HEADER HYDROLASE 03-JUL-01 1JJ3 TITLE CRYSTAL STRUCTURE OF MONOCLINIC LYSOZYME GROWN AT PH 4.6 COMPND MOL_ID: 1; COMPND 2 MOLECULE: LYSOZYME; COMPND 3 CHAIN: A, B; COMPND 4 SYNONYM: 1,4-BETA-N-ACETYLMURAMIDASE C; ALLERGEN GAL D 4; COMPND 5 GAL D IV; COMPND 6 EC: 3.2.1.17 SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: GALLUS GALLUS; SOURCE 3 ORGANISM_COMMON: CHICKEN; SOURCE 4 ORGANISM_TAXID: 9031; SOURCE 5 TISSUE: EGG WHITE; SOURCE 6 CELLULAR_LOCATION: CYTOPLASM KEYWDS GLYCOSIDASE, ENZYME-TETRAGONAL FORM, MUCOPEPTIDE N- KEYWDS 2 ACETYLMURAMYL HYDROLASE, HEN EGG-WHITE LYSOZYME EXPDTA X-RAY DIFFRACTION AUTHOR S.DATTA,B.K.BISWAL,M.VIJAYAN REVDAT 3 24-FEB-09 1JJ3 1 VERSN REVDAT 2 01-APR-03 1JJ3 1 JRNL REVDAT 1 02-NOV-01 1JJ3 0 JRNL AUTH S.DATTA,B.K.BISWAL,M.VIJAYAN JRNL TITL THE EFFECT OF STABILIZING ADDITIVES ON THE JRNL TITL 2 STRUCTURE AND HYDRATION OF PROTEINS: A STUDY JRNL TITL 3 INVOLVING TETRAGONAL LYSOZYME. JRNL REF ACTA CRYSTALLOGR.,SECT.D V. 57 1614 2001 JRNL REFN ISSN 0907-4449 JRNL PMID 11679726 JRNL DOI 10.1107/S090744490101280X REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH B.K.BISWAL,N.SUKUMAR,M.VIJAYAN REMARK 1 TITL HYDRATION, MOBILITY AND ACCESSIBILITY OF LYSOZYME: REMARK 1 TITL 2 STRUCUTRES OF A PH 6.5 ORTHORHOMBIC FORM AND ITS REMARK 1 TITL 3 LOW-HUMIDITY VARIANT AND A COMPARATIVE STUDY REMARK 1 TITL 4 INVOLVING 20 CRYSTALLOGRAPHICALLY INDEPENDENT REMARK 1 TITL 5 MOLECULES REMARK 1 REF ACTA CRYSTALLOGR.,SECT.D V. 56 1110 2000 REMARK 1 REFN ISSN 0907-4449 REMARK 1 DOI 10.1107/S0907444900008866 REMARK 1 REFERENCE 2 REMARK 1 AUTH K.MADHUSUDAN,R.KODANDAPANI,M.VIJAYAN REMARK 1 TITL PROTEIN HYDRATION AND WATER STRUCTURE: X-RAY REMARK 1 TITL 2 ANALYSIS OF A CLOSELY PACKED PROTEIN CRYSTAL WITH REMARK 1 TITL 3 VERY LOW SOLVENT CONTENT REMARK 1 REF ACTA CRYSTALLOGR.,SECT.D V. 49 234 1993 REMARK 1 REFN ISSN 0907-4449 REMARK 1 DOI 10.1107/S090744499200653X REMARK 2 REMARK 2 RESOLUTION. 1.90 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- REMARK 3 : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES, PANNU, REMARK 3 : READ,RICE,SIMONSON,WARREN REMARK 3 REMARK 3 REFINEMENT TARGET : NULL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.90 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 30.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 459140.770 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 98.6 REMARK 3 NUMBER OF REFLECTIONS : 16134 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING SET) : 0.176 REMARK 3 FREE R VALUE : 0.207 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 9.900 REMARK 3 FREE R VALUE TEST SET COUNT : 1603 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.005 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 6 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 1.90 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.02 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 97.20 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 2361 REMARK 3 BIN R VALUE (WORKING SET) : 0.2090 REMARK 3 BIN FREE R VALUE : 0.2460 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 10.10 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 264 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.015 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2002 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 290 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 9.90 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 18.10 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 4.36000 REMARK 3 B22 (A**2) : -4.00000 REMARK 3 B33 (A**2) : -0.36000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : -0.43000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.19 REMARK 3 ESD FROM SIGMAA (A) : 0.13 REMARK 3 LOW RESOLUTION CUTOFF (A) : 5.00 REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : 0.23 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.19 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.005 REMARK 3 BOND ANGLES (DEGREES) : 1.40 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 23.30 REMARK 3 IMPROPER ANGLES (DEGREES) : 0.81 REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : RESTRAINED REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : 0.970 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 1.580 ; 2.000 REMARK 3 SIDE-CHAIN BOND (A**2) : 1.680 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 2.670 ; 2.500 REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : FLAT MODEL REMARK 3 KSOL : 0.35 REMARK 3 BSOL : 57.13 REMARK 3 REMARK 3 NCS MODEL : NULL REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : PROTEIN_REP.PARAM REMARK 3 PARAMETER FILE 2 : WATER_REP.PARAM REMARK 3 PARAMETER FILE 3 : NULL REMARK 3 TOPOLOGY FILE 1 : PROTEIN.TOP REMARK 3 TOPOLOGY FILE 2 : WATER.TOP REMARK 3 TOPOLOGY FILE 3 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1JJ3 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 11-JUL-01. REMARK 100 THE RCSB ID CODE IS RCSB013830. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : NULL REMARK 200 TEMPERATURE (KELVIN) : 293 REMARK 200 PH : 4.6 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : ROTATING ANODE REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : RIGAKU RU200 REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : MARRESEARCH REMARK 200 INTENSITY-INTEGRATION SOFTWARE : MAR REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 19151 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.800 REMARK 200 RESOLUTION RANGE LOW (A) : 30.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.5 REMARK 200 DATA REDUNDANCY : NULL REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 0.07700 REMARK 200 FOR THE DATA SET : 9.3000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.80 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.86 REMARK 200 COMPLETENESS FOR SHELL (%) : 99.2 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : 0.21600 REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: AMORE REMARK 200 STARTING MODEL: PDB ENTRY 193L REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 32.71 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 1.83 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: NA-ACETATE BUFFER, PH 4.6, 10% REMARK 280 NACL, LIQUID DIFFUSION AT 293K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1 21 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,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 31.40150 REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1, 2 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: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A 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 350 REMARK 350 BIOMOLECULE: 2 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: 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 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O HOH A 191 O HOH A 200 1.99 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 SER B 72 112.10 7.41 REMARK 500 ASN B 74 65.22 -157.05 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH B 328 DISTANCE = 5.62 ANGSTROMS REMARK 525 HOH A 385 DISTANCE = 6.02 ANGSTROMS REMARK 525 HOH B 404 DISTANCE = 5.02 ANGSTROMS DBREF 1JJ3 A 1 129 UNP P00698 LYSC_CHICK 19 147 DBREF 1JJ3 B 1 129 UNP P00698 LYSC_CHICK 19 147 SEQRES 1 A 129 LYS VAL PHE GLY ARG CYS GLU LEU ALA ALA ALA MET LYS SEQRES 2 A 129 ARG HIS GLY LEU ASP ASN TYR ARG GLY TYR SER LEU GLY SEQRES 3 A 129 ASN TRP VAL CYS ALA ALA LYS PHE GLU SER ASN PHE ASN SEQRES 4 A 129 THR GLN ALA THR ASN ARG ASN THR ASP GLY SER THR ASP SEQRES 5 A 129 TYR GLY ILE LEU GLN ILE ASN SER ARG TRP TRP CYS ASN SEQRES 6 A 129 ASP GLY ARG THR PRO GLY SER ARG ASN LEU CYS ASN ILE SEQRES 7 A 129 PRO CYS SER ALA LEU LEU SER SER ASP ILE THR ALA SER SEQRES 8 A 129 VAL ASN CYS ALA LYS LYS ILE VAL SER ASP GLY ASN GLY SEQRES 9 A 129 MET ASN ALA TRP VAL ALA TRP ARG ASN ARG CYS LYS GLY SEQRES 10 A 129 THR ASP VAL GLN ALA TRP ILE ARG GLY CYS ARG LEU SEQRES 1 B 129 LYS VAL PHE GLY ARG CYS GLU LEU ALA ALA ALA MET LYS SEQRES 2 B 129 ARG HIS GLY LEU ASP ASN TYR ARG GLY TYR SER LEU GLY SEQRES 3 B 129 ASN TRP VAL CYS ALA ALA LYS PHE GLU SER ASN PHE ASN SEQRES 4 B 129 THR GLN ALA THR ASN ARG ASN THR ASP GLY SER THR ASP SEQRES 5 B 129 TYR GLY ILE LEU GLN ILE ASN SER ARG TRP TRP CYS ASN SEQRES 6 B 129 ASP GLY ARG THR PRO GLY SER ARG ASN LEU CYS ASN ILE SEQRES 7 B 129 PRO CYS SER ALA LEU LEU SER SER ASP ILE THR ALA SER SEQRES 8 B 129 VAL ASN CYS ALA LYS LYS ILE VAL SER ASP GLY ASN GLY SEQRES 9 B 129 MET ASN ALA TRP VAL ALA TRP ARG ASN ARG CYS LYS GLY SEQRES 10 B 129 THR ASP VAL GLN ALA TRP ILE ARG GLY CYS ARG LEU FORMUL 3 HOH *290(H2 O) HELIX 1 1 GLY A 4 HIS A 15 1 12 HELIX 2 2 SER A 24 ASN A 37 1 14 HELIX 3 3 CYS A 80 SER A 85 5 6 HELIX 4 4 ILE A 88 SER A 100 1 13 HELIX 5 5 ASN A 103 ALA A 107 5 5 HELIX 6 6 TRP A 108 CYS A 115 1 8 HELIX 7 7 ASP A 119 ARG A 125 5 7 HELIX 8 8 GLY B 4 HIS B 15 1 12 HELIX 9 9 SER B 24 ASN B 37 1 14 HELIX 10 10 CYS B 80 SER B 85 5 6 HELIX 11 11 ILE B 88 SER B 100 1 13 HELIX 12 12 ASN B 103 ALA B 107 5 5 HELIX 13 13 TRP B 108 CYS B 115 1 8 HELIX 14 14 ASP B 119 ARG B 125 5 7 SHEET 1 A 3 THR A 43 ARG A 45 0 SHEET 2 A 3 THR A 51 TYR A 53 -1 N ASP A 52 O ASN A 44 SHEET 3 A 3 ILE A 58 ASN A 59 -1 O ILE A 58 N TYR A 53 SHEET 1 B 3 THR B 43 ARG B 45 0 SHEET 2 B 3 THR B 51 TYR B 53 -1 N ASP B 52 O ASN B 44 SHEET 3 B 3 ILE B 58 ASN B 59 -1 O ILE B 58 N TYR B 53 SSBOND 1 CYS A 6 CYS A 127 1555 1555 2.04 SSBOND 2 CYS A 30 CYS A 115 1555 1555 2.03 SSBOND 3 CYS A 64 CYS A 80 1555 1555 2.03 SSBOND 4 CYS A 76 CYS A 94 1555 1555 2.03 SSBOND 5 CYS B 6 CYS B 127 1555 1555 2.05 SSBOND 6 CYS B 30 CYS B 115 1555 1555 2.02 SSBOND 7 CYS B 64 CYS B 80 1555 1555 2.04 SSBOND 8 CYS B 76 CYS B 94 1555 1555 2.04 CRYST1 27.415 62.803 60.935 90.00 92.72 90.00 P 1 21 1 4 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.036476 0.000000 0.001733 0.00000 SCALE2 0.000000 0.015923 0.000000 0.00000 SCALE3 0.000000 0.000000 0.016429 0.00000 ATOM 1 N LYS A 1 -1.018 11.966 14.747 1.00 15.38 N ATOM 2 CA LYS A 1 -0.533 12.915 13.707 1.00 16.16 C ATOM 3 C LYS A 1 -1.128 12.609 12.334 1.00 15.58 C ATOM 4 O LYS A 1 -1.272 11.448 11.951 1.00 15.56 O ATOM 5 CB LYS A 1 0.996 12.849 13.615 1.00 17.20 C ATOM 6 CG LYS A 1 1.581 13.576 12.411 1.00 18.68 C ATOM 7 CD LYS A 1 3.090 13.409 12.354 1.00 20.39 C ATOM 8 CE LYS A 1 3.687 14.114 11.152 1.00 20.28 C ATOM 9 NZ LYS A 1 5.171 13.985 11.145 1.00 23.01 N ATOM 10 N VAL A 2 -1.481 13.659 11.600 1.00 14.76 N ATOM 11 CA VAL A 2 -2.018 13.493 10.257 1.00 13.76 C ATOM 12 C VAL A 2 -0.939 13.951 9.279 1.00 13.07 C ATOM 13 O VAL A 2 -0.587 15.130 9.237 1.00 12.62 O ATOM 14 CB VAL A 2 -3.293 14.339 10.037 1.00 13.99 C ATOM 15 CG1 VAL A 2 -3.750 14.226 8.585 1.00 13.55 C ATOM 16 CG2 VAL A 2 -4.396 13.862 10.972 1.00 14.46 C ATOM 17 N PHE A 3 -0.413 13.007 8.504 1.00 11.48 N ATOM 18 CA PHE A 3 0.635 13.291 7.531 1.00 11.26 C ATOM 19 C PHE A 3 0.156 13.996 6.280 1.00 11.67 C ATOM 20 O PHE A 3 -0.982 13.814 5.846 1.00 12.96 O ATOM 21 CB PHE A 3 1.310 12.004 7.060 1.00 11.30 C ATOM 22 CG PHE A 3 2.409 11.515 7.941 1.00 11.58 C ATOM 23 CD1 PHE A 3 2.136 10.689 9.027 1.00 11.66 C ATOM 24 CD2 PHE A 3 3.728 11.878 7.684 1.00 11.79 C ATOM 25 CE1 PHE A 3 3.166 10.196 9.822 1.00 11.77 C ATOM 26 CE2 PHE A 3 4.767 11.391 8.472 1.00 11.92 C ATOM 27 CZ PHE A 3 4.487 10.562 9.552 1.00 12.10 C ATOM 28 N GLY A 4 1.048 14.795 5.699 1.00 11.14 N ATOM 29 CA GLY A 4 0.747 15.449 4.446 1.00 10.60 C ATOM 30 C GLY A 4 1.133 14.371 3.446 1.00 11.17 C ATOM 31 O GLY A 4 1.866 13.449 3.804 1.00 11.53 O ATOM 32 N ARG A 5 0.661 14.463 2.208 1.00 11.55 N ATOM 33 CA ARG A 5 0.974 13.446 1.208 1.00 12.31 C ATOM 34 C ARG A 5 2.467 13.248 0.948 1.00 12.13 C ATOM 35 O ARG A 5 2.985 12.136 1.072 1.00 12.04 O ATOM 36 CB ARG A 5 0.260 13.766 -0.110 1.00 12.07 C ATOM 37 CG ARG A 5 0.513 12.749 -1.216 1.00 11.99 C ATOM 38 CD ARG A 5 -0.477 12.925 -2.364 1.00 12.14 C ATOM 39 NE ARG A 5 -0.373 14.238 -3.001 1.00 11.93 N ATOM 40 CZ ARG A 5 0.609 14.606 -3.824 1.00 10.61 C ATOM 41 NH1 ARG A 5 1.586 13.763 -4.131 1.00 8.78 N ATOM 42 NH2 ARG A 5 0.616 15.829 -4.337 1.00 8.94 N ATOM 43 N CYS A 6 3.158 14.322 0.583 1.00 12.26 N ATOM 44 CA CYS A 6 4.588 14.245 0.307 1.00 12.41 C ATOM 45 C CYS A 6 5.398 13.969 1.565 1.00 11.85 C ATOM 46 O CYS A 6 6.455 13.333 1.509 1.00 11.78 O ATOM 47 CB CYS A 6 5.054 15.538 -0.357 1.00 13.71 C ATOM 48 SG CYS A 6 4.425 15.616 -2.088 1.00 19.23 S ATOM 49 N GLU A 7 4.911 14.462 2.699 1.00 10.60 N ATOM 50 CA GLU A 7 5.599 14.259 3.968 1.00 10.38 C ATOM 51 C GLU A 7 5.661 12.757 4.260 1.00 10.44 C ATOM 52 O GLU A 7 6.707 12.231 4.649 1.00 10.47 O ATOM 53 CB GLU A 7 4.856 14.991 5.091 1.00 12.00 C ATOM 54 CG GLU A 7 5.467 14.823 6.472 1.00 14.24 C ATOM 55 CD GLU A 7 4.606 15.431 7.565 1.00 14.07 C ATOM 56 OE1 GLU A 7 3.395 15.617 7.339 1.00 14.09 O ATOM 57 OE2 GLU A 7 5.134 15.707 8.658 1.00 15.70 O ATOM 58 N LEU A 8 4.538 12.071 4.062 1.00 9.25 N ATOM 59 CA LEU A 8 4.479 10.631 4.297 1.00 9.12 C ATOM 60 C LEU A 8 5.340 9.913 3.271 1.00 9.25 C ATOM 61 O LEU A 8 6.089 8.999 3.606 1.00 10.32 O ATOM 62 CB LEU A 8 3.038 10.115 4.190 1.00 9.03 C ATOM 63 CG LEU A 8 2.906 8.610 4.452 1.00 9.42 C ATOM 64 CD1 LEU A 8 3.411 8.302 5.851 1.00 10.14 C ATOM 65 CD2 LEU A 8 1.460 8.164 4.290 1.00 11.09 C ATOM 66 N ALA A 9 5.220 10.331 2.017 1.00 9.35 N ATOM 67 CA ALA A 9 5.988 9.728 0.935 1.00 9.97 C ATOM 68 C ALA A 9 7.476 9.735 1.273 1.00 10.45 C ATOM 69 O ALA A 9 8.154 8.716 1.152 1.00 10.00 O ATOM 70 CB ALA A 9 5.741 10.494 -0.364 1.00 10.71 C ATOM 71 N ALA A 10 7.975 10.888 1.706 1.00 11.19 N ATOM 72 CA ALA A 10 9.387 11.029 2.051 1.00 11.49 C ATOM 73 C ALA A 10 9.779 10.112 3.206 1.00 11.98 C ATOM 74 O ALA A 10 10.840 9.487 3.191 1.00 12.34 O ATOM 75 CB ALA A 10 9.691 12.480 2.412 1.00 13.17 C ATOM 76 N ALA A 11 8.917 10.042 4.211 1.00 10.86 N ATOM 77 CA ALA A 11 9.173 9.204 5.373 1.00 11.40 C ATOM 78 C ALA A 11 9.197 7.723 4.999 1.00 11.53 C ATOM 79 O ALA A 11 9.993 6.956 5.543 1.00 11.11 O ATOM 80 CB ALA A 11 8.115 9.460 6.440 1.00 10.39 C ATOM 81 N MET A 12 8.321 7.318 4.082 1.00 11.15 N ATOM 82 CA MET A 12 8.271 5.920 3.665 1.00 12.46 C ATOM 83 C MET A 12 9.481 5.587 2.813 1.00 13.56 C ATOM 84 O MET A 12 10.034 4.494 2.913 1.00 12.99 O ATOM 85 CB MET A 12 6.997 5.624 2.874 1.00 11.48 C ATOM 86 CG MET A 12 5.725 5.680 3.703 1.00 11.71 C ATOM 87 SD MET A 12 4.278 5.249 2.734 1.00 11.88 S ATOM 88 CE MET A 12 3.285 4.378 3.964 1.00 11.66 C ATOM 89 N LYS A 13 9.883 6.534 1.971 1.00 15.07 N ATOM 90 CA LYS A 13 11.042 6.338 1.105 1.00 17.79 C ATOM 91 C LYS A 13 12.275 6.190 1.990 1.00 17.95 C ATOM 92 O LYS A 13 13.154 5.369 1.732 1.00 18.10 O ATOM 93 CB LYS A 13 11.212 7.541 0.169 1.00 20.14 C ATOM 94 CG LYS A 13 12.317 7.364 -0.865 1.00 23.85 C ATOM 95 CD LYS A 13 12.370 8.541 -1.822 1.00 26.74 C ATOM 96 CE LYS A 13 13.421 8.327 -2.903 1.00 28.83 C ATOM 97 NZ LYS A 13 14.795 8.201 -2.335 1.00 30.07 N ATOM 98 N ARG A 14 12.318 6.993 3.046 1.00 18.36 N ATOM 99 CA ARG A 14 13.420 6.981 3.995 1.00 19.72 C ATOM 100 C ARG A 14 13.512 5.615 4.674 1.00 19.74 C ATOM 101 O ARG A 14 14.606 5.144 4.991 1.00 18.98 O ATOM 102 CB ARG A 14 13.197 8.080 5.037 1.00 21.87 C ATOM 103 CG ARG A 14 14.375 8.373 5.941 1.00 24.66 C ATOM 104 CD ARG A 14 14.036 9.523 6.887 1.00 27.52 C ATOM 105 NE ARG A 14 12.964 9.176 7.823 1.00 29.72 N ATOM 106 CZ ARG A 14 11.863 9.902 8.013 1.00 30.60 C ATOM 107 NH1 ARG A 14 11.675 11.024 7.328 1.00 30.57 N ATOM 108 NH2 ARG A 14 10.949 9.508 8.893 1.00 29.78 N ATOM 109 N HIS A 15 12.361 4.977 4.884 1.00 18.59 N ATOM 110 CA HIS A 15 12.322 3.667 5.529 1.00 18.99 C ATOM 111 C HIS A 15 12.383 2.478 4.570 1.00 18.88 C ATOM 112 O HIS A 15 12.026 1.357 4.938 1.00 19.69 O ATOM 113 CB HIS A 15 11.082 3.547 6.427 1.00 19.09 C ATOM 114 CG HIS A 15 11.182 4.305 7.698 1.00 20.89 C ATOM 115 ND1 HIS A 15 10.933 5.695 7.783 1.00 21.33 N ATOM 116 CD2 HIS A 15 11.515 3.948 8.950 1.00 20.44 C ATOM 117 CE1 HIS A 15 11.112 6.086 8.997 1.00 21.04 C ATOM 118 NE2 HIS A 15 11.471 5.061 9.760 1.00 21.40 N ATOM 119 N GLY A 16 12.824 2.732 3.343 1.00 18.28 N ATOM 120 CA GLY A 16 12.977 1.678 2.353 1.00 18.87 C ATOM 121 C GLY A 16 11.761 0.978 1.778 1.00 18.76 C ATOM 122 O GLY A 16 11.849 -0.192 1.411 1.00 19.59 O ATOM 123 N LEU A 17 10.631 1.667 1.675 1.00 18.13 N ATOM 124 CA LEU A 17 9.442 1.033 1.123 1.00 17.36 C ATOM 125 C LEU A 17 9.352 1.132 -0.396 1.00 17.99 C ATOM 126 O LEU A 17 8.630 0.361 -1.026 1.00 16.89 O ATOM 127 CB LEU A 17 8.175 1.616 1.758 1.00 15.99 C ATOM 128 CG LEU A 17 7.843 1.081 3.154 1.00 16.42 C ATOM 129 CD1 LEU A 17 6.573 1.740 3.680 1.00 15.99 C ATOM 130 CD2 LEU A 17 7.665 -0.431 3.083 1.00 14.83 C ATOM 131 N ASP A 18 10.090 2.068 -0.986 1.00 18.29 N ATOM 132 CA ASP A 18 10.064 2.236 -2.435 1.00 19.98 C ATOM 133 C ASP A 18 10.603 0.983 -3.130 1.00 20.57 C ATOM 134 O ASP A 18 11.765 0.619 -2.964 1.00 19.87 O ATOM 135 CB ASP A 18 10.886 3.467 -2.836 1.00 21.69 C ATOM 136 CG ASP A 18 10.783 3.782 -4.321 1.00 23.90 C ATOM 137 OD1 ASP A 18 9.748 3.444 -4.936 1.00 24.96 O ATOM 138 OD2 ASP A 18 11.730 4.383 -4.872 1.00 26.09 O ATOM 139 N ASN A 19 9.741 0.327 -3.901 1.00 21.95 N ATOM 140 CA ASN A 19 10.099 -0.888 -4.625 1.00 23.07 C ATOM 141 C ASN A 19 10.316 -2.096 -3.720 1.00 23.41 C ATOM 142 O ASN A 19 10.824 -3.125 -4.169 1.00 23.68 O ATOM 143 CB ASN A 19 11.354 -0.667 -5.479 1.00 24.61 C ATOM 144 CG ASN A 19 11.118 0.299 -6.618 1.00 24.68 C ATOM 145 OD1 ASN A 19 10.104 0.218 -7.311 1.00 25.85 O ATOM 146 ND2 ASN A 19 12.061 1.211 -6.828 1.00 25.14 N ATOM 147 N TYR A 20 9.946 -1.978 -2.448 1.00 23.17 N ATOM 148 CA TYR A 20 10.106 -3.102 -1.533 1.00 23.18 C ATOM 149 C TYR A 20 9.178 -4.220 -2.003 1.00 23.05 C ATOM 150 O TYR A 20 7.982 -4.006 -2.190 1.00 22.17 O ATOM 151 CB TYR A 20 9.741 -2.702 -0.105 1.00 23.34 C ATOM 152 CG TYR A 20 10.087 -3.768 0.904 1.00 24.15 C ATOM 153 CD1 TYR A 20 11.392 -3.911 1.372 1.00 24.62 C ATOM 154 CD2 TYR A 20 9.123 -4.670 1.353 1.00 24.24 C ATOM 155 CE1 TYR A 20 11.731 -4.931 2.264 1.00 25.48 C ATOM 156 CE2 TYR A 20 9.451 -5.692 2.242 1.00 25.29 C ATOM 157 CZ TYR A 20 10.756 -5.817 2.691 1.00 25.34 C ATOM 158 OH TYR A 20 11.086 -6.834 3.559 1.00 26.43 O ATOM 159 N ARG A 21 9.734 -5.411 -2.196 1.00 23.98 N ATOM 160 CA ARG A 21 8.958 -6.554 -2.663 1.00 25.26 C ATOM 161 C ARG A 21 8.287 -6.258 -3.998 1.00 24.27 C ATOM 162 O ARG A 21 7.269 -6.856 -4.335 1.00 24.36 O ATOM 163 CB ARG A 21 7.897 -6.947 -1.630 1.00 28.48 C ATOM 164 CG ARG A 21 8.462 -7.615 -0.388 1.00 32.07 C ATOM 165 CD ARG A 21 9.114 -8.952 -0.716 1.00 35.77 C ATOM 166 NE ARG A 21 9.776 -9.530 0.450 1.00 39.52 N ATOM 167 CZ ARG A 21 10.884 -9.041 1.000 1.00 40.84 C ATOM 168 NH1 ARG A 21 11.468 -7.970 0.480 1.00 42.43 N ATOM 169 NH2 ARG A 21 11.411 -9.625 2.067 1.00 41.86 N ATOM 170 N GLY A 22 8.861 -5.324 -4.750 1.00 24.07 N ATOM 171 CA GLY A 22 8.319 -4.977 -6.053 1.00 23.22 C ATOM 172 C GLY A 22 7.200 -3.951 -6.082 1.00 22.83 C ATOM 173 O GLY A 22 6.583 -3.742 -7.126 1.00 23.32 O ATOM 174 N TYR A 23 6.926 -3.306 -4.953 1.00 21.74 N ATOM 175 CA TYR A 23 5.866 -2.302 -4.906 1.00 19.92 C ATOM 176 C TYR A 23 6.426 -0.888 -4.793 1.00 19.21 C ATOM 177 O TYR A 23 7.042 -0.529 -3.788 1.00 18.25 O ATOM 178 CB TYR A 23 4.921 -2.585 -3.735 1.00 18.69 C ATOM 179 CG TYR A 23 4.075 -3.821 -3.923 1.00 18.27 C ATOM 180 CD1 TYR A 23 2.864 -3.761 -4.612 1.00 18.33 C ATOM 181 CD2 TYR A 23 4.487 -5.058 -3.419 1.00 18.51 C ATOM 182 CE1 TYR A 23 2.078 -4.895 -4.794 1.00 18.70 C ATOM 183 CE2 TYR A 23 3.705 -6.204 -3.597 1.00 18.00 C ATOM 184 CZ TYR A 23 2.502 -6.114 -4.286 1.00 18.58 C ATOM 185 OH TYR A 23 1.711 -7.229 -4.464 1.00 19.05 O ATOM 186 N SER A 24 6.201 -0.092 -5.835 1.00 19.13 N ATOM 187 CA SER A 24 6.679 1.288 -5.880 1.00 18.97 C ATOM 188 C SER A 24 6.112 2.132 -4.740 1.00 17.97 C ATOM 189 O SER A 24 5.049 1.827 -4.193 1.00 18.05 O ATOM 190 CB SER A 24 6.311 1.936 -7.220 1.00 18.15 C ATOM 191 OG SER A 24 4.904 2.042 -7.364 1.00 17.67 O ATOM 192 N LEU A 25 6.835 3.196 -4.401 1.00 16.94 N ATOM 193 CA LEU A 25 6.447 4.113 -3.332 1.00 15.55 C ATOM 194 C LEU A 25 4.982 4.522 -3.449 1.00 14.10 C ATOM 195 O LEU A 25 4.260 4.570 -2.453 1.00 13.35 O ATOM 196 CB LEU A 25 7.318 5.373 -3.384 1.00 16.74 C ATOM 197 CG LEU A 25 7.946 5.907 -2.096 1.00 18.67 C ATOM 198 CD1 LEU A 25 8.305 7.367 -2.300 1.00 19.01 C ATOM 199 CD2 LEU A 25 6.994 5.753 -0.926 1.00 19.64 C ATOM 200 N GLY A 26 4.559 4.825 -4.673 1.00 12.30 N ATOM 201 CA GLY A 26 3.188 5.236 -4.921 1.00 11.68 C ATOM 202 C GLY A 26 2.137 4.299 -4.357 1.00 10.77 C ATOM 203 O GLY A 26 1.079 4.740 -3.905 1.00 10.65 O ATOM 204 N ASN A 27 2.417 3.001 -4.399 1.00 11.17 N ATOM 205 CA ASN A 27 1.486 2.003 -3.875 1.00 10.67 C ATOM 206 C ASN A 27 1.306 2.164 -2.371 1.00 10.09 C ATOM 207 O ASN A 27 0.191 2.098 -1.853 1.00 10.12 O ATOM 208 CB ASN A 27 2.003 0.594 -4.163 1.00 11.01 C ATOM 209 CG ASN A 27 1.712 0.147 -5.578 1.00 11.81 C ATOM 210 OD1 ASN A 27 0.557 -0.061 -5.945 1.00 13.14 O ATOM 211 ND2 ASN A 27 2.757 0.001 -6.382 1.00 10.38 N ATOM 212 N TRP A 28 2.413 2.375 -1.673 1.00 9.76 N ATOM 213 CA TRP A 28 2.365 2.524 -0.229 1.00 9.99 C ATOM 214 C TRP A 28 1.643 3.785 0.229 1.00 9.94 C ATOM 215 O TRP A 28 0.882 3.751 1.200 1.00 9.95 O ATOM 216 CB TRP A 28 3.778 2.475 0.340 1.00 11.55 C ATOM 217 CG TRP A 28 4.450 1.169 0.068 1.00 11.85 C ATOM 218 CD1 TRP A 28 5.348 0.894 -0.924 1.00 14.26 C ATOM 219 CD2 TRP A 28 4.272 -0.049 0.794 1.00 13.20 C ATOM 220 NE1 TRP A 28 5.741 -0.421 -0.860 1.00 13.53 N ATOM 221 CE2 TRP A 28 5.091 -1.025 0.187 1.00 14.56 C ATOM 222 CE3 TRP A 28 3.490 -0.413 1.901 1.00 13.94 C ATOM 223 CZ2 TRP A 28 5.163 -2.343 0.652 1.00 14.16 C ATOM 224 CZ3 TRP A 28 3.562 -1.727 2.365 1.00 14.92 C ATOM 225 CH2 TRP A 28 4.391 -2.673 1.740 1.00 14.29 C ATOM 226 N VAL A 29 1.871 4.894 -0.468 1.00 9.58 N ATOM 227 CA VAL A 29 1.212 6.150 -0.120 1.00 9.02 C ATOM 228 C VAL A 29 -0.286 5.996 -0.350 1.00 8.70 C ATOM 229 O VAL A 29 -1.099 6.383 0.489 1.00 9.28 O ATOM 230 CB VAL A 29 1.739 7.321 -0.978 1.00 9.27 C ATOM 231 CG1 VAL A 29 0.994 8.600 -0.634 1.00 9.11 C ATOM 232 CG2 VAL A 29 3.235 7.498 -0.750 1.00 9.12 C ATOM 233 N CYS A 30 -0.647 5.418 -1.491 1.00 8.22 N ATOM 234 CA CYS A 30 -2.051 5.206 -1.818 1.00 9.06 C ATOM 235 C CYS A 30 -2.705 4.310 -0.769 1.00 8.56 C ATOM 236 O CYS A 30 -3.844 4.537 -0.359 1.00 9.18 O ATOM 237 CB CYS A 30 -2.177 4.562 -3.199 1.00 10.87 C ATOM 238 SG CYS A 30 -3.891 4.427 -3.794 1.00 14.74 S ATOM 239 N ALA A 31 -1.974 3.290 -0.335 1.00 7.46 N ATOM 240 CA ALA A 31 -2.482 2.363 0.670 1.00 7.34 C ATOM 241 C ALA A 31 -2.796 3.111 1.964 1.00 7.75 C ATOM 242 O ALA A 31 -3.880 2.967 2.529 1.00 8.00 O ATOM 243 CB ALA A 31 -1.452 1.266 0.934 1.00 7.32 C ATOM 244 N ALA A 32 -1.841 3.913 2.424 1.00 7.22 N ATOM 245 CA ALA A 32 -2.019 4.679 3.653 1.00 8.59 C ATOM 246 C ALA A 32 -3.197 5.639 3.536 1.00 8.62 C ATOM 247 O ALA A 32 -3.968 5.800 4.479 1.00 9.61 O ATOM 248 CB ALA A 32 -0.747 5.451 3.974 1.00 9.46 C ATOM 249 N LYS A 33 -3.337 6.266 2.371 1.00 9.21 N ATOM 250 CA LYS A 33 -4.420 7.214 2.137 1.00 9.70 C ATOM 251 C LYS A 33 -5.803 6.608 2.352 1.00 9.91 C ATOM 252 O LYS A 33 -6.639 7.181 3.049 1.00 10.26 O ATOM 253 CB LYS A 33 -4.338 7.773 0.712 1.00 12.43 C ATOM 254 CG LYS A 33 -5.535 8.642 0.305 1.00 15.41 C ATOM 255 CD LYS A 33 -5.678 9.862 1.207 1.00 17.57 C ATOM 256 CE LYS A 33 -6.801 10.780 0.743 1.00 20.67 C ATOM 257 NZ LYS A 33 -6.947 11.969 1.634 1.00 21.92 N ATOM 258 N PHE A 34 -6.050 5.449 1.754 1.00 9.65 N ATOM 259 CA PHE A 34 -7.357 4.829 1.877 1.00 10.24 C ATOM 260 C PHE A 34 -7.541 3.919 3.079 1.00 10.20 C ATOM 261 O PHE A 34 -8.669 3.609 3.458 1.00 11.63 O ATOM 262 CB PHE A 34 -7.698 4.116 0.570 1.00 12.28 C ATOM 263 CG PHE A 34 -7.811 5.063 -0.592 1.00 13.03 C ATOM 264 CD1 PHE A 34 -8.846 5.992 -0.645 1.00 14.62 C ATOM 265 CD2 PHE A 34 -6.859 5.065 -1.604 1.00 13.97 C ATOM 266 CE1 PHE A 34 -8.923 6.931 -1.679 1.00 14.63 C ATOM 267 CE2 PHE A 34 -6.925 6.002 -2.645 1.00 15.45 C ATOM 268 CZ PHE A 34 -7.967 6.930 -2.682 1.00 14.80 C ATOM 269 N GLU A 35 -6.441 3.499 3.690 1.00 9.87 N ATOM 270 CA GLU A 35 -6.536 2.665 4.879 1.00 8.91 C ATOM 271 C GLU A 35 -6.789 3.546 6.102 1.00 8.60 C ATOM 272 O GLU A 35 -7.689 3.280 6.891 1.00 8.10 O ATOM 273 CB GLU A 35 -5.240 1.881 5.114 1.00 10.16 C ATOM 274 CG GLU A 35 -5.033 0.650 4.241 1.00 11.41 C ATOM 275 CD GLU A 35 -6.074 -0.438 4.467 1.00 12.63 C ATOM 276 OE1 GLU A 35 -6.750 -0.436 5.518 1.00 13.18 O ATOM 277 OE2 GLU A 35 -6.204 -1.310 3.586 1.00 14.03 O ATOM 278 N SER A 36 -6.008 4.615 6.236 1.00 8.64 N ATOM 279 CA SER A 36 -6.105 5.486 7.407 1.00 8.77 C ATOM 280 C SER A 36 -6.277 6.976 7.143 1.00 9.94 C ATOM 281 O SER A 36 -6.373 7.758 8.090 1.00 8.55 O ATOM 282 CB SER A 36 -4.848 5.311 8.254 1.00 8.85 C ATOM 283 OG SER A 36 -3.743 5.878 7.570 1.00 8.15 O ATOM 284 N ASN A 37 -6.292 7.378 5.877 1.00 10.03 N ATOM 285 CA ASN A 37 -6.431 8.793 5.548 1.00 11.21 C ATOM 286 C ASN A 37 -5.261 9.566 6.174 1.00 10.42 C ATOM 287 O ASN A 37 -5.420 10.690 6.652 1.00 9.73 O ATOM 288 CB ASN A 37 -7.778 9.329 6.064 1.00 13.98 C ATOM 289 CG ASN A 37 -8.191 10.623 5.384 1.00 16.57 C ATOM 290 OD1 ASN A 37 -7.781 10.899 4.262 1.00 18.16 O ATOM 291 ND2 ASN A 37 -9.027 11.412 6.055 1.00 19.19 N ATOM 292 N PHE A 38 -4.092 8.929 6.163 1.00 8.18 N ATOM 293 CA PHE A 38 -2.843 9.484 6.685 1.00 9.69 C ATOM 294 C PHE A 38 -2.852 9.806 8.180 1.00 9.86 C ATOM 295 O PHE A 38 -2.045 10.610 8.652 1.00 9.32 O ATOM 296 CB PHE A 38 -2.438 10.752 5.919 1.00 11.19 C ATOM 297 CG PHE A 38 -2.261 10.552 4.436 1.00 11.38 C ATOM 298 CD1 PHE A 38 -1.698 9.382 3.927 1.00 11.51 C ATOM 299 CD2 PHE A 38 -2.602 11.570 3.548 1.00 12.28 C ATOM 300 CE1 PHE A 38 -1.488 9.227 2.551 1.00 12.19 C ATOM 301 CE2 PHE A 38 -2.397 11.425 2.171 1.00 12.31 C ATOM 302 CZ PHE A 38 -1.833 10.254 1.673 1.00 10.83 C ATOM 303 N ASN A 39 -3.746 9.167 8.922 1.00 9.64 N ATOM 304 CA ASN A 39 -3.847 9.397 10.357 1.00 9.38 C ATOM 305 C ASN A 39 -3.168 8.278 11.152 1.00 9.38 C ATOM 306 O ASN A 39 -3.646 7.141 11.157 1.00 8.01 O ATOM 307 CB ASN A 39 -5.326 9.510 10.745 1.00 9.99 C ATOM 308 CG ASN A 39 -5.527 9.722 12.231 1.00 10.84 C ATOM 309 OD1 ASN A 39 -4.640 10.218 12.923 1.00 12.48 O ATOM 310 ND2 ASN A 39 -6.705 9.363 12.725 1.00 12.22 N ATOM 311 N THR A 40 -2.062 8.603 11.825 1.00 8.35 N ATOM 312 CA THR A 40 -1.319 7.617 12.613 1.00 8.48 C ATOM 313 C THR A 40 -2.107 7.052 13.789 1.00 9.06 C ATOM 314 O THR A 40 -1.804 5.962 14.275 1.00 9.30 O ATOM 315 CB THR A 40 -0.008 8.197 13.200 1.00 8.49 C ATOM 316 OG1 THR A 40 -0.315 9.318 14.039 1.00 9.47 O ATOM 317 CG2 THR A 40 0.941 8.626 12.091 1.00 7.24 C ATOM 318 N GLN A 41 -3.111 7.789 14.251 1.00 9.23 N ATOM 319 CA GLN A 41 -3.899 7.330 15.387 1.00 10.92 C ATOM 320 C GLN A 41 -5.156 6.557 14.994 1.00 10.95 C ATOM 321 O GLN A 41 -5.911 6.128 15.859 1.00 11.05 O ATOM 322 CB GLN A 41 -4.295 8.520 16.264 1.00 13.74 C ATOM 323 CG GLN A 41 -3.140 9.422 16.650 1.00 18.11 C ATOM 324 CD GLN A 41 -3.547 10.485 17.657 1.00 21.06 C ATOM 325 OE1 GLN A 41 -4.557 11.169 17.483 1.00 22.83 O ATOM 326 NE2 GLN A 41 -2.754 10.634 18.714 1.00 22.64 N ATOM 327 N ALA A 42 -5.373 6.370 13.698 1.00 10.11 N ATOM 328 CA ALA A 42 -6.555 5.660 13.221 1.00 10.96 C ATOM 329 C ALA A 42 -6.691 4.243 13.780 1.00 10.89 C ATOM 330 O ALA A 42 -5.718 3.499 13.861 1.00 10.32 O ATOM 331 CB ALA A 42 -6.551 5.611 11.691 1.00 10.17 C ATOM 332 N THR A 43 -7.911 3.881 14.166 1.00 11.73 N ATOM 333 CA THR A 43 -8.198 2.548 14.681 1.00 12.28 C ATOM 334 C THR A 43 -9.575 2.123 14.188 1.00 13.56 C ATOM 335 O THR A 43 -10.491 2.945 14.089 1.00 13.60 O ATOM 336 CB THR A 43 -8.203 2.497 16.229 1.00 13.00 C ATOM 337 OG1 THR A 43 -9.260 3.318 16.739 1.00 13.43 O ATOM 338 CG2 THR A 43 -6.875 2.985 16.784 1.00 12.38 C ATOM 339 N ASN A 44 -9.712 0.840 13.876 1.00 11.95 N ATOM 340 CA ASN A 44 -10.973 0.298 13.397 1.00 13.23 C ATOM 341 C ASN A 44 -11.262 -1.004 14.121 1.00 13.49 C ATOM 342 O ASN A 44 -10.480 -1.953 14.046 1.00 13.13 O ATOM 343 CB ASN A 44 -10.906 0.052 11.884 1.00 11.97 C ATOM 344 CG ASN A 44 -12.155 -0.629 11.344 1.00 14.35 C ATOM 345 OD1 ASN A 44 -12.126 -1.805 10.974 1.00 14.29 O ATOM 346 ND2 ASN A 44 -13.262 0.108 11.304 1.00 13.09 N ATOM 347 N ARG A 45 -12.380 -1.041 14.837 1.00 14.10 N ATOM 348 CA ARG A 45 -12.762 -2.242 15.561 1.00 16.49 C ATOM 349 C ARG A 45 -13.497 -3.145 14.588 1.00 15.75 C ATOM 350 O ARG A 45 -14.455 -2.718 13.945 1.00 17.23 O ATOM 351 CB ARG A 45 -13.691 -1.904 16.724 1.00 18.26 C ATOM 352 CG ARG A 45 -13.852 -3.045 17.721 1.00 22.67 C ATOM 353 CD ARG A 45 -15.195 -2.980 18.433 1.00 26.09 C ATOM 354 NE ARG A 45 -16.242 -3.680 17.688 1.00 29.68 N ATOM 355 CZ ARG A 45 -16.465 -4.991 17.757 1.00 31.08 C ATOM 356 NH1 ARG A 45 -15.725 -5.756 18.550 1.00 32.59 N ATOM 357 NH2 ARG A 45 -17.436 -5.537 17.037 1.00 32.01 N ATOM 358 N ASN A 46 -13.047 -4.387 14.476 1.00 14.74 N ATOM 359 CA ASN A 46 -13.682 -5.344 13.577 1.00 14.58 C ATOM 360 C ASN A 46 -14.728 -6.189 14.304 1.00 14.93 C ATOM 361 O ASN A 46 -14.720 -6.285 15.532 1.00 14.84 O ATOM 362 CB ASN A 46 -12.620 -6.232 12.931 1.00 14.65 C ATOM 363 CG ASN A 46 -11.675 -5.442 12.042 1.00 15.46 C ATOM 364 OD1 ASN A 46 -10.510 -5.229 12.378 1.00 16.49 O ATOM 365 ND2 ASN A 46 -12.187 -4.982 10.908 1.00 16.42 N ATOM 366 N THR A 47 -15.630 -6.798 13.541 1.00 15.93 N ATOM 367 CA THR A 47 -16.697 -7.609 14.124 1.00 17.06 C ATOM 368 C THR A 47 -16.219 -8.829 14.916 1.00 17.25 C ATOM 369 O THR A 47 -16.934 -9.323 15.783 1.00 17.87 O ATOM 370 CB THR A 47 -17.695 -8.065 13.033 1.00 17.87 C ATOM 371 OG1 THR A 47 -17.030 -8.905 12.084 1.00 20.49 O ATOM 372 CG2 THR A 47 -18.265 -6.855 12.303 1.00 18.44 C ATOM 373 N ASP A 48 -15.009 -9.303 14.638 1.00 17.27 N ATOM 374 CA ASP A 48 -14.473 -10.467 15.337 1.00 16.90 C ATOM 375 C ASP A 48 -13.704 -10.113 16.615 1.00 16.44 C ATOM 376 O ASP A 48 -13.046 -10.971 17.207 1.00 17.51 O ATOM 377 CB ASP A 48 -13.564 -11.260 14.399 1.00 18.98 C ATOM 378 CG ASP A 48 -12.257 -10.550 14.123 1.00 19.69 C ATOM 379 OD1 ASP A 48 -12.223 -9.307 14.240 1.00 19.34 O ATOM 380 OD2 ASP A 48 -11.270 -11.232 13.780 1.00 20.32 O ATOM 381 N GLY A 49 -13.776 -8.858 17.042 1.00 14.22 N ATOM 382 CA GLY A 49 -13.087 -8.471 18.262 1.00 13.60 C ATOM 383 C GLY A 49 -11.669 -7.956 18.095 1.00 12.66 C ATOM 384 O GLY A 49 -11.065 -7.469 19.052 1.00 13.09 O ATOM 385 N SER A 50 -11.128 -8.075 16.889 1.00 10.78 N ATOM 386 CA SER A 50 -9.784 -7.590 16.609 1.00 9.97 C ATOM 387 C SER A 50 -9.872 -6.119 16.227 1.00 10.71 C ATOM 388 O SER A 50 -10.965 -5.585 15.995 1.00 10.73 O ATOM 389 CB SER A 50 -9.154 -8.382 15.457 1.00 10.03 C ATOM 390 OG SER A 50 -9.839 -8.161 14.232 1.00 8.01 O ATOM 391 N THR A 51 -8.719 -5.465 16.146 1.00 9.53 N ATOM 392 CA THR A 51 -8.671 -4.053 15.797 1.00 8.26 C ATOM 393 C THR A 51 -7.537 -3.788 14.805 1.00 8.29 C ATOM 394 O THR A 51 -6.497 -4.447 14.850 1.00 6.41 O ATOM 395 CB THR A 51 -8.447 -3.177 17.064 1.00 9.57 C ATOM 396 OG1 THR A 51 -9.570 -3.309 17.947 1.00 11.45 O ATOM 397 CG2 THR A 51 -8.288 -1.709 16.689 1.00 9.18 C ATOM 398 N ASP A 52 -7.755 -2.831 13.907 1.00 7.30 N ATOM 399 CA ASP A 52 -6.741 -2.453 12.924 1.00 7.69 C ATOM 400 C ASP A 52 -6.103 -1.182 13.467 1.00 7.44 C ATOM 401 O ASP A 52 -6.814 -0.241 13.836 1.00 7.43 O ATOM 402 CB ASP A 52 -7.376 -2.174 11.556 1.00 8.18 C ATOM 403 CG ASP A 52 -8.169 -3.355 11.021 1.00 11.76 C ATOM 404 OD1 ASP A 52 -7.664 -4.493 11.082 1.00 9.89 O ATOM 405 OD2 ASP A 52 -9.302 -3.141 10.534 1.00 13.54 O ATOM 406 N TYR A 53 -4.773 -1.146 13.505 1.00 6.00 N ATOM 407 CA TYR A 53 -4.057 0.004 14.043 1.00 6.22 C ATOM 408 C TYR A 53 -3.145 0.798 13.112 1.00 6.35 C ATOM 409 O TYR A 53 -2.445 0.239 12.269 1.00 6.55 O ATOM 410 CB TYR A 53 -3.192 -0.426 15.233 1.00 5.56 C ATOM 411 CG TYR A 53 -3.955 -0.961 16.416 1.00 6.19 C ATOM 412 CD1 TYR A 53 -4.368 -2.289 16.462 1.00 7.14 C ATOM 413 CD2 TYR A 53 -4.267 -0.136 17.489 1.00 7.35 C ATOM 414 CE1 TYR A 53 -5.078 -2.779 17.551 1.00 6.86 C ATOM 415 CE2 TYR A 53 -4.978 -0.615 18.579 1.00 8.37 C ATOM 416 CZ TYR A 53 -5.378 -1.938 18.605 1.00 7.33 C ATOM 417 OH TYR A 53 -6.078 -2.418 19.690 1.00 8.35 O ATOM 418 N GLY A 54 -3.164 2.112 13.305 1.00 6.58 N ATOM 419 CA GLY A 54 -2.283 3.012 12.584 1.00 6.56 C ATOM 420 C GLY A 54 -2.424 3.348 11.119 1.00 6.67 C ATOM 421 O GLY A 54 -3.407 3.029 10.459 1.00 6.01 O ATOM 422 N ILE A 55 -1.387 4.021 10.635 1.00 7.54 N ATOM 423 CA ILE A 55 -1.282 4.489 9.261 1.00 7.88 C ATOM 424 C ILE A 55 -1.583 3.405 8.213 1.00 7.26 C ATOM 425 O ILE A 55 -2.147 3.707 7.161 1.00 7.80 O ATOM 426 CB ILE A 55 0.138 5.095 9.035 1.00 9.16 C ATOM 427 CG1 ILE A 55 0.178 5.910 7.744 1.00 12.17 C ATOM 428 CG2 ILE A 55 1.178 3.999 9.041 1.00 9.44 C ATOM 429 CD1 ILE A 55 -0.480 7.266 7.875 1.00 14.23 C ATOM 430 N LEU A 56 -1.208 2.156 8.491 1.00 7.13 N ATOM 431 CA LEU A 56 -1.456 1.058 7.553 1.00 8.28 C ATOM 432 C LEU A 56 -2.514 0.060 8.035 1.00 8.06 C ATOM 433 O LEU A 56 -2.655 -1.026 7.468 1.00 9.18 O ATOM 434 CB LEU A 56 -0.159 0.299 7.230 1.00 10.68 C ATOM 435 CG LEU A 56 0.800 0.837 6.157 1.00 12.47 C ATOM 436 CD1 LEU A 56 0.030 1.286 4.927 1.00 14.49 C ATOM 437 CD2 LEU A 56 1.595 1.976 6.715 1.00 16.29 C ATOM 438 N GLN A 57 -3.242 0.430 9.084 1.00 6.41 N ATOM 439 CA GLN A 57 -4.311 -0.409 9.628 1.00 6.19 C ATOM 440 C GLN A 57 -3.954 -1.888 9.744 1.00 6.24 C ATOM 441 O GLN A 57 -4.594 -2.753 9.141 1.00 6.64 O ATOM 442 CB GLN A 57 -5.569 -0.230 8.773 1.00 6.48 C ATOM 443 CG GLN A 57 -6.163 1.168 8.888 1.00 7.53 C ATOM 444 CD GLN A 57 -6.879 1.397 10.208 1.00 8.19 C ATOM 445 OE1 GLN A 57 -8.024 0.977 10.385 1.00 9.28 O ATOM 446 NE2 GLN A 57 -6.204 2.054 11.147 1.00 7.09 N ATOM 447 N ILE A 58 -2.926 -2.166 10.537 1.00 4.96 N ATOM 448 CA ILE A 58 -2.444 -3.523 10.772 1.00 5.63 C ATOM 449 C ILE A 58 -3.289 -4.187 11.869 1.00 6.11 C ATOM 450 O ILE A 58 -3.505 -3.610 12.933 1.00 6.20 O ATOM 451 CB ILE A 58 -0.953 -3.461 11.133 1.00 4.72 C ATOM 452 CG1 ILE A 58 -0.172 -3.065 9.868 1.00 4.52 C ATOM 453 CG2 ILE A 58 -0.483 -4.786 11.726 1.00 5.56 C ATOM 454 CD1 ILE A 58 1.309 -2.802 10.075 1.00 7.31 C ATOM 455 N ASN A 59 -3.752 -5.402 11.587 1.00 6.75 N ATOM 456 CA ASN A 59 -4.646 -6.162 12.466 1.00 8.64 C ATOM 457 C ASN A 59 -4.049 -6.901 13.665 1.00 8.72 C ATOM 458 O ASN A 59 -3.024 -7.570 13.555 1.00 9.57 O ATOM 459 CB ASN A 59 -5.448 -7.142 11.610 1.00 9.55 C ATOM 460 CG ASN A 59 -6.621 -7.745 12.354 1.00 11.94 C ATOM 461 OD1 ASN A 59 -6.539 -8.860 12.868 1.00 13.26 O ATOM 462 ND2 ASN A 59 -7.722 -7.003 12.418 1.00 11.99 N ATOM 463 N SER A 60 -4.740 -6.795 14.800 1.00 9.50 N ATOM 464 CA SER A 60 -4.324 -7.406 16.068 1.00 8.63 C ATOM 465 C SER A 60 -4.538 -8.914 16.187 1.00 9.92 C ATOM 466 O SER A 60 -4.063 -9.537 17.133 1.00 8.10 O ATOM 467 CB SER A 60 -5.055 -6.732 17.232 1.00 9.29 C ATOM 468 OG SER A 60 -6.439 -7.052 17.208 1.00 8.65 O ATOM 469 N ARG A 61 -5.260 -9.516 15.253 1.00 10.99 N ATOM 470 CA ARG A 61 -5.479 -10.948 15.363 1.00 13.25 C ATOM 471 C ARG A 61 -4.210 -11.717 15.022 1.00 12.58 C ATOM 472 O ARG A 61 -3.996 -12.820 15.520 1.00 12.59 O ATOM 473 CB ARG A 61 -6.636 -11.397 14.463 1.00 17.01 C ATOM 474 CG ARG A 61 -6.979 -12.875 14.625 1.00 21.87 C ATOM 475 CD ARG A 61 -8.429 -13.176 14.267 1.00 26.53 C ATOM 476 NE ARG A 61 -9.222 -13.575 15.433 1.00 29.80 N ATOM 477 CZ ARG A 61 -9.714 -12.736 16.341 1.00 31.85 C ATOM 478 NH1 ARG A 61 -9.500 -11.432 16.238 1.00 33.53 N ATOM 479 NH2 ARG A 61 -10.426 -13.201 17.358 1.00 33.36 N ATOM 480 N TRP A 62 -3.353 -11.120 14.199 1.00 11.69 N ATOM 481 CA TRP A 62 -2.116 -11.783 13.804 1.00 11.94 C ATOM 482 C TRP A 62 -0.811 -11.027 14.022 1.00 11.33 C ATOM 483 O TRP A 62 0.205 -11.629 14.357 1.00 12.20 O ATOM 484 CB TRP A 62 -2.140 -12.122 12.313 1.00 14.94 C ATOM 485 CG TRP A 62 -3.288 -12.935 11.843 1.00 19.04 C ATOM 486 CD1 TRP A 62 -4.420 -12.483 11.233 1.00 18.98 C ATOM 487 CD2 TRP A 62 -3.408 -14.356 11.912 1.00 19.66 C ATOM 488 NE1 TRP A 62 -5.233 -13.538 10.903 1.00 20.02 N ATOM 489 CE2 TRP A 62 -4.627 -14.702 11.302 1.00 20.94 C ATOM 490 CE3 TRP A 62 -2.584 -15.374 12.407 1.00 21.77 C ATOM 491 CZ2 TRP A 62 -5.065 -16.026 11.199 1.00 22.41 C ATOM 492 CZ3 TRP A 62 -3.015 -16.691 12.303 1.00 22.50 C ATOM 493 CH2 TRP A 62 -4.240 -17.004 11.693 1.00 22.46 C ATOM 494 N TRP A 63 -0.838 -9.714 13.832 1.00 9.29 N ATOM 495 CA TRP A 63 0.389 -8.929 13.857 1.00 8.00 C ATOM 496 C TRP A 63 0.926 -8.203 15.084 1.00 7.94 C ATOM 497 O TRP A 63 2.134 -7.984 15.178 1.00 7.03 O ATOM 498 CB TRP A 63 0.321 -7.957 12.683 1.00 7.52 C ATOM 499 CG TRP A 63 -0.084 -8.662 11.427 1.00 9.38 C ATOM 500 CD1 TRP A 63 -1.315 -8.651 10.833 1.00 9.81 C ATOM 501 CD2 TRP A 63 0.724 -9.561 10.662 1.00 10.54 C ATOM 502 NE1 TRP A 63 -1.322 -9.495 9.745 1.00 11.15 N ATOM 503 CE2 TRP A 63 -0.085 -10.064 9.617 1.00 11.24 C ATOM 504 CE3 TRP A 63 2.055 -9.990 10.760 1.00 10.90 C ATOM 505 CZ2 TRP A 63 0.398 -10.981 8.676 1.00 11.54 C ATOM 506 CZ3 TRP A 63 2.532 -10.901 9.824 1.00 11.12 C ATOM 507 CH2 TRP A 63 1.704 -11.386 8.794 1.00 11.78 C ATOM 508 N CYS A 64 0.064 -7.822 16.017 1.00 7.20 N ATOM 509 CA CYS A 64 0.538 -7.121 17.202 1.00 7.32 C ATOM 510 C CYS A 64 -0.283 -7.509 18.425 1.00 9.12 C ATOM 511 O CYS A 64 -1.357 -8.094 18.305 1.00 8.59 O ATOM 512 CB CYS A 64 0.459 -5.609 16.975 1.00 8.12 C ATOM 513 SG CYS A 64 -1.232 -5.037 16.625 1.00 7.95 S ATOM 514 N ASN A 65 0.221 -7.173 19.606 1.00 10.31 N ATOM 515 CA ASN A 65 -0.484 -7.502 20.837 1.00 10.22 C ATOM 516 C ASN A 65 -1.171 -6.282 21.435 1.00 9.84 C ATOM 517 O ASN A 65 -0.514 -5.285 21.738 1.00 10.21 O ATOM 518 CB ASN A 65 0.501 -8.098 21.855 1.00 12.08 C ATOM 519 CG ASN A 65 -0.146 -8.388 23.194 1.00 14.25 C ATOM 520 OD1 ASN A 65 -1.231 -8.971 23.260 1.00 15.32 O ATOM 521 ND2 ASN A 65 0.524 -7.994 24.274 1.00 14.01 N ATOM 522 N ASP A 66 -2.492 -6.342 21.592 1.00 9.04 N ATOM 523 CA ASP A 66 -3.193 -5.222 22.207 1.00 9.57 C ATOM 524 C ASP A 66 -3.824 -5.649 23.533 1.00 10.47 C ATOM 525 O ASP A 66 -4.467 -4.853 24.212 1.00 11.84 O ATOM 526 CB ASP A 66 -4.237 -4.601 21.256 1.00 9.44 C ATOM 527 CG ASP A 66 -5.368 -5.550 20.879 1.00 8.89 C ATOM 528 OD1 ASP A 66 -5.436 -6.678 21.401 1.00 10.96 O ATOM 529 OD2 ASP A 66 -6.208 -5.143 20.046 1.00 10.13 O ATOM 530 N GLY A 67 -3.609 -6.910 23.897 1.00 10.75 N ATOM 531 CA GLY A 67 -4.128 -7.439 25.147 1.00 12.19 C ATOM 532 C GLY A 67 -5.638 -7.546 25.252 1.00 12.67 C ATOM 533 O GLY A 67 -6.169 -7.828 26.333 1.00 13.37 O ATOM 534 N ARG A 68 -6.339 -7.330 24.143 1.00 12.54 N ATOM 535 CA ARG A 68 -7.798 -7.406 24.155 1.00 12.55 C ATOM 536 C ARG A 68 -8.374 -8.207 22.991 1.00 12.28 C ATOM 537 O ARG A 68 -9.547 -8.054 22.652 1.00 11.60 O ATOM 538 CB ARG A 68 -8.406 -5.998 24.163 1.00 12.82 C ATOM 539 CG ARG A 68 -7.856 -5.070 23.103 1.00 14.64 C ATOM 540 CD ARG A 68 -8.554 -3.714 23.114 1.00 16.04 C ATOM 541 NE ARG A 68 -9.919 -3.779 22.599 1.00 17.10 N ATOM 542 CZ ARG A 68 -10.725 -2.727 22.474 1.00 18.09 C ATOM 543 NH1 ARG A 68 -10.306 -1.516 22.819 1.00 17.08 N ATOM 544 NH2 ARG A 68 -11.957 -2.883 22.002 1.00 18.67 N ATOM 545 N THR A 69 -7.550 -9.064 22.390 1.00 10.80 N ATOM 546 CA THR A 69 -7.983 -9.898 21.273 1.00 11.37 C ATOM 547 C THR A 69 -7.660 -11.359 21.599 1.00 12.27 C ATOM 548 O THR A 69 -6.620 -11.885 21.195 1.00 11.19 O ATOM 549 CB THR A 69 -7.263 -9.499 19.968 1.00 10.59 C ATOM 550 OG1 THR A 69 -7.426 -8.092 19.742 1.00 9.11 O ATOM 551 CG2 THR A 69 -7.843 -10.265 18.781 1.00 11.56 C ATOM 552 N PRO A 70 -8.553 -12.035 22.333 1.00 13.93 N ATOM 553 CA PRO A 70 -8.321 -13.436 22.696 1.00 15.15 C ATOM 554 C PRO A 70 -8.042 -14.383 21.530 1.00 15.90 C ATOM 555 O PRO A 70 -8.629 -14.263 20.449 1.00 15.54 O ATOM 556 CB PRO A 70 -9.582 -13.808 23.488 1.00 16.77 C ATOM 557 CG PRO A 70 -10.623 -12.853 22.974 1.00 16.92 C ATOM 558 CD PRO A 70 -9.854 -11.566 22.845 1.00 15.07 C ATOM 559 N GLY A 71 -7.122 -15.316 21.767 1.00 16.37 N ATOM 560 CA GLY A 71 -6.752 -16.293 20.761 1.00 17.49 C ATOM 561 C GLY A 71 -5.969 -15.743 19.582 1.00 17.68 C ATOM 562 O GLY A 71 -5.852 -16.411 18.553 1.00 19.19 O ATOM 563 N SER A 72 -5.415 -14.543 19.724 1.00 16.60 N ATOM 564 CA SER A 72 -4.662 -13.927 18.632 1.00 14.41 C ATOM 565 C SER A 72 -3.161 -14.172 18.707 1.00 14.80 C ATOM 566 O SER A 72 -2.654 -14.712 19.690 1.00 15.35 O ATOM 567 CB SER A 72 -4.911 -12.419 18.609 1.00 13.22 C ATOM 568 OG SER A 72 -4.352 -11.808 19.758 1.00 9.33 O ATOM 569 N ARG A 73 -2.463 -13.767 17.650 1.00 13.34 N ATOM 570 CA ARG A 73 -1.017 -13.904 17.565 1.00 13.48 C ATOM 571 C ARG A 73 -0.388 -12.511 17.519 1.00 12.38 C ATOM 572 O ARG A 73 -1.092 -11.504 17.437 1.00 11.21 O ATOM 573 CB ARG A 73 -0.629 -14.688 16.308 1.00 15.67 C ATOM 574 CG ARG A 73 -1.181 -16.105 16.257 1.00 18.94 C ATOM 575 CD ARG A 73 -0.615 -16.970 17.373 1.00 22.76 C ATOM 576 NE ARG A 73 0.827 -17.164 17.242 1.00 26.30 N ATOM 577 CZ ARG A 73 1.406 -17.833 16.248 1.00 27.96 C ATOM 578 NH1 ARG A 73 0.668 -18.380 15.293 1.00 29.38 N ATOM 579 NH2 ARG A 73 2.726 -17.957 16.209 1.00 29.28 N ATOM 580 N ASN A 74 0.941 -12.470 17.562 1.00 11.29 N ATOM 581 CA ASN A 74 1.702 -11.221 17.545 1.00 10.96 C ATOM 582 C ASN A 74 2.974 -11.504 16.747 1.00 10.75 C ATOM 583 O ASN A 74 4.069 -11.559 17.308 1.00 9.94 O ATOM 584 CB ASN A 74 2.036 -10.827 18.990 1.00 10.82 C ATOM 585 CG ASN A 74 2.963 -9.622 19.090 1.00 11.32 C ATOM 586 OD1 ASN A 74 3.181 -8.897 18.120 1.00 11.13 O ATOM 587 ND2 ASN A 74 3.505 -9.400 20.289 1.00 9.57 N ATOM 588 N LEU A 75 2.811 -11.686 15.437 1.00 10.50 N ATOM 589 CA LEU A 75 3.929 -12.007 14.550 1.00 11.37 C ATOM 590 C LEU A 75 4.974 -10.913 14.376 1.00 11.37 C ATOM 591 O LEU A 75 6.117 -11.200 14.012 1.00 11.48 O ATOM 592 CB LEU A 75 3.420 -12.436 13.164 1.00 13.93 C ATOM 593 CG LEU A 75 2.806 -13.828 12.952 1.00 16.44 C ATOM 594 CD1 LEU A 75 3.693 -14.887 13.591 1.00 17.56 C ATOM 595 CD2 LEU A 75 1.427 -13.892 13.550 1.00 19.12 C ATOM 596 N CYS A 76 4.604 -9.663 14.622 1.00 10.31 N ATOM 597 CA CYS A 76 5.577 -8.597 14.476 1.00 9.94 C ATOM 598 C CYS A 76 6.326 -8.341 15.779 1.00 10.87 C ATOM 599 O CYS A 76 7.229 -7.509 15.832 1.00 10.75 O ATOM 600 CB CYS A 76 4.909 -7.327 13.940 1.00 8.64 C ATOM 601 SG CYS A 76 4.595 -7.416 12.140 1.00 5.77 S ATOM 602 N ASN A 77 5.951 -9.069 16.830 1.00 11.32 N ATOM 603 CA ASN A 77 6.632 -8.962 18.124 1.00 13.40 C ATOM 604 C ASN A 77 6.595 -7.545 18.690 1.00 13.01 C ATOM 605 O ASN A 77 7.612 -7.018 19.154 1.00 12.31 O ATOM 606 CB ASN A 77 8.089 -9.417 17.960 1.00 17.41 C ATOM 607 CG ASN A 77 8.822 -9.541 19.278 1.00 21.22 C ATOM 608 OD1 ASN A 77 10.057 -9.593 19.314 1.00 23.52 O ATOM 609 ND2 ASN A 77 8.069 -9.604 20.372 1.00 23.25 N ATOM 610 N ILE A 78 5.418 -6.930 18.663 1.00 11.42 N ATOM 611 CA ILE A 78 5.271 -5.573 19.163 1.00 11.88 C ATOM 612 C ILE A 78 3.877 -5.304 19.695 1.00 10.92 C ATOM 613 O ILE A 78 2.917 -5.981 19.323 1.00 10.37 O ATOM 614 CB ILE A 78 5.492 -4.534 18.046 1.00 13.92 C ATOM 615 CG1 ILE A 78 4.494 -4.801 16.909 1.00 14.00 C ATOM 616 CG2 ILE A 78 6.931 -4.581 17.552 1.00 16.07 C ATOM 617 CD1 ILE A 78 4.417 -3.703 15.869 1.00 15.93 C ATOM 618 N PRO A 79 3.753 -4.320 20.595 1.00 9.89 N ATOM 619 CA PRO A 79 2.438 -3.981 21.135 1.00 9.98 C ATOM 620 C PRO A 79 1.771 -3.160 20.032 1.00 9.49 C ATOM 621 O PRO A 79 2.448 -2.434 19.305 1.00 8.35 O ATOM 622 CB PRO A 79 2.776 -3.150 22.367 1.00 9.48 C ATOM 623 CG PRO A 79 4.091 -2.511 22.000 1.00 9.27 C ATOM 624 CD PRO A 79 4.824 -3.657 21.364 1.00 9.60 C ATOM 625 N CYS A 80 0.458 -3.285 19.883 1.00 8.86 N ATOM 626 CA CYS A 80 -0.232 -2.539 18.835 1.00 8.30 C ATOM 627 C CYS A 80 -0.106 -1.033 19.032 1.00 8.61 C ATOM 628 O CYS A 80 -0.211 -0.266 18.076 1.00 8.52 O ATOM 629 CB CYS A 80 -1.709 -2.928 18.789 1.00 7.81 C ATOM 630 SG CYS A 80 -2.009 -4.696 18.471 1.00 7.87 S ATOM 631 N SER A 81 0.126 -0.611 20.271 1.00 8.51 N ATOM 632 CA SER A 81 0.268 0.813 20.576 1.00 10.50 C ATOM 633 C SER A 81 1.441 1.421 19.797 1.00 10.10 C ATOM 634 O SER A 81 1.449 2.617 19.499 1.00 10.23 O ATOM 635 CB SER A 81 0.475 1.015 22.086 1.00 11.87 C ATOM 636 OG SER A 81 1.666 0.381 22.525 1.00 15.27 O ATOM 637 N ALA A 82 2.423 0.591 19.463 1.00 9.58 N ATOM 638 CA ALA A 82 3.586 1.053 18.710 1.00 9.86 C ATOM 639 C ALA A 82 3.186 1.439 17.284 1.00 10.03 C ATOM 640 O ALA A 82 3.843 2.264 16.649 1.00 9.51 O ATOM 641 CB ALA A 82 4.658 -0.035 18.675 1.00 9.95 C ATOM 642 N LEU A 83 2.105 0.843 16.790 1.00 9.76 N ATOM 643 CA LEU A 83 1.620 1.126 15.442 1.00 10.31 C ATOM 644 C LEU A 83 0.849 2.442 15.373 1.00 11.02 C ATOM 645 O LEU A 83 0.459 2.884 14.292 1.00 12.21 O ATOM 646 CB LEU A 83 0.728 -0.018 14.955 1.00 9.45 C ATOM 647 CG LEU A 83 1.394 -1.388 14.828 1.00 9.32 C ATOM 648 CD1 LEU A 83 0.373 -2.409 14.355 1.00 8.91 C ATOM 649 CD2 LEU A 83 2.554 -1.304 13.848 1.00 10.92 C ATOM 650 N LEU A 84 0.641 3.063 16.531 1.00 10.91 N ATOM 651 CA LEU A 84 -0.080 4.330 16.628 1.00 13.02 C ATOM 652 C LEU A 84 0.882 5.491 16.872 1.00 14.34 C ATOM 653 O LEU A 84 0.460 6.614 17.146 1.00 15.15 O ATOM 654 CB LEU A 84 -1.090 4.276 17.777 1.00 11.66 C ATOM 655 CG LEU A 84 -2.198 3.226 17.682 1.00 11.83 C ATOM 656 CD1 LEU A 84 -3.071 3.299 18.920 1.00 12.16 C ATOM 657 CD2 LEU A 84 -3.027 3.471 16.430 1.00 12.03 C ATOM 658 N SER A 85 2.175 5.209 16.773 1.00 15.78 N ATOM 659 CA SER A 85 3.202 6.221 16.994 1.00 16.53 C ATOM 660 C SER A 85 3.329 7.171 15.807 1.00 17.89 C ATOM 661 O SER A 85 3.026 6.800 14.671 1.00 17.45 O ATOM 662 CB SER A 85 4.546 5.528 17.255 1.00 16.92 C ATOM 663 OG SER A 85 5.598 6.463 17.405 1.00 18.99 O ATOM 664 N SER A 86 3.765 8.402 16.074 1.00 17.94 N ATOM 665 CA SER A 86 3.958 9.385 15.013 1.00 18.58 C ATOM 666 C SER A 86 5.206 8.985 14.237 1.00 18.42 C ATOM 667 O SER A 86 5.445 9.461 13.126 1.00 19.63 O ATOM 668 CB SER A 86 4.132 10.785 15.600 1.00 19.29 C ATOM 669 OG SER A 86 2.930 11.230 16.204 1.00 22.56 O ATOM 670 N ASP A 87 6.005 8.114 14.848 1.00 17.90 N ATOM 671 CA ASP A 87 7.226 7.582 14.243 1.00 17.73 C ATOM 672 C ASP A 87 6.748 6.306 13.552 1.00 16.39 C ATOM 673 O ASP A 87 6.432 5.326 14.221 1.00 16.28 O ATOM 674 CB ASP A 87 8.237 7.226 15.339 1.00 19.65 C ATOM 675 CG ASP A 87 9.527 6.644 14.787 1.00 21.51 C ATOM 676 OD1 ASP A 87 9.473 5.902 13.785 1.00 21.77 O ATOM 677 OD2 ASP A 87 10.601 6.917 15.368 1.00 24.14 O ATOM 678 N ILE A 88 6.707 6.308 12.224 1.00 15.85 N ATOM 679 CA ILE A 88 6.205 5.149 11.488 1.00 14.09 C ATOM 680 C ILE A 88 7.124 3.932 11.405 1.00 13.46 C ATOM 681 O ILE A 88 6.811 2.976 10.704 1.00 11.99 O ATOM 682 CB ILE A 88 5.807 5.536 10.045 1.00 13.89 C ATOM 683 CG1 ILE A 88 7.058 5.845 9.214 1.00 14.35 C ATOM 684 CG2 ILE A 88 4.876 6.734 10.072 1.00 13.94 C ATOM 685 CD1 ILE A 88 6.766 6.086 7.739 1.00 13.77 C ATOM 686 N THR A 89 8.240 3.949 12.123 1.00 12.84 N ATOM 687 CA THR A 89 9.174 2.826 12.070 1.00 13.10 C ATOM 688 C THR A 89 8.521 1.463 12.329 1.00 12.47 C ATOM 689 O THR A 89 8.675 0.536 11.531 1.00 12.44 O ATOM 690 CB THR A 89 10.337 3.025 13.069 1.00 14.34 C ATOM 691 OG1 THR A 89 11.052 4.223 12.735 1.00 14.24 O ATOM 692 CG2 THR A 89 11.295 1.844 13.014 1.00 15.03 C ATOM 693 N ALA A 90 7.799 1.342 13.440 1.00 10.63 N ATOM 694 CA ALA A 90 7.142 0.084 13.788 1.00 10.34 C ATOM 695 C ALA A 90 6.163 -0.377 12.710 1.00 8.86 C ATOM 696 O ALA A 90 6.149 -1.551 12.338 1.00 8.53 O ATOM 697 CB ALA A 90 6.419 0.219 15.130 1.00 9.90 C ATOM 698 N SER A 91 5.343 0.544 12.210 1.00 8.01 N ATOM 699 CA SER A 91 4.376 0.197 11.171 1.00 7.52 C ATOM 700 C SER A 91 5.089 -0.273 9.908 1.00 7.37 C ATOM 701 O SER A 91 4.711 -1.282 9.309 1.00 7.97 O ATOM 702 CB SER A 91 3.480 1.397 10.849 1.00 7.33 C ATOM 703 OG SER A 91 2.588 1.660 11.919 1.00 8.44 O ATOM 704 N VAL A 92 6.127 0.455 9.507 1.00 6.64 N ATOM 705 CA VAL A 92 6.879 0.091 8.313 1.00 6.88 C ATOM 706 C VAL A 92 7.523 -1.285 8.434 1.00 7.31 C ATOM 707 O VAL A 92 7.392 -2.119 7.538 1.00 6.45 O ATOM 708 CB VAL A 92 7.997 1.114 8.007 1.00 7.72 C ATOM 709 CG1 VAL A 92 8.882 0.587 6.888 1.00 8.89 C ATOM 710 CG2 VAL A 92 7.389 2.444 7.608 1.00 8.09 C ATOM 711 N ASN A 93 8.230 -1.524 9.533 1.00 7.81 N ATOM 712 CA ASN A 93 8.888 -2.812 9.701 1.00 8.99 C ATOM 713 C ASN A 93 7.900 -3.968 9.731 1.00 9.17 C ATOM 714 O ASN A 93 8.163 -5.025 9.164 1.00 7.34 O ATOM 715 CB ASN A 93 9.762 -2.812 10.958 1.00 12.32 C ATOM 716 CG ASN A 93 10.974 -1.906 10.816 1.00 15.42 C ATOM 717 OD1 ASN A 93 11.365 -1.552 9.701 1.00 18.41 O ATOM 718 ND2 ASN A 93 11.580 -1.534 11.939 1.00 16.00 N ATOM 719 N CYS A 94 6.757 -3.767 10.378 1.00 6.87 N ATOM 720 CA CYS A 94 5.750 -4.818 10.437 1.00 6.70 C ATOM 721 C CYS A 94 5.136 -5.011 9.051 1.00 6.88 C ATOM 722 O CYS A 94 4.903 -6.140 8.617 1.00 7.13 O ATOM 723 CB CYS A 94 4.663 -4.454 11.447 1.00 6.02 C ATOM 724 SG CYS A 94 3.453 -5.783 11.753 1.00 6.09 S ATOM 725 N ALA A 95 4.884 -3.905 8.355 1.00 6.22 N ATOM 726 CA ALA A 95 4.307 -3.970 7.017 1.00 7.46 C ATOM 727 C ALA A 95 5.197 -4.789 6.083 1.00 8.79 C ATOM 728 O ALA A 95 4.697 -5.563 5.270 1.00 8.74 O ATOM 729 CB ALA A 95 4.103 -2.563 6.457 1.00 7.18 C ATOM 730 N LYS A 96 6.513 -4.619 6.202 1.00 8.33 N ATOM 731 CA LYS A 96 7.447 -5.360 5.363 1.00 10.53 C ATOM 732 C LYS A 96 7.307 -6.863 5.583 1.00 11.37 C ATOM 733 O LYS A 96 7.488 -7.652 4.658 1.00 12.62 O ATOM 734 CB LYS A 96 8.888 -4.926 5.649 1.00 10.88 C ATOM 735 CG LYS A 96 9.215 -3.533 5.155 1.00 11.73 C ATOM 736 CD LYS A 96 10.656 -3.164 5.460 1.00 14.40 C ATOM 737 CE LYS A 96 11.018 -1.806 4.884 1.00 14.04 C ATOM 738 NZ LYS A 96 12.391 -1.396 5.303 1.00 15.31 N ATOM 739 N LYS A 97 6.987 -7.260 6.810 1.00 11.20 N ATOM 740 CA LYS A 97 6.808 -8.672 7.106 1.00 10.72 C ATOM 741 C LYS A 97 5.485 -9.130 6.496 1.00 10.20 C ATOM 742 O LYS A 97 5.398 -10.210 5.913 1.00 9.38 O ATOM 743 CB LYS A 97 6.788 -8.905 8.617 1.00 12.84 C ATOM 744 CG LYS A 97 6.790 -10.370 9.016 1.00 15.07 C ATOM 745 CD LYS A 97 6.651 -10.525 10.525 1.00 18.35 C ATOM 746 CE LYS A 97 6.668 -11.987 10.945 1.00 19.84 C ATOM 747 NZ LYS A 97 8.004 -12.607 10.764 1.00 21.45 N ATOM 748 N ILE A 98 4.456 -8.298 6.631 1.00 9.15 N ATOM 749 CA ILE A 98 3.139 -8.619 6.101 1.00 8.67 C ATOM 750 C ILE A 98 3.128 -8.781 4.585 1.00 9.85 C ATOM 751 O ILE A 98 2.552 -9.737 4.062 1.00 10.53 O ATOM 752 CB ILE A 98 2.104 -7.536 6.495 1.00 8.41 C ATOM 753 CG1 ILE A 98 1.901 -7.548 8.013 1.00 7.32 C ATOM 754 CG2 ILE A 98 0.784 -7.783 5.786 1.00 9.29 C ATOM 755 CD1 ILE A 98 1.025 -6.413 8.525 1.00 9.02 C ATOM 756 N VAL A 99 3.773 -7.857 3.879 1.00 9.71 N ATOM 757 CA VAL A 99 3.794 -7.917 2.422 1.00 11.27 C ATOM 758 C VAL A 99 4.619 -9.100 1.904 1.00 11.96 C ATOM 759 O VAL A 99 4.513 -9.473 0.737 1.00 11.36 O ATOM 760 CB VAL A 99 4.326 -6.584 1.818 1.00 11.79 C ATOM 761 CG1 VAL A 99 5.808 -6.428 2.093 1.00 12.24 C ATOM 762 CG2 VAL A 99 4.023 -6.528 0.332 1.00 11.47 C ATOM 763 N SER A 100 5.423 -9.695 2.782 1.00 12.27 N ATOM 764 CA SER A 100 6.260 -10.833 2.406 1.00 13.66 C ATOM 765 C SER A 100 5.591 -12.145 2.796 1.00 13.62 C ATOM 766 O SER A 100 6.170 -13.217 2.623 1.00 13.25 O ATOM 767 CB SER A 100 7.616 -10.751 3.114 1.00 13.74 C ATOM 768 OG SER A 100 8.240 -9.497 2.894 1.00 16.41 O ATOM 769 N ASP A 101 4.369 -12.061 3.313 1.00 13.37 N ATOM 770 CA ASP A 101 3.670 -13.258 3.766 1.00 14.36 C ATOM 771 C ASP A 101 2.934 -14.065 2.700 1.00 14.09 C ATOM 772 O ASP A 101 2.083 -14.891 3.025 1.00 15.45 O ATOM 773 CB ASP A 101 2.718 -12.901 4.912 1.00 14.00 C ATOM 774 CG ASP A 101 2.544 -14.042 5.898 1.00 16.61 C ATOM 775 OD1 ASP A 101 3.526 -14.778 6.131 1.00 15.61 O ATOM 776 OD2 ASP A 101 1.436 -14.195 6.454 1.00 17.46 O ATOM 777 N GLY A 102 3.252 -13.824 1.432 1.00 14.37 N ATOM 778 CA GLY A 102 2.638 -14.598 0.367 1.00 14.64 C ATOM 779 C GLY A 102 1.500 -14.016 -0.446 1.00 14.36 C ATOM 780 O GLY A 102 1.097 -14.625 -1.438 1.00 14.28 O ATOM 781 N ASN A 103 0.977 -12.860 -0.050 1.00 13.50 N ATOM 782 CA ASN A 103 -0.126 -12.250 -0.783 1.00 13.74 C ATOM 783 C ASN A 103 0.192 -10.838 -1.249 1.00 13.71 C ATOM 784 O ASN A 103 -0.707 -10.092 -1.638 1.00 14.01 O ATOM 785 CB ASN A 103 -1.381 -12.213 0.091 1.00 15.39 C ATOM 786 CG ASN A 103 -1.756 -13.574 0.624 1.00 15.69 C ATOM 787 OD1 ASN A 103 -1.702 -13.822 1.830 1.00 18.55 O ATOM 788 ND2 ASN A 103 -2.133 -14.471 -0.274 1.00 16.54 N ATOM 789 N GLY A 104 1.469 -10.475 -1.216 1.00 14.03 N ATOM 790 CA GLY A 104 1.852 -9.139 -1.631 1.00 13.50 C ATOM 791 C GLY A 104 1.051 -8.107 -0.864 1.00 13.21 C ATOM 792 O GLY A 104 0.736 -8.307 0.309 1.00 12.68 O ATOM 793 N MET A 105 0.706 -7.007 -1.520 1.00 13.14 N ATOM 794 CA MET A 105 -0.058 -5.960 -0.858 1.00 14.00 C ATOM 795 C MET A 105 -1.547 -6.248 -0.811 1.00 13.87 C ATOM 796 O MET A 105 -2.326 -5.442 -0.310 1.00 14.36 O ATOM 797 CB MET A 105 0.200 -4.611 -1.528 1.00 13.42 C ATOM 798 CG MET A 105 1.574 -4.044 -1.203 1.00 14.54 C ATOM 799 SD MET A 105 1.744 -2.321 -1.679 1.00 14.54 S ATOM 800 CE MET A 105 0.591 -1.535 -0.531 1.00 14.27 C ATOM 801 N ASN A 106 -1.947 -7.404 -1.326 1.00 14.52 N ATOM 802 CA ASN A 106 -3.353 -7.777 -1.303 1.00 15.16 C ATOM 803 C ASN A 106 -3.842 -7.938 0.132 1.00 15.25 C ATOM 804 O ASN A 106 -5.042 -8.062 0.381 1.00 15.58 O ATOM 805 CB ASN A 106 -3.569 -9.066 -2.097 1.00 16.44 C ATOM 806 CG ASN A 106 -3.337 -8.868 -3.579 1.00 16.74 C ATOM 807 OD1 ASN A 106 -4.016 -8.066 -4.216 1.00 16.83 O ATOM 808 ND2 ASN A 106 -2.370 -9.589 -4.135 1.00 17.35 N ATOM 809 N ALA A 107 -2.907 -7.927 1.078 1.00 14.98 N ATOM 810 CA ALA A 107 -3.258 -8.046 2.488 1.00 15.14 C ATOM 811 C ALA A 107 -4.023 -6.789 2.921 1.00 15.16 C ATOM 812 O ALA A 107 -4.738 -6.797 3.921 1.00 15.92 O ATOM 813 CB ALA A 107 -2.000 -8.213 3.328 1.00 14.82 C ATOM 814 N TRP A 108 -3.869 -5.713 2.155 1.00 13.92 N ATOM 815 CA TRP A 108 -4.552 -4.456 2.445 1.00 13.84 C ATOM 816 C TRP A 108 -5.759 -4.291 1.525 1.00 14.75 C ATOM 817 O TRP A 108 -5.618 -3.955 0.350 1.00 14.46 O ATOM 818 CB TRP A 108 -3.582 -3.281 2.271 1.00 11.69 C ATOM 819 CG TRP A 108 -2.595 -3.159 3.400 1.00 10.24 C ATOM 820 CD1 TRP A 108 -2.815 -2.596 4.623 1.00 10.57 C ATOM 821 CD2 TRP A 108 -1.260 -3.680 3.430 1.00 9.78 C ATOM 822 NE1 TRP A 108 -1.699 -2.738 5.421 1.00 10.36 N ATOM 823 CE2 TRP A 108 -0.733 -3.399 4.715 1.00 9.84 C ATOM 824 CE3 TRP A 108 -0.459 -4.357 2.502 1.00 11.09 C ATOM 825 CZ2 TRP A 108 0.561 -3.776 5.091 1.00 9.17 C ATOM 826 CZ3 TRP A 108 0.835 -4.732 2.880 1.00 10.53 C ATOM 827 CH2 TRP A 108 1.327 -4.438 4.167 1.00 11.05 C ATOM 828 N VAL A 109 -6.947 -4.523 2.077 1.00 15.42 N ATOM 829 CA VAL A 109 -8.193 -4.436 1.319 1.00 16.66 C ATOM 830 C VAL A 109 -8.427 -3.093 0.629 1.00 17.14 C ATOM 831 O VAL A 109 -8.860 -3.053 -0.524 1.00 17.54 O ATOM 832 CB VAL A 109 -9.410 -4.738 2.222 1.00 16.90 C ATOM 833 CG1 VAL A 109 -9.476 -3.731 3.357 1.00 18.68 C ATOM 834 CG2 VAL A 109 -10.697 -4.704 1.397 1.00 16.90 C ATOM 835 N ALA A 110 -8.154 -1.997 1.331 1.00 17.14 N ATOM 836 CA ALA A 110 -8.353 -0.666 0.758 1.00 17.73 C ATOM 837 C ALA A 110 -7.437 -0.455 -0.438 1.00 17.44 C ATOM 838 O ALA A 110 -7.831 0.148 -1.435 1.00 17.84 O ATOM 839 CB ALA A 110 -8.093 0.411 1.812 1.00 17.20 C ATOM 840 N TRP A 111 -6.208 -0.946 -0.330 1.00 16.78 N ATOM 841 CA TRP A 111 -5.249 -0.813 -1.414 1.00 17.87 C ATOM 842 C TRP A 111 -5.745 -1.592 -2.630 1.00 19.31 C ATOM 843 O TRP A 111 -5.710 -1.101 -3.761 1.00 18.57 O ATOM 844 CB TRP A 111 -3.885 -1.354 -0.984 1.00 16.60 C ATOM 845 CG TRP A 111 -2.934 -1.469 -2.116 1.00 16.49 C ATOM 846 CD1 TRP A 111 -2.157 -0.478 -2.643 1.00 15.17 C ATOM 847 CD2 TRP A 111 -2.694 -2.633 -2.911 1.00 16.30 C ATOM 848 NE1 TRP A 111 -1.451 -0.954 -3.723 1.00 15.60 N ATOM 849 CE2 TRP A 111 -1.768 -2.276 -3.913 1.00 15.65 C ATOM 850 CE3 TRP A 111 -3.187 -3.946 -2.883 1.00 15.87 C ATOM 851 CZ2 TRP A 111 -1.307 -3.183 -4.869 1.00 16.61 C ATOM 852 CZ3 TRP A 111 -2.731 -4.850 -3.835 1.00 16.91 C ATOM 853 CH2 TRP A 111 -1.804 -4.461 -4.819 1.00 15.95 C ATOM 854 N ARG A 112 -6.203 -2.812 -2.385 1.00 20.63 N ATOM 855 CA ARG A 112 -6.709 -3.671 -3.447 1.00 23.32 C ATOM 856 C ARG A 112 -7.895 -3.027 -4.169 1.00 23.55 C ATOM 857 O ARG A 112 -7.937 -2.988 -5.396 1.00 23.17 O ATOM 858 CB ARG A 112 -7.139 -5.015 -2.855 1.00 25.90 C ATOM 859 CG ARG A 112 -7.618 -6.040 -3.870 1.00 30.41 C ATOM 860 CD ARG A 112 -8.437 -7.123 -3.182 1.00 33.71 C ATOM 861 NE ARG A 112 -7.708 -7.767 -2.093 1.00 37.83 N ATOM 862 CZ ARG A 112 -8.280 -8.223 -0.981 1.00 40.04 C ATOM 863 NH1 ARG A 112 -9.592 -8.100 -0.809 1.00 41.01 N ATOM 864 NH2 ARG A 112 -7.546 -8.810 -0.042 1.00 40.91 N ATOM 865 N ASN A 113 -8.846 -2.504 -3.402 1.00 24.31 N ATOM 866 CA ASN A 113 -10.043 -1.899 -3.979 1.00 25.70 C ATOM 867 C ASN A 113 -9.936 -0.484 -4.545 1.00 25.76 C ATOM 868 O ASN A 113 -10.846 -0.042 -5.245 1.00 26.02 O ATOM 869 CB ASN A 113 -11.189 -1.928 -2.963 1.00 27.57 C ATOM 870 CG ASN A 113 -11.665 -3.337 -2.657 1.00 29.09 C ATOM 871 OD1 ASN A 113 -11.369 -4.279 -3.395 1.00 30.36 O ATOM 872 ND2 ASN A 113 -12.421 -3.486 -1.572 1.00 29.48 N ATOM 873 N ARG A 114 -8.852 0.232 -4.261 1.00 24.90 N ATOM 874 CA ARG A 114 -8.733 1.595 -4.773 1.00 24.67 C ATOM 875 C ARG A 114 -7.382 1.965 -5.366 1.00 22.13 C ATOM 876 O ARG A 114 -7.263 2.982 -6.050 1.00 22.82 O ATOM 877 CB ARG A 114 -9.068 2.604 -3.670 1.00 27.94 C ATOM 878 CG ARG A 114 -10.375 2.331 -2.956 1.00 32.99 C ATOM 879 CD ARG A 114 -11.166 3.609 -2.730 1.00 37.32 C ATOM 880 NE ARG A 114 -11.519 4.253 -3.993 1.00 41.12 N ATOM 881 CZ ARG A 114 -12.652 4.918 -4.201 1.00 43.43 C ATOM 882 NH1 ARG A 114 -13.548 5.027 -3.229 1.00 44.64 N ATOM 883 NH2 ARG A 114 -12.891 5.472 -5.384 1.00 44.76 N ATOM 884 N CYS A 115 -6.368 1.148 -5.119 1.00 19.13 N ATOM 885 CA CYS A 115 -5.033 1.453 -5.613 1.00 16.99 C ATOM 886 C CYS A 115 -4.487 0.505 -6.670 1.00 16.62 C ATOM 887 O CYS A 115 -3.892 0.943 -7.653 1.00 15.34 O ATOM 888 CB CYS A 115 -4.047 1.489 -4.444 1.00 16.34 C ATOM 889 SG CYS A 115 -4.524 2.626 -3.107 1.00 14.30 S ATOM 890 N LYS A 116 -4.675 -0.791 -6.456 1.00 15.91 N ATOM 891 CA LYS A 116 -4.163 -1.792 -7.381 1.00 16.59 C ATOM 892 C LYS A 116 -4.651 -1.586 -8.814 1.00 16.49 C ATOM 893 O LYS A 116 -5.849 -1.443 -9.061 1.00 16.50 O ATOM 894 CB LYS A 116 -4.550 -3.189 -6.889 1.00 16.87 C ATOM 895 CG LYS A 116 -3.853 -4.323 -7.624 1.00 16.91 C ATOM 896 CD LYS A 116 -4.313 -5.673 -7.098 1.00 17.77 C ATOM 897 CE LYS A 116 -3.596 -6.815 -7.797 1.00 17.77 C ATOM 898 NZ LYS A 116 -4.058 -8.129 -7.276 1.00 18.13 N ATOM 899 N GLY A 117 -3.709 -1.562 -9.752 1.00 16.31 N ATOM 900 CA GLY A 117 -4.057 -1.386 -11.151 1.00 18.00 C ATOM 901 C GLY A 117 -4.163 0.051 -11.630 1.00 17.74 C ATOM 902 O GLY A 117 -4.150 0.302 -12.836 1.00 17.15 O ATOM 903 N THR A 118 -4.270 0.999 -10.701 1.00 18.40 N ATOM 904 CA THR A 118 -4.378 2.409 -11.071 1.00 18.08 C ATOM 905 C THR A 118 -2.998 3.030 -11.250 1.00 17.95 C ATOM 906 O THR A 118 -1.977 2.378 -11.035 1.00 18.16 O ATOM 907 CB THR A 118 -5.139 3.228 -9.996 1.00 17.77 C ATOM 908 OG1 THR A 118 -4.360 3.291 -8.796 1.00 17.49 O ATOM 909 CG2 THR A 118 -6.482 2.591 -9.687 1.00 18.02 C ATOM 910 N ASP A 119 -2.975 4.296 -11.653 1.00 18.83 N ATOM 911 CA ASP A 119 -1.720 5.017 -11.840 1.00 19.26 C ATOM 912 C ASP A 119 -1.289 5.554 -10.472 1.00 18.89 C ATOM 913 O ASP A 119 -1.442 6.740 -10.185 1.00 18.45 O ATOM 914 CB ASP A 119 -1.928 6.162 -12.839 1.00 21.22 C ATOM 915 CG ASP A 119 -0.714 7.063 -12.968 1.00 23.03 C ATOM 916 OD1 ASP A 119 0.421 6.544 -13.034 1.00 24.25 O ATOM 917 OD2 ASP A 119 -0.901 8.297 -13.017 1.00 24.91 O ATOM 918 N VAL A 120 -0.760 4.662 -9.634 1.00 18.45 N ATOM 919 CA VAL A 120 -0.317 5.014 -8.281 1.00 18.84 C ATOM 920 C VAL A 120 0.799 6.049 -8.272 1.00 19.36 C ATOM 921 O VAL A 120 1.051 6.710 -7.262 1.00 18.78 O ATOM 922 CB VAL A 120 0.170 3.765 -7.511 1.00 18.57 C ATOM 923 CG1 VAL A 120 -0.977 2.783 -7.348 1.00 19.18 C ATOM 924 CG2 VAL A 120 1.332 3.115 -8.244 1.00 18.11 C ATOM 925 N GLN A 121 1.465 6.177 -9.411 1.00 19.97 N ATOM 926 CA GLN A 121 2.555 7.126 -9.584 1.00 21.26 C ATOM 927 C GLN A 121 2.087 8.545 -9.254 1.00 19.83 C ATOM 928 O GLN A 121 2.877 9.394 -8.845 1.00 20.73 O ATOM 929 CB GLN A 121 3.038 7.033 -11.031 1.00 24.84 C ATOM 930 CG GLN A 121 4.150 7.961 -11.435 1.00 29.09 C ATOM 931 CD GLN A 121 4.594 7.686 -12.864 1.00 31.82 C ATOM 932 OE1 GLN A 121 3.775 7.663 -13.787 1.00 33.14 O ATOM 933 NE2 GLN A 121 5.890 7.467 -13.051 1.00 32.80 N ATOM 934 N ALA A 122 0.791 8.787 -9.421 1.00 18.42 N ATOM 935 CA ALA A 122 0.206 10.096 -9.154 1.00 17.04 C ATOM 936 C ALA A 122 0.261 10.464 -7.675 1.00 16.41 C ATOM 937 O ALA A 122 0.174 11.637 -7.320 1.00 15.50 O ATOM 938 CB ALA A 122 -1.238 10.124 -9.637 1.00 17.46 C ATOM 939 N TRP A 123 0.420 9.464 -6.814 1.00 15.43 N ATOM 940 CA TRP A 123 0.463 9.730 -5.386 1.00 14.84 C ATOM 941 C TRP A 123 1.727 10.412 -4.871 1.00 15.30 C ATOM 942 O TRP A 123 1.740 10.918 -3.752 1.00 15.10 O ATOM 943 CB TRP A 123 0.171 8.445 -4.610 1.00 14.50 C ATOM 944 CG TRP A 123 -1.269 8.082 -4.742 1.00 12.74 C ATOM 945 CD1 TRP A 123 -1.822 7.202 -5.628 1.00 13.18 C ATOM 946 CD2 TRP A 123 -2.360 8.681 -4.035 1.00 13.37 C ATOM 947 NE1 TRP A 123 -3.195 7.222 -5.522 1.00 13.17 N ATOM 948 CE2 TRP A 123 -3.549 8.122 -4.555 1.00 12.69 C ATOM 949 CE3 TRP A 123 -2.447 9.643 -3.023 1.00 13.44 C ATOM 950 CZ2 TRP A 123 -4.814 8.493 -4.086 1.00 14.28 C ATOM 951 CZ3 TRP A 123 -3.705 10.011 -2.558 1.00 14.81 C ATOM 952 CH2 TRP A 123 -4.872 9.438 -3.093 1.00 14.53 C ATOM 953 N ILE A 124 2.789 10.439 -5.674 1.00 15.77 N ATOM 954 CA ILE A 124 4.004 11.124 -5.242 1.00 16.52 C ATOM 955 C ILE A 124 4.262 12.322 -6.155 1.00 17.35 C ATOM 956 O ILE A 124 5.366 12.868 -6.218 1.00 15.33 O ATOM 957 CB ILE A 124 5.228 10.180 -5.221 1.00 17.34 C ATOM 958 CG1 ILE A 124 5.498 9.608 -6.611 1.00 18.78 C ATOM 959 CG2 ILE A 124 4.989 9.061 -4.212 1.00 16.64 C ATOM 960 CD1 ILE A 124 6.732 8.715 -6.662 1.00 18.89 C ATOM 961 N ARG A 125 3.204 12.726 -6.848 1.00 18.75 N ATOM 962 CA ARG A 125 3.234 13.857 -7.762 1.00 21.39 C ATOM 963 C ARG A 125 3.643 15.138 -7.037 1.00 22.27 C ATOM 964 O ARG A 125 3.055 15.499 -6.018 1.00 22.99 O ATOM 965 CB ARG A 125 1.846 14.026 -8.381 1.00 22.81 C ATOM 966 CG ARG A 125 1.634 15.292 -9.177 1.00 25.08 C ATOM 967 CD ARG A 125 0.270 15.247 -9.846 1.00 26.30 C ATOM 968 NE ARG A 125 -0.823 15.293 -8.877 1.00 26.96 N ATOM 969 CZ ARG A 125 -2.016 14.743 -9.077 1.00 27.52 C ATOM 970 NH1 ARG A 125 -2.269 14.097 -10.208 1.00 28.21 N ATOM 971 NH2 ARG A 125 -2.961 14.850 -8.156 1.00 27.41 N ATOM 972 N GLY A 126 4.662 15.813 -7.560 1.00 23.84 N ATOM 973 CA GLY A 126 5.114 17.054 -6.956 1.00 24.80 C ATOM 974 C GLY A 126 5.915 16.926 -5.674 1.00 26.65 C ATOM 975 O GLY A 126 6.168 17.927 -5.003 1.00 26.10 O ATOM 976 N CYS A 127 6.315 15.708 -5.322 1.00 27.86 N ATOM 977 CA CYS A 127 7.102 15.491 -4.111 1.00 29.98 C ATOM 978 C CYS A 127 8.584 15.661 -4.396 1.00 33.38 C ATOM 979 O CYS A 127 9.043 15.417 -5.512 1.00 32.74 O ATOM 980 CB CYS A 127 6.842 14.095 -3.551 1.00 28.36 C ATOM 981 SG CYS A 127 5.070 13.912 -3.003 1.00 23.23 S ATOM 982 N ARG A 128 9.334 16.077 -3.382 1.00 37.98 N ATOM 983 CA ARG A 128 10.775 16.247 -3.521 1.00 43.61 C ATOM 984 C ARG A 128 11.437 15.028 -2.885 1.00 45.06 C ATOM 985 O ARG A 128 11.820 15.061 -1.717 1.00 45.80 O ATOM 986 CB ARG A 128 11.240 17.516 -2.803 1.00 46.55 C ATOM 987 CG ARG A 128 12.743 17.713 -2.852 1.00 51.62 C ATOM 988 CD ARG A 128 13.213 18.711 -1.811 1.00 55.63 C ATOM 989 NE ARG A 128 14.671 18.738 -1.728 1.00 59.58 N ATOM 990 CZ ARG A 128 15.359 19.404 -0.806 1.00 61.46 C ATOM 991 NH1 ARG A 128 14.722 20.107 0.122 1.00 62.59 N ATOM 992 NH2 ARG A 128 16.685 19.370 -0.812 1.00 62.39 N ATOM 993 N LEU A 129 11.567 13.953 -3.657 1.00 46.70 N ATOM 994 CA LEU A 129 12.155 12.719 -3.150 1.00 48.26 C ATOM 995 C LEU A 129 13.498 12.389 -3.794 1.00 49.06 C ATOM 996 O LEU A 129 14.499 12.314 -3.050 1.00 49.31 O ATOM 997 CB LEU A 129 11.178 11.565 -3.371 1.00 48.83 C ATOM 998 CG LEU A 129 9.765 11.812 -2.836 1.00 49.22 C ATOM 999 CD1 LEU A 129 8.843 10.694 -3.279 1.00 49.57 C ATOM 1000 CD2 LEU A 129 9.803 11.918 -1.321 1.00 49.66 C ATOM 1001 OXT LEU A 129 13.532 12.204 -5.030 1.00 49.72 O TER 1002 LEU A 129 ATOM 1003 N LYS A 1 7.368 71.741 47.131 1.00 19.75 N ATOM 1004 CA LYS A 1 7.590 72.972 46.319 1.00 19.73 C ATOM 1005 C LYS A 1 7.135 72.782 44.876 1.00 18.57 C ATOM 1006 O LYS A 1 7.309 71.711 44.292 1.00 18.03 O ATOM 1007 CB LYS A 1 9.073 73.350 46.326 1.00 20.58 C ATOM 1008 CG LYS A 1 9.408 74.519 45.417 1.00 22.22 C ATOM 1009 CD LYS A 1 10.908 74.764 45.353 1.00 23.46 C ATOM 1010 CE LYS A 1 11.228 75.925 44.429 1.00 23.72 C ATOM 1011 NZ LYS A 1 12.690 76.177 44.342 1.00 24.47 N ATOM 1012 N VAL A 2 6.544 73.826 44.306 1.00 17.62 N ATOM 1013 CA VAL A 2 6.094 73.779 42.925 1.00 16.76 C ATOM 1014 C VAL A 2 7.046 74.640 42.100 1.00 16.50 C ATOM 1015 O VAL A 2 7.055 75.866 42.228 1.00 15.23 O ATOM 1016 CB VAL A 2 4.658 74.318 42.778 1.00 17.88 C ATOM 1017 CG1 VAL A 2 4.244 74.292 41.313 1.00 17.61 C ATOM 1018 CG2 VAL A 2 3.702 73.478 43.616 1.00 17.53 C ATOM 1019 N PHE A 3 7.853 73.989 41.267 1.00 14.20 N ATOM 1020 CA PHE A 3 8.823 74.687 40.431 1.00 13.59 C ATOM 1021 C PHE A 3 8.241 75.426 39.242 1.00 12.82 C ATOM 1022 O PHE A 3 7.181 75.071 38.719 1.00 11.64 O ATOM 1023 CB PHE A 3 9.861 73.716 39.862 1.00 14.21 C ATOM 1024 CG PHE A 3 10.975 73.378 40.794 1.00 13.98 C ATOM 1025 CD1 PHE A 3 10.818 72.392 41.758 1.00 15.04 C ATOM 1026 CD2 PHE A 3 12.201 74.032 40.692 1.00 15.59 C ATOM 1027 CE1 PHE A 3 11.877 72.037 42.596 1.00 16.35 C ATOM 1028 CE2 PHE A 3 13.266 73.689 41.522 1.00 15.67 C ATOM 1029 CZ PHE A 3 13.101 72.693 42.484 1.00 15.53 C ATOM 1030 N GLY A 4 8.970 76.450 38.813 1.00 11.75 N ATOM 1031 CA GLY A 4 8.588 77.194 37.635 1.00 11.10 C ATOM 1032 C GLY A 4 9.315 76.440 36.532 1.00 11.07 C ATOM 1033 O GLY A 4 10.340 75.813 36.799 1.00 9.39 O ATOM 1034 N ARG A 5 8.802 76.486 35.307 1.00 10.64 N ATOM 1035 CA ARG A 5 9.420 75.769 34.191 1.00 11.49 C ATOM 1036 C ARG A 5 10.926 76.005 34.042 1.00 11.38 C ATOM 1037 O ARG A 5 11.712 75.060 34.072 1.00 10.54 O ATOM 1038 CB ARG A 5 8.706 76.131 32.884 1.00 12.61 C ATOM 1039 CG ARG A 5 9.219 75.397 31.654 1.00 12.53 C ATOM 1040 CD ARG A 5 8.261 75.577 30.486 1.00 12.58 C ATOM 1041 NE ARG A 5 8.108 76.977 30.102 1.00 13.85 N ATOM 1042 CZ ARG A 5 8.988 77.660 29.373 1.00 14.02 C ATOM 1043 NH1 ARG A 5 10.098 77.075 28.938 1.00 13.13 N ATOM 1044 NH2 ARG A 5 8.754 78.933 29.079 1.00 13.44 N ATOM 1045 N CYS A 6 11.328 77.262 33.888 1.00 12.16 N ATOM 1046 CA CYS A 6 12.742 77.588 33.726 1.00 12.69 C ATOM 1047 C CYS A 6 13.538 77.410 35.006 1.00 12.80 C ATOM 1048 O CYS A 6 14.736 77.134 34.968 1.00 12.79 O ATOM 1049 CB CYS A 6 12.891 79.007 33.186 1.00 12.90 C ATOM 1050 SG CYS A 6 12.297 79.108 31.443 1.00 15.98 S ATOM 1051 N GLU A 7 12.879 77.571 36.146 1.00 12.73 N ATOM 1052 CA GLU A 7 13.560 77.393 37.421 1.00 13.00 C ATOM 1053 C GLU A 7 14.013 75.940 37.521 1.00 11.59 C ATOM 1054 O GLU A 7 15.138 75.656 37.931 1.00 11.70 O ATOM 1055 CB GLU A 7 12.620 77.739 38.576 1.00 15.36 C ATOM 1056 CG GLU A 7 13.122 77.303 39.941 1.00 18.48 C ATOM 1057 CD GLU A 7 12.163 77.673 41.052 1.00 20.36 C ATOM 1058 OE1 GLU A 7 10.937 77.575 40.830 1.00 21.23 O ATOM 1059 OE2 GLU A 7 12.635 78.050 42.149 1.00 21.53 O ATOM 1060 N LEU A 8 13.134 75.022 37.130 1.00 10.84 N ATOM 1061 CA LEU A 8 13.455 73.603 37.175 1.00 9.54 C ATOM 1062 C LEU A 8 14.526 73.266 36.143 1.00 9.74 C ATOM 1063 O LEU A 8 15.447 72.502 36.424 1.00 9.52 O ATOM 1064 CB LEU A 8 12.204 72.756 36.911 1.00 9.15 C ATOM 1065 CG LEU A 8 12.431 71.236 36.955 1.00 11.10 C ATOM 1066 CD1 LEU A 8 12.952 70.841 38.321 1.00 10.61 C ATOM 1067 CD2 LEU A 8 11.137 70.488 36.647 1.00 10.15 C ATOM 1068 N ALA A 9 14.402 73.829 34.946 1.00 9.13 N ATOM 1069 CA ALA A 9 15.385 73.573 33.899 1.00 9.21 C ATOM 1070 C ALA A 9 16.771 73.980 34.397 1.00 9.21 C ATOM 1071 O ALA A 9 17.749 73.265 34.184 1.00 9.57 O ATOM 1072 CB ALA A 9 15.027 74.347 32.635 1.00 8.46 C ATOM 1073 N ALA A 10 16.846 75.127 35.067 1.00 9.28 N ATOM 1074 CA ALA A 10 18.111 75.627 35.597 1.00 9.06 C ATOM 1075 C ALA A 10 18.709 74.671 36.617 1.00 9.36 C ATOM 1076 O ALA A 10 19.904 74.376 36.572 1.00 10.52 O ATOM 1077 CB ALA A 10 17.907 77.007 36.234 1.00 10.71 C ATOM 1078 N ALA A 11 17.878 74.192 37.540 1.00 9.78 N ATOM 1079 CA ALA A 11 18.333 73.272 38.580 1.00 10.29 C ATOM 1080 C ALA A 11 18.808 71.949 37.986 1.00 10.70 C ATOM 1081 O ALA A 11 19.806 71.382 38.429 1.00 11.41 O ATOM 1082 CB ALA A 11 17.217 73.021 39.585 1.00 8.84 C ATOM 1083 N MET A 12 18.080 71.456 36.991 1.00 10.71 N ATOM 1084 CA MET A 12 18.444 70.207 36.343 1.00 11.23 C ATOM 1085 C MET A 12 19.749 70.364 35.567 1.00 12.38 C ATOM 1086 O MET A 12 20.606 69.482 35.593 1.00 11.95 O ATOM 1087 CB MET A 12 17.322 69.750 35.408 1.00 11.29 C ATOM 1088 CG MET A 12 16.095 69.223 36.144 1.00 8.78 C ATOM 1089 SD MET A 12 14.771 68.747 35.015 1.00 10.29 S ATOM 1090 CE MET A 12 13.817 67.664 36.043 1.00 10.37 C ATOM 1091 N LYS A 13 19.908 71.490 34.880 1.00 13.86 N ATOM 1092 CA LYS A 13 21.134 71.710 34.126 1.00 15.44 C ATOM 1093 C LYS A 13 22.311 71.727 35.100 1.00 16.17 C ATOM 1094 O LYS A 13 23.365 71.153 34.827 1.00 15.03 O ATOM 1095 CB LYS A 13 21.067 73.030 33.356 1.00 17.33 C ATOM 1096 CG LYS A 13 22.276 73.266 32.468 1.00 19.94 C ATOM 1097 CD LYS A 13 22.096 74.476 31.575 1.00 21.84 C ATOM 1098 CE LYS A 13 23.342 74.726 30.733 1.00 23.77 C ATOM 1099 NZ LYS A 13 24.550 74.983 31.573 1.00 24.34 N ATOM 1100 N ARG A 14 22.109 72.376 36.242 1.00 16.63 N ATOM 1101 CA ARG A 14 23.133 72.478 37.276 1.00 19.14 C ATOM 1102 C ARG A 14 23.503 71.095 37.814 1.00 18.49 C ATOM 1103 O ARG A 14 24.645 70.861 38.210 1.00 18.19 O ATOM 1104 CB ARG A 14 22.628 73.388 38.405 1.00 21.62 C ATOM 1105 CG ARG A 14 23.563 73.555 39.593 1.00 27.43 C ATOM 1106 CD ARG A 14 23.224 74.821 40.388 1.00 31.16 C ATOM 1107 NE ARG A 14 21.787 74.972 40.622 1.00 35.38 N ATOM 1108 CZ ARG A 14 21.042 75.956 40.120 1.00 37.16 C ATOM 1109 NH1 ARG A 14 21.593 76.886 39.351 1.00 38.34 N ATOM 1110 NH2 ARG A 14 19.742 76.012 40.386 1.00 38.12 N ATOM 1111 N HIS A 15 22.544 70.174 37.814 1.00 17.64 N ATOM 1112 CA HIS A 15 22.812 68.825 38.299 1.00 17.28 C ATOM 1113 C HIS A 15 23.279 67.854 37.215 1.00 16.60 C ATOM 1114 O HIS A 15 23.339 66.648 37.443 1.00 17.42 O ATOM 1115 CB HIS A 15 21.589 68.256 39.022 1.00 17.92 C ATOM 1116 CG HIS A 15 21.425 68.764 40.416 1.00 18.47 C ATOM 1117 ND1 HIS A 15 20.693 69.897 40.724 1.00 19.78 N ATOM 1118 CD2 HIS A 15 21.918 68.321 41.597 1.00 19.40 C ATOM 1119 CE1 HIS A 15 20.743 70.123 42.015 1.00 19.46 C ATOM 1120 NE2 HIS A 15 21.489 69.169 42.577 1.00 19.68 N ATOM 1121 N GLY A 16 23.596 68.385 36.036 1.00 15.62 N ATOM 1122 CA GLY A 16 24.103 67.562 34.949 1.00 14.94 C ATOM 1123 C GLY A 16 23.171 66.704 34.109 1.00 15.14 C ATOM 1124 O GLY A 16 23.620 65.723 33.519 1.00 14.68 O ATOM 1125 N LEU A 17 21.890 67.051 34.023 1.00 14.11 N ATOM 1126 CA LEU A 17 20.967 66.245 33.222 1.00 13.45 C ATOM 1127 C LEU A 17 20.919 66.575 31.732 1.00 12.68 C ATOM 1128 O LEU A 17 20.448 65.762 30.940 1.00 13.03 O ATOM 1129 CB LEU A 17 19.544 66.332 33.779 1.00 13.52 C ATOM 1130 CG LEU A 17 19.148 65.433 34.949 1.00 13.67 C ATOM 1131 CD1 LEU A 17 17.658 65.606 35.201 1.00 12.72 C ATOM 1132 CD2 LEU A 17 19.460 63.972 34.633 1.00 14.82 C ATOM 1133 N ASP A 18 21.394 67.751 31.334 1.00 12.87 N ATOM 1134 CA ASP A 18 21.348 68.112 29.915 1.00 14.13 C ATOM 1135 C ASP A 18 22.198 67.177 29.055 1.00 14.18 C ATOM 1136 O ASP A 18 23.422 67.131 29.187 1.00 13.58 O ATOM 1137 CB ASP A 18 21.790 69.569 29.720 1.00 15.85 C ATOM 1138 CG ASP A 18 21.564 70.063 28.301 1.00 17.33 C ATOM 1139 OD1 ASP A 18 20.691 69.503 27.598 1.00 17.58 O ATOM 1140 OD2 ASP A 18 22.249 71.023 27.892 1.00 19.45 O ATOM 1141 N ASN A 19 21.526 66.434 28.178 1.00 12.93 N ATOM 1142 CA ASN A 19 22.162 65.474 27.277 1.00 14.07 C ATOM 1143 C ASN A 19 22.677 64.217 27.978 1.00 13.53 C ATOM 1144 O ASN A 19 23.482 63.468 27.420 1.00 13.53 O ATOM 1145 CB ASN A 19 23.304 66.134 26.489 1.00 15.77 C ATOM 1146 CG ASN A 19 22.811 67.210 25.546 1.00 18.27 C ATOM 1147 OD1 ASN A 19 21.938 66.968 24.718 1.00 20.36 O ATOM 1148 ND2 ASN A 19 23.369 68.408 25.667 1.00 20.67 N ATOM 1149 N TYR A 20 22.230 63.989 29.208 1.00 12.09 N ATOM 1150 CA TYR A 20 22.647 62.795 29.920 1.00 12.52 C ATOM 1151 C TYR A 20 22.027 61.639 29.139 1.00 12.33 C ATOM 1152 O TYR A 20 20.830 61.648 28.851 1.00 11.65 O ATOM 1153 CB TYR A 20 22.119 62.799 31.358 1.00 12.86 C ATOM 1154 CG TYR A 20 22.711 61.692 32.197 1.00 14.11 C ATOM 1155 CD1 TYR A 20 24.021 61.774 32.666 1.00 15.96 C ATOM 1156 CD2 TYR A 20 21.978 60.542 32.490 1.00 14.64 C ATOM 1157 CE1 TYR A 20 24.590 60.737 33.402 1.00 16.14 C ATOM 1158 CE2 TYR A 20 22.536 59.499 33.219 1.00 15.05 C ATOM 1159 CZ TYR A 20 23.842 59.602 33.675 1.00 16.94 C ATOM 1160 OH TYR A 20 24.406 58.570 34.389 1.00 17.92 O ATOM 1161 N ARG A 21 22.843 60.651 28.791 1.00 12.45 N ATOM 1162 CA ARG A 21 22.379 59.508 28.017 1.00 12.91 C ATOM 1163 C ARG A 21 21.653 59.904 26.736 1.00 12.01 C ATOM 1164 O ARG A 21 20.726 59.220 26.304 1.00 11.78 O ATOM 1165 CB ARG A 21 21.476 58.598 28.861 1.00 15.56 C ATOM 1166 CG ARG A 21 22.228 57.660 29.795 1.00 19.87 C ATOM 1167 CD ARG A 21 23.453 57.066 29.103 1.00 23.24 C ATOM 1168 NE ARG A 21 23.989 55.903 29.803 1.00 25.64 N ATOM 1169 CZ ARG A 21 23.563 54.659 29.614 1.00 26.90 C ATOM 1170 NH1 ARG A 21 22.593 54.413 28.743 1.00 27.71 N ATOM 1171 NH2 ARG A 21 24.107 53.661 30.296 1.00 28.13 N ATOM 1172 N GLY A 22 22.076 61.015 26.138 1.00 11.11 N ATOM 1173 CA GLY A 22 21.482 61.461 24.889 1.00 10.74 C ATOM 1174 C GLY A 22 20.144 62.171 24.962 1.00 10.93 C ATOM 1175 O GLY A 22 19.509 62.391 23.927 1.00 11.15 O ATOM 1176 N TYR A 23 19.707 62.529 26.166 1.00 9.00 N ATOM 1177 CA TYR A 23 18.439 63.228 26.326 1.00 8.28 C ATOM 1178 C TYR A 23 18.648 64.699 26.679 1.00 8.04 C ATOM 1179 O TYR A 23 19.136 65.028 27.764 1.00 8.06 O ATOM 1180 CB TYR A 23 17.588 62.549 27.404 1.00 8.21 C ATOM 1181 CG TYR A 23 17.096 61.171 27.007 1.00 9.06 C ATOM 1182 CD1 TYR A 23 15.995 61.014 26.162 1.00 8.32 C ATOM 1183 CD2 TYR A 23 17.745 60.024 27.465 1.00 9.17 C ATOM 1184 CE1 TYR A 23 15.554 59.744 25.784 1.00 9.44 C ATOM 1185 CE2 TYR A 23 17.315 58.758 27.092 1.00 9.26 C ATOM 1186 CZ TYR A 23 16.223 58.624 26.256 1.00 9.10 C ATOM 1187 OH TYR A 23 15.805 57.370 25.899 1.00 11.16 O ATOM 1188 N SER A 24 18.278 65.574 25.748 1.00 7.91 N ATOM 1189 CA SER A 24 18.407 67.015 25.942 1.00 9.13 C ATOM 1190 C SER A 24 17.556 67.443 27.137 1.00 9.20 C ATOM 1191 O SER A 24 16.613 66.748 27.511 1.00 8.34 O ATOM 1192 CB SER A 24 17.944 67.754 24.688 1.00 10.32 C ATOM 1193 OG SER A 24 16.575 67.485 24.434 1.00 11.85 O ATOM 1194 N LEU A 25 17.897 68.590 27.720 1.00 8.76 N ATOM 1195 CA LEU A 25 17.198 69.129 28.883 1.00 9.85 C ATOM 1196 C LEU A 25 15.683 69.140 28.732 1.00 9.12 C ATOM 1197 O LEU A 25 14.962 68.784 29.663 1.00 9.46 O ATOM 1198 CB LEU A 25 17.665 70.560 29.170 1.00 11.58 C ATOM 1199 CG LEU A 25 18.083 70.923 30.600 1.00 13.55 C ATOM 1200 CD1 LEU A 25 18.071 72.433 30.732 1.00 13.68 C ATOM 1201 CD2 LEU A 25 17.163 70.297 31.627 1.00 15.53 C ATOM 1202 N GLY A 26 15.207 69.555 27.563 1.00 7.82 N ATOM 1203 CA GLY A 26 13.775 69.616 27.328 1.00 7.56 C ATOM 1204 C GLY A 26 13.039 68.343 27.713 1.00 7.44 C ATOM 1205 O GLY A 26 11.916 68.401 28.223 1.00 5.88 O ATOM 1206 N ASN A 27 13.664 67.193 27.463 1.00 6.39 N ATOM 1207 CA ASN A 27 13.055 65.905 27.797 1.00 7.06 C ATOM 1208 C ASN A 27 12.759 65.781 29.291 1.00 6.88 C ATOM 1209 O ASN A 27 11.666 65.362 29.692 1.00 5.90 O ATOM 1210 CB ASN A 27 13.977 64.755 27.368 1.00 7.95 C ATOM 1211 CG ASN A 27 13.952 64.512 25.867 1.00 9.02 C ATOM 1212 OD1 ASN A 27 12.975 63.993 25.331 1.00 8.02 O ATOM 1213 ND2 ASN A 27 15.030 64.892 25.184 1.00 9.66 N ATOM 1214 N TRP A 28 13.739 66.152 30.110 1.00 6.38 N ATOM 1215 CA TRP A 28 13.608 66.075 31.559 1.00 6.30 C ATOM 1216 C TRP A 28 12.566 67.043 32.119 1.00 6.50 C ATOM 1217 O TRP A 28 11.825 66.704 33.045 1.00 6.56 O ATOM 1218 CB TRP A 28 14.972 66.322 32.210 1.00 7.56 C ATOM 1219 CG TRP A 28 15.999 65.325 31.761 1.00 7.56 C ATOM 1220 CD1 TRP A 28 16.917 65.479 30.757 1.00 8.67 C ATOM 1221 CD2 TRP A 28 16.137 63.983 32.228 1.00 8.68 C ATOM 1222 NE1 TRP A 28 17.622 64.309 30.576 1.00 10.48 N ATOM 1223 CE2 TRP A 28 17.170 63.379 31.474 1.00 9.56 C ATOM 1224 CE3 TRP A 28 15.501 63.234 33.230 1.00 9.60 C ATOM 1225 CZ2 TRP A 28 17.560 62.047 31.670 1.00 10.32 C ATOM 1226 CZ3 TRP A 28 15.892 61.910 33.425 1.00 10.26 C ATOM 1227 CH2 TRP A 28 16.920 61.336 32.655 1.00 9.94 C ATOM 1228 N VAL A 29 12.514 68.249 31.567 1.00 6.10 N ATOM 1229 CA VAL A 29 11.533 69.227 32.019 1.00 5.83 C ATOM 1230 C VAL A 29 10.147 68.751 31.591 1.00 6.24 C ATOM 1231 O VAL A 29 9.175 68.866 32.340 1.00 5.96 O ATOM 1232 CB VAL A 29 11.816 70.614 31.411 1.00 5.58 C ATOM 1233 CG1 VAL A 29 10.720 71.602 31.805 1.00 6.32 C ATOM 1234 CG2 VAL A 29 13.182 71.106 31.880 1.00 5.70 C ATOM 1235 N CYS A 30 10.065 68.196 30.387 1.00 6.62 N ATOM 1236 CA CYS A 30 8.794 67.711 29.870 1.00 6.15 C ATOM 1237 C CYS A 30 8.294 66.543 30.713 1.00 6.14 C ATOM 1238 O CYS A 30 7.109 66.466 31.044 1.00 5.64 O ATOM 1239 CB CYS A 30 8.941 67.280 28.409 1.00 7.00 C ATOM 1240 SG CYS A 30 7.344 66.769 27.665 1.00 10.34 S ATOM 1241 N ALA A 31 9.203 65.639 31.064 1.00 5.23 N ATOM 1242 CA ALA A 31 8.850 64.492 31.891 1.00 5.63 C ATOM 1243 C ALA A 31 8.298 64.972 33.236 1.00 6.13 C ATOM 1244 O ALA A 31 7.245 64.514 33.698 1.00 5.40 O ATOM 1245 CB ALA A 31 10.081 63.617 32.109 1.00 5.21 C ATOM 1246 N ALA A 32 9.009 65.908 33.858 1.00 5.30 N ATOM 1247 CA ALA A 32 8.596 66.439 35.152 1.00 6.24 C ATOM 1248 C ALA A 32 7.227 67.110 35.072 1.00 7.14 C ATOM 1249 O ALA A 32 6.412 66.988 35.988 1.00 7.61 O ATOM 1250 CB ALA A 32 9.634 67.435 35.668 1.00 6.50 C ATOM 1251 N LYS A 33 6.982 67.820 33.976 1.00 7.71 N ATOM 1252 CA LYS A 33 5.714 68.512 33.799 1.00 8.89 C ATOM 1253 C LYS A 33 4.530 67.564 33.870 1.00 9.05 C ATOM 1254 O LYS A 33 3.592 67.790 34.629 1.00 9.30 O ATOM 1255 CB LYS A 33 5.688 69.248 32.455 1.00 9.92 C ATOM 1256 CG LYS A 33 4.320 69.833 32.088 1.00 14.11 C ATOM 1257 CD LYS A 33 3.814 70.800 33.152 1.00 15.16 C ATOM 1258 CE LYS A 33 2.488 71.431 32.738 1.00 17.36 C ATOM 1259 NZ LYS A 33 2.043 72.438 33.731 1.00 18.92 N ATOM 1260 N PHE A 34 4.584 66.494 33.086 1.00 9.16 N ATOM 1261 CA PHE A 34 3.486 65.544 33.041 1.00 10.03 C ATOM 1262 C PHE A 34 3.486 64.450 34.097 1.00 10.05 C ATOM 1263 O PHE A 34 2.466 63.796 34.309 1.00 10.13 O ATOM 1264 CB PHE A 34 3.407 64.960 31.637 1.00 10.85 C ATOM 1265 CG PHE A 34 3.124 65.996 30.593 1.00 11.42 C ATOM 1266 CD1 PHE A 34 1.884 66.631 30.551 1.00 12.04 C ATOM 1267 CD2 PHE A 34 4.105 66.379 29.686 1.00 11.36 C ATOM 1268 CE1 PHE A 34 1.627 67.641 29.623 1.00 12.45 C ATOM 1269 CE2 PHE A 34 3.860 67.387 28.754 1.00 12.73 C ATOM 1270 CZ PHE A 34 2.613 68.019 28.723 1.00 12.12 C ATOM 1271 N GLU A 35 4.617 64.243 34.764 1.00 9.12 N ATOM 1272 CA GLU A 35 4.668 63.239 35.818 1.00 9.81 C ATOM 1273 C GLU A 35 4.116 63.824 37.112 1.00 10.04 C ATOM 1274 O GLU A 35 3.329 63.184 37.803 1.00 9.45 O ATOM 1275 CB GLU A 35 6.105 62.771 36.084 1.00 9.33 C ATOM 1276 CG GLU A 35 6.672 61.764 35.091 1.00 9.96 C ATOM 1277 CD GLU A 35 5.943 60.425 35.093 1.00 9.89 C ATOM 1278 OE1 GLU A 35 5.059 60.205 35.947 1.00 10.69 O ATOM 1279 OE2 GLU A 35 6.265 59.584 34.231 1.00 9.89 O ATOM 1280 N SER A 36 4.512 65.058 37.420 1.00 11.15 N ATOM 1281 CA SER A 36 4.102 65.683 38.676 1.00 11.48 C ATOM 1282 C SER A 36 3.633 67.131 38.608 1.00 12.80 C ATOM 1283 O SER A 36 3.332 67.721 39.643 1.00 12.40 O ATOM 1284 CB SER A 36 5.271 65.628 39.651 1.00 11.50 C ATOM 1285 OG SER A 36 6.312 66.484 39.192 1.00 10.28 O ATOM 1286 N ASN A 37 3.577 67.703 37.411 1.00 12.84 N ATOM 1287 CA ASN A 37 3.193 69.101 37.247 1.00 14.07 C ATOM 1288 C ASN A 37 4.152 69.973 38.067 1.00 13.36 C ATOM 1289 O ASN A 37 3.745 70.951 38.701 1.00 12.40 O ATOM 1290 CB ASN A 37 1.753 69.342 37.711 1.00 17.15 C ATOM 1291 CG ASN A 37 1.045 70.390 36.872 1.00 19.63 C ATOM 1292 OD1 ASN A 37 1.675 71.306 36.339 1.00 21.32 O ATOM 1293 ND2 ASN A 37 -0.273 70.266 36.758 1.00 22.74 N ATOM 1294 N PHE A 38 5.428 69.595 38.050 1.00 12.01 N ATOM 1295 CA PHE A 38 6.491 70.312 38.755 1.00 12.45 C ATOM 1296 C PHE A 38 6.373 70.361 40.285 1.00 12.60 C ATOM 1297 O PHE A 38 6.980 71.217 40.925 1.00 13.58 O ATOM 1298 CB PHE A 38 6.609 71.747 38.224 1.00 12.33 C ATOM 1299 CG PHE A 38 6.880 71.838 36.745 1.00 12.29 C ATOM 1300 CD1 PHE A 38 7.742 70.941 36.118 1.00 13.26 C ATOM 1301 CD2 PHE A 38 6.305 72.854 35.987 1.00 13.55 C ATOM 1302 CE1 PHE A 38 8.029 71.055 34.754 1.00 13.18 C ATOM 1303 CE2 PHE A 38 6.583 72.981 34.625 1.00 13.66 C ATOM 1304 CZ PHE A 38 7.449 72.078 34.006 1.00 14.21 C ATOM 1305 N ASN A 39 5.610 69.447 40.872 1.00 12.72 N ATOM 1306 CA ASN A 39 5.435 69.426 42.328 1.00 13.70 C ATOM 1307 C ASN A 39 6.349 68.402 43.009 1.00 13.35 C ATOM 1308 O ASN A 39 6.173 67.200 42.822 1.00 13.83 O ATOM 1309 CB ASN A 39 3.980 69.099 42.673 1.00 14.06 C ATOM 1310 CG ASN A 39 3.649 69.395 44.121 1.00 15.20 C ATOM 1311 OD1 ASN A 39 4.490 69.251 45.005 1.00 15.57 O ATOM 1312 ND2 ASN A 39 2.412 69.804 44.370 1.00 19.13 N ATOM 1313 N THR A 40 7.309 68.875 43.803 1.00 13.07 N ATOM 1314 CA THR A 40 8.246 67.985 44.499 1.00 14.62 C ATOM 1315 C THR A 40 7.577 67.039 45.493 1.00 15.95 C ATOM 1316 O THR A 40 8.151 66.015 45.861 1.00 17.86 O ATOM 1317 CB THR A 40 9.315 68.773 45.294 1.00 14.19 C ATOM 1318 OG1 THR A 40 8.664 69.663 46.211 1.00 15.03 O ATOM 1319 CG2 THR A 40 10.214 69.566 44.360 1.00 12.46 C ATOM 1320 N GLN A 41 6.369 67.383 45.926 1.00 16.99 N ATOM 1321 CA GLN A 41 5.648 66.576 46.908 1.00 18.54 C ATOM 1322 C GLN A 41 4.630 65.586 46.348 1.00 18.06 C ATOM 1323 O GLN A 41 3.951 64.891 47.106 1.00 18.30 O ATOM 1324 CB GLN A 41 4.947 67.501 47.904 1.00 20.65 C ATOM 1325 CG GLN A 41 5.895 68.236 48.830 1.00 24.97 C ATOM 1326 CD GLN A 41 5.831 67.709 50.248 1.00 27.61 C ATOM 1327 OE1 GLN A 41 6.141 66.543 50.510 1.00 29.03 O ATOM 1328 NE2 GLN A 41 5.416 68.566 51.175 1.00 29.80 N ATOM 1329 N ALA A 42 4.519 65.519 45.028 1.00 17.22 N ATOM 1330 CA ALA A 42 3.571 64.610 44.400 1.00 17.48 C ATOM 1331 C ALA A 42 3.847 63.148 44.754 1.00 17.60 C ATOM 1332 O ALA A 42 4.991 62.692 44.714 1.00 16.27 O ATOM 1333 CB ALA A 42 3.600 64.796 42.883 1.00 16.74 C ATOM 1334 N THR A 43 2.790 62.426 45.118 1.00 17.84 N ATOM 1335 CA THR A 43 2.902 61.012 45.453 1.00 19.31 C ATOM 1336 C THR A 43 1.701 60.282 44.874 1.00 19.98 C ATOM 1337 O THR A 43 0.582 60.804 44.872 1.00 19.89 O ATOM 1338 CB THR A 43 2.934 60.764 46.976 1.00 19.62 C ATOM 1339 OG1 THR A 43 1.652 61.068 47.536 1.00 21.71 O ATOM 1340 CG2 THR A 43 3.999 61.622 47.635 1.00 19.33 C ATOM 1341 N ASN A 44 1.940 59.073 44.382 1.00 19.62 N ATOM 1342 CA ASN A 44 0.889 58.267 43.787 1.00 21.42 C ATOM 1343 C ASN A 44 0.998 56.835 44.292 1.00 22.28 C ATOM 1344 O ASN A 44 1.985 56.151 44.022 1.00 21.07 O ATOM 1345 CB ASN A 44 1.026 58.287 42.262 1.00 22.25 C ATOM 1346 CG ASN A 44 -0.040 57.467 41.566 1.00 24.13 C ATOM 1347 OD1 ASN A 44 0.246 56.747 40.607 1.00 25.58 O ATOM 1348 ND2 ASN A 44 -1.278 57.580 42.035 1.00 23.75 N ATOM 1349 N ARG A 45 -0.007 56.385 45.036 1.00 23.09 N ATOM 1350 CA ARG A 45 0.005 55.021 45.545 1.00 25.12 C ATOM 1351 C ARG A 45 -0.535 54.067 44.490 1.00 24.55 C ATOM 1352 O ARG A 45 -1.533 54.354 43.826 1.00 23.81 O ATOM 1353 CB ARG A 45 -0.835 54.900 46.823 1.00 28.10 C ATOM 1354 CG ARG A 45 -1.237 53.460 47.137 1.00 32.70 C ATOM 1355 CD ARG A 45 -1.688 53.259 48.577 1.00 36.28 C ATOM 1356 NE ARG A 45 -0.569 53.308 49.516 1.00 39.97 N ATOM 1357 CZ ARG A 45 -0.643 52.932 50.790 1.00 41.86 C ATOM 1358 NH1 ARG A 45 -1.785 52.474 51.286 1.00 42.91 N ATOM 1359 NH2 ARG A 45 0.425 53.012 51.571 1.00 43.06 N ATOM 1360 N ASN A 46 0.134 52.931 44.330 1.00 24.34 N ATOM 1361 CA ASN A 46 -0.306 51.945 43.359 1.00 24.10 C ATOM 1362 C ASN A 46 -0.949 50.776 44.090 1.00 24.10 C ATOM 1363 O ASN A 46 -0.826 50.652 45.307 1.00 24.83 O ATOM 1364 CB ASN A 46 0.872 51.474 42.507 1.00 24.55 C ATOM 1365 CG ASN A 46 1.509 52.608 41.727 1.00 25.63 C ATOM 1366 OD1 ASN A 46 2.607 53.066 42.053 1.00 26.41 O ATOM 1367 ND2 ASN A 46 0.815 53.080 40.697 1.00 24.39 N ATOM 1368 N THR A 47 -1.643 49.925 43.348 1.00 24.07 N ATOM 1369 CA THR A 47 -2.319 48.782 43.948 1.00 23.87 C ATOM 1370 C THR A 47 -1.374 47.653 44.343 1.00 23.96 C ATOM 1371 O THR A 47 -1.710 46.837 45.204 1.00 24.35 O ATOM 1372 CB THR A 47 -3.389 48.226 43.001 1.00 23.55 C ATOM 1373 OG1 THR A 47 -2.794 47.935 41.732 1.00 24.00 O ATOM 1374 CG2 THR A 47 -4.508 49.239 42.812 1.00 24.13 C ATOM 1375 N ASP A 48 -0.197 47.601 43.724 1.00 22.93 N ATOM 1376 CA ASP A 48 0.766 46.553 44.044 1.00 22.31 C ATOM 1377 C ASP A 48 1.543 46.850 45.325 1.00 21.72 C ATOM 1378 O ASP A 48 2.479 46.128 45.673 1.00 22.69 O ATOM 1379 CB ASP A 48 1.748 46.333 42.885 1.00 22.85 C ATOM 1380 CG ASP A 48 2.567 47.568 42.563 1.00 22.85 C ATOM 1381 OD1 ASP A 48 2.786 48.396 43.472 1.00 21.53 O ATOM 1382 OD2 ASP A 48 3.006 47.700 41.400 1.00 23.51 O ATOM 1383 N GLY A 49 1.160 47.915 46.020 1.00 20.23 N ATOM 1384 CA GLY A 49 1.832 48.257 47.262 1.00 19.18 C ATOM 1385 C GLY A 49 2.958 49.264 47.123 1.00 17.88 C ATOM 1386 O GLY A 49 3.518 49.720 48.121 1.00 18.25 O ATOM 1387 N SER A 50 3.293 49.614 45.887 1.00 17.09 N ATOM 1388 CA SER A 50 4.356 50.580 45.640 1.00 14.71 C ATOM 1389 C SER A 50 3.775 51.985 45.558 1.00 14.33 C ATOM 1390 O SER A 50 2.558 52.170 45.525 1.00 13.80 O ATOM 1391 CB SER A 50 5.081 50.258 44.332 1.00 14.20 C ATOM 1392 OG SER A 50 4.243 50.491 43.217 1.00 10.55 O ATOM 1393 N THR A 51 4.661 52.973 45.514 1.00 12.88 N ATOM 1394 CA THR A 51 4.256 54.365 45.439 1.00 12.47 C ATOM 1395 C THR A 51 5.240 55.116 44.548 1.00 12.28 C ATOM 1396 O THR A 51 6.426 54.790 44.516 1.00 11.47 O ATOM 1397 CB THR A 51 4.263 55.014 46.844 1.00 12.85 C ATOM 1398 OG1 THR A 51 3.395 54.280 47.717 1.00 14.13 O ATOM 1399 CG2 THR A 51 3.800 56.463 46.773 1.00 12.19 C ATOM 1400 N ASP A 52 4.741 56.105 43.815 1.00 11.61 N ATOM 1401 CA ASP A 52 5.591 56.923 42.956 1.00 11.74 C ATOM 1402 C ASP A 52 5.849 58.210 43.732 1.00 11.00 C ATOM 1403 O ASP A 52 4.909 58.832 44.230 1.00 11.49 O ATOM 1404 CB ASP A 52 4.888 57.217 41.629 1.00 11.28 C ATOM 1405 CG ASP A 52 4.467 55.950 40.905 1.00 13.73 C ATOM 1406 OD1 ASP A 52 5.290 55.016 40.810 1.00 14.81 O ATOM 1407 OD2 ASP A 52 3.316 55.886 40.431 1.00 14.54 O ATOM 1408 N TYR A 53 7.117 58.604 43.832 1.00 10.65 N ATOM 1409 CA TYR A 53 7.497 59.789 44.599 1.00 10.74 C ATOM 1410 C TYR A 53 8.219 60.915 43.874 1.00 10.61 C ATOM 1411 O TYR A 53 9.078 60.685 43.026 1.00 9.71 O ATOM 1412 CB TYR A 53 8.418 59.404 45.760 1.00 12.16 C ATOM 1413 CG TYR A 53 7.847 58.466 46.792 1.00 13.75 C ATOM 1414 CD1 TYR A 53 7.845 57.086 46.587 1.00 13.44 C ATOM 1415 CD2 TYR A 53 7.349 58.957 47.996 1.00 13.95 C ATOM 1416 CE1 TYR A 53 7.365 56.221 47.557 1.00 14.10 C ATOM 1417 CE2 TYR A 53 6.866 58.100 48.973 1.00 15.05 C ATOM 1418 CZ TYR A 53 6.878 56.735 48.752 1.00 15.18 C ATOM 1419 OH TYR A 53 6.406 55.892 49.735 1.00 15.18 O ATOM 1420 N GLY A 54 7.878 62.140 44.253 1.00 9.96 N ATOM 1421 CA GLY A 54 8.560 63.298 43.712 1.00 9.58 C ATOM 1422 C GLY A 54 8.241 63.849 42.344 1.00 9.77 C ATOM 1423 O GLY A 54 7.332 63.407 41.650 1.00 8.44 O ATOM 1424 N ILE A 55 9.047 64.836 41.972 1.00 10.21 N ATOM 1425 CA ILE A 55 8.911 65.546 40.718 1.00 10.66 C ATOM 1426 C ILE A 55 9.008 64.643 39.492 1.00 9.95 C ATOM 1427 O ILE A 55 8.434 64.952 38.447 1.00 9.38 O ATOM 1428 CB ILE A 55 9.964 66.682 40.655 1.00 11.91 C ATOM 1429 CG1 ILE A 55 9.546 67.721 39.618 1.00 13.31 C ATOM 1430 CG2 ILE A 55 11.343 66.101 40.363 1.00 11.45 C ATOM 1431 CD1 ILE A 55 9.981 69.128 39.955 1.00 16.26 C ATOM 1432 N LEU A 56 9.714 63.522 39.624 1.00 8.70 N ATOM 1433 CA LEU A 56 9.866 62.583 38.512 1.00 9.06 C ATOM 1434 C LEU A 56 9.141 61.263 38.780 1.00 8.78 C ATOM 1435 O LEU A 56 9.336 60.278 38.067 1.00 8.46 O ATOM 1436 CB LEU A 56 11.351 62.322 38.244 1.00 9.06 C ATOM 1437 CG LEU A 56 12.003 62.834 36.950 1.00 13.09 C ATOM 1438 CD1 LEU A 56 11.283 64.043 36.385 1.00 12.52 C ATOM 1439 CD2 LEU A 56 13.461 63.157 37.242 1.00 11.63 C ATOM 1440 N GLN A 57 8.307 61.253 39.816 1.00 7.90 N ATOM 1441 CA GLN A 57 7.526 60.072 40.173 1.00 8.43 C ATOM 1442 C GLN A 57 8.291 58.752 40.088 1.00 7.94 C ATOM 1443 O GLN A 57 7.903 57.837 39.357 1.00 6.66 O ATOM 1444 CB GLN A 57 6.278 60.013 39.289 1.00 9.61 C ATOM 1445 CG GLN A 57 5.299 61.141 39.585 1.00 9.77 C ATOM 1446 CD GLN A 57 4.574 60.923 40.898 1.00 10.62 C ATOM 1447 OE1 GLN A 57 3.552 60.239 40.945 1.00 9.29 O ATOM 1448 NE2 GLN A 57 5.117 61.482 41.979 1.00 10.34 N ATOM 1449 N ILE A 58 9.375 58.658 40.852 1.00 6.83 N ATOM 1450 CA ILE A 58 10.194 57.454 40.875 1.00 7.09 C ATOM 1451 C ILE A 58 9.506 56.409 41.752 1.00 8.47 C ATOM 1452 O ILE A 58 9.069 56.707 42.862 1.00 8.75 O ATOM 1453 CB ILE A 58 11.616 57.796 41.375 1.00 6.28 C ATOM 1454 CG1 ILE A 58 12.307 58.652 40.305 1.00 7.19 C ATOM 1455 CG2 ILE A 58 12.411 56.529 41.658 1.00 6.44 C ATOM 1456 CD1 ILE A 58 13.660 59.212 40.703 1.00 7.61 C ATOM 1457 N ASN A 59 9.395 55.189 41.233 1.00 9.70 N ATOM 1458 CA ASN A 59 8.701 54.103 41.933 1.00 10.32 C ATOM 1459 C ASN A 59 9.508 53.394 43.019 1.00 10.46 C ATOM 1460 O ASN A 59 10.696 53.133 42.854 1.00 10.72 O ATOM 1461 CB ASN A 59 8.188 53.087 40.907 1.00 9.99 C ATOM 1462 CG ASN A 59 7.260 52.059 41.520 1.00 10.22 C ATOM 1463 OD1 ASN A 59 7.683 50.963 41.882 1.00 11.01 O ATOM 1464 ND2 ASN A 59 5.988 52.417 41.652 1.00 10.15 N ATOM 1465 N SER A 60 8.835 53.062 44.121 1.00 9.99 N ATOM 1466 CA SER A 60 9.468 52.412 45.265 1.00 10.20 C ATOM 1467 C SER A 60 9.747 50.913 45.126 1.00 11.13 C ATOM 1468 O SER A 60 10.495 50.353 45.915 1.00 10.46 O ATOM 1469 CB SER A 60 8.623 52.639 46.524 1.00 9.57 C ATOM 1470 OG SER A 60 7.364 52.001 46.411 1.00 7.95 O ATOM 1471 N ARG A 61 9.158 50.256 44.135 1.00 12.08 N ATOM 1472 CA ARG A 61 9.385 48.822 43.986 1.00 14.26 C ATOM 1473 C ARG A 61 10.860 48.484 43.771 1.00 13.30 C ATOM 1474 O ARG A 61 11.348 47.465 44.262 1.00 11.85 O ATOM 1475 CB ARG A 61 8.545 48.261 42.832 1.00 16.53 C ATOM 1476 CG ARG A 61 8.481 46.740 42.812 1.00 23.14 C ATOM 1477 CD ARG A 61 7.149 46.246 42.256 1.00 27.76 C ATOM 1478 NE ARG A 61 6.932 44.828 42.534 1.00 31.91 N ATOM 1479 CZ ARG A 61 5.796 44.178 42.291 1.00 33.77 C ATOM 1480 NH1 ARG A 61 4.761 44.816 41.760 1.00 35.13 N ATOM 1481 NH2 ARG A 61 5.694 42.887 42.581 1.00 34.40 N ATOM 1482 N TRP A 62 11.574 49.358 43.069 1.00 11.83 N ATOM 1483 CA TRP A 62 12.982 49.120 42.775 1.00 12.03 C ATOM 1484 C TRP A 62 13.989 50.179 43.205 1.00 10.67 C ATOM 1485 O TRP A 62 15.076 49.860 43.672 1.00 12.18 O ATOM 1486 CB TRP A 62 13.177 48.945 41.268 1.00 12.49 C ATOM 1487 CG TRP A 62 12.646 47.689 40.698 1.00 13.72 C ATOM 1488 CD1 TRP A 62 11.510 47.536 39.961 1.00 13.78 C ATOM 1489 CD2 TRP A 62 13.256 46.399 40.776 1.00 14.12 C ATOM 1490 NE1 TRP A 62 11.372 46.225 39.575 1.00 15.29 N ATOM 1491 CE2 TRP A 62 12.425 45.505 40.070 1.00 15.39 C ATOM 1492 CE3 TRP A 62 14.417 45.912 41.392 1.00 15.06 C ATOM 1493 CZ2 TRP A 62 12.733 44.146 39.941 1.00 15.93 C ATOM 1494 CZ3 TRP A 62 14.721 44.560 41.263 1.00 16.59 C ATOM 1495 CH2 TRP A 62 13.875 43.693 40.549 1.00 16.44 C ATOM 1496 N TRP A 63 13.619 51.438 43.047 1.00 10.36 N ATOM 1497 CA TRP A 63 14.546 52.536 43.284 1.00 9.95 C ATOM 1498 C TRP A 63 14.787 53.140 44.658 1.00 10.12 C ATOM 1499 O TRP A 63 15.854 53.709 44.897 1.00 9.94 O ATOM 1500 CB TRP A 63 14.203 53.631 42.276 1.00 9.66 C ATOM 1501 CG TRP A 63 13.996 53.028 40.927 1.00 9.53 C ATOM 1502 CD1 TRP A 63 12.801 52.718 40.333 1.00 10.51 C ATOM 1503 CD2 TRP A 63 15.014 52.528 40.054 1.00 10.10 C ATOM 1504 NE1 TRP A 63 13.018 52.050 39.149 1.00 9.05 N ATOM 1505 CE2 TRP A 63 14.369 51.920 38.956 1.00 9.97 C ATOM 1506 CE3 TRP A 63 16.415 52.531 40.102 1.00 9.98 C ATOM 1507 CZ2 TRP A 63 15.077 51.322 37.905 1.00 10.58 C ATOM 1508 CZ3 TRP A 63 17.120 51.935 39.056 1.00 11.58 C ATOM 1509 CH2 TRP A 63 16.448 51.338 37.975 1.00 11.50 C ATOM 1510 N CYS A 64 13.825 53.036 45.563 1.00 10.63 N ATOM 1511 CA CYS A 64 14.026 53.609 46.881 1.00 11.67 C ATOM 1512 C CYS A 64 13.300 52.839 47.969 1.00 12.73 C ATOM 1513 O CYS A 64 12.448 51.994 47.698 1.00 12.36 O ATOM 1514 CB CYS A 64 13.589 55.087 46.892 1.00 11.45 C ATOM 1515 SG CYS A 64 11.784 55.338 46.588 1.00 14.09 S ATOM 1516 N ASN A 65 13.643 53.153 49.210 1.00 14.61 N ATOM 1517 CA ASN A 65 13.070 52.477 50.358 1.00 16.81 C ATOM 1518 C ASN A 65 12.052 53.312 51.124 1.00 16.74 C ATOM 1519 O ASN A 65 12.350 54.429 51.549 1.00 16.72 O ATOM 1520 CB ASN A 65 14.208 52.045 51.291 1.00 18.98 C ATOM 1521 CG ASN A 65 13.710 51.475 52.599 1.00 21.44 C ATOM 1522 OD1 ASN A 65 12.839 50.606 52.616 1.00 23.06 O ATOM 1523 ND2 ASN A 65 14.270 51.952 53.707 1.00 22.66 N ATOM 1524 N ASP A 66 10.844 52.776 51.276 1.00 16.86 N ATOM 1525 CA ASP A 66 9.803 53.457 52.037 1.00 18.27 C ATOM 1526 C ASP A 66 9.270 52.507 53.103 1.00 19.65 C ATOM 1527 O ASP A 66 8.216 52.733 53.691 1.00 20.52 O ATOM 1528 CB ASP A 66 8.665 53.969 51.134 1.00 17.10 C ATOM 1529 CG ASP A 66 7.954 52.865 50.375 1.00 16.44 C ATOM 1530 OD1 ASP A 66 8.220 51.673 50.636 1.00 14.96 O ATOM 1531 OD2 ASP A 66 7.114 53.206 49.511 1.00 14.59 O ATOM 1532 N GLY A 67 10.027 51.437 53.333 1.00 21.78 N ATOM 1533 CA GLY A 67 9.690 50.446 54.340 1.00 23.05 C ATOM 1534 C GLY A 67 8.324 49.784 54.307 1.00 24.15 C ATOM 1535 O GLY A 67 7.932 49.152 55.286 1.00 24.75 O ATOM 1536 N ARG A 68 7.595 49.907 53.205 1.00 24.67 N ATOM 1537 CA ARG A 68 6.276 49.287 53.127 1.00 25.72 C ATOM 1538 C ARG A 68 6.006 48.669 51.760 1.00 25.13 C ATOM 1539 O ARG A 68 4.917 48.150 51.506 1.00 25.74 O ATOM 1540 CB ARG A 68 5.184 50.314 53.448 1.00 27.44 C ATOM 1541 CG ARG A 68 4.962 51.352 52.364 1.00 29.14 C ATOM 1542 CD ARG A 68 3.892 52.358 52.764 1.00 31.28 C ATOM 1543 NE ARG A 68 3.603 53.293 51.678 1.00 33.04 N ATOM 1544 CZ ARG A 68 2.833 54.369 51.795 1.00 33.40 C ATOM 1545 NH1 ARG A 68 2.263 54.658 52.958 1.00 33.58 N ATOM 1546 NH2 ARG A 68 2.626 55.155 50.743 1.00 33.78 N ATOM 1547 N THR A 69 6.999 48.719 50.881 1.00 24.22 N ATOM 1548 CA THR A 69 6.843 48.165 49.545 1.00 23.58 C ATOM 1549 C THR A 69 7.377 46.740 49.495 1.00 24.92 C ATOM 1550 O THR A 69 8.535 46.488 49.828 1.00 23.60 O ATOM 1551 CB THR A 69 7.574 49.031 48.496 1.00 22.40 C ATOM 1552 OG1 THR A 69 7.055 50.367 48.537 1.00 19.98 O ATOM 1553 CG2 THR A 69 7.370 48.463 47.096 1.00 20.22 C ATOM 1554 N PRO A 70 6.533 45.788 49.071 1.00 26.38 N ATOM 1555 CA PRO A 70 6.924 44.379 48.980 1.00 28.26 C ATOM 1556 C PRO A 70 8.227 44.155 48.224 1.00 30.12 C ATOM 1557 O PRO A 70 8.429 44.696 47.135 1.00 30.71 O ATOM 1558 CB PRO A 70 5.721 43.726 48.295 1.00 28.38 C ATOM 1559 CG PRO A 70 5.120 44.846 47.501 1.00 27.93 C ATOM 1560 CD PRO A 70 5.208 45.999 48.463 1.00 26.85 C ATOM 1561 N GLY A 71 9.107 43.357 48.823 1.00 31.31 N ATOM 1562 CA GLY A 71 10.389 43.053 48.218 1.00 33.00 C ATOM 1563 C GLY A 71 11.264 44.276 48.053 1.00 34.28 C ATOM 1564 O GLY A 71 12.436 44.263 48.433 1.00 35.53 O ATOM 1565 N SER A 72 10.672 45.330 47.494 1.00 34.96 N ATOM 1566 CA SER A 72 11.338 46.601 47.224 1.00 34.52 C ATOM 1567 C SER A 72 12.833 46.642 47.454 1.00 33.82 C ATOM 1568 O SER A 72 13.319 46.548 48.585 1.00 34.28 O ATOM 1569 CB SER A 72 10.702 47.745 48.022 1.00 35.31 C ATOM 1570 OG SER A 72 11.385 48.976 47.777 1.00 35.96 O ATOM 1571 N ARG A 73 13.560 46.777 46.357 1.00 32.48 N ATOM 1572 CA ARG A 73 14.992 46.899 46.431 1.00 29.86 C ATOM 1573 C ARG A 73 15.170 48.363 46.798 1.00 27.42 C ATOM 1574 O ARG A 73 14.221 49.033 47.211 1.00 26.26 O ATOM 1575 CB ARG A 73 15.617 46.638 45.066 1.00 32.59 C ATOM 1576 CG ARG A 73 15.579 45.197 44.618 1.00 36.08 C ATOM 1577 CD ARG A 73 16.514 44.342 45.456 1.00 38.31 C ATOM 1578 NE ARG A 73 17.130 43.300 44.644 1.00 40.92 N ATOM 1579 CZ ARG A 73 16.452 42.353 44.004 1.00 42.43 C ATOM 1580 NH1 ARG A 73 15.127 42.310 44.084 1.00 43.59 N ATOM 1581 NH2 ARG A 73 17.097 41.459 43.268 1.00 43.70 N ATOM 1582 N ASN A 74 16.384 48.856 46.633 1.00 23.78 N ATOM 1583 CA ASN A 74 16.694 50.241 46.923 1.00 21.23 C ATOM 1584 C ASN A 74 17.927 50.498 46.079 1.00 20.07 C ATOM 1585 O ASN A 74 19.019 50.715 46.600 1.00 18.91 O ATOM 1586 CB ASN A 74 17.003 50.421 48.412 1.00 21.17 C ATOM 1587 CG ASN A 74 17.221 51.870 48.788 1.00 20.59 C ATOM 1588 OD1 ASN A 74 17.218 52.749 47.928 1.00 19.56 O ATOM 1589 ND2 ASN A 74 17.414 52.127 50.074 1.00 20.37 N ATOM 1590 N LEU A 75 17.732 50.434 44.764 1.00 18.05 N ATOM 1591 CA LEU A 75 18.804 50.622 43.796 1.00 18.19 C ATOM 1592 C LEU A 75 19.514 51.962 43.854 1.00 18.11 C ATOM 1593 O LEU A 75 20.662 52.075 43.428 1.00 18.38 O ATOM 1594 CB LEU A 75 18.273 50.395 42.380 1.00 18.03 C ATOM 1595 CG LEU A 75 18.249 48.947 41.889 1.00 18.86 C ATOM 1596 CD1 LEU A 75 17.530 48.064 42.882 1.00 20.45 C ATOM 1597 CD2 LEU A 75 17.574 48.891 40.534 1.00 18.44 C ATOM 1598 N CYS A 76 18.836 52.980 44.365 1.00 17.94 N ATOM 1599 CA CYS A 76 19.445 54.294 44.452 1.00 18.42 C ATOM 1600 C CYS A 76 19.908 54.580 45.874 1.00 19.17 C ATOM 1601 O CYS A 76 20.320 55.694 46.199 1.00 18.51 O ATOM 1602 CB CYS A 76 18.443 55.352 43.985 1.00 17.11 C ATOM 1603 SG CYS A 76 17.956 55.333 42.205 1.00 15.31 S ATOM 1604 N ASN A 77 19.846 53.546 46.705 1.00 20.56 N ATOM 1605 CA ASN A 77 20.252 53.628 48.100 1.00 22.74 C ATOM 1606 C ASN A 77 19.812 54.920 48.770 1.00 22.76 C ATOM 1607 O ASN A 77 20.633 55.678 49.299 1.00 23.15 O ATOM 1608 CB ASN A 77 21.766 53.489 48.227 1.00 25.16 C ATOM 1609 CG ASN A 77 22.206 53.321 49.667 1.00 28.46 C ATOM 1610 OD1 ASN A 77 22.943 54.147 50.211 1.00 29.84 O ATOM 1611 ND2 ASN A 77 21.741 52.247 50.299 1.00 30.09 N ATOM 1612 N ILE A 78 18.510 55.167 48.749 1.00 21.63 N ATOM 1613 CA ILE A 78 17.959 56.364 49.358 1.00 21.07 C ATOM 1614 C ILE A 78 16.553 56.112 49.856 1.00 20.08 C ATOM 1615 O ILE A 78 15.843 55.246 49.339 1.00 19.18 O ATOM 1616 CB ILE A 78 17.869 57.535 48.352 1.00 22.58 C ATOM 1617 CG1 ILE A 78 17.036 57.106 47.139 1.00 22.53 C ATOM 1618 CG2 ILE A 78 19.258 57.980 47.933 1.00 22.30 C ATOM 1619 CD1 ILE A 78 16.732 58.225 46.170 1.00 23.40 C ATOM 1620 N PRO A 79 16.137 56.852 50.888 1.00 18.88 N ATOM 1621 CA PRO A 79 14.782 56.670 51.401 1.00 18.15 C ATOM 1622 C PRO A 79 13.896 57.398 50.386 1.00 17.41 C ATOM 1623 O PRO A 79 14.328 58.381 49.790 1.00 16.24 O ATOM 1624 CB PRO A 79 14.833 57.372 52.755 1.00 18.69 C ATOM 1625 CG PRO A 79 15.807 58.479 52.518 1.00 19.04 C ATOM 1626 CD PRO A 79 16.901 57.795 51.727 1.00 19.44 C ATOM 1627 N CYS A 80 12.679 56.918 50.171 1.00 15.68 N ATOM 1628 CA CYS A 80 11.791 57.570 49.215 1.00 15.38 C ATOM 1629 C CYS A 80 11.495 59.015 49.598 1.00 16.14 C ATOM 1630 O CYS A 80 11.209 59.848 48.735 1.00 15.95 O ATOM 1631 CB CYS A 80 10.500 56.773 49.087 1.00 15.61 C ATOM 1632 SG CYS A 80 10.841 55.100 48.375 1.00 15.54 S ATOM 1633 N SER A 81 11.573 59.317 50.893 1.00 16.08 N ATOM 1634 CA SER A 81 11.299 60.669 51.377 1.00 16.11 C ATOM 1635 C SER A 81 12.262 61.716 50.810 1.00 15.67 C ATOM 1636 O SER A 81 11.904 62.886 50.678 1.00 16.39 O ATOM 1637 CB SER A 81 11.336 60.707 52.909 1.00 16.32 C ATOM 1638 OG SER A 81 12.619 60.386 53.407 1.00 17.04 O ATOM 1639 N ALA A 82 13.475 61.296 50.468 1.00 14.49 N ATOM 1640 CA ALA A 82 14.462 62.213 49.909 1.00 15.09 C ATOM 1641 C ALA A 82 13.992 62.706 48.540 1.00 15.18 C ATOM 1642 O ALA A 82 14.415 63.767 48.063 1.00 14.89 O ATOM 1643 CB ALA A 82 15.813 61.517 49.784 1.00 14.65 C ATOM 1644 N LEU A 83 13.110 61.931 47.917 1.00 14.26 N ATOM 1645 CA LEU A 83 12.572 62.276 46.605 1.00 14.95 C ATOM 1646 C LEU A 83 11.472 63.332 46.704 1.00 15.28 C ATOM 1647 O LEU A 83 10.991 63.827 45.686 1.00 15.25 O ATOM 1648 CB LEU A 83 12.012 61.023 45.917 1.00 14.23 C ATOM 1649 CG LEU A 83 13.006 59.899 45.630 1.00 13.65 C ATOM 1650 CD1 LEU A 83 12.264 58.681 45.089 1.00 14.74 C ATOM 1651 CD2 LEU A 83 14.046 60.385 44.637 1.00 13.39 C ATOM 1652 N LEU A 84 11.079 63.673 47.930 1.00 15.97 N ATOM 1653 CA LEU A 84 10.024 64.660 48.149 1.00 17.96 C ATOM 1654 C LEU A 84 10.569 66.001 48.641 1.00 19.30 C ATOM 1655 O LEU A 84 9.809 66.874 49.053 1.00 20.37 O ATOM 1656 CB LEU A 84 9.007 64.121 49.163 1.00 16.97 C ATOM 1657 CG LEU A 84 8.255 62.839 48.797 1.00 16.03 C ATOM 1658 CD1 LEU A 84 7.421 62.378 49.986 1.00 15.85 C ATOM 1659 CD2 LEU A 84 7.368 63.094 47.583 1.00 15.14 C ATOM 1660 N SER A 85 11.885 66.161 48.582 1.00 20.77 N ATOM 1661 CA SER A 85 12.534 67.385 49.039 1.00 22.09 C ATOM 1662 C SER A 85 12.469 68.530 48.031 1.00 22.46 C ATOM 1663 O SER A 85 12.257 68.311 46.837 1.00 22.50 O ATOM 1664 CB SER A 85 13.996 67.091 49.378 1.00 21.79 C ATOM 1665 OG SER A 85 14.698 68.280 49.689 1.00 24.10 O ATOM 1666 N SER A 86 12.643 69.754 48.525 1.00 21.59 N ATOM 1667 CA SER A 86 12.637 70.935 47.665 1.00 21.52 C ATOM 1668 C SER A 86 13.954 70.891 46.898 1.00 19.64 C ATOM 1669 O SER A 86 14.126 71.546 45.873 1.00 19.71 O ATOM 1670 CB SER A 86 12.575 72.210 48.510 1.00 21.62 C ATOM 1671 OG SER A 86 11.441 72.205 49.357 1.00 25.52 O ATOM 1672 N ASP A 87 14.879 70.105 47.435 1.00 18.90 N ATOM 1673 CA ASP A 87 16.200 69.898 46.861 1.00 17.80 C ATOM 1674 C ASP A 87 16.061 68.687 45.937 1.00 16.86 C ATOM 1675 O ASP A 87 15.875 67.569 46.409 1.00 16.46 O ATOM 1676 CB ASP A 87 17.184 69.618 48.003 1.00 19.22 C ATOM 1677 CG ASP A 87 18.543 69.162 47.522 1.00 20.20 C ATOM 1678 OD1 ASP A 87 18.789 69.162 46.296 1.00 19.97 O ATOM 1679 OD2 ASP A 87 19.371 68.804 48.388 1.00 20.43 O ATOM 1680 N ILE A 88 16.151 68.907 44.625 1.00 15.93 N ATOM 1681 CA ILE A 88 15.985 67.815 43.662 1.00 14.87 C ATOM 1682 C ILE A 88 17.210 66.931 43.470 1.00 13.86 C ATOM 1683 O ILE A 88 17.247 66.113 42.552 1.00 13.07 O ATOM 1684 CB ILE A 88 15.576 68.345 42.273 1.00 15.22 C ATOM 1685 CG1 ILE A 88 16.730 69.139 41.656 1.00 15.59 C ATOM 1686 CG2 ILE A 88 14.337 69.224 42.394 1.00 16.14 C ATOM 1687 CD1 ILE A 88 16.511 69.492 40.200 1.00 17.72 C ATOM 1688 N THR A 89 18.203 67.082 44.337 1.00 12.68 N ATOM 1689 CA THR A 89 19.425 66.294 44.228 1.00 12.04 C ATOM 1690 C THR A 89 19.188 64.787 44.176 1.00 12.08 C ATOM 1691 O THR A 89 19.708 64.106 43.294 1.00 12.68 O ATOM 1692 CB THR A 89 20.392 66.602 45.391 1.00 12.41 C ATOM 1693 OG1 THR A 89 20.798 67.974 45.318 1.00 13.88 O ATOM 1694 CG2 THR A 89 21.625 65.719 45.307 1.00 13.73 C ATOM 1695 N ALA A 90 18.411 64.270 45.122 1.00 10.45 N ATOM 1696 CA ALA A 90 18.120 62.843 45.183 1.00 10.68 C ATOM 1697 C ALA A 90 17.401 62.374 43.926 1.00 10.02 C ATOM 1698 O ALA A 90 17.743 61.336 43.364 1.00 10.47 O ATOM 1699 CB ALA A 90 17.267 62.532 46.418 1.00 11.14 C ATOM 1700 N SER A 91 16.399 63.139 43.496 1.00 10.14 N ATOM 1701 CA SER A 91 15.629 62.787 42.302 1.00 9.79 C ATOM 1702 C SER A 91 16.501 62.719 41.054 1.00 9.16 C ATOM 1703 O SER A 91 16.405 61.768 40.275 1.00 8.61 O ATOM 1704 CB SER A 91 14.494 63.792 42.074 1.00 9.31 C ATOM 1705 OG SER A 91 13.462 63.630 43.029 1.00 10.41 O ATOM 1706 N VAL A 92 17.350 63.724 40.861 1.00 8.83 N ATOM 1707 CA VAL A 92 18.221 63.742 39.694 1.00 9.61 C ATOM 1708 C VAL A 92 19.223 62.591 39.715 1.00 9.77 C ATOM 1709 O VAL A 92 19.409 61.910 38.709 1.00 9.64 O ATOM 1710 CB VAL A 92 18.981 65.090 39.576 1.00 10.66 C ATOM 1711 CG1 VAL A 92 20.028 65.006 38.479 1.00 12.05 C ATOM 1712 CG2 VAL A 92 17.995 66.212 39.267 1.00 11.48 C ATOM 1713 N ASN A 93 19.861 62.360 40.858 1.00 10.06 N ATOM 1714 CA ASN A 93 20.839 61.279 40.950 1.00 10.67 C ATOM 1715 C ASN A 93 20.218 59.920 40.654 1.00 10.15 C ATOM 1716 O ASN A 93 20.812 59.089 39.967 1.00 9.62 O ATOM 1717 CB ASN A 93 21.493 61.252 42.336 1.00 13.35 C ATOM 1718 CG ASN A 93 22.407 62.435 42.568 1.00 16.41 C ATOM 1719 OD1 ASN A 93 22.889 63.050 41.617 1.00 17.14 O ATOM 1720 ND2 ASN A 93 22.662 62.753 43.838 1.00 18.05 N ATOM 1721 N CYS A 94 19.013 59.707 41.169 1.00 8.34 N ATOM 1722 CA CYS A 94 18.302 58.455 40.971 1.00 7.46 C ATOM 1723 C CYS A 94 17.843 58.315 39.513 1.00 7.45 C ATOM 1724 O CYS A 94 17.945 57.240 38.915 1.00 7.96 O ATOM 1725 CB CYS A 94 17.108 58.379 41.915 1.00 6.92 C ATOM 1726 SG CYS A 94 16.420 56.666 42.030 1.00 7.41 S ATOM 1727 N ALA A 95 17.349 59.410 38.943 1.00 6.86 N ATOM 1728 CA ALA A 95 16.892 59.401 37.561 1.00 6.85 C ATOM 1729 C ALA A 95 18.044 59.008 36.637 1.00 7.67 C ATOM 1730 O ALA A 95 17.836 58.336 35.626 1.00 6.10 O ATOM 1731 CB ALA A 95 16.342 60.770 37.177 1.00 6.79 C ATOM 1732 N LYS A 96 19.264 59.418 36.984 1.00 7.47 N ATOM 1733 CA LYS A 96 20.419 59.068 36.162 1.00 8.52 C ATOM 1734 C LYS A 96 20.633 57.549 36.161 1.00 9.36 C ATOM 1735 O LYS A 96 21.047 56.973 35.151 1.00 10.01 O ATOM 1736 CB LYS A 96 21.680 59.766 36.674 1.00 8.81 C ATOM 1737 CG LYS A 96 21.706 61.273 36.448 1.00 11.27 C ATOM 1738 CD LYS A 96 22.983 61.888 37.011 1.00 13.25 C ATOM 1739 CE LYS A 96 23.050 63.378 36.722 1.00 16.35 C ATOM 1740 NZ LYS A 96 24.262 64.010 37.332 1.00 17.22 N ATOM 1741 N LYS A 97 20.358 56.902 37.292 1.00 9.03 N ATOM 1742 CA LYS A 97 20.526 55.454 37.373 1.00 9.85 C ATOM 1743 C LYS A 97 19.427 54.759 36.577 1.00 9.85 C ATOM 1744 O LYS A 97 19.686 53.804 35.843 1.00 9.52 O ATOM 1745 CB LYS A 97 20.502 54.974 38.831 1.00 12.52 C ATOM 1746 CG LYS A 97 21.764 55.321 39.629 1.00 15.90 C ATOM 1747 CD LYS A 97 21.791 54.599 40.976 1.00 20.00 C ATOM 1748 CE LYS A 97 23.121 54.797 41.707 1.00 22.39 C ATOM 1749 NZ LYS A 97 23.359 56.208 42.126 1.00 23.62 N ATOM 1750 N ILE A 98 18.203 55.252 36.717 1.00 8.17 N ATOM 1751 CA ILE A 98 17.060 54.690 36.008 1.00 7.40 C ATOM 1752 C ILE A 98 17.219 54.788 34.484 1.00 7.45 C ATOM 1753 O ILE A 98 17.036 53.798 33.773 1.00 7.58 O ATOM 1754 CB ILE A 98 15.750 55.417 36.407 1.00 7.41 C ATOM 1755 CG1 ILE A 98 15.424 55.142 37.877 1.00 6.16 C ATOM 1756 CG2 ILE A 98 14.615 54.971 35.497 1.00 6.18 C ATOM 1757 CD1 ILE A 98 14.245 55.951 38.411 1.00 6.79 C ATOM 1758 N VAL A 99 17.565 55.973 33.985 1.00 7.30 N ATOM 1759 CA VAL A 99 17.713 56.174 32.542 1.00 8.27 C ATOM 1760 C VAL A 99 18.877 55.380 31.941 1.00 8.95 C ATOM 1761 O VAL A 99 18.952 55.207 30.724 1.00 8.53 O ATOM 1762 CB VAL A 99 17.868 57.690 32.200 1.00 8.40 C ATOM 1763 CG1 VAL A 99 19.265 58.180 32.554 1.00 7.04 C ATOM 1764 CG2 VAL A 99 17.556 57.934 30.728 1.00 8.08 C ATOM 1765 N SER A 100 19.771 54.889 32.796 1.00 9.65 N ATOM 1766 CA SER A 100 20.921 54.103 32.348 1.00 11.11 C ATOM 1767 C SER A 100 20.658 52.608 32.524 1.00 12.46 C ATOM 1768 O SER A 100 21.535 51.784 32.265 1.00 12.59 O ATOM 1769 CB SER A 100 22.169 54.473 33.158 1.00 10.70 C ATOM 1770 OG SER A 100 22.486 55.849 33.047 1.00 12.82 O ATOM 1771 N ASP A 101 19.448 52.266 32.959 1.00 12.66 N ATOM 1772 CA ASP A 101 19.085 50.877 33.223 1.00 13.53 C ATOM 1773 C ASP A 101 18.725 50.022 32.011 1.00 13.69 C ATOM 1774 O ASP A 101 18.476 48.824 32.156 1.00 15.81 O ATOM 1775 CB ASP A 101 17.940 50.836 34.244 1.00 13.10 C ATOM 1776 CG ASP A 101 17.765 49.467 34.871 1.00 14.85 C ATOM 1777 OD1 ASP A 101 18.777 48.873 35.291 1.00 13.79 O ATOM 1778 OD2 ASP A 101 16.611 48.993 34.956 1.00 16.93 O ATOM 1779 N GLY A 102 18.685 50.618 30.823 1.00 13.15 N ATOM 1780 CA GLY A 102 18.369 49.832 29.644 1.00 13.33 C ATOM 1781 C GLY A 102 17.140 50.206 28.836 1.00 13.85 C ATOM 1782 O GLY A 102 16.953 49.679 27.743 1.00 13.67 O ATOM 1783 N ASN A 103 16.296 51.096 29.351 1.00 13.06 N ATOM 1784 CA ASN A 103 15.103 51.484 28.607 1.00 12.81 C ATOM 1785 C ASN A 103 15.039 52.993 28.393 1.00 12.15 C ATOM 1786 O ASN A 103 13.988 53.534 28.044 1.00 11.51 O ATOM 1787 CB ASN A 103 13.841 50.995 29.332 1.00 13.54 C ATOM 1788 CG ASN A 103 12.616 50.989 28.432 1.00 14.00 C ATOM 1789 OD1 ASN A 103 12.707 50.674 27.248 1.00 14.13 O ATOM 1790 ND2 ASN A 103 11.460 51.319 28.996 1.00 15.77 N ATOM 1791 N GLY A 104 16.171 53.666 28.592 1.00 10.83 N ATOM 1792 CA GLY A 104 16.207 55.107 28.413 1.00 10.24 C ATOM 1793 C GLY A 104 15.084 55.770 29.188 1.00 8.95 C ATOM 1794 O GLY A 104 14.721 55.311 30.272 1.00 8.38 O ATOM 1795 N MET A 105 14.517 56.837 28.633 1.00 7.52 N ATOM 1796 CA MET A 105 13.434 57.541 29.312 1.00 7.01 C ATOM 1797 C MET A 105 12.052 56.920 29.154 1.00 7.64 C ATOM 1798 O MET A 105 11.063 57.486 29.619 1.00 6.12 O ATOM 1799 CB MET A 105 13.393 59.005 28.875 1.00 7.02 C ATOM 1800 CG MET A 105 14.483 59.841 29.507 1.00 8.27 C ATOM 1801 SD MET A 105 14.225 61.595 29.243 1.00 7.50 S ATOM 1802 CE MET A 105 12.830 61.917 30.346 1.00 10.42 C ATOM 1803 N ASN A 106 11.981 55.761 28.506 1.00 6.88 N ATOM 1804 CA ASN A 106 10.704 55.072 28.341 1.00 8.65 C ATOM 1805 C ASN A 106 10.260 54.507 29.687 1.00 8.50 C ATOM 1806 O ASN A 106 9.153 53.976 29.824 1.00 9.79 O ATOM 1807 CB ASN A 106 10.834 53.956 27.306 1.00 9.32 C ATOM 1808 CG ASN A 106 10.949 54.495 25.896 1.00 11.88 C ATOM 1809 OD1 ASN A 106 9.999 55.067 25.364 1.00 12.04 O ATOM 1810 ND2 ASN A 106 12.121 54.336 25.289 1.00 12.85 N ATOM 1811 N ALA A 107 11.130 54.635 30.684 1.00 7.76 N ATOM 1812 CA ALA A 107 10.820 54.163 32.029 1.00 7.50 C ATOM 1813 C ALA A 107 9.789 55.097 32.661 1.00 7.17 C ATOM 1814 O ALA A 107 9.124 54.740 33.632 1.00 7.17 O ATOM 1815 CB ALA A 107 12.076 54.126 32.876 1.00 7.77 C ATOM 1816 N TRP A 108 9.679 56.303 32.115 1.00 6.99 N ATOM 1817 CA TRP A 108 8.708 57.277 32.604 1.00 7.56 C ATOM 1818 C TRP A 108 7.497 57.261 31.686 1.00 7.52 C ATOM 1819 O TRP A 108 7.551 57.745 30.561 1.00 7.74 O ATOM 1820 CB TRP A 108 9.322 58.679 32.644 1.00 6.97 C ATOM 1821 CG TRP A 108 10.188 58.892 33.847 1.00 7.71 C ATOM 1822 CD1 TRP A 108 9.774 59.209 35.115 1.00 8.13 C ATOM 1823 CD2 TRP A 108 11.606 58.726 33.918 1.00 6.95 C ATOM 1824 NE1 TRP A 108 10.852 59.254 35.966 1.00 7.64 N ATOM 1825 CE2 TRP A 108 11.990 58.975 35.257 1.00 7.65 C ATOM 1826 CE3 TRP A 108 12.597 58.419 32.973 1.00 8.40 C ATOM 1827 CZ2 TRP A 108 13.322 58.887 35.684 1.00 7.38 C ATOM 1828 CZ3 TRP A 108 13.929 58.338 33.401 1.00 7.29 C ATOM 1829 CH2 TRP A 108 14.275 58.585 34.742 1.00 7.56 C ATOM 1830 N VAL A 109 6.403 56.692 32.176 1.00 8.58 N ATOM 1831 CA VAL A 109 5.175 56.598 31.392 1.00 9.43 C ATOM 1832 C VAL A 109 4.708 57.945 30.842 1.00 8.92 C ATOM 1833 O VAL A 109 4.267 58.027 29.695 1.00 8.34 O ATOM 1834 CB VAL A 109 4.035 55.979 32.234 1.00 10.26 C ATOM 1835 CG1 VAL A 109 3.759 56.849 33.448 1.00 13.55 C ATOM 1836 CG2 VAL A 109 2.788 55.831 31.395 1.00 10.87 C ATOM 1837 N ALA A 110 4.803 59.000 31.651 1.00 8.20 N ATOM 1838 CA ALA A 110 4.367 60.322 31.204 1.00 8.34 C ATOM 1839 C ALA A 110 5.209 60.816 30.032 1.00 7.94 C ATOM 1840 O ALA A 110 4.691 61.435 29.098 1.00 7.18 O ATOM 1841 CB ALA A 110 4.431 61.325 32.357 1.00 7.58 C ATOM 1842 N TRP A 111 6.506 60.534 30.079 1.00 7.71 N ATOM 1843 CA TRP A 111 7.397 60.958 29.010 1.00 8.52 C ATOM 1844 C TRP A 111 7.017 60.256 27.710 1.00 7.76 C ATOM 1845 O TRP A 111 6.901 60.887 26.662 1.00 7.38 O ATOM 1846 CB TRP A 111 8.848 60.630 29.356 1.00 8.83 C ATOM 1847 CG TRP A 111 9.793 61.071 28.295 1.00 9.11 C ATOM 1848 CD1 TRP A 111 10.261 62.335 28.086 1.00 9.08 C ATOM 1849 CD2 TRP A 111 10.325 60.264 27.243 1.00 8.85 C ATOM 1850 NE1 TRP A 111 11.052 62.367 26.962 1.00 8.29 N ATOM 1851 CE2 TRP A 111 11.107 61.111 26.424 1.00 9.43 C ATOM 1852 CE3 TRP A 111 10.215 58.909 26.907 1.00 10.06 C ATOM 1853 CZ2 TRP A 111 11.780 60.642 25.288 1.00 9.96 C ATOM 1854 CZ3 TRP A 111 10.886 58.444 25.778 1.00 9.94 C ATOM 1855 CH2 TRP A 111 11.657 59.313 24.982 1.00 10.03 C ATOM 1856 N ARG A 112 6.817 58.947 27.803 1.00 7.95 N ATOM 1857 CA ARG A 112 6.457 58.109 26.663 1.00 10.38 C ATOM 1858 C ARG A 112 5.117 58.497 26.027 1.00 9.45 C ATOM 1859 O ARG A 112 4.929 58.355 24.812 1.00 7.83 O ATOM 1860 CB ARG A 112 6.402 56.650 27.125 1.00 13.47 C ATOM 1861 CG ARG A 112 6.109 55.629 26.052 1.00 18.98 C ATOM 1862 CD ARG A 112 5.563 54.359 26.695 1.00 22.11 C ATOM 1863 NE ARG A 112 6.399 53.895 27.798 1.00 24.06 N ATOM 1864 CZ ARG A 112 6.031 52.970 28.681 1.00 25.94 C ATOM 1865 NH1 ARG A 112 4.834 52.405 28.596 1.00 26.46 N ATOM 1866 NH2 ARG A 112 6.863 52.603 29.646 1.00 25.04 N ATOM 1867 N ASN A 113 4.189 58.989 26.842 1.00 9.75 N ATOM 1868 CA ASN A 113 2.874 59.359 26.330 1.00 11.05 C ATOM 1869 C ASN A 113 2.690 60.813 25.924 1.00 11.80 C ATOM 1870 O ASN A 113 1.813 61.119 25.117 1.00 11.56 O ATOM 1871 CB ASN A 113 1.784 59.012 27.344 1.00 11.94 C ATOM 1872 CG ASN A 113 1.711 57.534 27.645 1.00 13.64 C ATOM 1873 OD1 ASN A 113 2.018 56.699 26.796 1.00 15.45 O ATOM 1874 ND2 ASN A 113 1.279 57.201 28.855 1.00 15.13 N ATOM 1875 N ARG A 114 3.510 61.710 26.462 1.00 12.49 N ATOM 1876 CA ARG A 114 3.340 63.126 26.151 1.00 13.29 C ATOM 1877 C ARG A 114 4.564 63.909 25.673 1.00 12.13 C ATOM 1878 O ARG A 114 4.427 65.045 25.223 1.00 13.71 O ATOM 1879 CB ARG A 114 2.738 63.819 27.375 1.00 17.07 C ATOM 1880 CG ARG A 114 1.373 63.265 27.779 1.00 22.90 C ATOM 1881 CD ARG A 114 0.978 63.732 29.166 1.00 28.00 C ATOM 1882 NE ARG A 114 -0.441 64.066 29.257 1.00 31.62 N ATOM 1883 CZ ARG A 114 -1.026 65.018 28.536 1.00 32.81 C ATOM 1884 NH1 ARG A 114 -0.319 65.729 27.666 1.00 33.82 N ATOM 1885 NH2 ARG A 114 -2.315 65.265 28.690 1.00 34.69 N ATOM 1886 N CYS A 115 5.750 63.315 25.745 1.00 10.15 N ATOM 1887 CA CYS A 115 6.968 64.020 25.340 1.00 9.59 C ATOM 1888 C CYS A 115 7.705 63.406 24.159 1.00 9.10 C ATOM 1889 O CYS A 115 8.196 64.109 23.275 1.00 8.70 O ATOM 1890 CB CYS A 115 7.927 64.082 26.528 1.00 8.94 C ATOM 1891 SG CYS A 115 7.180 64.786 28.029 1.00 9.36 S ATOM 1892 N LYS A 116 7.808 62.086 24.182 1.00 10.07 N ATOM 1893 CA LYS A 116 8.502 61.326 23.153 1.00 10.21 C ATOM 1894 C LYS A 116 8.060 61.726 21.749 1.00 10.61 C ATOM 1895 O LYS A 116 6.873 61.721 21.441 1.00 9.66 O ATOM 1896 CB LYS A 116 8.245 59.836 23.390 1.00 10.82 C ATOM 1897 CG LYS A 116 8.986 58.867 22.494 1.00 12.14 C ATOM 1898 CD LYS A 116 8.626 57.446 22.927 1.00 12.78 C ATOM 1899 CE LYS A 116 9.317 56.384 22.108 1.00 15.31 C ATOM 1900 NZ LYS A 116 8.916 55.025 22.583 1.00 14.41 N ATOM 1901 N GLY A 117 9.026 62.085 20.909 1.00 11.02 N ATOM 1902 CA GLY A 117 8.717 62.467 19.540 1.00 12.34 C ATOM 1903 C GLY A 117 8.192 63.873 19.323 1.00 12.79 C ATOM 1904 O GLY A 117 7.924 64.267 18.187 1.00 12.50 O ATOM 1905 N THR A 118 8.028 64.639 20.395 1.00 13.01 N ATOM 1906 CA THR A 118 7.533 66.001 20.250 1.00 13.95 C ATOM 1907 C THR A 118 8.721 66.955 20.210 1.00 14.98 C ATOM 1908 O THR A 118 9.878 66.533 20.299 1.00 13.86 O ATOM 1909 CB THR A 118 6.632 66.412 21.430 1.00 13.93 C ATOM 1910 OG1 THR A 118 7.429 66.532 22.613 1.00 13.55 O ATOM 1911 CG2 THR A 118 5.538 65.377 21.657 1.00 12.55 C ATOM 1912 N ASP A 119 8.430 68.243 20.077 1.00 15.81 N ATOM 1913 CA ASP A 119 9.476 69.255 20.048 1.00 17.91 C ATOM 1914 C ASP A 119 9.773 69.637 21.501 1.00 16.73 C ATOM 1915 O ASP A 119 9.340 70.684 21.980 1.00 16.38 O ATOM 1916 CB ASP A 119 8.987 70.465 19.244 1.00 20.27 C ATOM 1917 CG ASP A 119 10.032 71.552 19.129 1.00 23.07 C ATOM 1918 OD1 ASP A 119 11.231 71.225 19.008 1.00 24.53 O ATOM 1919 OD2 ASP A 119 9.647 72.738 19.146 1.00 26.14 O ATOM 1920 N VAL A 120 10.510 68.770 22.196 1.00 15.77 N ATOM 1921 CA VAL A 120 10.841 68.976 23.605 1.00 14.44 C ATOM 1922 C VAL A 120 11.673 70.216 23.901 1.00 14.61 C ATOM 1923 O VAL A 120 11.705 70.688 25.038 1.00 13.50 O ATOM 1924 CB VAL A 120 11.572 67.742 24.206 1.00 14.07 C ATOM 1925 CG1 VAL A 120 10.669 66.518 24.135 1.00 13.59 C ATOM 1926 CG2 VAL A 120 12.879 67.489 23.471 1.00 12.60 C ATOM 1927 N GLN A 121 12.350 70.748 22.891 1.00 14.99 N ATOM 1928 CA GLN A 121 13.159 71.942 23.104 1.00 16.11 C ATOM 1929 C GLN A 121 12.247 73.097 23.519 1.00 14.99 C ATOM 1930 O GLN A 121 12.703 74.097 24.072 1.00 14.04 O ATOM 1931 CB GLN A 121 13.932 72.295 21.830 1.00 19.66 C ATOM 1932 CG GLN A 121 14.847 73.497 21.972 1.00 26.12 C ATOM 1933 CD GLN A 121 15.824 73.633 20.811 1.00 29.28 C ATOM 1934 OE1 GLN A 121 15.423 73.748 19.651 1.00 31.49 O ATOM 1935 NE2 GLN A 121 17.115 73.618 21.123 1.00 31.65 N ATOM 1936 N ALA A 122 10.951 72.941 23.259 1.00 14.22 N ATOM 1937 CA ALA A 122 9.962 73.952 23.612 1.00 13.42 C ATOM 1938 C ALA A 122 9.890 74.153 25.124 1.00 13.03 C ATOM 1939 O ALA A 122 9.547 75.237 25.599 1.00 13.50 O ATOM 1940 CB ALA A 122 8.582 73.547 23.074 1.00 13.58 C ATOM 1941 N TRP A 123 10.215 73.113 25.886 1.00 11.97 N ATOM 1942 CA TRP A 123 10.155 73.220 27.338 1.00 11.84 C ATOM 1943 C TRP A 123 11.226 74.099 27.965 1.00 11.54 C ATOM 1944 O TRP A 123 11.129 74.443 29.142 1.00 11.69 O ATOM 1945 CB TRP A 123 10.147 71.828 27.976 1.00 11.23 C ATOM 1946 CG TRP A 123 8.884 71.120 27.653 1.00 12.63 C ATOM 1947 CD1 TRP A 123 8.669 70.256 26.620 1.00 13.58 C ATOM 1948 CD2 TRP A 123 7.609 71.336 28.268 1.00 13.88 C ATOM 1949 NE1 TRP A 123 7.335 69.923 26.552 1.00 14.63 N ATOM 1950 CE2 TRP A 123 6.666 70.564 27.559 1.00 13.95 C ATOM 1951 CE3 TRP A 123 7.178 72.092 29.367 1.00 14.84 C ATOM 1952 CZ2 TRP A 123 5.305 70.554 27.889 1.00 15.80 C ATOM 1953 CZ3 TRP A 123 5.823 72.079 29.698 1.00 15.24 C ATOM 1954 CH2 TRP A 123 4.908 71.304 28.967 1.00 15.41 C ATOM 1955 N ILE A 124 12.247 74.463 27.195 1.00 12.16 N ATOM 1956 CA ILE A 124 13.272 75.350 27.727 1.00 14.00 C ATOM 1957 C ILE A 124 13.299 76.650 26.927 1.00 13.96 C ATOM 1958 O ILE A 124 14.224 77.451 27.048 1.00 14.18 O ATOM 1959 CB ILE A 124 14.681 74.697 27.742 1.00 15.81 C ATOM 1960 CG1 ILE A 124 15.138 74.362 26.324 1.00 16.91 C ATOM 1961 CG2 ILE A 124 14.657 73.450 28.627 1.00 16.79 C ATOM 1962 CD1 ILE A 124 16.545 73.790 26.270 1.00 18.98 C ATOM 1963 N ARG A 125 12.266 76.854 26.114 1.00 14.50 N ATOM 1964 CA ARG A 125 12.146 78.071 25.320 1.00 15.31 C ATOM 1965 C ARG A 125 11.950 79.225 26.301 1.00 15.89 C ATOM 1966 O ARG A 125 11.193 79.104 27.262 1.00 13.86 O ATOM 1967 CB ARG A 125 10.939 77.978 24.386 1.00 15.72 C ATOM 1968 CG ARG A 125 10.604 79.271 23.658 1.00 17.06 C ATOM 1969 CD ARG A 125 9.379 79.093 22.777 1.00 17.96 C ATOM 1970 NE ARG A 125 8.180 78.820 23.561 1.00 18.31 N ATOM 1971 CZ ARG A 125 7.256 77.925 23.228 1.00 19.20 C ATOM 1972 NH1 ARG A 125 7.389 77.209 22.116 1.00 19.22 N ATOM 1973 NH2 ARG A 125 6.197 77.745 24.007 1.00 19.29 N ATOM 1974 N GLY A 126 12.634 80.340 26.068 1.00 16.78 N ATOM 1975 CA GLY A 126 12.487 81.467 26.974 1.00 18.62 C ATOM 1976 C GLY A 126 13.480 81.390 28.115 1.00 19.38 C ATOM 1977 O GLY A 126 13.779 82.397 28.757 1.00 20.40 O ATOM 1978 N CYS A 127 13.968 80.189 28.406 1.00 20.48 N ATOM 1979 CA CYS A 127 14.976 80.051 29.444 1.00 22.55 C ATOM 1980 C CYS A 127 16.212 80.429 28.650 1.00 26.29 C ATOM 1981 O CYS A 127 16.244 80.233 27.439 1.00 27.38 O ATOM 1982 CB CYS A 127 15.091 78.603 29.919 1.00 20.48 C ATOM 1983 SG CYS A 127 13.456 77.821 30.355 1.00 14.35 S ATOM 1984 N ARG A 128 17.222 80.980 29.297 1.00 30.58 N ATOM 1985 CA ARG A 128 18.435 81.331 28.567 1.00 34.76 C ATOM 1986 C ARG A 128 19.620 80.924 29.424 1.00 36.45 C ATOM 1987 O ARG A 128 20.414 81.760 29.852 1.00 37.04 O ATOM 1988 CB ARG A 128 18.470 82.835 28.259 1.00 36.62 C ATOM 1989 CG ARG A 128 17.303 83.337 27.398 1.00 39.31 C ATOM 1990 CD ARG A 128 17.258 82.665 26.024 1.00 42.16 C ATOM 1991 NE ARG A 128 18.273 83.171 25.101 1.00 44.60 N ATOM 1992 CZ ARG A 128 18.074 84.160 24.233 1.00 45.97 C ATOM 1993 NH1 ARG A 128 16.893 84.756 24.162 1.00 46.98 N ATOM 1994 NH2 ARG A 128 19.057 84.550 23.429 1.00 46.75 N ATOM 1995 N LEU A 129 19.722 79.620 29.670 1.00 38.69 N ATOM 1996 CA LEU A 129 20.786 79.060 30.493 1.00 40.67 C ATOM 1997 C LEU A 129 22.067 78.887 29.682 1.00 41.36 C ATOM 1998 O LEU A 129 22.873 77.999 30.036 1.00 41.87 O ATOM 1999 CB LEU A 129 20.352 77.699 31.053 1.00 41.52 C ATOM 2000 CG LEU A 129 18.864 77.473 31.347 1.00 42.50 C ATOM 2001 CD1 LEU A 129 18.114 77.280 30.039 1.00 43.54 C ATOM 2002 CD2 LEU A 129 18.685 76.238 32.214 1.00 43.04 C ATOM 2003 OXT LEU A 129 22.257 79.650 28.713 1.00 42.05 O TER 2004 LEU B 129 HETATM 2005 O HOH A 130 -3.256 -6.549 8.854 1.00 18.22 O HETATM 2006 O HOH A 131 -0.114 0.678 10.836 1.00 6.11 O HETATM 2007 O HOH A 132 0.487 4.868 12.624 1.00 17.98 O HETATM 2008 O HOH A 133 3.089 4.806 12.571 1.00 26.53 O HETATM 2009 O HOH A 134 4.534 3.068 13.946 1.00 15.44 O HETATM 2010 O HOH A 135 7.754 3.277 15.621 1.00 16.24 O HETATM 2011 O HOH A 136 -17.540 -2.910 14.844 1.00 31.49 O HETATM 2012 O HOH A 137 7.409 -3.196 13.958 1.00 30.96 O HETATM 2013 O HOH A 138 -3.659 12.268 14.540 1.00 12.08 O HETATM 2014 O HOH A 139 0.590 9.387 16.681 1.00 22.79 O HETATM 2015 O HOH A 140 -0.997 16.334 12.725 1.00 24.73 O HETATM 2016 O HOH A 141 -6.881 12.076 9.090 1.00 30.23 O HETATM 2017 O HOH A 142 -5.731 13.165 5.216 1.00 27.92 O HETATM 2018 O HOH A 143 -3.802 13.328 -0.562 1.00 27.42 O HETATM 2019 O HOH A 144 3.988 -11.891 -0.453 1.00 14.85 O HETATM 2020 O HOH A 145 1.029 -10.751 1.929 1.00 16.01 O HETATM 2021 O HOH A 146 -0.928 -11.778 3.809 1.00 28.14 O HETATM 2022 O HOH A 147 -0.998 -13.124 6.073 1.00 21.21 O HETATM 2023 O HOH A 148 -3.975 -9.601 8.135 1.00 33.77 O HETATM 2024 O HOH A 149 -5.361 -12.619 -1.832 1.00 34.80 O HETATM 2025 O HOH A 150 -7.244 -8.524 -7.899 1.00 17.37 O HETATM 2026 O HOH A 151 -0.408 -7.483 -6.382 1.00 23.28 O HETATM 2027 O HOH A 153 4.614 -1.544 -7.901 1.00 23.72 O HETATM 2028 O HOH A 154 5.290 5.284 -7.625 1.00 25.99 O HETATM 2029 O HOH A 159 8.728 13.247 6.101 1.00 20.98 O HETATM 2030 O HOH A 163 8.464 8.674 10.946 1.00 22.41 O HETATM 2031 O HOH A 164 10.698 3.956 16.968 1.00 30.96 O HETATM 2032 O HOH A 165 -9.912 3.350 10.509 1.00 28.40 O HETATM 2033 O HOH A 167 12.810 -6.223 -1.584 1.00 25.51 O HETATM 2034 O HOH A 168 -8.060 -0.803 -7.695 1.00 18.82 O HETATM 2035 O HOH A 169 -0.763 -0.023 -10.801 1.00 28.84 O HETATM 2036 O HOH A 170 -3.304 -1.246 -14.689 1.00 20.58 O HETATM 2037 O HOH A 172 -4.557 5.767 -7.754 1.00 24.04 O HETATM 2038 O HOH A 173 -7.545 5.604 -6.417 1.00 33.60 O HETATM 2039 O HOH A 174 5.171 6.651 20.248 1.00 28.09 O HETATM 2040 O HOH A 180 -8.958 -5.388 19.616 1.00 9.52 O HETATM 2041 O HOH A 189 -4.579 -10.304 23.054 1.00 8.75 O HETATM 2042 O HOH A 190 -3.810 -8.671 20.584 1.00 4.42 O HETATM 2043 O HOH A 191 -2.153 -10.985 20.522 1.00 29.00 O HETATM 2044 O HOH A 192 2.731 -14.792 18.660 1.00 15.28 O HETATM 2045 O HOH A 195 -9.531 -0.535 8.727 1.00 19.46 O HETATM 2046 O HOH A 196 -1.019 -2.175 22.576 1.00 25.79 O HETATM 2047 O HOH A 197 -0.149 -4.360 24.325 1.00 19.44 O HETATM 2048 O HOH A 200 -0.283 -10.851 21.195 1.00 35.32 O HETATM 2049 O HOH A 218 6.378 -12.721 6.405 1.00 27.86 O HETATM 2050 O HOH A 219 -3.176 14.996 5.139 1.00 29.53 O HETATM 2051 O HOH A 221 16.239 8.387 -5.356 1.00 36.75 O HETATM 2052 O HOH A 226 7.555 15.369 -8.719 1.00 44.41 O HETATM 2053 O HOH A 233 3.151 14.158 16.846 1.00 30.92 O HETATM 2054 O HOH A 234 11.071 -5.558 -8.303 1.00 46.06 O HETATM 2055 O HOH A 235 6.513 -15.556 0.003 1.00 45.72 O HETATM 2056 O HOH A 236 7.734 -12.079 -1.643 1.00 48.52 O HETATM 2057 O HOH A 245 -14.668 -4.801 21.191 1.00 34.43 O HETATM 2058 O HOH A 247 -9.389 1.082 20.142 1.00 36.68 O HETATM 2059 O HOH A 249 2.932 4.991 20.353 1.00 43.30 O HETATM 2060 O HOH A 251 -13.820 1.627 15.607 1.00 29.77 O HETATM 2061 O HOH A 258 -3.192 -14.377 -2.591 1.00 13.07 O HETATM 2062 O HOH A 259 12.761 3.455 -0.275 1.00 16.34 O HETATM 2063 O HOH A 260 16.215 10.252 -1.286 1.00 61.33 O HETATM 2064 O HOH A 261 12.280 12.426 5.277 1.00 40.39 O HETATM 2065 O HOH A 262 -8.287 8.567 10.432 1.00 36.76 O HETATM 2066 O HOH A 263 -10.027 6.159 13.732 1.00 27.48 O HETATM 2067 O HOH A 264 11.767 0.955 8.828 1.00 43.60 O HETATM 2068 O HOH A 265 15.235 0.368 5.444 1.00 49.37 O HETATM 2069 O HOH A 266 -10.696 -7.349 -5.127 1.00 59.59 O HETATM 2070 O HOH A 267 -0.723 -1.394 -8.156 1.00 26.50 O HETATM 2071 O HOH A 269 10.217 -8.945 5.769 1.00 42.99 O HETATM 2072 O HOH A 270 -15.319 -6.093 10.599 1.00 24.08 O HETATM 2073 O HOH A 271 -8.839 -10.509 11.968 1.00 24.47 O HETATM 2074 O HOH A 273 -3.595 -18.659 15.442 1.00 47.36 O HETATM 2075 O HOH A 274 7.901 -13.363 14.227 1.00 52.96 O HETATM 2076 O HOH A 275 -1.777 17.522 7.667 1.00 53.82 O HETATM 2077 O HOH A 279 -5.307 -15.573 14.931 1.00 39.34 O HETATM 2078 O HOH A 280 -10.160 10.695 9.050 1.00 26.87 O HETATM 2079 O HOH A 281 -8.033 9.534 15.528 1.00 30.37 O HETATM 2080 O HOH A 282 4.218 9.229 18.976 1.00 25.39 O HETATM 2081 O HOH A 283 -11.058 -13.321 19.976 1.00 51.04 O HETATM 2082 O HOH A 284 -6.297 -11.270 25.226 1.00 43.17 O HETATM 2083 O HOH A 285 10.180 17.726 -6.866 1.00 46.24 O HETATM 2084 O HOH A 286 -0.465 12.808 -12.108 1.00 31.45 O HETATM 2085 O HOH A 287 -3.419 -18.024 18.724 1.00 41.28 O HETATM 2086 O HOH A 288 2.877 -11.308 22.516 1.00 28.60 O HETATM 2087 O HOH A 291 -12.508 0.748 21.896 1.00 29.14 O HETATM 2088 O HOH A 293 -6.341 2.245 21.045 1.00 57.82 O HETATM 2089 O HOH A 294 -4.547 12.248 20.733 1.00 54.57 O HETATM 2090 O HOH A 296 -2.213 12.825 -5.698 1.00 37.96 O HETATM 2091 O HOH A 297 -4.613 11.010 -6.575 1.00 39.71 O HETATM 2092 O HOH A 298 -3.470 1.377 22.444 1.00 45.21 O HETATM 2093 O HOH A 300 0.147 12.640 17.043 1.00 25.41 O HETATM 2094 O HOH A 301 -1.351 -9.857 -7.148 1.00 42.00 O HETATM 2095 O HOH A 302 7.774 13.659 9.026 1.00 31.92 O HETATM 2096 O HOH A 303 6.720 11.645 12.139 1.00 32.29 O HETATM 2097 O HOH A 305 -8.155 -6.032 8.909 1.00 38.40 O HETATM 2098 O HOH A 306 -3.520 -13.225 22.740 1.00 36.73 O HETATM 2099 O HOH A 307 -3.058 -20.651 19.723 1.00 56.86 O HETATM 2100 O HOH A 310 -16.913 -11.837 12.582 1.00 36.68 O HETATM 2101 O HOH A 311 -16.839 -13.609 14.642 1.00 43.73 O HETATM 2102 O HOH A 312 -9.312 -11.378 -0.068 1.00 75.71 O HETATM 2103 O HOH A 313 -4.549 17.435 6.463 1.00 45.06 O HETATM 2104 O HOH A 314 12.792 10.674 1.597 1.00 57.34 O HETATM 2105 O HOH A 320 -1.209 -12.140 -3.991 1.00 42.43 O HETATM 2106 O HOH A 321 2.026 16.726 9.634 1.00 37.38 O HETATM 2107 O HOH A 330 -6.326 6.131 18.933 1.00 46.40 O HETATM 2108 O HOH A 331 -3.517 6.474 21.443 1.00 52.30 O HETATM 2109 O HOH A 333 0.536 -13.546 21.015 1.00 38.92 O HETATM 2110 O HOH A 337 -9.658 2.030 -8.299 1.00 43.99 O HETATM 2111 O HOH A 338 6.906 -0.950 -8.841 1.00 35.79 O HETATM 2112 O HOH A 339 -10.888 -0.948 19.231 1.00 35.86 O HETATM 2113 O HOH A 340 -11.740 -6.238 21.382 1.00 48.87 O HETATM 2114 O HOH A 342 10.774 7.961 11.467 1.00 44.36 O HETATM 2115 O HOH A 343 -14.100 -8.959 11.151 1.00 38.04 O HETATM 2116 O HOH A 345 -9.018 -10.378 3.317 1.00 58.46 O HETATM 2117 O HOH A 346 14.422 -2.667 4.105 1.00 31.74 O HETATM 2118 O HOH A 347 -11.189 -4.780 6.197 1.00 52.95 O HETATM 2119 O HOH A 348 -4.092 7.558 -10.043 1.00 43.51 O HETATM 2120 O HOH A 351 -3.518 7.684 19.015 1.00 65.39 O HETATM 2121 O HOH A 352 -11.060 12.798 2.098 1.00 40.54 O HETATM 2122 O HOH A 353 -8.830 10.815 -2.490 1.00 74.27 O HETATM 2123 O HOH A 361 -8.131 14.713 2.898 1.00 56.83 O HETATM 2124 O HOH A 362 8.825 16.369 5.985 1.00 64.81 O HETATM 2125 O HOH A 363 -9.041 9.623 -4.789 1.00 46.18 O HETATM 2126 O HOH A 364 5.012 11.406 -9.639 1.00 53.35 O HETATM 2127 O HOH A 365 -9.604 7.673 3.146 1.00 27.61 O HETATM 2128 O HOH A 371 -17.002 -10.397 9.121 1.00 63.08 O HETATM 2129 O HOH A 372 -9.018 -2.105 6.048 1.00 49.77 O HETATM 2130 O HOH A 373 3.607 -10.672 -4.527 1.00 48.80 O HETATM 2131 O HOH A 377 5.398 -12.962 20.090 1.00 29.17 O HETATM 2132 O HOH A 379 10.420 -6.383 8.811 1.00 29.48 O HETATM 2133 O HOH A 380 -10.481 -9.090 5.364 1.00 51.39 O HETATM 2134 O HOH A 385 -2.539 -14.150 26.036 1.00 46.07 O HETATM 2135 O HOH A 386 -11.824 -0.572 0.836 1.00 28.30 O HETATM 2136 O HOH A 387 -10.970 -1.256 3.969 1.00 32.89 O HETATM 2137 O HOH A 388 -10.005 1.877 7.611 1.00 26.83 O HETATM 2138 O HOH A 389 -11.884 4.986 12.796 1.00 27.16 O HETATM 2139 O HOH A 390 -9.670 8.362 12.535 1.00 29.44 O HETATM 2140 O HOH A 391 -12.724 -7.344 8.605 1.00 32.11 O HETATM 2141 O HOH A 392 -10.541 -9.463 10.397 1.00 30.77 O HETATM 2142 O HOH A 393 13.037 -10.263 21.600 1.00 28.63 O HETATM 2143 O HOH A 398 -2.068 -10.682 25.144 1.00 28.97 O HETATM 2144 O HOH A 399 -7.259 -4.738 5.133 1.00 28.65 O HETATM 2145 O HOH A 400 -11.426 1.799 -0.088 1.00 27.81 O HETATM 2146 O HOH A 418 6.220 -10.842 21.536 1.00 29.81 O HETATM 2147 O HOH B 152 0.800 57.596 52.797 1.00 44.13 O HETATM 2148 O HOH B 155 10.802 65.957 44.233 1.00 20.43 O HETATM 2149 O HOH B 156 17.140 65.609 47.477 1.00 23.44 O HETATM 2150 O HOH B 157 19.433 59.289 44.727 1.00 32.83 O HETATM 2151 O HOH B 158 21.443 57.560 43.509 1.00 33.30 O HETATM 2152 O HOH B 160 10.711 49.796 50.151 1.00 19.35 O HETATM 2153 O HOH B 161 4.692 52.239 48.986 1.00 14.90 O HETATM 2154 O HOH B 162 10.796 57.102 52.880 1.00 21.02 O HETATM 2155 O HOH B 166 11.441 69.981 51.804 1.00 45.92 O HETATM 2156 O HOH B 171 -2.416 58.332 45.291 1.00 32.16 O HETATM 2157 O HOH B 175 11.454 63.372 22.833 1.00 30.93 O HETATM 2158 O HOH B 176 12.043 61.367 21.240 1.00 28.13 O HETATM 2159 O HOH B 177 16.041 70.506 24.825 1.00 6.88 O HETATM 2160 O HOH B 178 17.566 64.667 23.069 1.00 15.19 O HETATM 2161 O HOH B 179 19.890 62.323 21.303 1.00 27.17 O HETATM 2162 O HOH B 181 14.237 51.797 24.960 1.00 23.59 O HETATM 2163 O HOH B 182 8.957 50.148 28.095 1.00 18.58 O HETATM 2164 O HOH B 183 14.880 48.136 26.529 1.00 20.14 O HETATM 2165 O HOH B 184 10.763 79.773 36.801 1.00 16.92 O HETATM 2166 O HOH B 185 15.647 52.723 31.744 1.00 16.67 O HETATM 2167 O HOH B 186 19.343 46.576 33.375 1.00 51.35 O HETATM 2168 O HOH B 187 18.625 52.799 26.644 1.00 43.79 O HETATM 2169 O HOH B 188 18.970 53.031 29.170 1.00 21.57 O HETATM 2170 O HOH B 193 4.829 75.682 37.516 1.00 21.07 O HETATM 2171 O HOH B 194 5.782 77.044 34.902 1.00 25.44 O HETATM 2172 O HOH B 198 3.216 56.166 23.804 1.00 21.49 O HETATM 2173 O HOH B 199 5.689 54.965 22.264 1.00 9.59 O HETATM 2174 O HOH B 201 25.857 60.438 29.069 1.00 17.06 O HETATM 2175 O HOH B 202 25.503 59.283 26.370 1.00 45.94 O HETATM 2176 O HOH B 203 1.182 59.000 33.677 1.00 46.88 O HETATM 2177 O HOH B 204 3.158 58.401 36.099 1.00 32.38 O HETATM 2178 O HOH B 205 2.722 58.505 38.887 1.00 19.44 O HETATM 2179 O HOH B 206 6.243 56.220 35.094 1.00 22.82 O HETATM 2180 O HOH B 207 10.332 54.474 38.524 1.00 12.92 O HETATM 2181 O HOH B 208 10.368 55.804 36.011 1.00 35.13 O HETATM 2182 O HOH B 209 10.525 50.886 37.523 1.00 7.14 O HETATM 2183 O HOH B 210 6.001 48.602 40.478 1.00 28.33 O HETATM 2184 O HOH B 211 4.939 45.929 44.560 1.00 34.64 O HETATM 2185 O HOH B 212 4.570 75.152 32.302 1.00 21.30 O HETATM 2186 O HOH B 213 26.182 72.840 34.379 1.00 51.72 O HETATM 2187 O HOH B 214 23.409 69.505 32.370 1.00 15.15 O HETATM 2188 O HOH B 215 26.588 69.230 32.717 1.00 39.63 O HETATM 2189 O HOH B 216 17.288 71.708 43.915 1.00 36.57 O HETATM 2190 O HOH B 217 16.610 77.021 39.686 1.00 20.80 O HETATM 2191 O HOH B 220 5.333 45.664 52.752 1.00 32.95 O HETATM 2192 O HOH B 222 22.956 57.075 47.168 1.00 48.07 O HETATM 2193 O HOH B 223 14.755 64.833 45.333 1.00 16.71 O HETATM 2194 O HOH B 224 11.254 62.215 41.882 1.00 9.54 O HETATM 2195 O HOH B 225 5.625 68.322 53.935 1.00 34.73 O HETATM 2196 O HOH B 227 15.097 50.382 33.500 1.00 38.35 O HETATM 2197 O HOH B 228 26.891 66.283 37.067 1.00 34.19 O HETATM 2198 O HOH B 229 0.591 59.411 31.111 1.00 23.00 O HETATM 2199 O HOH B 230 1.334 61.272 36.313 1.00 40.79 O HETATM 2200 O HOH B 231 -2.305 51.222 40.796 1.00 34.68 O HETATM 2201 O HOH B 232 23.194 51.373 46.916 1.00 34.45 O HETATM 2202 O HOH B 237 5.828 54.343 53.942 1.00 48.16 O HETATM 2203 O HOH B 238 2.239 49.366 50.776 1.00 27.43 O HETATM 2204 O HOH B 239 8.034 45.507 53.217 1.00 32.70 O HETATM 2205 O HOH B 240 -0.992 59.813 38.681 1.00 36.77 O HETATM 2206 O HOH B 241 0.216 62.662 32.662 1.00 41.98 O HETATM 2207 O HOH B 242 26.195 64.944 32.914 1.00 39.20 O HETATM 2208 O HOH B 243 -1.728 54.287 39.183 1.00 41.14 O HETATM 2209 O HOH B 244 12.337 55.243 22.021 1.00 23.00 O HETATM 2210 O HOH B 246 11.688 64.145 20.270 1.00 32.83 O HETATM 2211 O HOH B 248 6.557 68.583 24.061 1.00 25.70 O HETATM 2212 O HOH B 250 10.168 63.205 16.213 1.00 31.85 O HETATM 2213 O HOH B 252 5.413 77.498 31.211 1.00 33.40 O HETATM 2214 O HOH B 253 10.979 50.412 25.054 1.00 31.99 O HETATM 2215 O HOH B 254 14.269 56.804 23.643 1.00 13.92 O HETATM 2216 O HOH B 255 25.898 69.380 28.194 1.00 37.17 O HETATM 2217 O HOH B 256 1.815 66.161 24.470 1.00 36.53 O HETATM 2218 O HOH B 257 10.257 50.434 40.806 1.00 19.93 O HETATM 2219 O HOH B 268 22.380 58.063 49.720 1.00 41.96 O HETATM 2220 O HOH B 272 9.103 78.310 42.453 1.00 30.17 O HETATM 2221 O HOH B 276 3.903 64.271 49.819 1.00 24.04 O HETATM 2222 O HOH B 277 9.085 69.410 49.170 1.00 27.09 O HETATM 2223 O HOH B 278 4.897 71.619 46.787 1.00 25.71 O HETATM 2224 O HOH B 289 18.578 73.790 46.412 1.00 45.64 O HETATM 2225 O HOH B 290 13.084 66.884 44.665 1.00 30.05 O HETATM 2226 O HOH B 292 9.705 42.684 51.287 1.00 35.22 O HETATM 2227 O HOH B 295 18.593 77.614 27.111 1.00 36.22 O HETATM 2228 O HOH B 299 6.184 76.235 46.231 1.00 30.62 O HETATM 2229 O HOH B 304 17.868 50.020 51.941 1.00 49.97 O HETATM 2230 O HOH B 308 16.570 72.822 50.178 1.00 41.47 O HETATM 2231 O HOH B 309 5.926 70.712 22.458 1.00 32.93 O HETATM 2232 O HOH B 315 24.781 64.429 46.844 1.00 39.03 O HETATM 2233 O HOH B 316 23.470 58.561 39.924 1.00 29.62 O HETATM 2234 O HOH B 317 0.879 63.080 39.643 1.00 54.47 O HETATM 2235 O HOH B 318 19.713 71.099 44.658 1.00 43.83 O HETATM 2236 O HOH B 319 -1.925 60.611 41.489 1.00 51.09 O HETATM 2237 O HOH B 322 20.519 49.392 48.687 1.00 31.21 O HETATM 2238 O HOH B 323 24.725 57.106 51.959 1.00 50.03 O HETATM 2239 O HOH B 324 1.260 52.211 47.993 1.00 72.53 O HETATM 2240 O HOH B 325 10.350 80.353 39.610 1.00 56.43 O HETATM 2241 O HOH B 326 16.424 74.480 43.457 1.00 73.79 O HETATM 2242 O HOH B 327 27.044 74.161 31.967 1.00 52.38 O HETATM 2243 O HOH B 328 0.581 71.264 27.974 1.00 66.21 O HETATM 2244 O HOH B 329 21.180 69.604 23.349 1.00 43.34 O HETATM 2245 O HOH B 332 2.776 73.998 37.547 1.00 34.51 O HETATM 2246 O HOH B 334 2.772 54.057 27.149 1.00 29.76 O HETATM 2247 O HOH B 335 0.949 67.417 41.608 1.00 32.29 O HETATM 2248 O HOH B 336 24.858 65.096 43.592 1.00 56.72 O HETATM 2249 O HOH B 341 25.607 57.152 31.580 1.00 37.65 O HETATM 2250 O HOH B 344 25.219 63.055 25.130 1.00 34.20 O HETATM 2251 O HOH B 349 3.234 74.700 34.594 1.00 64.24 O HETATM 2252 O HOH B 350 21.109 79.307 36.777 1.00 47.48 O HETATM 2253 O HOH B 354 14.600 51.448 56.883 1.00 52.34 O HETATM 2254 O HOH B 355 18.551 46.811 47.078 1.00 14.73 O HETATM 2255 O HOH B 356 9.132 44.015 43.546 1.00 43.52 O HETATM 2256 O HOH B 357 26.356 62.918 36.047 1.00 48.51 O HETATM 2257 O HOH B 358 16.454 78.416 25.804 1.00 42.52 O HETATM 2258 O HOH B 359 15.377 80.306 23.528 1.00 41.78 O HETATM 2259 O HOH B 360 1.251 49.481 38.383 1.00 43.77 O HETATM 2260 O HOH B 366 16.703 80.261 38.362 1.00 51.92 O HETATM 2261 O HOH B 367 -1.418 70.912 30.893 1.00 64.07 O HETATM 2262 O HOH B 368 24.622 57.129 37.616 1.00 37.08 O HETATM 2263 O HOH B 369 11.443 65.067 52.461 1.00 71.37 O HETATM 2264 O HOH B 370 4.445 68.096 25.272 1.00 33.76 O HETATM 2265 O HOH B 374 19.423 71.259 25.551 1.00 47.48 O HETATM 2266 O HOH B 375 9.588 67.081 52.447 1.00 44.06 O HETATM 2267 O HOH B 376 22.277 84.252 26.204 1.00 58.11 O HETATM 2268 O HOH B 378 -5.379 48.635 39.091 1.00 49.16 O HETATM 2269 O HOH B 381 11.466 44.741 43.871 1.00 27.76 O HETATM 2270 O HOH B 382 14.004 65.550 19.655 1.00 46.44 O HETATM 2271 O HOH B 383 17.457 79.140 41.433 1.00 43.37 O HETATM 2272 O HOH B 384 26.254 50.830 28.244 1.00 41.79 O HETATM 2273 O HOH B 394 8.768 52.118 23.815 1.00 25.33 O HETATM 2274 O HOH B 395 6.596 51.638 25.245 1.00 29.60 O HETATM 2275 O HOH B 396 3.976 53.088 24.572 1.00 31.15 O HETATM 2276 O HOH B 397 0.350 54.070 29.043 1.00 26.26 O HETATM 2277 O HOH B 401 18.116 78.417 43.810 1.00 30.09 O HETATM 2278 O HOH B 402 24.622 66.516 41.022 1.00 29.22 O HETATM 2279 O HOH B 403 24.494 67.962 43.709 1.00 29.15 O HETATM 2280 O HOH B 404 25.737 74.391 26.598 1.00 30.31 O HETATM 2281 O HOH B 405 19.075 69.870 21.550 1.00 29.64 O HETATM 2282 O HOH B 406 20.304 73.937 24.585 1.00 28.32 O HETATM 2283 O HOH B 407 20.014 74.335 27.920 1.00 31.64 O HETATM 2284 O HOH B 408 0.531 67.944 34.485 1.00 29.73 O HETATM 2285 O HOH B 409 -0.692 59.658 48.249 1.00 30.82 O HETATM 2286 O HOH B 410 -0.287 55.804 49.873 1.00 30.89 O HETATM 2287 O HOH B 411 3.511 46.579 38.408 1.00 30.78 O HETATM 2288 O HOH B 412 8.611 46.467 38.119 1.00 30.85 O HETATM 2289 O HOH B 413 12.568 48.633 54.393 1.00 28.28 O HETATM 2290 O HOH B 414 -3.290 50.810 50.186 1.00 31.00 O HETATM 2291 O HOH B 415 25.217 80.089 28.579 1.00 28.65 O HETATM 2292 O HOH B 416 21.886 52.116 36.103 1.00 24.64 O HETATM 2293 O HOH B 417 23.824 53.633 36.660 1.00 28.55 O HETATM 2294 O HOH B 419 13.607 74.055 18.138 1.00 28.55 O CONECT 48 981 CONECT 238 889 CONECT 513 630 CONECT 601 724 CONECT 630 513 CONECT 724 601 CONECT 889 238 CONECT 981 48 CONECT 1050 1983 CONECT 1240 1891 CONECT 1515 1632 CONECT 1603 1726 CONECT 1632 1515 CONECT 1726 1603 CONECT 1891 1240 CONECT 1983 1050 MASTER 274 0 0 14 6 0 0 6 2292 2 16 20 END