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*** TRANSCRIPTION/DNA 09-FEB-09 3G73 ***elNémo ID: 23042019240534475Job options:ID = 23042019240534475 JOBID = TRANSCRIPTION/DNA 09-FEB-09 3G73 USERID = unknown PRIVAT = 0 NMODES = 5 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = 0 CUTOFF = 0 CAONLY = 0 Input data for this run:HEADER TRANSCRIPTION/DNA 09-FEB-09 3G73 TITLE STRUCTURE OF THE FOXM1 DNA BINDING COMPND MOL_ID: 1; COMPND 2 MOLECULE: FORKHEAD BOX PROTEIN M1; COMPND 3 CHAIN: A, B; COMPND 4 FRAGMENT: DNA-BINDING DOMAIN, UNP RESIDUES 222-360; COMPND 5 SYNONYM: FORKHEAD-RELATED PROTEIN FKHL16, HEPATOCYTE NUCLEAR FACTOR 3 COMPND 6 FORKHEAD HOMOLOG 11, HNF-3/FORK-HEAD HOMOLOG 11, HFH-11, WINGED-HELIX COMPND 7 FACTOR FROM INS-1 CELLS, M-PHASE PHOSPHOPROTEIN 2, MPM-2 REACTIVE COMPND 8 PHOSPHOPROTEIN 2, TRANSCRIPTION FACTOR TRIDENT; COMPND 9 ENGINEERED: YES; COMPND 10 MOL_ID: 2; COMPND 11 MOLECULE: DNA (5'- COMPND 12 D(P*AP*AP*AP*TP*TP*GP*TP*TP*TP*AP*TP*AP*AP*AP*CP*AP*GP*CP*CP*CP*G)- COMPND 13 3'); COMPND 14 CHAIN: C; COMPND 15 ENGINEERED: YES; COMPND 16 OTHER_DETAILS: FORKHEAD CONSENSUS SEQUENCE PLUS STRAND; COMPND 17 MOL_ID: 3; COMPND 18 MOLECULE: DNA (5'- COMPND 19 D(P*TP*TP*CP*GP*GP*GP*CP*TP*GP*TP*TP*TP*AP*TP*AP*AP*AP*CP*AP*AP*T)- COMPND 20 3'); COMPND 21 CHAIN: D; COMPND 22 ENGINEERED: YES; COMPND 23 OTHER_DETAILS: FORKHEAD CONSENSUS SEQUENCE MINUS STRAND SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: FKHL16, FOXM1, HFH11, MPP2, WIN; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PET28-LIC; SOURCE 11 MOL_ID: 2; SOURCE 12 SYNTHETIC: YES; SOURCE 13 OTHER_DETAILS: DNA OLIGO; SOURCE 14 MOL_ID: 3; SOURCE 15 SYNTHETIC: YES; SOURCE 16 OTHER_DETAILS: DNA OLIGO KEYWDS DNA-BINDING DOMAIN, FORKHEAD TRANSCRIPTION FACTORS, FOXM1, WINGED KEYWDS 2 HELIX, FORKHEAD, TRANSCRIPTION REGULATION, TRANSCRIPTION-DNA KEYWDS 3 COMPLEX, ACTIVATOR, DNA-BINDING, NUCLEUS, PHOSPHOPROTEIN, KEYWDS 4 TRANSCRIPTION EXPDTA X-RAY DIFFRACTION AUTHOR D.R.LITTLER,A.PERRAKIS,R.G.HIBBERT,R.H.MEDEMA REVDAT 4 13-JUL-11 3G73 1 VERSN REVDAT 3 23-JUN-10 3G73 1 JRNL REVDAT 2 19-MAY-09 3G73 1 REMARK REVDAT 1 03-MAR-09 3G73 0 JRNL AUTH D.R.LITTLER,M.ALVAREZ-FERNANDEZ,A.STEIN,R.G.HIBBERT, JRNL AUTH 2 T.HEIDEBRECHT,P.ALOY,R.H.MEDEMA,A.PERRAKIS JRNL TITL STRUCTURE OF THE FOXM1 DNA-RECOGNITION DOMAIN BOUND TO A JRNL TITL 2 PROMOTER SEQUENCE JRNL REF NUCLEIC ACIDS RES. 2010 JRNL REFN ESSN 1362-4962 JRNL PMID 20360045 JRNL DOI 10.1093/NAR/GKQ194 REMARK 2 REMARK 2 RESOLUTION. 2.21 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.5.0063 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.21 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 32.94 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : 91.4 REMARK 3 NUMBER OF REFLECTIONS : 25545 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.206 REMARK 3 R VALUE (WORKING SET) : 0.204 REMARK 3 FREE R VALUE : 0.234 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.200 REMARK 3 FREE R VALUE TEST SET COUNT : 1389 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.21 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.27 REMARK 3 REFLECTION IN BIN (WORKING SET) : 1117 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 54.88 REMARK 3 BIN R VALUE (WORKING SET) : 0.3310 REMARK 3 BIN FREE R VALUE SET COUNT : 69 REMARK 3 BIN FREE R VALUE : 0.4090 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1560 REMARK 3 NUCLEIC ACID ATOMS : 861 REMARK 3 HETEROGEN ATOMS : 2 REMARK 3 SOLVENT ATOMS : 163 REMARK 3 REMARK 3 B VALUES. REMARK 3 B VALUE TYPE : LIKELY RESIDUAL REMARK 3 FROM WILSON PLOT (A**2) : 48.10 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 19.23 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 1.22000 REMARK 3 B22 (A**2) : 0.23000 REMARK 3 B33 (A**2) : -1.45000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.195 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.173 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.105 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 9.275 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.950 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.939 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2582 ; 0.009 ; 0.021 REMARK 3 BOND LENGTHS OTHERS (A): 1510 ; 0.001 ; 0.020 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3676 ; 1.446 ; 2.354 REMARK 3 BOND ANGLES OTHERS (DEGREES): 3694 ; 0.922 ; 3.000 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 185 ; 5.831 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 80 ;31.395 ;22.375 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 276 ;13.639 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 12 ;15.812 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 393 ; 0.066 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 2201 ; 0.005 ; 0.021 REMARK 3 GENERAL PLANES OTHERS (A): 450 ; 0.001 ; 0.020 REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 933 ; 1.059 ; 2.000 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): 362 ; 0.211 ; 2.000 REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 1523 ; 1.782 ; 3.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 1649 ; 0.965 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 2152 ; 1.545 ; 3.000 REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : 3 REMARK 3 REMARK 3 TLS GROUP : 1 REMARK 3 NUMBER OF COMPONENTS GROUP : 2 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : C 1 C 21 REMARK 3 RESIDUE RANGE : D 1 D 21 REMARK 3 ORIGIN FOR THE GROUP (A): 10.2974 29.1822 12.9834 REMARK 3 T TENSOR REMARK 3 T11: 0.0293 T22: 0.1433 REMARK 3 T33: 0.0492 T12: 0.0188 REMARK 3 T13: -0.0187 T23: 0.0410 REMARK 3 L TENSOR REMARK 3 L11: 3.8974 L22: 4.9382 REMARK 3 L33: 4.1264 L12: -1.9459 REMARK 3 L13: -0.7514 L23: 0.9201 REMARK 3 S TENSOR REMARK 3 S11: -0.1242 S12: -0.0764 S13: -0.0977 REMARK 3 S21: 0.3535 S22: 0.1006 S23: -0.3056 REMARK 3 S31: 0.1759 S32: 0.2009 S33: 0.0237 REMARK 3 REMARK 3 TLS GROUP : 2 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 232 A 321 REMARK 3 ORIGIN FOR THE GROUP (A): 10.2625 23.7499 -2.3788 REMARK 3 T TENSOR REMARK 3 T11: 0.0436 T22: 0.1841 REMARK 3 T33: 0.0414 T12: 0.0102 REMARK 3 T13: 0.0226 T23: -0.0188 REMARK 3 L TENSOR REMARK 3 L11: 8.9571 L22: 4.3913 REMARK 3 L33: 7.6112 L12: 1.7863 REMARK 3 L13: -0.3356 L23: 0.5534 REMARK 3 S TENSOR REMARK 3 S11: -0.3497 S12: 0.8179 S13: -0.3373 REMARK 3 S21: -0.2595 S22: 0.1424 S23: 0.0523 REMARK 3 S31: 0.1524 S32: -0.0090 S33: 0.2073 REMARK 3 REMARK 3 TLS GROUP : 3 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 235 B 327 REMARK 3 ORIGIN FOR THE GROUP (A): -4.4671 36.2163 25.5536 REMARK 3 T TENSOR REMARK 3 T11: 0.0555 T22: 0.2198 REMARK 3 T33: 0.0253 T12: 0.0557 REMARK 3 T13: 0.0220 T23: 0.0197 REMARK 3 L TENSOR REMARK 3 L11: 3.4803 L22: 3.8758 REMARK 3 L33: 9.7247 L12: 0.0694 REMARK 3 L13: -0.7681 L23: -1.7432 REMARK 3 S TENSOR REMARK 3 S11: 0.2254 S12: 0.0460 S13: 0.0979 REMARK 3 S21: 0.2633 S22: 0.0784 S23: 0.2770 REMARK 3 S31: -0.1218 S32: -0.9885 S33: -0.3038 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING REMARK 3 POSITIONS REMARK 4 REMARK 4 3G73 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 15-FEB-09. REMARK 100 THE RCSB ID CODE IS RCSB051505. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 01-NOV-08 REMARK 200 TEMPERATURE (KELVIN) : 100.0 REMARK 200 PH : 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ESRF REMARK 200 BEAMLINE : ID23-1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.0723 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM Q315R REMARK 200 INTENSITY-INTEGRATION SOFTWARE : MOSFLM REMARK 200 DATA SCALING SOFTWARE : SCALA REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 27165 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.200 REMARK 200 RESOLUTION RANGE LOW (A) : 76.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 91.4 REMARK 200 DATA REDUNDANCY : 5.000 REMARK 200 R MERGE (I) : 0.05800 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 16.1000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.20 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.32 REMARK 200 COMPLETENESS FOR SHELL (%) : 59.4 REMARK 200 DATA REDUNDANCY IN SHELL : 4.40 REMARK 200 R MERGE FOR SHELL (I) : 0.45000 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 3.100 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: AMORE REMARK 200 STARTING MODEL: PDB ENTRY 2C6Y REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 60.38 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.10 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 24% PEG3350, 0.2M SODIUM MALONATE, REMARK 280 PH7.5, 3UL PROTEIN AT 12G/L MIXED WITH DNA AT 0.5MM ADDED TO 3UL REMARK 280 OF RESERVOIR, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 291K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 2 2 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -X,Y,-Z+1/2 REMARK 290 4555 X,-Y,-Z REMARK 290 5555 X+1/2,Y+1/2,Z REMARK 290 6555 -X+1/2,-Y+1/2,Z+1/2 REMARK 290 7555 -X+1/2,Y+1/2,-Z+1/2 REMARK 290 8555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 76.48500 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 76.48500 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 31.53500 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 59.87500 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 6 -1.000000 0.000000 0.000000 31.53500 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 59.87500 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 76.48500 REMARK 290 SMTRY1 7 -1.000000 0.000000 0.000000 31.53500 REMARK 290 SMTRY2 7 0.000000 1.000000 0.000000 59.87500 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 76.48500 REMARK 290 SMTRY1 8 1.000000 0.000000 0.000000 31.53500 REMARK 290 SMTRY2 8 0.000000 -1.000000 0.000000 59.87500 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: TETRAMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 5270 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 16980 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -64.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, C, D, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY A 219 REMARK 465 PRO A 220 REMARK 465 GLY A 221 REMARK 465 PRO A 222 REMARK 465 SER A 223 REMARK 465 ARG A 224 REMARK 465 PRO A 225 REMARK 465 SER A 226 REMARK 465 ALA A 227 REMARK 465 SER A 228 REMARK 465 TRP A 229 REMARK 465 GLN A 230 REMARK 465 ASN A 231 REMARK 465 GLN A 322 REMARK 465 VAL A 323 REMARK 465 PHE A 324 REMARK 465 LYS A 325 REMARK 465 PRO A 326 REMARK 465 LEU A 327 REMARK 465 ASP A 328 REMARK 465 PRO A 329 REMARK 465 GLY A 330 REMARK 465 SER A 331 REMARK 465 PRO A 332 REMARK 465 GLN A 333 REMARK 465 LEU A 334 REMARK 465 PRO A 335 REMARK 465 GLU A 336 REMARK 465 HIS A 337 REMARK 465 LEU A 338 REMARK 465 GLU A 339 REMARK 465 SER A 340 REMARK 465 GLN A 341 REMARK 465 GLN A 342 REMARK 465 LYS A 343 REMARK 465 ARG A 344 REMARK 465 PRO A 345 REMARK 465 ASN A 346 REMARK 465 PRO A 347 REMARK 465 GLU A 348 REMARK 465 LEU A 349 REMARK 465 ARG A 350 REMARK 465 ARG A 351 REMARK 465 ASN A 352 REMARK 465 MET A 353 REMARK 465 THR A 354 REMARK 465 ILE A 355 REMARK 465 LYS A 356 REMARK 465 THR A 357 REMARK 465 GLU A 358 REMARK 465 LEU A 359 REMARK 465 PRO A 360 REMARK 465 GLY B 219 REMARK 465 PRO B 220 REMARK 465 GLY B 221 REMARK 465 PRO B 222 REMARK 465 SER B 223 REMARK 465 ARG B 224 REMARK 465 PRO B 225 REMARK 465 SER B 226 REMARK 465 ALA B 227 REMARK 465 SER B 228 REMARK 465 TRP B 229 REMARK 465 GLN B 230 REMARK 465 ASN B 231 REMARK 465 SER B 232 REMARK 465 VAL B 233 REMARK 465 PRO B 329 REMARK 465 GLY B 330 REMARK 465 SER B 331 REMARK 465 PRO B 332 REMARK 465 GLN B 333 REMARK 465 LEU B 334 REMARK 465 PRO B 335 REMARK 465 GLU B 336 REMARK 465 HIS B 337 REMARK 465 LEU B 338 REMARK 465 GLU B 339 REMARK 465 SER B 340 REMARK 465 GLN B 341 REMARK 465 GLN B 342 REMARK 465 LYS B 343 REMARK 465 ARG B 344 REMARK 465 PRO B 345 REMARK 465 ASN B 346 REMARK 465 PRO B 347 REMARK 465 GLU B 348 REMARK 465 LEU B 349 REMARK 465 ARG B 350 REMARK 465 ARG B 351 REMARK 465 ASN B 352 REMARK 465 MET B 353 REMARK 465 THR B 354 REMARK 465 ILE B 355 REMARK 465 LYS B 356 REMARK 465 THR B 357 REMARK 465 GLU B 358 REMARK 465 LEU B 359 REMARK 465 PRO B 360 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 OP2 DT D 1 O3' DT D 21 5545 1.97 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 DG D 5 O3' DG D 5 C3' -0.043 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DC C 15 O4' - C1' - N1 ANGL. DEV. = 3.5 DEGREES REMARK 500 DC D 7 O4' - C1' - N1 ANGL. DEV. = -4.5 DEGREES REMARK 500 DC D 18 O4' - C4' - C3' ANGL. DEV. = -3.8 DEGREES REMARK 500 DC D 18 C1' - O4' - C4' ANGL. DEV. = -8.9 DEGREES REMARK 500 DC D 18 O4' - C1' - N1 ANGL. DEV. = 3.6 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 PRO A 238 42.65 -88.64 REMARK 500 LEU A 318 108.82 -59.08 REMARK 500 PRO B 238 45.64 -91.40 REMARK 500 ALA B 314 49.59 -149.37 REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 MG A 996 MG REMARK 620 N RES CSSEQI ATOM REMARK 620 1 LEU A 289 O REMARK 620 2 HIS A 292 O 93.9 REMARK 620 3 PHE A 295 O 102.4 91.1 REMARK 620 4 HOH A 24 O 135.0 92.4 122.0 REMARK 620 5 HOH D 26 O 93.5 172.3 89.3 80.9 REMARK 620 N 1 2 3 4 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 MG B 996 MG REMARK 620 N RES CSSEQI ATOM REMARK 620 1 LEU B 289 O REMARK 620 2 HOH B 49 O 145.9 REMARK 620 3 HOH C 46 O 99.4 88.6 REMARK 620 4 PHE B 295 O 105.5 106.1 97.8 REMARK 620 5 HIS B 292 O 90.5 80.6 169.0 83.8 REMARK 620 N 1 2 3 4 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MG A 996 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MG B 996 DBREF 3G73 A 222 360 UNP Q08050 FOXM1_HUMAN 222 360 DBREF 3G73 B 222 360 UNP Q08050 FOXM1_HUMAN 222 360 DBREF 3G73 C 1 21 PDB 3G73 3G73 1 21 DBREF 3G73 D 1 21 PDB 3G73 3G73 1 21 SEQADV 3G73 GLY A 219 UNP Q08050 EXPRESSION TAG SEQADV 3G73 PRO A 220 UNP Q08050 EXPRESSION TAG SEQADV 3G73 GLY A 221 UNP Q08050 EXPRESSION TAG SEQADV 3G73 GLY B 219 UNP Q08050 EXPRESSION TAG SEQADV 3G73 PRO B 220 UNP Q08050 EXPRESSION TAG SEQADV 3G73 GLY B 221 UNP Q08050 EXPRESSION TAG SEQRES 1 A 142 GLY PRO GLY PRO SER ARG PRO SER ALA SER TRP GLN ASN SEQRES 2 A 142 SER VAL SER GLU ARG PRO PRO TYR SER TYR MET ALA MET SEQRES 3 A 142 ILE GLN PHE ALA ILE ASN SER THR GLU ARG LYS ARG MET SEQRES 4 A 142 THR LEU LYS ASP ILE TYR THR TRP ILE GLU ASP HIS PHE SEQRES 5 A 142 PRO TYR PHE LYS HIS ILE ALA LYS PRO GLY TRP LYS ASN SEQRES 6 A 142 SER ILE ARG HIS ASN LEU SER LEU HIS ASP MET PHE VAL SEQRES 7 A 142 ARG GLU THR SER ALA ASN GLY LYS VAL SER PHE TRP THR SEQRES 8 A 142 ILE HIS PRO SER ALA ASN ARG TYR LEU THR LEU ASP GLN SEQRES 9 A 142 VAL PHE LYS PRO LEU ASP PRO GLY SER PRO GLN LEU PRO SEQRES 10 A 142 GLU HIS LEU GLU SER GLN GLN LYS ARG PRO ASN PRO GLU SEQRES 11 A 142 LEU ARG ARG ASN MET THR ILE LYS THR GLU LEU PRO SEQRES 1 B 142 GLY PRO GLY PRO SER ARG PRO SER ALA SER TRP GLN ASN SEQRES 2 B 142 SER VAL SER GLU ARG PRO PRO TYR SER TYR MET ALA MET SEQRES 3 B 142 ILE GLN PHE ALA ILE ASN SER THR GLU ARG LYS ARG MET SEQRES 4 B 142 THR LEU LYS ASP ILE TYR THR TRP ILE GLU ASP HIS PHE SEQRES 5 B 142 PRO TYR PHE LYS HIS ILE ALA LYS PRO GLY TRP LYS ASN SEQRES 6 B 142 SER ILE ARG HIS ASN LEU SER LEU HIS ASP MET PHE VAL SEQRES 7 B 142 ARG GLU THR SER ALA ASN GLY LYS VAL SER PHE TRP THR SEQRES 8 B 142 ILE HIS PRO SER ALA ASN ARG TYR LEU THR LEU ASP GLN SEQRES 9 B 142 VAL PHE LYS PRO LEU ASP PRO GLY SER PRO GLN LEU PRO SEQRES 10 B 142 GLU HIS LEU GLU SER GLN GLN LYS ARG PRO ASN PRO GLU SEQRES 11 B 142 LEU ARG ARG ASN MET THR ILE LYS THR GLU LEU PRO SEQRES 1 C 21 DA DA DA DT DT DG DT DT DT DA DT DA DA SEQRES 2 C 21 DA DC DA DG DC DC DC DG SEQRES 1 D 21 DT DT DC DG DG DG DC DT DG DT DT DT DA SEQRES 2 D 21 DT DA DA DA DC DA DA DT HET MG A 996 1 HET MG B 996 1 HETNAM MG MAGNESIUM ION FORMUL 5 MG 2(MG 2+) FORMUL 7 HOH *163(H2 O) HELIX 1 1 SER A 240 SER A 251 1 12 HELIX 2 2 THR A 258 ILE A 276 1 19 HELIX 3 3 GLY A 280 HIS A 292 1 13 SHEET 1 1 1 ARG A 256 MET A 257 0 SHEET 2 2 1 PHE A 295 THR A 299 0 SHEET 3 3 1 SER A 306 ILE A 310 0 LINK O LEU A 289 MG MG A 996 1555 1555 2.35 LINK O HIS A 292 MG MG A 996 1555 1555 2.47 LINK O PHE A 295 MG MG A 996 1555 1555 2.37 LINK O LEU B 289 MG MG B 996 1555 1555 2.17 LINK MG MG A 996 O HOH A 24 1555 1555 2.32 LINK MG MG B 996 O HOH B 49 1555 1555 2.33 LINK MG MG A 996 O HOH D 26 1555 1555 2.50 LINK MG MG B 996 O HOH C 46 1555 1555 2.51 LINK O PHE B 295 MG MG B 996 1555 1555 2.56 LINK O HIS B 292 MG MG B 996 1555 1555 2.57 CISPEP 1 GLY A 303 LYS A 304 0 -0.18 SITE 1 AC1 6 HOH A 24 LEU A 289 SER A 290 HIS A 292 SITE 2 AC1 6 PHE A 295 HOH D 26 SITE 1 AC2 6 HOH B 49 LEU B 289 SER B 290 HIS B 292 SITE 2 AC2 6 PHE B 295 HOH C 46 CRYST1 63.070 119.750 152.970 90.00 90.00 90.00 C 2 2 21 16 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 0.015855 0.000000 0.000000 0.00000 SCALE2 0.000000 0.008351 0.000000 0.00000 SCALE3 0.000000 0.000000 0.006537 0.00000 ATOM 1 N SER A 232 21.364 40.072 -13.197 1.00 39.35 N ATOM 2 CA SER A 232 22.401 39.348 -12.409 1.00 38.82 C ATOM 3 C SER A 232 21.829 38.065 -11.805 1.00 37.91 C ATOM 4 O SER A 232 20.969 38.107 -10.920 1.00 39.29 O ATOM 5 CB SER A 232 22.959 40.255 -11.318 1.00 39.15 C ATOM 6 OG SER A 232 23.624 39.504 -10.318 1.00 39.72 O ATOM 7 HA SER A 232 23.216 39.078 -13.081 1.00 0.00 H ATOM 8 HB2 SER A 232 23.665 40.955 -11.765 1.00 0.00 H ATOM 9 HB3 SER A 232 22.141 40.813 -10.862 1.00 0.00 H ATOM 10 HG SER A 232 23.965 40.098 -9.645 1.00 0.00 H ATOM 11 H SER A 232 21.011 40.960 -12.871 1.00 0.00 H ATOM 12 N VAL A 233 22.348 36.929 -12.266 1.00 36.29 N ATOM 13 CA VAL A 233 21.752 35.612 -12.003 1.00 34.65 C ATOM 14 C VAL A 233 21.815 35.129 -10.544 1.00 32.90 C ATOM 15 O VAL A 233 21.026 34.265 -10.165 1.00 32.03 O ATOM 16 CB VAL A 233 22.366 34.524 -12.955 1.00 34.42 C ATOM 17 CG1 VAL A 233 21.844 33.126 -12.635 1.00 34.14 C ATOM 18 CG2 VAL A 233 22.056 34.855 -14.395 1.00 33.68 C ATOM 19 H VAL A 233 23.190 36.975 -12.822 1.00 0.00 H ATOM 20 HA VAL A 233 20.696 35.691 -12.260 1.00 0.00 H ATOM 21 HB VAL A 233 23.448 34.525 -12.827 1.00 0.00 H ATOM 22 HG21 VAL A 233 22.428 35.853 -14.627 1.00 0.00 H ATOM 23 HG22 VAL A 233 22.539 34.127 -15.047 1.00 0.00 H ATOM 24 HG23 VAL A 233 20.978 34.823 -14.551 1.00 0.00 H ATOM 25 HG11 VAL A 233 22.047 32.461 -13.474 1.00 0.00 H ATOM 26 HG12 VAL A 233 22.343 32.748 -11.743 1.00 0.00 H ATOM 27 HG13 VAL A 233 20.769 33.171 -12.459 1.00 0.00 H ATOM 28 N SER A 234 22.718 35.679 -9.725 1.00 31.23 N ATOM 29 CA SER A 234 22.912 35.156 -8.357 1.00 29.80 C ATOM 30 C SER A 234 22.485 36.073 -7.195 1.00 28.46 C ATOM 31 O SER A 234 22.841 35.828 -6.045 1.00 26.99 O ATOM 32 CB SER A 234 24.365 34.713 -8.165 1.00 30.19 C ATOM 33 OG SER A 234 25.219 35.813 -7.925 1.00 30.32 O ATOM 34 H SER A 234 23.273 36.460 -10.045 1.00 0.00 H ATOM 35 HA SER A 234 22.302 34.256 -8.281 1.00 0.00 H ATOM 36 HB2 SER A 234 24.699 34.197 -9.065 1.00 0.00 H ATOM 37 HB3 SER A 234 24.420 34.028 -7.319 1.00 0.00 H ATOM 38 HG SER A 234 26.119 35.500 -7.810 1.00 0.00 H ATOM 39 N GLU A 235 21.711 37.112 -7.488 1.00 28.28 N ATOM 40 CA GLU A 235 21.138 37.969 -6.442 1.00 28.39 C ATOM 41 C GLU A 235 19.898 37.291 -5.858 1.00 27.21 C ATOM 42 O GLU A 235 19.339 36.393 -6.493 1.00 26.96 O ATOM 43 CB GLU A 235 20.768 39.329 -7.021 1.00 29.52 C ATOM 44 CG GLU A 235 21.969 40.158 -7.426 1.00 30.49 C ATOM 45 CD GLU A 235 21.616 41.248 -8.414 1.00 31.39 C ATOM 46 OE1 GLU A 235 20.478 41.239 -8.935 1.00 32.52 O ATOM 47 OE2 GLU A 235 22.482 42.111 -8.680 1.00 32.04 O ATOM 48 H GLU A 235 21.511 37.318 -8.456 1.00 0.00 H ATOM 49 HA GLU A 235 21.875 38.107 -5.651 1.00 0.00 H ATOM 50 HB2 GLU A 235 20.204 39.882 -6.270 1.00 0.00 H ATOM 51 HB3 GLU A 235 20.135 39.178 -7.895 1.00 0.00 H ATOM 52 HG2 GLU A 235 22.392 40.619 -6.534 1.00 0.00 H ATOM 53 HG3 GLU A 235 22.716 39.503 -7.874 1.00 0.00 H ATOM 54 N ARG A 236 19.473 37.714 -4.663 1.00 25.39 N ATOM 55 CA ARG A 236 18.310 37.103 -4.004 1.00 25.30 C ATOM 56 C ARG A 236 16.989 37.291 -4.789 1.00 22.77 C ATOM 57 O ARG A 236 16.610 38.406 -5.115 1.00 22.56 O ATOM 58 CB ARG A 236 18.122 37.637 -2.577 1.00 26.12 C ATOM 59 CG ARG A 236 17.179 36.744 -1.764 1.00 27.59 C ATOM 60 CD ARG A 236 16.552 37.418 -0.557 1.00 28.56 C ATOM 61 NE ARG A 236 15.664 36.469 0.128 1.00 29.74 N ATOM 62 CZ ARG A 236 15.930 35.838 1.274 1.00 30.70 C ATOM 63 NH1 ARG A 236 17.072 36.043 1.931 1.00 31.11 N ATOM 64 NH2 ARG A 236 15.036 34.994 1.784 1.00 31.12 N ATOM 65 H ARG A 236 19.961 38.469 -4.203 1.00 0.00 H ATOM 66 HA ARG A 236 18.499 36.032 -3.931 1.00 0.00 H ATOM 67 HB2 ARG A 236 17.703 38.642 -2.627 1.00 0.00 H ATOM 68 HB3 ARG A 236 19.091 37.679 -2.080 1.00 0.00 H ATOM 69 HG2 ARG A 236 16.376 36.410 -2.422 1.00 0.00 H ATOM 70 HG3 ARG A 236 17.735 35.870 -1.424 1.00 0.00 H ATOM 71 HD2 ARG A 236 17.337 37.740 0.128 1.00 0.00 H ATOM 72 HD3 ARG A 236 15.976 38.284 -0.883 1.00 0.00 H ATOM 73 HE ARG A 236 14.773 36.277 -0.307 1.00 0.00 H ATOM 74 HH11 ARG A 236 17.760 36.684 1.561 1.00 0.00 H ATOM 75 HH12 ARG A 236 17.249 35.558 2.799 1.00 0.00 H ATOM 76 HH21 ARG A 236 14.164 34.830 1.302 1.00 0.00 H ATOM 77 HH22 ARG A 236 15.230 34.517 2.653 1.00 0.00 H ATOM 78 N PRO A 237 16.270 36.202 -5.068 1.00 21.37 N ATOM 79 CA PRO A 237 15.044 36.339 -5.878 1.00 20.69 C ATOM 80 C PRO A 237 13.910 37.091 -5.170 1.00 19.03 C ATOM 81 O PRO A 237 13.860 37.108 -3.949 1.00 18.59 O ATOM 82 CB PRO A 237 14.614 34.888 -6.129 1.00 20.92 C ATOM 83 CG PRO A 237 15.691 34.033 -5.563 1.00 21.31 C ATOM 84 CD PRO A 237 16.442 34.833 -4.570 1.00 21.26 C ATOM 85 HA PRO A 237 15.277 36.826 -6.825 1.00 0.00 H ATOM 86 HB2 PRO A 237 13.667 34.683 -5.630 1.00 0.00 H ATOM 87 HB3 PRO A 237 14.518 34.707 -7.200 1.00 0.00 H ATOM 88 HG2 PRO A 237 16.362 33.709 -6.359 1.00 0.00 H ATOM 89 HG3 PRO A 237 15.251 33.162 -5.076 1.00 0.00 H ATOM 90 HD2 PRO A 237 16.018 34.721 -3.572 1.00 0.00 H ATOM 91 HD3 PRO A 237 17.496 34.554 -4.572 1.00 0.00 H ATOM 92 N PRO A 238 12.983 37.691 -5.936 1.00 18.02 N ATOM 93 CA PRO A 238 11.862 38.382 -5.321 1.00 17.47 C ATOM 94 C PRO A 238 10.679 37.436 -5.078 1.00 17.47 C ATOM 95 O PRO A 238 9.540 37.795 -5.341 1.00 18.90 O ATOM 96 CB PRO A 238 11.524 39.448 -6.367 1.00 17.30 C ATOM 97 CG PRO A 238 11.797 38.776 -7.663 1.00 16.87 C ATOM 98 CD PRO A 238 12.921 37.783 -7.405 1.00 17.54 C ATOM 99 HA PRO A 238 12.171 38.851 -4.387 1.00 0.00 H ATOM 100 HB2 PRO A 238 10.477 39.743 -6.296 1.00 0.00 H ATOM 101 HB3 PRO A 238 12.171 40.317 -6.246 1.00 0.00 H ATOM 102 HG2 PRO A 238 10.906 38.254 -8.012 1.00 0.00 H ATOM 103 HG3 PRO A 238 12.112 39.511 -8.404 1.00 0.00 H ATOM 104 HD2 PRO A 238 13.864 38.151 -7.810 1.00 0.00 H ATOM 105 HD3 PRO A 238 12.676 36.812 -7.836 1.00 0.00 H ATOM 106 N TYR A 239 10.960 36.231 -4.598 1.00 17.45 N ATOM 107 CA TYR A 239 9.931 35.253 -4.278 1.00 18.30 C ATOM 108 C TYR A 239 10.057 34.780 -2.837 1.00 17.41 C ATOM 109 O TYR A 239 11.162 34.573 -2.328 1.00 16.45 O ATOM 110 CB TYR A 239 10.041 34.029 -5.187 1.00 19.04 C ATOM 111 CG TYR A 239 10.010 34.364 -6.647 1.00 20.61 C ATOM 112 CD1 TYR A 239 8.921 35.020 -7.198 1.00 21.17 C ATOM 113 CD2 TYR A 239 11.063 34.016 -7.484 1.00 21.24 C ATOM 114 CE1 TYR A 239 8.880 35.331 -8.530 1.00 21.54 C ATOM 115 CE2 TYR A 239 11.032 34.330 -8.825 1.00 21.66 C ATOM 116 CZ TYR A 239 9.937 34.987 -9.340 1.00 21.73 C ATOM 117 OH TYR A 239 9.890 35.300 -10.671 1.00 22.14 O ATOM 118 H TYR A 239 11.928 35.983 -4.449 1.00 0.00 H ATOM 119 HA TYR A 239 8.951 35.711 -4.417 1.00 0.00 H ATOM 120 HB2 TYR A 239 9.208 33.361 -4.969 1.00 0.00 H ATOM 121 HB3 TYR A 239 10.974 33.510 -4.966 1.00 0.00 H ATOM 122 HD1 TYR A 239 8.089 35.291 -6.565 1.00 0.00 H ATOM 123 HD2 TYR A 239 11.916 33.493 -7.078 1.00 0.00 H ATOM 124 HE1 TYR A 239 8.023 35.843 -8.942 1.00 0.00 H ATOM 125 HE2 TYR A 239 11.859 34.063 -9.466 1.00 0.00 H ATOM 126 HH TYR A 239 9.811 36.251 -10.773 1.00 0.00 H ATOM 127 N SER A 240 8.915 34.572 -2.192 1.00 16.44 N ATOM 128 CA SER A 240 8.906 34.060 -0.834 1.00 15.28 C ATOM 129 C SER A 240 9.301 32.589 -0.851 1.00 15.60 C ATOM 130 O SER A 240 9.197 31.911 -1.878 1.00 16.19 O ATOM 131 CB SER A 240 7.527 34.246 -0.208 1.00 13.87 C ATOM 132 OG SER A 240 6.570 33.488 -0.924 1.00 13.99 O ATOM 133 H SER A 240 8.039 34.773 -2.653 1.00 0.00 H ATOM 134 HA SER A 240 9.637 34.614 -0.245 1.00 0.00 H ATOM 135 HB2 SER A 240 7.253 35.300 -0.243 1.00 0.00 H ATOM 136 HB3 SER A 240 7.552 33.912 0.829 1.00 0.00 H ATOM 137 HG SER A 240 5.793 33.355 -0.377 1.00 0.00 H ATOM 138 N TYR A 241 9.764 32.084 0.279 1.00 16.52 N ATOM 139 CA TYR A 241 10.011 30.646 0.377 1.00 18.94 C ATOM 140 C TYR A 241 8.794 29.809 -0.060 1.00 21.54 C ATOM 141 O TYR A 241 8.949 28.760 -0.720 1.00 21.35 O ATOM 142 CB TYR A 241 10.410 30.254 1.782 1.00 18.64 C ATOM 143 CG TYR A 241 11.798 30.703 2.152 1.00 19.17 C ATOM 144 CD1 TYR A 241 12.004 31.590 3.195 1.00 17.64 C ATOM 145 CD2 TYR A 241 12.910 30.240 1.438 1.00 19.39 C ATOM 146 CE1 TYR A 241 13.294 32.014 3.533 1.00 19.52 C ATOM 147 CE2 TYR A 241 14.197 30.653 1.766 1.00 19.86 C ATOM 148 CZ TYR A 241 14.387 31.528 2.817 1.00 19.48 C ATOM 149 OH TYR A 241 15.652 31.934 3.128 1.00 18.74 O ATOM 150 H TYR A 241 9.946 32.687 1.069 1.00 0.00 H ATOM 151 HA TYR A 241 10.841 30.403 -0.287 1.00 0.00 H ATOM 152 HB2 TYR A 241 10.364 29.168 1.865 1.00 0.00 H ATOM 153 HB3 TYR A 241 9.700 30.691 2.484 1.00 0.00 H ATOM 154 HD1 TYR A 241 11.158 31.960 3.755 1.00 0.00 H ATOM 155 HD2 TYR A 241 12.766 29.551 0.619 1.00 0.00 H ATOM 156 HE1 TYR A 241 13.442 32.713 4.343 1.00 0.00 H ATOM 157 HE2 TYR A 241 15.044 30.291 1.201 1.00 0.00 H ATOM 158 HH TYR A 241 16.039 32.382 2.372 1.00 0.00 H ATOM 159 N MET A 242 7.603 30.281 0.316 1.00 21.15 N ATOM 160 CA MET A 242 6.346 29.613 -0.033 1.00 21.95 C ATOM 161 C MET A 242 6.152 29.549 -1.564 1.00 18.93 C ATOM 162 O MET A 242 5.767 28.527 -2.090 1.00 19.71 O ATOM 163 CB MET A 242 5.165 30.335 0.656 1.00 22.05 C ATOM 164 CG MET A 242 3.808 29.704 0.426 1.00 24.16 C ATOM 165 SD MET A 242 2.399 30.809 0.805 1.00 24.00 S ATOM 166 CE MET A 242 2.477 31.863 -0.630 1.00 25.02 C ATOM 167 H MET A 242 7.567 31.130 0.861 1.00 0.00 H ATOM 168 HA MET A 242 6.388 28.592 0.347 1.00 0.00 H ATOM 169 HB2 MET A 242 5.130 31.358 0.282 1.00 0.00 H ATOM 170 HB3 MET A 242 5.356 30.365 1.729 1.00 0.00 H ATOM 171 HG2 MET A 242 3.740 29.409 -0.621 1.00 0.00 H ATOM 172 HG3 MET A 242 3.728 28.811 1.046 1.00 0.00 H ATOM 173 HE1 MET A 242 1.685 32.610 -0.576 1.00 0.00 H ATOM 174 HE2 MET A 242 3.445 32.362 -0.662 1.00 0.00 H ATOM 175 HE3 MET A 242 2.349 31.262 -1.530 1.00 0.00 H ATOM 176 N ALA A 243 6.399 30.645 -2.265 1.00 17.37 N ATOM 177 CA ALA A 243 6.351 30.638 -3.737 1.00 18.04 C ATOM 178 C ALA A 243 7.364 29.646 -4.351 1.00 18.43 C ATOM 179 O ALA A 243 7.020 28.831 -5.216 1.00 17.42 O ATOM 180 CB ALA A 243 6.584 32.035 -4.280 1.00 17.01 C ATOM 181 H ALA A 243 6.625 31.502 -1.781 1.00 0.00 H ATOM 182 HA ALA A 243 5.351 30.324 -4.038 1.00 0.00 H ATOM 183 HB1 ALA A 243 6.546 32.013 -5.369 1.00 0.00 H ATOM 184 HB2 ALA A 243 7.563 32.391 -3.958 1.00 0.00 H ATOM 185 HB3 ALA A 243 5.812 32.705 -3.903 1.00 0.00 H ATOM 186 N MET A 244 8.598 29.689 -3.869 1.00 19.53 N ATOM 187 CA MET A 244 9.666 28.879 -4.456 1.00 19.48 C ATOM 188 C MET A 244 9.414 27.393 -4.205 1.00 19.19 C ATOM 189 O MET A 244 9.704 26.556 -5.057 1.00 20.03 O ATOM 190 CB MET A 244 11.032 29.306 -3.919 1.00 19.10 C ATOM 191 CG MET A 244 11.459 30.683 -4.372 1.00 19.52 C ATOM 192 SD MET A 244 13.114 31.147 -3.769 1.00 20.18 S ATOM 193 CE MET A 244 12.801 31.530 -2.039 1.00 19.54 C ATOM 194 H MET A 244 8.804 30.290 -3.084 1.00 0.00 H ATOM 195 HA MET A 244 9.661 29.044 -5.533 1.00 0.00 H ATOM 196 HB2 MET A 244 11.776 28.586 -4.259 1.00 0.00 H ATOM 197 HB3 MET A 244 11.001 29.289 -2.830 1.00 0.00 H ATOM 198 HG2 MET A 244 10.737 31.410 -4.001 1.00 0.00 H ATOM 199 HG3 MET A 244 11.460 30.711 -5.462 1.00 0.00 H ATOM 200 HE1 MET A 244 13.733 31.827 -1.558 1.00 0.00 H ATOM 201 HE2 MET A 244 12.081 32.346 -1.972 1.00 0.00 H ATOM 202 HE3 MET A 244 12.399 30.649 -1.539 1.00 0.00 H ATOM 203 N ILE A 245 8.870 27.066 -3.041 1.00 19.72 N ATOM 204 CA ILE A 245 8.507 25.686 -2.751 1.00 19.25 C ATOM 205 C ILE A 245 7.451 25.212 -3.772 1.00 19.38 C ATOM 206 O ILE A 245 7.558 24.098 -4.313 1.00 18.65 O ATOM 207 CB ILE A 245 7.996 25.509 -1.303 1.00 19.33 C ATOM 208 CG1 ILE A 245 9.148 25.668 -0.291 1.00 19.33 C ATOM 209 CG2 ILE A 245 7.372 24.128 -1.127 1.00 19.48 C ATOM 210 CD1 ILE A 245 8.697 26.011 1.154 1.00 18.33 C ATOM 211 H ILE A 245 8.706 27.782 -2.348 1.00 0.00 H ATOM 212 HA ILE A 245 9.397 25.069 -2.874 1.00 0.00 H ATOM 213 HB ILE A 245 7.240 26.267 -1.100 1.00 0.00 H ATOM 214 HG12 ILE A 245 9.801 26.467 -0.642 1.00 0.00 H ATOM 215 HG13 ILE A 245 9.719 24.740 -0.266 1.00 0.00 H ATOM 216 HD11 ILE A 245 9.573 26.104 1.796 1.00 0.00 H ATOM 217 HD12 ILE A 245 8.149 26.953 1.149 1.00 0.00 H ATOM 218 HD13 ILE A 245 8.052 25.217 1.531 1.00 0.00 H ATOM 219 HG21 ILE A 245 6.555 24.004 -1.838 1.00 0.00 H ATOM 220 HG22 ILE A 245 6.987 24.030 -0.112 1.00 0.00 H ATOM 221 HG23 ILE A 245 8.127 23.363 -1.305 1.00 0.00 H ATOM 222 N GLN A 246 6.471 26.066 -4.078 1.00 19.21 N ATOM 223 CA GLN A 246 5.444 25.692 -5.044 1.00 20.44 C ATOM 224 C GLN A 246 6.031 25.465 -6.435 1.00 19.66 C ATOM 225 O GLN A 246 5.643 24.521 -7.126 1.00 18.62 O ATOM 226 CB GLN A 246 4.343 26.745 -5.145 1.00 21.99 C ATOM 227 CG GLN A 246 3.541 26.937 -3.896 1.00 23.71 C ATOM 228 CD GLN A 246 2.559 28.066 -4.053 1.00 24.36 C ATOM 229 OE1 GLN A 246 1.510 27.898 -4.664 1.00 26.12 O ATOM 230 NE2 GLN A 246 2.903 29.232 -3.529 1.00 25.44 N ATOM 231 H GLN A 246 6.441 26.975 -3.639 1.00 0.00 H ATOM 232 HA GLN A 246 4.990 24.758 -4.711 1.00 0.00 H ATOM 233 HB2 GLN A 246 4.808 27.698 -5.399 1.00 0.00 H ATOM 234 HB3 GLN A 246 3.666 26.463 -5.952 1.00 0.00 H ATOM 235 HG2 GLN A 246 4.216 27.164 -3.071 1.00 0.00 H ATOM 236 HG3 GLN A 246 2.999 26.018 -3.673 1.00 0.00 H ATOM 237 HE21 GLN A 246 3.783 29.327 -3.043 1.00 0.00 H ATOM 238 HE22 GLN A 246 2.285 30.026 -3.615 1.00 0.00 H ATOM 239 N PHE A 247 6.936 26.352 -6.847 1.00 18.71 N ATOM 240 CA PHE A 247 7.570 26.243 -8.148 1.00 18.88 C ATOM 241 C PHE A 247 8.265 24.902 -8.248 1.00 18.13 C ATOM 242 O PHE A 247 8.198 24.223 -9.268 1.00 19.95 O ATOM 243 CB PHE A 247 8.625 27.337 -8.359 1.00 19.27 C ATOM 244 CG PHE A 247 8.078 28.737 -8.498 1.00 20.00 C ATOM 245 CD1 PHE A 247 6.831 28.989 -9.069 1.00 21.19 C ATOM 246 CD2 PHE A 247 8.850 29.818 -8.104 1.00 20.36 C ATOM 247 CE1 PHE A 247 6.366 30.295 -9.209 1.00 21.01 C ATOM 248 CE2 PHE A 247 8.394 31.116 -8.249 1.00 20.48 C ATOM 249 CZ PHE A 247 7.154 31.356 -8.793 1.00 20.65 C ATOM 250 H PHE A 247 7.187 27.119 -6.239 1.00 0.00 H ATOM 251 HA PHE A 247 6.812 26.317 -8.927 1.00 0.00 H ATOM 252 HB2 PHE A 247 9.302 27.322 -7.505 1.00 0.00 H ATOM 253 HB3 PHE A 247 9.196 27.098 -9.256 1.00 0.00 H ATOM 254 HD1 PHE A 247 6.220 28.164 -9.406 1.00 0.00 H ATOM 255 HD2 PHE A 247 9.826 29.644 -7.676 1.00 0.00 H ATOM 256 HE1 PHE A 247 5.393 30.480 -9.641 1.00 0.00 H ATOM 257 HE2 PHE A 247 9.013 31.943 -7.934 1.00 0.00 H ATOM 258 HZ PHE A 247 6.795 32.369 -8.896 1.00 0.00 H ATOM 259 N ALA A 248 8.941 24.538 -7.176 1.00 17.29 N ATOM 260 CA ALA A 248 9.714 23.316 -7.135 1.00 17.52 C ATOM 261 C ALA A 248 8.802 22.110 -7.287 1.00 17.01 C ATOM 262 O ALA A 248 9.000 21.296 -8.178 1.00 18.25 O ATOM 263 CB ALA A 248 10.521 23.241 -5.826 1.00 16.00 C ATOM 264 H ALA A 248 8.918 25.131 -6.358 1.00 0.00 H ATOM 265 HA ALA A 248 10.414 23.324 -7.970 1.00 0.00 H ATOM 266 HB1 ALA A 248 11.099 22.317 -5.807 1.00 0.00 H ATOM 267 HB2 ALA A 248 11.198 24.093 -5.767 1.00 0.00 H ATOM 268 HB3 ALA A 248 9.838 23.260 -4.977 1.00 0.00 H ATOM 269 N ILE A 249 7.787 22.011 -6.434 1.00 17.50 N ATOM 270 CA ILE A 249 6.854 20.887 -6.491 1.00 16.42 C ATOM 271 C ILE A 249 6.095 20.838 -7.827 1.00 16.29 C ATOM 272 O ILE A 249 5.892 19.759 -8.399 1.00 16.63 O ATOM 273 CB ILE A 249 5.840 20.932 -5.327 1.00 15.70 C ATOM 274 CG1 ILE A 249 6.565 20.750 -3.988 1.00 15.49 C ATOM 275 CG2 ILE A 249 4.754 19.858 -5.514 1.00 14.30 C ATOM 276 CD1 ILE A 249 5.715 21.109 -2.766 1.00 14.83 C ATOM 277 H ILE A 249 7.658 22.726 -5.733 1.00 0.00 H ATOM 278 HA ILE A 249 7.431 19.967 -6.399 1.00 0.00 H ATOM 279 HB ILE A 249 5.359 21.910 -5.327 1.00 0.00 H ATOM 280 HG12 ILE A 249 6.867 19.706 -3.901 1.00 0.00 H ATOM 281 HG13 ILE A 249 7.459 21.374 -3.987 1.00 0.00 H ATOM 282 HD11 ILE A 249 6.299 20.954 -1.859 1.00 0.00 H ATOM 283 HD12 ILE A 249 4.829 20.475 -2.741 1.00 0.00 H ATOM 284 HD13 ILE A 249 5.412 22.154 -2.829 1.00 0.00 H ATOM 285 HG21 ILE A 249 4.049 19.905 -4.684 1.00 0.00 H ATOM 286 HG22 ILE A 249 5.219 18.872 -5.540 1.00 0.00 H ATOM 287 HG23 ILE A 249 4.225 20.035 -6.451 1.00 0.00 H ATOM 288 N ASN A 250 5.675 21.993 -8.329 1.00 15.99 N ATOM 289 CA ASN A 250 4.913 22.016 -9.574 1.00 17.18 C ATOM 290 C ASN A 250 5.748 21.733 -10.824 1.00 16.87 C ATOM 291 O ASN A 250 5.182 21.583 -11.901 1.00 15.95 O ATOM 292 CB ASN A 250 4.150 23.335 -9.733 1.00 18.67 C ATOM 293 CG ASN A 250 2.921 23.407 -8.839 1.00 19.92 C ATOM 294 OD1 ASN A 250 2.374 22.373 -8.436 1.00 20.16 O ATOM 295 ND2 ASN A 250 2.478 24.625 -8.530 1.00 19.80 N ATOM 296 H ASN A 250 5.883 22.857 -7.849 1.00 0.00 H ATOM 297 HA ASN A 250 4.167 21.224 -9.504 1.00 0.00 H ATOM 298 HB2 ASN A 250 4.817 24.158 -9.477 1.00 0.00 H ATOM 299 HB3 ASN A 250 3.839 23.441 -10.772 1.00 0.00 H ATOM 300 HD21 ASN A 250 2.956 25.441 -8.884 1.00 0.00 H ATOM 301 HD22 ASN A 250 1.664 24.732 -7.942 1.00 0.00 H ATOM 302 N SER A 251 7.072 21.660 -10.683 1.00 16.32 N ATOM 303 CA SER A 251 7.948 21.335 -11.817 1.00 16.71 C ATOM 304 C SER A 251 7.920 19.842 -12.149 1.00 17.22 C ATOM 305 O SER A 251 8.369 19.446 -13.200 1.00 17.93 O ATOM 306 CB SER A 251 9.386 21.805 -11.551 1.00 16.63 C ATOM 307 OG SER A 251 10.046 21.031 -10.561 1.00 16.47 O ATOM 308 H SER A 251 7.482 21.832 -9.776 1.00 0.00 H ATOM 309 HA SER A 251 7.578 21.876 -12.688 1.00 0.00 H ATOM 310 HB2 SER A 251 9.357 22.843 -11.219 1.00 0.00 H ATOM 311 HB3 SER A 251 9.953 21.748 -12.480 1.00 0.00 H ATOM 312 HG SER A 251 9.965 21.465 -9.708 1.00 0.00 H ATOM 313 N THR A 252 7.359 19.026 -11.263 1.00 18.53 N ATOM 314 CA THR A 252 7.330 17.581 -11.436 1.00 18.91 C ATOM 315 C THR A 252 5.999 17.135 -12.035 1.00 20.91 C ATOM 316 O THR A 252 4.962 17.750 -11.782 1.00 21.51 O ATOM 317 CB THR A 252 7.518 16.892 -10.082 1.00 19.03 C ATOM 318 OG1 THR A 252 6.418 17.229 -9.219 1.00 17.70 O ATOM 319 CG2 THR A 252 8.832 17.348 -9.432 1.00 18.28 C ATOM 320 H THR A 252 6.936 19.424 -10.437 1.00 0.00 H ATOM 321 HA THR A 252 8.139 17.285 -12.103 1.00 0.00 H ATOM 322 HB THR A 252 7.544 15.812 -10.228 1.00 0.00 H ATOM 323 HG1 THR A 252 6.685 17.928 -8.618 1.00 0.00 H ATOM 324 HG21 THR A 252 8.954 16.851 -8.470 1.00 0.00 H ATOM 325 HG22 THR A 252 8.808 18.427 -9.282 1.00 0.00 H ATOM 326 HG23 THR A 252 9.668 17.090 -10.082 1.00 0.00 H ATOM 327 N GLU A 253 6.028 16.062 -12.820 1.00 21.59 N ATOM 328 CA GLU A 253 4.816 15.506 -13.425 1.00 22.80 C ATOM 329 C GLU A 253 3.822 15.013 -12.366 1.00 23.56 C ATOM 330 O GLU A 253 2.613 15.169 -12.525 1.00 24.44 O ATOM 331 CB GLU A 253 5.200 14.367 -14.374 1.00 23.06 C ATOM 332 CG GLU A 253 4.074 13.704 -15.131 1.00 23.47 C ATOM 333 CD GLU A 253 4.500 12.365 -15.714 1.00 23.89 C ATOM 334 OE1 GLU A 253 4.906 11.482 -14.930 1.00 24.50 O ATOM 335 OE2 GLU A 253 4.431 12.187 -16.949 1.00 23.96 O ATOM 336 H GLU A 253 6.915 15.616 -13.005 1.00 0.00 H ATOM 337 HA GLU A 253 4.334 16.290 -14.009 1.00 0.00 H ATOM 338 HB2 GLU A 253 5.697 13.598 -13.782 1.00 0.00 H ATOM 339 HB3 GLU A 253 5.916 14.755 -15.099 1.00 0.00 H ATOM 340 HG2 GLU A 253 3.761 14.359 -15.944 1.00 0.00 H ATOM 341 HG3 GLU A 253 3.233 13.547 -14.455 1.00 0.00 H ATOM 342 N ARG A 254 4.337 14.426 -11.292 1.00 23.65 N ATOM 343 CA ARG A 254 3.503 13.884 -10.226 1.00 24.18 C ATOM 344 C ARG A 254 3.085 14.941 -9.202 1.00 23.21 C ATOM 345 O ARG A 254 2.362 14.630 -8.263 1.00 22.17 O ATOM 346 CB ARG A 254 4.259 12.769 -9.496 1.00 25.86 C ATOM 347 CG ARG A 254 4.607 11.569 -10.351 1.00 26.95 C ATOM 348 CD ARG A 254 3.402 10.710 -10.591 1.00 28.56 C ATOM 349 NE ARG A 254 2.876 10.126 -9.353 1.00 30.17 N ATOM 350 CZ ARG A 254 3.090 8.876 -8.932 1.00 31.45 C ATOM 351 NH1 ARG A 254 3.840 8.022 -9.630 1.00 31.68 N ATOM 352 NH2 ARG A 254 2.540 8.469 -7.791 1.00 32.01 N ATOM 353 H ARG A 254 5.341 14.352 -11.211 1.00 0.00 H ATOM 354 HA ARG A 254 2.604 13.459 -10.672 1.00 0.00 H ATOM 355 HB2 ARG A 254 3.639 12.426 -8.668 1.00 0.00 H ATOM 356 HB3 ARG A 254 5.181 13.184 -9.090 1.00 0.00 H ATOM 357 HG2 ARG A 254 4.994 11.915 -11.309 1.00 0.00 H ATOM 358 HG3 ARG A 254 5.373 10.980 -9.847 1.00 0.00 H ATOM 359 HD2 ARG A 254 3.677 9.902 -11.269 1.00 0.00 H ATOM 360 HD3 ARG A 254 2.623 11.314 -11.057 1.00 0.00 H ATOM 361 HE ARG A 254 2.303 10.719 -8.769 1.00 0.00 H ATOM 362 HH11 ARG A 254 4.263 8.315 -10.499 1.00 0.00 H ATOM 363 HH12 ARG A 254 3.985 7.082 -9.290 1.00 0.00 H ATOM 364 HH21 ARG A 254 2.694 7.526 -7.464 1.00 0.00 H ATOM 365 HH22 ARG A 254 1.968 9.103 -7.252 1.00 0.00 H ATOM 366 N LYS A 255 3.567 16.172 -9.367 1.00 22.85 N ATOM 367 CA LYS A 255 3.296 17.267 -8.435 1.00 22.03 C ATOM 368 C LYS A 255 3.647 16.897 -6.996 1.00 21.56 C ATOM 369 O LYS A 255 2.889 17.163 -6.062 1.00 20.29 O ATOM 370 CB LYS A 255 1.843 17.734 -8.550 1.00 22.82 C ATOM 371 CG LYS A 255 1.411 18.066 -9.982 1.00 23.22 C ATOM 372 CD LYS A 255 2.202 19.232 -10.573 1.00 23.57 C ATOM 373 CE LYS A 255 1.727 19.544 -11.988 1.00 23.82 C ATOM 374 NZ LYS A 255 2.375 20.767 -12.559 1.00 24.09 N ATOM 375 H LYS A 255 4.147 16.358 -10.173 1.00 0.00 H ATOM 376 HA LYS A 255 3.932 18.105 -8.721 1.00 0.00 H ATOM 377 HB2 LYS A 255 1.197 16.942 -8.171 1.00 0.00 H ATOM 378 HB3 LYS A 255 1.710 18.621 -7.930 1.00 0.00 H ATOM 379 HG2 LYS A 255 1.565 17.186 -10.607 1.00 0.00 H ATOM 380 HG3 LYS A 255 0.351 18.320 -9.983 1.00 0.00 H ATOM 381 HD2 LYS A 255 3.259 18.969 -10.601 1.00 0.00 H ATOM 382 HD3 LYS A 255 2.067 20.113 -9.946 1.00 0.00 H ATOM 383 HE2 LYS A 255 0.648 19.699 -11.967 1.00 0.00 H ATOM 384 HE3 LYS A 255 1.950 18.693 -12.631 1.00 0.00 H ATOM 385 HZ1 LYS A 255 1.704 21.521 -12.589 1.00 0.00 H ATOM 386 HZ2 LYS A 255 2.701 20.569 -13.494 1.00 0.00 H ATOM 387 HZ3 LYS A 255 3.157 21.036 -11.980 1.00 0.00 H ATOM 388 N ARG A 256 4.811 16.274 -6.834 1.00 21.15 N ATOM 389 CA ARG A 256 5.355 15.964 -5.518 1.00 21.07 C ATOM 390 C ARG A 256 6.878 15.964 -5.580 1.00 20.37 C ATOM 391 O ARG A 256 7.468 15.774 -6.642 1.00 19.21 O ATOM 392 CB ARG A 256 4.839 14.614 -5.028 1.00 21.74 C ATOM 393 CG ARG A 256 5.423 13.441 -5.781 1.00 23.41 C ATOM 394 CD ARG A 256 4.713 12.160 -5.457 1.00 24.01 C ATOM 395 NE ARG A 256 5.305 11.039 -6.177 1.00 25.08 N ATOM 396 CZ ARG A 256 4.892 9.779 -6.073 1.00 26.24 C ATOM 397 NH1 ARG A 256 5.489 8.824 -6.771 1.00 26.45 N ATOM 398 NH2 ARG A 256 3.878 9.465 -5.274 1.00 27.45 N ATOM 399 H ARG A 256 5.337 16.006 -7.653 1.00 0.00 H ATOM 400 HA ARG A 256 5.034 16.735 -4.818 1.00 0.00 H ATOM 401 HB2 ARG A 256 3.755 14.595 -5.145 1.00 0.00 H ATOM 402 HB3 ARG A 256 5.080 14.508 -3.970 1.00 0.00 H ATOM 403 HG2 ARG A 256 6.475 13.339 -5.513 1.00 0.00 H ATOM 404 HG3 ARG A 256 5.345 13.631 -6.852 1.00 0.00 H ATOM 405 HD2 ARG A 256 4.785 11.974 -4.385 1.00 0.00 H ATOM 406 HD3 ARG A 256 3.663 12.251 -5.735 1.00 0.00 H ATOM 407 HE ARG A 256 6.080 11.232 -6.796 1.00 0.00 H ATOM 408 HH11 ARG A 256 5.173 7.868 -6.692 1.00 0.00 H ATOM 409 HH12 ARG A 256 6.260 9.052 -7.382 1.00 0.00 H ATOM 410 HH21 ARG A 256 3.415 10.186 -4.739 1.00 0.00 H ATOM 411 HH22 ARG A 256 3.570 8.506 -5.202 1.00 0.00 H ATOM 412 N MET A 257 7.516 16.189 -4.440 1.00 20.12 N ATOM 413 CA MET A 257 8.968 16.286 -4.406 1.00 20.28 C ATOM 414 C MET A 257 9.477 16.066 -2.993 1.00 18.72 C ATOM 415 O MET A 257 8.890 16.578 -2.029 1.00 18.68 O ATOM 416 CB MET A 257 9.401 17.662 -4.919 1.00 21.85 C ATOM 417 CG MET A 257 10.886 17.834 -5.117 1.00 23.32 C ATOM 418 SD MET A 257 11.266 19.403 -5.927 1.00 25.39 S ATOM 419 CE MET A 257 11.461 18.908 -7.634 1.00 22.62 C ATOM 420 H MET A 257 6.989 16.294 -3.585 1.00 0.00 H ATOM 421 HA MET A 257 9.388 15.519 -5.056 1.00 0.00 H ATOM 422 HB2 MET A 257 8.911 17.834 -5.877 1.00 0.00 H ATOM 423 HB3 MET A 257 9.056 18.418 -4.213 1.00 0.00 H ATOM 424 HG2 MET A 257 11.378 17.809 -4.145 1.00 0.00 H ATOM 425 HG3 MET A 257 11.262 17.015 -5.730 1.00 0.00 H ATOM 426 HE1 MET A 257 12.465 19.163 -7.974 1.00 0.00 H ATOM 427 HE2 MET A 257 10.726 19.428 -8.249 1.00 0.00 H ATOM 428 HE3 MET A 257 11.311 17.832 -7.720 1.00 0.00 H ATOM 429 N THR A 258 10.554 15.295 -2.873 1.00 16.06 N ATOM 430 CA THR A 258 11.238 15.121 -1.599 1.00 15.93 C ATOM 431 C THR A 258 11.881 16.440 -1.146 1.00 16.20 C ATOM 432 O THR A 258 12.184 17.315 -1.965 1.00 16.04 O ATOM 433 CB THR A 258 12.362 14.072 -1.696 1.00 15.58 C ATOM 434 OG1 THR A 258 13.376 14.566 -2.582 1.00 15.81 O ATOM 435 CG2 THR A 258 11.825 12.728 -2.198 1.00 13.76 C ATOM 436 H THR A 258 10.908 14.816 -3.689 1.00 0.00 H ATOM 437 HA THR A 258 10.516 14.801 -0.848 1.00 0.00 H ATOM 438 HB THR A 258 12.797 13.930 -0.707 1.00 0.00 H ATOM 439 HG1 THR A 258 14.120 13.960 -2.586 1.00 0.00 H ATOM 440 HG21 THR A 258 12.642 12.009 -2.256 1.00 0.00 H ATOM 441 HG22 THR A 258 11.065 12.360 -1.508 1.00 0.00 H ATOM 442 HG23 THR A 258 11.385 12.859 -3.187 1.00 0.00 H ATOM 443 N LEU A 259 12.104 16.572 0.159 1.00 16.38 N ATOM 444 CA LEU A 259 12.743 17.774 0.700 1.00 16.67 C ATOM 445 C LEU A 259 14.114 18.035 0.056 1.00 16.95 C ATOM 446 O LEU A 259 14.397 19.163 -0.347 1.00 17.39 O ATOM 447 CB LEU A 259 12.878 17.684 2.223 1.00 17.00 C ATOM 448 CG LEU A 259 13.521 18.866 2.972 1.00 17.05 C ATOM 449 CD1 LEU A 259 12.680 20.148 2.851 1.00 16.80 C ATOM 450 CD2 LEU A 259 13.775 18.491 4.437 1.00 15.81 C ATOM 451 H LEU A 259 11.828 15.831 0.787 1.00 0.00 H ATOM 452 HA LEU A 259 12.100 18.624 0.472 1.00 0.00 H ATOM 453 HB2 LEU A 259 13.477 16.800 2.442 1.00 0.00 H ATOM 454 HB3 LEU A 259 11.883 17.526 2.639 1.00 0.00 H ATOM 455 HG LEU A 259 14.488 19.062 2.510 1.00 0.00 H ATOM 456 HD21 LEU A 259 14.230 19.335 4.955 1.00 0.00 H ATOM 457 HD22 LEU A 259 12.829 18.238 4.916 1.00 0.00 H ATOM 458 HD23 LEU A 259 14.446 17.633 4.481 1.00 0.00 H ATOM 459 HD11 LEU A 259 12.521 20.381 1.798 1.00 0.00 H ATOM 460 HD12 LEU A 259 11.717 19.998 3.339 1.00 0.00 H ATOM 461 HD13 LEU A 259 13.205 20.974 3.331 1.00 0.00 H ATOM 462 N LYS A 260 14.951 17.002 -0.056 1.00 17.05 N ATOM 463 CA LYS A 260 16.265 17.157 -0.678 1.00 18.07 C ATOM 464 C LYS A 260 16.114 17.749 -2.066 1.00 17.95 C ATOM 465 O LYS A 260 16.807 18.695 -2.432 1.00 18.24 O ATOM 466 CB LYS A 260 16.986 15.815 -0.807 1.00 19.33 C ATOM 467 CG LYS A 260 17.661 15.340 0.446 1.00 20.41 C ATOM 468 CD LYS A 260 18.375 13.995 0.223 1.00 20.95 C ATOM 469 CE LYS A 260 18.519 13.198 1.523 1.00 21.22 C ATOM 470 NZ LYS A 260 19.084 11.831 1.292 1.00 21.92 N ATOM 471 H LYS A 260 14.672 16.097 0.295 1.00 0.00 H ATOM 472 HA LYS A 260 16.870 17.829 -0.069 1.00 0.00 H ATOM 473 HB2 LYS A 260 17.744 15.911 -1.585 1.00 0.00 H ATOM 474 HB3 LYS A 260 16.263 15.061 -1.118 1.00 0.00 H ATOM 475 HG2 LYS A 260 16.912 15.218 1.228 1.00 0.00 H ATOM 476 HG3 LYS A 260 18.391 16.084 0.763 1.00 0.00 H ATOM 477 HD2 LYS A 260 17.798 13.405 -0.489 1.00 0.00 H ATOM 478 HD3 LYS A 260 19.366 14.183 -0.191 1.00 0.00 H ATOM 479 HE2 LYS A 260 19.182 13.742 2.196 1.00 0.00 H ATOM 480 HE3 LYS A 260 17.539 13.102 1.991 1.00 0.00 H ATOM 481 HZ1 LYS A 260 19.161 11.344 2.174 1.00 0.00 H ATOM 482 HZ2 LYS A 260 18.474 11.315 0.675 1.00 0.00 H ATOM 483 HZ3 LYS A 260 19.999 11.911 0.871 1.00 0.00 H ATOM 484 N ASP A 261 15.198 17.184 -2.843 1.00 17.40 N ATOM 485 CA ASP A 261 14.993 17.655 -4.204 1.00 17.28 C ATOM 486 C ASP A 261 14.513 19.095 -4.251 1.00 17.51 C ATOM 487 O ASP A 261 14.865 19.806 -5.180 1.00 18.81 O ATOM 488 CB ASP A 261 14.059 16.716 -4.968 1.00 17.56 C ATOM 489 CG ASP A 261 14.749 15.430 -5.380 1.00 17.97 C ATOM 490 OD1 ASP A 261 15.976 15.319 -5.194 1.00 18.46 O ATOM 491 OD2 ASP A 261 14.079 14.532 -5.916 1.00 18.93 O ATOM 492 H ASP A 261 14.639 16.422 -2.487 1.00 0.00 H ATOM 493 HA ASP A 261 15.961 17.623 -4.704 1.00 0.00 H ATOM 494 HB2 ASP A 261 13.705 17.226 -5.864 1.00 0.00 H ATOM 495 HB3 ASP A 261 13.205 16.474 -4.336 1.00 0.00 H ATOM 496 N ILE A 262 13.742 19.531 -3.246 1.00 17.26 N ATOM 497 CA ILE A 262 13.317 20.933 -3.157 1.00 16.80 C ATOM 498 C ILE A 262 14.518 21.851 -2.893 1.00 17.44 C ATOM 499 O ILE A 262 14.632 22.925 -3.502 1.00 17.97 O ATOM 500 CB ILE A 262 12.221 21.148 -2.066 1.00 17.07 C ATOM 501 CG1 ILE A 262 10.916 20.449 -2.463 1.00 17.35 C ATOM 502 CG2 ILE A 262 11.945 22.609 -1.842 1.00 16.21 C ATOM 503 CD1 ILE A 262 9.897 20.386 -1.329 1.00 16.78 C ATOM 504 H ILE A 262 13.446 18.880 -2.533 1.00 0.00 H ATOM 505 HA ILE A 262 12.889 21.213 -4.119 1.00 0.00 H ATOM 506 HB ILE A 262 12.575 20.715 -1.130 1.00 0.00 H ATOM 507 HG12 ILE A 262 11.150 19.431 -2.775 1.00 0.00 H ATOM 508 HG13 ILE A 262 10.473 20.982 -3.304 1.00 0.00 H ATOM 509 HD11 ILE A 262 8.997 19.879 -1.677 1.00 0.00 H ATOM 510 HD12 ILE A 262 10.322 19.836 -0.489 1.00 0.00 H ATOM 511 HD13 ILE A 262 9.645 21.397 -1.011 1.00 0.00 H ATOM 512 HG21 ILE A 262 12.868 23.115 -1.559 1.00 0.00 H ATOM 513 HG22 ILE A 262 11.210 22.722 -1.045 1.00 0.00 H ATOM 514 HG23 ILE A 262 11.556 23.050 -2.760 1.00 0.00 H ATOM 515 N TYR A 263 15.417 21.439 -1.998 1.00 17.38 N ATOM 516 CA TYR A 263 16.645 22.207 -1.781 1.00 18.15 C ATOM 517 C TYR A 263 17.379 22.333 -3.098 1.00 17.60 C ATOM 518 O TYR A 263 17.769 23.431 -3.500 1.00 17.70 O ATOM 519 CB TYR A 263 17.599 21.525 -0.789 1.00 18.32 C ATOM 520 CG TYR A 263 17.123 21.406 0.639 1.00 18.87 C ATOM 521 CD1 TYR A 263 16.319 22.388 1.240 1.00 19.86 C ATOM 522 CD2 TYR A 263 17.526 20.323 1.418 1.00 18.70 C ATOM 523 CE1 TYR A 263 15.917 22.274 2.585 1.00 18.61 C ATOM 524 CE2 TYR A 263 17.128 20.195 2.731 1.00 18.27 C ATOM 525 CZ TYR A 263 16.328 21.172 3.317 1.00 18.59 C ATOM 526 OH TYR A 263 15.965 21.011 4.647 1.00 18.58 O ATOM 527 H TYR A 263 15.250 20.595 -1.469 1.00 0.00 H ATOM 528 HA TYR A 263 16.390 23.201 -1.413 1.00 0.00 H ATOM 529 HB2 TYR A 263 18.528 22.094 -0.781 1.00 0.00 H ATOM 530 HB3 TYR A 263 17.817 20.523 -1.160 1.00 0.00 H ATOM 531 HD1 TYR A 263 16.004 23.244 0.662 1.00 0.00 H ATOM 532 HD2 TYR A 263 18.164 19.568 0.983 1.00 0.00 H ATOM 533 HE1 TYR A 263 15.298 23.034 3.039 1.00 0.00 H ATOM 534 HE2 TYR A 263 17.437 19.335 3.307 1.00 0.00 H ATOM 535 HH TYR A 263 15.022 21.166 4.742 1.00 0.00 H ATOM 536 N THR A 264 17.579 21.192 -3.753 1.00 17.61 N ATOM 537 CA THR A 264 18.311 21.129 -5.029 1.00 16.97 C ATOM 538 C THR A 264 17.671 21.996 -6.110 1.00 16.74 C ATOM 539 O THR A 264 18.374 22.697 -6.842 1.00 17.98 O ATOM 540 CB THR A 264 18.394 19.682 -5.545 1.00 16.31 C ATOM 541 OG1 THR A 264 19.170 18.913 -4.635 1.00 15.74 O ATOM 542 CG2 THR A 264 19.041 19.613 -6.923 1.00 16.22 C ATOM 543 H THR A 264 17.215 20.336 -3.360 1.00 0.00 H ATOM 544 HA THR A 264 19.326 21.489 -4.859 1.00 0.00 H ATOM 545 HB THR A 264 17.389 19.264 -5.600 1.00 0.00 H ATOM 546 HG1 THR A 264 18.628 18.664 -3.883 1.00 0.00 H ATOM 547 HG21 THR A 264 19.082 18.575 -7.254 1.00 0.00 H ATOM 548 HG22 THR A 264 20.052 20.018 -6.870 1.00 0.00 H ATOM 549 HG23 THR A 264 18.452 20.197 -7.630 1.00 0.00 H ATOM 550 N TRP A 265 16.348 21.944 -6.217 1.00 16.42 N ATOM 551 CA TRP A 265 15.644 22.701 -7.258 1.00 16.49 C ATOM 552 C TRP A 265 15.857 24.196 -7.042 1.00 16.62 C ATOM 553 O TRP A 265 16.201 24.925 -7.969 1.00 17.30 O ATOM 554 CB TRP A 265 14.155 22.357 -7.282 1.00 16.45 C ATOM 555 CG TRP A 265 13.443 22.948 -8.444 1.00 16.61 C ATOM 556 CD1 TRP A 265 13.163 22.331 -9.620 1.00 17.48 C ATOM 557 CD2 TRP A 265 12.924 24.278 -8.555 1.00 16.25 C ATOM 558 NE1 TRP A 265 12.512 23.192 -10.465 1.00 17.84 N ATOM 559 CE2 TRP A 265 12.349 24.395 -9.832 1.00 17.13 C ATOM 560 CE3 TRP A 265 12.897 25.382 -7.704 1.00 16.02 C ATOM 561 CZ2 TRP A 265 11.757 25.576 -10.283 1.00 17.39 C ATOM 562 CZ3 TRP A 265 12.307 26.550 -8.150 1.00 16.58 C ATOM 563 CH2 TRP A 265 11.747 26.642 -9.423 1.00 17.12 C ATOM 564 H TRP A 265 15.819 21.375 -5.572 1.00 0.00 H ATOM 565 HA TRP A 265 16.072 22.432 -8.224 1.00 0.00 H ATOM 566 HB2 TRP A 265 13.697 22.732 -6.367 1.00 0.00 H ATOM 567 HB3 TRP A 265 14.044 21.273 -7.314 1.00 0.00 H ATOM 568 HD1 TRP A 265 13.417 21.308 -9.856 1.00 0.00 H ATOM 569 HE3 TRP A 265 13.329 25.326 -6.716 1.00 0.00 H ATOM 570 HZ2 TRP A 265 11.324 25.646 -11.270 1.00 0.00 H ATOM 571 HZ3 TRP A 265 12.279 27.410 -7.498 1.00 0.00 H ATOM 572 HH2 TRP A 265 11.296 27.572 -9.737 1.00 0.00 H ATOM 573 HE1 TRP A 265 12.203 22.974 -11.402 1.00 0.00 H ATOM 574 N ILE A 266 15.682 24.639 -5.805 1.00 17.79 N ATOM 575 CA ILE A 266 15.868 26.047 -5.447 1.00 19.26 C ATOM 576 C ILE A 266 17.326 26.502 -5.654 1.00 18.62 C ATOM 577 O ILE A 266 17.565 27.550 -6.264 1.00 17.53 O ATOM 578 CB ILE A 266 15.387 26.325 -3.998 1.00 19.86 C ATOM 579 CG1 ILE A 266 13.858 26.225 -3.940 1.00 20.75 C ATOM 580 CG2 ILE A 266 15.830 27.711 -3.541 1.00 20.49 C ATOM 581 CD1 ILE A 266 13.278 26.007 -2.556 1.00 20.46 C ATOM 582 H ILE A 266 15.411 23.984 -5.085 1.00 0.00 H ATOM 583 HA ILE A 266 15.244 26.639 -6.117 1.00 0.00 H ATOM 584 HB ILE A 266 15.817 25.577 -3.332 1.00 0.00 H ATOM 585 HG12 ILE A 266 13.444 27.152 -4.337 1.00 0.00 H ATOM 586 HG13 ILE A 266 13.541 25.403 -4.581 1.00 0.00 H ATOM 587 HG21 ILE A 266 16.917 27.778 -3.584 1.00 0.00 H ATOM 588 HG22 ILE A 266 15.496 27.880 -2.517 1.00 0.00 H ATOM 589 HG23 ILE A 266 15.394 28.466 -4.195 1.00 0.00 H ATOM 590 HD11 ILE A 266 12.191 25.950 -2.622 1.00 0.00 H ATOM 591 HD12 ILE A 266 13.666 25.076 -2.142 1.00 0.00 H ATOM 592 HD13 ILE A 266 13.560 26.838 -1.909 1.00 0.00 H ATOM 593 N GLU A 267 18.285 25.704 -5.178 1.00 18.79 N ATOM 594 CA GLU A 267 19.712 25.961 -5.443 1.00 19.48 C ATOM 595 C GLU A 267 19.981 26.100 -6.934 1.00 18.55 C ATOM 596 O GLU A 267 20.625 27.053 -7.355 1.00 16.76 O ATOM 597 CB GLU A 267 20.597 24.838 -4.882 1.00 20.49 C ATOM 598 CG GLU A 267 20.774 24.902 -3.362 1.00 21.89 C ATOM 599 CD GLU A 267 21.539 23.724 -2.796 1.00 22.17 C ATOM 600 OE1 GLU A 267 21.665 22.699 -3.494 1.00 23.16 O ATOM 601 OE2 GLU A 267 22.008 23.822 -1.647 1.00 22.39 O ATOM 602 H GLU A 267 18.025 24.902 -4.621 1.00 0.00 H ATOM 603 HA GLU A 267 19.990 26.895 -4.955 1.00 0.00 H ATOM 604 HB2 GLU A 267 21.580 24.909 -5.347 1.00 0.00 H ATOM 605 HB3 GLU A 267 20.153 23.877 -5.144 1.00 0.00 H ATOM 606 HG2 GLU A 267 21.315 25.816 -3.115 1.00 0.00 H ATOM 607 HG3 GLU A 267 19.790 24.939 -2.895 1.00 0.00 H ATOM 608 N ASP A 268 19.480 25.148 -7.720 1.00 18.20 N ATOM 609 CA ASP A 268 19.691 25.148 -9.179 1.00 18.81 C ATOM 610 C ASP A 268 19.136 26.404 -9.854 1.00 17.71 C ATOM 611 O ASP A 268 19.768 26.963 -10.740 1.00 16.72 O ATOM 612 CB ASP A 268 19.043 23.914 -9.833 1.00 20.20 C ATOM 613 CG ASP A 268 19.786 22.608 -9.530 1.00 21.56 C ATOM 614 OD1 ASP A 268 20.912 22.647 -8.984 1.00 21.68 O ATOM 615 OD2 ASP A 268 19.228 21.534 -9.848 1.00 22.42 O ATOM 616 H ASP A 268 18.939 24.404 -7.304 1.00 0.00 H ATOM 617 HA ASP A 268 20.764 25.108 -9.367 1.00 0.00 H ATOM 618 HB2 ASP A 268 19.029 24.062 -10.913 1.00 0.00 H ATOM 619 HB3 ASP A 268 18.017 23.825 -9.477 1.00 0.00 H ATOM 620 N HIS A 269 17.958 26.841 -9.423 1.00 16.98 N ATOM 621 CA HIS A 269 17.243 27.924 -10.096 1.00 17.20 C ATOM 622 C HIS A 269 17.497 29.319 -9.523 1.00 17.89 C ATOM 623 O HIS A 269 17.354 30.313 -10.233 1.00 16.90 O ATOM 624 CB HIS A 269 15.752 27.608 -10.112 1.00 16.42 C ATOM 625 CG HIS A 269 15.418 26.445 -10.990 1.00 15.97 C ATOM 626 ND1 HIS A 269 15.446 25.141 -10.541 1.00 15.32 N ATOM 627 CD2 HIS A 269 15.095 26.387 -12.304 1.00 14.23 C ATOM 628 CE1 HIS A 269 15.141 24.333 -11.542 1.00 15.35 C ATOM 629 NE2 HIS A 269 14.911 25.065 -12.617 1.00 13.71 N ATOM 630 H HIS A 269 17.544 26.413 -8.607 1.00 0.00 H ATOM 631 HA HIS A 269 17.580 27.936 -11.133 1.00 0.00 H ATOM 632 HB2 HIS A 269 15.214 28.484 -10.474 1.00 0.00 H ATOM 633 HB3 HIS A 269 15.426 27.388 -9.095 1.00 0.00 H ATOM 634 HD2 HIS A 269 15.000 27.225 -12.979 1.00 0.00 H ATOM 635 HE1 HIS A 269 15.089 23.256 -11.489 1.00 0.00 H ATOM 636 HD1 HIS A 269 15.664 24.850 -9.599 1.00 0.00 H ATOM 637 N PHE A 270 17.875 29.393 -8.251 1.00 18.13 N ATOM 638 CA PHE A 270 18.147 30.663 -7.617 1.00 17.86 C ATOM 639 C PHE A 270 19.508 30.561 -6.937 1.00 18.05 C ATOM 640 O PHE A 270 19.563 30.373 -5.720 1.00 18.75 O ATOM 641 CB PHE A 270 17.054 30.962 -6.592 1.00 18.48 C ATOM 642 CG PHE A 270 15.659 30.935 -7.153 1.00 18.76 C ATOM 643 CD1 PHE A 270 14.799 29.879 -6.864 1.00 19.67 C ATOM 644 CD2 PHE A 270 15.193 31.957 -7.958 1.00 19.75 C ATOM 645 CE1 PHE A 270 13.514 29.845 -7.371 1.00 18.48 C ATOM 646 CE2 PHE A 270 13.897 31.926 -8.472 1.00 20.06 C ATOM 647 CZ PHE A 270 13.063 30.866 -8.171 1.00 19.45 C ATOM 648 H PHE A 270 17.974 28.543 -7.715 1.00 0.00 H ATOM 649 HA PHE A 270 18.171 31.451 -8.369 1.00 0.00 H ATOM 650 HB2 PHE A 270 17.117 30.218 -5.798 1.00 0.00 H ATOM 651 HB3 PHE A 270 17.238 31.947 -6.163 1.00 0.00 H ATOM 652 HD1 PHE A 270 15.142 29.073 -6.233 1.00 0.00 H ATOM 653 HD2 PHE A 270 15.840 32.789 -8.192 1.00 0.00 H ATOM 654 HE1 PHE A 270 12.864 29.015 -7.138 1.00 0.00 H ATOM 655 HE2 PHE A 270 13.546 32.728 -9.104 1.00 0.00 H ATOM 656 HZ PHE A 270 12.058 30.841 -8.565 1.00 0.00 H ATOM 657 N PRO A 271 20.609 30.674 -7.721 1.00 16.61 N ATOM 658 CA PRO A 271 21.980 30.465 -7.253 1.00 16.64 C ATOM 659 C PRO A 271 22.372 31.232 -5.986 1.00 17.04 C ATOM 660 O PRO A 271 23.343 30.857 -5.325 1.00 16.89 O ATOM 661 CB PRO A 271 22.839 30.933 -8.429 1.00 16.46 C ATOM 662 CG PRO A 271 21.963 30.830 -9.615 1.00 16.05 C ATOM 663 CD PRO A 271 20.572 31.050 -9.146 1.00 16.33 C ATOM 664 HA PRO A 271 22.144 29.400 -7.092 1.00 0.00 H ATOM 665 HB2 PRO A 271 23.161 31.964 -8.280 1.00 0.00 H ATOM 666 HB3 PRO A 271 23.705 30.282 -8.544 1.00 0.00 H ATOM 667 HG2 PRO A 271 22.055 29.841 -10.064 1.00 0.00 H ATOM 668 HG3 PRO A 271 22.234 31.594 -10.344 1.00 0.00 H ATOM 669 HD2 PRO A 271 20.285 32.095 -9.263 1.00 0.00 H ATOM 670 HD3 PRO A 271 19.882 30.405 -9.690 1.00 0.00 H ATOM 671 N TYR A 272 21.644 32.295 -5.664 1.00 16.48 N ATOM 672 CA TYR A 272 21.778 32.946 -4.369 1.00 16.78 C ATOM 673 C TYR A 272 21.801 31.934 -3.214 1.00 17.04 C ATOM 674 O TYR A 272 22.612 32.043 -2.302 1.00 15.73 O ATOM 675 CB TYR A 272 20.640 33.948 -4.169 1.00 16.93 C ATOM 676 CG TYR A 272 20.569 34.538 -2.777 1.00 17.10 C ATOM 677 CD1 TYR A 272 21.279 35.684 -2.449 1.00 16.93 C ATOM 678 CD2 TYR A 272 19.787 33.946 -1.791 1.00 17.83 C ATOM 679 CE1 TYR A 272 21.208 36.232 -1.181 1.00 17.46 C ATOM 680 CE2 TYR A 272 19.715 34.484 -0.519 1.00 17.97 C ATOM 681 CZ TYR A 272 20.428 35.627 -0.228 1.00 18.32 C ATOM 682 OH TYR A 272 20.364 36.164 1.028 1.00 20.69 O ATOM 683 H TYR A 272 20.982 32.660 -6.333 1.00 0.00 H ATOM 684 HA TYR A 272 22.720 33.494 -4.360 1.00 0.00 H ATOM 685 HB2 TYR A 272 20.775 34.764 -4.879 1.00 0.00 H ATOM 686 HB3 TYR A 272 19.695 33.450 -4.385 1.00 0.00 H ATOM 687 HD1 TYR A 272 21.898 36.157 -3.197 1.00 0.00 H ATOM 688 HD2 TYR A 272 19.227 33.052 -2.022 1.00 0.00 H ATOM 689 HE1 TYR A 272 21.762 37.128 -0.943 1.00 0.00 H ATOM 690 HE2 TYR A 272 19.106 34.013 0.239 1.00 0.00 H ATOM 691 HH TYR A 272 20.023 37.060 0.976 1.00 0.00 H ATOM 692 N PHE A 273 20.902 30.958 -3.250 1.00 17.22 N ATOM 693 CA PHE A 273 20.847 29.953 -2.210 1.00 17.67 C ATOM 694 C PHE A 273 21.968 28.912 -2.295 1.00 17.93 C ATOM 695 O PHE A 273 22.263 28.271 -1.304 1.00 19.23 O ATOM 696 CB PHE A 273 19.457 29.293 -2.165 1.00 18.93 C ATOM 697 CG PHE A 273 18.358 30.262 -1.845 1.00 18.36 C ATOM 698 CD1 PHE A 273 17.544 30.766 -2.849 1.00 18.06 C ATOM 699 CD2 PHE A 273 18.187 30.722 -0.552 1.00 18.84 C ATOM 700 CE1 PHE A 273 16.574 31.704 -2.571 1.00 17.98 C ATOM 701 CE2 PHE A 273 17.205 31.648 -0.256 1.00 18.74 C ATOM 702 CZ PHE A 273 16.399 32.146 -1.272 1.00 18.69 C ATOM 703 H PHE A 273 20.245 30.916 -4.016 1.00 0.00 H ATOM 704 HA PHE A 273 20.976 30.476 -1.262 1.00 0.00 H ATOM 705 HB2 PHE A 273 19.253 28.846 -3.138 1.00 0.00 H ATOM 706 HB3 PHE A 273 19.464 28.507 -1.410 1.00 0.00 H ATOM 707 HD1 PHE A 273 17.673 30.418 -3.863 1.00 0.00 H ATOM 708 HD2 PHE A 273 18.828 30.353 0.235 1.00 0.00 H ATOM 709 HE1 PHE A 273 15.953 32.093 -3.364 1.00 0.00 H ATOM 710 HE2 PHE A 273 17.065 31.983 0.761 1.00 0.00 H ATOM 711 HZ PHE A 273 15.637 32.877 -1.048 1.00 0.00 H ATOM 712 N LYS A 274 22.598 28.745 -3.452 1.00 18.31 N ATOM 713 CA LYS A 274 23.731 27.823 -3.573 1.00 18.64 C ATOM 714 C LYS A 274 25.048 28.475 -3.155 1.00 19.28 C ATOM 715 O LYS A 274 25.940 27.782 -2.684 1.00 20.42 O ATOM 716 CB LYS A 274 23.821 27.247 -5.001 1.00 19.25 C ATOM 717 CG LYS A 274 25.115 26.479 -5.310 1.00 19.20 C ATOM 718 CD LYS A 274 24.966 25.476 -6.455 0.72 19.08 C ATOM 719 CE LYS A 274 24.278 26.043 -7.692 0.48 18.25 C ATOM 720 NZ LYS A 274 24.228 25.033 -8.777 1.00 16.69 N ATOM 721 H LYS A 274 22.291 29.263 -4.263 1.00 0.00 H ATOM 722 HA LYS A 274 23.549 26.989 -2.895 1.00 0.00 H ATOM 723 HB2 LYS A 274 22.982 26.567 -5.145 1.00 0.00 H ATOM 724 HB3 LYS A 274 23.727 28.068 -5.712 1.00 0.00 H ATOM 725 HG2 LYS A 274 25.888 27.199 -5.579 1.00 0.00 H ATOM 726 HG3 LYS A 274 25.429 25.945 -4.413 1.00 0.00 H ATOM 727 HD2 LYS A 274 24.381 24.630 -6.095 0.72 0.00 H ATOM 728 HD3 LYS A 274 25.956 25.120 -6.739 0.72 0.00 H ATOM 729 HE2 LYS A 274 23.262 26.338 -7.432 0.48 0.00 H ATOM 730 HE3 LYS A 274 24.828 26.917 -8.040 0.48 0.00 H ATOM 731 HZ1 LYS A 274 23.769 25.429 -9.585 1.00 0.00 H ATOM 732 HZ2 LYS A 274 25.168 24.758 -9.025 1.00 0.00 H ATOM 733 HZ3 LYS A 274 23.713 24.224 -8.460 1.00 0.00 H ATOM 734 N HIS A 275 25.161 29.799 -3.288 1.00 19.23 N ATOM 735 CA HIS A 275 26.442 30.482 -3.124 1.00 18.97 C ATOM 736 C HIS A 275 26.506 31.535 -2.040 1.00 19.12 C ATOM 737 O HIS A 275 27.591 31.831 -1.560 1.00 20.76 O ATOM 738 CB HIS A 275 26.845 31.169 -4.424 1.00 19.55 C ATOM 739 CG HIS A 275 27.063 30.227 -5.563 1.00 20.25 C ATOM 740 ND1 HIS A 275 27.950 29.176 -5.503 1.00 19.88 N ATOM 741 CD2 HIS A 275 26.515 30.189 -6.800 1.00 20.60 C ATOM 742 CE1 HIS A 275 27.934 28.524 -6.652 1.00 20.52 C ATOM 743 NE2 HIS A 275 27.067 29.116 -7.455 1.00 20.53 N ATOM 744 H HIS A 275 24.339 30.343 -3.508 1.00 0.00 H ATOM 745 HA HIS A 275 27.195 29.727 -2.899 1.00 0.00 H ATOM 746 HB2 HIS A 275 27.771 31.717 -4.250 1.00 0.00 H ATOM 747 HB3 HIS A 275 26.065 31.878 -4.701 1.00 0.00 H ATOM 748 HD2 HIS A 275 25.781 30.874 -7.197 1.00 0.00 H ATOM 749 HE1 HIS A 275 28.528 27.655 -6.894 1.00 0.00 H ATOM 750 HE2 HIS A 275 26.846 28.826 -8.397 1.00 0.00 H ATOM 751 N ILE A 276 25.385 32.137 -1.672 1.00 18.50 N ATOM 752 CA ILE A 276 25.423 33.265 -0.761 1.00 18.67 C ATOM 753 C ILE A 276 24.671 33.011 0.551 1.00 19.75 C ATOM 754 O ILE A 276 25.261 33.131 1.628 1.00 20.66 O ATOM 755 CB ILE A 276 24.906 34.541 -1.450 1.00 18.09 C ATOM 756 CG1 ILE A 276 25.718 34.789 -2.723 1.00 18.57 C ATOM 757 CG2 ILE A 276 25.026 35.732 -0.508 1.00 17.95 C ATOM 758 CD1 ILE A 276 25.717 36.211 -3.187 1.00 18.75 C ATOM 759 H ILE A 276 24.499 31.809 -2.028 1.00 0.00 H ATOM 760 HA ILE A 276 26.468 33.438 -0.505 1.00 0.00 H ATOM 761 HB ILE A 276 23.858 34.402 -1.717 1.00 0.00 H ATOM 762 HG12 ILE A 276 26.750 34.493 -2.533 1.00 0.00 H ATOM 763 HG13 ILE A 276 25.317 34.162 -3.520 1.00 0.00 H ATOM 764 HD11 ILE A 276 26.002 36.251 -4.238 1.00 0.00 H ATOM 765 HD12 ILE A 276 24.719 36.632 -3.065 1.00 0.00 H ATOM 766 HD13 ILE A 276 26.429 36.787 -2.596 1.00 0.00 H ATOM 767 HG21 ILE A 276 24.734 35.431 0.498 1.00 0.00 H ATOM 768 HG22 ILE A 276 24.372 36.534 -0.851 1.00 0.00 H ATOM 769 HG23 ILE A 276 26.058 36.084 -0.497 1.00 0.00 H ATOM 770 N ALA A 277 23.392 32.653 0.464 1.00 18.91 N ATOM 771 CA ALA A 277 22.571 32.418 1.654 1.00 19.49 C ATOM 772 C ALA A 277 23.309 31.619 2.732 1.00 20.60 C ATOM 773 O ALA A 277 23.951 30.610 2.440 1.00 21.02 O ATOM 774 CB ALA A 277 21.304 31.714 1.282 1.00 17.73 C ATOM 775 H ALA A 277 22.975 32.540 -0.449 1.00 0.00 H ATOM 776 HA ALA A 277 22.306 33.387 2.076 1.00 0.00 H ATOM 777 HB1 ALA A 277 20.705 31.546 2.177 1.00 0.00 H ATOM 778 HB2 ALA A 277 20.741 32.327 0.578 1.00 0.00 H ATOM 779 HB3 ALA A 277 21.543 30.756 0.820 1.00 0.00 H ATOM 780 N LYS A 278 23.220 32.095 3.973 1.00 21.79 N ATOM 781 CA LYS A 278 23.651 31.328 5.148 1.00 22.04 C ATOM 782 C LYS A 278 22.913 29.993 5.211 1.00 21.14 C ATOM 783 O LYS A 278 21.796 29.873 4.702 1.00 20.67 O ATOM 784 CB LYS A 278 23.361 32.100 6.439 1.00 22.20 C ATOM 785 CG LYS A 278 24.242 33.311 6.652 1.00 23.25 C ATOM 786 CD LYS A 278 23.953 33.988 7.981 1.00 23.99 C ATOM 787 CE LYS A 278 22.535 34.539 8.065 1.00 24.06 C ATOM 788 NZ LYS A 278 22.383 35.432 9.265 1.00 24.75 N ATOM 789 H LYS A 278 22.841 33.021 4.111 1.00 0.00 H ATOM 790 HA LYS A 278 24.722 31.140 5.078 1.00 0.00 H ATOM 791 HB2 LYS A 278 22.324 32.433 6.411 1.00 0.00 H ATOM 792 HB3 LYS A 278 23.487 31.424 7.285 1.00 0.00 H ATOM 793 HG2 LYS A 278 24.064 34.023 5.846 1.00 0.00 H ATOM 794 HG3 LYS A 278 25.287 33.001 6.629 1.00 0.00 H ATOM 795 HD2 LYS A 278 24.092 33.260 8.780 1.00 0.00 H ATOM 796 HD3 LYS A 278 24.659 34.806 8.122 1.00 0.00 H ATOM 797 HE2 LYS A 278 21.833 33.709 8.145 1.00 0.00 H ATOM 798 HE3 LYS A 278 22.316 35.109 7.162 1.00 0.00 H ATOM 799 HZ1 LYS A 278 21.438 35.787 9.304 1.00 0.00 H ATOM 800 HZ2 LYS A 278 23.030 36.204 9.194 1.00 0.00 H ATOM 801 HZ3 LYS A 278 22.579 34.905 10.104 1.00 0.00 H ATOM 802 N PRO A 279 23.526 28.989 5.851 1.00 20.23 N ATOM 803 CA PRO A 279 22.918 27.656 5.992 1.00 20.38 C ATOM 804 C PRO A 279 21.428 27.607 6.426 1.00 19.32 C ATOM 805 O PRO A 279 20.695 26.727 5.987 1.00 21.96 O ATOM 806 CB PRO A 279 23.791 26.996 7.050 1.00 19.94 C ATOM 807 CG PRO A 279 25.119 27.655 6.911 1.00 20.30 C ATOM 808 CD PRO A 279 24.899 29.033 6.381 1.00 20.13 C ATOM 809 HA PRO A 279 23.031 27.115 5.053 1.00 0.00 H ATOM 810 HB2 PRO A 279 23.873 25.925 6.867 1.00 0.00 H ATOM 811 HB3 PRO A 279 23.382 27.178 8.044 1.00 0.00 H ATOM 812 HG2 PRO A 279 25.609 27.707 7.883 1.00 0.00 H ATOM 813 HG3 PRO A 279 25.739 27.089 6.216 1.00 0.00 H ATOM 814 HD2 PRO A 279 24.985 29.773 7.176 1.00 0.00 H ATOM 815 HD3 PRO A 279 25.608 29.250 5.582 1.00 0.00 H ATOM 816 N GLY A 280 20.985 28.537 7.259 1.00 17.92 N ATOM 817 CA GLY A 280 19.612 28.534 7.778 1.00 16.54 C ATOM 818 C GLY A 280 18.472 28.668 6.773 1.00 16.85 C ATOM 819 O GLY A 280 17.295 28.526 7.142 1.00 16.30 O ATOM 820 H GLY A 280 21.614 29.273 7.547 1.00 0.00 H ATOM 821 HA2 GLY A 280 19.527 29.365 8.478 1.00 0.00 H ATOM 822 HA3 GLY A 280 19.464 27.608 8.334 1.00 0.00 H ATOM 823 N TRP A 281 18.774 28.935 5.508 1.00 15.56 N ATOM 824 CA TRP A 281 17.696 29.032 4.537 1.00 17.49 C ATOM 825 C TRP A 281 16.930 27.694 4.459 1.00 17.35 C ATOM 826 O TRP A 281 15.735 27.672 4.201 1.00 16.15 O ATOM 827 CB TRP A 281 18.206 29.480 3.160 1.00 18.10 C ATOM 828 CG TRP A 281 18.986 28.444 2.380 1.00 19.06 C ATOM 829 CD1 TRP A 281 20.331 28.218 2.432 1.00 19.81 C ATOM 830 CD2 TRP A 281 18.467 27.528 1.415 1.00 19.83 C ATOM 831 NE1 TRP A 281 20.685 27.205 1.570 1.00 20.02 N ATOM 832 CE2 TRP A 281 19.558 26.772 0.922 1.00 21.37 C ATOM 833 CE3 TRP A 281 17.193 27.283 0.902 1.00 20.23 C ATOM 834 CZ2 TRP A 281 19.406 25.780 -0.058 1.00 21.24 C ATOM 835 CZ3 TRP A 281 17.040 26.294 -0.058 1.00 21.02 C ATOM 836 CH2 TRP A 281 18.142 25.546 -0.523 1.00 21.33 C ATOM 837 H TRP A 281 19.734 29.068 5.225 1.00 0.00 H ATOM 838 HA TRP A 281 16.999 29.791 4.893 1.00 0.00 H ATOM 839 HB2 TRP A 281 18.853 30.345 3.308 1.00 0.00 H ATOM 840 HB3 TRP A 281 17.350 29.789 2.560 1.00 0.00 H ATOM 841 HD1 TRP A 281 21.022 28.759 3.062 1.00 0.00 H ATOM 842 HE3 TRP A 281 16.342 27.853 1.246 1.00 0.00 H ATOM 843 HZ2 TRP A 281 20.253 25.224 -0.430 1.00 0.00 H ATOM 844 HZ3 TRP A 281 16.057 26.092 -0.458 1.00 0.00 H ATOM 845 HH2 TRP A 281 17.984 24.773 -1.261 1.00 0.00 H ATOM 846 HE1 TRP A 281 21.618 26.842 1.437 1.00 0.00 H ATOM 847 N LYS A 282 17.641 26.594 4.681 1.00 15.96 N ATOM 848 CA LYS A 282 17.054 25.272 4.652 1.00 15.10 C ATOM 849 C LYS A 282 16.114 25.056 5.834 1.00 14.37 C ATOM 850 O LYS A 282 15.083 24.435 5.677 1.00 14.54 O ATOM 851 CB LYS A 282 18.155 24.205 4.674 1.00 15.63 C ATOM 852 CG LYS A 282 18.905 24.082 3.359 1.00 15.84 C ATOM 853 CD LYS A 282 19.931 22.938 3.383 1.00 14.66 C ATOM 854 CE LYS A 282 20.617 22.777 2.020 1.00 14.35 C ATOM 855 NZ LYS A 282 21.611 21.640 2.010 1.00 14.34 N ATOM 856 H LYS A 282 18.628 26.684 4.877 1.00 0.00 H ATOM 857 HA LYS A 282 16.484 25.165 3.729 1.00 0.00 H ATOM 858 HB2 LYS A 282 18.869 24.463 5.456 1.00 0.00 H ATOM 859 HB3 LYS A 282 17.705 23.241 4.913 1.00 0.00 H ATOM 860 HG2 LYS A 282 19.428 25.018 3.164 1.00 0.00 H ATOM 861 HG3 LYS A 282 18.189 23.901 2.557 1.00 0.00 H ATOM 862 HD2 LYS A 282 20.687 23.155 4.138 1.00 0.00 H ATOM 863 HD3 LYS A 282 19.424 22.008 3.641 1.00 0.00 H ATOM 864 HE2 LYS A 282 19.855 22.583 1.265 1.00 0.00 H ATOM 865 HE3 LYS A 282 21.135 23.703 1.772 1.00 0.00 H ATOM 866 HZ1 LYS A 282 22.036 21.572 1.096 1.00 0.00 H ATOM 867 HZ2 LYS A 282 21.135 20.775 2.225 1.00 0.00 H ATOM 868 HZ3 LYS A 282 22.326 21.812 2.702 1.00 0.00 H ATOM 869 N ASN A 283 16.493 25.550 7.006 1.00 13.76 N ATOM 870 CA ASN A 283 15.612 25.595 8.172 1.00 17.20 C ATOM 871 C ASN A 283 14.317 26.339 7.794 1.00 16.99 C ATOM 872 O ASN A 283 13.214 25.880 8.107 1.00 17.26 O ATOM 873 CB ASN A 283 16.365 26.268 9.347 1.00 18.24 C ATOM 874 CG ASN A 283 15.571 26.314 10.656 1.00 20.06 C ATOM 875 OD1 ASN A 283 14.368 26.064 10.697 1.00 21.63 O ATOM 876 ND2 ASN A 283 16.267 26.663 11.755 1.00 21.23 N ATOM 877 H ASN A 283 17.432 25.911 7.097 1.00 0.00 H ATOM 878 HA ASN A 283 15.358 24.574 8.458 1.00 0.00 H ATOM 879 HB2 ASN A 283 17.286 25.713 9.525 1.00 0.00 H ATOM 880 HB3 ASN A 283 16.622 27.287 9.059 1.00 0.00 H ATOM 881 HD21 ASN A 283 17.253 26.868 11.684 1.00 0.00 H ATOM 882 HD22 ASN A 283 15.803 26.719 12.650 1.00 0.00 H ATOM 883 N SER A 284 14.464 27.444 7.065 1.00 15.78 N ATOM 884 CA SER A 284 13.325 28.258 6.678 1.00 17.13 C ATOM 885 C SER A 284 12.415 27.513 5.702 1.00 18.42 C ATOM 886 O SER A 284 11.201 27.646 5.780 1.00 17.46 O ATOM 887 CB SER A 284 13.778 29.604 6.097 1.00 16.08 C ATOM 888 OG SER A 284 14.400 30.404 7.097 1.00 14.93 O ATOM 889 H SER A 284 15.390 27.723 6.774 1.00 0.00 H ATOM 890 HA SER A 284 12.746 28.465 7.578 1.00 0.00 H ATOM 891 HB2 SER A 284 14.489 29.424 5.291 1.00 0.00 H ATOM 892 HB3 SER A 284 12.912 30.134 5.700 1.00 0.00 H ATOM 893 HG SER A 284 15.312 30.126 7.208 1.00 0.00 H ATOM 894 N ILE A 285 12.994 26.719 4.802 1.00 19.22 N ATOM 895 CA ILE A 285 12.186 25.866 3.921 1.00 18.81 C ATOM 896 C ILE A 285 11.354 24.887 4.756 1.00 19.45 C ATOM 897 O ILE A 285 10.152 24.747 4.530 1.00 20.43 O ATOM 898 CB ILE A 285 13.058 25.068 2.933 1.00 18.68 C ATOM 899 CG1 ILE A 285 13.658 25.991 1.861 1.00 19.05 C ATOM 900 CG2 ILE A 285 12.264 23.919 2.287 1.00 17.72 C ATOM 901 CD1 ILE A 285 12.628 26.627 0.907 1.00 18.94 C ATOM 902 H ILE A 285 14.001 26.704 4.725 1.00 0.00 H ATOM 903 HA ILE A 285 11.507 26.500 3.351 1.00 0.00 H ATOM 904 HB ILE A 285 13.883 24.629 3.495 1.00 0.00 H ATOM 905 HG12 ILE A 285 14.358 25.407 1.264 1.00 0.00 H ATOM 906 HG13 ILE A 285 14.209 26.789 2.359 1.00 0.00 H ATOM 907 HG21 ILE A 285 12.726 23.645 1.339 1.00 0.00 H ATOM 908 HG22 ILE A 285 11.238 24.241 2.111 1.00 0.00 H ATOM 909 HG23 ILE A 285 12.265 23.057 2.954 1.00 0.00 H ATOM 910 HD11 ILE A 285 11.875 27.160 1.487 1.00 0.00 H ATOM 911 HD12 ILE A 285 12.147 25.845 0.319 1.00 0.00 H ATOM 912 HD13 ILE A 285 13.134 27.325 0.239 1.00 0.00 H ATOM 913 N ARG A 286 11.979 24.229 5.734 1.00 17.62 N ATOM 914 CA ARG A 286 11.270 23.215 6.506 1.00 16.82 C ATOM 915 C ARG A 286 10.166 23.870 7.348 1.00 16.28 C ATOM 916 O ARG A 286 9.079 23.323 7.481 1.00 16.40 O ATOM 917 CB ARG A 286 12.232 22.408 7.398 1.00 16.61 C ATOM 918 CG ARG A 286 13.279 21.588 6.598 1.00 16.51 C ATOM 919 CD ARG A 286 13.948 20.547 7.473 1.00 15.95 C ATOM 920 NE ARG A 286 14.602 21.136 8.635 1.00 15.78 N ATOM 921 CZ ARG A 286 15.758 21.799 8.609 1.00 16.43 C ATOM 922 NH1 ARG A 286 16.417 22.012 7.483 1.00 16.36 N ATOM 923 NH2 ARG A 286 16.246 22.291 9.726 1.00 17.95 N ATOM 924 H ARG A 286 12.946 24.434 5.940 1.00 0.00 H ATOM 925 HA ARG A 286 10.798 22.525 5.806 1.00 0.00 H ATOM 926 HB2 ARG A 286 12.763 23.103 8.049 1.00 0.00 H ATOM 927 HB3 ARG A 286 11.648 21.725 8.015 1.00 0.00 H ATOM 928 HG2 ARG A 286 14.039 22.266 6.209 1.00 0.00 H ATOM 929 HG3 ARG A 286 12.783 21.090 5.765 1.00 0.00 H ATOM 930 HD2 ARG A 286 13.192 19.841 7.817 1.00 0.00 H ATOM 931 HD3 ARG A 286 14.691 20.011 6.882 1.00 0.00 H ATOM 932 HE ARG A 286 14.144 21.034 9.529 1.00 0.00 H ATOM 933 HH11 ARG A 286 16.054 21.656 6.610 1.00 0.00 H ATOM 934 HH12 ARG A 286 17.284 22.531 7.495 1.00 0.00 H ATOM 935 HH21 ARG A 286 17.114 22.807 9.714 1.00 0.00 H ATOM 936 HH22 ARG A 286 15.753 22.153 10.596 1.00 0.00 H ATOM 937 N HIS A 287 10.479 25.026 7.925 1.00 14.88 N ATOM 938 CA HIS A 287 9.513 25.850 8.650 1.00 14.43 C ATOM 939 C HIS A 287 8.270 26.153 7.807 1.00 15.40 C ATOM 940 O HIS A 287 7.140 25.989 8.295 1.00 14.05 O ATOM 941 CB HIS A 287 10.189 27.148 9.101 1.00 13.49 C ATOM 942 CG HIS A 287 9.256 28.165 9.670 1.00 12.23 C ATOM 943 ND1 HIS A 287 8.824 28.135 10.979 1.00 12.61 N ATOM 944 CD2 HIS A 287 8.674 29.250 9.105 1.00 12.18 C ATOM 945 CE1 HIS A 287 8.020 29.161 11.197 1.00 13.02 C ATOM 946 NE2 HIS A 287 7.912 29.854 10.076 1.00 13.09 N ATOM 947 H HIS A 287 11.433 25.352 7.859 1.00 0.00 H ATOM 948 HA HIS A 287 9.197 25.303 9.539 1.00 0.00 H ATOM 949 HB2 HIS A 287 10.928 26.900 9.863 1.00 0.00 H ATOM 950 HB3 HIS A 287 10.704 27.587 8.247 1.00 0.00 H ATOM 951 HD2 HIS A 287 8.788 29.579 8.083 1.00 0.00 H ATOM 952 HE1 HIS A 287 7.533 29.394 12.133 1.00 0.00 H ATOM 953 HE2 HIS A 287 7.360 30.691 9.953 1.00 0.00 H ATOM 954 N ASN A 288 8.483 26.596 6.565 1.00 15.41 N ATOM 955 CA ASN A 288 7.376 26.877 5.637 1.00 17.75 C ATOM 956 C ASN A 288 6.534 25.656 5.257 1.00 18.43 C ATOM 957 O ASN A 288 5.309 25.745 5.180 1.00 17.81 O ATOM 958 CB ASN A 288 7.874 27.558 4.366 1.00 16.78 C ATOM 959 CG ASN A 288 8.011 29.041 4.544 1.00 17.48 C ATOM 960 OD1 ASN A 288 7.090 29.781 4.213 1.00 17.35 O ATOM 961 ND2 ASN A 288 9.151 29.494 5.126 1.00 16.70 N ATOM 962 H ASN A 288 9.432 26.743 6.253 1.00 0.00 H ATOM 963 HA ASN A 288 6.711 27.581 6.137 1.00 0.00 H ATOM 964 HB2 ASN A 288 8.847 27.143 4.102 1.00 0.00 H ATOM 965 HB3 ASN A 288 7.171 27.360 3.557 1.00 0.00 H ATOM 966 HD21 ASN A 288 9.278 30.483 5.285 1.00 0.00 H ATOM 967 HD22 ASN A 288 9.872 28.842 5.399 1.00 0.00 H ATOM 968 N LEU A 289 7.206 24.535 5.014 1.00 17.72 N ATOM 969 CA LEU A 289 6.527 23.275 4.780 1.00 17.57 C ATOM 970 C LEU A 289 5.555 22.904 5.898 1.00 17.17 C ATOM 971 O LEU A 289 4.417 22.544 5.611 1.00 16.62 O ATOM 972 CB LEU A 289 7.539 22.156 4.536 1.00 17.73 C ATOM 973 CG LEU A 289 8.277 22.274 3.191 1.00 18.08 C ATOM 974 CD1 LEU A 289 9.391 21.240 3.132 1.00 17.12 C ATOM 975 CD2 LEU A 289 7.331 22.148 2.001 1.00 15.11 C ATOM 976 H LEU A 289 8.215 24.561 4.992 1.00 0.00 H ATOM 977 HA LEU A 289 5.942 23.387 3.867 1.00 0.00 H ATOM 978 HB2 LEU A 289 8.278 22.179 5.337 1.00 0.00 H ATOM 979 HB3 LEU A 289 7.018 21.199 4.567 1.00 0.00 H ATOM 980 HG LEU A 289 8.736 23.262 3.148 1.00 0.00 H ATOM 981 HD11 LEU A 289 9.914 21.323 2.179 1.00 0.00 H ATOM 982 HD12 LEU A 289 8.965 20.241 3.226 1.00 0.00 H ATOM 983 HD13 LEU A 289 10.092 21.414 3.948 1.00 0.00 H ATOM 984 HD21 LEU A 289 6.548 22.903 2.077 1.00 0.00 H ATOM 985 HD22 LEU A 289 6.880 21.156 1.999 1.00 0.00 H ATOM 986 HD23 LEU A 289 7.889 22.295 1.076 1.00 0.00 H ATOM 987 N SER A 290 5.995 23.011 7.154 1.00 16.97 N ATOM 988 CA SER A 290 5.137 22.724 8.309 1.00 17.94 C ATOM 989 C SER A 290 4.098 23.806 8.590 1.00 17.49 C ATOM 990 O SER A 290 2.969 23.497 8.972 1.00 17.83 O ATOM 991 CB SER A 290 5.974 22.510 9.572 1.00 18.45 C ATOM 992 OG SER A 290 6.717 21.314 9.466 1.00 20.68 O ATOM 993 H SER A 290 6.950 23.299 7.314 1.00 0.00 H ATOM 994 HA SER A 290 4.603 21.796 8.103 1.00 0.00 H ATOM 995 HB2 SER A 290 5.313 22.448 10.436 1.00 0.00 H ATOM 996 HB3 SER A 290 6.657 23.350 9.699 1.00 0.00 H ATOM 997 HG SER A 290 7.238 21.189 10.262 1.00 0.00 H ATOM 998 N LEU A 291 4.479 25.063 8.397 1.00 17.31 N ATOM 999 CA LEU A 291 3.614 26.197 8.717 1.00 17.50 C ATOM 1000 C LEU A 291 2.370 26.258 7.842 1.00 15.83 C ATOM 1001 O LEU A 291 1.289 26.463 8.341 1.00 13.79 O ATOM 1002 CB LEU A 291 4.385 27.520 8.571 1.00 18.39 C ATOM 1003 CG LEU A 291 3.640 28.811 8.937 1.00 19.96 C ATOM 1004 CD1 LEU A 291 3.056 28.689 10.324 1.00 19.51 C ATOM 1005 CD2 LEU A 291 4.565 30.043 8.836 1.00 20.48 C ATOM 1006 H LEU A 291 5.397 25.242 8.016 1.00 0.00 H ATOM 1007 HA LEU A 291 3.296 26.101 9.755 1.00 0.00 H ATOM 1008 HB2 LEU A 291 4.696 27.605 7.530 1.00 0.00 H ATOM 1009 HB3 LEU A 291 5.281 27.460 9.188 1.00 0.00 H ATOM 1010 HG LEU A 291 2.819 28.942 8.232 1.00 0.00 H ATOM 1011 HD11 LEU A 291 2.528 29.608 10.579 1.00 0.00 H ATOM 1012 HD12 LEU A 291 3.858 28.520 11.042 1.00 0.00 H ATOM 1013 HD13 LEU A 291 2.360 27.851 10.353 1.00 0.00 H ATOM 1014 HD21 LEU A 291 4.974 30.110 7.828 1.00 0.00 H ATOM 1015 HD22 LEU A 291 3.994 30.945 9.057 1.00 0.00 H ATOM 1016 HD23 LEU A 291 5.380 29.945 9.553 1.00 0.00 H ATOM 1017 N HIS A 292 2.552 26.116 6.535 1.00 15.34 N ATOM 1018 CA HIS A 292 1.480 26.321 5.582 1.00 15.59 C ATOM 1019 C HIS A 292 0.727 25.032 5.299 1.00 15.24 C ATOM 1020 O HIS A 292 1.315 24.037 4.869 1.00 13.72 O ATOM 1021 CB HIS A 292 2.038 26.898 4.288 1.00 15.91 C ATOM 1022 CG HIS A 292 2.696 28.226 4.472 1.00 17.65 C ATOM 1023 ND1 HIS A 292 1.985 29.371 4.775 1.00 17.57 N ATOM 1024 CD2 HIS A 292 3.998 28.594 4.416 1.00 17.05 C ATOM 1025 CE1 HIS A 292 2.819 30.389 4.884 1.00 17.25 C ATOM 1026 NE2 HIS A 292 4.046 29.947 4.661 1.00 17.45 N ATOM 1027 H HIS A 292 3.467 25.857 6.194 1.00 0.00 H ATOM 1028 HA HIS A 292 0.779 27.041 6.004 1.00 0.00 H ATOM 1029 HB2 HIS A 292 1.219 27.013 3.578 1.00 0.00 H ATOM 1030 HB3 HIS A 292 2.766 26.199 3.876 1.00 0.00 H ATOM 1031 HD2 HIS A 292 4.840 27.947 4.217 1.00 0.00 H ATOM 1032 HE1 HIS A 292 2.546 31.408 5.116 1.00 0.00 H ATOM 1033 HE2 HIS A 292 4.883 30.512 4.669 1.00 0.00 H ATOM 1034 N ASP A 293 -0.584 25.069 5.529 1.00 15.53 N ATOM 1035 CA ASP A 293 -1.441 23.894 5.327 1.00 15.94 C ATOM 1036 C ASP A 293 -1.565 23.463 3.862 1.00 15.15 C ATOM 1037 O ASP A 293 -1.939 22.341 3.590 1.00 14.33 O ATOM 1038 CB ASP A 293 -2.818 24.122 5.957 1.00 16.67 C ATOM 1039 CG ASP A 293 -2.773 24.071 7.476 1.00 18.32 C ATOM 1040 OD1 ASP A 293 -1.805 23.491 8.026 1.00 20.29 O ATOM 1041 OD2 ASP A 293 -3.691 24.615 8.120 1.00 17.71 O ATOM 1042 H ASP A 293 -1.001 25.930 5.852 1.00 0.00 H ATOM 1043 HA ASP A 293 -0.978 23.066 5.864 1.00 0.00 H ATOM 1044 HB2 ASP A 293 -3.499 23.349 5.600 1.00 0.00 H ATOM 1045 HB3 ASP A 293 -3.194 25.097 5.646 1.00 0.00 H ATOM 1046 N MET A 294 -1.212 24.331 2.925 1.00 16.46 N ATOM 1047 CA MET A 294 -1.167 23.933 1.517 1.00 18.24 C ATOM 1048 C MET A 294 -0.078 22.899 1.213 1.00 17.69 C ATOM 1049 O MET A 294 -0.182 22.173 0.233 1.00 17.16 O ATOM 1050 CB MET A 294 -1.014 25.142 0.590 1.00 20.37 C ATOM 1051 CG MET A 294 0.281 25.933 0.719 1.00 22.52 C ATOM 1052 SD MET A 294 0.511 27.000 -0.746 1.00 26.63 S ATOM 1053 CE MET A 294 0.223 25.847 -2.073 1.00 25.21 C ATOM 1054 H MET A 294 -0.972 25.277 3.185 1.00 0.00 H ATOM 1055 HA MET A 294 -2.125 23.469 1.284 1.00 0.00 H ATOM 1056 HB2 MET A 294 -1.840 25.823 0.794 1.00 0.00 H ATOM 1057 HB3 MET A 294 -1.102 24.796 -0.440 1.00 0.00 H ATOM 1058 HG2 MET A 294 0.237 26.554 1.614 1.00 0.00 H ATOM 1059 HG3 MET A 294 1.120 25.242 0.799 1.00 0.00 H ATOM 1060 HE1 MET A 294 0.772 26.167 -2.959 1.00 0.00 H ATOM 1061 HE2 MET A 294 0.564 24.856 -1.773 1.00 0.00 H ATOM 1062 HE3 MET A 294 -0.843 25.812 -2.299 1.00 0.00 H ATOM 1063 N PHE A 295 0.960 22.833 2.038 1.00 17.33 N ATOM 1064 CA PHE A 295 2.007 21.831 1.847 1.00 16.96 C ATOM 1065 C PHE A 295 1.697 20.630 2.713 1.00 17.43 C ATOM 1066 O PHE A 295 1.687 20.725 3.955 1.00 16.57 O ATOM 1067 CB PHE A 295 3.383 22.394 2.154 1.00 16.76 C ATOM 1068 CG PHE A 295 3.731 23.596 1.325 1.00 17.75 C ATOM 1069 CD1 PHE A 295 4.200 24.762 1.927 1.00 17.36 C ATOM 1070 CD2 PHE A 295 3.569 23.576 -0.062 1.00 17.39 C ATOM 1071 CE1 PHE A 295 4.518 25.866 1.172 1.00 17.20 C ATOM 1072 CE2 PHE A 295 3.894 24.685 -0.826 1.00 18.08 C ATOM 1073 CZ PHE A 295 4.362 25.837 -0.207 1.00 17.48 C ATOM 1074 H PHE A 295 1.027 23.484 2.808 1.00 0.00 H ATOM 1075 HA PHE A 295 1.992 21.514 0.804 1.00 0.00 H ATOM 1076 HB2 PHE A 295 3.413 22.679 3.206 1.00 0.00 H ATOM 1077 HB3 PHE A 295 4.128 21.618 1.978 1.00 0.00 H ATOM 1078 HD1 PHE A 295 4.315 24.799 3.000 1.00 0.00 H ATOM 1079 HD2 PHE A 295 3.187 22.688 -0.543 1.00 0.00 H ATOM 1080 HE1 PHE A 295 4.890 26.758 1.653 1.00 0.00 H ATOM 1081 HE2 PHE A 295 3.784 24.654 -1.900 1.00 0.00 H ATOM 1082 HZ PHE A 295 4.604 26.708 -0.797 1.00 0.00 H ATOM 1083 N VAL A 296 1.414 19.515 2.033 1.00 17.06 N ATOM 1084 CA VAL A 296 0.965 18.290 2.671 1.00 17.05 C ATOM 1085 C VAL A 296 1.997 17.199 2.426 1.00 18.96 C ATOM 1086 O VAL A 296 2.443 16.964 1.301 1.00 19.30 O ATOM 1087 CB VAL A 296 -0.427 17.838 2.137 1.00 16.75 C ATOM 1088 CG1 VAL A 296 -0.856 16.485 2.765 1.00 13.65 C ATOM 1089 CG2 VAL A 296 -1.488 18.930 2.392 1.00 15.83 C ATOM 1090 H VAL A 296 1.517 19.525 1.028 1.00 0.00 H ATOM 1091 HA VAL A 296 0.888 18.463 3.744 1.00 0.00 H ATOM 1092 HB VAL A 296 -0.343 17.696 1.059 1.00 0.00 H ATOM 1093 HG11 VAL A 296 -0.090 15.734 2.570 1.00 0.00 H ATOM 1094 HG12 VAL A 296 -1.800 16.164 2.325 1.00 0.00 H ATOM 1095 HG13 VAL A 296 -0.980 16.607 3.841 1.00 0.00 H ATOM 1096 HG21 VAL A 296 -2.453 18.595 2.012 1.00 0.00 H ATOM 1097 HG22 VAL A 296 -1.195 19.847 1.881 1.00 0.00 H ATOM 1098 HG23 VAL A 296 -1.565 19.119 3.463 1.00 0.00 H ATOM 1099 N ARG A 297 2.365 16.526 3.497 1.00 20.80 N ATOM 1100 CA ARG A 297 3.338 15.461 3.434 1.00 22.97 C ATOM 1101 C ARG A 297 2.658 14.129 3.089 1.00 24.41 C ATOM 1102 O ARG A 297 1.652 13.780 3.678 1.00 24.87 O ATOM 1103 CB ARG A 297 4.032 15.382 4.780 1.00 23.25 C ATOM 1104 CG ARG A 297 5.262 14.565 4.777 1.00 24.02 C ATOM 1105 CD ARG A 297 5.975 14.719 6.075 1.00 24.88 C ATOM 1106 NE ARG A 297 6.756 13.533 6.349 1.00 26.02 N ATOM 1107 CZ ARG A 297 6.264 12.421 6.869 1.00 26.86 C ATOM 1108 NH1 ARG A 297 4.976 12.330 7.189 1.00 27.45 N ATOM 1109 NH2 ARG A 297 7.071 11.391 7.068 1.00 27.62 N ATOM 1110 H ARG A 297 1.954 16.762 4.389 1.00 0.00 H ATOM 1111 HA ARG A 297 4.075 15.695 2.666 1.00 0.00 H ATOM 1112 HB2 ARG A 297 4.294 16.394 5.090 1.00 0.00 H ATOM 1113 HB3 ARG A 297 3.337 14.963 5.507 1.00 0.00 H ATOM 1114 HG2 ARG A 297 5.912 14.894 3.966 1.00 0.00 H ATOM 1115 HG3 ARG A 297 5.000 13.517 4.629 1.00 0.00 H ATOM 1116 HD2 ARG A 297 6.636 15.584 6.024 1.00 0.00 H ATOM 1117 HD3 ARG A 297 5.247 14.866 6.873 1.00 0.00 H ATOM 1118 HE ARG A 297 7.741 13.555 6.129 1.00 0.00 H ATOM 1119 HH11 ARG A 297 4.613 11.475 7.585 1.00 0.00 H ATOM 1120 HH12 ARG A 297 4.361 13.116 7.036 1.00 0.00 H ATOM 1121 HH21 ARG A 297 8.049 11.461 6.824 1.00 0.00 H ATOM 1122 HH22 ARG A 297 6.709 10.535 7.464 1.00 0.00 H ATOM 1123 N GLU A 298 3.203 13.411 2.111 1.00 27.04 N ATOM 1124 CA GLU A 298 2.696 12.105 1.707 1.00 29.53 C ATOM 1125 C GLU A 298 3.808 11.077 1.817 1.00 30.69 C ATOM 1126 O GLU A 298 4.831 11.194 1.140 1.00 30.89 O ATOM 1127 CB GLU A 298 2.202 12.141 0.261 1.00 30.99 C ATOM 1128 CG GLU A 298 0.837 12.764 0.090 1.00 32.44 C ATOM 1129 CD GLU A 298 0.216 12.478 -1.270 1.00 33.68 C ATOM 1130 OE1 GLU A 298 0.957 12.142 -2.229 1.00 33.77 O ATOM 1131 OE2 GLU A 298 -1.029 12.596 -1.369 1.00 34.87 O ATOM 1132 H GLU A 298 4.005 13.788 1.626 1.00 0.00 H ATOM 1133 HA GLU A 298 1.874 11.819 2.362 1.00 0.00 H ATOM 1134 HB2 GLU A 298 2.916 12.714 -0.330 1.00 0.00 H ATOM 1135 HB3 GLU A 298 2.171 11.121 -0.123 1.00 0.00 H ATOM 1136 HG2 GLU A 298 0.177 12.370 0.862 1.00 0.00 H ATOM 1137 HG3 GLU A 298 0.924 13.843 0.218 1.00 0.00 H ATOM 1138 N THR A 299 3.616 10.080 2.672 1.00 31.62 N ATOM 1139 CA THR A 299 4.586 9.003 2.808 1.00 32.94 C ATOM 1140 C THR A 299 4.223 7.851 1.879 1.00 33.49 C ATOM 1141 O THR A 299 3.060 7.457 1.777 1.00 33.81 O ATOM 1142 CB THR A 299 4.713 8.506 4.262 1.00 33.33 C ATOM 1143 OG1 THR A 299 3.414 8.257 4.815 1.00 33.71 O ATOM 1144 CG2 THR A 299 5.445 9.546 5.109 1.00 33.62 C ATOM 1145 H THR A 299 2.781 10.068 3.239 1.00 0.00 H ATOM 1146 HA THR A 299 5.558 9.388 2.500 1.00 0.00 H ATOM 1147 HB THR A 299 5.284 7.578 4.270 1.00 0.00 H ATOM 1148 HG21 THR A 299 5.530 9.186 6.134 1.00 0.00 H ATOM 1149 HG22 THR A 299 6.441 9.712 4.699 1.00 0.00 H ATOM 1150 HG23 THR A 299 4.887 10.482 5.098 1.00 0.00 H ATOM 1151 HG1 THR A 299 2.958 7.603 4.280 1.00 0.00 H ATOM 1152 N SER A 300 5.241 7.321 1.207 1.00 34.20 N ATOM 1153 CA SER A 300 5.064 6.319 0.162 1.00 34.72 C ATOM 1154 C SER A 300 4.553 4.989 0.711 1.00 34.48 C ATOM 1155 O SER A 300 4.742 4.672 1.889 1.00 34.19 O ATOM 1156 CB SER A 300 6.390 6.102 -0.574 1.00 34.98 C ATOM 1157 OG SER A 300 6.218 5.259 -1.696 1.00 35.92 O ATOM 1158 H SER A 300 6.178 7.626 1.430 1.00 0.00 H ATOM 1159 HA SER A 300 4.334 6.697 -0.554 1.00 0.00 H ATOM 1160 HB2 SER A 300 6.773 7.066 -0.909 1.00 0.00 H ATOM 1161 HB3 SER A 300 7.109 5.648 0.108 1.00 0.00 H ATOM 1162 HG SER A 300 7.061 5.139 -2.139 1.00 0.00 H ATOM 1163 N ALA A 301 3.923 4.210 -0.169 1.00 34.91 N ATOM 1164 CA ALA A 301 3.361 2.897 0.176 1.00 34.85 C ATOM 1165 C ALA A 301 4.373 1.944 0.817 1.00 35.16 C ATOM 1166 O ALA A 301 3.984 0.958 1.435 1.00 35.53 O ATOM 1167 CB ALA A 301 2.759 2.249 -1.064 1.00 34.58 C ATOM 1168 H ALA A 301 3.827 4.539 -1.119 1.00 0.00 H ATOM 1169 HA ALA A 301 2.555 3.058 0.892 1.00 0.00 H ATOM 1170 HB1 ALA A 301 2.344 1.276 -0.801 1.00 0.00 H ATOM 1171 HB2 ALA A 301 1.968 2.886 -1.459 1.00 0.00 H ATOM 1172 HB3 ALA A 301 3.534 2.121 -1.820 1.00 0.00 H ATOM 1173 N ASN A 302 5.662 2.258 0.678 1.00 35.81 N ATOM 1174 CA ASN A 302 6.759 1.391 1.135 1.00 35.91 C ATOM 1175 C ASN A 302 6.875 1.259 2.646 1.00 35.95 C ATOM 1176 O ASN A 302 7.007 0.153 3.170 1.00 36.33 O ATOM 1177 CB ASN A 302 8.120 1.878 0.594 1.00 35.95 C ATOM 1178 CG ASN A 302 7.998 2.712 -0.671 1.00 35.92 C ATOM 1179 OD1 ASN A 302 7.226 2.387 -1.574 1.00 35.97 O ATOM 1180 ND2 ASN A 302 8.758 3.802 -0.734 1.00 35.84 N ATOM 1181 H ASN A 302 5.897 3.136 0.237 1.00 0.00 H ATOM 1182 HA ASN A 302 6.581 0.395 0.730 1.00 0.00 H ATOM 1183 HB2 ASN A 302 8.602 2.483 1.362 1.00 0.00 H ATOM 1184 HB3 ASN A 302 8.746 1.011 0.385 1.00 0.00 H ATOM 1185 HD21 ASN A 302 9.375 4.033 0.032 1.00 0.00 H ATOM 1186 HD22 ASN A 302 8.718 4.399 -1.548 1.00 0.00 H ATOM 1187 N GLY A 303 6.836 2.391 3.337 1.00 36.02 N ATOM 1188 CA GLY A 303 7.177 2.432 4.746 1.00 35.71 C ATOM 1189 C GLY A 303 8.680 2.560 4.959 1.00 35.43 C ATOM 1190 O GLY A 303 9.300 1.600 5.403 1.00 35.53 O ATOM 1191 H GLY A 303 6.562 3.244 2.871 1.00 0.00 H ATOM 1192 HA2 GLY A 303 6.681 3.288 5.204 1.00 0.00 H ATOM 1193 HA3 GLY A 303 6.826 1.518 5.225 1.00 0.00 H ATOM 1194 N LYS A 304 9.301 3.703 4.648 1.00 35.04 N ATOM 1195 CA LYS A 304 8.661 4.898 4.096 1.00 34.76 C ATOM 1196 C LYS A 304 9.651 5.730 3.263 1.00 34.05 C ATOM 1197 O LYS A 304 10.847 5.782 3.556 1.00 34.10 O ATOM 1198 CB LYS A 304 8.116 5.791 5.225 1.00 35.53 C ATOM 1199 CG LYS A 304 6.824 5.305 5.864 1.00 36.19 C ATOM 1200 CD LYS A 304 6.150 6.330 6.761 1.00 36.61 C ATOM 1201 CE LYS A 304 4.736 5.852 7.123 1.00 36.89 C ATOM 1202 NZ LYS A 304 4.006 6.789 8.022 1.00 37.16 N ATOM 1203 H LYS A 304 10.297 3.745 4.808 1.00 0.00 H ATOM 1204 HA LYS A 304 7.833 4.592 3.457 1.00 0.00 H ATOM 1205 HB2 LYS A 304 7.936 6.784 4.813 1.00 0.00 H ATOM 1206 HB3 LYS A 304 8.877 5.871 6.001 1.00 0.00 H ATOM 1207 HG2 LYS A 304 6.129 5.037 5.068 1.00 0.00 H ATOM 1208 HG3 LYS A 304 7.040 4.414 6.453 1.00 0.00 H ATOM 1209 HD2 LYS A 304 6.087 7.284 6.237 1.00 0.00 H ATOM 1210 HD3 LYS A 304 6.735 6.455 7.672 1.00 0.00 H ATOM 1211 HE2 LYS A 304 4.163 5.740 6.202 1.00 0.00 H ATOM 1212 HE3 LYS A 304 4.808 4.881 7.612 1.00 0.00 H ATOM 1213 HZ1 LYS A 304 3.088 6.419 8.221 1.00 0.00 H ATOM 1214 HZ2 LYS A 304 4.520 6.896 8.885 1.00 0.00 H ATOM 1215 HZ3 LYS A 304 3.916 7.688 7.570 1.00 0.00 H ATOM 1216 N VAL A 305 9.132 6.369 2.219 1.00 32.88 N ATOM 1217 CA VAL A 305 9.789 7.501 1.563 1.00 31.38 C ATOM 1218 C VAL A 305 8.744 8.606 1.526 1.00 29.93 C ATOM 1219 O VAL A 305 7.576 8.333 1.261 1.00 29.45 O ATOM 1220 CB VAL A 305 10.224 7.160 0.134 1.00 31.43 C ATOM 1221 CG1 VAL A 305 10.910 8.362 -0.513 1.00 31.30 C ATOM 1222 CG2 VAL A 305 11.136 5.937 0.137 1.00 31.50 C ATOM 1223 H VAL A 305 8.240 6.058 1.861 1.00 0.00 H ATOM 1224 HA VAL A 305 10.651 7.822 2.148 1.00 0.00 H ATOM 1225 HB VAL A 305 9.333 6.921 -0.447 1.00 0.00 H ATOM 1226 HG11 VAL A 305 11.214 8.105 -1.528 1.00 0.00 H ATOM 1227 HG12 VAL A 305 10.217 9.203 -0.543 1.00 0.00 H ATOM 1228 HG13 VAL A 305 11.789 8.636 0.071 1.00 0.00 H ATOM 1229 HG21 VAL A 305 12.176 6.259 0.180 1.00 0.00 H ATOM 1230 HG22 VAL A 305 10.911 5.318 1.006 1.00 0.00 H ATOM 1231 HG23 VAL A 305 10.972 5.359 -0.773 1.00 0.00 H ATOM 1232 N SER A 306 9.126 9.846 1.805 1.00 28.62 N ATOM 1233 CA SER A 306 8.109 10.884 1.949 1.00 27.05 C ATOM 1234 C SER A 306 8.308 12.048 0.990 1.00 25.35 C ATOM 1235 O SER A 306 9.424 12.525 0.796 1.00 26.26 O ATOM 1236 CB SER A 306 8.008 11.345 3.406 1.00 27.65 C ATOM 1237 OG SER A 306 8.680 12.562 3.644 1.00 28.83 O ATOM 1238 H SER A 306 10.105 10.068 1.916 1.00 0.00 H ATOM 1239 HA SER A 306 7.153 10.426 1.696 1.00 0.00 H ATOM 1240 HB2 SER A 306 6.955 11.474 3.658 1.00 0.00 H ATOM 1241 HB3 SER A 306 8.433 10.575 4.050 1.00 0.00 H ATOM 1242 HG SER A 306 8.586 12.805 4.568 1.00 0.00 H ATOM 1243 N PHE A 307 7.207 12.481 0.380 1.00 22.93 N ATOM 1244 CA PHE A 307 7.206 13.597 -0.553 1.00 21.25 C ATOM 1245 C PHE A 307 6.393 14.741 0.022 1.00 19.43 C ATOM 1246 O PHE A 307 5.467 14.530 0.798 1.00 18.73 O ATOM 1247 CB PHE A 307 6.566 13.191 -1.882 1.00 21.91 C ATOM 1248 CG PHE A 307 7.242 12.035 -2.573 1.00 21.72 C ATOM 1249 CD1 PHE A 307 8.168 12.256 -3.585 1.00 21.89 C ATOM 1250 CD2 PHE A 307 6.932 10.725 -2.231 1.00 21.99 C ATOM 1251 CE1 PHE A 307 8.788 11.180 -4.241 1.00 21.58 C ATOM 1252 CE2 PHE A 307 7.549 9.645 -2.880 1.00 21.83 C ATOM 1253 CZ PHE A 307 8.479 9.881 -3.883 1.00 21.36 C ATOM 1254 H PHE A 307 6.333 12.014 0.574 1.00 0.00 H ATOM 1255 HA PHE A 307 8.230 13.928 -0.727 1.00 0.00 H ATOM 1256 HB2 PHE A 307 6.595 14.051 -2.551 1.00 0.00 H ATOM 1257 HB3 PHE A 307 5.524 12.927 -1.700 1.00 0.00 H ATOM 1258 HD1 PHE A 307 8.414 13.268 -3.871 1.00 0.00 H ATOM 1259 HD2 PHE A 307 6.206 10.535 -1.455 1.00 0.00 H ATOM 1260 HE1 PHE A 307 9.506 11.367 -5.025 1.00 0.00 H ATOM 1261 HE2 PHE A 307 7.301 8.632 -2.600 1.00 0.00 H ATOM 1262 HZ PHE A 307 8.960 9.053 -4.382 1.00 0.00 H ATOM 1263 N TRP A 308 6.746 15.951 -0.379 1.00 18.22 N ATOM 1264 CA TRP A 308 5.932 17.122 -0.125 1.00 17.23 C ATOM 1265 C TRP A 308 5.092 17.393 -1.355 1.00 17.16 C ATOM 1266 O TRP A 308 5.576 17.303 -2.488 1.00 17.43 O ATOM 1267 CB TRP A 308 6.792 18.323 0.247 1.00 16.99 C ATOM 1268 CG TRP A 308 7.313 18.200 1.665 1.00 17.27 C ATOM 1269 CD1 TRP A 308 8.541 17.762 2.045 1.00 17.11 C ATOM 1270 CD2 TRP A 308 6.591 18.472 2.875 1.00 17.12 C ATOM 1271 NE1 TRP A 308 8.643 17.764 3.416 1.00 17.28 N ATOM 1272 CE2 TRP A 308 7.463 18.201 3.950 1.00 17.59 C ATOM 1273 CE3 TRP A 308 5.307 18.953 3.150 1.00 17.21 C ATOM 1274 CZ2 TRP A 308 7.088 18.374 5.278 1.00 18.07 C ATOM 1275 CZ3 TRP A 308 4.931 19.130 4.468 1.00 17.16 C ATOM 1276 CH2 TRP A 308 5.815 18.846 5.517 1.00 18.11 C ATOM 1277 H TRP A 308 7.615 16.063 -0.881 1.00 0.00 H ATOM 1278 HA TRP A 308 5.264 16.904 0.708 1.00 0.00 H ATOM 1279 HB2 TRP A 308 6.192 19.230 0.165 1.00 0.00 H ATOM 1280 HB3 TRP A 308 7.635 18.387 -0.441 1.00 0.00 H ATOM 1281 HD1 TRP A 308 9.325 17.456 1.368 1.00 0.00 H ATOM 1282 HE3 TRP A 308 4.622 19.182 2.347 1.00 0.00 H ATOM 1283 HZ2 TRP A 308 7.766 18.148 6.088 1.00 0.00 H ATOM 1284 HZ3 TRP A 308 3.939 19.493 4.693 1.00 0.00 H ATOM 1285 HH2 TRP A 308 5.492 19.000 6.536 1.00 0.00 H ATOM 1286 HE1 TRP A 308 9.458 17.487 3.944 1.00 0.00 H ATOM 1287 N THR A 309 3.812 17.663 -1.116 1.00 16.64 N ATOM 1288 CA THR A 309 2.843 17.907 -2.176 1.00 16.08 C ATOM 1289 C THR A 309 2.127 19.196 -1.878 1.00 16.78 C ATOM 1290 O THR A 309 2.208 19.731 -0.759 1.00 16.78 O ATOM 1291 CB THR A 309 1.774 16.810 -2.237 1.00 15.66 C ATOM 1292 OG1 THR A 309 1.029 16.802 -1.008 1.00 14.93 O ATOM 1293 CG2 THR A 309 2.406 15.457 -2.449 1.00 15.65 C ATOM 1294 H THR A 309 3.498 17.701 -0.157 1.00 0.00 H ATOM 1295 HA THR A 309 3.354 17.980 -3.136 1.00 0.00 H ATOM 1296 HB THR A 309 1.095 17.020 -3.064 1.00 0.00 H ATOM 1297 HG1 THR A 309 1.514 17.288 -0.336 1.00 0.00 H ATOM 1298 HG21 THR A 309 1.628 14.694 -2.489 1.00 0.00 H ATOM 1299 HG22 THR A 309 3.085 15.240 -1.624 1.00 0.00 H ATOM 1300 HG23 THR A 309 2.962 15.459 -3.387 1.00 0.00 H ATOM 1301 N ILE A 310 1.400 19.680 -2.872 1.00 17.12 N ATOM 1302 CA ILE A 310 0.505 20.795 -2.666 1.00 17.52 C ATOM 1303 C ILE A 310 -0.895 20.231 -2.558 1.00 17.47 C ATOM 1304 O ILE A 310 -1.330 19.425 -3.391 1.00 18.18 O ATOM 1305 CB ILE A 310 0.573 21.796 -3.813 1.00 18.19 C ATOM 1306 CG1 ILE A 310 1.965 22.412 -3.889 1.00 18.57 C ATOM 1307 CG2 ILE A 310 -0.465 22.887 -3.632 1.00 18.36 C ATOM 1308 CD1 ILE A 310 2.199 23.144 -5.167 1.00 20.06 C ATOM 1309 H ILE A 310 1.472 19.263 -3.789 1.00 0.00 H ATOM 1310 HA ILE A 310 0.764 21.297 -1.734 1.00 0.00 H ATOM 1311 HB ILE A 310 0.371 21.272 -4.747 1.00 0.00 H ATOM 1312 HG12 ILE A 310 2.083 23.110 -3.060 1.00 0.00 H ATOM 1313 HG13 ILE A 310 2.708 21.620 -3.794 1.00 0.00 H ATOM 1314 HD11 ILE A 310 3.205 23.562 -5.168 1.00 0.00 H ATOM 1315 HD12 ILE A 310 1.471 23.949 -5.263 1.00 0.00 H ATOM 1316 HD13 ILE A 310 2.091 22.455 -6.005 1.00 0.00 H ATOM 1317 HG21 ILE A 310 -1.411 22.565 -4.067 1.00 0.00 H ATOM 1318 HG22 ILE A 310 -0.127 23.796 -4.130 1.00 0.00 H ATOM 1319 HG23 ILE A 310 -0.603 23.085 -2.569 1.00 0.00 H ATOM 1320 N HIS A 311 -1.601 20.660 -1.518 1.00 17.81 N ATOM 1321 CA HIS A 311 -2.995 20.317 -1.331 1.00 17.46 C ATOM 1322 C HIS A 311 -3.733 20.415 -2.672 1.00 18.66 C ATOM 1323 O HIS A 311 -3.629 21.426 -3.359 1.00 17.58 O ATOM 1324 CB HIS A 311 -3.610 21.261 -0.299 1.00 17.86 C ATOM 1325 CG HIS A 311 -4.981 20.861 0.149 1.00 17.51 C ATOM 1326 ND1 HIS A 311 -6.030 20.696 -0.726 1.00 16.52 N ATOM 1327 CD2 HIS A 311 -5.474 20.605 1.383 1.00 17.27 C ATOM 1328 CE1 HIS A 311 -7.111 20.345 -0.053 1.00 17.59 C ATOM 1329 NE2 HIS A 311 -6.801 20.290 1.230 1.00 17.73 N ATOM 1330 H HIS A 311 -1.149 21.247 -0.832 1.00 0.00 H ATOM 1331 HA HIS A 311 -3.063 19.294 -0.962 1.00 0.00 H ATOM 1332 HB2 HIS A 311 -3.670 22.257 -0.738 1.00 0.00 H ATOM 1333 HB3 HIS A 311 -2.956 21.301 0.572 1.00 0.00 H ATOM 1334 HD2 HIS A 311 -4.926 20.642 2.313 1.00 0.00 H ATOM 1335 HE1 HIS A 311 -8.082 20.138 -0.479 1.00 0.00 H ATOM 1336 HE2 HIS A 311 -7.438 20.054 1.978 1.00 0.00 H ATOM 1337 N PRO A 312 -4.466 19.354 -3.054 1.00 21.24 N ATOM 1338 CA PRO A 312 -5.198 19.268 -4.328 1.00 22.61 C ATOM 1339 C PRO A 312 -6.123 20.450 -4.661 1.00 23.91 C ATOM 1340 O PRO A 312 -6.303 20.774 -5.838 1.00 24.95 O ATOM 1341 CB PRO A 312 -6.063 18.011 -4.150 1.00 22.64 C ATOM 1342 CG PRO A 312 -5.352 17.186 -3.162 1.00 22.34 C ATOM 1343 CD PRO A 312 -4.590 18.112 -2.265 1.00 21.67 C ATOM 1344 HA PRO A 312 -4.493 19.114 -5.145 1.00 0.00 H ATOM 1345 HB2 PRO A 312 -6.158 17.477 -5.095 1.00 0.00 H ATOM 1346 HB3 PRO A 312 -7.048 18.284 -3.772 1.00 0.00 H ATOM 1347 HG2 PRO A 312 -6.067 16.607 -2.578 1.00 0.00 H ATOM 1348 HG3 PRO A 312 -4.661 16.514 -3.671 1.00 0.00 H ATOM 1349 HD2 PRO A 312 -5.138 18.294 -1.341 1.00 0.00 H ATOM 1350 HD3 PRO A 312 -3.604 17.702 -2.046 1.00 0.00 H ATOM 1351 N SER A 313 -6.744 21.037 -3.640 1.00 23.75 N ATOM 1352 CA SER A 313 -7.647 22.173 -3.814 1.00 23.82 C ATOM 1353 C SER A 313 -6.906 23.511 -3.757 1.00 24.32 C ATOM 1354 O SER A 313 -7.504 24.557 -3.985 1.00 23.20 O ATOM 1355 CB SER A 313 -8.745 22.148 -2.740 1.00 23.91 C ATOM 1356 OG SER A 313 -9.554 20.983 -2.848 1.00 23.87 O ATOM 1357 H SER A 313 -6.585 20.683 -2.708 1.00 0.00 H ATOM 1358 HA SER A 313 -8.122 22.086 -4.791 1.00 0.00 H ATOM 1359 HB2 SER A 313 -9.376 23.029 -2.858 1.00 0.00 H ATOM 1360 HB3 SER A 313 -8.281 22.170 -1.754 1.00 0.00 H ATOM 1361 HG SER A 313 -10.229 20.997 -2.165 1.00 0.00 H ATOM 1362 N ALA A 314 -5.615 23.481 -3.440 1.00 25.84 N ATOM 1363 CA ALA A 314 -4.813 24.706 -3.342 1.00 27.86 C ATOM 1364 C ALA A 314 -4.011 25.001 -4.597 1.00 29.97 C ATOM 1365 O ALA A 314 -3.643 26.151 -4.848 1.00 31.74 O ATOM 1366 CB ALA A 314 -3.865 24.626 -2.155 1.00 27.46 C ATOM 1367 H ALA A 314 -5.174 22.590 -3.262 1.00 0.00 H ATOM 1368 HA ALA A 314 -5.493 25.541 -3.174 1.00 0.00 H ATOM 1369 HB1 ALA A 314 -3.363 25.585 -2.025 1.00 0.00 H ATOM 1370 HB2 ALA A 314 -4.430 24.387 -1.254 1.00 0.00 H ATOM 1371 HB3 ALA A 314 -3.123 23.848 -2.335 1.00 0.00 H ATOM 1372 N ASN A 315 -3.733 23.970 -5.385 1.00 31.73 N ATOM 1373 CA ASN A 315 -2.712 24.081 -6.412 1.00 31.92 C ATOM 1374 C ASN A 315 -3.164 24.905 -7.606 1.00 32.13 C ATOM 1375 O ASN A 315 -4.062 24.506 -8.352 1.00 32.24 O ATOM 1376 CB ASN A 315 -2.251 22.699 -6.873 1.00 32.07 C ATOM 1377 CG ASN A 315 -0.868 22.732 -7.486 1.00 31.70 C ATOM 1378 OD1 ASN A 315 -0.363 23.794 -7.857 1.00 31.39 O ATOM 1379 ND2 ASN A 315 -0.242 21.569 -7.581 1.00 31.01 N ATOM 1380 H ASN A 315 -4.235 23.101 -5.270 1.00 0.00 H ATOM 1381 HA ASN A 315 -1.853 24.585 -5.970 1.00 0.00 H ATOM 1382 HB2 ASN A 315 -2.238 22.029 -6.013 1.00 0.00 H ATOM 1383 HB3 ASN A 315 -2.957 22.317 -7.610 1.00 0.00 H ATOM 1384 HD21 ASN A 315 0.687 21.526 -7.976 1.00 0.00 H ATOM 1385 HD22 ASN A 315 -0.693 20.725 -7.258 1.00 0.00 H ATOM 1386 N ARG A 316 -2.517 26.054 -7.779 1.00 32.42 N ATOM 1387 CA ARG A 316 -2.752 26.922 -8.926 1.00 33.27 C ATOM 1388 C ARG A 316 -1.883 26.502 -10.106 1.00 32.89 C ATOM 1389 O ARG A 316 -2.015 27.040 -11.199 1.00 32.31 O ATOM 1390 CB ARG A 316 -2.433 28.370 -8.560 1.00 34.41 C ATOM 1391 CG ARG A 316 -3.110 28.875 -7.275 1.00 35.87 C ATOM 1392 CD ARG A 316 -2.761 30.336 -6.974 1.00 36.71 C ATOM 1393 NE ARG A 316 -2.977 31.200 -8.142 1.00 37.76 N ATOM 1394 CZ ARG A 316 -2.781 32.519 -8.164 1.00 38.15 C ATOM 1395 NH1 ARG A 316 -2.996 33.192 -9.287 1.00 38.33 N ATOM 1396 NH2 ARG A 316 -2.384 33.173 -7.077 1.00 38.61 N ATOM 1397 H ARG A 316 -1.836 26.336 -7.088 1.00 0.00 H ATOM 1398 HA ARG A 316 -3.801 26.852 -9.215 1.00 0.00 H ATOM 1399 HB2 ARG A 316 -2.754 29.007 -9.385 1.00 0.00 H ATOM 1400 HB3 ARG A 316 -1.354 28.469 -8.445 1.00 0.00 H ATOM 1401 HG2 ARG A 316 -4.190 28.789 -7.390 1.00 0.00 H ATOM 1402 HG3 ARG A 316 -2.791 28.254 -6.438 1.00 0.00 H ATOM 1403 HD2 ARG A 316 -3.389 30.687 -6.155 1.00 0.00 H ATOM 1404 HD3 ARG A 316 -1.715 30.398 -6.674 1.00 0.00 H ATOM 1405 HE ARG A 316 -3.298 30.762 -8.993 1.00 0.00 H ATOM 1406 HH11 ARG A 316 -3.302 32.705 -10.117 1.00 0.00 H ATOM 1407 HH12 ARG A 316 -2.854 34.192 -9.312 1.00 0.00 H ATOM 1408 HH21 ARG A 316 -2.245 34.173 -7.112 1.00 0.00 H ATOM 1409 HH22 ARG A 316 -2.222 32.670 -6.216 1.00 0.00 H ATOM 1410 N TYR A 317 -0.982 25.548 -9.868 1.00 33.60 N ATOM 1411 CA TYR A 317 0.030 25.131 -10.838 1.00 33.82 C ATOM 1412 C TYR A 317 0.889 26.299 -11.300 1.00 33.87 C ATOM 1413 O TYR A 317 1.268 26.388 -12.458 1.00 33.85 O ATOM 1414 CB TYR A 317 -0.609 24.375 -12.003 1.00 33.93 C ATOM 1415 CG TYR A 317 -1.405 23.206 -11.495 1.00 34.57 C ATOM 1416 CD1 TYR A 317 -2.786 23.155 -11.647 1.00 34.60 C ATOM 1417 CD2 TYR A 317 -0.779 22.176 -10.794 1.00 35.02 C ATOM 1418 CE1 TYR A 317 -3.520 22.090 -11.152 1.00 34.88 C ATOM 1419 CE2 TYR A 317 -1.505 21.106 -10.295 1.00 35.03 C ATOM 1420 CZ TYR A 317 -2.873 21.070 -10.476 1.00 35.16 C ATOM 1421 OH TYR A 317 -3.595 20.010 -9.981 1.00 35.74 O ATOM 1422 H TYR A 317 -0.999 25.088 -8.969 1.00 0.00 H ATOM 1423 HA TYR A 317 0.691 24.431 -10.328 1.00 0.00 H ATOM 1424 HB2 TYR A 317 -1.269 25.049 -12.549 1.00 0.00 H ATOM 1425 HB3 TYR A 317 0.173 24.015 -12.672 1.00 0.00 H ATOM 1426 HD1 TYR A 317 -3.294 23.959 -12.159 1.00 0.00 H ATOM 1427 HD2 TYR A 317 0.289 22.213 -10.637 1.00 0.00 H ATOM 1428 HE1 TYR A 317 -4.590 22.056 -11.293 1.00 0.00 H ATOM 1429 HE2 TYR A 317 -1.004 20.307 -9.769 1.00 0.00 H ATOM 1430 HH TYR A 317 -3.482 19.962 -9.029 1.00 0.00 H ATOM 1431 N LEU A 318 1.196 27.186 -10.361 1.00 34.56 N ATOM 1432 CA LEU A 318 2.237 28.181 -10.555 1.00 35.30 C ATOM 1433 C LEU A 318 3.543 27.440 -10.831 1.00 35.20 C ATOM 1434 O LEU A 318 4.080 26.782 -9.935 1.00 34.50 O ATOM 1435 CB LEU A 318 2.412 29.049 -9.291 1.00 35.22 C ATOM 1436 CG LEU A 318 1.227 29.871 -8.775 1.00 35.34 C ATOM 1437 CD1 LEU A 318 1.665 30.730 -7.601 1.00 34.74 C ATOM 1438 CD2 LEU A 318 0.589 30.728 -9.886 1.00 35.54 C ATOM 1439 H LEU A 318 0.691 27.169 -9.486 1.00 0.00 H ATOM 1440 HA LEU A 318 1.987 28.815 -11.405 1.00 0.00 H ATOM 1441 HB2 LEU A 318 2.709 28.379 -8.484 1.00 0.00 H ATOM 1442 HB3 LEU A 318 3.238 29.736 -9.473 1.00 0.00 H ATOM 1443 HG LEU A 318 0.470 29.175 -8.415 1.00 0.00 H ATOM 1444 HD21 LEU A 318 0.286 30.085 -10.712 1.00 0.00 H ATOM 1445 HD22 LEU A 318 1.314 31.459 -10.242 1.00 0.00 H ATOM 1446 HD23 LEU A 318 -0.284 31.246 -9.489 1.00 0.00 H ATOM 1447 HD11 LEU A 318 0.817 31.312 -7.239 1.00 0.00 H ATOM 1448 HD12 LEU A 318 2.458 31.405 -7.921 1.00 0.00 H ATOM 1449 HD13 LEU A 318 2.034 30.090 -6.800 1.00 0.00 H ATOM 1450 N THR A 319 4.011 27.506 -12.074 1.00 35.37 N ATOM 1451 CA THR A 319 5.374 27.104 -12.423 1.00 36.08 C ATOM 1452 C THR A 319 6.221 28.351 -12.700 1.00 36.28 C ATOM 1453 O THR A 319 5.679 29.418 -13.005 1.00 36.86 O ATOM 1454 CB THR A 319 5.400 26.197 -13.654 1.00 35.69 C ATOM 1455 OG1 THR A 319 4.753 26.858 -14.744 1.00 36.31 O ATOM 1456 CG2 THR A 319 4.697 24.890 -13.362 1.00 35.53 C ATOM 1457 H THR A 319 3.403 27.846 -12.805 1.00 0.00 H ATOM 1458 HA THR A 319 5.808 26.565 -11.581 1.00 0.00 H ATOM 1459 HB THR A 319 6.436 25.992 -13.925 1.00 0.00 H ATOM 1460 HG21 THR A 319 4.724 24.256 -14.248 1.00 0.00 H ATOM 1461 HG22 THR A 319 5.199 24.384 -12.538 1.00 0.00 H ATOM 1462 HG23 THR A 319 3.661 25.088 -13.089 1.00 0.00 H ATOM 1463 HG1 THR A 319 3.838 27.033 -14.514 1.00 0.00 H ATOM 1464 N LEU A 320 7.543 28.211 -12.600 1.00 36.09 N ATOM 1465 CA LEU A 320 8.468 29.352 -12.721 1.00 35.81 C ATOM 1466 C LEU A 320 8.358 30.068 -14.076 1.00 36.00 C ATOM 1467 O LEU A 320 8.652 31.254 -14.178 1.00 36.84 O ATOM 1468 CB LEU A 320 9.915 28.902 -12.469 1.00 35.05 C ATOM 1469 CG LEU A 320 10.989 29.991 -12.339 1.00 34.93 C ATOM 1470 CD1 LEU A 320 10.739 30.851 -11.111 1.00 34.61 C ATOM 1471 CD2 LEU A 320 12.389 29.393 -12.278 1.00 34.38 C ATOM 1472 H LEU A 320 7.924 27.290 -12.435 1.00 0.00 H ATOM 1473 HA LEU A 320 8.207 30.072 -11.945 1.00 0.00 H ATOM 1474 HB2 LEU A 320 10.204 28.257 -13.299 1.00 0.00 H ATOM 1475 HB3 LEU A 320 9.928 28.305 -11.557 1.00 0.00 H ATOM 1476 HG LEU A 320 10.931 30.631 -13.219 1.00 0.00 H ATOM 1477 HD11 LEU A 320 9.736 31.275 -11.162 1.00 0.00 H ATOM 1478 HD12 LEU A 320 10.829 30.238 -10.214 1.00 0.00 H ATOM 1479 HD13 LEU A 320 11.473 31.656 -11.076 1.00 0.00 H ATOM 1480 HD21 LEU A 320 12.561 28.778 -13.161 1.00 0.00 H ATOM 1481 HD22 LEU A 320 12.482 28.777 -11.383 1.00 0.00 H ATOM 1482 HD23 LEU A 320 13.126 30.196 -12.245 1.00 0.00 H ATOM 1483 N ASP A 321 7.922 29.353 -15.106 1.00 36.55 N ATOM 1484 CA ASP A 321 7.676 29.959 -16.418 1.00 36.85 C ATOM 1485 C ASP A 321 6.347 30.702 -16.443 1.00 36.68 C ATOM 1486 O ASP A 321 6.215 31.767 -15.841 1.00 36.62 O ATOM 1487 CB ASP A 321 7.693 28.886 -17.501 1.00 37.24 C ATOM 1488 CG ASP A 321 9.006 28.135 -17.549 1.00 37.88 C ATOM 1489 OD1 ASP A 321 9.731 28.141 -16.525 1.00 38.84 O ATOM 1490 OD2 ASP A 321 9.315 27.540 -18.603 1.00 38.42 O ATOM 1491 HA ASP A 321 8.474 30.672 -16.625 1.00 0.00 H ATOM 1492 HB2 ASP A 321 6.891 28.176 -17.302 1.00 0.00 H ATOM 1493 HB3 ASP A 321 7.518 29.356 -18.469 1.00 0.00 H ATOM 1494 H ASP A 321 7.755 28.365 -14.982 1.00 0.00 H END If you find results from this site helpful for your research, please cite one of our papers:
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