 52.764 46.719 1.00 20.35 N ATOM 222 CA ARG 283 38.975 51.958 47.423 1.00 19.11 C ATOM 223 C ARG 283 39.335 52.009 48.901 1.00 19.17 C ATOM 224 O ARG 283 40.329 51.419 49.341 1.00 18.08 O ATOM 225 CB ARG 283 38.966 50.514 46.919 1.00 20.97 C ATOM 226 CG ARG 283 38.739 50.382 45.419 1.00 21.39 C ATOM 227 CD ARG 283 38.351 48.958 45.041 1.00 30.11 C ATOM 228 NE ARG 283 36.939 48.681 45.309 1.00 33.70 N ATOM 229 CZ ARG 283 36.496 47.660 46.039 1.00 35.66 C ATOM 230 NH1 ARG 283 37.355 46.807 46.576 1.00 36.83 N ATOM 231 NH2 ARG 283 35.193 47.507 46.244 1.00 38.21 N ATOM 232 H ARG 283 40.865 52.396 46.551 1.00 15.00 H ATOM 233 HE ARG 283 36.314 49.300 44.857 1.00 15.00 H ATOM 234 1HH1 ARG 283 38.348 46.923 46.432 1.00 0.00 H ATOM 235 2HH1 ARG 283 37.184 46.009 47.159 1.00 0.00 H ATOM 236 1HH2 ARG 283 34.536 48.171 45.871 1.00 0.00 H ATOM 237 2HH2 ARG 283 34.822 46.768 46.808 1.00 0.00 H ATOM 238 N VAL 284 38.543 52.762 49.650 1.00 17.49 N ATOM 239 CA VAL 284 38.767 52.957 51.077 1.00 17.41 C ATOM 240 C VAL 284 37.823 52.137 51.946 1.00 16.10 C ATOM 241 O VAL 284 36.745 51.727 51.502 1.00 16.77 O ATOM 242 CB VAL 284 38.608 54.448 51.447 1.00 14.63 C ATOM 243 CG1 VAL 284 39.628 55.279 50.710 1.00 15.98 C ATOM 244 CG2 VAL 284 37.209 54.928 51.098 1.00 12.20 C ATOM 245 H VAL 284 37.765 53.186 49.230 1.00 15.00 H ATOM 246 N LEU 285 38.229 51.905 53.191 1.00 16.61 N ATOM 247 CA LEU 285 37.406 51.153 54.129 1.00 13.92 C ATOM 248 C LEU 285 36.132 51.951 54.419 1.00 14.23 C ATOM 249 O LEU 285 36.182 53.139 54.782 1.00 13.03 O ATOM 250 CB LEU 285 38.168 50.895 55.423 1.00 15.15 C ATOM 251 CG LEU 285 37.374 50.114 56.467 1.00 15.90 C ATOM 252 CD1 LEU 285 37.005 48.739 55.934 1.00 13.72 C ATOM 253 CD2 LEU 285 38.193 50.011 57.730 1.00 18.37 C ATOM 254 H LEU 285 39.073 52.288 53.491 1.00 15.00 H ATOM 255 N SER 286 34.999 51.278 54.281 1.00 16.38 N ATOM 256 CA SER 286 33.692 51.876 54.487 1.00 16.58 C ATOM 257 C SER 286 32.861 50.948 55.357 1.00 16.41 C ATOM 258 O SER 286 33.382 49.976 55.902 1.00 15.31 O ATOM 259 CB SER 286 33.007 52.096 53.135 1.00 13.46 C ATOM 260 OG SER 286 33.765 52.997 52.345 1.00 16.52 O ATOM 261 H SER 286 35.052 50.337 54.088 1.00 15.00 H ATOM 262 HG SER 286 33.326 53.150 51.513 1.00 15.00 H HETATM 263 N MSE 287 31.571 51.247 55.476 1.00 19.83 N HETATM 264 CA MSE 287 30.659 50.453 56.297 1.00 19.65 C HETATM 265 C MSE 287 29.345 50.194 55.566 1.00 18.10 C HETATM 266 O MSE 287 28.784 51.092 54.941 1.00 14.99 O HETATM 267 CB MSE 287 30.376 51.195 57.605 1.00 22.35 C HETATM 268 CG MSE 287 29.494 50.434 58.573 1.00 23.51 C HETATM 269 SE MSE 287 28.922 51.559 60.043 1.00 34.21 SE HETATM 270 CE MSE 287 27.616 52.600 59.104 1.00 23.89 C HETATM 271 1HN MSE 287 31.182 52.010 55.000 1.00 15.00 H ATOM 272 N THR 288 28.861 48.962 55.635 1.00 17.29 N ATOM 273 CA THR 288 27.606 48.612 54.991 1.00 19.59 C ATOM 274 C THR 288 26.453 49.127 55.852 1.00 17.87 C ATOM 275 O THR 288 26.665 49.560 56.987 1.00 16.30 O ATOM 276 CB THR 288 27.471 47.086 54.820 1.00 19.43 C ATOM 277 OG1 THR 288 27.507 46.455 56.105 1.00 22.38 O ATOM 278 CG2 THR 288 28.606 46.548 53.975 1.00 21.84 C ATOM 279 H THR 288 29.342 48.268 56.127 1.00 15.00 H ATOM 280 HG1 THR 288 27.094 45.592 55.989 1.00 15.00 H ATOM 281 N ALA 289 25.234 49.042 55.330 1.00 19.18 N ATOM 282 CA ALA 289 24.056 49.503 56.056 1.00 21.97 C ATOM 283 C ALA 289 23.906 48.781 57.389 1.00 24.37 C ATOM 284 O ALA 289 23.391 49.353 58.349 1.00 29.81 O ATOM 285 CB ALA 289 22.806 49.323 55.213 1.00 21.21 C ATOM 286 H ALA 289 25.111 48.670 54.439 1.00 15.00 H ATOM 287 N ASN 290 24.346 47.529 57.463 1.00 27.16 N ATOM 288 CA ASN 290 24.248 46.795 58.720 1.00 28.46 C ATOM 289 C ASN 290 25.533 46.833 59.555 1.00 28.72 C ATOM 290 O ASN 290 25.780 45.944 60.371 1.00 29.80 O ATOM 291 CB ASN 290 23.748 45.360 58.504 1.00 30.68 C ATOM 292 CG ASN 290 24.697 44.516 57.684 1.00 37.79 C ATOM 293 OD1 ASN 290 25.602 45.028 57.026 1.00 44.95 O ATOM 294 ND2 ASN 290 24.487 43.208 57.709 1.00 41.27 N ATOM 295 H ASN 290 24.721 47.083 56.668 1.00 15.00 H ATOM 296 1HD2 ASN 290 25.092 42.640 57.195 1.00 0.00 H ATOM 297 2HD2 ASN 290 23.742 42.875 58.248 1.00 0.00 H ATOM 298 N GLY 291 26.348 47.863 59.331 1.00 26.09 N ATOM 299 CA GLY 291 27.574 48.051 60.089 1.00 25.21 C ATOM 300 C GLY 291 28.790 47.175 59.845 1.00 27.79 C ATOM 301 O GLY 291 29.661 47.098 60.712 1.00 29.12 O ATOM 302 H GLY 291 26.134 48.513 58.628 1.00 15.00 H ATOM 303 N GLN 292 28.886 46.537 58.683 1.00 27.92 N ATOM 304 CA GLN 292 30.035 45.681 58.381 1.00 28.22 C ATOM 305 C GLN 292 31.119 46.421 57.603 1.00 24.47 C ATOM 306 O GLN 292 30.826 47.323 56.819 1.00 21.85 O ATOM 307 CB GLN 292 29.609 44.476 57.549 1.00 35.21 C ATOM 308 CG GLN 292 28.567 43.588 58.173 1.00 49.41 C ATOM 309 CD GLN 292 28.119 42.515 57.206 1.00 59.07 C ATOM 310 OE1 GLN 292 28.609 41.386 57.242 1.00 65.27 O ATOM 311 NE2 GLN 292 27.206 42.871 56.308 1.00 62.22 N ATOM 312 H GLN 292 28.187 46.655 58.004 1.00 15.00 H ATOM 313 1HE2 GLN 292 26.926 42.199 55.656 1.00 15.00 H ATOM 314 2HE2 GLN 292 26.867 43.787 56.336 1.00 15.00 H ATOM 315 N ALA 293 32.368 46.019 57.807 1.00 21.86 N ATOM 316 CA ALA 293 33.486 46.624 57.095 1.00 19.84 C ATOM 317 C ALA 293 33.410 46.162 55.645 1.00 21.54 C ATOM 318 O ALA 293 33.038 45.017 55.371 1.00 24.83 O ATOM 319 CB ALA 293 34.813 46.185 57.711 1.00 16.48 C ATOM 320 H ALA 293 32.548 45.308 58.457 1.00 15.00 H ATOM 321 N VAL 294 33.724 47.063 54.723 1.00 20.27 N ATOM 322 CA VAL 294 33.718 46.759 53.295 1.00 19.51 C ATOM 323 C VAL 294 34.528 47.845 52.597 1.00 21.21 C ATOM 324 O VAL 294 34.641 48.951 53.110 1.00 22.56 O ATOM 325 CB VAL 294 32.279 46.739 52.728 1.00 19.61 C ATOM 326 CG1 VAL 294 31.626 48.103 52.868 1.00 18.36 C ATOM 327 CG2 VAL 294 32.290 46.304 51.278 1.00 20.85 C ATOM 328 H VAL 294 33.960 47.979 54.995 1.00 15.00 H ATOM 329 N TYR 295 35.153 47.521 51.472 1.00 21.44 N ATOM 330 CA TYR 295 35.925 48.522 50.744 1.00 19.69 C ATOM 331 C TYR 295 35.080 49.084 49.611 1.00 20.16 C ATOM 332 O TYR 295 34.379 48.336 48.926 1.00 22.97 O ATOM 333 CB TYR 295 37.246 47.936 50.250 1.00 17.97 C ATOM 334 CG TYR 295 38.200 47.700 51.391 1.00 15.98 C ATOM 335 CD1 TYR 295 38.908 48.759 51.948 1.00 17.54 C ATOM 336 CD2 TYR 295 38.339 46.438 51.965 1.00 18.30 C ATOM 337 CE1 TYR 295 39.727 48.576 53.052 1.00 21.38 C ATOM 338 CE2 TYR 295 39.160 46.242 53.077 1.00 19.79 C ATOM 339 CZ TYR 295 39.849 47.319 53.612 1.00 19.71 C ATOM 340 OH TYR 295 40.660 47.155 54.710 1.00 27.93 O ATOM 341 H TYR 295 35.082 46.610 51.114 1.00 15.00 H ATOM 342 HH TYR 295 40.975 48.012 55.023 1.00 15.00 H ATOM 343 N SER 296 35.116 50.403 49.449 1.00 18.22 N ATOM 344 CA SER 296 34.324 51.085 48.433 1.00 18.71 C ATOM 345 C SER 296 35.164 52.185 47.794 1.00 19.86 C ATOM 346 O SER 296 35.998 52.795 48.461 1.00 20.01 O ATOM 347 CB SER 296 33.079 51.697 49.095 1.00 17.18 C ATOM 348 OG SER 296 32.158 52.204 48.142 1.00 13.50 O ATOM 349 H SER 296 35.692 50.963 50.020 1.00 15.00 H ATOM 350 HG SER 296 31.840 51.428 47.642 1.00 15.00 H ATOM 351 N GLU 297 34.953 52.445 46.506 1.00 20.42 N ATOM 352 CA GLU 297 35.731 53.474 45.837 1.00 20.26 C ATOM 353 C GLU 297 35.192 54.872 46.055 1.00 17.59 C ATOM 354 O GLU 297 33.986 55.075 46.242 1.00 15.45 O ATOM 355 CB GLU 297 35.892 53.187 44.329 1.00 29.10 C ATOM 356 CG GLU 297 34.655 53.387 43.453 1.00 40.22 C ATOM 357 CD GLU 297 34.911 53.078 41.972 1.00 45.05 C ATOM 358 OE1 GLU 297 36.055 52.733 41.611 1.00 48.31 O ATOM 359 OE2 GLU 297 33.960 53.157 41.158 1.00 49.18 O ATOM 360 H GLU 297 34.285 51.944 45.994 1.00 15.00 H ATOM 361 N VAL 298 36.119 55.818 46.118 1.00 17.50 N ATOM 362 CA VAL 298 35.799 57.225 46.273 1.00 15.03 C ATOM 363 C VAL 298 35.354 57.649 44.882 1.00 18.45 C ATOM 364 O VAL 298 36.071 57.420 43.905 1.00 15.02 O ATOM 365 CB VAL 298 37.049 58.040 46.663 1.00 14.43 C ATOM 366 CG1 VAL 298 36.736 59.529 46.657 1.00 15.93 C ATOM 367 CG2 VAL 298 37.563 57.600 48.038 1.00 14.91 C ATOM 368 H VAL 298 37.057 55.549 46.050 1.00 15.00 H ATOM 369 N ILE 299 34.148 58.194 44.780 1.00 19.20 N ATOM 370 CA ILE 299 33.628 58.636 43.495 1.00 19.52 C ATOM 371 C ILE 299 33.836 60.132 43.278 1.00 18.26 C ATOM 372 O ILE 299 33.971 60.584 42.144 1.00 16.91 O ATOM 373 CB ILE 299 32.141 58.242 43.316 1.00 25.61 C ATOM 374 CG1 ILE 299 31.293 58.781 44.468 1.00 27.27 C ATOM 375 CG2 ILE 299 32.015 56.720 43.221 1.00 27.04 C ATOM 376 CD1 ILE 299 29.844 58.344 44.416 1.00 31.00 C ATOM 377 H ILE 299 33.611 58.286 45.591 1.00 15.00 H ATOM 378 N LEU 300 33.888 60.893 44.365 1.00 18.37 N ATOM 379 CA LEU 300 34.099 62.333 44.285 1.00 19.90 C ATOM 380 C LEU 300 34.291 62.937 45.670 1.00 20.44 C ATOM 381 O LEU 300 34.223 62.233 46.679 1.00 21.76 O ATOM 382 CB LEU 300 32.921 63.020 43.566 1.00 23.03 C ATOM 383 CG LEU 300 31.475 62.929 44.083 1.00 25.21 C ATOM 384 CD1 LEU 300 31.209 63.921 45.215 1.00 25.11 C ATOM 385 CD2 LEU 300 30.535 63.232 42.937 1.00 25.57 C ATOM 386 H LEU 300 33.787 60.495 45.259 1.00 15.00 H ATOM 387 N PHE 301 34.600 64.227 45.701 1.00 18.38 N ATOM 388 CA PHE 301 34.764 64.962 46.946 1.00 23.08 C ATOM 389 C PHE 301 33.647 66.001 46.961 1.00 25.70 C ATOM 390 O PHE 301 33.456 66.727 45.981 1.00 27.88 O ATOM 391 CB PHE 301 36.122 65.661 46.993 1.00 18.97 C ATOM 392 CG PHE 301 37.272 64.724 47.157 1.00 22.39 C ATOM 393 CD1 PHE 301 37.714 64.366 48.425 1.00 18.14 C ATOM 394 CD2 PHE 301 37.903 64.173 46.045 1.00 23.79 C ATOM 395 CE1 PHE 301 38.766 63.468 48.585 1.00 21.32 C ATOM 396 CE2 PHE 301 38.962 63.270 46.195 1.00 21.28 C ATOM 397 CZ PHE 301 39.391 62.919 47.467 1.00 20.44 C ATOM 398 H PHE 301 34.728 64.728 44.861 1.00 15.00 H HETATM 399 N MSE 302 32.864 66.017 48.033 1.00 21.20 N HETATM 400 CA MSE 302 31.769 66.971 48.166 1.00 21.95 C HETATM 401 C MSE 302 32.312 68.317 48.623 1.00 21.37 C HETATM 402 O MSE 302 31.664 69.348 48.475 1.00 23.53 O HETATM 403 CB MSE 302 30.739 66.438 49.150 1.00 22.49 C HETATM 404 CG MSE 302 30.093 65.157 48.675 1.00 29.08 C HETATM 405 SE MSE 302 29.327 64.348 50.227 1.00 50.65 SE HETATM 406 CE MSE 302 30.856 63.518 50.927 1.00 33.75 C HETATM 407 1HN MSE 302 33.016 65.371 48.745 1.00 15.00 H ATOM 408 N ASP 303 33.513 68.282 49.184 1.00 21.02 N ATOM 409 CA ASP 303 34.212 69.465 49.654 1.00 23.59 C ATOM 410 C ASP 303 35.669 69.058 49.697 1.00 22.14 C ATOM 411 O ASP 303 35.989 67.921 50.047 1.00 23.38 O ATOM 412 CB ASP 303 33.749 69.871 51.058 1.00 31.03 C ATOM 413 CG ASP 303 33.250 71.312 51.117 1.00 40.01 C ATOM 414 OD1 ASP 303 34.074 72.241 51.276 1.00 39.78 O ATOM 415 OD2 ASP 303 32.024 71.515 50.998 1.00 45.51 O ATOM 416 H ASP 303 33.970 67.427 49.313 1.00 15.00 H ATOM 417 N ARG 304 36.540 69.954 49.260 1.00 21.19 N ATOM 418 CA ARG 304 37.968 69.699 49.258 1.00 23.09 C ATOM 419 C ARG 304 38.686 71.017 49.080 1.00 25.39 C ATOM 420 O ARG 304 38.954 71.456 47.958 1.00 27.97 O ATOM 421 CB ARG 304 38.377 68.735 48.142 1.00 21.91 C ATOM 422 CG ARG 304 39.835 68.308 48.263 1.00 21.12 C ATOM 423 CD ARG 304 40.292 67.440 47.118 1.00 21.36 C ATOM 424 NE ARG 304 41.648 66.951 47.343 1.00 22.93 N ATOM 425 CZ ARG 304 42.757 67.599 47.000 1.00 20.68 C ATOM 426 NH1 ARG 304 42.685 68.779 46.399 1.00 21.98 N ATOM 427 NH2 ARG 304 43.939 67.073 47.283 1.00 20.79 N ATOM 428 H ARG 304 36.211 70.825 48.939 1.00 15.00 H ATOM 429 HE ARG 304 41.695 66.077 47.760 1.00 15.00 H ATOM 430 1HH1 ARG 304 41.808 69.221 46.178 1.00 0.00 H ATOM 431 2HH1 ARG 304 43.514 69.306 46.136 1.00 0.00 H ATOM 432 1HH2 ARG 304 44.016 66.189 47.766 1.00 0.00 H ATOM 433 2HH2 ARG 304 44.798 67.546 47.012 1.00 0.00 H ATOM 434 N ASN 305 38.966 71.659 50.202 1.00 28.37 N ATOM 435 CA ASN 305 39.653 72.932 50.214 1.00 30.77 C ATOM 436 C ASN 305 40.679 72.797 51.318 1.00 30.73 C ATOM 437 O ASN 305 40.352 72.941 52.497 1.00 31.26 O ATOM 438 CB ASN 305 38.670 74.058 50.531 1.00 32.02 C ATOM 439 CG ASN 305 39.307 75.427 50.440 1.00 37.63 C ATOM 440 OD1 ASN 305 40.522 75.575 50.608 1.00 38.66 O ATOM 441 ND2 ASN 305 38.490 76.442 50.189 1.00 40.06 N ATOM 442 H ASN 305 38.706 71.248 51.054 1.00 15.00 H ATOM 443 1HD2 ASN 305 38.877 77.335 50.104 1.00 0.00 H ATOM 444 2HD2 ASN 305 37.532 76.246 50.100 1.00 0.00 H ATOM 445 N LEU 306 41.920 72.522 50.927 1.00 32.41 N ATOM 446 CA LEU 306 43.014 72.323 51.874 1.00 34.36 C ATOM 447 C LEU 306 43.514 73.562 52.615 1.00 37.88 C ATOM 448 O LEU 306 44.445 73.472 53.418 1.00 39.10 O ATOM 449 CB LEU 306 44.180 71.614 51.189 1.00 30.29 C ATOM 450 CG LEU 306 43.793 70.347 50.424 1.00 30.25 C ATOM 451 CD1 LEU 306 45.042 69.658 49.912 1.00 30.56 C ATOM 452 CD2 LEU 306 42.995 69.412 51.316 1.00 28.66 C ATOM 453 H LEU 306 42.112 72.465 49.962 1.00 15.00 H ATOM 454 N GLU 307 42.881 74.704 52.377 1.00 40.12 N ATOM 455 CA GLU 307 43.272 75.939 53.036 1.00 42.74 C ATOM 456 C GLU 307 42.196 76.449 53.991 1.00 44.43 C ATOM 457 O GLU 307 42.501 77.081 55.002 1.00 46.70 O ATOM 458 CB GLU 307 43.591 77.007 51.987 1.00 44.35 C ATOM 459 CG GLU 307 44.723 76.622 51.044 1.00 50.66 C ATOM 460 CD GLU 307 46.000 76.275 51.788 1.00 54.60 C ATOM 461 OE1 GLU 307 46.501 77.124 52.557 1.00 58.99 O ATOM 462 OE2 GLU 307 46.499 75.137 51.639 1.00 56.69 O ATOM 463 H GLU 307 42.158 74.747 51.719 1.00 15.00 H ATOM 464 N GLN 308 40.946 76.107 53.698 1.00 46.20 N ATOM 465 CA GLN 308 39.784 76.535 54.480 1.00 48.55 C ATOM 466 C GLN 308 39.800 76.248 55.983 1.00 48.83 C ATOM 467 O GLN 308 39.730 75.092 56.399 1.00 48.53 O ATOM 468 CB GLN 308 38.523 75.937 53.860 1.00 50.62 C ATOM 469 CG GLN 308 37.216 76.387 54.482 1.00 55.59 C ATOM 470 CD GLN 308 36.019 75.887 53.695 1.00 59.38 C ATOM 471 OE1 GLN 308 35.890 76.157 52.499 1.00 62.25 O ATOM 472 NE2 GLN 308 35.144 75.146 54.356 1.00 62.82 N ATOM 473 H GLN 308 40.803 75.524 52.924 1.00 15.00 H ATOM 474 1HE2 GLN 308 34.390 74.791 53.837 1.00 15.00 H ATOM 475 2HE2 GLN 308 35.287 74.972 55.310 1.00 15.00 H HETATM 476 N MSE 309 39.882 77.305 56.791 1.00 50.56 N HETATM 477 CA MSE 309 39.874 77.165 58.249 1.00 51.68 C HETATM 478 C MSE 309 38.497 76.655 58.651 1.00 49.83 C HETATM 479 O MSE 309 37.482 77.143 58.138 1.00 48.93 O HETATM 480 CB MSE 309 40.160 78.503 58.936 1.00 53.45 C HETATM 481 CG MSE 309 41.580 79.001 58.745 1.00 60.33 C HETATM 482 SE MSE 309 42.970 77.758 59.293 1.00 71.84 SE HETATM 483 CE MSE 309 42.768 77.704 61.196 1.00 62.87 C HETATM 484 1HN MSE 309 39.952 78.192 56.391 1.00 15.00 H ATOM 485 N GLN 310 38.459 75.726 59.605 1.00 46.57 N ATOM 486 CA GLN 310 37.201 75.118 60.030 1.00 41.83 C ATOM 487 C GLN 310 37.187 74.635 61.480 1.00 37.43 C ATOM 488 O GLN 310 38.221 74.256 62.029 1.00 37.02 O ATOM 489 CB GLN 310 36.902 73.934 59.095 1.00 40.17 C ATOM 490 CG GLN 310 35.745 73.050 59.507 1.00 37.42 C ATOM 491 CD GLN 310 34.419 73.751 59.386 1.00 37.49 C ATOM 492 OE1 GLN 310 34.175 74.474 58.419 1.00 35.28 O ATOM 493 NE2 GLN 310 33.549 73.548 60.370 1.00 35.89 N ATOM 494 H GLN 310 39.281 75.413 60.034 1.00 15.00 H ATOM 495 1HE2 GLN 310 32.660 73.968 60.311 1.00 15.00 H ATOM 496 2HE2 GLN 310 33.815 72.968 61.110 1.00 15.00 H ATOM 497 N ASN 311 36.010 74.674 62.099 1.00 34.78 N ATOM 498 CA ASN 311 35.844 74.197 63.471 1.00 34.91 C ATOM 499 C ASN 311 35.506 72.712 63.405 1.00 32.82 C ATOM 500 O ASN 311 34.632 72.309 62.632 1.00 31.53 O ATOM 501 CB ASN 311 34.701 74.924 64.178 1.00 37.99 C ATOM 502 CG ASN 311 35.030 76.360 64.502 1.00 40.25 C ATOM 503 OD1 ASN 311 36.198 76.741 64.586 1.00 42.33 O ATOM 504 ND2 ASN 311 33.998 77.171 64.688 1.00 40.83 N ATOM 505 H ASN 311 35.229 75.020 61.623 1.00 15.00 H ATOM 506 1HD2 ASN 311 34.157 78.112 64.901 1.00 0.00 H ATOM 507 2HD2 ASN 311 33.102 76.763 64.627 1.00 0.00 H ATOM 508 N PHE 312 36.182 71.908 64.219 1.00 29.74 N ATOM 509 CA PHE 312 35.957 70.466 64.239 1.00 29.93 C ATOM 510 C PHE 312 35.678 69.911 65.637 1.00 29.03 C ATOM 511 O PHE 312 36.196 70.407 66.640 1.00 27.15 O ATOM 512 CB PHE 312 37.175 69.711 63.684 1.00 26.74 C ATOM 513 CG PHE 312 37.469 69.969 62.228 1.00 26.92 C ATOM 514 CD1 PHE 312 36.864 69.204 61.235 1.00 25.07 C ATOM 515 CD2 PHE 312 38.394 70.943 61.852 1.00 26.63 C ATOM 516 CE1 PHE 312 37.178 69.404 59.888 1.00 27.45 C ATOM 517 CE2 PHE 312 38.715 71.151 60.511 1.00 25.24 C ATOM 518 CZ PHE 312 38.108 70.381 59.527 1.00 24.21 C ATOM 519 H PHE 312 36.829 72.280 64.845 1.00 15.00 H ATOM 520 N VAL 313 34.853 68.871 65.678 1.00 27.34 N ATOM 521 CA VAL 313 34.527 68.153 66.903 1.00 23.86 C ATOM 522 C VAL 313 35.554 67.028 66.900 1.00 22.64 C ATOM 523 O VAL 313 35.923 66.530 65.835 1.00 21.33 O ATOM 524 CB VAL 313 33.111 67.507 66.832 1.00 22.28 C ATOM 525 CG1 VAL 313 32.828 66.682 68.082 1.00 19.36 C ATOM 526 CG2 VAL 313 32.052 68.573 66.660 1.00 20.57 C ATOM 527 H VAL 313 34.455 68.569 64.859 1.00 15.00 H ATOM 528 N GLN 314 36.065 66.670 68.068 1.00 23.51 N ATOM 529 CA GLN 314 37.029 65.587 68.156 1.00 24.70 C ATOM 530 C GLN 314 36.481 64.521 69.090 1.00 25.31 C ATOM 531 O GLN 314 36.229 64.779 70.268 1.00 27.17 O ATOM 532 CB GLN 314 38.386 66.093 68.639 1.00 23.66 C ATOM 533 CG GLN 314 39.082 66.996 67.637 1.00 29.49 C ATOM 534 CD GLN 314 40.472 67.389 68.083 1.00 35.38 C ATOM 535 OE1 GLN 314 40.663 67.884 69.195 1.00 36.28 O ATOM 536 NE2 GLN 314 41.455 67.154 67.227 1.00 37.33 N ATOM 537 H GLN 314 35.772 67.131 68.883 1.00 15.00 H ATOM 538 1HE2 GLN 314 42.358 67.416 67.492 1.00 15.00 H ATOM 539 2HE2 GLN 314 41.228 66.734 66.367 1.00 15.00 H ATOM 540 N LEU 315 36.243 63.338 68.539 1.00 23.42 N ATOM 541 CA LEU 315 35.711 62.228 69.304 1.00 21.63 C ATOM 542 C LEU 315 36.819 61.250 69.652 1.00 23.84 C ATOM 543 O LEU 315 37.502 60.729 68.768 1.00 24.09 O ATOM 544 CB LEU 315 34.624 61.518 68.502 1.00 19.18 C ATOM 545 CG LEU 315 33.455 62.397 68.061 1.00 20.92 C ATOM 546 CD1 LEU 315 32.550 61.600 67.145 1.00 22.26 C ATOM 547 CD2 LEU 315 32.687 62.901 69.280 1.00 20.80 C ATOM 548 H LEU 315 36.428 63.210 67.585 1.00 15.00 H ATOM 549 N HIS 316 37.012 61.028 70.947 1.00 22.36 N ATOM 550 CA HIS 316 38.035 60.107 71.428 1.00 21.94 C ATOM 551 C HIS 316 37.350 58.835 71.883 1.00 20.18 C ATOM 552 O HIS 316 36.383 58.890 72.645 1.00 20.85 O ATOM 553 CB HIS 316 38.798 60.721 72.604 1.00 21.65 C ATOM 554 CG HIS 316 39.371 62.071 72.317 1.00 18.25 C ATOM 555 ND1 HIS 316 40.716 62.277 72.099 1.00 18.83 N ATOM 556 CD2 HIS 316 38.780 63.285 72.205 1.00 17.22 C ATOM 557 CE1 HIS 316 40.928 63.560 71.863 1.00 17.88 C ATOM 558 NE2 HIS 316 39.770 64.192 71.922 1.00 21.82 N ATOM 559 H HIS 316 36.419 61.470 71.593 1.00 15.00 H ATOM 560 HD1 HIS 316 41.403 61.571 72.109 1.00 15.00 H ATOM 561 HE2 HIS 316 39.624 65.145 71.748 1.00 15.00 H ATOM 562 N THR 317 37.850 57.694 71.424 1.00 21.53 N ATOM 563 CA THR 317 37.277 56.404 71.780 1.00 22.47 C ATOM 564 C THR 317 38.113 55.731 72.867 1.00 25.42 C ATOM 565 O THR 317 39.272 56.105 73.078 1.00 24.99 O ATOM 566 CB THR 317 37.172 55.487 70.539 1.00 20.66 C ATOM 567 OG1 THR 317 38.477 55.031 70.145 1.00 20.83 O ATOM 568 CG2 THR 317 36.547 56.255 69.384 1.00 15.24 C ATOM 569 H THR 317 38.628 57.694 70.829 1.00 15.00 H ATOM 570 HG1 THR 317 38.329 54.158 69.746 1.00 15.00 H ATOM 571 N ASP 318 37.536 54.740 73.546 1.00 28.17 N ATOM 572 CA ASP 318 38.249 54.040 74.614 1.00 30.39 C ATOM 573 C ASP 318 39.488 53.322 74.101 1.00 30.95 C ATOM 574 O ASP 318 40.425 53.079 74.859 1.00 32.95 O ATOM 575 CB ASP 318 37.325 53.074 75.389 1.00 29.73 C ATOM 576 CG ASP 318 36.873 51.865 74.566 1.00 34.28 C ATOM 577 OD1 ASP 318 37.711 51.033 74.157 1.00 38.02 O ATOM 578 OD2 ASP 318 35.653 51.706 74.365 1.00 34.69 O ATOM 579 H ASP 318 36.610 54.482 73.345 1.00 15.00 H ATOM 580 N GLY 319 39.498 53.013 72.806 1.00 29.87 N ATOM 581 CA GLY 319 40.630 52.328 72.210 1.00 26.63 C ATOM 582 C GLY 319 41.761 53.257 71.817 1.00 27.08 C ATOM 583 O GLY 319 42.841 52.796 71.447 1.00 28.35 O ATOM 584 H GLY 319 38.715 53.210 72.253 1.00 15.00 H ATOM 585 N GLY 320 41.522 54.562 71.881 1.00 25.04 N ATOM 586 CA GLY 320 42.556 55.513 71.518 1.00 26.01 C ATOM 587 C GLY 320 42.372 56.218 70.178 1.00 25.80 C ATOM 588 O GLY 320 43.174 57.081 69.819 1.00 26.65 O ATOM 589 H GLY 320 40.646 54.888 72.178 1.00 15.00 H ATOM 590 N ALA 321 41.326 55.866 69.434 1.00 26.03 N ATOM 591 CA ALA 321 41.072 56.497 68.141 1.00 20.08 C ATOM 592 C ALA 321 40.492 57.883 68.372 1.00 19.10 C ATOM 593 O ALA 321 39.818 58.124 69.371 1.00 21.79 O ATOM 594 CB ALA 321 40.110 55.653 67.309 1.00 19.37 C ATOM 595 H ALA 321 40.695 55.199 69.774 1.00 15.00 H ATOM 596 N VAL 322 40.806 58.809 67.478 1.00 19.21 N ATOM 597 CA VAL 322 40.300 60.162 67.580 1.00 18.82 C ATOM 598 C VAL 322 39.836 60.561 66.197 1.00 19.81 C ATOM 599 O VAL 322 40.610 60.509 65.240 1.00 18.23 O ATOM 600 CB VAL 322 41.382 61.153 68.070 1.00 20.95 C ATOM 601 CG1 VAL 322 40.794 62.553 68.217 1.00 21.30 C ATOM 602 CG2 VAL 322 41.961 60.687 69.398 1.00 21.73 C ATOM 603 H VAL 322 41.393 58.588 66.724 1.00 15.00 H ATOM 604 N LEU 323 38.551 60.885 66.089 1.00 20.48 N ATOM 605 CA LEU 323 37.951 61.300 64.825 1.00 18.10 C ATOM 606 C LEU 323 37.671 62.787 64.879 1.00 18.87 C ATOM 607 O LEU 323 36.950 63.263 65.756 1.00 19.99 O ATOM 608 CB LEU 323 36.643 60.542 64.568 1.00 17.71 C ATOM 609 CG LEU 323 35.829 60.960 63.336 1.00 21.10 C ATOM 610 CD1 LEU 323 36.623 60.688 62.062 1.00 16.54 C ATOM 611 CD2 LEU 323 34.484 60.234 63.307 1.00 17.43 C ATOM 612 H LEU 323 37.986 60.859 66.889 1.00 15.00 H ATOM 613 N THR 324 38.273 63.522 63.959 1.00 19.47 N ATOM 614 CA THR 324 38.081 64.955 63.882 1.00 19.04 C ATOM 615 C THR 324 37.119 65.191 62.715 1.00 21.57 C ATOM 616 O THR 324 37.451 64.910 61.561 1.00 21.37 O ATOM 617 CB THR 324 39.427 65.647 63.653 1.00 22.34 C ATOM 618 OG1 THR 324 40.344 65.223 64.671 1.00 21.37 O ATOM 619 CG2 THR 324 39.278 67.152 63.714 1.00 24.83 C ATOM 620 H THR 324 38.847 63.098 63.282 1.00 15.00 H ATOM 621 HG1 THR 324 40.620 64.313 64.468 1.00 15.00 H ATOM 622 N VAL 325 35.920 65.673 63.036 1.00 20.89 N ATOM 623 CA VAL 325 34.861 65.910 62.055 1.00 21.64 C ATOM 624 C VAL 325 34.102 67.204 62.311 1.00 22.28 C ATOM 625 O VAL 325 33.981 67.645 63.451 1.00 19.36 O ATOM 626 CB VAL 325 33.796 64.783 62.097 1.00 22.15 C ATOM 627 CG1 VAL 325 34.216 63.621 61.263 1.00 24.57 C ATOM 628 CG2 VAL 325 33.561 64.329 63.533 1.00 23.78 C ATOM 629 H VAL 325 35.728 65.900 63.973 1.00 15.00 H ATOM 630 N THR 326 33.543 67.783 61.252 1.00 24.45 N ATOM 631 CA THR 326 32.772 69.015 61.391 1.00 24.41 C ATOM 632 C THR 326 31.491 68.747 62.187 1.00 24.72 C ATOM 633 O THR 326 30.961 67.629 62.176 1.00 21.98 O ATOM 634 CB THR 326 32.434 69.634 60.024 1.00 23.58 C ATOM 635 OG1 THR 326 31.770 68.667 59.194 1.00 23.52 O ATOM 636 CG2 THR 326 33.709 70.109 59.342 1.00 20.95 C ATOM 637 H THR 326 33.670 67.379 60.377 1.00 15.00 H ATOM 638 HG1 THR 326 30.893 69.095 59.067 1.00 15.00 H ATOM 639 N PRO 327 30.965 69.780 62.865 1.00 23.37 N ATOM 640 CA PRO 327 29.753 69.682 63.679 1.00 22.02 C ATOM 641 C PRO 327 28.566 69.013 62.998 1.00 21.49 C ATOM 642 O PRO 327 27.902 68.161 63.590 1.00 20.60 O ATOM 643 CB PRO 327 29.456 71.145 64.003 1.00 21.12 C ATOM 644 CG PRO 327 30.813 71.741 64.099 1.00 20.95 C ATOM 645 CD PRO 327 31.480 71.162 62.876 1.00 23.37 C ATOM 646 N ALA 328 28.320 69.384 61.747 1.00 21.89 N ATOM 647 CA ALA 328 27.194 68.847 60.998 1.00 21.19 C ATOM 648 C ALA 328 27.438 67.548 60.223 1.00 22.46 C ATOM 649 O ALA 328 26.629 67.171 59.386 1.00 25.32 O ATOM 650 CB ALA 328 26.643 69.923 60.076 1.00 22.12 C ATOM 651 H ALA 328 28.888 70.057 61.312 1.00 15.00 H ATOM 652 N HIS 329 28.522 66.840 60.515 1.00 21.91 N ATOM 653 CA HIS 329 28.797 65.588 59.813 1.00 20.09 C ATOM 654 C HIS 329 28.104 64.426 60.539 1.00 22.07 C ATOM 655 O HIS 329 28.108 64.376 61.774 1.00 19.35 O ATOM 656 CB HIS 329 30.312 65.344 59.749 1.00 20.44 C ATOM 657 CG HIS 329 30.729 64.375 58.683 1.00 19.94 C ATOM 658 ND1 HIS 329 31.615 64.713 57.683 1.00 21.37 N ATOM 659 CD2 HIS 329 30.359 63.094 58.437 1.00 17.76 C ATOM 660 CE1 HIS 329 31.761 63.688 56.859 1.00 20.67 C ATOM 661 NE2 HIS 329 31.011 62.696 57.298 1.00 16.61 N ATOM 662 H HIS 329 29.125 67.138 61.229 1.00 15.00 H ATOM 663 HD1 HIS 329 32.241 65.423 57.778 1.00 15.00 H ATOM 664 HE2 HIS 329 30.980 61.835 56.856 1.00 15.00 H ATOM 665 N LEU 330 27.487 63.516 59.782 1.00 20.38 N ATOM 666 CA LEU 330 26.815 62.355 60.376 1.00 20.67 C ATOM 667 C LEU 330 27.819 61.279 60.755 1.00 20.47 C ATOM 668 O LEU 330 28.704 60.929 59.967 1.00 21.10 O ATOM 669 CB LEU 330 25.790 61.742 59.426 1.00 20.88 C ATOM 670 CG LEU 330 24.415 62.383 59.319 1.00 25.29 C ATOM 671 CD1 LEU 330 23.641 61.634 58.256 1.00 28.05 C ATOM 672 CD2 LEU 330 23.694 62.330 60.663 1.00 21.60 C ATOM 673 H LEU 330 27.462 63.620 58.805 1.00 15.00 H ATOM 674 N VAL 331 27.639 60.719 61.945 1.00 15.96 N ATOM 675 CA VAL 331 28.522 59.686 62.459 1.00 16.90 C ATOM 676 C VAL 331 27.686 58.528 63.004 1.00 17.73 C ATOM 677 O VAL 331 26.599 58.749 63.541 1.00 20.35 O ATOM 678 CB VAL 331 29.440 60.284 63.563 1.00 14.54 C ATOM 679 CG1 VAL 331 30.227 59.189 64.274 1.00 11.65 C ATOM 680 CG2 VAL 331 30.388 61.326 62.940 1.00 10.58 C ATOM 681 H VAL 331 26.894 60.996 62.517 1.00 15.00 H ATOM 682 N SER 332 28.160 57.299 62.800 1.00 17.80 N ATOM 683 CA SER 332 27.462 56.109 63.280 1.00 18.51 C ATOM 684 C SER 332 27.577 55.995 64.794 1.00 20.43 C ATOM 685 O SER 332 28.671 56.123 65.356 1.00 20.10 O ATOM 686 CB SER 332 28.051 54.845 62.655 1.00 14.46 C ATOM 687 OG SER 332 27.965 54.895 61.251 1.00 29.75 O ATOM 688 H SER 332 29.008 57.163 62.338 1.00 15.00 H ATOM 689 HG SER 332 28.319 54.058 60.946 1.00 15.00 H ATOM 690 N VAL 333 26.445 55.746 65.441 1.00 20.76 N ATOM 691 CA VAL 333 26.373 55.590 66.884 1.00 18.57 C ATOM 692 C VAL 333 25.671 54.265 67.148 1.00 18.56 C ATOM 693 O VAL 333 24.632 53.963 66.555 1.00 18.98 O ATOM 694 CB VAL 333 25.596 56.755 67.549 1.00 18.12 C ATOM 695 CG1 VAL 333 25.319 56.444 69.013 1.00 19.82 C ATOM 696 CG2 VAL 333 26.401 58.035 67.452 1.00 17.31 C ATOM 697 H VAL 333 25.618 55.619 64.957 1.00 15.00 H ATOM 698 N TRP 334 26.289 53.442 67.979 1.00 18.51 N ATOM 699 CA TRP 334 25.738 52.149 68.313 1.00 20.87 C ATOM 700 C TRP 334 25.016 52.236 69.648 1.00 23.69 C ATOM 701 O TRP 334 25.545 52.780 70.617 1.00 26.06 O ATOM 702 CB TRP 334 26.860 51.113 68.382 1.00 23.41 C ATOM 703 CG TRP 334 26.404 49.744 68.779 1.00 27.36 C ATOM 704 CD1 TRP 334 26.707 49.083 69.935 1.00 25.44 C ATOM 705 CD2 TRP 334 25.579 48.858 68.013 1.00 29.88 C ATOM 706 NE1 TRP 334 26.124 47.839 69.936 1.00 29.97 N ATOM 707 CE2 TRP 334 25.426 47.673 68.769 1.00 30.97 C ATOM 708 CE3 TRP 334 24.954 48.950 66.760 1.00 31.09 C ATOM 709 CZ2 TRP 334 24.674 46.585 68.314 1.00 30.77 C ATOM 710 CZ3 TRP 334 24.206 47.866 66.307 1.00 33.89 C ATOM 711 CH2 TRP 334 24.074 46.699 67.084 1.00 30.11 C ATOM 712 H TRP 334 27.117 53.731 68.393 1.00 15.00 H ATOM 713 HE1 TRP 334 26.190 47.202 70.677 1.00 15.00 H ATOM 714 N GLN 335 23.796 51.717 69.679 1.00 25.10 N ATOM 715 CA GLN 335 22.977 51.699 70.885 1.00 28.43 C ATOM 716 C GLN 335 23.071 50.241 71.329 1.00 28.27 C ATOM 717 O GLN 335 22.383 49.367 70.789 1.00 29.57 O ATOM 718 CB GLN 335 21.535 52.068 70.542 1.00 33.35 C ATOM 719 CG GLN 335 21.412 53.097 69.424 1.00 39.99 C ATOM 720 CD GLN 335 20.843 54.414 69.893 1.00 48.27 C ATOM 721 OE1 GLN 335 21.568 55.275 70.401 1.00 50.26 O ATOM 722 NE2 GLN 335 19.538 54.588 69.716 1.00 46.06 N ATOM 723 H GLN 335 23.433 51.324 68.858 1.00 15.00 H ATOM 724 1HE2 GLN 335 19.147 55.442 69.983 1.00 15.00 H ATOM 725 2HE2 GLN 335 19.038 53.845 69.320 1.00 15.00 H ATOM 726 N PRO 336 23.948 49.956 72.303 1.00 28.94 N ATOM 727 CA PRO 336 24.164 48.604 72.825 1.00 30.31 C ATOM 728 C PRO 336 22.928 47.857 73.314 1.00 34.58 C ATOM 729 O PRO 336 22.795 46.661 73.065 1.00 34.85 O ATOM 730 CB PRO 336 25.184 48.830 73.941 1.00 28.76 C ATOM 731 CG PRO 336 24.858 50.215 74.415 1.00 27.12 C ATOM 732 CD PRO 336 24.668 50.949 73.121 1.00 27.34 C ATOM 733 N GLU 337 22.020 48.561 73.979 1.00 37.25 N ATOM 734 CA GLU 337 20.815 47.941 74.511 1.00 42.86 C ATOM 735 C GLU 337 19.829 47.467 73.455 1.00 44.32 C ATOM 736 O GLU 337 19.335 46.343 73.523 1.00 48.00 O ATOM 737 CB GLU 337 20.102 48.897 75.462 1.00 46.51 C ATOM 738 CG GLU 337 19.249 49.969 74.775 1.00 53.72 C ATOM 739 CD GLU 337 20.048 50.952 73.930 1.00 55.65 C ATOM 740 OE1 GLU 337 21.240 51.194 74.214 1.00 57.08 O ATOM 741 OE2 GLU 337 19.470 51.488 72.965 1.00 60.21 O ATOM 742 H GLU 337 22.155 49.516 74.149 1.00 15.00 H ATOM 743 N SER 338 19.540 48.323 72.483 1.00 45.40 N ATOM 744 CA SER 338 18.584 47.988 71.444 1.00 44.63 C ATOM 745 C SER 338 19.219 47.414 70.197 1.00 45.84 C ATOM 746 O SER 338 18.521 47.166 69.217 1.00 50.46 O ATOM 747 CB SER 338 17.758 49.220 71.069 1.00 44.61 C ATOM 748 OG SER 338 18.577 50.255 70.558 1.00 42.59 O ATOM 749 H SER 338 19.975 49.199 72.447 1.00 15.00 H ATOM 750 HG SER 338 18.949 50.742 71.310 1.00 15.00 H ATOM 751 N GLN 339 20.533 47.206 70.221 1.00 45.70 N ATOM 752 CA GLN 339 21.228 46.673 69.054 1.00 48.08 C ATOM 753 C GLN 339 20.873 47.518 67.832 1.00 46.32 C ATOM 754 O GLN 339 20.592 46.992 66.753 1.00 48.50 O ATOM 755 CB GLN 339 20.831 45.213 68.795 1.00 54.30 C ATOM 756 CG GLN 339 21.740 44.174 69.423 1.00 58.34 C ATOM 757 CD GLN 339 21.740 44.249 70.924 1.00 61.64 C ATOM 758 OE1 GLN 339 20.714 44.037 71.564 1.00 66.54 O ATOM 759 NE2 GLN 339 22.893 44.554 71.499 1.00 64.72 N ATOM 760 H GLN 339 21.036 47.424 71.031 1.00 15.00 H ATOM 761 1HE2 GLN 339 22.875 44.646 72.477 1.00 15.00 H ATOM 762 2HE2 GLN 339 23.681 44.696 70.951 1.00 15.00 H ATOM 763 N LYS 340 20.857 48.831 68.011 1.00 43.54 N ATOM 764 CA LYS 340 20.523 49.723 66.917 1.00 41.88 C ATOM 765 C LYS 340 21.690 50.583 66.467 1.00 40.15 C ATOM 766 O LYS 340 22.403 51.167 67.285 1.00 38.32 O ATOM 767 CB LYS 340 19.336 50.620 67.289 1.00 45.10 C ATOM 768 CG LYS 340 17.967 50.005 67.016 1.00 52.74 C ATOM 769 CD LYS 340 17.716 49.804 65.515 1.00 58.16 C ATOM 770 CE LYS 340 17.671 51.134 64.748 1.00 60.74 C ATOM 771 NZ LYS 340 17.369 50.951 63.290 1.00 63.19 N ATOM 772 H LYS 340 21.082 49.195 68.893 1.00 15.00 H ATOM 773 1HZ LYS 340 16.448 50.478 63.168 1.00 15.00 H ATOM 774 2HZ LYS 340 17.290 51.859 62.779 1.00 15.00 H ATOM 775 3HZ LYS 340 18.091 50.357 62.839 1.00 15.00 H ATOM 776 N LEU 341 21.909 50.609 65.158 1.00 35.89 N ATOM 777 CA LEU 341 22.958 51.429 64.576 1.00 32.34 C ATOM 778 C LEU 341 22.229 52.653 64.030 1.00 29.28 C ATOM 779 O LEU 341 21.271 52.520 63.254 1.00 25.51 O ATOM 780 CB LEU 341 23.663 50.674 63.447 1.00 35.05 C ATOM 781 CG LEU 341 24.859 51.371 62.793 1.00 36.44 C ATOM 782 CD1 LEU 341 25.948 51.586 63.828 1.00 32.25 C ATOM 783 CD2 LEU 341 25.378 50.547 61.615 1.00 36.63 C ATOM 784 H LEU 341 21.374 50.048 64.570 1.00 15.00 H ATOM 785 N THR 342 22.609 53.834 64.496 1.00 24.12 N ATOM 786 CA THR 342 21.970 55.059 64.043 1.00 25.39 C ATOM 787 C THR 342 23.014 56.095 63.678 1.00 24.68 C ATOM 788 O THR 342 24.190 55.938 63.991 1.00 26.37 O ATOM 789 CB THR 342 21.065 55.655 65.138 1.00 27.36 C ATOM 790 OG1 THR 342 21.839 55.888 66.319 1.00 31.36 O ATOM 791 CG2 THR 342 19.920 54.701 65.468 1.00 29.12 C ATOM 792 H THR 342 23.326 53.932 65.160 1.00 15.00 H ATOM 793 HG1 THR 342 21.249 56.299 66.971 1.00 15.00 H ATOM 794 N PHE 343 22.588 57.137 62.978 1.00 22.20 N ATOM 795 CA PHE 343 23.488 58.209 62.594 1.00 19.85 C ATOM 796 C PHE 343 23.096 59.422 63.400 1.00 19.94 C ATOM 797 O PHE 343 21.912 59.719 63.545 1.00 20.56 O ATOM 798 CB PHE 343 23.372 58.513 61.105 1.00 20.12 C ATOM 799 CG PHE 343 23.971 57.461 60.230 1.00 21.85 C ATOM 800 CD1 PHE 343 25.309 57.532 59.860 1.00 22.32 C ATOM 801 CD2 PHE 343 23.196 56.403 59.764 1.00 25.92 C ATOM 802 CE1 PHE 343 25.869 56.567 59.038 1.00 23.81 C ATOM 803 CE2 PHE 343 23.745 55.435 58.941 1.00 27.13 C ATOM 804 CZ PHE 343 25.087 55.517 58.576 1.00 25.71 C ATOM 805 H PHE 343 21.644 57.202 62.729 1.00 15.00 H ATOM 806 N VAL 344 24.095 60.115 63.928 1.00 20.23 N ATOM 807 CA VAL 344 23.882 61.303 64.745 1.00 21.14 C ATOM 808 C VAL 344 24.894 62.340 64.286 1.00 23.09 C ATOM 809 O VAL 344 25.970 61.981 63.799 1.00 23.80 O ATOM 810 CB VAL 344 24.139 60.978 66.244 1.00 22.15 C ATOM 811 CG1 VAL 344 24.073 62.237 67.095 1.00 25.77 C ATOM 812 CG2 VAL 344 23.128 59.951 66.746 1.00 21.95 C ATOM 813 H VAL 344 25.026 59.842 63.777 1.00 15.00 H ATOM 814 N PHE 345 24.537 63.617 64.380 1.00 19.48 N ATOM 815 CA PHE 345 25.463 64.671 63.992 1.00 20.27 C ATOM 816 C PHE 345 26.610 64.686 64.993 1.00 19.87 C ATOM 817 O PHE 345 26.407 64.430 66.185 1.00 22.05 O ATOM 818 CB PHE 345 24.758 66.027 63.927 1.00 22.77 C ATOM 819 CG PHE 345 23.903 66.197 62.707 1.00 23.93 C ATOM 820 CD1 PHE 345 24.485 66.327 61.453 1.00 23.25 C ATOM 821 CD2 PHE 345 22.521 66.202 62.806 1.00 24.18 C ATOM 822 CE1 PHE 345 23.704 66.458 60.315 1.00 26.82 C ATOM 823 CE2 PHE 345 21.729 66.332 61.674 1.00 28.95 C ATOM 824 CZ PHE 345 22.323 66.459 60.424 1.00 29.06 C ATOM 825 H PHE 345 23.660 63.849 64.732 1.00 15.00 H ATOM 826 N ALA 346 27.816 64.939 64.498 1.00 16.60 N ATOM 827 CA ALA 346 29.004 64.958 65.333 1.00 20.06 C ATOM 828 C ALA 346 28.839 65.796 66.602 1.00 22.16 C ATOM 829 O ALA 346 29.158 65.335 67.700 1.00 18.07 O ATOM 830 CB ALA 346 30.199 65.442 64.529 1.00 19.45 C ATOM 831 H ALA 346 27.905 65.112 63.536 1.00 15.00 H ATOM 832 N ASP 347 28.288 66.997 66.456 1.00 24.92 N ATOM 833 CA ASP 347 28.105 67.890 67.594 1.00 24.42 C ATOM 834 C ASP 347 27.073 67.421 68.615 1.00 25.88 C ATOM 835 O ASP 347 27.034 67.925 69.735 1.00 28.00 O ATOM 836 CB ASP 347 27.797 69.316 67.124 1.00 28.38 C ATOM 837 CG ASP 347 26.498 69.424 66.346 1.00 34.05 C ATOM 838 OD1 ASP 347 25.787 68.410 66.166 1.00 35.51 O ATOM 839 OD2 ASP 347 26.189 70.549 65.896 1.00 39.41 O ATOM 840 H ASP 347 27.969 67.296 65.575 1.00 15.00 H ATOM 841 N ARG 348 26.256 66.445 68.240 1.00 23.58 N ATOM 842 CA ARG 348 25.245 65.919 69.147 1.00 26.55 C ATOM 843 C ARG 348 25.720 64.668 69.872 1.00 26.68 C ATOM 844 O ARG 348 24.985 64.092 70.679 1.00 28.14 O ATOM 845 CB ARG 348 23.946 65.633 68.397 1.00 28.43 C ATOM 846 CG ARG 348 23.339 66.865 67.769 1.00 34.46 C ATOM 847 CD ARG 348 22.142 66.528 66.905 1.00 43.24 C ATOM 848 NE ARG 348 21.875 67.612 65.964 1.00 52.79 N ATOM 849 CZ ARG 348 20.759 67.750 65.254 1.00 54.24 C ATOM 850 NH1 ARG 348 19.775 66.865 65.368 1.00 57.33 N ATOM 851 NH2 ARG 348 20.642 68.771 64.414 1.00 57.51 N ATOM 852 H ARG 348 26.330 66.110 67.324 1.00 15.00 H ATOM 853 HE ARG 348 22.615 68.267 65.855 1.00 15.00 H ATOM 854 1HH1 ARG 348 19.883 66.079 65.981 1.00 0.00 H ATOM 855 2HH1 ARG 348 18.923 66.920 64.846 1.00 0.00 H ATOM 856 1HH2 ARG 348 21.436 69.402 64.333 1.00 0.00 H ATOM 857 2HH2 ARG 348 19.839 68.951 63.841 1.00 0.00 H ATOM 858 N ILE 349 26.942 64.238 69.576 1.00 27.51 N ATOM 859 CA ILE 349 27.509 63.058 70.223 1.00 27.57 C ATOM 860 C ILE 349 28.134 63.446 71.565 1.00 28.58 C ATOM 861 O ILE 349 28.755 64.503 71.689 1.00 28.78 O ATOM 862 CB ILE 349 28.548 62.365 69.309 1.00 28.10 C ATOM 863 CG1 ILE 349 27.825 61.734 68.113 1.00 24.68 C ATOM 864 CG2 ILE 349 29.347 61.323 70.096 1.00 24.91 C ATOM 865 CD1 ILE 349 28.730 61.044 67.123 1.00 27.15 C ATOM 866 H ILE 349 27.481 64.731 68.922 1.00 15.00 H ATOM 867 N GLU 350 27.961 62.595 72.568 1.00 29.37 N ATOM 868 CA GLU 350 28.495 62.870 73.894 1.00 32.44 C ATOM 869 C GLU 350 29.228 61.665 74.472 1.00 29.73 C ATOM 870 O GLU 350 29.138 60.559 73.928 1.00 29.43 O ATOM 871 CB GLU 350 27.352 63.267 74.822 1.00 36.33 C ATOM 872 CG GLU 350 26.307 62.184 74.981 1.00 46.89 C ATOM 873 CD GLU 350 25.163 62.600 75.877 1.00 57.70 C ATOM 874 OE1 GLU 350 25.359 63.490 76.736 1.00 63.53 O ATOM 875 OE2 GLU 350 24.065 62.026 75.726 1.00 61.61 O ATOM 876 H GLU 350 27.457 61.759 72.450 1.00 15.00 H ATOM 877 N GLU 351 29.969 61.884 75.559 1.00 28.71 N ATOM 878 CA GLU 351 30.703 60.805 76.225 1.00 28.29 C ATOM 879 C GLU 351 29.718 59.709 76.579 1.00 28.44 C ATOM 880 O GLU 351 28.545 59.983 76.824 1.00 32.82 O ATOM 881 CB GLU 351 31.363 61.294 77.509 1.00 27.83 C ATOM 882 CG GLU 351 32.560 62.204 77.315 1.00 36.96 C ATOM 883 CD GLU 351 33.302 62.472 78.617 1.00 42.97 C ATOM 884 OE1 GLU 351 33.132 61.694 79.581 1.00 47.39 O ATOM 885 OE2 GLU 351 34.069 63.456 78.677 1.00 49.22 O ATOM 886 H GLU 351 29.997 62.790 75.930 1.00 15.00 H ATOM 887 N LYS 352 30.200 58.474 76.617 1.00 27.45 N ATOM 888 CA LYS 352 29.376 57.311 76.926 1.00 28.56 C ATOM 889 C LYS 352 28.648 56.758 75.707 1.00 26.52 C ATOM 890 O LYS 352 28.344 55.570 75.674 1.00 29.71 O ATOM 891 CB LYS 352 28.408 57.588 78.082 1.00 34.51 C ATOM 892 CG LYS 352 29.092 57.709 79.440 1.00 36.88 C ATOM 893 CD LYS 352 28.221 58.472 80.428 1.00 40.61 C ATOM 894 CE LYS 352 28.691 58.268 81.853 1.00 42.06 C ATOM 895 NZ LYS 352 28.519 56.849 82.271 1.00 46.84 N ATOM 896 H LYS 352 31.151 58.363 76.415 1.00 15.00 H ATOM 897 1HZ LYS 352 27.539 56.529 82.127 1.00 15.00 H ATOM 898 2HZ LYS 352 29.104 56.224 81.689 1.00 15.00 H ATOM 899 3HZ LYS 352 28.764 56.727 83.278 1.00 15.00 H ATOM 900 N ASN 353 28.367 57.596 74.708 1.00 25.27 N ATOM 901 CA ASN 353 27.737 57.104 73.479 1.00 22.17 C ATOM 902 C ASN 353 28.764 56.141 72.887 1.00 22.22 C ATOM 903 O ASN 353 29.935 56.179 73.269 1.00 22.20 O ATOM 904 CB ASN 353 27.516 58.232 72.461 1.00 25.03 C ATOM 905 CG ASN 353 26.215 58.988 72.671 1.00 26.72 C ATOM 906 OD1 ASN 353 26.097 60.145 72.262 1.00 26.06 O ATOM 907 ND2 ASN 353 25.223 58.334 73.260 1.00 29.58 N ATOM 908 H ASN 353 28.573 58.550 74.785 1.00 15.00 H ATOM 909 1HD2 ASN 353 24.411 58.858 73.449 1.00 0.00 H ATOM 910 2HD2 ASN 353 25.286 57.387 73.516 1.00 0.00 H ATOM 911 N GLN 354 28.348 55.289 71.958 1.00 21.01 N ATOM 912 CA GLN 354 29.279 54.351 71.345 1.00 21.15 C ATOM 913 C GLN 354 29.371 54.516 69.829 1.00 21.13 C ATOM 914 O GLN 354 28.379 54.806 69.162 1.00 20.61 O ATOM 915 CB GLN 354 28.923 52.913 71.728 1.00 19.37 C ATOM 916 CG GLN 354 29.281 52.587 73.177 1.00 27.77 C ATOM 917 CD GLN 354 28.902 51.179 73.597 1.00 28.99 C ATOM 918 OE1 GLN 354 29.308 50.198 72.980 1.00 33.01 O ATOM 919 NE2 GLN 354 28.136 51.074 74.666 1.00 34.42 N ATOM 920 H GLN 354 27.409 55.279 71.671 1.00 15.00 H ATOM 921 1HE2 GLN 354 27.907 50.178 74.984 1.00 15.00 H ATOM 922 2HE2 GLN 354 27.838 51.891 75.118 1.00 15.00 H ATOM 923 N VAL 355 30.589 54.415 69.307 1.00 19.75 N ATOM 924 CA VAL 355 30.837 54.535 67.875 1.00 18.01 C ATOM 925 C VAL 355 31.552 53.261 67.414 1.00 19.37 C ATOM 926 O VAL 355 32.069 52.501 68.235 1.00 18.72 O ATOM 927 CB VAL 355 31.707 55.776 67.544 1.00 15.68 C ATOM 928 CG1 VAL 355 30.939 57.060 67.841 1.00 13.49 C ATOM 929 CG2 VAL 355 33.015 55.734 68.321 1.00 14.78 C ATOM 930 H VAL 355 31.351 54.227 69.900 1.00 15.00 H ATOM 931 N LEU 356 31.542 53.004 66.112 1.00 19.07 N ATOM 932 CA LEU 356 32.188 51.814 65.577 1.00 20.61 C ATOM 933 C LEU 356 33.637 52.120 65.225 1.00 21.30 C ATOM 934 O LEU 356 33.923 53.082 64.509 1.00 19.84 O ATOM 935 CB LEU 356 31.442 51.288 64.345 1.00 20.72 C ATOM 936 CG LEU 356 30.042 50.696 64.546 1.00 23.62 C ATOM 937 CD1 LEU 356 30.068 49.658 65.655 1.00 20.29 C ATOM 938 CD2 LEU 356 29.060 51.796 64.885 1.00 26.92 C ATOM 939 H LEU 356 31.135 53.647 65.492 1.00 15.00 H ATOM 940 N VAL 357 34.545 51.301 65.746 1.00 19.19 N ATOM 941 CA VAL 357 35.970 51.468 65.515 1.00 16.68 C ATOM 942 C VAL 357 36.529 50.161 64.967 1.00 18.54 C ATOM 943 O VAL 357 36.151 49.085 65.426 1.00 19.20 O ATOM 944 CB VAL 357 36.685 51.840 66.831 1.00 15.03 C ATOM 945 CG1 VAL 357 38.186 51.944 66.625 1.00 15.30 C ATOM 946 CG2 VAL 357 36.140 53.158 67.358 1.00 13.30 C ATOM 947 H VAL 357 34.265 50.554 66.306 1.00 15.00 H ATOM 948 N ARG 358 37.391 50.257 63.955 1.00 18.49 N ATOM 949 CA ARG 358 38.001 49.077 63.349 1.00 17.30 C ATOM 950 C ARG 358 38.964 48.397 64.314 1.00 15.54 C ATOM 951 O ARG 358 39.858 49.041 64.870 1.00 18.22 O ATOM 952 CB ARG 358 38.766 49.449 62.071 1.00 17.24 C ATOM 953 CG ARG 358 39.368 48.244 61.354 1.00 15.15 C ATOM 954 CD ARG 358 40.178 48.649 60.137 1.00 18.03 C ATOM 955 NE ARG 358 40.740 47.487 59.449 1.00 21.98 N ATOM 956 CZ ARG 358 41.931 46.958 59.726 1.00 22.56 C ATOM 957 NH1 ARG 358 42.693 47.479 60.677 1.00 21.96 N ATOM 958 NH2 ARG 358 42.368 45.908 59.054 1.00 23.99 N ATOM 959 H ARG 358 37.618 51.146 63.628 1.00 15.00 H ATOM 960 HE ARG 358 40.183 47.067 58.742 1.00 15.00 H ATOM 961 1HH1 ARG 358 42.422 48.284 61.204 1.00 0.00 H ATOM 962 2HH1 ARG 358 43.589 47.090 60.905 1.00 0.00 H ATOM 963 1HH2 ARG 358 41.846 45.480 58.327 1.00 0.00 H ATOM 964 2HH2 ARG 358 43.262 45.488 59.251 1.00 0.00 H ATOM 965 N ASP 359 38.770 47.102 64.516 1.00 16.95 N ATOM 966 CA ASP 359 39.633 46.314 65.389 1.00 17.28 C ATOM 967 C ASP 359 40.841 45.902 64.546 1.00 17.95 C ATOM 968 O ASP 359 40.685 45.404 63.428 1.00 17.73 O ATOM 969 CB ASP 359 38.886 45.073 65.889 1.00 18.53 C ATOM 970 CG ASP 359 39.760 44.167 66.731 1.00 18.79 C ATOM 971 OD1 ASP 359 40.251 44.613 67.784 1.00 21.29 O ATOM 972 OD2 ASP 359 39.963 43.002 66.343 1.00 24.12 O ATOM 973 H ASP 359 38.038 46.647 64.063 1.00 15.00 H ATOM 974 N VAL 360 42.042 46.112 65.069 1.00 18.46 N ATOM 975 CA VAL 360 43.247 45.774 64.325 1.00 21.47 C ATOM 976 C VAL 360 43.361 44.293 63.959 1.00 22.98 C ATOM 977 O VAL 360 43.489 43.948 62.782 1.00 21.80 O ATOM 978 CB VAL 360 44.517 46.221 65.077 1.00 22.94 C ATOM 979 CG1 VAL 360 45.773 45.759 64.329 1.00 25.38 C ATOM 980 CG2 VAL 360 44.524 47.738 65.225 1.00 23.45 C ATOM 981 H VAL 360 42.114 46.448 65.988 1.00 15.00 H ATOM 982 N GLU 361 43.278 43.418 64.954 1.00 21.24 N ATOM 983 CA GLU 361 43.413 41.992 64.705 1.00 20.59 C ATOM 984 C GLU 361 42.398 41.392 63.735 1.00 21.53 C ATOM 985 O GLU 361 42.780 40.728 62.767 1.00 23.33 O ATOM 986 CB GLU 361 43.414 41.215 66.025 1.00 18.41 C ATOM 987 CG GLU 361 43.568 39.710 65.834 1.00 21.35 C ATOM 988 CD GLU 361 43.801 38.943 67.123 1.00 29.39 C ATOM 989 OE1 GLU 361 43.757 39.539 68.228 1.00 28.37 O ATOM 990 OE2 GLU 361 44.048 37.726 67.022 1.00 30.00 O ATOM 991 H GLU 361 43.101 43.732 65.867 1.00 15.00 H ATOM 992 N THR 362 41.112 41.639 63.969 1.00 21.93 N ATOM 993 CA THR 362 40.067 41.072 63.123 1.00 20.44 C ATOM 994 C THR 362 39.680 41.905 61.906 1.00 21.22 C ATOM 995 O THR 362 39.219 41.360 60.902 1.00 22.63 O ATOM 996 CB THR 362 38.790 40.788 63.939 1.00 21.13 C ATOM 997 OG1 THR 362 38.202 42.026 64.362 1.00 20.53 O ATOM 998 CG2 THR 362 39.116 39.945 65.155 1.00 17.62 C ATOM 999 H THR 362 40.854 42.215 64.722 1.00 15.00 H ATOM 1000 HG1 THR 362 37.364 41.862 64.806 1.00 15.00 H ATOM 1001 N GLY 363 39.840 43.221 62.005 1.00 22.47 N ATOM 1002 CA GLY 363 39.474 44.099 60.907 1.00 20.73 C ATOM 1003 C GLY 363 37.995 44.458 60.945 1.00 22.87 C ATOM 1004 O GLY 363 37.498 45.185 60.081 1.00 23.27 O ATOM 1005 H GLY 363 40.197 43.603 62.837 1.00 15.00 H ATOM 1006 N GLU 364 37.293 43.971 61.966 1.00 25.01 N ATOM 1007 CA GLU 364 35.859 44.215 62.122 1.00 24.61 C ATOM 1008 C GLU 364 35.554 45.557 62.773 1.00 23.62 C ATOM 1009 O GLU 364 36.352 46.075 63.554 1.00 22.43 O ATOM 1010 CB GLU 364 35.232 43.113 62.980 1.00 28.66 C ATOM 1011 CG GLU 364 35.407 41.695 62.448 1.00 34.34 C ATOM 1012 CD GLU 364 35.074 40.626 63.488 1.00 42.13 C ATOM 1013 OE1 GLU 364 34.638 40.968 64.612 1.00 43.68 O ATOM 1014 OE2 GLU 364 35.276 39.432 63.191 1.00 46.71 O ATOM 1015 H GLU 364 37.745 43.449 62.664 1.00 15.00 H ATOM 1016 N LEU 365 34.396 46.119 62.440 1.00 23.21 N ATOM 1017 CA LEU 365 33.957 47.383 63.020 1.00 23.86 C ATOM 1018 C LEU 365 33.233 47.017 64.316 1.00 24.67 C ATOM 1019 O LEU 365 32.159 46.413 64.287 1.00 25.62 O ATOM 1020 CB LEU 365 33.008 48.120 62.063 1.00 21.37 C ATOM 1021 CG LEU 365 33.616 48.584 60.734 1.00 21.23 C ATOM 1022 CD1 LEU 365 32.539 49.194 59.859 1.00 15.28 C ATOM 1023 CD2 LEU 365 34.736 49.587 60.994 1.00 21.18 C ATOM 1024 H LEU 365 33.815 45.684 61.788 1.00 15.00 H ATOM 1025 N ARG 366 33.851 47.341 65.447 1.00 23.34 N ATOM 1026 CA ARG 366 33.288 47.023 66.754 1.00 22.16 C ATOM 1027 C ARG 366 33.064 48.279 67.579 1.00 21.59 C ATOM 1028 O ARG 366 33.863 49.216 67.531 1.00 19.10 O ATOM 1029 CB ARG 366 34.219 46.064 67.493 1.00 26.57 C ATOM 1030 CG ARG 366 34.420 44.734 66.774 1.00 30.48 C ATOM 1031 CD ARG 366 35.439 43.851 67.478 1.00 33.83 C ATOM 1032 NE ARG 366 35.469 42.507 66.904 1.00 39.62 N ATOM 1033 CZ ARG 366 36.246 41.517 67.337 1.00 40.17 C ATOM 1034 NH1 ARG 366 37.075 41.709 68.361 1.00 38.11 N ATOM 1035 NH2 ARG 366 36.178 40.327 66.750 1.00 38.02 N ATOM 1036 H ARG 366 34.712 47.813 65.406 1.00 15.00 H ATOM 1037 HE ARG 366 34.881 42.326 66.127 1.00 15.00 H ATOM 1038 1HH1 ARG 366 37.129 42.611 68.815 1.00 0.00 H ATOM 1039 2HH1 ARG 366 37.747 41.037 68.697 1.00 0.00 H ATOM 1040 1HH2 ARG 366 35.541 40.192 65.966 1.00 0.00 H ATOM 1041 2HH2 ARG 366 36.740 39.549 67.023 1.00 0.00 H ATOM 1042 N PRO 367 31.972 48.316 68.355 1.00 22.98 N ATOM 1043 CA PRO 367 31.674 49.489 69.179 1.00 23.15 C ATOM 1044 C PRO 367 32.664 49.781 70.302 1.00 23.78 C ATOM 1045 O PRO 367 33.218 48.870 70.928 1.00 25.30 O ATOM 1046 CB PRO 367 30.267 49.195 69.705 1.00 25.11 C ATOM 1047 CG PRO 367 30.213 47.700 69.732 1.00 24.95 C ATOM 1048 CD PRO 367 30.892 47.317 68.448 1.00 22.17 C ATOM 1049 N GLN 368 32.911 51.069 70.506 1.00 22.65 N ATOM 1050 CA GLN 368 33.809 51.558 71.540 1.00 23.52 C ATOM 1051 C GLN 368 33.182 52.811 72.127 1.00 24.78 C ATOM 1052 O GLN 368 32.537 53.592 71.420 1.00 27.17 O ATOM 1053 CB GLN 368 35.185 51.905 70.970 1.00 20.18 C ATOM 1054 CG GLN 368 36.049 50.713 70.603 1.00 17.14 C ATOM 1055 CD GLN 368 37.475 51.117 70.286 1.00 19.05 C ATOM 1056 OE1 GLN 368 37.894 52.245 70.571 1.00 22.80 O ATOM 1057 NE2 GLN 368 38.225 50.211 69.681 1.00 19.88 N ATOM 1058 H GLN 368 32.473 51.749 69.949 1.00 15.00 H ATOM 1059 1HE2 GLN 368 39.152 50.467 69.484 1.00 15.00 H ATOM 1060 2HE2 GLN 368 37.853 49.333 69.449 1.00 15.00 H ATOM 1061 N ARG 369 33.377 52.995 73.424 1.00 23.11 N ATOM 1062 CA ARG 369 32.839 54.133 74.145 1.00 20.90 C ATOM 1063 C ARG 369 33.572 55.412 73.780 1.00 20.34 C ATOM 1064 O ARG 369 34.786 55.404 73.582 1.00 19.58 O ATOM 1065 CB ARG 369 33.012 53.919 75.651 1.00 21.66 C ATOM 1066 CG ARG 369 32.457 52.615 76.219 1.00 23.46 C ATOM 1067 CD ARG 369 33.298 52.158 77.426 1.00 27.70 C ATOM 1068 NE ARG 369 33.775 53.300 78.204 1.00 28.11 N ATOM 1069 CZ ARG 369 35.001 53.426 78.700 1.00 27.13 C ATOM 1070 NH1 ARG 369 35.906 52.471 78.527 1.00 28.35 N ATOM 1071 NH2 ARG 369 35.337 54.552 79.311 1.00 32.07 N ATOM 1072 H ARG 369 33.920 52.350 73.912 1.00 15.00 H ATOM 1073 HE ARG 369 33.140 54.034 78.374 1.00 15.00 H ATOM 1074 1HH1 ARG 369 35.705 51.628 78.005 1.00 0.00 H ATOM 1075 2HH1 ARG 369 36.857 52.481 78.849 1.00 0.00 H ATOM 1076 1HH2 ARG 369 34.649 55.284 79.369 1.00 0.00 H ATOM 1077 2HH2 ARG 369 36.244 54.730 79.716 1.00 0.00 H ATOM 1078 N VAL 370 32.823 56.502 73.660 1.00 18.94 N ATOM 1079 CA VAL 370 33.408 57.806 73.392 1.00 21.93 C ATOM 1080 C VAL 370 33.787 58.260 74.802 1.00 25.28 C ATOM 1081 O VAL 370 32.926 58.405 75.678 1.00 23.54 O ATOM 1082 CB VAL 370 32.382 58.787 72.766 1.00 22.48 C ATOM 1083 CG1 VAL 370 32.989 60.164 72.641 1.00 18.15 C ATOM 1084 CG2 VAL 370 31.927 58.285 71.397 1.00 15.61 C ATOM 1085 H VAL 370 31.852 56.432 73.739 1.00 15.00 H ATOM 1086 N VAL 371 35.085 58.381 75.042 1.00 29.66 N ATOM 1087 CA VAL 371 35.593 58.760 76.354 1.00 28.04 C ATOM 1088 C VAL 371 35.870 60.245 76.534 1.00 27.56 C ATOM 1089 O VAL 371 36.108 60.696 77.652 1.00 30.57 O ATOM 1090 CB VAL 371 36.859 57.954 76.709 1.00 22.40 C ATOM 1091 CG1 VAL 371 36.555 56.472 76.670 1.00 20.99 C ATOM 1092 CG2 VAL 371 37.986 58.285 75.752 1.00 23.33 C ATOM 1093 H VAL 371 35.709 58.196 74.310 1.00 15.00 H ATOM 1094 N LYS 372 35.827 61.003 75.443 1.00 25.92 N ATOM 1095 CA LYS 372 36.083 62.433 75.509 1.00 25.82 C ATOM 1096 C LYS 372 35.661 63.131 74.221 1.00 27.55 C ATOM 1097 O LYS 372 35.915 62.633 73.120 1.00 25.97 O ATOM 1098 CB LYS 372 37.568 62.674 75.782 1.00 29.23 C ATOM 1099 CG LYS 372 38.011 64.125 75.733 1.00 35.85 C ATOM 1100 CD LYS 372 39.519 64.208 75.936 1.00 46.15 C ATOM 1101 CE LYS 372 40.077 65.573 75.561 1.00 50.92 C ATOM 1102 NZ LYS 372 41.564 65.591 75.680 1.00 54.13 N ATOM 1103 H LYS 372 35.609 60.601 74.579 1.00 15.00 H ATOM 1104 1HZ LYS 372 42.011 64.849 75.094 1.00 15.00 H ATOM 1105 2HZ LYS 372 41.952 66.514 75.413 1.00 15.00 H ATOM 1106 3HZ LYS 372 41.830 65.388 76.662 1.00 15.00 H ATOM 1107 N VAL 373 34.993 64.269 74.367 1.00 25.46 N ATOM 1108 CA VAL 373 34.542 65.056 73.228 1.00 25.93 C ATOM 1109 C VAL 373 35.237 66.406 73.299 1.00 28.67 C ATOM 1110 O VAL 373 35.005 67.184 74.229 1.00 29.40 O ATOM 1111 CB VAL 373 33.011 65.263 73.250 1.00 24.05 C ATOM 1112 CG1 VAL 373 32.586 66.196 72.126 1.00 20.71 C ATOM 1113 CG2 VAL 373 32.301 63.923 73.125 1.00 22.06 C ATOM 1114 H VAL 373 34.787 64.601 75.269 1.00 15.00 H ATOM 1115 N GLY 374 36.115 66.659 72.335 1.00 27.67 N ATOM 1116 CA GLY 374 36.849 67.910 72.300 1.00 26.55 C ATOM 1117 C GLY 374 36.494 68.763 71.099 1.00 27.44 C ATOM 1118 O GLY 374 35.487 68.533 70.429 1.00 28.07 O ATOM 1119 H GLY 374 36.240 65.999 71.634 1.00 15.00 H ATOM 1120 N SER 375 37.358 69.717 70.792 1.00 27.06 N ATOM 1121 CA SER 375 37.136 70.616 69.678 1.00 30.67 C ATOM 1122 C SER 375 38.490 71.140 69.232 1.00 30.73 C ATOM 1123 O SER 375 39.468 71.047 69.978 1.00 32.57 O ATOM 1124 CB SER 375 36.246 71.777 70.137 1.00 34.00 C ATOM 1125 OG SER 375 35.825 72.583 69.048 1.00 46.47 O ATOM 1126 H SER 375 38.195 69.844 71.290 1.00 15.00 H ATOM 1127 HG SER 375 35.259 73.279 69.401 1.00 15.00 H ATOM 1128 N VAL 376 38.545 71.680 68.018 1.00 33.73 N ATOM 1129 CA VAL 376 39.773 72.243 67.463 1.00 33.52 C ATOM 1130 C VAL 376 39.459 72.995 66.177 1.00 33.13 C ATOM 1131 O VAL 376 38.475 72.690 65.507 1.00 34.43 O ATOM 1132 CB VAL 376 40.811 71.138 67.144 1.00 37.58 C ATOM 1133 CG1 VAL 376 40.316 70.246 66.002 1.00 35.87 C ATOM 1134 CG2 VAL 376 42.159 71.761 66.804 1.00 38.43 C ATOM 1135 H VAL 376 37.728 71.690 67.467 1.00 15.00 H ATOM 1136 N ARG 377 40.255 74.012 65.864 1.00 31.72 N ATOM 1137 CA ARG 377 40.064 74.766 64.631 1.00 34.58 C ATOM 1138 C ARG 377 41.345 74.607 63.835 1.00 36.01 C ATOM 1139 O ARG 377 42.430 74.922 64.330 1.00 39.64 O ATOM 1140 CB ARG 377 39.789 76.246 64.901 1.00 31.09 C ATOM 1141 CG ARG 377 39.476 77.032 63.633 1.00 38.05 C ATOM 1142 CD ARG 377 38.963 78.429 63.945 1.00 40.51 C ATOM 1143 NE ARG 377 38.592 79.180 62.745 1.00 40.74 N ATOM 1144 CZ ARG 377 37.498 78.955 62.020 1.00 43.48 C ATOM 1145 NH1 ARG 377 36.653 77.990 62.359 1.00 45.42 N ATOM 1146 NH2 ARG 377 37.227 79.722 60.972 1.00 46.27 N ATOM 1147 H ARG 377 41.007 74.254 66.436 1.00 15.00 H ATOM 1148 HE ARG 377 39.223 79.891 62.501 1.00 15.00 H ATOM 1149 1HH1 ARG 377 36.846 77.440 63.183 1.00 0.00 H ATOM 1150 2HH1 ARG 377 35.803 77.760 61.862 1.00 0.00 H ATOM 1151 1HH2 ARG 377 37.819 80.484 60.705 1.00 0.00 H ATOM 1152 2HH2 ARG 377 36.413 79.561 60.407 1.00 0.00 H ATOM 1153 N SER 378 41.226 74.088 62.620 1.00 35.57 N ATOM 1154 CA SER 378 42.389 73.867 61.774 1.00 33.68 C ATOM 1155 C SER 378 42.117 74.262 60.327 1.00 34.10 C ATOM 1156 O SER 378 41.004 74.678 59.993 1.00 36.78 O ATOM 1157 CB SER 378 42.814 72.402 61.874 1.00 33.06 C ATOM 1158 OG SER 378 41.688 71.540 61.829 1.00 37.00 O ATOM 1159 H SER 378 40.347 73.826 62.268 1.00 15.00 H ATOM 1160 HG SER 378 41.687 71.136 60.951 1.00 15.00 H ATOM 1161 N LYS 379 43.140 74.195 59.480 1.00 33.31 N ATOM 1162 CA LYS 379 42.961 74.551 58.077 1.00 33.09 C ATOM 1163 C LYS 379 42.823 73.331 57.184 1.00 30.96 C ATOM 1164 O LYS 379 43.580 72.355 57.296 1.00 29.10 O ATOM 1165 CB LYS 379 44.097 75.441 57.565 1.00 34.38 C ATOM 1166 CG LYS 379 45.488 74.859 57.749 1.00 41.94 C ATOM 1167 CD LYS 379 46.465 75.427 56.730 1.00 44.09 C ATOM 1168 CE LYS 379 46.132 74.910 55.348 1.00 48.84 C ATOM 1169 NZ LYS 379 47.096 75.317 54.301 1.00 52.91 N ATOM 1170 H LYS 379 44.020 73.887 59.794 1.00 15.00 H ATOM 1171 1HZ LYS 379 48.060 75.004 54.457 1.00 15.00 H ATOM 1172 2HZ LYS 379 46.756 74.892 53.406 1.00 15.00 H ATOM 1173 3HZ LYS 379 47.046 76.337 54.087 1.00 15.00 H ATOM 1174 N GLY 380 41.857 73.409 56.283 1.00 30.22 N ATOM 1175 CA GLY 380 41.610 72.330 55.357 1.00 27.22 C ATOM 1176 C GLY 380 40.383 71.518 55.704 1.00 28.24 C ATOM 1177 O GLY 380 40.154 71.168 56.867 1.00 25.18 O ATOM 1178 H GLY 380 41.295 74.199 56.261 1.00 15.00 H ATOM 1179 N VAL 381 39.595 71.226 54.677 1.00 26.27 N ATOM 1180 CA VAL 381 38.385 70.434 54.806 1.00 25.62 C ATOM 1181 C VAL 381 38.353 69.456 53.639 1.00 23.39 C ATOM 1182 O VAL 381 38.678 69.825 52.505 1.00 22.57 O ATOM 1183 CB VAL 381 37.100 71.315 54.755 1.00 25.50 C ATOM 1184 CG1 VAL 381 36.985 72.162 56.008 1.00 27.70 C ATOM 1185 CG2 VAL 381 37.102 72.202 53.516 1.00 25.84 C ATOM 1186 H VAL 381 39.831 71.545 53.781 1.00 15.00 H ATOM 1187 N VAL 382 38.042 68.196 53.930 1.00 21.11 N ATOM 1188 CA VAL 382 37.938 67.166 52.899 1.00 17.94 C ATOM 1189 C VAL 382 36.705 66.319 53.219 1.00 18.68 C ATOM 1190 O VAL 382 36.542 65.855 54.348 1.00 15.45 O ATOM 1191 CB VAL 382 39.186 66.240 52.847 1.00 15.49 C ATOM 1192 CG1 VAL 382 39.086 65.293 51.656 1.00 13.31 C ATOM 1193 CG2 VAL 382 40.463 67.054 52.756 1.00 18.19 C ATOM 1194 H VAL 382 37.901 67.934 54.865 1.00 15.00 H ATOM 1195 N ALA 383 35.823 66.159 52.238 1.00 18.20 N ATOM 1196 CA ALA 383 34.612 65.367 52.405 1.00 16.48 C ATOM 1197 C ALA 383 34.499 64.384 51.245 1.00 17.94 C ATOM 1198 O ALA 383 33.942 64.712 50.190 1.00 19.79 O ATOM 1199 CB ALA 383 33.391 66.283 52.450 1.00 17.95 C ATOM 1200 H ALA 383 35.997 66.582 51.373 1.00 15.00 H ATOM 1201 N PRO 384 35.102 63.191 51.384 1.00 17.42 N ATOM 1202 CA PRO 384 35.026 62.206 50.302 1.00 17.87 C ATOM 1203 C PRO 384 33.722 61.420 50.300 1.00 17.15 C ATOM 1204 O PRO 384 33.154 61.136 51.356 1.00 18.47 O ATOM 1205 CB PRO 384 36.237 61.311 50.568 1.00 18.14 C ATOM 1206 CG PRO 384 36.367 61.347 52.044 1.00 21.19 C ATOM 1207 CD PRO 384 36.056 62.771 52.425 1.00 17.42 C ATOM 1208 N LEU 385 33.219 61.135 49.104 1.00 16.35 N ATOM 1209 CA LEU 385 31.992 60.368 48.945 1.00 16.50 C ATOM 1210 C LEU 385 32.335 59.046 48.272 1.00 15.39 C ATOM 1211 O LEU 385 32.895 59.032 47.173 1.00 16.72 O ATOM 1212 CB LEU 385 30.983 61.137 48.088 1.00 15.54 C ATOM 1213 CG LEU 385 29.668 60.417 47.788 1.00 15.83 C ATOM 1214 CD1 LEU 385 28.893 60.190 49.076 1.00 15.01 C ATOM 1215 CD2 LEU 385 28.841 61.230 46.797 1.00 20.38 C ATOM 1216 H LEU 385 33.688 61.434 48.300 1.00 15.00 H ATOM 1217 N THR 386 32.011 57.941 48.934 1.00 15.81 N ATOM 1218 CA THR 386 32.277 56.604 48.398 1.00 15.23 C ATOM 1219 C THR 386 30.987 56.028 47.797 1.00 16.19 C ATOM 1220 O THR 386 29.905 56.588 48.008 1.00 14.54 O ATOM 1221 CB THR 386 32.747 55.663 49.524 1.00 16.32 C ATOM 1222 OG1 THR 386 31.702 55.530 50.499 1.00 15.38 O ATOM 1223 CG2 THR 386 33.994 56.216 50.203 1.00 12.69 C ATOM 1224 H THR 386 31.566 57.990 49.806 1.00 15.00 H ATOM 1225 HG1 THR 386 32.148 55.241 51.311 1.00 15.00 H ATOM 1226 N ARG 387 31.084 54.914 47.071 1.00 13.27 N ATOM 1227 CA ARG 387 29.888 54.288 46.500 1.00 17.43 C ATOM 1228 C ARG 387 28.943 53.822 47.596 1.00 17.43 C ATOM 1229 O ARG 387 27.726 53.871 47.435 1.00 18.76 O ATOM 1230 CB ARG 387 30.238 53.085 45.632 1.00 22.27 C ATOM 1231 CG ARG 387 30.761 53.437 44.272 1.00 29.73 C ATOM 1232 CD ARG 387 30.876 52.199 43.398 1.00 33.76 C ATOM 1233 NE ARG 387 31.438 52.571 42.113 1.00 40.36 N ATOM 1234 CZ ARG 387 30.720 52.872 41.037 1.00 47.04 C ATOM 1235 NH1 ARG 387 29.391 52.822 41.077 1.00 47.61 N ATOM 1236 NH2 ARG 387 31.333 53.348 39.958 1.00 49.99 N ATOM 1237 H ARG 387 31.974 54.533 46.905 1.00 15.00 H ATOM 1238 HE ARG 387 32.418 52.621 42.107 1.00 15.00 H ATOM 1239 1HH1 ARG 387 28.867 52.567 41.904 1.00 0.00 H ATOM 1240 2HH1 ARG 387 28.810 53.040 40.287 1.00 0.00 H ATOM 1241 1HH2 ARG 387 32.326 53.532 40.039 1.00 0.00 H ATOM 1242 2HH2 ARG 387 30.805 53.596 39.140 1.00 0.00 H ATOM 1243 N GLU 388 29.513 53.346 48.700 1.00 20.58 N ATOM 1244 CA GLU 388 28.732 52.872 49.838 1.00 19.91 C ATOM 1245 C GLU 388 28.019 54.007 50.555 1.00 18.28 C ATOM 1246 O GLU 388 26.947 53.806 51.127 1.00 21.31 O ATOM 1247 CB GLU 388 29.628 52.122 50.827 1.00 23.45 C ATOM 1248 CG GLU 388 29.855 50.663 50.470 1.00 30.77 C ATOM 1249 CD GLU 388 28.567 49.855 50.450 1.00 36.54 C ATOM 1250 OE1 GLU 388 27.805 49.902 51.440 1.00 43.37 O ATOM 1251 OE2 GLU 388 28.315 49.162 49.446 1.00 41.56 O ATOM 1252 H GLU 388 30.492 53.291 48.738 1.00 15.00 H ATOM 1253 N GLY 389 28.627 55.190 50.538 1.00 16.30 N ATOM 1254 CA GLY 389 28.033 56.344 51.188 1.00 15.88 C ATOM 1255 C GLY 389 28.564 56.546 52.593 1.00 15.48 C ATOM 1256 O GLY 389 28.191 57.497 53.281 1.00 15.71 O ATOM 1257 H GLY 389 29.492 55.294 50.087 1.00 15.00 H ATOM 1258 N THR 390 29.441 55.649 53.023 1.00 13.18 N ATOM 1259 CA THR 390 30.041 55.724 54.349 1.00 12.70 C ATOM 1260 C THR 390 31.555 55.633 54.195 1.00 14.70 C ATOM 1261 O THR 390 32.059 55.247 53.132 1.00 14.45 O ATOM 1262 CB THR 390 29.587 54.553 55.231 1.00 10.18 C ATOM 1263 OG1 THR 390 29.849 53.327 54.543 1.00 13.87 O ATOM 1264 CG2 THR 390 28.096 54.644 55.540 1.00 10.39 C ATOM 1265 H THR 390 29.744 54.917 52.450 1.00 15.00 H ATOM 1266 HG1 THR 390 29.008 52.854 54.447 1.00 15.00 H ATOM 1267 N ILE 391 32.280 55.955 55.259 1.00 11.27 N ATOM 1268 CA ILE 391 33.730 55.896 55.215 1.00 12.82 C ATOM 1269 C ILE 391 34.273 55.814 56.638 1.00 13.99 C ATOM 1270 O ILE 391 33.717 56.415 57.562 1.00 11.91 O ATOM 1271 CB ILE 391 34.308 57.133 54.478 1.00 13.94 C ATOM 1272 CG1 ILE 391 35.814 56.964 54.238 1.00 10.95 C ATOM 1273 CG2 ILE 391 33.974 58.421 55.250 1.00 13.52 C ATOM 1274 CD1 ILE 391 36.437 58.094 53.452 1.00 11.92 C ATOM 1275 H ILE 391 31.857 56.251 56.094 1.00 15.00 H ATOM 1276 N VAL 392 35.315 55.009 56.817 1.00 12.17 N ATOM 1277 CA VAL 392 35.951 54.841 58.116 1.00 11.27 C ATOM 1278 C VAL 392 37.194 55.732 58.129 1.00 13.16 C ATOM 1279 O VAL 392 38.156 55.500 57.391 1.00 12.85 O ATOM 1280 CB VAL 392 36.324 53.370 58.359 1.00 9.95 C ATOM 1281 CG1 VAL 392 36.916 53.199 59.726 1.00 10.01 C ATOM 1282 CG2 VAL 392 35.098 52.495 58.234 1.00 13.23 C ATOM 1283 H VAL 392 35.672 54.518 56.047 1.00 15.00 H ATOM 1284 N VAL 393 37.141 56.787 58.931 1.00 14.52 N ATOM 1285 CA VAL 393 38.238 57.742 59.030 1.00 15.57 C ATOM 1286 C VAL 393 38.876 57.631 60.414 1.00 17.62 C ATOM 1287 O VAL 393 38.190 57.675 61.438 1.00 15.35 O ATOM 1288 CB VAL 393 37.735 59.176 58.737 1.00 9.20 C ATOM 1289 CG1 VAL 393 38.857 60.183 58.881 1.00 11.16 C ATOM 1290 CG2 VAL 393 37.163 59.235 57.316 1.00 8.19 C ATOM 1291 H VAL 393 36.353 56.926 59.505 1.00 15.00 H ATOM 1292 N ASN 394 40.188 57.417 60.427 1.00 17.25 N ATOM 1293 CA ASN 394 40.932 57.248 61.665 1.00 17.90 C ATOM 1294 C ASN 394 40.346 56.086 62.441 1.00 15.32 C ATOM 1295 O ASN 394 40.199 56.157 63.661 1.00 22.64 O ATOM 1296 CB ASN 394 40.904 58.522 62.514 1.00 19.90 C ATOM 1297 CG ASN 394 41.960 59.511 62.101 1.00 20.39 C ATOM 1298 OD1 ASN 394 41.829 60.186 61.084 1.00 22.71 O ATOM 1299 ND2 ASN 394 43.025 59.597 62.882 1.00 24.05 N ATOM 1300 H ASN 394 40.660 57.370 59.570 1.00 15.00 H ATOM 1301 1HD2 ASN 394 43.728 60.230 62.651 1.00 0.00 H ATOM 1302 2HD2 ASN 394 43.064 59.027 63.684 1.00 0.00 H ATOM 1303 N SER 395 39.991 55.032 61.710 1.00 13.85 N ATOM 1304 CA SER 395 39.415 53.809 62.264 1.00 14.13 C ATOM 1305 C SER 395 37.987 53.939 62.785 1.00 13.08 C ATOM 1306 O SER 395 37.403 52.947 63.211 1.00 14.43 O ATOM 1307 CB SER 395 40.309 53.228 63.364 1.00 16.95 C ATOM 1308 OG SER 395 41.574 52.851 62.852 1.00 22.47 O ATOM 1309 H SER 395 40.127 55.070 60.741 1.00 15.00 H ATOM 1310 HG SER 395 41.866 52.093 63.391 1.00 15.00 H ATOM 1311 N VAL 396 37.412 55.136 62.711 1.00 16.38 N ATOM 1312 CA VAL 396 36.049 55.361 63.192 1.00 13.89 C ATOM 1313 C VAL 396 35.077 55.471 62.027 1.00 14.96 C ATOM 1314 O VAL 396 35.303 56.251 61.093 1.00 15.90 O ATOM 1315 CB VAL 396 35.955 56.645 64.040 1.00 16.51 C ATOM 1316 CG1 VAL 396 34.553 56.778 64.645 1.00 16.89 C ATOM 1317 CG2 VAL 396 37.021 56.631 65.131 1.00 15.93 C ATOM 1318 H VAL 396 37.872 55.909 62.324 1.00 15.00 H ATOM 1319 N ALA 397 33.998 54.693 62.091 1.00 15.43 N ATOM 1320 CA ALA 397 32.982 54.680 61.043 1.00 14.51 C ATOM 1321 C ALA 397 32.145 55.955 61.036 1.00 17.75 C ATOM 1322 O ALA 397 31.741 56.464 62.088 1.00 16.67 O ATOM 1323 CB ALA 397 32.089 53.462 61.194 1.00 13.58 C ATOM 1324 H ALA 397 33.884 54.128 62.883 1.00 15.00 H ATOM 1325 N ALA 398 31.868 56.456 59.839 1.00 16.97 N ATOM 1326 CA ALA 398 31.079 57.667 59.681 1.00 16.27 C ATOM 1327 C ALA 398 30.353 57.654 58.349 1.00 16.22 C ATOM 1328 O ALA 398 30.642 56.834 57.478 1.00 15.87 O ATOM 1329 CB ALA 398 31.990 58.889 59.756 1.00 16.76 C ATOM 1330 H ALA 398 32.206 56.042 59.017 1.00 15.00 H ATOM 1331 N SER 399 29.369 58.530 58.216 1.00 15.62 N ATOM 1332 CA SER 399 28.640 58.659 56.967 1.00 14.99 C ATOM 1333 C SER 399 29.517 59.598 56.146 1.00 16.70 C ATOM 1334 O SER 399 30.458 60.202 56.677 1.00 12.54 O ATOM 1335 CB SER 399 27.286 59.330 57.217 1.00 16.74 C ATOM 1336 OG SER 399 26.655 59.703 56.004 1.00 14.34 O ATOM 1337 H SER 399 29.152 59.137 58.952 1.00 15.00 H ATOM 1338 HG SER 399 26.282 58.876 55.648 1.00 15.00 H ATOM 1339 N CYS 400 29.255 59.678 54.847 1.00 18.31 N ATOM 1340 CA CYS 400 29.995 60.594 53.986 1.00 17.33 C ATOM 1341 C CYS 400 29.312 61.960 54.034 1.00 18.57 C ATOM 1342 O CYS 400 29.932 62.983 53.741 1.00 15.97 O ATOM 1343 CB CYS 400 30.002 60.094 52.545 1.00 14.86 C ATOM 1344 SG CYS 400 31.085 58.705 52.259 1.00 14.85 S ATOM 1345 H CYS 400 28.555 59.101 54.464 1.00 15.00 H ATOM 1346 N TYR 401 28.038 61.966 54.424 1.00 19.24 N ATOM 1347 CA TYR 401 27.241 63.189 54.491 1.00 26.13 C ATOM 1348 C TYR 401 27.600 64.121 55.644 1.00 25.89 C ATOM 1349 O TYR 401 27.846 63.682 56.767 1.00 23.80 O ATOM 1350 CB TYR 401 25.746 62.844 54.553 1.00 30.90 C ATOM 1351 CG TYR 401 24.846 64.048 54.763 1.00 43.11 C ATOM 1352 CD1 TYR 401 24.627 64.972 53.735 1.00 47.12 C ATOM 1353 CD2 TYR 401 24.226 64.277 55.998 1.00 45.49 C ATOM 1354 CE1 TYR 401 23.813 66.095 53.932 1.00 48.98 C ATOM 1355 CE2 TYR 401 23.412 65.396 56.205 1.00 48.52 C ATOM 1356 CZ TYR 401 23.211 66.298 55.169 1.00 49.88 C ATOM 1357 OH TYR 401 22.401 67.394 55.360 1.00 52.84 O ATOM 1358 H TYR 401 27.608 61.134 54.718 1.00 15.00 H ATOM 1359 HH TYR 401 22.517 67.989 54.615 1.00 15.00 H ATOM 1360 N ALA 402 27.600 65.415 55.357 1.00 27.75 N ATOM 1361 CA ALA 402 27.902 66.429 56.353 1.00 34.25 C ATOM 1362 C ALA 402 26.992 67.634 56.122 1.00 39.23 C ATOM 1363 O ALA 402 26.264 67.643 55.108 1.00 38.86 O ATOM 1364 CB ALA 402 29.371 66.845 56.258 1.00 34.17 C ATOM 1365 OXT ALA 402 27.035 68.572 56.943 1.00 47.09 O ATOM 1366 H ALA 402 27.338 65.763 54.479 1.00 0.00 H TER 1367 ALA 402 HETATM 1368 O HOH 501 25.534 55.077 72.105 1.00 24.77 O HETATM 1369 1H HOH 501 25.223 54.365 71.529 1.00 0.00 H HETATM 1370 2H HOH 501 24.766 55.696 72.073 1.00 0.00 H HETATM 1371 O HOH 502 26.113 51.943 54.678 1.00 31.07 O HETATM 1372 1H HOH 502 26.976 51.516 54.639 1.00 0.00 H HETATM 1373 2H HOH 502 25.744 51.692 53.796 1.00 0.00 H HETATM 1374 O HOH 503 26.226 53.173 45.228 1.00 20.77 O HETATM 1375 1H HOH 503 25.564 52.645 45.735 1.00 0.00 H HETATM 1376 2H HOH 503 26.667 53.591 45.973 1.00 0.00 H HETATM 1377 O HOH 504 30.913 55.159 64.287 1.00 17.24 O HETATM 1378 1H HOH 504 30.388 55.853 64.705 1.00 0.00 H HETATM 1379 2H HOH 504 31.546 55.675 63.774 1.00 0.00 H HETATM 1380 O HOH 505 32.694 62.808 53.593 1.00 21.08 O HETATM 1381 1H HOH 505 31.809 62.982 53.253 1.00 0.00 H HETATM 1382 2H HOH 505 32.970 62.052 53.058 1.00 0.00 H HETATM 1383 O HOH 506 35.338 44.685 50.375 1.00 23.77 O HETATM 1384 1H HOH 506 34.803 44.035 49.909 1.00 0.00 H HETATM 1385 2H HOH 506 36.207 44.609 49.951 1.00 0.00 H HETATM 1386 O HOH 507 35.798 65.435 43.194 1.00 21.00 O HETATM 1387 1H HOH 507 35.802 66.369 43.452 1.00 0.00 H HETATM 1388 2H HOH 507 36.756 65.311 43.246 1.00 0.00 H HETATM 1389 O HOH 508 37.389 48.029 67.732 1.00 20.48 O HETATM 1390 1H HOH 508 36.933 48.057 66.879 1.00 0.00 H HETATM 1391 2H HOH 508 36.666 47.848 68.357 1.00 0.00 H HETATM 1392 O HOH 509 38.726 54.340 54.915 1.00 14.86 O HETATM 1393 1H HOH 509 37.832 54.101 54.631 1.00 0.00 H HETATM 1394 2H HOH 509 38.537 54.852 55.708 1.00 0.00 H HETATM 1395 O HOH 510 38.896 51.654 41.636 1.00 29.39 O HETATM 1396 1H HOH 510 38.123 52.077 41.224 1.00 0.00 H HETATM 1397 2H HOH 510 38.995 52.231 42.404 1.00 0.00 H HETATM 1398 O HOH 511 40.049 62.456 61.860 1.00 19.60 O HETATM 1399 1H HOH 511 40.586 61.719 61.538 1.00 0.00 H HETATM 1400 2H HOH 511 40.566 63.206 61.535 1.00 0.00 H HETATM 1401 O HOH 512 40.318 54.572 58.890 1.00 15.94 O HETATM 1402 1H HOH 512 41.263 54.859 58.851 1.00 0.00 H HETATM 1403 2H HOH 512 39.946 54.978 58.093 1.00 0.00 H HETATM 1404 O HOH 513 42.028 50.273 63.961 1.00 29.23 O HETATM 1405 1H HOH 513 42.547 49.819 63.263 1.00 0.00 H HETATM 1406 2H HOH 513 41.465 49.571 64.285 1.00 0.00 H HETATM 1407 O HOH 514 42.957 44.093 67.747 1.00 20.35 O HETATM 1408 1H HOH 514 42.888 43.498 68.518 1.00 0.00 H HETATM 1409 2H HOH 514 42.092 44.503 67.782 1.00 0.00 H HETATM 1410 O HOH 515 42.591 56.151 42.372 1.00 29.38 O HETATM 1411 1H HOH 515 42.705 56.881 42.990 1.00 0.00 H HETATM 1412 2H HOH 515 42.800 55.440 43.000 1.00 0.00 H HETATM 1413 O HOH 516 42.404 64.628 48.393 1.00 19.50 O HETATM 1414 1H HOH 516 42.409 63.897 47.759 1.00 0.00 H HETATM 1415 2H HOH 516 42.000 64.203 49.163 1.00 0.00 H HETATM 1416 O HOH 517 42.866 55.270 59.331 1.00 15.29 O HETATM 1417 1H HOH 517 43.163 56.185 59.244 1.00 0.00 H HETATM 1418 2H HOH 517 43.309 54.992 60.160 1.00 0.00 H HETATM 1419 O HOH 518 43.689 54.498 61.902 1.00 29.55 O HETATM 1420 1H HOH 518 44.305 53.812 62.185 1.00 0.00 H HETATM 1421 2H HOH 518 42.849 54.044 62.087 1.00 0.00 H HETATM 1422 O HOH 519 48.024 61.372 45.877 1.00 28.27 O HETATM 1423 1H HOH 519 47.114 61.382 46.226 1.00 0.00 H HETATM 1424 2H HOH 519 48.430 62.086 46.436 1.00 0.00 H HETATM 1425 O HOH 520 19.859 57.040 61.927 1.00 24.87 O HETATM 1426 1H HOH 520 19.771 57.928 62.300 1.00 0.00 H HETATM 1427 2H HOH 520 19.169 57.040 61.253 1.00 0.00 H HETATM 1428 O HOH 521 25.305 48.814 52.660 1.00 39.22 O HETATM 1429 1H HOH 521 26.025 49.075 52.062 1.00 0.00 H HETATM 1430 2H HOH 521 24.533 49.234 52.232 1.00 0.00 H HETATM 1431 O HOH 522 27.246 57.366 47.515 1.00 28.84 O HETATM 1432 1H HOH 522 28.152 57.310 47.837 1.00 0.00 H HETATM 1433 2H HOH 522 26.782 56.730 48.110 1.00 0.00 H HETATM 1434 O HOH 523 28.261 53.127 76.531 1.00 24.92 O HETATM 1435 1H HOH 523 28.353 53.525 77.409 1.00 0.00 H HETATM 1436 2H HOH 523 28.705 53.795 75.996 1.00 0.00 H HETATM 1437 O HOH 524 29.335 47.475 73.036 1.00 39.79 O HETATM 1438 1H HOH 524 30.230 47.564 73.389 1.00 0.00 H HETATM 1439 2H HOH 524 29.184 48.396 72.754 1.00 0.00 H HETATM 1440 O HOH 525 29.587 69.815 57.972 1.00 29.87 O HETATM 1441 1H HOH 525 29.373 70.323 57.156 1.00 0.00 H HETATM 1442 2H HOH 525 28.744 69.306 57.966 1.00 0.00 H HETATM 1443 O HOH 526 32.791 69.447 70.567 1.00 29.85 O HETATM 1444 1H HOH 526 33.604 68.940 70.661 1.00 0.00 H HETATM 1445 2H HOH 526 32.106 68.767 70.583 1.00 0.00 H HETATM 1446 O HOH 527 38.612 46.126 57.852 1.00 27.96 O HETATM 1447 1H HOH 527 38.159 45.552 57.192 1.00 0.00 H HETATM 1448 2H HOH 527 37.954 46.086 58.559 1.00 0.00 H HETATM 1449 O HOH 528 39.950 66.898 71.840 1.00 25.90 O HETATM 1450 1H HOH 528 40.271 67.151 70.949 1.00 0.00 H HETATM 1451 2H HOH 528 39.937 67.784 72.223 1.00 0.00 H HETATM 1452 O HOH 529 40.526 70.557 45.430 1.00 30.22 O HETATM 1453 1H HOH 529 39.997 69.907 44.918 1.00 0.00 H HETATM 1454 2H HOH 529 39.812 70.964 45.951 1.00 0.00 H HETATM 1455 O HOH 530 42.146 47.707 67.578 1.00 25.21 O HETATM 1456 1H HOH 530 41.569 48.221 67.006 1.00 0.00 H HETATM 1457 2H HOH 530 41.488 47.388 68.231 1.00 0.00 H HETATM 1458 O HOH 531 42.725 51.860 46.246 1.00 23.20 O HETATM 1459 1H HOH 531 42.655 51.304 45.461 1.00 0.00 H HETATM 1460 2H HOH 531 43.249 52.591 45.847 1.00 0.00 H HETATM 1461 O HOH 532 42.540 72.578 47.833 1.00 32.53 O HETATM 1462 1H HOH 532 42.520 73.502 47.558 1.00 0.00 H HETATM 1463 2H HOH 532 41.978 72.154 47.167 1.00 0.00 H HETATM 1464 O HOH 533 43.301 47.386 54.432 1.00 36.95 O HETATM 1465 1H HOH 533 42.504 46.832 54.409 1.00 0.00 H HETATM 1466 2H HOH 533 43.198 47.941 53.648 1.00 0.00 H HETATM 1467 O HOH 534 45.982 56.586 44.309 1.00 37.79 O HETATM 1468 1H HOH 534 45.103 56.375 44.679 1.00 0.00 H HETATM 1469 2H HOH 534 46.240 55.716 43.946 1.00 0.00 H HETATM 1470 O HOH 535 48.068 62.419 58.371 1.00 48.31 O HETATM 1471 1H HOH 535 47.178 62.091 58.196 1.00 0.00 H HETATM 1472 2H HOH 535 47.894 63.087 59.035 1.00 0.00 H HETATM 1473 O HOH 537 23.668 46.179 55.078 1.00 50.41 O HETATM 1474 1H HOH 537 22.724 45.979 55.080 1.00 0.00 H HETATM 1475 2H HOH 537 23.768 46.628 54.226 1.00 0.00 H HETATM 1476 O HOH 538 23.566 69.436 64.349 1.00 32.22 O HETATM 1477 1H HOH 538 24.159 69.080 63.669 1.00 0.00 H HETATM 1478 2H HOH 538 24.235 69.493 65.077 1.00 0.00 H HETATM 1479 O HOH 539 24.475 53.882 61.305 1.00 40.35 O HETATM 1480 1H HOH 539 25.145 54.570 61.284 1.00 0.00 H HETATM 1481 2H HOH 539 24.533 53.460 60.435 1.00 0.00 H HETATM 1482 O HOH 540 25.358 51.583 49.358 1.00 28.26 O HETATM 1483 1H HOH 540 25.190 52.463 49.719 1.00 0.00 H HETATM 1484 2H HOH 540 24.674 51.088 49.845 1.00 0.00 H HETATM 1485 O HOH 541 25.535 55.627 48.519 1.00 30.66 O HETATM 1486 1H HOH 541 25.446 54.666 48.487 1.00 0.00 H HETATM 1487 2H HOH 541 25.009 55.926 47.763 1.00 0.00 H HETATM 1488 O HOH 542 25.241 57.165 45.954 1.00 23.61 O HETATM 1489 1H HOH 542 25.983 57.451 46.545 1.00 0.00 H HETATM 1490 2H HOH 542 25.709 56.494 45.446 1.00 0.00 H HETATM 1491 O HOH 543 27.204 46.102 71.846 1.00 36.37 O HETATM 1492 1H HOH 543 27.877 46.647 72.319 1.00 0.00 H HETATM 1493 2H HOH 543 26.629 45.866 72.596 1.00 0.00 H HETATM 1494 O HOH 544 29.787 64.656 76.573 1.00 41.24 O HETATM 1495 1H HOH 544 29.062 64.335 77.151 1.00 0.00 H HETATM 1496 2H HOH 544 30.525 64.699 77.189 1.00 0.00 H HETATM 1497 O HOH 545 29.785 66.268 70.176 1.00 34.67 O HETATM 1498 1H HOH 545 29.181 66.142 70.914 1.00 0.00 H HETATM 1499 2H HOH 545 29.577 65.530 69.598 1.00 0.00 H HETATM 1500 O HOH 546 30.582 69.313 51.603 1.00 43.64 O HETATM 1501 1H HOH 546 30.986 69.532 50.748 1.00 0.00 H HETATM 1502 2H HOH 546 30.864 70.128 52.044 1.00 0.00 H HETATM 1503 O HOH 547 30.713 74.720 60.475 1.00 53.51 O HETATM 1504 1H HOH 547 30.188 74.941 61.253 1.00 0.00 H HETATM 1505 2H HOH 547 30.567 75.460 59.878 1.00 0.00 H HETATM 1506 O HOH 548 32.840 56.242 78.666 1.00 66.15 O HETATM 1507 1H HOH 548 32.451 56.619 77.870 1.00 0.00 H HETATM 1508 2H HOH 548 32.936 57.073 79.188 1.00 0.00 H HETATM 1509 O HOH 549 33.068 44.641 60.416 1.00 22.49 O HETATM 1510 1H HOH 549 32.453 44.182 60.998 1.00 0.00 H HETATM 1511 2H HOH 549 33.581 43.892 60.039 1.00 0.00 H HETATM 1512 O HOH 550 33.659 50.284 45.087 1.00 28.82 O HETATM 1513 1H HOH 550 32.770 50.009 45.416 1.00 0.00 H HETATM 1514 2H HOH 550 33.442 50.725 44.259 1.00 0.00 H HETATM 1515 O HOH 551 37.509 55.730 80.638 1.00 73.11 O HETATM 1516 1H HOH 551 37.690 55.127 81.384 1.00 0.00 H HETATM 1517 2H HOH 551 38.376 55.756 80.200 1.00 0.00 H HETATM 1518 O HOH 552 38.070 38.766 60.641 1.00 37.79 O HETATM 1519 1H HOH 552 37.311 39.119 61.121 1.00 0.00 H HETATM 1520 2H HOH 552 38.534 39.555 60.348 1.00 0.00 H HETATM 1521 O HOH 553 39.652 47.322 68.751 1.00 33.63 O HETATM 1522 1H HOH 553 38.836 47.579 68.264 1.00 0.00 H HETATM 1523 2H HOH 553 39.683 46.364 68.567 1.00 0.00 H HETATM 1524 O HOH 554 39.781 41.120 68.671 1.00 46.72 O HETATM 1525 1H HOH 554 40.707 40.892 68.821 1.00 0.00 H HETATM 1526 2H HOH 554 39.901 41.913 68.111 1.00 0.00 H HETATM 1527 O HOH 555 40.939 51.856 59.752 1.00 26.14 O HETATM 1528 1H HOH 555 40.886 52.772 59.412 1.00 0.00 H HETATM 1529 2H HOH 555 40.018 51.694 59.966 1.00 0.00 H HETATM 1530 O HOH 556 41.615 43.518 51.786 1.00 36.28 O HETATM 1531 1H HOH 556 41.690 42.674 51.329 1.00 0.00 H HETATM 1532 2H HOH 556 41.137 44.056 51.140 1.00 0.00 H HETATM 1533 O HOH 557 43.062 42.001 69.717 1.00 46.29 O HETATM 1534 1H HOH 557 43.068 41.284 69.060 1.00 0.00 H HETATM 1535 2H HOH 557 43.799 41.723 70.278 1.00 0.00 H HETATM 1536 O HOH 558 42.609 57.345 65.110 1.00 29.47 O HETATM 1537 1H HOH 558 41.707 57.118 64.822 1.00 0.00 H HETATM 1538 2H HOH 558 43.077 56.520 64.924 1.00 0.00 H HETATM 1539 O HOH 559 47.064 65.571 53.816 1.00 63.80 O HETATM 1540 1H HOH 559 46.637 65.121 54.555 1.00 0.00 H HETATM 1541 2H HOH 559 48.004 65.457 53.999 1.00 0.00 H HETATM 1542 O HOH 560 47.657 66.676 48.263 1.00 26.59 O HETATM 1543 1H HOH 560 48.379 66.574 48.896 1.00 0.00 H HETATM 1544 2H HOH 560 46.922 66.269 48.740 1.00 0.00 H HETATM 1545 O HOH 561 19.890 59.520 65.525 1.00 31.02 O HETATM 1546 1H HOH 561 19.175 60.067 65.184 1.00 0.00 H HETATM 1547 2H HOH 561 20.600 59.714 64.895 1.00 0.00 H HETATM 1548 O HOH 562 20.193 63.684 63.067 1.00 37.68 O HETATM 1549 1H HOH 562 19.558 62.971 62.892 1.00 0.00 H HETATM 1550 2H HOH 562 20.714 63.653 62.260 1.00 0.00 H HETATM 1551 O HOH 563 23.497 52.237 58.962 1.00 38.32 O HETATM 1552 1H HOH 563 23.884 52.570 58.121 1.00 0.00 H HETATM 1553 2H HOH 563 23.625 51.280 58.848 1.00 0.00 H HETATM 1554 O HOH 564 25.165 71.504 63.424 1.00 49.11 O HETATM 1555 1H HOH 564 24.421 71.055 63.842 1.00 0.00 H HETATM 1556 2H HOH 564 25.844 71.366 64.100 1.00 0.00 H HETATM 1557 O HOH 565 25.755 53.788 74.819 1.00 23.27 O HETATM 1558 1H HOH 565 25.938 54.032 73.895 1.00 0.00 H HETATM 1559 2H HOH 565 26.619 53.846 75.251 1.00 0.00 H HETATM 1560 O HOH 566 32.884 58.966 79.603 1.00 51.02 O HETATM 1561 1H HOH 566 33.707 59.487 79.598 1.00 0.00 H HETATM 1562 2H HOH 566 32.318 59.760 79.597 1.00 0.00 H HETATM 1563 O HOH 567 32.660 61.365 39.710 1.00 72.74 O HETATM 1564 1H HOH 567 32.907 61.066 40.596 1.00 0.00 H HETATM 1565 2H HOH 567 33.516 61.661 39.386 1.00 0.00 H HETATM 1566 O HOH 568 36.468 49.982 42.328 1.00 33.18 O HETATM 1567 1H HOH 568 37.384 50.189 42.093 1.00 0.00 H HETATM 1568 2H HOH 568 36.099 50.874 42.288 1.00 0.00 H HETATM 1569 O HOH 569 40.988 51.185 68.791 1.00 35.37 O HETATM 1570 1H HOH 569 41.543 50.414 68.934 1.00 0.00 H HETATM 1571 2H HOH 569 40.915 51.241 67.835 1.00 0.00 H HETATM 1572 O HOH 570 41.774 62.854 64.382 1.00 25.85 O HETATM 1573 1H HOH 570 41.339 61.999 64.254 1.00 0.00 H HETATM 1574 2H HOH 570 42.594 62.583 64.806 1.00 0.00 H HETATM 1575 O HOH 571 43.568 51.121 60.092 1.00 46.29 O HETATM 1576 1H HOH 571 42.638 51.437 60.012 1.00 0.00 H HETATM 1577 2H HOH 571 43.964 51.488 59.297 1.00 0.00 H HETATM 1578 O HOH 572 44.198 59.267 65.883 1.00 40.30 O HETATM 1579 1H HOH 572 44.730 58.929 66.606 1.00 0.00 H HETATM 1580 2H HOH 572 43.583 58.530 65.697 1.00 0.00 H HETATM 1581 O HOH 573 45.277 51.293 64.092 1.00 56.12 O HETATM 1582 1H HOH 573 45.360 51.401 65.060 1.00 0.00 H HETATM 1583 2H HOH 573 44.361 50.982 64.045 1.00 0.00 H HETATM 1584 O HOH 574 46.264 71.411 56.298 1.00 33.76 O HETATM 1585 1H HOH 574 45.390 71.468 56.703 1.00 0.00 H HETATM 1586 2H HOH 574 46.548 70.547 56.646 1.00 0.00 H HETATM 1587 O HOH 575 48.012 50.188 57.636 1.00 43.24 O HETATM 1588 1H HOH 575 47.217 50.314 58.204 1.00 0.00 H HETATM 1589 2H HOH 575 47.603 50.152 56.756 1.00 0.00 H HETATM 1590 O HOH 576 20.281 57.842 67.549 1.00 49.51 O HETATM 1591 1H HOH 576 20.057 58.456 66.812 1.00 0.00 H HETATM 1592 2H HOH 576 21.047 58.282 67.929 1.00 0.00 H HETATM 1593 O HOH 577 23.420 56.748 71.970 1.00 52.21 O HETATM 1594 1H HOH 577 22.744 56.384 71.370 1.00 0.00 H HETATM 1595 2H HOH 577 23.002 57.562 72.271 1.00 0.00 H HETATM 1596 O HOH 578 24.084 56.061 75.143 1.00 58.63 O HETATM 1597 1H HOH 578 24.593 55.225 75.107 1.00 0.00 H HETATM 1598 2H HOH 578 23.241 55.756 74.788 1.00 0.00 H HETATM 1599 O HOH 579 25.118 58.275 77.200 1.00 49.50 O HETATM 1600 1H HOH 579 24.652 57.788 76.504 1.00 0.00 H HETATM 1601 2H HOH 579 25.201 59.167 76.841 1.00 0.00 H HETATM 1602 O HOH 580 30.732 48.100 48.299 1.00 49.13 O HETATM 1603 1H HOH 580 31.020 47.831 49.175 1.00 0.00 H HETATM 1604 2H HOH 580 29.856 48.460 48.523 1.00 0.00 H HETATM 1605 O HOH 581 31.354 49.432 46.072 1.00 39.24 O HETATM 1606 1H HOH 581 30.906 48.750 45.540 1.00 0.00 H HETATM 1607 2H HOH 581 31.169 49.030 46.959 1.00 0.00 H HETATM 1608 O HOH 582 32.008 74.882 65.713 1.00 44.85 O HETATM 1609 1H HOH 582 32.448 74.251 66.314 1.00 0.00 H HETATM 1610 2H HOH 582 31.082 74.693 65.896 1.00 0.00 H HETATM 1611 O HOH 583 34.549 42.356 59.438 1.00 31.95 O HETATM 1612 1H HOH 583 34.664 41.554 59.965 1.00 0.00 H HETATM 1613 2H HOH 583 35.313 42.339 58.852 1.00 0.00 H HETATM 1614 O HOH 584 36.044 43.645 53.685 1.00 49.91 O HETATM 1615 1H HOH 584 35.123 43.475 53.920 1.00 0.00 H HETATM 1616 2H HOH 584 35.992 43.815 52.736 1.00 0.00 H HETATM 1617 O HOH 585 35.828 54.079 82.266 1.00 30.30 O HETATM 1618 1H HOH 585 35.393 54.939 82.238 1.00 0.00 H HETATM 1619 2H HOH 585 35.099 53.464 82.071 1.00 0.00 H HETATM 1620 O HOH 586 37.625 44.230 56.042 1.00 70.82 O HETATM 1621 1H HOH 586 37.159 44.031 55.205 1.00 0.00 H HETATM 1622 2H HOH 586 38.057 43.386 56.235 1.00 0.00 H HETATM 1623 O HOH 587 37.001 43.443 70.335 1.00 38.34 O HETATM 1624 1H HOH 587 37.215 44.281 70.790 1.00 0.00 H HETATM 1625 2H HOH 587 37.115 42.818 71.066 1.00 0.00 H HETATM 1626 O HOH 588 43.219 63.691 74.964 1.00 55.87 O HETATM 1627 1H HOH 588 43.342 62.775 75.268 1.00 0.00 H HETATM 1628 2H HOH 588 44.090 63.837 74.553 1.00 0.00 H HETATM 1629 O HOH 589 39.324 48.776 73.263 1.00 32.48 O HETATM 1630 1H HOH 589 39.008 49.381 73.963 1.00 0.00 H HETATM 1631 2H HOH 589 40.022 49.315 72.883 1.00 0.00 H HETATM 1632 O HOH 590 39.630 56.101 38.748 1.00 49.52 O HETATM 1633 1H HOH 590 40.236 56.851 38.918 1.00 0.00 H HETATM 1634 2H HOH 590 40.053 55.382 39.214 1.00 0.00 H HETATM 1635 O HOH 591 40.909 45.168 57.101 1.00 46.03 O HETATM 1636 1H HOH 591 39.989 45.505 57.128 1.00 0.00 H HETATM 1637 2H HOH 591 40.895 44.579 56.333 1.00 0.00 H HETATM 1638 O HOH 593 41.471 57.926 39.496 1.00 46.56 O HETATM 1639 1H HOH 593 41.353 58.887 39.507 1.00 0.00 H HETATM 1640 2H HOH 593 41.449 57.719 40.443 1.00 0.00 H HETATM 1641 O HOH 594 43.547 49.259 62.075 1.00 47.10 O HETATM 1642 1H HOH 594 43.613 50.037 61.462 1.00 0.00 H HETATM 1643 2H HOH 594 44.459 48.907 62.000 1.00 0.00 H HETATM 1644 O HOH 595 43.928 50.096 47.814 1.00 29.87 O HETATM 1645 1H HOH 595 43.324 50.687 47.315 1.00 0.00 H HETATM 1646 2H HOH 595 44.731 50.633 47.795 1.00 0.00 H HETATM 1647 O HOH 597 44.346 71.004 46.123 1.00 59.86 O HETATM 1648 1H HOH 597 45.318 71.072 46.149 1.00 0.00 H HETATM 1649 2H HOH 597 44.087 71.673 46.770 1.00 0.00 H HETATM 1650 O HOH 598 46.044 50.001 59.314 1.00 35.77 O HETATM 1651 1H HOH 598 45.647 49.346 58.691 1.00 0.00 H HETATM 1652 2H HOH 598 45.741 49.602 60.150 1.00 0.00 H HETATM 1653 O HOH 599 50.802 66.956 44.971 1.00 56.35 O HETATM 1654 1H HOH 599 49.959 66.857 45.437 1.00 0.00 H HETATM 1655 2H HOH 599 50.641 67.746 44.444 1.00 0.00 H HETATM 1656 O HOH 601 46.333 68.523 46.483 1.00 26.21 O HETATM 1657 1H HOH 601 46.985 67.963 46.951 1.00 0.00 H HETATM 1658 2H HOH 601 46.764 69.390 46.499 1.00 0.00 H HETATM 1659 O HOH 602 47.155 49.516 63.270 1.00 54.55 O HETATM 1660 1H HOH 602 46.590 50.240 63.621 1.00 0.00 H HETATM 1661 2H HOH 602 48.005 49.702 63.691 1.00 0.00 H HETATM 1662 O HOH 604 48.647 56.824 60.060 1.00 52.37 O HETATM 1663 1H HOH 604 48.697 57.631 59.531 1.00 0.00 H HETATM 1664 2H HOH 604 48.670 57.178 60.958 1.00 0.00 H HETATM 1665 O HOH 605 51.877 66.979 47.853 1.00 53.20 O HETATM 1666 1H HOH 605 52.627 67.189 48.412 1.00 0.00 H HETATM 1667 2H HOH 605 52.183 67.185 46.964 1.00 0.00 H HETATM 1668 O HOH 606 23.015 59.970 74.391 1.00 47.21 O HETATM 1669 1H HOH 606 23.554 60.756 74.192 1.00 0.00 H HETATM 1670 2H HOH 606 22.861 60.199 75.319 1.00 0.00 H HETATM 1671 O HOH 607 26.673 45.313 64.570 1.00 54.59 O HETATM 1672 1H HOH 607 27.101 46.058 65.023 1.00 0.00 H HETATM 1673 2H HOH 607 26.534 45.639 63.679 1.00 0.00 H HETATM 1674 O HOH 608 28.023 47.163 65.903 1.00 46.61 O HETATM 1675 1H HOH 608 27.719 48.075 65.982 1.00 0.00 H HETATM 1676 2H HOH 608 28.568 47.220 65.076 1.00 0.00 H HETATM 1677 O HOH 609 27.879 63.418 78.249 1.00 59.87 O HETATM 1678 1H HOH 609 27.310 63.221 77.477 1.00 0.00 H HETATM 1679 2H HOH 609 27.195 63.324 78.917 1.00 0.00 H HETATM 1680 O HOH 610 27.726 73.130 66.490 1.00 34.48 O HETATM 1681 1H HOH 610 27.636 72.166 66.587 1.00 0.00 H HETATM 1682 2H HOH 610 26.870 73.326 66.101 1.00 0.00 H HETATM 1683 O HOH 611 28.639 45.029 67.401 1.00 43.95 O HETATM 1684 1H HOH 611 28.692 44.451 66.621 1.00 0.00 H HETATM 1685 2H HOH 611 28.355 45.851 66.926 1.00 0.00 H HETATM 1686 O HOH 612 29.449 47.181 63.509 1.00 47.32 O HETATM 1687 1H HOH 612 29.411 47.107 62.547 1.00 0.00 H HETATM 1688 2H HOH 612 30.335 46.822 63.668 1.00 0.00 H HETATM 1689 O HOH 613 29.513 71.931 60.186 1.00 36.69 O HETATM 1690 1H HOH 613 29.287 71.647 59.288 1.00 0.00 H HETATM 1691 2H HOH 613 29.908 72.807 60.045 1.00 0.00 H HETATM 1692 O HOH 614 30.098 47.082 44.261 1.00 44.89 O HETATM 1693 1H HOH 614 30.677 46.648 43.627 1.00 0.00 H HETATM 1694 2H HOH 614 29.413 47.472 43.709 1.00 0.00 H HETATM 1695 O HOH 615 33.095 72.871 67.657 1.00 43.33 O HETATM 1696 1H HOH 615 32.549 72.334 68.245 1.00 0.00 H HETATM 1697 2H HOH 615 33.973 72.478 67.783 1.00 0.00 H HETATM 1698 O HOH 616 35.713 72.690 49.043 1.00 53.42 O HETATM 1699 1H HOH 616 35.504 72.692 49.994 1.00 0.00 H HETATM 1700 2H HOH 616 34.829 72.895 48.719 1.00 0.00 H HETATM 1701 O HOH 617 38.978 41.636 73.107 1.00 48.44 O HETATM 1702 1H HOH 617 38.317 40.922 73.130 1.00 0.00 H HETATM 1703 2H HOH 617 39.665 41.249 72.562 1.00 0.00 H HETATM 1704 O HOH 618 42.077 59.923 72.527 1.00 43.20 O HETATM 1705 1H HOH 618 42.430 59.371 71.811 1.00 0.00 H HETATM 1706 2H HOH 618 41.944 59.257 73.216 1.00 0.00 H HETATM 1707 O HOH 619 44.192 44.229 52.735 1.00 54.58 O HETATM 1708 1H HOH 619 44.127 45.116 52.365 1.00 0.00 H HETATM 1709 2H HOH 619 43.259 43.950 52.653 1.00 0.00 H HETATM 1710 O HOH 620 44.806 70.544 60.193 1.00 72.03 O HETATM 1711 1H HOH 620 45.408 69.799 60.022 1.00 0.00 H HETATM 1712 2H HOH 620 44.084 70.260 59.616 1.00 0.00 H HETATM 1713 O HOH 621 47.207 71.593 46.898 1.00 47.94 O HETATM 1714 1H HOH 621 47.292 71.981 47.798 1.00 0.00 H HETATM 1715 2H HOH 621 47.943 72.022 46.454 1.00 0.00 H HETATM 1716 O HOH 622 47.109 69.054 53.429 1.00 48.43 O HETATM 1717 1H HOH 622 46.920 69.781 54.035 1.00 0.00 H HETATM 1718 2H HOH 622 47.019 68.294 54.015 1.00 0.00 H HETATM 1719 O HOH 623 47.635 72.853 49.408 1.00 51.77 O HETATM 1720 1H HOH 623 47.355 72.320 50.162 1.00 0.00 H HETATM 1721 2H HOH 623 47.436 73.745 49.746 1.00 0.00 H HETATM 1722 O HOH 624 28.334 70.703 55.610 1.00 45.99 O HETATM 1723 1H HOH 624 27.616 70.126 55.944 1.00 0.00 H HETATM 1724 2H HOH 624 28.306 70.444 54.684 1.00 0.00 H HETATM 1725 O HOH 625 45.873 73.120 60.520 1.00 57.83 O HETATM 1726 1H HOH 625 45.473 72.219 60.483 1.00 0.00 H HETATM 1727 2H HOH 625 46.758 72.927 60.204 1.00 0.00 H HETATM 1728 O HOH 626 45.624 48.063 57.491 1.00 63.12 O HETATM 1729 1H HOH 626 45.086 47.237 57.378 1.00 0.00 H HETATM 1730 2H HOH 626 45.776 48.216 56.548 1.00 0.00 H HETATM 1731 O HOH 627 24.163 61.059 70.300 1.00 47.07 O HETATM 1732 1H HOH 627 24.302 61.983 70.548 1.00 0.00 H HETATM 1733 2H HOH 627 24.668 60.602 70.984 1.00 0.00 H HETATM 1734 O HOH 628 34.277 76.978 61.232 1.00 33.81 O HETATM 1735 1H HOH 628 33.383 77.046 61.590 1.00 0.00 H HETATM 1736 2H HOH 628 34.098 76.709 60.313 1.00 0.00 H HETATM 1737 O HOH 629 30.768 43.635 53.350 1.00 44.29 O HETATM 1738 1H HOH 629 31.346 44.106 53.962 1.00 0.00 H HETATM 1739 2H HOH 629 30.785 42.738 53.684 1.00 0.00 H HETATM 1740 O HOH 630 37.130 39.189 72.558 1.00 67.09 O HETATM 1741 1H HOH 630 36.541 38.451 72.357 1.00 0.00 H HETATM 1742 2H HOH 630 36.520 39.679 73.140 1.00 0.00 H HETATM 1743 O HOH 631 41.965 70.875 59.120 1.00 38.06 O HETATM 1744 1H HOH 631 42.558 71.138 58.402 1.00 0.00 H HETATM 1745 2H HOH 631 41.098 71.052 58.716 1.00 0.00 H CONECT 257 256 258 263 CONECT 263 257 264 271 CONECT 264 263 265 267 CONECT 265 264 266 272 CONECT 266 265 CONECT 267 264 268 CONECT 268 267 269 CONECT 269 268 270 CONECT 270 269 CONECT 271 263 CONECT 272 265 273 279 CONECT 389 388 390 399 CONECT 399 389 400 407 CONECT 400 399 401 403 CONECT 401 400 402 408 CONECT 402 401 CONECT 403 400 404 CONECT 404 403 405 CONECT 405 404 406 CONECT 406 405 CONECT 407 399 CONECT 408 401 409 416 CONECT 466 465 467 476 CONECT 476 466 477 484 CONECT 477 476 478 480 CONECT 478 477 479 485 CONECT 479 478 CONECT 480 477 481 CONECT 481 480 482 CONECT 482 481 483 CONECT 483 482 CONECT 484 476 CONECT 485 478 486 494 MASTER 272 0 3 2 15 0 1 6 1744 1 33 12 END