HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 31-OCT-05 2D59 TITLE HYPOTHETICAL PROTEIN FROM PYROCOCCUS HORIKOSHII OT3 COMPND MOL_ID: 1; COMPND 2 MOLECULE: HYPOTHETICAL PROTEIN PH1109; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII OT3; SOURCE 3 ORGANISM_TAXID: 70601; SOURCE 4 STRAIN: OT3; SOURCE 5 GENE: PH1109; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID KEYWDS COA BINDING, HYPOTHETICAL PROTEIN, STRUCTURAL GENOMICS, KEYWDS 2 NPPSFA, NATIONAL PROJECT ON PROTEIN STRUCTURAL AND KEYWDS 3 FUNCTIONAL ANALYSES, RIKEN STRUCTURAL GENOMICS/PROTEOMICS KEYWDS 4 INITIATIVE, RSGI, UNKNOWN FUNCTION EXPDTA X-RAY DIFFRACTION AUTHOR T.B.HIYAMA,S.SEKINE,S.YOKOYAMA,RIKEN STRUCTURAL AUTHOR 2 GENOMICS/PROTEOMICS INITIATIVE (RSGI) REVDAT 2 25-NOV-08 2D59 1 JRNL VERSN REVDAT 1 31-OCT-06 2D59 0 JRNL AUTH T.B.HIYAMA,M.ZHAO,Y.KITAGO,M.YAO,S.SEKINE,T.TERADA, JRNL AUTH 2 C.KUROISHI,Z.J.LIU,J.P.ROSE,S.KURAMITSU,M.SHIROUZU, JRNL AUTH 3 N.WATANABE,S.YOKOYAMA,I.TANAKA,B.C.WANG JRNL TITL STRUCTURAL BASIS OF COA RECOGNITION BY THE JRNL TITL 2 PYROCOCCUS SINGLE-DOMAIN COA-BINDING PROTEINS. JRNL REF J.STRUCT.FUNCT.GENOM. V. 7 119 2006 JRNL REFN ISSN 1345-711X JRNL PMID 17342453 JRNL DOI 10.1007/S10969-007-9015-6 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 1.65 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.1 REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- REMARK 3 : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES, PANNU, REMARK 3 : READ,RICE,SIMONSON,WARREN REMARK 3 REMARK 3 REFINEMENT TARGET : NULL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.65 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 40.33 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 915614.160 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 99.5 REMARK 3 NUMBER OF REFLECTIONS : 16264 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) : 0.212 REMARK 3 FREE R VALUE : 0.239 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.900 REMARK 3 FREE R VALUE TEST SET COUNT : 817 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.008 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) : 1.65 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.75 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 99.20 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 2584 REMARK 3 BIN R VALUE (WORKING SET) : 0.2610 REMARK 3 BIN FREE R VALUE : 0.2980 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 4.50 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 123 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.027 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1148 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 123 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 24.80 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 28.60 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 2.33000 REMARK 3 B22 (A**2) : 2.33000 REMARK 3 B33 (A**2) : -4.67000 REMARK 3 B12 (A**2) : 2.01000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.21 REMARK 3 ESD FROM SIGMAA (A) : 0.14 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) : 0.24 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.20 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.004 REMARK 3 BOND ANGLES (DEGREES) : 1.10 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 22.50 REMARK 3 IMPROPER ANGLES (DEGREES) : 0.68 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) : 2.310 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 3.110 ; 2.000 REMARK 3 SIDE-CHAIN BOND (A**2) : 4.030 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 5.620 ; 2.500 REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : FLAT MODEL REMARK 3 KSOL : 0.40 REMARK 3 BSOL : 54.44 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 3 : WATER_REP.PARAM REMARK 3 PARAMETER FILE 4 : NULL REMARK 3 TOPOLOGY FILE 1 : PROTEIN.TOP REMARK 3 TOPOLOGY FILE 3 : WATER.TOP REMARK 3 TOPOLOGY FILE 4 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 2D59 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 09-NOV-05. REMARK 100 THE RCSB ID CODE IS RCSB025002. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 25-JUL-05 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : SPRING-8 REMARK 200 BEAMLINE : BL41XU REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.0 REMARK 200 MONOCHROMATOR : SILICON REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 315 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 16631 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.650 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -3.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.2 REMARK 200 DATA REDUNDANCY : 4.900 REMARK 200 R MERGE (I) : 0.05700 REMARK 200 R SYM (I) : 0.05700 REMARK 200 FOR THE DATA SET : 40.8610 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.65 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.71 REMARK 200 COMPLETENESS FOR SHELL (%) : 96.5 REMARK 200 DATA REDUNDANCY IN SHELL : 5.90 REMARK 200 R MERGE FOR SHELL (I) : 0.61400 REMARK 200 R SYM FOR SHELL (I) : 0.61400 REMARK 200 FOR SHELL : 3.600 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: MOLREP REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 39.02 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.02 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 30% PEG 4000, 0.1M TRIS-HCL, 1M DI REMARK 280 -AMMONIUM HYDROGEN CITRATE, PH 7.5, VAPOR DIFFUSION, SITTING REMARK 280 DROP, TEMPERATURE 293K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 31 2 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+1/3 REMARK 290 3555 -X+Y,-X,Z+2/3 REMARK 290 4555 Y,X,-Z REMARK 290 5555 X-Y,-Y,-Z+2/3 REMARK 290 6555 -X,-X+Y,-Z+1/3 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 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 20.46300 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 40.92600 REMARK 290 SMTRY1 4 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 4 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 5 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 40.92600 REMARK 290 SMTRY1 6 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 20.46300 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC REMARK 350 SOFTWARE USED: PISA 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 375 REMARK 375 SPECIAL POSITION REMARK 375 THE FOLLOWING ATOMS ARE FOUND TO BE WITHIN 0.15 ANGSTROMS REMARK 375 OF A SYMMETRY RELATED ATOM AND ARE ASSUMED TO BE ON SPECIAL REMARK 375 POSITIONS. REMARK 375 REMARK 375 ATOM RES CSSEQI REMARK 375 HOH A1007 LIES ON A SPECIAL POSITION. REMARK 375 HOH A1073 LIES ON A SPECIAL POSITION. REMARK 375 HOH A1120 LIES ON A SPECIAL POSITION. REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 1 REMARK 465 GLU A 2 REMARK 465 GLU A 3 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. AN ATOM LOCATED WITHIN 0.15 REMARK 500 ANGSTROMS OF A SYMMETRY RELATED ATOM IS ASSUMED TO BE ON A REMARK 500 SPECIAL POSITION AND IS, THEREFORE, LISTED IN REMARK 375 REMARK 500 INSTEAD OF REMARK 500. ATOMS WITH NON-BLANK ALTERNATE REMARK 500 LOCATION INDICATORS ARE NOT INCLUDED IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 O HOH A 1080 O HOH A 1080 6765 1.24 REMARK 500 O HOH A 1110 O HOH A 1110 6766 1.73 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 ASN A 56 111.56 -176.05 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 A1088 DISTANCE = 5.04 ANGSTROMS REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 2D5A RELATED DB: PDB REMARK 900 PH1109 COMPLEXED WITH COENZYME A REMARK 900 RELATED ID: PHO001001109.1 RELATED DB: TARGETDB DBREF 2D59 A 1 144 UNP O58836 O58836_PYRHO 1 144 SEQRES 1 A 144 MET GLU GLU THR ARG PRO ILE ASP GLY LEU THR ASP GLU SEQRES 2 A 144 ASP ILE ARG GLU ILE LEU THR ARG TYR LYS LYS ILE ALA SEQRES 3 A 144 LEU VAL GLY ALA SER PRO LYS PRO GLU ARG ASP ALA ASN SEQRES 4 A 144 ILE VAL MET LYS TYR LEU LEU GLU HIS GLY TYR ASP VAL SEQRES 5 A 144 TYR PRO VAL ASN PRO LYS TYR GLU GLU VAL LEU GLY ARG SEQRES 6 A 144 LYS CYS TYR PRO SER VAL LEU ASP ILE PRO ASP LYS ILE SEQRES 7 A 144 GLU VAL VAL ASP LEU PHE VAL LYS PRO LYS LEU THR MET SEQRES 8 A 144 GLU TYR VAL GLU GLN ALA ILE LYS LYS GLY ALA LYS VAL SEQRES 9 A 144 VAL TRP PHE GLN TYR ASN THR TYR ASN ARG GLU ALA SER SEQRES 10 A 144 LYS LYS ALA ASP GLU ALA GLY LEU ILE ILE VAL ALA ASN SEQRES 11 A 144 ARG CYS MET MET ARG GLU HIS GLU ARG LEU LEU GLY GLU SEQRES 12 A 144 LYS FORMUL 2 HOH *123(H2 O) HELIX 1 1 THR A 11 TYR A 22 1 12 HELIX 2 2 ARG A 36 HIS A 48 1 13 HELIX 3 3 SER A 70 ILE A 74 5 5 HELIX 4 4 LYS A 86 GLY A 101 1 16 HELIX 5 5 ASN A 113 ALA A 123 1 11 HELIX 6 6 CYS A 132 GLY A 142 1 11 SHEET 1 A 5 ASP A 51 VAL A 55 0 SHEET 2 A 5 LYS A 24 VAL A 28 1 N ILE A 25 O TYR A 53 SHEET 3 A 5 VAL A 80 LEU A 83 1 O VAL A 80 N ALA A 26 SHEET 4 A 5 VAL A 104 PHE A 107 1 O TRP A 106 N VAL A 81 SHEET 5 A 5 ILE A 126 ALA A 129 1 O VAL A 128 N PHE A 107 SHEET 1 B 2 GLU A 61 VAL A 62 0 SHEET 2 B 2 ARG A 65 LYS A 66 -1 O ARG A 65 N VAL A 62 CRYST1 61.758 61.758 61.389 90.00 90.00 120.00 P 31 2 1 6 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 0.016192 0.009349 0.000000 0.00000 SCALE2 0.000000 0.018697 0.000000 0.00000 SCALE3 0.000000 0.000000 0.016290 0.00000 ATOM 1 N THR A 4 50.609 30.636 11.571 1.00 52.04 N ATOM 2 CA THR A 4 49.601 31.331 12.421 1.00 48.12 C ATOM 3 C THR A 4 49.915 32.818 12.551 1.00 42.98 C ATOM 4 O THR A 4 50.367 33.280 13.599 1.00 46.25 O ATOM 5 CB THR A 4 49.545 30.712 13.832 1.00 53.88 C ATOM 6 OG1 THR A 4 50.847 30.761 14.430 1.00 55.84 O ATOM 7 CG2 THR A 4 49.077 29.267 13.761 1.00 56.80 C ATOM 8 N ARG A 5 49.668 33.563 11.479 1.00 35.68 N ATOM 9 CA ARG A 5 49.928 34.998 11.460 1.00 32.56 C ATOM 10 C ARG A 5 48.798 35.782 12.122 1.00 29.04 C ATOM 11 O ARG A 5 47.622 35.472 11.932 1.00 31.30 O ATOM 12 CB ARG A 5 50.086 35.483 10.017 1.00 33.64 C ATOM 13 CG ARG A 5 51.172 34.777 9.222 1.00 36.06 C ATOM 14 CD ARG A 5 51.025 35.076 7.738 1.00 37.71 C ATOM 15 NE ARG A 5 52.054 34.426 6.930 1.00 41.96 N ATOM 16 CZ ARG A 5 53.341 34.755 6.950 1.00 44.73 C ATOM 17 NH1 ARG A 5 53.767 35.733 7.739 1.00 42.54 N ATOM 18 NH2 ARG A 5 54.202 34.106 6.179 1.00 43.25 N ATOM 19 N PRO A 6 49.143 36.812 12.912 1.00 26.45 N ATOM 20 CA PRO A 6 48.125 37.624 13.582 1.00 24.64 C ATOM 21 C PRO A 6 47.186 38.271 12.566 1.00 23.74 C ATOM 22 O PRO A 6 47.608 38.673 11.479 1.00 24.27 O ATOM 23 CB PRO A 6 48.953 38.664 14.333 1.00 23.65 C ATOM 24 CG PRO A 6 50.216 37.927 14.641 1.00 25.18 C ATOM 25 CD PRO A 6 50.495 37.206 13.345 1.00 26.73 C ATOM 26 N ILE A 7 45.914 38.366 12.928 1.00 19.40 N ATOM 27 CA ILE A 7 44.909 38.972 12.065 1.00 18.91 C ATOM 28 C ILE A 7 44.783 40.458 12.390 1.00 20.68 C ATOM 29 O ILE A 7 44.469 41.269 11.519 1.00 23.27 O ATOM 30 CB ILE A 7 43.550 38.260 12.249 1.00 22.66 C ATOM 31 CG1 ILE A 7 43.564 36.949 11.462 1.00 19.66 C ATOM 32 CG2 ILE A 7 42.403 39.151 11.809 1.00 23.69 C ATOM 33 CD1 ILE A 7 42.344 36.086 11.692 1.00 17.40 C ATOM 34 N ASP A 8 45.037 40.813 13.646 1.00 19.94 N ATOM 35 CA ASP A 8 44.968 42.211 14.057 1.00 21.19 C ATOM 36 C ASP A 8 46.244 42.919 13.607 1.00 24.25 C ATOM 37 O ASP A 8 47.211 42.269 13.206 1.00 27.18 O ATOM 38 CB ASP A 8 44.823 42.319 15.578 1.00 20.22 C ATOM 39 CG ASP A 8 46.020 41.764 16.315 1.00 23.14 C ATOM 40 OD1 ASP A 8 45.946 40.619 16.814 1.00 19.20 O ATOM 41 OD2 ASP A 8 47.046 42.471 16.388 1.00 23.11 O ATOM 42 N GLY A 9 46.247 44.247 13.675 1.00 26.77 N ATOM 43 CA GLY A 9 47.418 45.001 13.262 1.00 27.33 C ATOM 44 C GLY A 9 48.207 45.600 14.412 1.00 26.49 C ATOM 45 O GLY A 9 49.056 46.468 14.206 1.00 31.89 O ATOM 46 N LEU A 10 47.937 45.135 15.627 1.00 25.76 N ATOM 47 CA LEU A 10 48.628 45.638 16.808 1.00 21.50 C ATOM 48 C LEU A 10 50.102 45.220 16.826 1.00 19.87 C ATOM 49 O LEU A 10 50.489 44.222 16.215 1.00 24.99 O ATOM 50 CB LEU A 10 47.921 45.130 18.070 1.00 23.16 C ATOM 51 CG LEU A 10 46.410 45.380 18.140 1.00 25.60 C ATOM 52 CD1 LEU A 10 45.845 44.733 19.395 1.00 25.85 C ATOM 53 CD2 LEU A 10 46.122 46.881 18.139 1.00 27.68 C ATOM 54 N THR A 11 50.920 45.990 17.537 1.00 21.66 N ATOM 55 CA THR A 11 52.351 45.722 17.645 1.00 23.20 C ATOM 56 C THR A 11 52.643 44.872 18.875 1.00 21.89 C ATOM 57 O THR A 11 51.771 44.682 19.725 1.00 23.53 O ATOM 58 CB THR A 11 53.149 47.028 17.789 1.00 25.32 C ATOM 59 OG1 THR A 11 52.831 47.641 19.046 1.00 26.81 O ATOM 60 CG2 THR A 11 52.804 47.991 16.663 1.00 25.16 C ATOM 61 N ASP A 12 53.865 44.361 18.979 1.00 20.96 N ATOM 62 CA ASP A 12 54.220 43.558 20.140 1.00 21.40 C ATOM 63 C ASP A 12 54.064 44.403 21.399 1.00 23.70 C ATOM 64 O ASP A 12 53.734 43.889 22.465 1.00 22.25 O ATOM 65 CB ASP A 12 55.658 43.045 20.034 1.00 20.22 C ATOM 66 CG ASP A 12 55.786 41.869 19.087 1.00 23.33 C ATOM 67 OD1 ASP A 12 56.909 41.347 18.936 1.00 26.45 O ATOM 68 OD2 ASP A 12 54.762 41.467 18.497 1.00 24.70 O ATOM 69 N GLU A 13 54.293 45.706 21.263 1.00 25.87 N ATOM 70 CA GLU A 13 54.179 46.629 22.386 1.00 27.43 C ATOM 71 C GLU A 13 52.727 46.723 22.850 1.00 24.94 C ATOM 72 O GLU A 13 52.447 46.754 24.050 1.00 23.44 O ATOM 73 CB GLU A 13 54.674 48.020 21.975 1.00 28.73 C ATOM 74 CG GLU A 13 55.365 48.780 23.089 1.00 44.55 C ATOM 75 CD GLU A 13 56.767 48.262 23.357 1.00 51.96 C ATOM 76 OE1 GLU A 13 56.928 47.034 23.514 1.00 55.30 O ATOM 77 OE2 GLU A 13 57.709 49.081 23.414 1.00 51.65 O ATOM 78 N ASP A 14 51.808 46.778 21.890 1.00 21.83 N ATOM 79 CA ASP A 14 50.383 46.861 22.199 1.00 22.13 C ATOM 80 C ASP A 14 49.922 45.619 22.943 1.00 22.65 C ATOM 81 O ASP A 14 49.220 45.709 23.950 1.00 23.63 O ATOM 82 CB ASP A 14 49.547 46.991 20.923 1.00 23.62 C ATOM 83 CG ASP A 14 49.817 48.279 20.167 1.00 29.57 C ATOM 84 OD1 ASP A 14 49.946 49.339 20.813 1.00 27.54 O ATOM 85 OD2 ASP A 14 49.879 48.230 18.922 1.00 28.52 O ATOM 86 N ILE A 15 50.317 44.454 22.437 1.00 23.41 N ATOM 87 CA ILE A 15 49.919 43.191 23.055 1.00 22.97 C ATOM 88 C ILE A 15 50.487 43.090 24.456 1.00 22.44 C ATOM 89 O ILE A 15 49.796 42.682 25.393 1.00 22.16 O ATOM 90 CB ILE A 15 50.377 41.972 22.208 1.00 24.16 C ATOM 91 CG1 ILE A 15 49.555 41.917 20.921 1.00 27.53 C ATOM 92 CG2 ILE A 15 50.150 40.670 22.960 1.00 23.17 C ATOM 93 CD1 ILE A 15 49.534 43.190 20.149 1.00 39.46 C ATOM 94 N ARG A 16 51.751 43.464 24.599 1.00 20.02 N ATOM 95 CA ARG A 16 52.410 43.417 25.895 1.00 20.28 C ATOM 96 C ARG A 16 51.668 44.309 26.892 1.00 21.60 C ATOM 97 O ARG A 16 51.533 43.966 28.069 1.00 22.09 O ATOM 98 CB ARG A 16 53.864 43.876 25.755 1.00 22.60 C ATOM 99 CG ARG A 16 54.675 43.752 27.024 1.00 27.86 C ATOM 100 CD ARG A 16 56.126 44.166 26.810 1.00 29.79 C ATOM 101 NE ARG A 16 56.895 43.195 26.032 1.00 28.74 N ATOM 102 CZ ARG A 16 57.420 43.437 24.833 1.00 32.13 C ATOM 103 NH1 ARG A 16 58.109 42.493 24.203 1.00 26.94 N ATOM 104 NH2 ARG A 16 57.254 44.623 24.257 1.00 26.85 N ATOM 105 N GLU A 17 51.189 45.453 26.412 1.00 21.90 N ATOM 106 CA GLU A 17 50.446 46.397 27.248 1.00 24.42 C ATOM 107 C GLU A 17 49.103 45.793 27.665 1.00 24.80 C ATOM 108 O GLU A 17 48.687 45.908 28.817 1.00 19.46 O ATOM 109 CB GLU A 17 50.213 47.705 26.483 1.00 25.87 C ATOM 110 CG GLU A 17 49.260 48.673 27.166 1.00 27.45 C ATOM 111 CD GLU A 17 49.813 49.244 28.459 1.00 36.35 C ATOM 112 OE1 GLU A 17 49.087 50.016 29.120 1.00 41.34 O ATOM 113 OE2 GLU A 17 50.969 48.928 28.815 1.00 33.94 O ATOM 114 N ILE A 18 48.431 45.147 26.718 1.00 21.02 N ATOM 115 CA ILE A 18 47.146 44.514 26.990 1.00 22.34 C ATOM 116 C ILE A 18 47.296 43.441 28.060 1.00 22.38 C ATOM 117 O ILE A 18 46.464 43.325 28.962 1.00 21.11 O ATOM 118 CB ILE A 18 46.569 43.863 25.714 1.00 19.68 C ATOM 119 CG1 ILE A 18 46.128 44.955 24.740 1.00 27.03 C ATOM 120 CG2 ILE A 18 45.387 42.983 26.052 1.00 19.02 C ATOM 121 CD1 ILE A 18 45.051 45.868 25.300 1.00 36.35 C ATOM 122 N LEU A 19 48.354 42.645 27.944 1.00 18.86 N ATOM 123 CA LEU A 19 48.620 41.567 28.891 1.00 16.73 C ATOM 124 C LEU A 19 49.051 42.106 30.249 1.00 21.17 C ATOM 125 O LEU A 19 48.951 41.424 31.267 1.00 18.99 O ATOM 126 CB LEU A 19 49.721 40.649 28.340 1.00 17.18 C ATOM 127 CG LEU A 19 49.389 39.800 27.113 1.00 18.88 C ATOM 128 CD1 LEU A 19 50.655 39.127 26.596 1.00 19.38 C ATOM 129 CD2 LEU A 19 48.350 38.753 27.483 1.00 18.39 C ATOM 130 N THR A 20 49.531 43.342 30.263 1.00 18.64 N ATOM 131 CA THR A 20 49.997 43.942 31.499 1.00 20.96 C ATOM 132 C THR A 20 48.906 44.699 32.247 1.00 23.94 C ATOM 133 O THR A 20 48.776 44.570 33.464 1.00 23.59 O ATOM 134 CB THR A 20 51.174 44.898 31.222 1.00 23.39 C ATOM 135 OG1 THR A 20 52.249 44.164 30.621 1.00 24.64 O ATOM 136 CG2 THR A 20 51.664 45.533 32.511 1.00 23.76 C ATOM 137 N ARG A 21 48.112 45.471 31.517 1.00 24.30 N ATOM 138 CA ARG A 21 47.060 46.267 32.139 1.00 24.96 C ATOM 139 C ARG A 21 45.763 45.541 32.475 1.00 26.40 C ATOM 140 O ARG A 21 45.099 45.884 33.451 1.00 26.64 O ATOM 141 CB ARG A 21 46.757 47.481 31.264 1.00 35.12 C ATOM 142 CG ARG A 21 47.954 48.401 31.079 1.00 43.51 C ATOM 143 CD ARG A 21 48.480 48.914 32.417 1.00 52.15 C ATOM 144 NE ARG A 21 49.618 49.819 32.265 1.00 54.47 N ATOM 145 CZ ARG A 21 50.794 49.472 31.749 1.00 59.27 C ATOM 146 NH1 ARG A 21 50.998 48.231 31.329 1.00 62.54 N ATOM 147 NH2 ARG A 21 51.769 50.366 31.656 1.00 59.89 N ATOM 148 N TYR A 22 45.402 44.538 31.682 1.00 23.73 N ATOM 149 CA TYR A 22 44.167 43.803 31.928 1.00 22.00 C ATOM 150 C TYR A 22 44.423 42.420 32.522 1.00 26.06 C ATOM 151 O TYR A 22 44.994 41.543 31.871 1.00 25.25 O ATOM 152 CB TYR A 22 43.368 43.682 30.629 1.00 24.22 C ATOM 153 CG TYR A 22 43.050 45.020 29.998 1.00 30.55 C ATOM 154 CD1 TYR A 22 42.298 45.975 30.684 1.00 31.29 C ATOM 155 CD2 TYR A 22 43.509 45.337 28.719 1.00 26.64 C ATOM 156 CE1 TYR A 22 42.012 47.215 30.113 1.00 33.35 C ATOM 157 CE2 TYR A 22 43.228 46.574 28.139 1.00 34.56 C ATOM 158 CZ TYR A 22 42.481 47.506 28.841 1.00 36.05 C ATOM 159 OH TYR A 22 42.203 48.729 28.273 1.00 35.02 O ATOM 160 N LYS A 23 43.992 42.238 33.768 1.00 24.45 N ATOM 161 CA LYS A 23 44.165 40.973 34.471 1.00 24.16 C ATOM 162 C LYS A 23 42.845 40.230 34.663 1.00 22.44 C ATOM 163 O LYS A 23 42.846 39.083 35.100 1.00 22.15 O ATOM 164 CB LYS A 23 44.804 41.212 35.843 1.00 26.94 C ATOM 165 CG LYS A 23 46.158 41.898 35.790 1.00 29.08 C ATOM 166 CD LYS A 23 47.161 41.082 34.991 1.00 27.76 C ATOM 167 CE LYS A 23 48.516 41.771 34.945 1.00 29.76 C ATOM 168 NZ LYS A 23 49.509 41.007 34.135 1.00 27.37 N ATOM 169 N LYS A 24 41.731 40.886 34.345 1.00 18.83 N ATOM 170 CA LYS A 24 40.407 40.279 34.497 1.00 23.07 C ATOM 171 C LYS A 24 40.010 39.609 33.185 1.00 21.24 C ATOM 172 O LYS A 24 39.565 40.273 32.243 1.00 21.19 O ATOM 173 CB LYS A 24 39.375 41.351 34.864 1.00 22.85 C ATOM 174 CG LYS A 24 39.810 42.274 35.991 1.00 29.86 C ATOM 175 CD LYS A 24 39.935 41.546 37.317 1.00 35.66 C ATOM 176 CE LYS A 24 38.572 41.162 37.868 1.00 41.35 C ATOM 177 NZ LYS A 24 38.688 40.549 39.219 1.00 37.97 N ATOM 178 N ILE A 25 40.164 38.289 33.131 1.00 19.83 N ATOM 179 CA ILE A 25 39.860 37.533 31.922 1.00 18.44 C ATOM 180 C ILE A 25 38.657 36.606 32.007 1.00 21.21 C ATOM 181 O ILE A 25 38.532 35.817 32.942 1.00 20.25 O ATOM 182 CB ILE A 25 41.051 36.631 31.491 1.00 18.74 C ATOM 183 CG1 ILE A 25 42.371 37.380 31.625 1.00 25.06 C ATOM 184 CG2 ILE A 25 40.857 36.157 30.050 1.00 17.75 C ATOM 185 CD1 ILE A 25 42.929 37.312 33.010 1.00 34.76 C ATOM 186 N ALA A 26 37.779 36.711 31.016 1.00 21.12 N ATOM 187 CA ALA A 26 36.627 35.833 30.912 1.00 20.07 C ATOM 188 C ALA A 26 37.082 34.869 29.819 1.00 21.90 C ATOM 189 O ALA A 26 37.288 35.274 28.672 1.00 22.35 O ATOM 190 CB ALA A 26 35.397 36.610 30.466 1.00 23.23 C ATOM 191 N LEU A 27 37.264 33.602 30.171 1.00 18.02 N ATOM 192 CA LEU A 27 37.733 32.626 29.197 1.00 16.54 C ATOM 193 C LEU A 27 36.577 31.761 28.712 1.00 21.84 C ATOM 194 O LEU A 27 36.131 30.843 29.404 1.00 21.00 O ATOM 195 CB LEU A 27 38.845 31.776 29.823 1.00 18.99 C ATOM 196 CG LEU A 27 39.739 30.979 28.869 1.00 20.27 C ATOM 197 CD1 LEU A 27 41.180 30.974 29.384 1.00 19.94 C ATOM 198 CD2 LEU A 27 39.198 29.567 28.728 1.00 21.41 C ATOM 199 N VAL A 28 36.105 32.079 27.508 1.00 21.22 N ATOM 200 CA VAL A 28 34.982 31.391 26.879 1.00 20.37 C ATOM 201 C VAL A 28 35.401 30.100 26.192 1.00 23.31 C ATOM 202 O VAL A 28 36.362 30.071 25.420 1.00 22.38 O ATOM 203 CB VAL A 28 34.300 32.313 25.848 1.00 22.91 C ATOM 204 CG1 VAL A 28 33.083 31.628 25.256 1.00 25.08 C ATOM 205 CG2 VAL A 28 33.914 33.628 26.511 1.00 23.58 C ATOM 206 N GLY A 29 34.660 29.031 26.461 1.00 22.58 N ATOM 207 CA GLY A 29 34.990 27.748 25.877 1.00 18.16 C ATOM 208 C GLY A 29 35.856 26.953 26.833 1.00 18.72 C ATOM 209 O GLY A 29 36.488 25.973 26.439 1.00 24.23 O ATOM 210 N ALA A 30 35.881 27.381 28.093 1.00 19.31 N ATOM 211 CA ALA A 30 36.670 26.712 29.123 1.00 20.82 C ATOM 212 C ALA A 30 36.350 25.222 29.156 1.00 24.01 C ATOM 213 O ALA A 30 35.204 24.819 28.951 1.00 22.57 O ATOM 214 CB ALA A 30 36.395 27.339 30.483 1.00 20.25 C ATOM 215 N SER A 31 37.367 24.411 29.428 1.00 19.98 N ATOM 216 CA SER A 31 37.199 22.963 29.460 1.00 22.03 C ATOM 217 C SER A 31 38.078 22.304 30.517 1.00 22.09 C ATOM 218 O SER A 31 39.204 22.735 30.758 1.00 20.93 O ATOM 219 CB SER A 31 37.536 22.385 28.082 1.00 26.63 C ATOM 220 OG SER A 31 37.589 20.970 28.110 1.00 25.55 O ATOM 221 N PRO A 32 37.565 21.248 31.171 1.00 21.58 N ATOM 222 CA PRO A 32 38.323 20.534 32.201 1.00 18.86 C ATOM 223 C PRO A 32 39.316 19.552 31.572 1.00 18.32 C ATOM 224 O PRO A 32 40.150 18.968 32.262 1.00 21.57 O ATOM 225 CB PRO A 32 37.228 19.830 32.997 1.00 21.37 C ATOM 226 CG PRO A 32 36.244 19.473 31.924 1.00 19.94 C ATOM 227 CD PRO A 32 36.181 20.743 31.089 1.00 20.05 C ATOM 228 N LYS A 33 39.220 19.382 30.255 1.00 19.73 N ATOM 229 CA LYS A 33 40.095 18.473 29.521 1.00 23.05 C ATOM 230 C LYS A 33 41.491 19.068 29.363 1.00 25.14 C ATOM 231 O LYS A 33 41.679 20.050 28.645 1.00 25.08 O ATOM 232 CB LYS A 33 39.501 18.176 28.144 1.00 28.14 C ATOM 233 CG LYS A 33 38.122 17.537 28.192 1.00 32.54 C ATOM 234 CD LYS A 33 37.556 17.357 26.791 1.00 38.27 C ATOM 235 CE LYS A 33 36.156 16.771 26.826 1.00 38.81 C ATOM 236 NZ LYS A 33 35.573 16.669 25.457 1.00 45.11 N ATOM 237 N PRO A 34 42.492 18.464 30.020 1.00 23.92 N ATOM 238 CA PRO A 34 43.888 18.916 29.979 1.00 24.66 C ATOM 239 C PRO A 34 44.510 19.088 28.595 1.00 25.32 C ATOM 240 O PRO A 34 45.385 19.939 28.411 1.00 28.18 O ATOM 241 CB PRO A 34 44.619 17.850 30.792 1.00 25.27 C ATOM 242 CG PRO A 34 43.583 17.393 31.763 1.00 25.12 C ATOM 243 CD PRO A 34 42.360 17.280 30.889 1.00 21.88 C ATOM 244 N GLU A 35 44.069 18.291 27.626 1.00 23.14 N ATOM 245 CA GLU A 35 44.644 18.363 26.289 1.00 25.76 C ATOM 246 C GLU A 35 44.075 19.454 25.390 1.00 22.82 C ATOM 247 O GLU A 35 44.607 19.704 24.309 1.00 25.99 O ATOM 248 CB GLU A 35 44.526 17.000 25.589 1.00 27.35 C ATOM 249 CG GLU A 35 43.150 16.641 25.035 1.00 29.59 C ATOM 250 CD GLU A 35 42.058 16.599 26.086 1.00 33.54 C ATOM 251 OE1 GLU A 35 42.340 16.217 27.241 1.00 23.41 O ATOM 252 OE2 GLU A 35 40.903 16.934 25.749 1.00 44.09 O ATOM 253 N ARG A 36 43.003 20.105 25.832 1.00 23.44 N ATOM 254 CA ARG A 36 42.382 21.170 25.049 1.00 25.73 C ATOM 255 C ARG A 36 43.098 22.495 25.289 1.00 21.18 C ATOM 256 O ARG A 36 43.502 22.793 26.411 1.00 20.98 O ATOM 257 CB ARG A 36 40.904 21.302 25.424 1.00 29.25 C ATOM 258 CG ARG A 36 40.098 20.035 25.177 1.00 33.15 C ATOM 259 CD ARG A 36 39.565 19.955 23.757 1.00 44.02 C ATOM 260 NE ARG A 36 38.166 20.369 23.692 1.00 49.48 N ATOM 261 CZ ARG A 36 37.414 20.303 22.599 1.00 56.21 C ATOM 262 NH1 ARG A 36 36.149 20.700 22.636 1.00 62.26 N ATOM 263 NH2 ARG A 36 37.927 19.843 21.466 1.00 55.72 N ATOM 264 N ASP A 37 43.249 23.286 24.230 1.00 22.01 N ATOM 265 CA ASP A 37 43.922 24.579 24.334 1.00 20.71 C ATOM 266 C ASP A 37 43.314 25.477 25.411 1.00 19.52 C ATOM 267 O ASP A 37 44.037 26.153 26.141 1.00 18.44 O ATOM 268 CB ASP A 37 43.902 25.306 22.984 1.00 21.00 C ATOM 269 CG ASP A 37 44.681 24.568 21.913 1.00 29.39 C ATOM 270 OD1 ASP A 37 45.722 23.965 22.245 1.00 27.69 O ATOM 271 OD2 ASP A 37 44.262 24.601 20.738 1.00 36.17 O ATOM 272 N ALA A 38 41.990 25.482 25.519 1.00 18.76 N ATOM 273 CA ALA A 38 41.322 26.309 26.519 1.00 19.24 C ATOM 274 C ALA A 38 41.822 26.006 27.930 1.00 18.95 C ATOM 275 O ALA A 38 41.968 26.908 28.753 1.00 17.68 O ATOM 276 CB ALA A 38 39.815 26.104 26.448 1.00 19.39 C ATOM 277 N ASN A 39 42.080 24.733 28.208 1.00 16.21 N ATOM 278 CA ASN A 39 42.559 24.335 29.527 1.00 18.85 C ATOM 279 C ASN A 39 44.034 24.702 29.689 1.00 17.34 C ATOM 280 O ASN A 39 44.436 25.274 30.705 1.00 18.13 O ATOM 281 CB ASN A 39 42.354 22.827 29.730 1.00 20.11 C ATOM 282 CG ASN A 39 42.704 22.371 31.135 1.00 15.50 C ATOM 283 OD1 ASN A 39 43.871 22.160 31.467 1.00 17.23 O ATOM 284 ND2 ASN A 39 41.688 22.225 31.972 1.00 17.07 N ATOM 285 N ILE A 40 44.831 24.380 28.677 1.00 18.22 N ATOM 286 CA ILE A 40 46.257 24.681 28.694 1.00 16.20 C ATOM 287 C ILE A 40 46.504 26.170 28.961 1.00 18.51 C ATOM 288 O ILE A 40 47.296 26.535 29.837 1.00 17.98 O ATOM 289 CB ILE A 40 46.894 24.305 27.348 1.00 18.92 C ATOM 290 CG1 ILE A 40 46.769 22.794 27.130 1.00 22.15 C ATOM 291 CG2 ILE A 40 48.361 24.739 27.318 1.00 17.64 C ATOM 292 CD1 ILE A 40 47.167 22.342 25.746 1.00 23.41 C ATOM 293 N VAL A 41 45.818 27.022 28.207 1.00 17.37 N ATOM 294 CA VAL A 41 45.978 28.467 28.356 1.00 15.26 C ATOM 295 C VAL A 41 45.446 28.972 29.698 1.00 17.25 C ATOM 296 O VAL A 41 46.088 29.785 30.364 1.00 16.22 O ATOM 297 CB VAL A 41 45.276 29.220 27.203 1.00 17.16 C ATOM 298 CG1 VAL A 41 45.409 30.722 27.400 1.00 16.54 C ATOM 299 CG2 VAL A 41 45.891 28.810 25.868 1.00 18.58 C ATOM 300 N MET A 42 44.280 28.493 30.115 1.00 17.35 N ATOM 301 CA MET A 42 43.746 28.946 31.394 1.00 16.67 C ATOM 302 C MET A 42 44.691 28.584 32.535 1.00 17.44 C ATOM 303 O MET A 42 44.946 29.393 33.427 1.00 16.41 O ATOM 304 CB MET A 42 42.372 28.332 31.661 1.00 18.46 C ATOM 305 CG MET A 42 41.738 28.843 32.944 1.00 16.97 C ATOM 306 SD MET A 42 40.013 28.329 33.094 1.00 18.49 S ATOM 307 CE MET A 42 39.690 28.748 34.814 1.00 19.27 C ATOM 308 N LYS A 43 45.212 27.361 32.509 1.00 14.31 N ATOM 309 CA LYS A 43 46.120 26.915 33.556 1.00 17.35 C ATOM 310 C LYS A 43 47.324 27.853 33.630 1.00 18.58 C ATOM 311 O LYS A 43 47.739 28.264 34.712 1.00 18.93 O ATOM 312 CB LYS A 43 46.579 25.483 33.271 1.00 18.67 C ATOM 313 CG LYS A 43 47.478 24.888 34.343 1.00 30.40 C ATOM 314 CD LYS A 43 47.846 23.451 34.004 1.00 35.00 C ATOM 315 CE LYS A 43 48.796 22.858 35.029 1.00 35.15 C ATOM 316 NZ LYS A 43 49.168 21.460 34.676 1.00 45.46 N ATOM 317 N TYR A 44 47.865 28.194 32.466 1.00 18.08 N ATOM 318 CA TYR A 44 49.020 29.082 32.378 1.00 15.10 C ATOM 319 C TYR A 44 48.689 30.465 32.937 1.00 16.98 C ATOM 320 O TYR A 44 49.472 31.041 33.698 1.00 18.23 O ATOM 321 CB TYR A 44 49.473 29.190 30.916 1.00 16.07 C ATOM 322 CG TYR A 44 50.638 30.128 30.690 1.00 18.78 C ATOM 323 CD1 TYR A 44 50.436 31.499 30.540 1.00 15.65 C ATOM 324 CD2 TYR A 44 51.946 29.643 30.645 1.00 15.52 C ATOM 325 CE1 TYR A 44 51.511 32.369 30.351 1.00 17.94 C ATOM 326 CE2 TYR A 44 53.025 30.502 30.458 1.00 18.80 C ATOM 327 CZ TYR A 44 52.801 31.861 30.314 1.00 18.04 C ATOM 328 OH TYR A 44 53.871 32.714 30.148 1.00 21.32 O ATOM 329 N LEU A 45 47.528 30.995 32.563 1.00 17.57 N ATOM 330 CA LEU A 45 47.118 32.314 33.038 1.00 16.96 C ATOM 331 C LEU A 45 46.953 32.337 34.555 1.00 16.85 C ATOM 332 O LEU A 45 47.370 33.285 35.216 1.00 18.79 O ATOM 333 CB LEU A 45 45.815 32.746 32.358 1.00 17.44 C ATOM 334 CG LEU A 45 45.905 32.976 30.846 1.00 17.19 C ATOM 335 CD1 LEU A 45 44.524 33.251 30.282 1.00 20.00 C ATOM 336 CD2 LEU A 45 46.845 34.144 30.561 1.00 19.84 C ATOM 337 N LEU A 46 46.349 31.292 35.114 1.00 17.38 N ATOM 338 CA LEU A 46 46.168 31.236 36.555 1.00 14.32 C ATOM 339 C LEU A 46 47.529 31.214 37.238 1.00 15.75 C ATOM 340 O LEU A 46 47.730 31.866 38.261 1.00 16.95 O ATOM 341 CB LEU A 46 45.372 29.985 36.946 1.00 17.18 C ATOM 342 CG LEU A 46 43.885 29.997 36.592 1.00 16.99 C ATOM 343 CD1 LEU A 46 43.272 28.635 36.892 1.00 18.52 C ATOM 344 CD2 LEU A 46 43.177 31.083 37.386 1.00 19.11 C ATOM 345 N GLU A 47 48.461 30.463 36.659 1.00 17.06 N ATOM 346 CA GLU A 47 49.799 30.351 37.219 1.00 18.42 C ATOM 347 C GLU A 47 50.590 31.647 37.076 1.00 18.61 C ATOM 348 O GLU A 47 51.619 31.822 37.724 1.00 23.37 O ATOM 349 CB GLU A 47 50.552 29.193 36.556 1.00 23.26 C ATOM 350 CG GLU A 47 49.978 27.825 36.911 1.00 25.85 C ATOM 351 CD GLU A 47 50.544 26.700 36.068 1.00 31.47 C ATOM 352 OE1 GLU A 47 50.184 25.530 36.322 1.00 36.69 O ATOM 353 OE2 GLU A 47 51.343 26.980 35.150 1.00 40.48 O ATOM 354 N HIS A 48 50.097 32.562 36.249 1.00 16.57 N ATOM 355 CA HIS A 48 50.785 33.830 36.060 1.00 19.64 C ATOM 356 C HIS A 48 50.046 35.055 36.595 1.00 20.39 C ATOM 357 O HIS A 48 50.168 36.164 36.066 1.00 22.60 O ATOM 358 CB HIS A 48 51.170 34.000 34.591 1.00 18.57 C ATOM 359 CG HIS A 48 52.351 33.168 34.196 1.00 20.21 C ATOM 360 ND1 HIS A 48 52.257 31.825 33.907 1.00 24.00 N ATOM 361 CD2 HIS A 48 53.668 33.479 34.129 1.00 24.22 C ATOM 362 CE1 HIS A 48 53.468 31.341 33.680 1.00 25.86 C ATOM 363 NE2 HIS A 48 54.339 32.323 33.810 1.00 23.39 N ATOM 364 N GLY A 49 49.270 34.832 37.654 1.00 22.13 N ATOM 365 CA GLY A 49 48.563 35.911 38.324 1.00 20.79 C ATOM 366 C GLY A 49 47.286 36.506 37.774 1.00 16.70 C ATOM 367 O GLY A 49 46.766 37.466 38.346 1.00 20.10 O ATOM 368 N TYR A 50 46.770 35.966 36.678 1.00 18.69 N ATOM 369 CA TYR A 50 45.542 36.498 36.109 1.00 17.65 C ATOM 370 C TYR A 50 44.294 36.052 36.867 1.00 20.28 C ATOM 371 O TYR A 50 44.269 34.975 37.468 1.00 17.69 O ATOM 372 CB TYR A 50 45.421 36.085 34.640 1.00 19.40 C ATOM 373 CG TYR A 50 46.410 36.785 33.735 1.00 16.65 C ATOM 374 CD1 TYR A 50 47.720 36.324 33.606 1.00 18.01 C ATOM 375 CD2 TYR A 50 46.043 37.932 33.033 1.00 22.14 C ATOM 376 CE1 TYR A 50 48.639 36.992 32.798 1.00 18.12 C ATOM 377 CE2 TYR A 50 46.953 38.606 32.224 1.00 18.38 C ATOM 378 CZ TYR A 50 48.245 38.133 32.112 1.00 18.66 C ATOM 379 OH TYR A 50 49.145 38.808 31.318 1.00 19.71 O ATOM 380 N ASP A 51 43.276 36.909 36.865 1.00 19.73 N ATOM 381 CA ASP A 51 41.990 36.594 37.493 1.00 19.33 C ATOM 382 C ASP A 51 41.192 36.011 36.334 1.00 17.96 C ATOM 383 O ASP A 51 40.727 36.747 35.463 1.00 20.31 O ATOM 384 CB ASP A 51 41.302 37.862 38.009 1.00 19.92 C ATOM 385 CG ASP A 51 41.878 38.354 39.327 1.00 25.51 C ATOM 386 OD1 ASP A 51 41.542 39.487 39.738 1.00 26.42 O ATOM 387 OD2 ASP A 51 42.651 37.611 39.960 1.00 21.02 O ATOM 388 N VAL A 52 41.046 34.690 36.314 1.00 17.80 N ATOM 389 CA VAL A 52 40.347 34.029 35.222 1.00 18.93 C ATOM 390 C VAL A 52 38.982 33.481 35.616 1.00 20.20 C ATOM 391 O VAL A 52 38.863 32.678 36.541 1.00 19.44 O ATOM 392 CB VAL A 52 41.201 32.870 34.650 1.00 17.90 C ATOM 393 CG1 VAL A 52 40.568 32.327 33.377 1.00 19.20 C ATOM 394 CG2 VAL A 52 42.620 33.359 34.369 1.00 20.20 C ATOM 395 N TYR A 53 37.963 33.931 34.893 1.00 17.28 N ATOM 396 CA TYR A 53 36.584 33.518 35.112 1.00 20.07 C ATOM 397 C TYR A 53 36.150 32.717 33.890 1.00 19.69 C ATOM 398 O TYR A 53 35.801 33.283 32.853 1.00 20.17 O ATOM 399 CB TYR A 53 35.717 34.766 35.295 1.00 21.36 C ATOM 400 CG TYR A 53 36.221 35.656 36.410 1.00 20.00 C ATOM 401 CD1 TYR A 53 35.902 35.390 37.742 1.00 22.59 C ATOM 402 CD2 TYR A 53 37.080 36.721 36.141 1.00 22.64 C ATOM 403 CE1 TYR A 53 36.430 36.158 38.773 1.00 24.42 C ATOM 404 CE2 TYR A 53 37.614 37.498 37.163 1.00 21.57 C ATOM 405 CZ TYR A 53 37.288 37.212 38.478 1.00 25.65 C ATOM 406 OH TYR A 53 37.821 37.975 39.488 1.00 26.21 O ATOM 407 N PRO A 54 36.185 31.379 33.991 1.00 20.25 N ATOM 408 CA PRO A 54 35.792 30.528 32.867 1.00 21.02 C ATOM 409 C PRO A 54 34.317 30.609 32.506 1.00 20.57 C ATOM 410 O PRO A 54 33.461 30.778 33.375 1.00 20.27 O ATOM 411 CB PRO A 54 36.211 29.134 33.326 1.00 16.12 C ATOM 412 CG PRO A 54 36.037 29.208 34.810 1.00 19.12 C ATOM 413 CD PRO A 54 36.598 30.568 35.151 1.00 21.41 C ATOM 414 N VAL A 55 34.041 30.493 31.211 1.00 19.33 N ATOM 415 CA VAL A 55 32.680 30.537 30.696 1.00 22.00 C ATOM 416 C VAL A 55 32.412 29.356 29.770 1.00 24.57 C ATOM 417 O VAL A 55 33.106 29.163 28.774 1.00 23.28 O ATOM 418 CB VAL A 55 32.410 31.831 29.899 1.00 20.37 C ATOM 419 CG1 VAL A 55 31.016 31.771 29.279 1.00 21.31 C ATOM 420 CG2 VAL A 55 32.542 33.042 30.802 1.00 22.84 C ATOM 421 N ASN A 56 31.400 28.566 30.115 1.00 24.93 N ATOM 422 CA ASN A 56 30.998 27.413 29.318 1.00 26.46 C ATOM 423 C ASN A 56 29.753 26.801 29.951 1.00 29.73 C ATOM 424 O ASN A 56 29.814 26.250 31.047 1.00 25.73 O ATOM 425 CB ASN A 56 32.106 26.356 29.266 1.00 24.40 C ATOM 426 CG ASN A 56 31.864 25.318 28.181 1.00 29.91 C ATOM 427 OD1 ASN A 56 30.733 24.875 27.969 1.00 30.64 O ATOM 428 ND2 ASN A 56 32.928 24.920 27.492 1.00 26.47 N ATOM 429 N PRO A 57 28.603 26.902 29.270 1.00 31.06 N ATOM 430 CA PRO A 57 27.341 26.354 29.777 1.00 35.05 C ATOM 431 C PRO A 57 27.405 24.865 30.122 1.00 34.96 C ATOM 432 O PRO A 57 26.574 24.363 30.879 1.00 33.65 O ATOM 433 CB PRO A 57 26.368 26.633 28.635 1.00 35.25 C ATOM 434 CG PRO A 57 26.890 27.911 28.067 1.00 38.74 C ATOM 435 CD PRO A 57 28.380 27.647 28.018 1.00 34.67 C ATOM 436 N LYS A 58 28.393 24.166 29.571 1.00 33.51 N ATOM 437 CA LYS A 58 28.544 22.733 29.809 1.00 33.28 C ATOM 438 C LYS A 58 29.274 22.365 31.097 1.00 35.15 C ATOM 439 O LYS A 58 29.264 21.203 31.504 1.00 34.47 O ATOM 440 CB LYS A 58 29.265 22.080 28.626 1.00 39.62 C ATOM 441 CG LYS A 58 28.485 22.121 27.321 1.00 46.55 C ATOM 442 CD LYS A 58 29.279 21.497 26.183 1.00 50.25 C ATOM 443 CE LYS A 58 28.455 21.425 24.905 1.00 54.31 C ATOM 444 NZ LYS A 58 27.976 22.764 24.460 1.00 53.62 N ATOM 445 N TYR A 59 29.908 23.341 31.740 1.00 28.42 N ATOM 446 CA TYR A 59 30.643 23.064 32.969 1.00 28.62 C ATOM 447 C TYR A 59 30.307 24.031 34.094 1.00 24.54 C ATOM 448 O TYR A 59 29.967 25.190 33.856 1.00 29.53 O ATOM 449 CB TYR A 59 32.151 23.091 32.693 1.00 22.49 C ATOM 450 CG TYR A 59 32.559 22.191 31.550 1.00 30.07 C ATOM 451 CD1 TYR A 59 32.985 22.723 30.334 1.00 27.50 C ATOM 452 CD2 TYR A 59 32.477 20.803 31.669 1.00 26.12 C ATOM 453 CE1 TYR A 59 33.317 21.897 29.264 1.00 28.28 C ATOM 454 CE2 TYR A 59 32.805 19.969 30.606 1.00 24.69 C ATOM 455 CZ TYR A 59 33.223 20.522 29.406 1.00 29.49 C ATOM 456 OH TYR A 59 33.536 19.701 28.351 1.00 30.40 O ATOM 457 N GLU A 60 30.408 23.546 35.327 1.00 27.64 N ATOM 458 CA GLU A 60 30.107 24.364 36.492 1.00 27.61 C ATOM 459 C GLU A 60 31.396 24.786 37.197 1.00 26.11 C ATOM 460 O GLU A 60 31.406 25.739 37.976 1.00 28.44 O ATOM 461 CB GLU A 60 29.209 23.580 37.456 1.00 36.60 C ATOM 462 CG GLU A 60 28.546 24.432 38.520 1.00 43.37 C ATOM 463 CD GLU A 60 27.529 23.658 39.338 1.00 50.61 C ATOM 464 OE1 GLU A 60 26.844 24.285 40.173 1.00 54.68 O ATOM 465 OE2 GLU A 60 27.414 22.427 39.148 1.00 47.88 O ATOM 466 N GLU A 61 32.479 24.072 36.910 1.00 26.24 N ATOM 467 CA GLU A 61 33.774 24.372 37.510 1.00 26.06 C ATOM 468 C GLU A 61 34.922 23.884 36.633 1.00 23.97 C ATOM 469 O GLU A 61 34.907 22.759 36.139 1.00 24.83 O ATOM 470 CB GLU A 61 33.867 23.720 38.891 1.00 24.49 C ATOM 471 CG GLU A 61 35.168 23.983 39.629 1.00 32.46 C ATOM 472 CD GLU A 61 35.174 23.375 41.020 1.00 35.06 C ATOM 473 OE1 GLU A 61 36.191 23.516 41.729 1.00 41.73 O ATOM 474 OE2 GLU A 61 34.157 22.759 41.406 1.00 42.35 O ATOM 475 N VAL A 62 35.919 24.742 36.435 1.00 21.90 N ATOM 476 CA VAL A 62 37.078 24.385 35.631 1.00 17.94 C ATOM 477 C VAL A 62 38.332 24.880 36.344 1.00 18.26 C ATOM 478 O VAL A 62 38.414 26.044 36.728 1.00 19.00 O ATOM 479 CB VAL A 62 37.001 25.018 34.220 1.00 21.19 C ATOM 480 CG1 VAL A 62 38.259 24.699 33.431 1.00 19.16 C ATOM 481 CG2 VAL A 62 35.773 24.486 33.481 1.00 20.22 C ATOM 482 N LEU A 63 39.287 23.977 36.539 1.00 21.22 N ATOM 483 CA LEU A 63 40.545 24.300 37.200 1.00 19.34 C ATOM 484 C LEU A 63 40.360 25.035 38.529 1.00 21.42 C ATOM 485 O LEU A 63 41.067 25.999 38.822 1.00 20.74 O ATOM 486 CB LEU A 63 41.429 25.118 36.247 1.00 20.03 C ATOM 487 CG LEU A 63 41.886 24.313 35.023 1.00 17.93 C ATOM 488 CD1 LEU A 63 42.506 25.225 33.966 1.00 20.23 C ATOM 489 CD2 LEU A 63 42.878 23.255 35.478 1.00 19.20 C ATOM 490 N GLY A 64 39.405 24.569 39.331 1.00 20.24 N ATOM 491 CA GLY A 64 39.149 25.175 40.627 1.00 20.79 C ATOM 492 C GLY A 64 38.442 26.516 40.584 1.00 18.94 C ATOM 493 O GLY A 64 38.318 27.187 41.608 1.00 21.92 O ATOM 494 N ARG A 65 37.968 26.905 39.406 1.00 17.67 N ATOM 495 CA ARG A 65 37.278 28.181 39.244 1.00 18.92 C ATOM 496 C ARG A 65 35.811 27.963 38.880 1.00 18.29 C ATOM 497 O ARG A 65 35.491 27.084 38.078 1.00 22.90 O ATOM 498 CB ARG A 65 37.958 28.998 38.143 1.00 19.96 C ATOM 499 CG ARG A 65 39.430 29.297 38.406 1.00 19.40 C ATOM 500 CD ARG A 65 39.605 30.327 39.512 1.00 15.78 C ATOM 501 NE ARG A 65 39.053 31.626 39.132 1.00 17.27 N ATOM 502 CZ ARG A 65 38.882 32.642 39.971 1.00 16.90 C ATOM 503 NH1 ARG A 65 39.219 32.519 41.249 1.00 16.87 N ATOM 504 NH2 ARG A 65 38.364 33.783 39.531 1.00 17.68 N ATOM 505 N LYS A 66 34.923 28.761 39.467 1.00 20.96 N ATOM 506 CA LYS A 66 33.505 28.632 39.155 1.00 21.33 C ATOM 507 C LYS A 66 33.315 28.987 37.685 1.00 22.32 C ATOM 508 O LYS A 66 33.779 30.032 37.229 1.00 22.98 O ATOM 509 CB LYS A 66 32.662 29.569 40.020 1.00 21.70 C ATOM 510 CG LYS A 66 31.172 29.477 39.719 1.00 28.94 C ATOM 511 CD LYS A 66 30.355 30.367 40.634 1.00 30.56 C ATOM 512 CE LYS A 66 28.872 30.251 40.318 1.00 35.46 C ATOM 513 NZ LYS A 66 28.052 31.091 41.232 1.00 41.89 N ATOM 514 N CYS A 67 32.631 28.118 36.949 1.00 22.85 N ATOM 515 CA CYS A 67 32.402 28.340 35.526 1.00 24.26 C ATOM 516 C CYS A 67 30.979 28.822 35.252 1.00 26.42 C ATOM 517 O CYS A 67 30.012 28.197 35.686 1.00 28.65 O ATOM 518 CB CYS A 67 32.679 27.048 34.761 1.00 20.94 C ATOM 519 SG CYS A 67 32.760 27.239 32.972 1.00 24.06 S ATOM 520 N TYR A 68 30.859 29.933 34.529 1.00 26.54 N ATOM 521 CA TYR A 68 29.555 30.511 34.213 1.00 28.25 C ATOM 522 C TYR A 68 29.066 30.163 32.805 1.00 31.18 C ATOM 523 O TYR A 68 29.862 29.965 31.888 1.00 29.09 O ATOM 524 CB TYR A 68 29.609 32.035 34.381 1.00 26.12 C ATOM 525 CG TYR A 68 30.060 32.481 35.755 1.00 30.54 C ATOM 526 CD1 TYR A 68 31.406 32.427 36.124 1.00 27.12 C ATOM 527 CD2 TYR A 68 29.137 32.928 36.698 1.00 26.50 C ATOM 528 CE1 TYR A 68 31.820 32.807 37.401 1.00 29.41 C ATOM 529 CE2 TYR A 68 29.538 33.309 37.976 1.00 31.20 C ATOM 530 CZ TYR A 68 30.877 33.247 38.321 1.00 32.72 C ATOM 531 OH TYR A 68 31.268 33.626 39.586 1.00 34.92 O ATOM 532 N PRO A 69 27.738 30.073 32.621 1.00 30.91 N ATOM 533 CA PRO A 69 27.174 29.745 31.308 1.00 32.31 C ATOM 534 C PRO A 69 27.235 30.915 30.327 1.00 32.43 C ATOM 535 O PRO A 69 27.124 30.726 29.117 1.00 36.03 O ATOM 536 CB PRO A 69 25.742 29.338 31.645 1.00 32.64 C ATOM 537 CG PRO A 69 25.420 30.229 32.795 1.00 32.34 C ATOM 538 CD PRO A 69 26.676 30.155 33.641 1.00 32.64 C ATOM 539 N SER A 70 27.415 32.120 30.859 1.00 32.29 N ATOM 540 CA SER A 70 27.493 33.329 30.045 1.00 33.43 C ATOM 541 C SER A 70 28.438 34.355 30.660 1.00 33.05 C ATOM 542 O SER A 70 28.640 34.379 31.874 1.00 36.28 O ATOM 543 CB SER A 70 26.104 33.953 29.893 1.00 33.68 C ATOM 544 OG SER A 70 26.197 35.285 29.417 1.00 34.90 O ATOM 545 N VAL A 71 29.012 35.206 29.815 1.00 31.40 N ATOM 546 CA VAL A 71 29.930 36.239 30.280 1.00 28.99 C ATOM 547 C VAL A 71 29.233 37.227 31.213 1.00 34.01 C ATOM 548 O VAL A 71 29.825 37.704 32.183 1.00 34.25 O ATOM 549 CB VAL A 71 30.538 37.026 29.095 1.00 31.59 C ATOM 550 CG1 VAL A 71 31.371 38.185 29.614 1.00 27.81 C ATOM 551 CG2 VAL A 71 31.394 36.104 28.242 1.00 32.40 C ATOM 552 N LEU A 72 27.974 37.529 30.915 1.00 34.33 N ATOM 553 CA LEU A 72 27.202 38.466 31.721 1.00 36.39 C ATOM 554 C LEU A 72 26.883 37.942 33.120 1.00 37.76 C ATOM 555 O LEU A 72 26.578 38.724 34.021 1.00 36.50 O ATOM 556 CB LEU A 72 25.901 38.833 31.000 1.00 35.32 C ATOM 557 CG LEU A 72 26.051 39.686 29.737 1.00 43.56 C ATOM 558 CD1 LEU A 72 24.686 39.932 29.114 1.00 39.67 C ATOM 559 CD2 LEU A 72 26.720 41.007 30.090 1.00 45.04 C ATOM 560 N ASP A 73 26.954 36.626 33.302 1.00 36.74 N ATOM 561 CA ASP A 73 26.667 36.025 34.602 1.00 36.47 C ATOM 562 C ASP A 73 27.803 36.231 35.597 1.00 38.87 C ATOM 563 O ASP A 73 27.614 36.087 36.805 1.00 40.83 O ATOM 564 CB ASP A 73 26.389 34.527 34.455 1.00 37.43 C ATOM 565 CG ASP A 73 25.134 34.243 33.660 1.00 42.10 C ATOM 566 OD1 ASP A 73 24.100 34.882 33.941 1.00 44.82 O ATOM 567 OD2 ASP A 73 25.177 33.376 32.764 1.00 47.20 O ATOM 568 N ILE A 74 28.984 36.559 35.087 1.00 34.37 N ATOM 569 CA ILE A 74 30.140 36.784 35.944 1.00 33.27 C ATOM 570 C ILE A 74 29.920 38.032 36.792 1.00 37.40 C ATOM 571 O ILE A 74 29.661 39.112 36.266 1.00 37.86 O ATOM 572 CB ILE A 74 31.419 36.963 35.102 1.00 29.92 C ATOM 573 CG1 ILE A 74 31.667 35.696 34.287 1.00 25.61 C ATOM 574 CG2 ILE A 74 32.606 37.259 36.006 1.00 29.51 C ATOM 575 CD1 ILE A 74 32.769 35.831 33.250 1.00 27.53 C ATOM 576 N PRO A 75 30.016 37.894 38.123 1.00 36.68 N ATOM 577 CA PRO A 75 29.828 39.007 39.061 1.00 38.56 C ATOM 578 C PRO A 75 30.880 40.108 38.930 1.00 39.10 C ATOM 579 O PRO A 75 30.554 41.293 38.898 1.00 42.07 O ATOM 580 CB PRO A 75 29.902 38.326 40.431 1.00 37.40 C ATOM 581 CG PRO A 75 29.496 36.916 40.148 1.00 38.71 C ATOM 582 CD PRO A 75 30.198 36.629 38.852 1.00 41.02 C ATOM 583 N ASP A 76 32.144 39.704 38.857 1.00 37.44 N ATOM 584 CA ASP A 76 33.255 40.646 38.760 1.00 35.53 C ATOM 585 C ASP A 76 33.399 41.296 37.390 1.00 32.90 C ATOM 586 O ASP A 76 32.878 40.793 36.394 1.00 29.93 O ATOM 587 CB ASP A 76 34.558 39.940 39.136 1.00 41.95 C ATOM 588 CG ASP A 76 34.549 39.445 40.570 1.00 43.95 C ATOM 589 OD1 ASP A 76 35.520 38.784 40.990 1.00 45.91 O ATOM 590 OD2 ASP A 76 33.556 39.716 41.278 1.00 56.86 O ATOM 591 N LYS A 77 34.110 42.420 37.348 1.00 32.32 N ATOM 592 CA LYS A 77 34.318 43.131 36.094 1.00 34.87 C ATOM 593 C LYS A 77 35.244 42.319 35.199 1.00 33.55 C ATOM 594 O LYS A 77 36.182 41.676 35.674 1.00 30.27 O ATOM 595 CB LYS A 77 34.926 44.519 36.339 1.00 41.05 C ATOM 596 CG LYS A 77 36.400 44.522 36.735 1.00 47.05 C ATOM 597 CD LYS A 77 36.621 44.163 38.197 1.00 58.01 C ATOM 598 CE LYS A 77 36.142 45.270 39.130 1.00 60.61 C ATOM 599 NZ LYS A 77 34.661 45.417 39.130 1.00 65.82 N ATOM 600 N ILE A 78 34.964 42.345 33.903 1.00 31.92 N ATOM 601 CA ILE A 78 35.768 41.620 32.927 1.00 27.98 C ATOM 602 C ILE A 78 36.376 42.616 31.958 1.00 26.02 C ATOM 603 O ILE A 78 35.686 43.503 31.459 1.00 28.23 O ATOM 604 CB ILE A 78 34.910 40.611 32.145 1.00 27.22 C ATOM 605 CG1 ILE A 78 34.453 39.505 33.093 1.00 26.49 C ATOM 606 CG2 ILE A 78 35.702 40.011 30.996 1.00 26.83 C ATOM 607 CD1 ILE A 78 35.603 38.752 33.748 1.00 28.42 C ATOM 608 N GLU A 79 37.670 42.469 31.695 1.00 27.30 N ATOM 609 CA GLU A 79 38.360 43.371 30.783 1.00 21.38 C ATOM 610 C GLU A 79 38.655 42.696 29.448 1.00 26.10 C ATOM 611 O GLU A 79 38.507 43.307 28.390 1.00 25.48 O ATOM 612 CB GLU A 79 39.653 43.862 31.429 1.00 23.65 C ATOM 613 CG GLU A 79 39.427 44.496 32.801 1.00 25.69 C ATOM 614 CD GLU A 79 40.712 44.737 33.567 1.00 27.00 C ATOM 615 OE1 GLU A 79 41.522 43.795 33.688 1.00 25.21 O ATOM 616 OE2 GLU A 79 40.908 45.865 34.061 1.00 31.28 O ATOM 617 N VAL A 80 39.061 41.430 29.504 1.00 23.72 N ATOM 618 CA VAL A 80 39.378 40.677 28.295 1.00 19.21 C ATOM 619 C VAL A 80 38.512 39.430 28.137 1.00 23.81 C ATOM 620 O VAL A 80 38.378 38.626 29.061 1.00 22.56 O ATOM 621 CB VAL A 80 40.864 40.219 28.280 1.00 19.76 C ATOM 622 CG1 VAL A 80 41.165 39.466 26.985 1.00 18.76 C ATOM 623 CG2 VAL A 80 41.790 41.417 28.428 1.00 19.86 C ATOM 624 N VAL A 81 37.916 39.281 26.961 1.00 19.65 N ATOM 625 CA VAL A 81 37.107 38.108 26.671 1.00 18.36 C ATOM 626 C VAL A 81 37.937 37.257 25.712 1.00 19.37 C ATOM 627 O VAL A 81 38.077 37.573 24.527 1.00 21.22 O ATOM 628 CB VAL A 81 35.764 38.486 26.022 1.00 21.25 C ATOM 629 CG1 VAL A 81 34.974 37.224 25.698 1.00 25.52 C ATOM 630 CG2 VAL A 81 34.963 39.366 26.972 1.00 30.57 C ATOM 631 N ASP A 82 38.493 36.180 26.255 1.00 19.70 N ATOM 632 CA ASP A 82 39.361 35.258 25.529 1.00 18.93 C ATOM 633 C ASP A 82 38.531 34.122 24.938 1.00 19.18 C ATOM 634 O ASP A 82 38.071 33.241 25.664 1.00 19.34 O ATOM 635 CB ASP A 82 40.404 34.731 26.516 1.00 18.48 C ATOM 636 CG ASP A 82 41.548 34.021 25.845 1.00 16.28 C ATOM 637 OD1 ASP A 82 41.822 34.302 24.661 1.00 18.93 O ATOM 638 OD2 ASP A 82 42.188 33.193 26.527 1.00 19.06 O ATOM 639 N LEU A 83 38.358 34.141 23.618 1.00 17.55 N ATOM 640 CA LEU A 83 37.532 33.150 22.925 1.00 17.71 C ATOM 641 C LEU A 83 38.195 31.884 22.392 1.00 16.73 C ATOM 642 O LEU A 83 39.155 31.940 21.628 1.00 18.15 O ATOM 643 CB LEU A 83 36.803 33.823 21.760 1.00 18.25 C ATOM 644 CG LEU A 83 35.941 35.053 22.052 1.00 21.68 C ATOM 645 CD1 LEU A 83 35.605 35.740 20.738 1.00 25.23 C ATOM 646 CD2 LEU A 83 34.677 34.651 22.801 1.00 22.40 C ATOM 647 N PHE A 84 37.637 30.737 22.768 1.00 21.02 N ATOM 648 CA PHE A 84 38.136 29.447 22.311 1.00 23.62 C ATOM 649 C PHE A 84 37.074 28.694 21.508 1.00 29.04 C ATOM 650 O PHE A 84 37.282 27.544 21.119 1.00 36.25 O ATOM 651 CB PHE A 84 38.585 28.601 23.507 1.00 20.91 C ATOM 652 CG PHE A 84 39.912 29.016 24.076 1.00 18.93 C ATOM 653 CD1 PHE A 84 41.097 28.509 23.549 1.00 18.83 C ATOM 654 CD2 PHE A 84 39.979 29.931 25.123 1.00 19.48 C ATOM 655 CE1 PHE A 84 42.335 28.909 24.059 1.00 16.04 C ATOM 656 CE2 PHE A 84 41.209 30.338 25.638 1.00 21.09 C ATOM 657 CZ PHE A 84 42.387 29.825 25.106 1.00 15.77 C ATOM 658 N VAL A 85 35.947 29.350 21.244 1.00 23.68 N ATOM 659 CA VAL A 85 34.856 28.722 20.497 1.00 26.63 C ATOM 660 C VAL A 85 34.897 28.954 18.985 1.00 27.73 C ATOM 661 O VAL A 85 35.595 29.842 18.494 1.00 27.66 O ATOM 662 CB VAL A 85 33.481 29.186 21.031 1.00 23.77 C ATOM 663 CG1 VAL A 85 33.331 28.782 22.491 1.00 27.95 C ATOM 664 CG2 VAL A 85 33.331 30.695 20.875 1.00 24.37 C ATOM 665 N LYS A 86 34.134 28.141 18.257 1.00 28.37 N ATOM 666 CA LYS A 86 34.069 28.218 16.801 1.00 30.49 C ATOM 667 C LYS A 86 33.612 29.597 16.343 1.00 26.20 C ATOM 668 O LYS A 86 32.825 30.255 17.018 1.00 28.42 O ATOM 669 CB LYS A 86 33.106 27.153 16.261 1.00 32.87 C ATOM 670 CG LYS A 86 33.137 25.845 17.035 1.00 41.23 C ATOM 671 CD LYS A 86 34.549 25.296 17.169 1.00 46.11 C ATOM 672 CE LYS A 86 34.605 24.204 18.229 1.00 51.41 C ATOM 673 NZ LYS A 86 34.136 24.709 19.556 1.00 48.86 N ATOM 674 N PRO A 87 34.101 30.048 15.178 1.00 28.87 N ATOM 675 CA PRO A 87 33.744 31.357 14.626 1.00 26.38 C ATOM 676 C PRO A 87 32.249 31.671 14.668 1.00 29.17 C ATOM 677 O PRO A 87 31.850 32.767 15.055 1.00 26.02 O ATOM 678 CB PRO A 87 34.277 31.278 13.199 1.00 28.19 C ATOM 679 CG PRO A 87 35.506 30.445 13.361 1.00 28.45 C ATOM 680 CD PRO A 87 35.021 29.335 14.273 1.00 29.66 C ATOM 681 N LYS A 88 31.432 30.702 14.273 1.00 31.93 N ATOM 682 CA LYS A 88 29.985 30.878 14.238 1.00 36.14 C ATOM 683 C LYS A 88 29.373 31.144 15.612 1.00 35.53 C ATOM 684 O LYS A 88 28.254 31.649 15.709 1.00 39.26 O ATOM 685 CB LYS A 88 29.328 29.641 13.619 1.00 40.40 C ATOM 686 CG LYS A 88 27.866 29.825 13.243 1.00 49.01 C ATOM 687 CD LYS A 88 27.710 30.825 12.105 1.00 52.50 C ATOM 688 CE LYS A 88 26.253 30.985 11.702 1.00 53.41 C ATOM 689 NZ LYS A 88 26.094 31.922 10.555 1.00 56.76 N ATOM 690 N LEU A 89 30.107 30.813 16.671 1.00 33.49 N ATOM 691 CA LEU A 89 29.606 31.005 18.028 1.00 31.05 C ATOM 692 C LEU A 89 30.163 32.236 18.738 1.00 30.36 C ATOM 693 O LEU A 89 29.699 32.591 19.821 1.00 26.61 O ATOM 694 CB LEU A 89 29.906 29.763 18.869 1.00 35.89 C ATOM 695 CG LEU A 89 29.351 28.438 18.342 1.00 42.03 C ATOM 696 CD1 LEU A 89 29.831 27.295 19.224 1.00 41.35 C ATOM 697 CD2 LEU A 89 27.831 28.496 18.308 1.00 41.39 C ATOM 698 N THR A 90 31.150 32.891 18.136 1.00 27.79 N ATOM 699 CA THR A 90 31.747 34.064 18.759 1.00 27.54 C ATOM 700 C THR A 90 30.827 35.279 18.797 1.00 28.94 C ATOM 701 O THR A 90 30.946 36.119 19.688 1.00 27.94 O ATOM 702 CB THR A 90 33.059 34.465 18.058 1.00 25.05 C ATOM 703 OG1 THR A 90 32.788 34.857 16.707 1.00 24.54 O ATOM 704 CG2 THR A 90 34.035 33.295 18.064 1.00 22.80 C ATOM 705 N MET A 91 29.912 35.379 17.837 1.00 27.51 N ATOM 706 CA MET A 91 28.997 36.514 17.800 1.00 30.05 C ATOM 707 C MET A 91 28.223 36.645 19.108 1.00 27.10 C ATOM 708 O MET A 91 28.164 37.720 19.699 1.00 27.49 O ATOM 709 CB MET A 91 28.016 36.373 16.634 1.00 33.84 C ATOM 710 CG MET A 91 27.002 37.505 16.542 1.00 31.76 C ATOM 711 SD MET A 91 27.763 39.139 16.401 1.00 37.89 S ATOM 712 CE MET A 91 27.849 39.317 14.616 1.00 32.19 C ATOM 713 N GLU A 92 27.636 35.544 19.561 1.00 30.52 N ATOM 714 CA GLU A 92 26.868 35.558 20.799 1.00 32.75 C ATOM 715 C GLU A 92 27.715 36.065 21.966 1.00 33.01 C ATOM 716 O GLU A 92 27.262 36.889 22.757 1.00 28.20 O ATOM 717 CB GLU A 92 26.334 34.153 21.105 1.00 36.40 C ATOM 718 CG GLU A 92 27.407 33.129 21.425 1.00 50.27 C ATOM 719 CD GLU A 92 26.868 31.715 21.503 1.00 54.92 C ATOM 720 OE1 GLU A 92 25.920 31.476 22.284 1.00 59.06 O ATOM 721 OE2 GLU A 92 27.395 30.841 20.783 1.00 53.26 O ATOM 722 N TYR A 93 28.950 35.584 22.062 1.00 31.48 N ATOM 723 CA TYR A 93 29.836 35.995 23.141 1.00 28.81 C ATOM 724 C TYR A 93 30.363 37.416 22.989 1.00 30.04 C ATOM 725 O TYR A 93 30.691 38.068 23.980 1.00 29.78 O ATOM 726 CB TYR A 93 30.991 35.000 23.277 1.00 27.80 C ATOM 727 CG TYR A 93 30.527 33.660 23.795 1.00 26.07 C ATOM 728 CD1 TYR A 93 30.508 32.538 22.970 1.00 24.26 C ATOM 729 CD2 TYR A 93 30.057 33.526 25.101 1.00 30.69 C ATOM 730 CE1 TYR A 93 30.030 31.313 23.434 1.00 26.15 C ATOM 731 CE2 TYR A 93 29.577 32.312 25.572 1.00 27.32 C ATOM 732 CZ TYR A 93 29.565 31.210 24.735 1.00 28.65 C ATOM 733 OH TYR A 93 29.083 30.007 25.196 1.00 33.86 O ATOM 734 N VAL A 94 30.451 37.899 21.753 1.00 28.69 N ATOM 735 CA VAL A 94 30.910 39.262 21.523 1.00 30.71 C ATOM 736 C VAL A 94 29.822 40.205 22.025 1.00 30.47 C ATOM 737 O VAL A 94 30.107 41.212 22.668 1.00 30.56 O ATOM 738 CB VAL A 94 31.165 39.536 20.025 1.00 32.59 C ATOM 739 CG1 VAL A 94 31.375 41.027 19.793 1.00 33.58 C ATOM 740 CG2 VAL A 94 32.387 38.765 19.564 1.00 35.77 C ATOM 741 N GLU A 95 28.572 39.867 21.723 1.00 33.07 N ATOM 742 CA GLU A 95 27.438 40.668 22.157 1.00 36.52 C ATOM 743 C GLU A 95 27.428 40.722 23.681 1.00 35.86 C ATOM 744 O GLU A 95 27.115 41.755 24.275 1.00 36.29 O ATOM 745 CB GLU A 95 26.136 40.058 21.629 1.00 37.39 C ATOM 746 CG GLU A 95 26.019 40.118 20.111 1.00 40.61 C ATOM 747 CD GLU A 95 24.790 39.407 19.577 1.00 43.61 C ATOM 748 OE1 GLU A 95 24.544 39.489 18.355 1.00 43.89 O ATOM 749 OE2 GLU A 95 24.072 38.766 20.372 1.00 46.46 O ATOM 750 N GLN A 96 27.783 39.603 24.307 1.00 34.06 N ATOM 751 CA GLN A 96 27.846 39.522 25.761 1.00 32.61 C ATOM 752 C GLN A 96 28.977 40.407 26.267 1.00 33.49 C ATOM 753 O GLN A 96 28.805 41.172 27.214 1.00 34.39 O ATOM 754 CB GLN A 96 28.094 38.079 26.204 1.00 32.43 C ATOM 755 CG GLN A 96 26.868 37.186 26.178 1.00 33.48 C ATOM 756 CD GLN A 96 27.202 35.750 26.515 1.00 32.40 C ATOM 757 OE1 GLN A 96 28.105 35.481 27.310 1.00 35.67 O ATOM 758 NE2 GLN A 96 26.470 34.815 25.921 1.00 35.23 N ATOM 759 N ALA A 97 30.140 40.292 25.632 1.00 32.71 N ATOM 760 CA ALA A 97 31.302 41.089 26.010 1.00 31.36 C ATOM 761 C ALA A 97 30.956 42.572 25.921 1.00 32.28 C ATOM 762 O ALA A 97 31.384 43.368 26.751 1.00 29.39 O ATOM 763 CB ALA A 97 32.478 40.768 25.089 1.00 31.34 C ATOM 764 N ILE A 98 30.177 42.930 24.904 1.00 33.87 N ATOM 765 CA ILE A 98 29.765 44.313 24.702 1.00 35.74 C ATOM 766 C ILE A 98 28.921 44.764 25.876 1.00 33.92 C ATOM 767 O ILE A 98 29.150 45.829 26.442 1.00 35.48 O ATOM 768 CB ILE A 98 28.921 44.481 23.421 1.00 35.96 C ATOM 769 CG1 ILE A 98 29.738 44.047 22.209 1.00 35.01 C ATOM 770 CG2 ILE A 98 28.510 45.934 23.246 1.00 35.85 C ATOM 771 CD1 ILE A 98 31.039 44.796 22.075 1.00 42.09 C ATOM 772 N LYS A 99 27.925 43.958 26.223 1.00 34.28 N ATOM 773 CA LYS A 99 27.034 44.278 27.334 1.00 39.37 C ATOM 774 C LYS A 99 27.790 44.319 28.656 1.00 40.77 C ATOM 775 O LYS A 99 27.498 45.140 29.521 1.00 40.40 O ATOM 776 CB LYS A 99 25.903 43.247 27.428 1.00 41.02 C ATOM 777 CG LYS A 99 24.878 43.315 26.302 1.00 46.75 C ATOM 778 CD LYS A 99 24.308 44.721 26.154 1.00 53.53 C ATOM 779 CE LYS A 99 22.959 44.712 25.454 1.00 55.81 C ATOM 780 NZ LYS A 99 21.913 44.084 26.309 1.00 55.03 N ATOM 781 N LYS A 100 28.765 43.427 28.802 1.00 40.07 N ATOM 782 CA LYS A 100 29.570 43.344 30.017 1.00 36.48 C ATOM 783 C LYS A 100 30.509 44.539 30.147 1.00 37.47 C ATOM 784 O LYS A 100 31.008 44.831 31.233 1.00 38.69 O ATOM 785 CB LYS A 100 30.380 42.042 30.011 1.00 37.92 C ATOM 786 CG LYS A 100 31.225 41.805 31.253 1.00 35.84 C ATOM 787 CD LYS A 100 30.365 41.647 32.497 1.00 38.28 C ATOM 788 CE LYS A 100 31.224 41.376 33.724 1.00 35.89 C ATOM 789 NZ LYS A 100 30.408 41.223 34.958 1.00 29.50 N ATOM 790 N GLY A 101 30.748 45.226 29.034 1.00 35.30 N ATOM 791 CA GLY A 101 31.627 46.381 29.055 1.00 32.30 C ATOM 792 C GLY A 101 33.098 46.014 28.994 1.00 33.65 C ATOM 793 O GLY A 101 33.952 46.742 29.505 1.00 32.24 O ATOM 794 N ALA A 102 33.399 44.881 28.368 1.00 31.23 N ATOM 795 CA ALA A 102 34.779 44.425 28.239 1.00 30.89 C ATOM 796 C ALA A 102 35.588 45.462 27.469 1.00 30.57 C ATOM 797 O ALA A 102 35.023 46.310 26.781 1.00 30.67 O ATOM 798 CB ALA A 102 34.819 43.082 27.520 1.00 33.07 C ATOM 799 N LYS A 103 36.908 45.389 27.588 1.00 27.61 N ATOM 800 CA LYS A 103 37.797 46.326 26.909 1.00 26.91 C ATOM 801 C LYS A 103 38.477 45.684 25.708 1.00 26.54 C ATOM 802 O LYS A 103 38.862 46.371 24.760 1.00 24.51 O ATOM 803 CB LYS A 103 38.879 46.818 27.872 1.00 29.70 C ATOM 804 CG LYS A 103 38.366 47.569 29.088 1.00 30.84 C ATOM 805 CD LYS A 103 37.788 48.918 28.703 1.00 35.97 C ATOM 806 CE LYS A 103 37.396 49.713 29.938 1.00 39.00 C ATOM 807 NZ LYS A 103 36.830 51.044 29.588 1.00 45.92 N ATOM 808 N VAL A 104 38.620 44.363 25.755 1.00 22.44 N ATOM 809 CA VAL A 104 39.290 43.630 24.686 1.00 22.01 C ATOM 810 C VAL A 104 38.606 42.311 24.347 1.00 23.38 C ATOM 811 O VAL A 104 38.120 41.606 25.230 1.00 23.24 O ATOM 812 CB VAL A 104 40.753 43.303 25.092 1.00 21.52 C ATOM 813 CG1 VAL A 104 41.440 42.489 24.003 1.00 20.82 C ATOM 814 CG2 VAL A 104 41.520 44.587 25.363 1.00 25.55 C ATOM 815 N VAL A 105 38.555 41.998 23.057 1.00 23.63 N ATOM 816 CA VAL A 105 38.005 40.732 22.597 1.00 21.58 C ATOM 817 C VAL A 105 39.227 40.049 21.998 1.00 19.18 C ATOM 818 O VAL A 105 39.881 40.596 21.111 1.00 19.66 O ATOM 819 CB VAL A 105 36.929 40.911 21.507 1.00 23.66 C ATOM 820 CG1 VAL A 105 36.420 39.543 21.056 1.00 23.13 C ATOM 821 CG2 VAL A 105 35.778 41.739 22.049 1.00 31.71 C ATOM 822 N TRP A 106 39.546 38.867 22.503 1.00 18.47 N ATOM 823 CA TRP A 106 40.710 38.138 22.032 1.00 17.00 C ATOM 824 C TRP A 106 40.311 36.844 21.333 1.00 16.21 C ATOM 825 O TRP A 106 39.847 35.904 21.975 1.00 18.68 O ATOM 826 CB TRP A 106 41.629 37.837 23.221 1.00 17.02 C ATOM 827 CG TRP A 106 42.969 37.274 22.849 1.00 17.55 C ATOM 828 CD1 TRP A 106 43.210 36.149 22.113 1.00 18.20 C ATOM 829 CD2 TRP A 106 44.254 37.792 23.222 1.00 15.10 C ATOM 830 NE1 TRP A 106 44.561 35.933 22.007 1.00 16.78 N ATOM 831 CE2 TRP A 106 45.226 36.923 22.680 1.00 15.78 C ATOM 832 CE3 TRP A 106 44.678 38.900 23.969 1.00 15.93 C ATOM 833 CZ2 TRP A 106 46.600 37.132 22.851 1.00 17.28 C ATOM 834 CZ3 TRP A 106 46.046 39.107 24.142 1.00 18.03 C ATOM 835 CH2 TRP A 106 46.989 38.224 23.585 1.00 17.12 C ATOM 836 N PHE A 107 40.489 36.809 20.014 1.00 17.01 N ATOM 837 CA PHE A 107 40.170 35.631 19.214 1.00 17.71 C ATOM 838 C PHE A 107 41.374 34.695 19.168 1.00 20.48 C ATOM 839 O PHE A 107 42.405 35.024 18.580 1.00 18.10 O ATOM 840 CB PHE A 107 39.805 36.046 17.785 1.00 17.94 C ATOM 841 CG PHE A 107 38.473 36.741 17.666 1.00 16.72 C ATOM 842 CD1 PHE A 107 37.305 36.011 17.451 1.00 18.20 C ATOM 843 CD2 PHE A 107 38.390 38.126 17.752 1.00 19.37 C ATOM 844 CE1 PHE A 107 36.074 36.656 17.319 1.00 17.65 C ATOM 845 CE2 PHE A 107 37.162 38.781 17.621 1.00 19.49 C ATOM 846 CZ PHE A 107 36.004 38.042 17.404 1.00 20.98 C ATOM 847 N GLN A 108 41.248 33.531 19.795 1.00 16.13 N ATOM 848 CA GLN A 108 42.327 32.553 19.790 1.00 18.07 C ATOM 849 C GLN A 108 42.382 31.929 18.392 1.00 17.70 C ATOM 850 O GLN A 108 41.532 32.208 17.546 1.00 20.29 O ATOM 851 CB GLN A 108 42.064 31.475 20.845 1.00 15.95 C ATOM 852 CG GLN A 108 42.153 31.953 22.293 1.00 15.99 C ATOM 853 CD GLN A 108 43.568 31.939 22.841 1.00 17.73 C ATOM 854 OE1 GLN A 108 44.346 31.024 22.560 1.00 22.54 O ATOM 855 NE2 GLN A 108 43.900 32.937 23.650 1.00 13.56 N ATOM 856 N TYR A 109 43.378 31.087 18.151 1.00 19.62 N ATOM 857 CA TYR A 109 43.533 30.448 16.850 1.00 21.49 C ATOM 858 C TYR A 109 42.270 29.742 16.352 1.00 23.28 C ATOM 859 O TYR A 109 41.590 29.046 17.107 1.00 24.42 O ATOM 860 CB TYR A 109 44.696 29.451 16.894 1.00 24.52 C ATOM 861 CG TYR A 109 46.043 30.097 17.141 1.00 25.05 C ATOM 862 CD1 TYR A 109 46.499 31.129 16.323 1.00 30.52 C ATOM 863 CD2 TYR A 109 46.868 29.670 18.185 1.00 29.36 C ATOM 864 CE1 TYR A 109 47.740 31.722 16.535 1.00 30.31 C ATOM 865 CE2 TYR A 109 48.115 30.259 18.405 1.00 30.39 C ATOM 866 CZ TYR A 109 48.542 31.283 17.573 1.00 33.26 C ATOM 867 OH TYR A 109 49.777 31.864 17.766 1.00 37.98 O ATOM 868 N ASN A 110 41.969 29.946 15.073 1.00 24.48 N ATOM 869 CA ASN A 110 40.821 29.331 14.414 1.00 26.27 C ATOM 870 C ASN A 110 39.461 29.641 15.036 1.00 25.60 C ATOM 871 O ASN A 110 38.589 28.774 15.083 1.00 25.74 O ATOM 872 CB ASN A 110 41.012 27.812 14.354 1.00 33.84 C ATOM 873 CG ASN A 110 42.307 27.412 13.671 1.00 41.25 C ATOM 874 OD1 ASN A 110 43.397 27.728 14.148 1.00 53.00 O ATOM 875 ND2 ASN A 110 42.193 26.715 12.547 1.00 48.51 N ATOM 876 N THR A 111 39.276 30.871 15.504 1.00 21.20 N ATOM 877 CA THR A 111 38.003 31.268 16.102 1.00 20.10 C ATOM 878 C THR A 111 37.486 32.573 15.499 1.00 20.74 C ATOM 879 O THR A 111 36.351 32.976 15.753 1.00 22.62 O ATOM 880 CB THR A 111 38.134 31.504 17.624 1.00 22.30 C ATOM 881 OG1 THR A 111 38.864 32.716 17.856 1.00 18.95 O ATOM 882 CG2 THR A 111 38.868 30.355 18.288 1.00 19.82 C ATOM 883 N TYR A 112 38.312 33.230 14.694 1.00 21.27 N ATOM 884 CA TYR A 112 37.929 34.516 14.124 1.00 21.78 C ATOM 885 C TYR A 112 36.751 34.536 13.150 1.00 23.23 C ATOM 886 O TYR A 112 36.662 33.720 12.232 1.00 24.80 O ATOM 887 CB TYR A 112 39.147 35.171 13.469 1.00 16.84 C ATOM 888 CG TYR A 112 38.964 36.643 13.207 1.00 21.91 C ATOM 889 CD1 TYR A 112 38.528 37.108 11.964 1.00 21.94 C ATOM 890 CD2 TYR A 112 39.216 37.577 14.211 1.00 22.50 C ATOM 891 CE1 TYR A 112 38.352 38.472 11.728 1.00 19.92 C ATOM 892 CE2 TYR A 112 39.044 38.937 13.989 1.00 17.95 C ATOM 893 CZ TYR A 112 38.615 39.378 12.747 1.00 18.18 C ATOM 894 OH TYR A 112 38.467 40.730 12.537 1.00 23.72 O ATOM 895 N ASN A 113 35.852 35.490 13.374 1.00 21.84 N ATOM 896 CA ASN A 113 34.671 35.706 12.540 1.00 21.85 C ATOM 897 C ASN A 113 34.644 37.214 12.312 1.00 22.89 C ATOM 898 O ASN A 113 34.594 37.982 13.272 1.00 23.74 O ATOM 899 CB ASN A 113 33.398 35.276 13.278 1.00 25.33 C ATOM 900 CG ASN A 113 32.139 35.553 12.475 1.00 26.24 C ATOM 901 OD1 ASN A 113 31.727 34.747 11.640 1.00 36.52 O ATOM 902 ND2 ASN A 113 31.532 36.706 12.710 1.00 26.18 N ATOM 903 N ARG A 114 34.681 37.647 11.055 1.00 22.24 N ATOM 904 CA ARG A 114 34.703 39.080 10.776 1.00 24.50 C ATOM 905 C ARG A 114 33.459 39.844 11.214 1.00 25.07 C ATOM 906 O ARG A 114 33.552 41.005 11.604 1.00 25.24 O ATOM 907 CB ARG A 114 34.968 39.344 9.289 1.00 28.82 C ATOM 908 CG ARG A 114 33.859 38.933 8.344 1.00 25.13 C ATOM 909 CD ARG A 114 34.150 39.460 6.941 1.00 37.35 C ATOM 910 NE ARG A 114 34.130 40.922 6.900 1.00 31.12 N ATOM 911 CZ ARG A 114 33.021 41.652 6.967 1.00 37.80 C ATOM 912 NH1 ARG A 114 33.085 42.977 6.929 1.00 39.13 N ATOM 913 NH2 ARG A 114 31.842 41.056 7.059 1.00 40.51 N ATOM 914 N GLU A 115 32.297 39.204 11.155 1.00 27.64 N ATOM 915 CA GLU A 115 31.064 39.872 11.558 1.00 26.96 C ATOM 916 C GLU A 115 31.066 40.163 13.058 1.00 28.04 C ATOM 917 O GLU A 115 30.723 41.265 13.486 1.00 28.66 O ATOM 918 CB GLU A 115 29.857 39.007 11.184 1.00 27.76 C ATOM 919 CG GLU A 115 29.653 38.864 9.683 1.00 39.53 C ATOM 920 CD GLU A 115 29.118 40.132 9.044 1.00 48.25 C ATOM 921 OE1 GLU A 115 27.924 40.441 9.236 1.00 55.50 O ATOM 922 OE2 GLU A 115 29.891 40.827 8.355 1.00 56.68 O ATOM 923 N ALA A 116 31.459 39.172 13.852 1.00 25.95 N ATOM 924 CA ALA A 116 31.514 39.329 15.302 1.00 21.57 C ATOM 925 C ALA A 116 32.569 40.367 15.679 1.00 26.05 C ATOM 926 O ALA A 116 32.363 41.184 16.577 1.00 26.12 O ATOM 927 CB ALA A 116 31.835 37.993 15.957 1.00 19.83 C ATOM 928 N SER A 117 33.702 40.332 14.985 1.00 25.23 N ATOM 929 CA SER A 117 34.785 41.272 15.243 1.00 23.25 C ATOM 930 C SER A 117 34.358 42.692 14.897 1.00 25.09 C ATOM 931 O SER A 117 34.679 43.639 15.614 1.00 24.35 O ATOM 932 CB SER A 117 36.016 40.897 14.415 1.00 22.43 C ATOM 933 OG SER A 117 37.064 41.829 14.606 1.00 29.20 O ATOM 934 N LYS A 118 33.629 42.835 13.795 1.00 25.94 N ATOM 935 CA LYS A 118 33.166 44.146 13.357 1.00 24.03 C ATOM 936 C LYS A 118 32.263 44.784 14.407 1.00 26.53 C ATOM 937 O LYS A 118 32.418 45.957 14.738 1.00 30.13 O ATOM 938 CB LYS A 118 32.413 44.028 12.032 1.00 28.32 C ATOM 939 CG LYS A 118 31.921 45.354 11.478 1.00 30.69 C ATOM 940 CD LYS A 118 31.241 45.163 10.132 1.00 32.80 C ATOM 941 CE LYS A 118 30.748 46.485 9.568 1.00 36.15 C ATOM 942 NZ LYS A 118 30.122 46.321 8.225 1.00 33.39 N ATOM 943 N LYS A 119 31.324 44.005 14.933 1.00 28.99 N ATOM 944 CA LYS A 119 30.413 44.517 15.948 1.00 31.71 C ATOM 945 C LYS A 119 31.207 44.949 17.175 1.00 29.79 C ATOM 946 O LYS A 119 30.959 46.011 17.748 1.00 31.51 O ATOM 947 CB LYS A 119 29.387 43.447 16.331 1.00 32.16 C ATOM 948 CG LYS A 119 28.347 43.913 17.341 1.00 38.23 C ATOM 949 CD LYS A 119 27.254 42.875 17.537 1.00 43.18 C ATOM 950 CE LYS A 119 26.454 42.666 16.261 1.00 44.32 C ATOM 951 NZ LYS A 119 25.381 41.648 16.439 1.00 47.37 N ATOM 952 N ALA A 120 32.174 44.127 17.568 1.00 29.25 N ATOM 953 CA ALA A 120 33.005 44.439 18.722 1.00 29.35 C ATOM 954 C ALA A 120 33.759 45.744 18.489 1.00 26.91 C ATOM 955 O ALA A 120 33.833 46.597 19.372 1.00 28.37 O ATOM 956 CB ALA A 120 33.989 43.306 18.977 1.00 26.73 C ATOM 957 N ASP A 121 34.318 45.893 17.291 1.00 26.97 N ATOM 958 CA ASP A 121 35.073 47.091 16.945 1.00 27.33 C ATOM 959 C ASP A 121 34.191 48.333 16.950 1.00 29.38 C ATOM 960 O ASP A 121 34.585 49.376 17.465 1.00 35.32 O ATOM 961 CB ASP A 121 35.731 46.929 15.571 1.00 34.06 C ATOM 962 CG ASP A 121 36.460 48.185 15.119 1.00 33.86 C ATOM 963 OD1 ASP A 121 37.268 48.729 15.904 1.00 34.52 O ATOM 964 OD2 ASP A 121 36.228 48.627 13.974 1.00 37.30 O ATOM 965 N GLU A 122 32.999 48.219 16.374 1.00 32.33 N ATOM 966 CA GLU A 122 32.078 49.348 16.329 1.00 35.15 C ATOM 967 C GLU A 122 31.633 49.741 17.735 1.00 37.26 C ATOM 968 O GLU A 122 31.164 50.858 17.958 1.00 37.08 O ATOM 969 CB GLU A 122 30.855 49.002 15.477 1.00 34.94 C ATOM 970 CG GLU A 122 31.183 48.706 14.022 1.00 41.78 C ATOM 971 CD GLU A 122 29.945 48.479 13.177 1.00 45.65 C ATOM 972 OE1 GLU A 122 29.136 47.592 13.524 1.00 48.62 O ATOM 973 OE2 GLU A 122 29.783 49.188 12.163 1.00 49.44 O ATOM 974 N ALA A 123 31.787 48.821 18.682 1.00 32.61 N ATOM 975 CA ALA A 123 31.401 49.077 20.065 1.00 33.57 C ATOM 976 C ALA A 123 32.556 49.654 20.879 1.00 31.84 C ATOM 977 O ALA A 123 32.409 49.920 22.074 1.00 34.65 O ATOM 978 CB ALA A 123 30.893 47.795 20.711 1.00 33.56 C ATOM 979 N GLY A 124 33.704 49.841 20.234 1.00 28.94 N ATOM 980 CA GLY A 124 34.857 50.399 20.920 1.00 31.36 C ATOM 981 C GLY A 124 35.784 49.377 21.552 1.00 32.11 C ATOM 982 O GLY A 124 36.716 49.739 22.268 1.00 34.67 O ATOM 983 N LEU A 125 35.534 48.099 21.289 1.00 30.41 N ATOM 984 CA LEU A 125 36.359 47.028 21.839 1.00 30.00 C ATOM 985 C LEU A 125 37.646 46.851 21.052 1.00 27.38 C ATOM 986 O LEU A 125 37.640 46.871 19.822 1.00 28.62 O ATOM 987 CB LEU A 125 35.589 45.705 21.826 1.00 29.03 C ATOM 988 CG LEU A 125 34.473 45.519 22.854 1.00 35.65 C ATOM 989 CD1 LEU A 125 35.090 45.298 24.217 1.00 40.04 C ATOM 990 CD2 LEU A 125 33.550 46.729 22.856 1.00 32.86 C ATOM 991 N ILE A 126 38.751 46.682 21.770 1.00 25.71 N ATOM 992 CA ILE A 126 40.043 46.464 21.139 1.00 24.71 C ATOM 993 C ILE A 126 40.023 45.019 20.657 1.00 23.19 C ATOM 994 O ILE A 126 39.521 44.144 21.357 1.00 21.49 O ATOM 995 CB ILE A 126 41.182 46.633 22.144 1.00 26.69 C ATOM 996 CG1 ILE A 126 41.168 48.056 22.704 1.00 29.76 C ATOM 997 CG2 ILE A 126 42.512 46.340 21.476 1.00 26.12 C ATOM 998 CD1 ILE A 126 42.164 48.275 23.820 1.00 31.41 C ATOM 999 N ILE A 127 40.569 44.770 19.471 1.00 22.10 N ATOM 1000 CA ILE A 127 40.567 43.424 18.914 1.00 22.23 C ATOM 1001 C ILE A 127 41.946 42.791 18.759 1.00 22.36 C ATOM 1002 O ILE A 127 42.843 43.355 18.127 1.00 22.28 O ATOM 1003 CB ILE A 127 39.868 43.418 17.537 1.00 23.56 C ATOM 1004 CG1 ILE A 127 38.452 43.979 17.686 1.00 28.70 C ATOM 1005 CG2 ILE A 127 39.811 41.997 16.966 1.00 21.46 C ATOM 1006 CD1 ILE A 127 37.754 44.229 16.377 1.00 36.24 C ATOM 1007 N VAL A 128 42.114 41.622 19.366 1.00 21.85 N ATOM 1008 CA VAL A 128 43.348 40.862 19.238 1.00 19.59 C ATOM 1009 C VAL A 128 42.841 39.632 18.502 1.00 21.85 C ATOM 1010 O VAL A 128 41.824 39.052 18.890 1.00 17.12 O ATOM 1011 CB VAL A 128 43.940 40.462 20.608 1.00 17.24 C ATOM 1012 CG1 VAL A 128 45.180 39.597 20.404 1.00 17.20 C ATOM 1013 CG2 VAL A 128 44.298 41.714 21.402 1.00 18.10 C ATOM 1014 N ALA A 129 43.512 39.246 17.425 1.00 22.03 N ATOM 1015 CA ALA A 129 43.028 38.105 16.662 1.00 20.07 C ATOM 1016 C ALA A 129 44.095 37.187 16.098 1.00 21.79 C ATOM 1017 O ALA A 129 45.129 37.627 15.578 1.00 20.83 O ATOM 1018 CB ALA A 129 42.116 38.593 15.542 1.00 21.33 C ATOM 1019 N ASN A 130 43.805 35.895 16.198 1.00 18.27 N ATOM 1020 CA ASN A 130 44.683 34.836 15.734 1.00 19.79 C ATOM 1021 C ASN A 130 46.026 34.850 16.453 1.00 18.31 C ATOM 1022 O ASN A 130 47.090 34.825 15.834 1.00 18.49 O ATOM 1023 CB ASN A 130 44.879 34.918 14.221 1.00 23.40 C ATOM 1024 CG ASN A 130 45.097 33.555 13.602 1.00 28.88 C ATOM 1025 OD1 ASN A 130 44.362 32.612 13.900 1.00 30.06 O ATOM 1026 ND2 ASN A 130 46.099 33.441 12.737 1.00 30.96 N ATOM 1027 N ARG A 131 45.944 34.915 17.778 1.00 15.16 N ATOM 1028 CA ARG A 131 47.097 34.889 18.667 1.00 15.33 C ATOM 1029 C ARG A 131 46.614 34.089 19.872 1.00 15.90 C ATOM 1030 O ARG A 131 45.411 33.911 20.059 1.00 18.07 O ATOM 1031 CB ARG A 131 47.483 36.293 19.154 1.00 16.59 C ATOM 1032 CG ARG A 131 47.814 37.317 18.085 1.00 18.54 C ATOM 1033 CD ARG A 131 48.372 38.559 18.772 1.00 17.74 C ATOM 1034 NE ARG A 131 48.442 39.728 17.900 1.00 21.60 N ATOM 1035 CZ ARG A 131 49.574 40.299 17.501 1.00 20.46 C ATOM 1036 NH1 ARG A 131 50.743 39.806 17.887 1.00 24.75 N ATOM 1037 NH2 ARG A 131 49.535 41.374 16.726 1.00 23.39 N ATOM 1038 N CYS A 132 47.546 33.611 20.683 1.00 14.26 N ATOM 1039 CA CYS A 132 47.202 32.860 21.879 1.00 14.52 C ATOM 1040 C CYS A 132 47.697 33.649 23.086 1.00 15.01 C ATOM 1041 O CYS A 132 48.848 34.082 23.109 1.00 17.84 O ATOM 1042 CB CYS A 132 47.868 31.486 21.850 1.00 17.33 C ATOM 1043 SG CYS A 132 47.672 30.555 23.381 1.00 18.96 S ATOM 1044 N MET A 133 46.841 33.845 24.086 1.00 16.29 N ATOM 1045 CA MET A 133 47.251 34.605 25.266 1.00 14.37 C ATOM 1046 C MET A 133 48.496 34.030 25.931 1.00 14.37 C ATOM 1047 O MET A 133 49.355 34.776 26.396 1.00 17.45 O ATOM 1048 CB MET A 133 46.109 34.700 26.283 1.00 18.72 C ATOM 1049 CG MET A 133 44.988 35.645 25.859 1.00 16.73 C ATOM 1050 SD MET A 133 43.929 36.140 27.246 1.00 19.17 S ATOM 1051 CE MET A 133 44.955 37.448 28.001 1.00 16.28 C ATOM 1052 N MET A 134 48.598 32.706 25.974 1.00 15.91 N ATOM 1053 CA MET A 134 49.757 32.067 26.579 1.00 18.96 C ATOM 1054 C MET A 134 51.011 32.265 25.735 1.00 17.99 C ATOM 1055 O MET A 134 52.066 32.640 26.255 1.00 21.32 O ATOM 1056 CB MET A 134 49.511 30.570 26.758 1.00 17.82 C ATOM 1057 CG MET A 134 50.740 29.824 27.226 1.00 16.29 C ATOM 1058 SD MET A 134 50.392 28.090 27.547 1.00 21.48 S ATOM 1059 CE MET A 134 50.404 27.439 25.899 1.00 25.49 C ATOM 1060 N ARG A 135 50.896 31.994 24.437 1.00 15.90 N ATOM 1061 CA ARG A 135 52.021 32.143 23.527 1.00 19.46 C ATOM 1062 C ARG A 135 52.555 33.571 23.561 1.00 19.44 C ATOM 1063 O ARG A 135 53.766 33.789 23.644 1.00 19.75 O ATOM 1064 CB ARG A 135 51.600 31.797 22.098 1.00 22.45 C ATOM 1065 CG ARG A 135 52.776 31.532 21.169 1.00 33.02 C ATOM 1066 CD ARG A 135 52.849 30.057 20.793 1.00 48.74 C ATOM 1067 NE ARG A 135 51.907 29.719 19.728 1.00 53.81 N ATOM 1068 CZ ARG A 135 51.613 28.477 19.354 1.00 59.45 C ATOM 1069 NH1 ARG A 135 50.750 28.267 18.370 1.00 60.71 N ATOM 1070 NH2 ARG A 135 52.170 27.444 19.973 1.00 61.14 N ATOM 1071 N GLU A 136 51.647 34.539 23.485 1.00 16.81 N ATOM 1072 CA GLU A 136 52.038 35.947 23.506 1.00 16.56 C ATOM 1073 C GLU A 136 52.694 36.312 24.832 1.00 17.63 C ATOM 1074 O GLU A 136 53.709 37.016 24.865 1.00 18.12 O ATOM 1075 CB GLU A 136 50.816 36.841 23.264 1.00 15.58 C ATOM 1076 CG GLU A 136 50.225 36.748 21.866 1.00 20.87 C ATOM 1077 CD GLU A 136 51.252 37.012 20.782 1.00 22.58 C ATOM 1078 OE1 GLU A 136 51.891 36.047 20.318 1.00 23.94 O ATOM 1079 OE2 GLU A 136 51.427 38.189 20.403 1.00 22.98 O ATOM 1080 N HIS A 137 52.125 35.832 25.932 1.00 14.54 N ATOM 1081 CA HIS A 137 52.690 36.134 27.236 1.00 17.88 C ATOM 1082 C HIS A 137 54.102 35.570 27.337 1.00 21.84 C ATOM 1083 O HIS A 137 55.034 36.263 27.746 1.00 19.76 O ATOM 1084 CB HIS A 137 51.804 35.562 28.343 1.00 17.87 C ATOM 1085 CG HIS A 137 52.210 35.990 29.718 1.00 16.93 C ATOM 1086 ND1 HIS A 137 53.259 35.412 30.398 1.00 19.40 N ATOM 1087 CD2 HIS A 137 51.719 36.955 30.531 1.00 16.09 C ATOM 1088 CE1 HIS A 137 53.396 36.001 31.572 1.00 19.00 C ATOM 1089 NE2 HIS A 137 52.475 36.941 31.678 1.00 19.35 N ATOM 1090 N GLU A 138 54.262 34.312 26.945 1.00 18.51 N ATOM 1091 CA GLU A 138 55.568 33.671 26.994 1.00 20.17 C ATOM 1092 C GLU A 138 56.635 34.411 26.195 1.00 22.68 C ATOM 1093 O GLU A 138 57.727 34.670 26.703 1.00 23.50 O ATOM 1094 CB GLU A 138 55.474 32.232 26.475 1.00 22.38 C ATOM 1095 CG GLU A 138 54.868 31.248 27.459 1.00 32.22 C ATOM 1096 CD GLU A 138 54.738 29.850 26.878 1.00 39.28 C ATOM 1097 OE1 GLU A 138 54.475 28.905 27.651 1.00 43.64 O ATOM 1098 OE2 GLU A 138 54.892 29.699 25.648 1.00 46.10 O ATOM 1099 N ARG A 139 56.324 34.754 24.949 1.00 21.00 N ATOM 1100 CA ARG A 139 57.307 35.423 24.101 1.00 19.62 C ATOM 1101 C ARG A 139 57.503 36.914 24.359 1.00 24.85 C ATOM 1102 O ARG A 139 58.576 37.453 24.088 1.00 24.83 O ATOM 1103 CB ARG A 139 56.968 35.198 22.622 1.00 23.87 C ATOM 1104 CG ARG A 139 55.852 36.065 22.084 1.00 22.85 C ATOM 1105 CD ARG A 139 55.541 35.734 20.623 1.00 28.93 C ATOM 1106 NE ARG A 139 54.578 36.679 20.069 1.00 27.22 N ATOM 1107 CZ ARG A 139 54.885 37.903 19.648 1.00 19.51 C ATOM 1108 NH1 ARG A 139 53.937 38.699 19.173 1.00 24.04 N ATOM 1109 NH2 ARG A 139 56.145 38.320 19.671 1.00 29.25 N ATOM 1110 N LEU A 140 56.487 37.582 24.894 1.00 21.06 N ATOM 1111 CA LEU A 140 56.595 39.016 25.147 1.00 22.49 C ATOM 1112 C LEU A 140 56.965 39.393 26.574 1.00 22.88 C ATOM 1113 O LEU A 140 57.602 40.425 26.798 1.00 24.43 O ATOM 1114 CB LEU A 140 55.289 39.715 24.767 1.00 20.39 C ATOM 1115 CG LEU A 140 54.889 39.621 23.292 1.00 22.35 C ATOM 1116 CD1 LEU A 140 53.488 40.187 23.101 1.00 20.79 C ATOM 1117 CD2 LEU A 140 55.894 40.378 22.438 1.00 27.67 C ATOM 1118 N LEU A 141 56.575 38.567 27.539 1.00 22.00 N ATOM 1119 CA LEU A 141 56.859 38.859 28.940 1.00 21.76 C ATOM 1120 C LEU A 141 57.654 37.764 29.650 1.00 27.97 C ATOM 1121 O LEU A 141 58.124 37.961 30.772 1.00 28.70 O ATOM 1122 CB LEU A 141 55.545 39.109 29.684 1.00 20.03 C ATOM 1123 CG LEU A 141 54.700 40.300 29.212 1.00 19.69 C ATOM 1124 CD1 LEU A 141 53.315 40.247 29.836 1.00 27.78 C ATOM 1125 CD2 LEU A 141 55.407 41.601 29.585 1.00 22.27 C ATOM 1126 N GLY A 142 57.801 36.616 28.996 1.00 25.74 N ATOM 1127 CA GLY A 142 58.534 35.510 29.586 1.00 29.39 C ATOM 1128 C GLY A 142 60.040 35.642 29.459 1.00 32.30 C ATOM 1129 O GLY A 142 60.543 36.620 28.907 1.00 33.64 O ATOM 1130 N GLU A 143 60.762 34.649 29.971 1.00 34.95 N ATOM 1131 CA GLU A 143 62.220 34.650 29.924 1.00 34.20 C ATOM 1132 C GLU A 143 62.774 33.967 28.674 1.00 37.99 C ATOM 1133 O GLU A 143 62.017 33.448 27.851 1.00 36.38 O ATOM 1134 CB GLU A 143 62.777 33.971 31.179 1.00 39.32 C ATOM 1135 CG GLU A 143 62.426 34.692 32.472 1.00 43.42 C ATOM 1136 CD GLU A 143 62.852 33.921 33.707 1.00 48.80 C ATOM 1137 OE1 GLU A 143 64.043 33.559 33.804 1.00 48.13 O ATOM 1138 OE2 GLU A 143 61.994 33.682 34.583 1.00 47.45 O ATOM 1139 N LYS A 144 64.100 33.984 28.550 1.00 41.57 N ATOM 1140 CA LYS A 144 64.827 33.386 27.428 1.00 48.00 C ATOM 1141 C LYS A 144 64.005 32.394 26.611 1.00 51.94 C ATOM 1142 O LYS A 144 63.810 32.643 25.399 1.00 59.55 O ATOM 1143 CB LYS A 144 66.086 32.682 27.942 1.00 51.69 C ATOM 1144 CG LYS A 144 67.076 33.593 28.654 1.00 52.45 C ATOM 1145 CD LYS A 144 67.754 34.555 27.690 1.00 53.36 C ATOM 1146 CE LYS A 144 68.629 33.814 26.692 1.00 56.92 C ATOM 1147 NZ LYS A 144 69.314 34.746 25.754 1.00 63.07 N ATOM 1148 OXT LYS A 144 63.572 31.376 27.191 1.00 56.74 O TER 1149 LYS A 144 HETATM 1150 O HOH A1001 45.834 33.621 39.171 1.00 21.22 O HETATM 1151 O HOH A1002 49.500 25.103 30.745 1.00 24.09 O HETATM 1152 O HOH A1003 50.169 33.843 19.801 1.00 19.71 O HETATM 1153 O HOH A1004 41.793 33.533 38.919 1.00 22.27 O HETATM 1154 O HOH A1005 36.045 30.895 40.908 1.00 22.21 O HETATM 1155 O HOH A1006 49.968 42.795 13.691 1.00 23.64 O HETATM 1156 O HOH A1007 41.319 35.401 40.926 0.50 19.96 O HETATM 1157 O HOH A1008 52.512 38.530 33.965 1.00 27.05 O HETATM 1158 O HOH A1009 41.258 20.374 34.236 1.00 20.90 O HETATM 1159 O HOH A1010 41.896 27.604 40.914 1.00 25.52 O HETATM 1160 O HOH A1011 46.524 21.502 30.546 1.00 25.43 O HETATM 1161 O HOH A1012 38.076 22.063 39.019 1.00 22.02 O HETATM 1162 O HOH A1013 35.444 32.158 38.506 1.00 23.36 O HETATM 1163 O HOH A1014 40.062 24.459 23.504 1.00 20.97 O HETATM 1164 O HOH A1015 33.888 34.010 40.064 1.00 29.49 O HETATM 1165 O HOH A1016 37.864 31.455 11.182 1.00 25.49 O HETATM 1166 O HOH A1017 36.624 20.878 36.963 1.00 29.28 O HETATM 1167 O HOH A1018 41.358 47.074 17.875 1.00 26.28 O HETATM 1168 O HOH A1019 44.273 28.911 20.530 1.00 22.51 O HETATM 1169 O HOH A1020 56.717 46.614 19.340 1.00 26.00 O HETATM 1170 O HOH A1021 38.894 21.366 35.492 1.00 24.96 O HETATM 1171 O HOH A1022 49.819 34.761 15.891 1.00 30.19 O HETATM 1172 O HOH A1023 53.558 42.744 32.612 1.00 25.89 O HETATM 1173 O HOH A1024 42.932 45.480 16.570 1.00 30.44 O HETATM 1174 O HOH A1025 41.376 33.259 14.587 1.00 35.08 O HETATM 1175 O HOH A1026 55.588 44.638 16.638 1.00 27.46 O HETATM 1176 O HOH A1027 41.930 27.806 19.674 1.00 33.19 O HETATM 1177 O HOH A1028 48.335 25.187 38.652 1.00 41.05 O HETATM 1178 O HOH A1029 42.208 22.178 21.765 1.00 32.66 O HETATM 1179 O HOH A1030 27.788 28.116 37.319 1.00 39.61 O HETATM 1180 O HOH A1031 56.425 31.962 30.662 1.00 31.66 O HETATM 1181 O HOH A1032 26.979 33.180 17.742 1.00 31.55 O HETATM 1182 O HOH A1033 44.013 45.633 14.105 1.00 29.57 O HETATM 1183 O HOH A1034 35.369 33.871 42.469 1.00 30.65 O HETATM 1184 O HOH A1035 53.593 37.256 15.921 1.00 33.45 O HETATM 1185 O HOH A1036 47.685 25.827 23.504 1.00 44.72 O HETATM 1186 O HOH A1037 37.328 24.874 24.036 1.00 37.27 O HETATM 1187 O HOH A1038 28.659 42.485 12.138 1.00 37.03 O HETATM 1188 O HOH A1039 47.536 19.716 32.801 1.00 34.77 O HETATM 1189 O HOH A1040 45.292 40.743 29.132 1.00 25.21 O HETATM 1190 O HOH A1041 31.963 28.098 13.083 1.00 45.18 O HETATM 1191 O HOH A1042 23.134 36.788 25.585 1.00 52.75 O HETATM 1192 O HOH A1043 54.160 47.351 26.306 1.00 33.53 O HETATM 1193 O HOH A1044 55.684 31.669 22.929 1.00 39.73 O HETATM 1194 O HOH A1045 61.814 38.193 25.825 1.00 51.85 O HETATM 1195 O HOH A1046 50.183 39.508 10.472 1.00 32.44 O HETATM 1196 O HOH A1047 52.756 27.836 23.356 1.00 56.09 O HETATM 1197 O HOH A1048 52.917 24.147 36.475 1.00 39.96 O HETATM 1198 O HOH A1049 38.098 52.145 27.374 1.00 55.76 O HETATM 1199 O HOH A1050 38.243 49.092 24.761 1.00 33.61 O HETATM 1200 O HOH A1051 29.127 33.549 41.370 1.00 45.25 O HETATM 1201 O HOH A1052 39.907 16.634 23.098 1.00 48.61 O HETATM 1202 O HOH A1053 33.006 44.328 33.571 1.00 43.53 O HETATM 1203 O HOH A1054 43.357 41.372 38.746 1.00 51.80 O HETATM 1204 O HOH A1055 24.049 45.371 28.979 1.00 40.46 O HETATM 1205 O HOH A1056 51.013 25.953 32.670 1.00 45.19 O HETATM 1206 O HOH A1057 23.898 36.216 28.583 1.00 33.23 O HETATM 1207 O HOH A1058 28.280 27.346 33.468 1.00 31.98 O HETATM 1208 O HOH A1059 37.277 44.258 13.403 1.00 34.80 O HETATM 1209 O HOH A1060 54.208 36.219 35.737 1.00 39.15 O HETATM 1210 O HOH A1061 57.545 40.433 16.387 1.00 49.84 O HETATM 1211 O HOH A1062 43.001 30.638 12.530 1.00 56.28 O HETATM 1212 O HOH A1063 31.212 28.247 26.043 1.00 38.78 O HETATM 1213 O HOH A1064 51.523 36.389 17.549 1.00 31.32 O HETATM 1214 O HOH A1065 51.517 20.739 36.696 1.00 56.72 O HETATM 1215 O HOH A1066 39.589 26.132 30.449 1.00 22.65 O HETATM 1216 O HOH A1067 36.025 26.140 42.847 1.00 27.02 O HETATM 1217 O HOH A1068 35.364 20.458 26.638 1.00 29.78 O HETATM 1218 O HOH A1069 33.430 36.942 39.901 1.00 36.99 O HETATM 1219 O HOH A1070 46.590 27.943 22.295 1.00 34.28 O HETATM 1220 O HOH A1071 54.574 40.266 33.446 1.00 36.85 O HETATM 1221 O HOH A1072 53.207 50.222 19.376 1.00 35.24 O HETATM 1222 O HOH A1073 43.241 32.073 40.926 0.50 31.24 O HETATM 1223 O HOH A1074 44.794 20.521 33.617 1.00 31.33 O HETATM 1224 O HOH A1075 34.826 47.628 11.887 1.00 37.71 O HETATM 1225 O HOH A1076 54.049 39.754 15.095 1.00 48.16 O HETATM 1226 O HOH A1077 33.014 32.273 42.849 1.00 48.90 O HETATM 1227 O HOH A1078 48.192 19.132 28.085 1.00 39.76 O HETATM 1228 O HOH A1079 31.811 25.920 41.242 1.00 40.15 O HETATM 1229 O HOH A1080 36.138 45.493 9.966 1.00 59.27 O HETATM 1230 O HOH A1081 47.857 45.581 36.344 1.00 45.02 O HETATM 1231 O HOH A1082 44.889 43.527 39.365 1.00 46.57 O HETATM 1232 O HOH A1083 30.743 34.402 43.369 1.00 45.55 O HETATM 1233 O HOH A1084 36.123 46.302 31.330 1.00 43.02 O HETATM 1234 O HOH A1085 53.389 44.010 14.221 1.00 52.39 O HETATM 1235 O HOH A1086 40.834 31.956 11.771 1.00 48.31 O HETATM 1236 O HOH A1087 45.112 24.953 38.543 1.00 55.00 O HETATM 1237 O HOH A1088 28.682 26.556 13.476 1.00 52.21 O HETATM 1238 O HOH A1089 59.106 41.697 20.687 1.00 44.17 O HETATM 1239 O HOH A1090 26.403 31.421 26.471 1.00 50.61 O HETATM 1240 O HOH A1091 31.179 26.427 24.186 1.00 47.50 O HETATM 1241 O HOH A1092 28.624 31.732 9.235 1.00 41.92 O HETATM 1242 O HOH A1093 26.701 33.524 13.610 1.00 48.26 O HETATM 1243 O HOH A1094 62.002 31.546 36.559 1.00 56.38 O HETATM 1244 O HOH A1095 45.125 49.801 30.493 1.00 59.07 O HETATM 1245 O HOH A1096 25.972 38.378 38.735 1.00 45.27 O HETATM 1246 O HOH A1097 45.451 47.982 14.148 1.00 48.20 O HETATM 1247 O HOH A1098 33.685 48.570 26.440 1.00 44.16 O HETATM 1248 O HOH A1099 47.772 18.845 24.108 1.00 49.25 O HETATM 1249 O HOH A1100 40.737 50.861 29.945 1.00 47.58 O HETATM 1250 O HOH A1101 52.640 41.768 16.820 1.00 30.44 O HETATM 1251 O HOH A1102 49.164 50.149 17.286 1.00 33.24 O HETATM 1252 O HOH A1103 36.954 22.391 44.132 1.00 40.28 O HETATM 1253 O HOH A1104 33.017 29.706 43.839 1.00 34.62 O HETATM 1254 O HOH A1105 33.504 27.297 42.658 1.00 36.59 O HETATM 1255 O HOH A1106 47.052 17.283 33.728 1.00 36.67 O HETATM 1256 O HOH A1107 48.975 22.495 30.557 1.00 25.47 O HETATM 1257 O HOH A1108 53.410 26.163 31.428 1.00 44.85 O HETATM 1258 O HOH A1109 48.918 17.526 36.074 1.00 47.88 O HETATM 1259 O HOH A1110 45.329 30.048 40.586 1.00 45.83 O HETATM 1260 O HOH A1111 51.820 42.277 34.598 1.00 31.77 O HETATM 1261 O HOH A1112 38.122 44.518 41.828 1.00 68.36 O HETATM 1262 O HOH A1113 49.775 38.782 35.530 1.00 31.43 O HETATM 1263 O HOH A1114 39.959 22.447 42.785 1.00 47.19 O HETATM 1264 O HOH A1115 38.888 47.824 17.798 1.00 36.66 O HETATM 1265 O HOH A1116 46.920 30.717 11.667 1.00 53.22 O HETATM 1266 O HOH A1117 43.423 19.263 35.526 1.00 29.67 O HETATM 1267 O HOH A1118 29.935 24.352 25.057 1.00 44.01 O HETATM 1268 O HOH A1119 38.654 42.230 41.008 1.00 40.05 O HETATM 1269 O HOH A1120 37.798 41.566 10.219 0.50 21.10 O HETATM 1270 O HOH A1121 57.903 45.768 21.526 1.00 48.51 O HETATM 1271 O HOH A1122 37.693 43.754 8.861 1.00 46.42 O HETATM 1272 O HOH A1123 60.000 37.330 32.612 1.00 36.27 O MASTER 300 0 0 6 7 0 0 6 1271 1 0 12 END