Browse entries in the PDBbind-CN Database
HEADER COMPLEX (TRANSCRIPTION ACTIVATOR/DNA) 18-AUG-98 1MHD TITLE CRYSTAL STRUCTURE OF A SMAD MH1 DOMAIN BOUND TO DNA COMPND MOL_ID: 1; COMPND 2 MOLECULE: DNA; COMPND 3 CHAIN: C; COMPND 4 ENGINEERED: YES; COMPND 5 MOL_ID: 2; COMPND 6 MOLECULE: DNA; COMPND 7 CHAIN: D; COMPND 8 ENGINEERED: YES; COMPND 9 MOL_ID: 3; COMPND 10 MOLECULE: SMAD3; COMPND 11 CHAIN: A, B; COMPND 12 FRAGMENT: MH1 DOMAIN, RESIDUES 1 - 144; COMPND 13 SYNONYM: SMAD N-DOMAIN; COMPND 14 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 SYNTHETIC: YES; SOURCE 3 MOL_ID: 2; SOURCE 4 SYNTHETIC: YES; SOURCE 5 MOL_ID: 3; SOURCE 6 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 7 ORGANISM_COMMON: HUMAN; SOURCE 8 ORGANISM_TAXID: 9606; SOURCE 9 CELLULAR_LOCATION: CYTOPLASM; SOURCE 10 GENE: SMAD; SOURCE 11 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 12 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 13 EXPRESSION_SYSTEM_STRAIN: BL21 (DE3); SOURCE 14 EXPRESSION_SYSTEM_CELLULAR_LOCATION: CYTOPLASM; SOURCE 15 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 16 EXPRESSION_SYSTEM_VECTOR: PGEX-2T; SOURCE 17 EXPRESSION_SYSTEM_PLASMID: PGEX KEYWDS COMPLEX (TRANSCRIPTION ACTIVATOR/DNA), SMAD3 MH1, SMAD KEYWDS 2 BINDING ELEMENT, DNA EXPDTA X-RAY DIFFRACTION AUTHOR Y.SHI REVDAT 2 24-FEB-09 1MHD 1 VERSN REVDAT 1 18-AUG-99 1MHD 0 JRNL AUTH Y.SHI,Y.F.WANG,L.JAYARAMAN,H.YANG,J.MASSAGUE, JRNL AUTH 2 N.P.PAVLETICH JRNL TITL CRYSTAL STRUCTURE OF A SMAD MH1 DOMAIN BOUND TO JRNL TITL 2 DNA: INSIGHTS ON DNA BINDING IN TGF-BETA SIGNALING. JRNL REF CELL(CAMBRIDGE,MASS.) V. 94 585 1998 JRNL REFN ISSN 0092-8674 JRNL PMID 9741623 JRNL DOI 10.1016/S0092-8674(00)81600-1 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 2.80 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.1 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.80 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 8.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 2.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 93.6 REMARK 3 NUMBER OF REFLECTIONS : 8490 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : R FACTOR REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING SET) : 0.212 REMARK 3 FREE R VALUE : 0.288 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 402 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 8 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.80 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.92 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 81.30 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 870 REMARK 3 BIN R VALUE (WORKING SET) : 0.3400 REMARK 3 BIN FREE R VALUE : 0.3820 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 5.00 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 39 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2042 REMARK 3 NUCLEIC ACID ATOMS : 548 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 24 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM SIGMAA (A) : NULL REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM C-V SIGMAA (A) : NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.014 REMARK 3 BOND ANGLES (DEGREES) : 1.73 REMARK 3 DIHEDRAL ANGLES (DEGREES) : NULL REMARK 3 IMPROPER ANGLES (DEGREES) : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL 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 : NULL REMARK 3 TOPOLOGY FILE 1 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1MHD COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 05-MAY-98 REMARK 200 TEMPERATURE (KELVIN) : 300 REMARK 200 PH : 5.6 REMARK 200 NUMBER OF CRYSTALS USED : 2 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 REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : NI FILTER REMARK 200 OPTICS : MIRRORS REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : RIGAKU RAXIS IIC REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 9228 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.800 REMARK 200 RESOLUTION RANGE LOW (A) : 20.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 2.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 97.0 REMARK 200 DATA REDUNDANCY : 4.300 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 0.05300 REMARK 200
FOR THE DATA SET : 33.0000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.80 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.90 REMARK 200 COMPLETENESS FOR SHELL (%) : 96.5 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : 0.16200 REMARK 200
FOR SHELL : 9.000 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: NULL REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MIR REMARK 200 SOFTWARE USED: X-PLOR 3.1 REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 36.00 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.43 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PH 5.6 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 30.20000 REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: C, D, A, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 1 REMARK 465 SER A 2 REMARK 465 SER A 3 REMARK 465 ILE A 4 REMARK 465 LEU A 5 REMARK 465 PRO A 6 REMARK 465 PHE A 7 REMARK 465 THR A 8 REMARK 465 PRO A 9 REMARK 465 MET B 1 REMARK 465 SER B 2 REMARK 465 SER B 3 REMARK 465 ILE B 4 REMARK 465 LEU B 5 REMARK 465 PRO B 6 REMARK 465 PHE B 7 REMARK 465 THR B 8 REMARK 465 PRO B 9 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 ARG A 80 N ARG A 80 CA 0.175 REMARK 500 ASN A 114 N ASN A 114 CA 0.180 REMARK 500 SER B 78 C HIS B 79 N -0.147 REMARK 500 ASN B 114 N ASN B 114 CA 0.158 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DA C1011 O4' - C1' - N9 ANGL. DEV. = 2.8 DEGREES REMARK 500 DA D2014 O4' - C1' - N9 ANGL. DEV. = 2.0 DEGREES REMARK 500 ARG A 80 N - CA - CB ANGL. DEV. = 14.2 DEGREES REMARK 500 ARG A 80 N - CA - C ANGL. DEV. = -31.5 DEGREES REMARK 500 ASN A 114 N - CA - C ANGL. DEV. = -22.2 DEGREES REMARK 500 ARG B 80 N - CA - C ANGL. DEV. = -19.5 DEGREES REMARK 500 LEU B 103 CA - CB - CG ANGL. DEV. = 15.6 DEGREES REMARK 500 ASN B 114 N - CA - C ANGL. DEV. = -22.6 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 LYS A 19 75.92 79.62 REMARK 500 GLN A 23 135.73 133.31 REMARK 500 GLN A 26 -8.78 -58.46 REMARK 500 SER A 78 -21.16 64.66 REMARK 500 HIS A 79 -5.32 154.15 REMARK 500 ARG A 93 -75.61 -143.02 REMARK 500 LEU A 97 112.26 -35.03 REMARK 500 GLU A 107 -27.43 68.20 REMARK 500 PHE A 111 45.71 -101.11 REMARK 500 ALA A 112 45.15 -75.66 REMARK 500 PHE A 113 -27.07 62.15 REMARK 500 LYS A 116 33.38 37.95 REMARK 500 LYS B 19 75.21 80.76 REMARK 500 GLN B 23 133.14 133.07 REMARK 500 GLN B 26 -7.72 -58.95 REMARK 500 SER B 78 -23.04 58.48 REMARK 500 HIS B 79 -16.09 155.60 REMARK 500 ARG B 93 -66.07 -145.34 REMARK 500 LEU B 97 113.40 -34.70 REMARK 500 GLU B 107 -27.45 65.19 REMARK 500 PHE B 111 42.53 -98.84 REMARK 500 ALA B 112 38.77 -68.55 REMARK 500 PHE B 113 -27.79 64.69 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: NON-CIS, NON-TRANS REMARK 500 REMARK 500 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH REMARK 500 CIS AND TRANS CONFORMATION. CIS BONDS, IF ANY, ARE LISTED REMARK 500 ON CISPEP RECORDS. TRANS IS DEFINED AS 180 +/- 30 AND REMARK 500 CIS IS DEFINED AS 0 +/- 30 DEGREES. REMARK 500 MODEL OMEGA REMARK 500 HIS A 79 ARG A 80 -135.39 REMARK 500 HIS B 79 ARG B 80 -146.13 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 DG C1003 0.06 SIDE_CHAIN REMARK 500 DA C1011 0.07 SIDE_CHAIN REMARK 500 DT C1012 0.07 SIDE_CHAIN REMARK 500 DT D2003 0.07 SIDE_CHAIN REMARK 500 DG D2004 0.06 SIDE_CHAIN REMARK 500 DA D2008 0.06 SIDE_CHAIN REMARK 500 TYR A 88 0.07 SIDE_CHAIN REMARK 500 TYR B 125 0.07 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL DBREF 1MHD A 1 132 UNP P84022 SMAD3_HUMAN 1 132 DBREF 1MHD B 1 132 UNP P84022 SMAD3_HUMAN 1 132 DBREF 1MHD C 1001 1013 PDB 1MHD 1MHD 1001 1013 DBREF 1MHD D 2001 2014 PDB 1MHD 1MHD 2001 2014 SEQRES 1 C 13 DC DA DG DT DC DT DA DG DA DC DA DT DA SEQRES 1 D 14 DT DA DT DG DT DC DT DA DG DA DC DT DG SEQRES 2 D 14 DA SEQRES 1 A 132 MET SER SER ILE LEU PRO PHE THR PRO PRO ILE VAL LYS SEQRES 2 A 132 ARG LEU LEU GLY TRP LYS LYS GLY GLU GLN ASN GLY GLN SEQRES 3 A 132 GLU GLU LYS TRP CYS GLU LYS ALA VAL LYS SER LEU VAL SEQRES 4 A 132 LYS LYS LEU LYS LYS THR GLY GLN LEU ASP GLU LEU GLU SEQRES 5 A 132 LYS ALA ILE THR THR GLN ASN VAL ASN THR LYS CYS ILE SEQRES 6 A 132 THR ILE PRO ARG SER LEU ASP GLY ARG LEU GLN VAL SER SEQRES 7 A 132 HIS ARG LYS GLY LEU PRO HIS VAL ILE TYR CYS ARG LEU SEQRES 8 A 132 TRP ARG TRP PRO ASP LEU HIS SER HIS HIS GLU LEU ARG SEQRES 9 A 132 ALA MET GLU LEU CYS GLU PHE ALA PHE ASN MET LYS LYS SEQRES 10 A 132 ASP GLU VAL CYS VAL ASN PRO TYR HIS TYR GLN ARG VAL SEQRES 11 A 132 GLU THR SEQRES 1 B 132 MET SER SER ILE LEU PRO PHE THR PRO PRO ILE VAL LYS SEQRES 2 B 132 ARG LEU LEU GLY TRP LYS LYS GLY GLU GLN ASN GLY GLN SEQRES 3 B 132 GLU GLU LYS TRP CYS GLU LYS ALA VAL LYS SER LEU VAL SEQRES 4 B 132 LYS LYS LEU LYS LYS THR GLY GLN LEU ASP GLU LEU GLU SEQRES 5 B 132 LYS ALA ILE THR THR GLN ASN VAL ASN THR LYS CYS ILE SEQRES 6 B 132 THR ILE PRO ARG SER LEU ASP GLY ARG LEU GLN VAL SER SEQRES 7 B 132 HIS ARG LYS GLY LEU PRO HIS VAL ILE TYR CYS ARG LEU SEQRES 8 B 132 TRP ARG TRP PRO ASP LEU HIS SER HIS HIS GLU LEU ARG SEQRES 9 B 132 ALA MET GLU LEU CYS GLU PHE ALA PHE ASN MET LYS LYS SEQRES 10 B 132 ASP GLU VAL CYS VAL ASN PRO TYR HIS TYR GLN ARG VAL SEQRES 11 B 132 GLU THR FORMUL 5 HOH *24(H2 O) HELIX 1 1 ILE A 11 GLY A 17 1 7 HELIX 2 2 GLN A 26 THR A 45 1 20 HELIX 3 3 LEU A 48 THR A 57 1 10 HELIX 4 4 PRO A 84 TRP A 92 1 9 HELIX 5 5 PRO A 124 HIS A 126 5 3 HELIX 6 6 ILE B 11 GLY B 17 1 7 HELIX 7 7 GLN B 26 THR B 45 1 20 HELIX 8 8 LEU B 48 THR B 57 1 10 HELIX 9 9 PRO B 84 TRP B 92 1 9 HELIX 10 10 PRO B 124 HIS B 126 5 3 SHEET 1 A 2 THR A 66 PRO A 68 0 SHEET 2 A 2 GLU A 119 CYS A 121 -1 N VAL A 120 O ILE A 67 SHEET 1 B 2 ARG A 74 VAL A 77 0 SHEET 2 B 2 ARG A 80 LEU A 83 -1 N GLY A 82 O LEU A 75 SHEET 1 C 2 LEU A 103 ALA A 105 0 SHEET 2 C 2 TYR A 127 ARG A 129 -1 N GLN A 128 O ARG A 104 SHEET 1 D 2 THR B 66 PRO B 68 0 SHEET 2 D 2 GLU B 119 CYS B 121 -1 N VAL B 120 O ILE B 67 SHEET 1 E 2 ARG B 74 VAL B 77 0 SHEET 2 E 2 ARG B 80 LEU B 83 -1 N GLY B 82 O LEU B 75 SHEET 1 F 2 LEU B 103 ALA B 105 0 SHEET 2 F 2 TYR B 127 ARG B 129 -1 N GLN B 128 O ARG B 104 SSBOND 1 CYS A 64 CYS A 109 1555 1555 2.21 SSBOND 2 CYS B 109 CYS B 121 1555 1555 2.49 CRYST1 45.600 60.400 71.600 90.00 102.00 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 0.021930 0.000000 0.004661 0.00000 SCALE2 0.000000 0.016556 0.000000 0.00000 SCALE3 0.000000 0.000000 0.014279 0.00000 ATOM 1 O5' DC C1001 11.980 -7.665 57.679 1.00 81.94 O ATOM 2 C5' DC C1001 11.287 -8.213 56.527 1.00 76.85 C ATOM 3 C4' DC C1001 12.242 -8.799 55.510 1.00 69.00 C ATOM 4 O4' DC C1001 11.817 -8.467 54.154 1.00 62.50 O ATOM 5 C3' DC C1001 13.666 -8.264 55.655 1.00 66.92 C ATOM 6 O3' DC C1001 14.617 -9.332 55.621 1.00 70.15 O ATOM 7 C2' DC C1001 13.820 -7.324 54.469 1.00 57.77 C ATOM 8 C1' DC C1001 12.925 -7.966 53.421 1.00 50.57 C ATOM 9 N1 DC C1001 12.443 -6.995 52.420 1.00 34.67 N ATOM 10 C2 DC C1001 12.010 -7.433 51.131 1.00 35.43 C ATOM 11 O2 DC C1001 11.954 -8.659 50.879 1.00 33.42 O ATOM 12 N3 DC C1001 11.668 -6.488 50.191 1.00 26.33 N ATOM 13 C4 DC C1001 11.748 -5.185 50.502 1.00 22.13 C ATOM 14 N4 DC C1001 11.499 -4.282 49.557 1.00 8.30 N ATOM 15 C5 DC C1001 12.115 -4.737 51.805 1.00 24.40 C ATOM 16 C6 DC C1001 12.452 -5.665 52.720 1.00 31.01 C ATOM 17 P DA C1002 16.090 -9.059 55.044 1.00 76.73 P ATOM 18 OP1 DA C1002 17.058 -10.031 55.632 1.00 78.32 O ATOM 19 OP2 DA C1002 16.368 -7.597 55.137 1.00 79.61 O ATOM 20 O5' DA C1002 15.901 -9.424 53.515 1.00 68.11 O ATOM 21 C5' DA C1002 15.218 -10.608 53.157 1.00 52.70 C ATOM 22 C4' DA C1002 15.711 -11.065 51.816 1.00 41.81 C ATOM 23 O4' DA C1002 15.173 -10.187 50.801 1.00 33.76 O ATOM 24 C3' DA C1002 17.227 -10.983 51.695 1.00 38.44 C ATOM 25 O3' DA C1002 17.616 -12.087 50.863 1.00 46.68 O ATOM 26 C2' DA C1002 17.434 -9.621 51.051 1.00 28.43 C ATOM 27 C1' DA C1002 16.225 -9.533 50.136 1.00 28.38 C ATOM 28 N9 DA C1002 15.767 -8.192 49.794 1.00 24.27 N ATOM 29 C8 DA C1002 16.025 -7.008 50.440 1.00 26.36 C ATOM 30 N7 DA C1002 15.527 -5.953 49.830 1.00 26.48 N ATOM 31 C5 DA C1002 14.887 -6.486 48.716 1.00 22.59 C ATOM 32 C6 DA C1002 14.181 -5.889 47.654 1.00 22.81 C ATOM 33 N6 DA C1002 14.008 -4.570 47.535 1.00 19.14 N ATOM 34 N1 DA C1002 13.660 -6.707 46.703 1.00 21.83 N ATOM 35 C2 DA C1002 13.844 -8.033 46.828 1.00 15.39 C ATOM 36 N3 DA C1002 14.490 -8.707 47.778 1.00 18.95 N ATOM 37 C4 DA C1002 15.000 -7.866 48.698 1.00 21.14 C ATOM 38 P DG C1003 19.170 -12.468 50.647 1.00 45.31 P ATOM 39 OP1 DG C1003 19.389 -13.819 51.237 1.00 46.31 O ATOM 40 OP2 DG C1003 20.023 -11.317 51.090 1.00 44.50 O ATOM 41 O5' DG C1003 19.235 -12.668 49.065 1.00 38.83 O ATOM 42 C5' DG C1003 18.376 -13.615 48.419 1.00 35.10 C ATOM 43 C4' DG C1003 18.220 -13.284 46.954 1.00 30.54 C ATOM 44 O4' DG C1003 17.478 -12.036 46.830 1.00 24.39 O ATOM 45 C3' DG C1003 19.560 -13.066 46.237 1.00 35.72 C ATOM 46 O3' DG C1003 19.668 -13.742 44.962 1.00 35.89 O ATOM 47 C2' DG C1003 19.618 -11.561 46.059 1.00 34.28 C ATOM 48 C1' DG C1003 18.158 -11.172 45.938 1.00 24.12 C ATOM 49 N9 DG C1003 17.958 -9.785 46.348 1.00 17.87 N ATOM 50 C8 DG C1003 18.381 -9.212 47.517 1.00 12.97 C ATOM 51 N7 DG C1003 18.190 -7.918 47.544 1.00 16.16 N ATOM 52 C5 DG C1003 17.581 -7.624 46.327 1.00 8.79 C ATOM 53 C6 DG C1003 17.182 -6.372 45.765 1.00 11.01 C ATOM 54 O6 DG C1003 17.311 -5.223 46.235 1.00 9.07 O ATOM 55 N1 DG C1003 16.608 -6.535 44.513 1.00 9.68 N ATOM 56 C2 DG C1003 16.466 -7.735 43.868 1.00 14.55 C ATOM 57 N2 DG C1003 15.943 -7.687 42.636 1.00 17.71 N ATOM 58 N3 DG C1003 16.832 -8.899 44.378 1.00 14.57 N ATOM 59 C4 DG C1003 17.389 -8.768 45.597 1.00 10.92 C ATOM 60 P DT C1004 20.976 -13.500 44.033 1.00 34.47 P ATOM 61 OP1 DT C1004 21.377 -14.781 43.402 1.00 36.97 O ATOM 62 OP2 DT C1004 22.012 -12.708 44.785 1.00 28.26 O ATOM 63 O5' DT C1004 20.391 -12.580 42.869 1.00 31.15 O ATOM 64 C5' DT C1004 19.209 -12.950 42.164 1.00 21.73 C ATOM 65 C4' DT C1004 18.937 -11.970 41.046 1.00 18.90 C ATOM 66 O4' DT C1004 18.649 -10.662 41.593 1.00 20.78 O ATOM 67 C3' DT C1004 20.100 -11.750 40.074 1.00 20.13 C ATOM 68 O3' DT C1004 19.585 -11.505 38.760 1.00 20.97 O ATOM 69 C2' DT C1004 20.723 -10.462 40.574 1.00 15.11 C ATOM 70 C1' DT C1004 19.475 -9.706 40.942 1.00 10.49 C ATOM 71 N1 DT C1004 19.698 -8.605 41.858 1.00 2.00 N ATOM 72 C2 DT C1004 19.261 -7.343 41.517 1.00 9.94 C ATOM 73 O2 DT C1004 18.665 -7.101 40.474 1.00 19.75 O ATOM 74 N3 DT C1004 19.547 -6.369 42.438 1.00 2.00 N ATOM 75 C4 DT C1004 20.211 -6.533 43.619 1.00 3.59 C ATOM 76 O4 DT C1004 20.453 -5.558 44.304 1.00 13.74 O ATOM 77 C5 DT C1004 20.600 -7.903 43.934 1.00 5.84 C ATOM 78 C7 DT C1004 21.256 -8.218 45.240 1.00 2.00 C ATOM 79 C6 DT C1004 20.336 -8.845 43.034 1.00 3.52 C ATOM 80 P DC C1005 20.516 -11.768 37.492 1.00 21.90 P ATOM 81 OP1 DC C1005 19.667 -12.541 36.549 1.00 30.37 O ATOM 82 OP2 DC C1005 21.796 -12.332 37.992 1.00 23.37 O ATOM 83 O5' DC C1005 20.798 -10.322 36.897 1.00 19.21 O ATOM 84 C5' DC C1005 19.738 -9.378 36.804 1.00 15.02 C ATOM 85 C4' DC C1005 20.259 -8.034 36.352 1.00 9.30 C ATOM 86 O4' DC C1005 20.409 -7.126 37.477 1.00 13.38 O ATOM 87 C3' DC C1005 21.599 -8.018 35.613 1.00 8.72 C ATOM 88 O3' DC C1005 21.475 -7.003 34.622 1.00 14.81 O ATOM 89 C2' DC C1005 22.561 -7.507 36.668 1.00 8.73 C ATOM 90 C1' DC C1005 21.678 -6.504 37.404 1.00 7.18 C ATOM 91 N1 DC C1005 22.102 -6.188 38.768 1.00 2.00 N ATOM 92 C2 DC C1005 22.012 -4.891 39.217 1.00 2.13 C ATOM 93 O2 DC C1005 21.601 -4.034 38.458 1.00 2.31 O ATOM 94 N3 DC C1005 22.389 -4.599 40.479 1.00 4.51 N ATOM 95 C4 DC C1005 22.849 -5.568 41.272 1.00 3.38 C ATOM 96 N4 DC C1005 23.184 -5.260 42.508 1.00 6.42 N ATOM 97 C5 DC C1005 22.972 -6.900 40.826 1.00 2.00 C ATOM 98 C6 DC C1005 22.586 -7.165 39.582 1.00 2.35 C ATOM 99 P DT C1006 22.233 -7.123 33.222 1.00 14.12 P ATOM 100 OP1 DT C1006 21.221 -7.105 32.112 1.00 8.95 O ATOM 101 OP2 DT C1006 23.223 -8.229 33.313 1.00 5.92 O ATOM 102 O5' DT C1006 22.963 -5.718 33.185 1.00 10.13 O ATOM 103 C5' DT C1006 22.191 -4.535 33.274 1.00 9.76 C ATOM 104 C4' DT C1006 23.037 -3.388 33.771 1.00 4.90 C ATOM 105 O4' DT C1006 23.283 -3.517 35.182 1.00 6.94 O ATOM 106 C3' DT C1006 24.400 -3.256 33.125 1.00 4.08 C ATOM 107 O3' DT C1006 24.637 -1.874 32.904 1.00 6.06 O ATOM 108 C2' DT C1006 25.327 -3.797 34.193 1.00 4.60 C ATOM 109 C1' DT C1006 24.632 -3.291 35.429 1.00 2.00 C ATOM 110 N1 DT C1006 24.959 -3.947 36.696 1.00 4.15 N ATOM 111 C2 DT C1006 24.897 -3.172 37.817 1.00 2.09 C ATOM 112 O2 DT C1006 24.495 -2.033 37.810 1.00 2.06 O ATOM 113 N3 DT C1006 25.308 -3.793 38.964 1.00 3.57 N ATOM 114 C4 DT C1006 25.727 -5.100 39.103 1.00 7.84 C ATOM 115 O4 DT C1006 26.125 -5.505 40.189 1.00 7.26 O ATOM 116 C5 DT C1006 25.674 -5.890 37.905 1.00 4.23 C ATOM 117 C7 DT C1006 25.980 -7.345 37.993 1.00 5.92 C ATOM 118 C6 DT C1006 25.324 -5.278 36.762 1.00 8.01 C ATOM 119 P DA C1007 24.717 -1.319 31.399 1.00 10.51 P ATOM 120 OP1 DA C1007 23.390 -1.436 30.718 1.00 14.92 O ATOM 121 OP2 DA C1007 25.908 -1.927 30.784 1.00 16.80 O ATOM 122 O5' DA C1007 24.989 0.221 31.595 1.00 9.65 O ATOM 123 C5' DA C1007 23.938 1.076 31.964 1.00 9.12 C ATOM 124 C4' DA C1007 24.466 2.165 32.858 1.00 7.94 C ATOM 125 O4' DA C1007 25.089 1.521 33.989 1.00 12.25 O ATOM 126 C3' DA C1007 25.534 3.056 32.242 1.00 9.91 C ATOM 127 O3' DA C1007 25.239 4.376 32.701 1.00 12.75 O ATOM 128 C2' DA C1007 26.842 2.452 32.757 1.00 8.15 C ATOM 129 C1' DA C1007 26.460 1.821 34.085 1.00 2.00 C ATOM 130 N9 DA C1007 27.122 0.574 34.471 1.00 2.13 N ATOM 131 C8 DA C1007 27.696 -0.395 33.695 1.00 7.95 C ATOM 132 N7 DA C1007 28.157 -1.420 34.385 1.00 7.37 N ATOM 133 C5 DA C1007 27.863 -1.092 35.696 1.00 3.11 C ATOM 134 C6 DA C1007 28.099 -1.748 36.906 1.00 3.27 C ATOM 135 N6 DA C1007 28.619 -2.959 37.013 1.00 13.26 N ATOM 136 N1 DA C1007 27.761 -1.127 38.029 1.00 6.71 N ATOM 137 C2 DA C1007 27.173 0.057 37.938 1.00 16.08 C ATOM 138 N3 DA C1007 26.856 0.759 36.863 1.00 9.13 N ATOM 139 C4 DA C1007 27.244 0.130 35.763 1.00 2.04 C ATOM 140 P DG C1008 26.177 5.615 32.310 1.00 17.27 P ATOM 141 OP1 DG C1008 25.249 6.763 32.342 1.00 21.12 O ATOM 142 OP2 DG C1008 27.060 5.417 31.145 1.00 10.13 O ATOM 143 O5' DG C1008 27.110 5.749 33.574 1.00 16.88 O ATOM 144 C5' DG C1008 26.538 5.856 34.862 1.00 16.38 C ATOM 145 C4' DG C1008 27.639 5.760 35.878 1.00 22.46 C ATOM 146 O4' DG C1008 28.068 4.379 36.001 1.00 22.26 O ATOM 147 C3' DG C1008 28.882 6.551 35.445 1.00 24.29 C ATOM 148 O3' DG C1008 29.534 7.002 36.637 1.00 32.34 O ATOM 149 C2' DG C1008 29.737 5.474 34.803 1.00 22.65 C ATOM 150 C1' DG C1008 29.467 4.334 35.764 1.00 21.24 C ATOM 151 N9 DG C1008 29.847 2.975 35.372 1.00 17.37 N ATOM 152 C8 DG C1008 29.789 2.388 34.130 1.00 17.11 C ATOM 153 N7 DG C1008 30.177 1.137 34.133 1.00 16.14 N ATOM 154 C5 DG C1008 30.519 0.891 35.456 1.00 20.82 C ATOM 155 C6 DG C1008 31.017 -0.281 36.076 1.00 21.11 C ATOM 156 O6 DG C1008 31.296 -1.367 35.554 1.00 21.38 O ATOM 157 N1 DG C1008 31.214 -0.095 37.445 1.00 21.53 N ATOM 158 C2 DG C1008 30.997 1.080 38.128 1.00 22.32 C ATOM 159 N2 DG C1008 31.243 1.074 39.456 1.00 10.26 N ATOM 160 N3 DG C1008 30.565 2.187 37.554 1.00 23.89 N ATOM 161 C4 DG C1008 30.335 2.018 36.229 1.00 21.78 C ATOM 162 P DA C1009 30.432 8.341 36.647 1.00 29.16 P ATOM 163 OP1 DA C1009 29.514 9.408 37.134 1.00 25.58 O ATOM 164 OP2 DA C1009 31.211 8.545 35.391 1.00 26.29 O ATOM 165 O5' DA C1009 31.455 7.968 37.802 1.00 19.12 O ATOM 166 C5' DA C1009 30.980 7.212 38.900 1.00 20.42 C ATOM 167 C4' DA C1009 32.100 6.421 39.510 1.00 20.79 C ATOM 168 O4' DA C1009 32.200 5.102 38.930 1.00 21.22 O ATOM 169 C3' DA C1009 33.439 7.093 39.276 1.00 27.71 C ATOM 170 O3' DA C1009 34.161 7.134 40.486 1.00 39.44 O ATOM 171 C2' DA C1009 34.131 6.179 38.286 1.00 22.61 C ATOM 172 C1' DA C1009 33.551 4.843 38.651 1.00 11.67 C ATOM 173 N9 DA C1009 33.611 3.908 37.550 1.00 7.72 N ATOM 174 C8 DA C1009 33.433 4.186 36.232 1.00 8.86 C ATOM 175 N7 DA C1009 33.628 3.152 35.446 1.00 13.61 N ATOM 176 C5 DA C1009 33.930 2.120 36.322 1.00 6.52 C ATOM 177 C6 DA C1009 34.264 0.762 36.122 1.00 7.53 C ATOM 178 N6 DA C1009 34.311 0.168 34.930 1.00 11.07 N ATOM 179 N1 DA C1009 34.547 0.023 37.204 1.00 6.38 N ATOM 180 C2 DA C1009 34.481 0.603 38.402 1.00 9.15 C ATOM 181 N3 DA C1009 34.171 1.857 38.718 1.00 11.72 N ATOM 182 C4 DA C1009 33.908 2.572 37.619 1.00 6.25 C ATOM 183 P DC C1010 35.249 8.278 40.698 1.00 52.11 P ATOM 184 OP1 DC C1010 34.870 9.007 41.945 1.00 53.50 O ATOM 185 OP2 DC C1010 35.456 9.037 39.430 1.00 54.10 O ATOM 186 O5' DC C1010 36.582 7.447 40.898 1.00 48.11 O ATOM 187 C5' DC C1010 37.045 6.606 39.860 1.00 39.24 C ATOM 188 C4' DC C1010 37.641 5.359 40.455 1.00 34.35 C ATOM 189 O4' DC C1010 37.109 4.227 39.751 1.00 25.47 O ATOM 190 C3' DC C1010 39.154 5.268 40.310 1.00 37.45 C ATOM 191 O3' DC C1010 39.705 4.601 41.448 1.00 46.64 O ATOM 192 C2' DC C1010 39.329 4.436 39.057 1.00 30.45 C ATOM 193 C1' DC C1010 38.141 3.508 39.126 1.00 16.17 C ATOM 194 N1 DC C1010 37.667 3.161 37.810 1.00 9.45 N ATOM 195 C2 DC C1010 37.919 1.908 37.345 1.00 14.22 C ATOM 196 O2 DC C1010 38.450 1.104 38.119 1.00 15.79 O ATOM 197 N3 DC C1010 37.563 1.582 36.068 1.00 21.30 N ATOM 198 C4 DC C1010 36.937 2.493 35.304 1.00 21.55 C ATOM 199 N4 DC C1010 36.629 2.170 34.037 1.00 19.50 N ATOM 200 C5 DC C1010 36.608 3.779 35.800 1.00 12.10 C ATOM 201 C6 DC C1010 36.996 4.069 37.046 1.00 10.00 C ATOM 202 P DA C1011 41.239 4.845 41.846 1.00 51.75 P ATOM 203 OP1 DA C1011 41.434 4.328 43.224 1.00 53.42 O ATOM 204 OP2 DA C1011 41.608 6.253 41.526 1.00 50.26 O ATOM 205 O5' DA C1011 42.009 3.882 40.858 1.00 43.08 O ATOM 206 C5' DA C1011 42.181 2.522 41.178 1.00 44.86 C ATOM 207 C4' DA C1011 42.943 1.874 40.059 1.00 47.25 C ATOM 208 O4' DA C1011 42.049 1.692 38.928 1.00 48.02 O ATOM 209 C3' DA C1011 44.036 2.829 39.573 1.00 52.58 C ATOM 210 O3' DA C1011 45.135 2.067 39.070 1.00 65.64 O ATOM 211 C2' DA C1011 43.354 3.539 38.418 1.00 47.41 C ATOM 212 C1' DA C1011 42.630 2.352 37.826 1.00 39.20 C ATOM 213 N9 DA C1011 41.636 2.601 36.775 1.00 30.34 N ATOM 214 C8 DA C1011 40.942 3.760 36.500 1.00 22.25 C ATOM 215 N7 DA C1011 40.293 3.722 35.360 1.00 18.40 N ATOM 216 C5 DA C1011 40.524 2.440 34.878 1.00 12.72 C ATOM 217 C6 DA C1011 40.113 1.791 33.714 1.00 12.66 C ATOM 218 N6 DA C1011 39.347 2.371 32.803 1.00 18.58 N ATOM 219 N1 DA C1011 40.511 0.510 33.513 1.00 11.60 N ATOM 220 C2 DA C1011 41.258 -0.073 34.464 1.00 15.42 C ATOM 221 N3 DA C1011 41.704 0.436 35.623 1.00 14.99 N ATOM 222 C4 DA C1011 41.307 1.719 35.762 1.00 20.04 C ATOM 223 P DT C1012 46.608 2.300 39.653 1.00 69.25 P ATOM 224 OP1 DT C1012 47.153 0.933 39.920 1.00 70.28 O ATOM 225 OP2 DT C1012 46.486 3.268 40.768 1.00 72.65 O ATOM 226 O5' DT C1012 47.428 3.004 38.466 1.00 64.65 O ATOM 227 C5' DT C1012 47.042 2.849 37.093 1.00 58.36 C ATOM 228 C4' DT C1012 47.008 1.380 36.715 1.00 56.06 C ATOM 229 O4' DT C1012 45.725 1.064 36.125 1.00 51.75 O ATOM 230 C3' DT C1012 48.043 0.927 35.693 1.00 55.08 C ATOM 231 O3' DT C1012 48.314 -0.469 35.869 1.00 59.71 O ATOM 232 C2' DT C1012 47.304 1.108 34.385 1.00 52.49 C ATOM 233 C1' DT C1012 45.866 0.750 34.748 1.00 42.63 C ATOM 234 N1 DT C1012 44.917 1.589 34.005 1.00 27.68 N ATOM 235 C2 DT C1012 44.302 1.081 32.887 1.00 25.02 C ATOM 236 O2 DT C1012 44.383 -0.087 32.545 1.00 30.96 O ATOM 237 N3 DT C1012 43.573 1.990 32.184 1.00 21.97 N ATOM 238 C4 DT C1012 43.370 3.323 32.498 1.00 27.67 C ATOM 239 O4 DT C1012 42.731 4.056 31.721 1.00 34.60 O ATOM 240 C5 DT C1012 43.966 3.757 33.743 1.00 23.62 C ATOM 241 C7 DT C1012 43.727 5.155 34.221 1.00 19.51 C ATOM 242 C6 DT C1012 44.705 2.879 34.418 1.00 21.23 C ATOM 243 P DA C1013 49.639 -1.111 35.215 1.00 61.88 P ATOM 244 OP1 DA C1013 49.862 -2.459 35.820 1.00 60.41 O ATOM 245 OP2 DA C1013 50.689 -0.063 35.306 1.00 57.47 O ATOM 246 O5' DA C1013 49.283 -1.346 33.680 1.00 60.53 O ATOM 247 C5' DA C1013 48.625 -2.551 33.278 1.00 62.47 C ATOM 248 C4' DA C1013 48.379 -2.566 31.785 1.00 60.00 C ATOM 249 O4' DA C1013 47.510 -1.476 31.402 1.00 55.47 O ATOM 250 C3' DA C1013 49.606 -2.429 30.889 1.00 59.86 C ATOM 251 O3' DA C1013 49.175 -3.125 29.698 1.00 63.70 O ATOM 252 C2' DA C1013 49.639 -0.936 30.601 1.00 52.45 C ATOM 253 C1' DA C1013 48.160 -0.671 30.436 1.00 47.33 C ATOM 254 N9 DA C1013 47.704 0.692 30.642 1.00 41.21 N ATOM 255 C8 DA C1013 47.988 1.583 31.644 1.00 38.64 C ATOM 256 N7 DA C1013 47.334 2.717 31.538 1.00 36.85 N ATOM 257 C5 DA C1013 46.586 2.562 30.378 1.00 31.95 C ATOM 258 C6 DA C1013 45.683 3.405 29.705 1.00 28.21 C ATOM 259 N6 DA C1013 45.340 4.632 30.122 1.00 25.97 N ATOM 260 N1 DA C1013 45.132 2.938 28.566 1.00 30.81 N ATOM 261 C2 DA C1013 45.462 1.707 28.144 1.00 35.87 C ATOM 262 N3 DA C1013 46.284 0.827 28.692 1.00 37.02 N ATOM 263 C4 DA C1013 46.819 1.323 29.815 1.00 35.86 C TER 264 DA C1013 ATOM 265 O5' DT D2001 40.746 5.373 23.203 1.00 55.68 O ATOM 266 C5' DT D2001 41.005 5.340 21.811 1.00 61.37 C ATOM 267 C4' DT D2001 41.586 4.023 21.339 1.00 67.04 C ATOM 268 O4' DT D2001 42.788 3.747 22.081 1.00 66.25 O ATOM 269 C3' DT D2001 40.700 2.796 21.513 1.00 69.32 C ATOM 270 O3' DT D2001 40.995 1.865 20.459 1.00 79.92 O ATOM 271 C2' DT D2001 41.118 2.268 22.871 1.00 68.48 C ATOM 272 C1' DT D2001 42.578 2.681 22.994 1.00 65.92 C ATOM 273 N1 DT D2001 42.857 3.226 24.313 1.00 65.00 N ATOM 274 C2 DT D2001 43.912 2.751 25.041 1.00 67.02 C ATOM 275 O2 DT D2001 44.629 1.833 24.663 1.00 71.07 O ATOM 276 N3 DT D2001 44.091 3.384 26.247 1.00 67.37 N ATOM 277 C4 DT D2001 43.303 4.387 26.795 1.00 69.75 C ATOM 278 O4 DT D2001 43.566 4.845 27.919 1.00 75.45 O ATOM 279 C5 DT D2001 42.199 4.815 25.968 1.00 66.76 C ATOM 280 C7 DT D2001 41.283 5.891 26.460 1.00 67.53 C ATOM 281 C6 DT D2001 42.044 4.224 24.789 1.00 64.86 C ATOM 282 P DA D2002 40.480 0.338 20.541 1.00 83.55 P ATOM 283 OP1 DA D2002 41.316 -0.435 19.562 1.00 84.38 O ATOM 284 OP2 DA D2002 38.993 0.282 20.437 1.00 83.22 O ATOM 285 O5' DA D2002 40.899 -0.119 22.003 1.00 75.42 O ATOM 286 C5' DA D2002 42.212 -0.592 22.251 1.00 66.11 C ATOM 287 C4' DA D2002 42.207 -1.450 23.487 1.00 54.61 C ATOM 288 O4' DA D2002 42.319 -0.603 24.651 1.00 45.69 O ATOM 289 C3' DA D2002 40.907 -2.236 23.647 1.00 44.81 C ATOM 290 O3' DA D2002 41.198 -3.578 24.049 1.00 45.86 O ATOM 291 C2' DA D2002 40.164 -1.456 24.717 1.00 39.38 C ATOM 292 C1' DA D2002 41.303 -0.930 25.558 1.00 32.67 C ATOM 293 N9 DA D2002 41.050 0.261 26.355 1.00 27.55 N ATOM 294 C8 DA D2002 40.256 1.352 26.086 1.00 24.25 C ATOM 295 N7 DA D2002 40.305 2.282 27.027 1.00 22.97 N ATOM 296 C5 DA D2002 41.178 1.755 27.980 1.00 17.77 C ATOM 297 C6 DA D2002 41.653 2.239 29.231 1.00 15.22 C ATOM 298 N6 DA D2002 41.287 3.415 29.777 1.00 6.31 N ATOM 299 N1 DA D2002 42.520 1.455 29.920 1.00 13.98 N ATOM 300 C2 DA D2002 42.869 0.274 29.399 1.00 18.32 C ATOM 301 N3 DA D2002 42.489 -0.290 28.247 1.00 22.09 N ATOM 302 C4 DA D2002 41.637 0.508 27.580 1.00 23.27 C ATOM 303 P DT D2003 39.993 -4.581 24.385 1.00 49.46 P ATOM 304 OP1 DT D2003 40.289 -5.968 23.924 1.00 44.83 O ATOM 305 OP2 DT D2003 38.728 -3.921 23.988 1.00 51.67 O ATOM 306 O5' DT D2003 39.981 -4.587 25.963 1.00 46.06 O ATOM 307 C5' DT D2003 41.086 -5.096 26.659 1.00 41.90 C ATOM 308 C4' DT D2003 40.776 -5.103 28.127 1.00 38.71 C ATOM 309 O4' DT D2003 40.814 -3.741 28.595 1.00 39.04 O ATOM 310 C3' DT D2003 39.376 -5.620 28.452 1.00 40.43 C ATOM 311 O3' DT D2003 39.450 -6.465 29.600 1.00 43.28 O ATOM 312 C2' DT D2003 38.625 -4.350 28.810 1.00 37.48 C ATOM 313 C1' DT D2003 39.738 -3.572 29.461 1.00 31.39 C ATOM 314 N1 DT D2003 39.510 -2.148 29.640 1.00 31.11 N ATOM 315 C2 DT D2003 40.034 -1.541 30.774 1.00 30.55 C ATOM 316 O2 DT D2003 40.794 -2.095 31.544 1.00 26.45 O ATOM 317 N3 DT D2003 39.640 -0.248 30.965 1.00 29.52 N ATOM 318 C4 DT D2003 38.822 0.496 30.140 1.00 30.68 C ATOM 319 O4 DT D2003 38.505 1.638 30.475 1.00 32.27 O ATOM 320 C5 DT D2003 38.386 -0.179 28.912 1.00 29.15 C ATOM 321 C7 DT D2003 37.560 0.571 27.913 1.00 30.55 C ATOM 322 C6 DT D2003 38.751 -1.449 28.731 1.00 28.31 C ATOM 323 P DG D2004 38.696 -7.883 29.611 1.00 44.54 P ATOM 324 OP1 DG D2004 39.498 -8.815 28.784 1.00 40.92 O ATOM 325 OP2 DG D2004 37.241 -7.689 29.315 1.00 42.54 O ATOM 326 O5' DG D2004 38.847 -8.326 31.132 1.00 38.59 O ATOM 327 C5' DG D2004 40.108 -8.224 31.773 1.00 35.27 C ATOM 328 C4' DG D2004 39.967 -7.532 33.108 1.00 33.64 C ATOM 329 O4' DG D2004 39.882 -6.085 32.968 1.00 34.09 O ATOM 330 C3' DG D2004 38.739 -7.968 33.898 1.00 32.12 C ATOM 331 O3' DG D2004 39.101 -8.315 35.249 1.00 32.88 O ATOM 332 C2' DG D2004 37.836 -6.746 33.834 1.00 32.74 C ATOM 333 C1' DG D2004 38.833 -5.602 33.777 1.00 28.06 C ATOM 334 N9 DG D2004 38.301 -4.359 33.206 1.00 25.49 N ATOM 335 C8 DG D2004 37.674 -4.185 31.991 1.00 24.30 C ATOM 336 N7 DG D2004 37.181 -2.978 31.840 1.00 19.00 N ATOM 337 C5 DG D2004 37.524 -2.316 33.010 1.00 14.86 C ATOM 338 C6 DG D2004 37.234 -0.998 33.437 1.00 16.29 C ATOM 339 O6 DG D2004 36.604 -0.132 32.857 1.00 17.84 O ATOM 340 N1 DG D2004 37.771 -0.728 34.685 1.00 15.97 N ATOM 341 C2 DG D2004 38.513 -1.616 35.425 1.00 21.25 C ATOM 342 N2 DG D2004 38.968 -1.184 36.618 1.00 17.11 N ATOM 343 N3 DG D2004 38.791 -2.852 35.031 1.00 18.71 N ATOM 344 C4 DG D2004 38.259 -3.134 33.836 1.00 14.98 C ATOM 345 P DT D2005 38.020 -9.041 36.200 1.00 30.50 P ATOM 346 OP1 DT D2005 38.611 -10.220 36.871 1.00 33.60 O ATOM 347 OP2 DT D2005 36.749 -9.197 35.433 1.00 26.73 O ATOM 348 O5' DT D2005 37.829 -7.952 37.325 1.00 22.00 O ATOM 349 C5' DT D2005 38.959 -7.233 37.772 1.00 23.06 C ATOM 350 C4' DT D2005 38.581 -6.403 38.968 1.00 23.84 C ATOM 351 O4' DT D2005 38.070 -5.118 38.555 1.00 21.44 O ATOM 352 C3' DT D2005 37.484 -7.054 39.793 1.00 19.78 C ATOM 353 O3' DT D2005 37.745 -6.779 41.159 1.00 21.47 O ATOM 354 C2' DT D2005 36.223 -6.379 39.277 1.00 16.29 C ATOM 355 C1' DT D2005 36.714 -4.980 38.917 1.00 12.70 C ATOM 356 N1 DT D2005 36.066 -4.312 37.786 1.00 5.77 N ATOM 357 C2 DT D2005 35.859 -2.971 37.914 1.00 8.93 C ATOM 358 O2 DT D2005 36.116 -2.360 38.947 1.00 13.59 O ATOM 359 N3 DT D2005 35.347 -2.357 36.785 1.00 6.50 N ATOM 360 C4 DT D2005 35.048 -2.956 35.574 1.00 6.38 C ATOM 361 O4 DT D2005 34.669 -2.275 34.632 1.00 7.74 O ATOM 362 C5 DT D2005 35.245 -4.388 35.531 1.00 4.16 C ATOM 363 C7 DT D2005 34.916 -5.130 34.275 1.00 2.00 C ATOM 364 C6 DT D2005 35.727 -4.986 36.630 1.00 6.00 C ATOM 365 P DC D2006 36.790 -7.399 42.272 1.00 26.88 P ATOM 366 OP1 DC D2006 37.606 -7.875 43.427 1.00 30.60 O ATOM 367 OP2 DC D2006 35.839 -8.341 41.602 1.00 16.77 O ATOM 368 O5' DC D2006 35.998 -6.107 42.754 1.00 27.89 O ATOM 369 C5' DC D2006 36.647 -4.844 42.841 1.00 19.93 C ATOM 370 C4' DC D2006 35.676 -3.813 43.364 1.00 16.06 C ATOM 371 O4' DC D2006 35.076 -3.165 42.215 1.00 15.11 O ATOM 372 C3' DC D2006 34.512 -4.385 44.187 1.00 15.50 C ATOM 373 O3' DC D2006 34.195 -3.512 45.301 1.00 17.79 O ATOM 374 C2' DC D2006 33.382 -4.440 43.171 1.00 13.62 C ATOM 375 C1' DC D2006 33.669 -3.234 42.294 1.00 2.01 C ATOM 376 N1 DC D2006 33.160 -3.313 40.928 1.00 2.00 N ATOM 377 C2 DC D2006 32.647 -2.164 40.309 1.00 4.81 C ATOM 378 O2 DC D2006 32.595 -1.088 40.938 1.00 11.11 O ATOM 379 N3 DC D2006 32.224 -2.248 39.031 1.00 4.64 N ATOM 380 C4 DC D2006 32.298 -3.414 38.379 1.00 7.27 C ATOM 381 N4 DC D2006 31.903 -3.448 37.114 1.00 6.23 N ATOM 382 C5 DC D2006 32.789 -4.591 38.992 1.00 2.05 C ATOM 383 C6 DC D2006 33.206 -4.493 40.254 1.00 2.01 C ATOM 384 P DT D2007 33.154 -3.989 46.452 1.00 20.74 P ATOM 385 OP1 DT D2007 33.725 -3.563 47.750 1.00 19.04 O ATOM 386 OP2 DT D2007 32.756 -5.405 46.268 1.00 8.35 O ATOM 387 O5' DT D2007 31.880 -3.061 46.200 1.00 17.14 O ATOM 388 C5' DT D2007 31.991 -1.632 46.286 1.00 8.26 C ATOM 389 C4' DT D2007 30.781 -0.957 45.673 1.00 5.74 C ATOM 390 O4' DT D2007 30.630 -1.214 44.254 1.00 2.60 O ATOM 391 C3' DT D2007 29.436 -1.320 46.280 1.00 4.75 C ATOM 392 O3' DT D2007 28.673 -0.128 46.374 1.00 5.51 O ATOM 393 C2' DT D2007 28.802 -2.210 45.227 1.00 2.00 C ATOM 394 C1' DT D2007 29.283 -1.527 43.983 1.00 2.00 C ATOM 395 N1 DT D2007 29.227 -2.327 42.763 1.00 2.00 N ATOM 396 C2 DT D2007 28.895 -1.685 41.625 1.00 2.08 C ATOM 397 O2 DT D2007 28.606 -0.517 41.607 1.00 17.55 O ATOM 398 N3 DT D2007 28.874 -2.452 40.501 1.00 2.00 N ATOM 399 C4 DT D2007 29.117 -3.787 40.412 1.00 4.10 C ATOM 400 O4 DT D2007 29.048 -4.343 39.314 1.00 2.00 O ATOM 401 C5 DT D2007 29.438 -4.434 41.679 1.00 4.78 C ATOM 402 C7 DT D2007 29.680 -5.907 41.717 1.00 4.85 C ATOM 403 C6 DT D2007 29.491 -3.673 42.771 1.00 6.68 C ATOM 404 P DA D2008 27.986 0.255 47.755 1.00 6.59 P ATOM 405 OP1 DA D2008 29.101 0.682 48.617 1.00 13.97 O ATOM 406 OP2 DA D2008 27.096 -0.854 48.180 1.00 9.38 O ATOM 407 O5' DA D2008 27.129 1.532 47.383 1.00 5.13 O ATOM 408 C5' DA D2008 27.781 2.664 46.857 1.00 7.26 C ATOM 409 C4' DA D2008 26.864 3.385 45.913 1.00 2.02 C ATOM 410 O4' DA D2008 26.524 2.497 44.838 1.00 2.04 O ATOM 411 C3' DA D2008 25.565 3.753 46.574 1.00 3.20 C ATOM 412 O3' DA D2008 25.152 4.978 46.017 1.00 10.36 O ATOM 413 C2' DA D2008 24.648 2.598 46.214 1.00 5.64 C ATOM 414 C1' DA D2008 25.173 2.115 44.871 1.00 2.46 C ATOM 415 N9 DA D2008 25.141 0.661 44.616 1.00 6.76 N ATOM 416 C8 DA D2008 25.142 -0.350 45.537 1.00 8.83 C ATOM 417 N7 DA D2008 25.245 -1.544 45.011 1.00 10.81 N ATOM 418 C5 DA D2008 25.291 -1.311 43.651 1.00 6.64 C ATOM 419 C6 DA D2008 25.434 -2.171 42.550 1.00 10.75 C ATOM 420 N6 DA D2008 25.570 -3.501 42.647 1.00 10.13 N ATOM 421 N1 DA D2008 25.438 -1.617 41.320 1.00 11.44 N ATOM 422 C2 DA D2008 25.295 -0.301 41.215 1.00 9.82 C ATOM 423 N3 DA D2008 25.156 0.610 42.173 1.00 15.34 N ATOM 424 C4 DA D2008 25.178 0.035 43.387 1.00 8.62 C ATOM 425 P DG D2009 23.685 5.509 46.333 1.00 16.52 P ATOM 426 OP1 DG D2009 23.785 6.998 46.269 1.00 6.12 O ATOM 427 OP2 DG D2009 23.202 4.831 47.560 1.00 5.97 O ATOM 428 O5' DG D2009 22.802 4.923 45.143 1.00 8.19 O ATOM 429 C5' DG D2009 23.014 5.395 43.823 1.00 11.61 C ATOM 430 C4' DG D2009 22.045 4.754 42.866 1.00 5.63 C ATOM 431 O4' DG D2009 22.370 3.360 42.762 1.00 2.88 O ATOM 432 C3' DG D2009 20.570 4.821 43.259 1.00 12.49 C ATOM 433 O3' DG D2009 19.799 5.110 42.076 1.00 22.77 O ATOM 434 C2' DG D2009 20.300 3.424 43.800 1.00 12.54 C ATOM 435 C1' DG D2009 21.200 2.600 42.912 1.00 5.86 C ATOM 436 N9 DG D2009 21.582 1.276 43.386 1.00 5.04 N ATOM 437 C8 DG D2009 21.812 0.884 44.670 1.00 8.44 C ATOM 438 N7 DG D2009 22.106 -0.389 44.769 1.00 12.37 N ATOM 439 C5 DG D2009 22.052 -0.858 43.462 1.00 10.17 C ATOM 440 C6 DG D2009 22.205 -2.169 42.942 1.00 9.38 C ATOM 441 O6 DG D2009 22.416 -3.212 43.541 1.00 17.67 O ATOM 442 N1 DG D2009 22.068 -2.197 41.576 1.00 8.20 N ATOM 443 C2 DG D2009 21.821 -1.107 40.790 1.00 11.46 C ATOM 444 N2 DG D2009 21.772 -1.320 39.458 1.00 9.77 N ATOM 445 N3 DG D2009 21.646 0.110 41.259 1.00 9.67 N ATOM 446 C4 DG D2009 21.765 0.160 42.596 1.00 6.98 C ATOM 447 P DA D2010 18.197 5.263 42.165 1.00 31.57 P ATOM 448 OP1 DA D2010 17.858 6.589 41.625 1.00 32.71 O ATOM 449 OP2 DA D2010 17.694 4.855 43.509 1.00 33.31 O ATOM 450 O5' DA D2010 17.693 4.179 41.130 1.00 25.52 O ATOM 451 C5' DA D2010 18.457 3.911 39.976 1.00 22.50 C ATOM 452 C4' DA D2010 17.965 2.640 39.348 1.00 23.66 C ATOM 453 O4' DA D2010 18.496 1.471 40.007 1.00 21.90 O ATOM 454 C3' DA D2010 16.452 2.514 39.433 1.00 27.46 C ATOM 455 O3' DA D2010 16.021 2.017 38.178 1.00 40.21 O ATOM 456 C2' DA D2010 16.249 1.479 40.522 1.00 23.98 C ATOM 457 C1' DA D2010 17.440 0.580 40.294 1.00 18.53 C ATOM 458 N9 DA D2010 17.831 -0.215 41.454 1.00 18.37 N ATOM 459 C8 DA D2010 17.893 0.222 42.749 1.00 20.63 C ATOM 460 N7 DA D2010 18.291 -0.694 43.598 1.00 23.33 N ATOM 461 C5 DA D2010 18.514 -1.813 42.805 1.00 13.75 C ATOM 462 C6 DA D2010 18.969 -3.117 43.111 1.00 11.29 C ATOM 463 N6 DA D2010 19.295 -3.502 44.336 1.00 7.48 N ATOM 464 N1 DA D2010 19.070 -4.009 42.106 1.00 6.75 N ATOM 465 C2 DA D2010 18.732 -3.603 40.874 1.00 12.41 C ATOM 466 N3 DA D2010 18.301 -2.398 40.455 1.00 13.24 N ATOM 467 C4 DA D2010 18.218 -1.539 41.484 1.00 14.25 C ATOM 468 P DC D2011 14.468 1.956 37.830 1.00 40.89 P ATOM 469 OP1 DC D2011 14.365 2.560 36.466 1.00 34.16 O ATOM 470 OP2 DC D2011 13.704 2.512 38.978 1.00 41.22 O ATOM 471 O5' DC D2011 14.197 0.395 37.779 1.00 40.59 O ATOM 472 C5' DC D2011 15.216 -0.457 37.280 1.00 41.88 C ATOM 473 C4' DC D2011 14.897 -1.894 37.586 1.00 37.74 C ATOM 474 O4' DC D2011 15.465 -2.266 38.861 1.00 37.67 O ATOM 475 C3' DC D2011 13.415 -2.238 37.663 1.00 36.66 C ATOM 476 O3' DC D2011 13.271 -3.499 37.007 1.00 44.79 O ATOM 477 C2' DC D2011 13.173 -2.368 39.156 1.00 32.81 C ATOM 478 C1' DC D2011 14.491 -2.989 39.576 1.00 31.84 C ATOM 479 N1 DC D2011 14.848 -2.946 40.998 1.00 25.72 N ATOM 480 C2 DC D2011 15.338 -4.111 41.596 1.00 27.75 C ATOM 481 O2 DC D2011 15.474 -5.147 40.901 1.00 23.42 O ATOM 482 N3 DC D2011 15.663 -4.080 42.909 1.00 29.66 N ATOM 483 C4 DC D2011 15.539 -2.942 43.603 1.00 26.55 C ATOM 484 N4 DC D2011 15.907 -2.952 44.882 1.00 34.14 N ATOM 485 C5 DC D2011 15.047 -1.750 43.016 1.00 20.53 C ATOM 486 C6 DC D2011 14.713 -1.797 41.726 1.00 24.74 C ATOM 487 P DT D2012 11.815 -4.072 36.667 1.00 46.07 P ATOM 488 OP1 DT D2012 11.870 -4.520 35.254 1.00 45.49 O ATOM 489 OP2 DT D2012 10.811 -3.053 37.096 1.00 44.97 O ATOM 490 O5' DT D2012 11.686 -5.359 37.600 1.00 45.17 O ATOM 491 C5' DT D2012 12.686 -6.381 37.575 1.00 44.68 C ATOM 492 C4' DT D2012 12.390 -7.448 38.607 1.00 44.65 C ATOM 493 O4' DT D2012 12.854 -7.094 39.932 1.00 41.99 O ATOM 494 C3' DT D2012 10.923 -7.832 38.764 1.00 43.41 C ATOM 495 O3' DT D2012 10.853 -9.253 38.906 1.00 49.84 O ATOM 496 C2' DT D2012 10.522 -7.132 40.053 1.00 36.60 C ATOM 497 C1' DT D2012 11.796 -7.264 40.861 1.00 31.11 C ATOM 498 N1 DT D2012 11.990 -6.297 41.955 1.00 24.20 N ATOM 499 C2 DT D2012 12.428 -6.808 43.135 1.00 25.01 C ATOM 500 O2 DT D2012 12.688 -7.981 43.276 1.00 38.71 O ATOM 501 N3 DT D2012 12.576 -5.903 44.148 1.00 21.29 N ATOM 502 C4 DT D2012 12.360 -4.556 44.087 1.00 23.71 C ATOM 503 O4 DT D2012 12.566 -3.862 45.082 1.00 20.31 O ATOM 504 C5 DT D2012 11.907 -4.070 42.802 1.00 23.50 C ATOM 505 C7 DT D2012 11.629 -2.610 42.637 1.00 28.30 C ATOM 506 C6 DT D2012 11.749 -4.958 41.809 1.00 20.30 C ATOM 507 P DG D2013 9.765 -10.072 38.069 1.00 54.93 P ATOM 508 OP1 DG D2013 10.188 -11.501 37.961 1.00 50.29 O ATOM 509 OP2 DG D2013 9.558 -9.269 36.831 1.00 50.76 O ATOM 510 O5' DG D2013 8.461 -9.991 38.998 1.00 57.01 O ATOM 511 C5' DG D2013 8.405 -9.109 40.132 1.00 54.10 C ATOM 512 C4' DG D2013 8.985 -9.797 41.346 1.00 51.91 C ATOM 513 O4' DG D2013 9.494 -8.845 42.306 1.00 46.62 O ATOM 514 C3' DG D2013 8.055 -10.715 42.127 1.00 52.77 C ATOM 515 O3' DG D2013 8.729 -11.943 42.361 1.00 68.44 O ATOM 516 C2' DG D2013 7.866 -9.990 43.455 1.00 45.40 C ATOM 517 C1' DG D2013 9.210 -9.326 43.601 1.00 32.41 C ATOM 518 N9 DG D2013 9.345 -8.200 44.508 1.00 19.28 N ATOM 519 C8 DG D2013 8.976 -6.900 44.245 1.00 23.56 C ATOM 520 N7 DG D2013 9.310 -6.066 45.200 1.00 14.83 N ATOM 521 C5 DG D2013 9.910 -6.868 46.152 1.00 8.75 C ATOM 522 C6 DG D2013 10.477 -6.508 47.386 1.00 18.50 C ATOM 523 O6 DG D2013 10.559 -5.385 47.872 1.00 13.90 O ATOM 524 N1 DG D2013 10.991 -7.609 48.067 1.00 19.30 N ATOM 525 C2 DG D2013 10.967 -8.911 47.590 1.00 27.99 C ATOM 526 N2 DG D2013 11.521 -9.836 48.411 1.00 28.85 N ATOM 527 N3 DG D2013 10.434 -9.268 46.398 1.00 15.14 N ATOM 528 C4 DG D2013 9.924 -8.196 45.749 1.00 12.25 C ATOM 529 P DA D2014 8.059 -13.311 41.855 1.00 86.35 P ATOM 530 OP1 DA D2014 9.046 -14.028 40.984 1.00 87.79 O ATOM 531 OP2 DA D2014 6.726 -12.931 41.311 1.00 87.78 O ATOM 532 O5' DA D2014 7.764 -14.154 43.178 1.00 78.98 O ATOM 533 C5' DA D2014 6.432 -14.273 43.669 1.00 69.23 C ATOM 534 C4' DA D2014 6.399 -14.004 45.154 1.00 68.00 C ATOM 535 O4' DA D2014 6.970 -12.696 45.462 1.00 63.64 O ATOM 536 C3' DA D2014 4.981 -14.005 45.731 1.00 67.64 C ATOM 537 O3' DA D2014 4.908 -14.764 46.947 1.00 73.36 O ATOM 538 C2' DA D2014 4.708 -12.535 46.004 1.00 65.75 C ATOM 539 C1' DA D2014 6.092 -12.005 46.345 1.00 57.45 C ATOM 540 N9 DA D2014 6.249 -10.548 46.186 1.00 47.86 N ATOM 541 C8 DA D2014 5.836 -9.743 45.143 1.00 44.50 C ATOM 542 N7 DA D2014 6.021 -8.454 45.358 1.00 40.64 N ATOM 543 C5 DA D2014 6.616 -8.404 46.616 1.00 39.16 C ATOM 544 C6 DA D2014 7.043 -7.316 47.443 1.00 35.51 C ATOM 545 N6 DA D2014 6.930 -6.022 47.113 1.00 32.95 N ATOM 546 N1 DA D2014 7.588 -7.617 48.640 1.00 26.30 N ATOM 547 C2 DA D2014 7.699 -8.914 48.985 1.00 31.46 C ATOM 548 N3 DA D2014 7.337 -10.012 48.312 1.00 33.13 N ATOM 549 C4 DA D2014 6.790 -9.688 47.123 1.00 40.66 C TER 550 DA D2014 ATOM 551 N PRO A 10 9.389 -17.838 25.240 1.00 54.81 N ATOM 552 CA PRO A 10 8.601 -16.803 24.538 1.00 47.85 C ATOM 553 C PRO A 10 9.536 -16.246 23.469 1.00 44.62 C ATOM 554 O PRO A 10 10.394 -16.985 22.959 1.00 45.87 O ATOM 555 CB PRO A 10 8.276 -15.739 25.579 1.00 53.07 C ATOM 556 CG PRO A 10 9.549 -15.794 26.468 1.00 53.68 C ATOM 557 CD PRO A 10 9.946 -17.294 26.499 1.00 58.38 C ATOM 558 N ILE A 11 9.409 -14.949 23.183 1.00 37.64 N ATOM 559 CA ILE A 11 10.243 -14.268 22.197 1.00 35.14 C ATOM 560 C ILE A 11 11.744 -14.596 22.342 1.00 33.87 C ATOM 561 O ILE A 11 12.425 -14.844 21.354 1.00 37.08 O ATOM 562 CB ILE A 11 10.008 -12.738 22.243 1.00 35.28 C ATOM 563 CG1 ILE A 11 10.822 -12.042 21.158 1.00 38.27 C ATOM 564 CG2 ILE A 11 10.346 -12.170 23.601 1.00 32.60 C ATOM 565 CD1 ILE A 11 10.353 -12.347 19.756 1.00 41.42 C ATOM 566 N VAL A 12 12.238 -14.635 23.581 1.00 31.80 N ATOM 567 CA VAL A 12 13.639 -14.965 23.881 1.00 23.05 C ATOM 568 C VAL A 12 13.982 -16.378 23.422 1.00 23.87 C ATOM 569 O VAL A 12 14.955 -16.581 22.709 1.00 24.58 O ATOM 570 CB VAL A 12 13.950 -14.851 25.411 1.00 20.24 C ATOM 571 CG1 VAL A 12 15.374 -15.374 25.738 1.00 9.62 C ATOM 572 CG2 VAL A 12 13.747 -13.402 25.889 1.00 14.24 C ATOM 573 N LYS A 13 13.198 -17.359 23.848 1.00 23.19 N ATOM 574 CA LYS A 13 13.471 -18.722 23.441 1.00 24.91 C ATOM 575 C LYS A 13 13.492 -18.817 21.923 1.00 27.38 C ATOM 576 O LYS A 13 14.326 -19.532 21.365 1.00 29.54 O ATOM 577 CB LYS A 13 12.439 -19.676 24.023 1.00 24.93 C ATOM 578 CG LYS A 13 12.541 -19.863 25.525 1.00 25.24 C ATOM 579 CD LYS A 13 13.954 -20.278 25.983 1.00 34.94 C ATOM 580 CE LYS A 13 14.467 -21.628 25.431 1.00 39.35 C ATOM 581 NZ LYS A 13 14.835 -21.634 23.966 1.00 45.70 N ATOM 582 N ARG A 14 12.608 -18.058 21.269 1.00 26.43 N ATOM 583 CA ARG A 14 12.525 -18.046 19.807 1.00 27.74 C ATOM 584 C ARG A 14 13.754 -17.401 19.144 1.00 25.74 C ATOM 585 O ARG A 14 14.427 -18.049 18.329 1.00 26.02 O ATOM 586 CB ARG A 14 11.254 -17.335 19.330 1.00 34.79 C ATOM 587 CG ARG A 14 9.969 -17.841 19.939 1.00 42.89 C ATOM 588 CD ARG A 14 8.734 -17.282 19.198 1.00 54.03 C ATOM 589 NE ARG A 14 7.461 -17.460 19.919 1.00 62.36 N ATOM 590 CZ ARG A 14 7.077 -18.558 20.586 1.00 65.37 C ATOM 591 NH1 ARG A 14 7.839 -19.643 20.676 1.00 67.82 N ATOM 592 NH2 ARG A 14 5.877 -18.590 21.140 1.00 69.39 N ATOM 593 N LEU A 15 14.036 -16.133 19.477 1.00 25.22 N ATOM 594 CA LEU A 15 15.193 -15.392 18.930 1.00 19.91 C ATOM 595 C LEU A 15 16.500 -16.139 19.203 1.00 17.74 C ATOM 596 O LEU A 15 17.429 -16.087 18.418 1.00 19.35 O ATOM 597 CB LEU A 15 15.272 -13.978 19.513 1.00 14.12 C ATOM 598 CG LEU A 15 14.093 -13.053 19.204 1.00 13.08 C ATOM 599 CD1 LEU A 15 14.386 -11.672 19.705 1.00 4.59 C ATOM 600 CD2 LEU A 15 13.815 -13.012 17.742 1.00 2.99 C ATOM 601 N LEU A 16 16.560 -16.812 20.341 1.00 19.08 N ATOM 602 CA LEU A 16 17.710 -17.604 20.719 1.00 22.27 C ATOM 603 C LEU A 16 17.877 -18.690 19.672 1.00 28.45 C ATOM 604 O LEU A 16 18.993 -19.025 19.272 1.00 30.64 O ATOM 605 CB LEU A 16 17.422 -18.260 22.053 1.00 19.32 C ATOM 606 CG LEU A 16 18.153 -17.682 23.239 1.00 18.31 C ATOM 607 CD1 LEU A 16 17.750 -18.484 24.449 1.00 14.06 C ATOM 608 CD2 LEU A 16 19.668 -17.745 23.000 1.00 14.45 C ATOM 609 N GLY A 17 16.736 -19.235 19.250 1.00 32.29 N ATOM 610 CA GLY A 17 16.687 -20.290 18.256 1.00 34.58 C ATOM 611 C GLY A 17 17.583 -20.002 17.077 1.00 37.79 C ATOM 612 O GLY A 17 18.258 -20.899 16.562 1.00 37.36 O ATOM 613 N TRP A 18 17.606 -18.746 16.652 1.00 39.60 N ATOM 614 CA TRP A 18 18.443 -18.349 15.538 1.00 44.26 C ATOM 615 C TRP A 18 19.830 -18.113 16.088 1.00 49.84 C ATOM 616 O TRP A 18 20.246 -16.983 16.278 1.00 57.32 O ATOM 617 CB TRP A 18 17.900 -17.092 14.889 1.00 38.11 C ATOM 618 CG TRP A 18 16.572 -17.309 14.268 1.00 42.06 C ATOM 619 CD1 TRP A 18 15.374 -17.357 14.900 1.00 44.21 C ATOM 620 CD2 TRP A 18 16.299 -17.470 12.886 1.00 43.25 C ATOM 621 NE1 TRP A 18 14.362 -17.525 13.996 1.00 42.46 N ATOM 622 CE2 TRP A 18 14.909 -17.595 12.748 1.00 45.53 C ATOM 623 CE3 TRP A 18 17.095 -17.514 11.747 1.00 48.30 C ATOM 624 CZ2 TRP A 18 14.300 -17.757 11.522 1.00 51.97 C ATOM 625 CZ3 TRP A 18 16.493 -17.673 10.531 1.00 54.45 C ATOM 626 CH2 TRP A 18 15.106 -17.792 10.422 1.00 54.52 C ATOM 627 N LYS A 19 20.522 -19.211 16.363 1.00 58.10 N ATOM 628 CA LYS A 19 21.879 -19.220 16.911 1.00 61.39 C ATOM 629 C LYS A 19 21.872 -18.971 18.427 1.00 66.17 C ATOM 630 O LYS A 19 22.208 -17.895 18.912 1.00 64.05 O ATOM 631 CB LYS A 19 22.794 -18.244 16.166 1.00 55.44 C ATOM 632 CG LYS A 19 24.250 -18.522 16.388 1.00 51.56 C ATOM 633 CD LYS A 19 25.035 -18.581 15.097 1.00 46.68 C ATOM 634 CE LYS A 19 26.472 -18.786 15.442 1.00 51.59 C ATOM 635 NZ LYS A 19 26.599 -19.489 16.770 1.00 53.04 N ATOM 636 N LYS A 20 21.490 -20.023 19.150 1.00 73.39 N ATOM 637 CA LYS A 20 21.397 -20.037 20.605 1.00 77.66 C ATOM 638 C LYS A 20 22.613 -19.433 21.295 1.00 78.28 C ATOM 639 O LYS A 20 22.483 -18.459 22.031 1.00 78.49 O ATOM 640 CB LYS A 20 21.170 -21.473 21.098 1.00 82.24 C ATOM 641 CG LYS A 20 22.276 -22.459 20.702 1.00 87.55 C ATOM 642 CD LYS A 20 22.279 -23.705 21.582 1.00 92.28 C ATOM 643 CE LYS A 20 23.598 -24.470 21.471 1.00 94.05 C ATOM 644 NZ LYS A 20 23.668 -25.610 22.433 1.00 94.00 N ATOM 645 N GLY A 21 23.788 -20.016 21.065 1.00 80.21 N ATOM 646 CA GLY A 21 25.001 -19.510 21.686 1.00 83.80 C ATOM 647 C GLY A 21 26.166 -20.476 21.633 1.00 82.32 C ATOM 648 O GLY A 21 26.115 -21.547 22.240 1.00 78.78 O ATOM 649 N GLU A 22 27.207 -20.100 20.890 1.00 86.46 N ATOM 650 CA GLU A 22 28.393 -20.943 20.751 1.00 90.77 C ATOM 651 C GLU A 22 29.467 -20.616 21.771 1.00 93.52 C ATOM 652 O GLU A 22 29.809 -19.445 21.987 1.00 91.78 O ATOM 653 CB GLU A 22 28.989 -20.872 19.336 1.00 88.70 C ATOM 654 CG GLU A 22 29.034 -22.222 18.606 1.00 82.79 C ATOM 655 CD GLU A 22 27.650 -22.736 18.233 1.00 80.58 C ATOM 656 OE1 GLU A 22 27.080 -22.233 17.237 1.00 77.46 O ATOM 657 OE2 GLU A 22 27.135 -23.637 18.937 1.00 76.74 O ATOM 658 N GLN A 23 30.023 -21.704 22.308 1.00 96.60 N ATOM 659 CA GLN A 23 31.075 -21.794 23.337 1.00 97.37 C ATOM 660 C GLN A 23 30.503 -22.845 24.296 1.00 98.46 C ATOM 661 O GLN A 23 29.301 -22.868 24.600 1.00 99.34 O ATOM 662 CB GLN A 23 31.391 -20.462 24.048 1.00 95.39 C ATOM 663 CG GLN A 23 32.712 -20.422 24.849 1.00 90.06 C ATOM 664 CD GLN A 23 32.697 -21.299 26.092 1.00 88.72 C ATOM 665 OE1 GLN A 23 31.884 -21.106 26.995 1.00 88.94 O ATOM 666 NE2 GLN A 23 33.597 -22.273 26.139 1.00 84.25 N ATOM 667 N ASN A 24 31.365 -23.761 24.706 1.00 97.87 N ATOM 668 CA ASN A 24 30.780 -24.703 25.743 1.00 93.50 C ATOM 669 C ASN A 24 30.666 -24.237 27.180 1.00 87.42 C ATOM 670 O ASN A 24 31.631 -23.733 27.754 1.00 80.63 O ATOM 671 CB ASN A 24 31.692 -25.939 25.651 1.00 97.69 C ATOM 672 CG ASN A 24 31.953 -26.381 24.203 1.00 98.27 C ATOM 673 OD1 ASN A 24 31.139 -27.078 23.591 1.00 96.70 O ATOM 674 ND2 ASN A 24 33.095 -25.967 23.653 1.00 97.51 N ATOM 675 N GLY A 25 29.462 -24.357 27.731 1.00 84.11 N ATOM 676 CA GLY A 25 29.264 -24.001 29.125 1.00 87.42 C ATOM 677 C GLY A 25 28.346 -22.862 29.515 1.00 85.77 C ATOM 678 O GLY A 25 27.219 -22.750 29.032 1.00 88.68 O ATOM 679 N GLN A 26 28.848 -22.021 30.420 1.00 83.75 N ATOM 680 CA GLN A 26 28.128 -20.857 30.944 1.00 80.28 C ATOM 681 C GLN A 26 27.751 -19.931 29.792 1.00 75.71 C ATOM 682 O GLN A 26 27.007 -18.971 29.971 1.00 73.47 O ATOM 683 CB GLN A 26 29.024 -20.105 31.953 1.00 84.83 C ATOM 684 CG GLN A 26 28.319 -19.496 33.190 1.00 86.34 C ATOM 685 CD GLN A 26 27.762 -20.533 34.176 1.00 86.13 C ATOM 686 OE1 GLN A 26 26.848 -20.239 34.945 1.00 85.17 O ATOM 687 NE2 GLN A 26 28.321 -21.738 34.165 1.00 85.20 N ATOM 688 N GLU A 27 28.277 -20.230 28.610 1.00 71.84 N ATOM 689 CA GLU A 27 28.011 -19.441 27.425 1.00 67.73 C ATOM 690 C GLU A 27 26.552 -19.482 26.970 1.00 62.52 C ATOM 691 O GLU A 27 25.940 -18.439 26.766 1.00 63.46 O ATOM 692 CB GLU A 27 28.929 -19.868 26.289 1.00 65.69 C ATOM 693 CG GLU A 27 29.208 -18.745 25.322 1.00 71.24 C ATOM 694 CD GLU A 27 30.137 -17.685 25.890 1.00 73.38 C ATOM 695 OE1 GLU A 27 30.704 -17.895 26.985 1.00 72.92 O ATOM 696 OE2 GLU A 27 30.313 -16.642 25.223 1.00 77.91 O ATOM 697 N GLU A 28 25.980 -20.667 26.833 1.00 56.67 N ATOM 698 CA GLU A 28 24.593 -20.751 26.403 1.00 55.04 C ATOM 699 C GLU A 28 23.684 -19.991 27.351 1.00 51.47 C ATOM 700 O GLU A 28 22.722 -19.361 26.922 1.00 51.08 O ATOM 701 CB GLU A 28 24.130 -22.199 26.296 1.00 58.61 C ATOM 702 CG GLU A 28 22.683 -22.352 25.808 1.00 64.13 C ATOM 703 CD GLU A 28 22.405 -21.642 24.487 1.00 66.98 C ATOM 704 OE1 GLU A 28 23.331 -21.528 23.648 1.00 70.13 O ATOM 705 OE2 GLU A 28 21.251 -21.200 24.290 1.00 65.14 O ATOM 706 N LYS A 29 23.993 -20.051 28.639 1.00 48.41 N ATOM 707 CA LYS A 29 23.203 -19.345 29.644 1.00 46.78 C ATOM 708 C LYS A 29 23.436 -17.831 29.485 1.00 39.69 C ATOM 709 O LYS A 29 22.501 -17.037 29.582 1.00 34.75 O ATOM 710 CB LYS A 29 23.583 -19.857 31.046 1.00 55.26 C ATOM 711 CG LYS A 29 22.909 -19.184 32.255 1.00 63.50 C ATOM 712 CD LYS A 29 23.439 -19.832 33.563 1.00 70.54 C ATOM 713 CE LYS A 29 23.512 -18.866 34.760 1.00 71.47 C ATOM 714 NZ LYS A 29 22.186 -18.489 35.311 1.00 72.13 N ATOM 715 N TRP A 30 24.669 -17.459 29.142 1.00 34.94 N ATOM 716 CA TRP A 30 25.053 -16.063 28.946 1.00 29.17 C ATOM 717 C TRP A 30 24.379 -15.463 27.741 1.00 27.10 C ATOM 718 O TRP A 30 24.013 -14.292 27.750 1.00 28.20 O ATOM 719 CB TRP A 30 26.553 -15.946 28.733 1.00 25.68 C ATOM 720 CG TRP A 30 26.999 -14.538 28.618 1.00 24.07 C ATOM 721 CD1 TRP A 30 27.429 -13.721 29.633 1.00 22.77 C ATOM 722 CD2 TRP A 30 27.106 -13.780 27.420 1.00 22.27 C ATOM 723 NE1 TRP A 30 27.804 -12.505 29.131 1.00 21.87 N ATOM 724 CE2 TRP A 30 27.624 -12.514 27.774 1.00 19.27 C ATOM 725 CE3 TRP A 30 26.834 -14.050 26.078 1.00 25.76 C ATOM 726 CZ2 TRP A 30 27.878 -11.523 26.829 1.00 15.36 C ATOM 727 CZ3 TRP A 30 27.087 -13.058 25.134 1.00 23.60 C ATOM 728 CH2 TRP A 30 27.607 -11.812 25.520 1.00 18.44 C ATOM 729 N CYS A 31 24.328 -16.235 26.666 1.00 26.43 N ATOM 730 CA CYS A 31 23.696 -15.794 25.438 1.00 24.17 C ATOM 731 C CYS A 31 22.232 -15.555 25.724 1.00 26.61 C ATOM 732 O CYS A 31 21.609 -14.689 25.114 1.00 34.09 O ATOM 733 CB CYS A 31 23.827 -16.846 24.354 1.00 20.20 C ATOM 734 SG CYS A 31 25.499 -17.169 23.921 1.00 32.34 S ATOM 735 N GLU A 32 21.685 -16.307 26.669 1.00 23.67 N ATOM 736 CA GLU A 32 20.284 -16.158 27.038 1.00 23.17 C ATOM 737 C GLU A 32 20.084 -14.890 27.841 1.00 19.68 C ATOM 738 O GLU A 32 19.043 -14.257 27.773 1.00 14.56 O ATOM 739 CB GLU A 32 19.835 -17.357 27.847 1.00 30.45 C ATOM 740 CG GLU A 32 18.450 -17.257 28.409 1.00 39.59 C ATOM 741 CD GLU A 32 17.939 -18.606 28.814 1.00 47.50 C ATOM 742 OE1 GLU A 32 18.768 -19.500 29.088 1.00 56.96 O ATOM 743 OE2 GLU A 32 16.709 -18.795 28.833 1.00 54.98 O ATOM 744 N LYS A 33 21.067 -14.567 28.666 1.00 22.39 N ATOM 745 CA LYS A 33 21.014 -13.353 29.458 1.00 21.61 C ATOM 746 C LYS A 33 21.147 -12.199 28.489 1.00 20.01 C ATOM 747 O LYS A 33 20.399 -11.229 28.588 1.00 23.58 O ATOM 748 CB LYS A 33 22.172 -13.296 30.452 1.00 28.73 C ATOM 749 CG LYS A 33 22.123 -14.341 31.556 1.00 34.90 C ATOM 750 CD LYS A 33 20.897 -14.127 32.378 1.00 50.23 C ATOM 751 CE LYS A 33 20.610 -15.305 33.271 1.00 62.23 C ATOM 752 NZ LYS A 33 19.175 -15.256 33.741 1.00 72.03 N ATOM 753 N ALA A 34 22.039 -12.364 27.502 1.00 15.27 N ATOM 754 CA ALA A 34 22.326 -11.340 26.502 1.00 4.84 C ATOM 755 C ALA A 34 21.152 -11.020 25.645 1.00 4.61 C ATOM 756 O ALA A 34 21.012 -9.882 25.203 1.00 4.05 O ATOM 757 CB ALA A 34 23.530 -11.706 25.664 1.00 2.00 C ATOM 758 N VAL A 35 20.305 -12.009 25.380 1.00 10.06 N ATOM 759 CA VAL A 35 19.107 -11.743 24.570 1.00 14.43 C ATOM 760 C VAL A 35 17.999 -11.137 25.436 1.00 15.65 C ATOM 761 O VAL A 35 17.227 -10.323 24.945 1.00 17.46 O ATOM 762 CB VAL A 35 18.550 -12.975 23.848 1.00 13.89 C ATOM 763 CG1 VAL A 35 17.338 -12.555 23.030 1.00 17.07 C ATOM 764 CG2 VAL A 35 19.616 -13.610 22.952 1.00 16.48 C ATOM 765 N LYS A 36 17.945 -11.531 26.718 1.00 16.20 N ATOM 766 CA LYS A 36 16.980 -11.010 27.673 1.00 11.49 C ATOM 767 C LYS A 36 17.159 -9.502 27.848 1.00 18.09 C ATOM 768 O LYS A 36 16.150 -8.776 27.876 1.00 20.94 O ATOM 769 CB LYS A 36 17.116 -11.707 29.014 1.00 16.09 C ATOM 770 CG LYS A 36 16.377 -13.032 29.100 1.00 24.24 C ATOM 771 CD LYS A 36 15.817 -13.292 30.507 1.00 23.55 C ATOM 772 CE LYS A 36 16.706 -14.236 31.330 1.00 33.43 C ATOM 773 NZ LYS A 36 16.829 -15.578 30.677 1.00 44.10 N ATOM 774 N SER A 37 18.415 -9.025 27.973 1.00 15.43 N ATOM 775 CA SER A 37 18.710 -7.575 28.088 1.00 15.03 C ATOM 776 C SER A 37 18.133 -6.822 26.898 1.00 18.98 C ATOM 777 O SER A 37 17.412 -5.836 27.055 1.00 20.51 O ATOM 778 CB SER A 37 20.206 -7.287 28.058 1.00 9.40 C ATOM 779 OG SER A 37 20.842 -7.763 29.212 1.00 30.04 O ATOM 780 N LEU A 38 18.485 -7.302 25.703 1.00 19.62 N ATOM 781 CA LEU A 38 18.045 -6.708 24.471 1.00 10.31 C ATOM 782 C LEU A 38 16.544 -6.661 24.427 1.00 14.70 C ATOM 783 O LEU A 38 15.974 -5.584 24.257 1.00 23.82 O ATOM 784 CB LEU A 38 18.560 -7.504 23.296 1.00 8.97 C ATOM 785 CG LEU A 38 18.342 -6.684 22.048 1.00 13.09 C ATOM 786 CD1 LEU A 38 19.223 -5.432 22.094 1.00 15.99 C ATOM 787 CD2 LEU A 38 18.634 -7.507 20.834 1.00 13.98 C ATOM 788 N VAL A 39 15.891 -7.795 24.677 1.00 15.57 N ATOM 789 CA VAL A 39 14.435 -7.840 24.599 1.00 11.62 C ATOM 790 C VAL A 39 13.764 -6.959 25.602 1.00 13.05 C ATOM 791 O VAL A 39 12.760 -6.351 25.291 1.00 15.27 O ATOM 792 CB VAL A 39 13.852 -9.243 24.710 1.00 13.39 C ATOM 793 CG1 VAL A 39 12.390 -9.139 24.609 1.00 20.09 C ATOM 794 CG2 VAL A 39 14.336 -10.155 23.580 1.00 12.82 C ATOM 795 N LYS A 40 14.319 -6.861 26.800 1.00 19.02 N ATOM 796 CA LYS A 40 13.723 -6.004 27.829 1.00 25.44 C ATOM 797 C LYS A 40 13.699 -4.537 27.404 1.00 23.04 C ATOM 798 O LYS A 40 12.672 -3.849 27.527 1.00 22.87 O ATOM 799 CB LYS A 40 14.487 -6.123 29.150 1.00 33.71 C ATOM 800 CG LYS A 40 13.889 -5.230 30.249 1.00 48.14 C ATOM 801 CD LYS A 40 14.619 -5.336 31.587 1.00 53.50 C ATOM 802 CE LYS A 40 14.565 -6.742 32.165 1.00 57.37 C ATOM 803 NZ LYS A 40 13.166 -7.209 32.378 1.00 59.54 N ATOM 804 N LYS A 41 14.839 -4.078 26.894 1.00 18.70 N ATOM 805 CA LYS A 41 14.988 -2.711 26.453 1.00 13.94 C ATOM 806 C LYS A 41 14.131 -2.439 25.225 1.00 17.42 C ATOM 807 O LYS A 41 13.469 -1.409 25.149 1.00 22.31 O ATOM 808 CB LYS A 41 16.442 -2.393 26.149 1.00 5.23 C ATOM 809 CG LYS A 41 17.427 -2.825 27.228 1.00 5.91 C ATOM 810 CD LYS A 41 18.823 -2.241 26.968 1.00 6.41 C ATOM 811 CE LYS A 41 19.965 -3.044 27.595 1.00 7.86 C ATOM 812 NZ LYS A 41 20.464 -4.218 26.767 1.00 19.84 N ATOM 813 N LEU A 42 14.117 -3.359 24.269 1.00 17.07 N ATOM 814 CA LEU A 42 13.318 -3.146 23.057 1.00 21.58 C ATOM 815 C LEU A 42 11.825 -3.051 23.348 1.00 24.73 C ATOM 816 O LEU A 42 11.130 -2.282 22.692 1.00 30.71 O ATOM 817 CB LEU A 42 13.593 -4.220 21.992 1.00 15.24 C ATOM 818 CG LEU A 42 14.998 -4.175 21.398 1.00 11.46 C ATOM 819 CD1 LEU A 42 15.158 -5.208 20.334 1.00 14.87 C ATOM 820 CD2 LEU A 42 15.244 -2.823 20.798 1.00 15.07 C ATOM 821 N LYS A 43 11.334 -3.844 24.300 1.00 27.07 N ATOM 822 CA LYS A 43 9.924 -3.803 24.669 1.00 33.54 C ATOM 823 C LYS A 43 9.570 -2.365 25.054 1.00 37.37 C ATOM 824 O LYS A 43 8.624 -1.771 24.509 1.00 41.70 O ATOM 825 CB LYS A 43 9.632 -4.693 25.881 1.00 33.42 C ATOM 826 CG LYS A 43 9.304 -6.141 25.592 1.00 40.66 C ATOM 827 CD LYS A 43 8.777 -6.823 26.865 1.00 49.18 C ATOM 828 CE LYS A 43 8.535 -8.324 26.683 1.00 52.16 C ATOM 829 NZ LYS A 43 9.802 -9.126 26.641 1.00 55.67 N ATOM 830 N LYS A 44 10.357 -1.800 25.966 1.00 32.65 N ATOM 831 CA LYS A 44 10.110 -0.447 26.427 1.00 30.15 C ATOM 832 C LYS A 44 10.023 0.567 25.300 1.00 28.54 C ATOM 833 O LYS A 44 9.432 1.622 25.475 1.00 33.07 O ATOM 834 CB LYS A 44 11.194 0.001 27.400 1.00 34.37 C ATOM 835 CG LYS A 44 11.440 -0.937 28.560 1.00 48.74 C ATOM 836 CD LYS A 44 12.597 -0.420 29.432 1.00 56.96 C ATOM 837 CE LYS A 44 12.980 -1.405 30.552 1.00 60.78 C ATOM 838 NZ LYS A 44 14.233 -0.992 31.261 1.00 62.75 N ATOM 839 N THR A 45 10.629 0.274 24.156 1.00 27.79 N ATOM 840 CA THR A 45 10.611 1.211 23.039 1.00 28.22 C ATOM 841 C THR A 45 9.933 0.689 21.792 1.00 31.88 C ATOM 842 O THR A 45 10.050 1.292 20.727 1.00 41.04 O ATOM 843 CB THR A 45 12.019 1.659 22.644 1.00 25.03 C ATOM 844 OG1 THR A 45 12.895 0.522 22.645 1.00 27.24 O ATOM 845 CG2 THR A 45 12.524 2.750 23.580 1.00 25.21 C ATOM 846 N GLY A 46 9.267 -0.453 21.897 1.00 31.67 N ATOM 847 CA GLY A 46 8.561 -0.998 20.749 1.00 25.27 C ATOM 848 C GLY A 46 9.389 -1.224 19.500 1.00 26.06 C ATOM 849 O GLY A 46 9.120 -0.650 18.433 1.00 21.36 O ATOM 850 N GLN A 47 10.416 -2.055 19.647 1.00 25.19 N ATOM 851 CA GLN A 47 11.279 -2.426 18.539 1.00 24.02 C ATOM 852 C GLN A 47 11.454 -3.938 18.533 1.00 25.48 C ATOM 853 O GLN A 47 12.112 -4.488 17.660 1.00 27.72 O ATOM 854 CB GLN A 47 12.643 -1.782 18.699 1.00 22.97 C ATOM 855 CG GLN A 47 12.578 -0.376 19.203 1.00 28.08 C ATOM 856 CD GLN A 47 13.824 0.397 18.892 1.00 27.87 C ATOM 857 OE1 GLN A 47 14.266 0.436 17.754 1.00 30.32 O ATOM 858 NE2 GLN A 47 14.387 1.034 19.894 1.00 28.87 N ATOM 859 N LEU A 48 10.850 -4.624 19.490 1.00 22.00 N ATOM 860 CA LEU A 48 11.007 -6.060 19.552 1.00 24.70 C ATOM 861 C LEU A 48 10.585 -6.772 18.275 1.00 30.06 C ATOM 862 O LEU A 48 11.177 -7.797 17.895 1.00 35.47 O ATOM 863 CB LEU A 48 10.250 -6.625 20.732 1.00 22.18 C ATOM 864 CG LEU A 48 10.909 -7.806 21.435 1.00 28.98 C ATOM 865 CD1 LEU A 48 9.797 -8.809 21.724 1.00 34.57 C ATOM 866 CD2 LEU A 48 12.057 -8.452 20.628 1.00 26.63 C ATOM 867 N ASP A 49 9.584 -6.231 17.591 1.00 33.12 N ATOM 868 CA ASP A 49 9.134 -6.875 16.365 1.00 38.54 C ATOM 869 C ASP A 49 10.057 -6.630 15.184 1.00 40.03 C ATOM 870 O ASP A 49 10.268 -7.535 14.391 1.00 47.03 O ATOM 871 CB ASP A 49 7.683 -6.523 16.037 1.00 44.93 C ATOM 872 CG ASP A 49 6.686 -7.225 16.961 1.00 51.65 C ATOM 873 OD1 ASP A 49 6.574 -8.480 16.894 1.00 56.17 O ATOM 874 OD2 ASP A 49 6.032 -6.528 17.773 1.00 53.15 O ATOM 875 N GLU A 50 10.633 -5.435 15.068 1.00 38.32 N ATOM 876 CA GLU A 50 11.545 -5.170 13.959 1.00 32.40 C ATOM 877 C GLU A 50 12.787 -6.020 14.160 1.00 27.53 C ATOM 878 O GLU A 50 13.487 -6.337 13.201 1.00 25.46 O ATOM 879 CB GLU A 50 11.876 -3.682 13.834 1.00 41.63 C ATOM 880 CG GLU A 50 12.357 -2.985 15.087 1.00 60.80 C ATOM 881 CD GLU A 50 12.457 -1.459 14.950 1.00 67.66 C ATOM 882 OE1 GLU A 50 11.482 -0.815 14.483 1.00 72.12 O ATOM 883 OE2 GLU A 50 13.510 -0.903 15.344 1.00 69.74 O ATOM 884 N LEU A 51 13.019 -6.431 15.411 1.00 22.55 N ATOM 885 CA LEU A 51 14.145 -7.303 15.773 1.00 16.47 C ATOM 886 C LEU A 51 13.761 -8.670 15.267 1.00 20.48 C ATOM 887 O LEU A 51 14.534 -9.351 14.585 1.00 22.33 O ATOM 888 CB LEU A 51 14.252 -7.430 17.263 1.00 9.42 C ATOM 889 CG LEU A 51 15.578 -7.787 17.879 1.00 7.53 C ATOM 890 CD1 LEU A 51 15.257 -8.581 19.087 1.00 2.09 C ATOM 891 CD2 LEU A 51 16.495 -8.510 16.937 1.00 4.27 C ATOM 892 N GLU A 52 12.555 -9.074 15.645 1.00 22.39 N ATOM 893 CA GLU A 52 11.970 -10.338 15.238 1.00 26.83 C ATOM 894 C GLU A 52 12.073 -10.479 13.691 1.00 28.23 C ATOM 895 O GLU A 52 12.566 -11.494 13.183 1.00 29.05 O ATOM 896 CB GLU A 52 10.506 -10.314 15.688 1.00 32.54 C ATOM 897 CG GLU A 52 9.849 -11.646 16.055 1.00 43.34 C ATOM 898 CD GLU A 52 8.375 -11.467 16.481 1.00 48.44 C ATOM 899 OE1 GLU A 52 8.109 -10.846 17.538 1.00 50.30 O ATOM 900 OE2 GLU A 52 7.474 -11.928 15.750 1.00 49.05 O ATOM 901 N LYS A 53 11.674 -9.437 12.952 1.00 25.40 N ATOM 902 CA LYS A 53 11.713 -9.458 11.498 1.00 25.29 C ATOM 903 C LYS A 53 13.130 -9.580 10.977 1.00 24.78 C ATOM 904 O LYS A 53 13.424 -10.503 10.214 1.00 26.70 O ATOM 905 CB LYS A 53 11.063 -8.213 10.897 1.00 34.81 C ATOM 906 CG LYS A 53 10.995 -8.264 9.358 1.00 45.50 C ATOM 907 CD LYS A 53 10.717 -6.895 8.699 1.00 53.20 C ATOM 908 CE LYS A 53 10.642 -6.970 7.146 1.00 57.50 C ATOM 909 NZ LYS A 53 11.875 -7.447 6.434 1.00 58.06 N ATOM 910 N ALA A 54 14.012 -8.666 11.386 1.00 23.34 N ATOM 911 CA ALA A 54 15.421 -8.695 10.946 1.00 21.18 C ATOM 912 C ALA A 54 16.148 -10.023 11.170 1.00 21.12 C ATOM 913 O ALA A 54 16.786 -10.526 10.265 1.00 26.08 O ATOM 914 CB ALA A 54 16.214 -7.566 11.577 1.00 11.69 C ATOM 915 N ILE A 55 16.040 -10.614 12.352 1.00 23.60 N ATOM 916 CA ILE A 55 16.732 -11.878 12.596 1.00 26.51 C ATOM 917 C ILE A 55 16.199 -13.032 11.766 1.00 29.04 C ATOM 918 O ILE A 55 16.975 -13.853 11.279 1.00 27.22 O ATOM 919 CB ILE A 55 16.683 -12.292 14.078 1.00 28.08 C ATOM 920 CG1 ILE A 55 17.470 -11.296 14.932 1.00 22.84 C ATOM 921 CG2 ILE A 55 17.205 -13.718 14.245 1.00 27.42 C ATOM 922 CD1 ILE A 55 18.856 -11.030 14.417 1.00 29.01 C ATOM 923 N THR A 56 14.874 -13.119 11.659 1.00 31.43 N ATOM 924 CA THR A 56 14.245 -14.187 10.897 1.00 34.00 C ATOM 925 C THR A 56 14.376 -13.981 9.385 1.00 39.63 C ATOM 926 O THR A 56 14.988 -14.809 8.700 1.00 47.60 O ATOM 927 CB THR A 56 12.771 -14.377 11.292 1.00 27.39 C ATOM 928 OG1 THR A 56 12.044 -13.183 11.023 1.00 26.02 O ATOM 929 CG2 THR A 56 12.661 -14.669 12.764 1.00 26.23 C ATOM 930 N THR A 57 13.868 -12.860 8.873 1.00 37.75 N ATOM 931 CA THR A 57 13.934 -12.576 7.438 1.00 35.41 C ATOM 932 C THR A 57 15.318 -12.236 6.894 1.00 34.37 C ATOM 933 O THR A 57 15.547 -12.300 5.692 1.00 40.48 O ATOM 934 CB THR A 57 12.980 -11.457 7.055 1.00 37.35 C ATOM 935 OG1 THR A 57 13.477 -10.208 7.545 1.00 40.70 O ATOM 936 CG2 THR A 57 11.631 -11.711 7.662 1.00 41.51 C ATOM 937 N GLN A 58 16.229 -11.824 7.765 1.00 34.10 N ATOM 938 CA GLN A 58 17.585 -11.482 7.346 1.00 29.99 C ATOM 939 C GLN A 58 17.591 -10.325 6.353 1.00 29.75 C ATOM 940 O GLN A 58 18.520 -10.184 5.563 1.00 32.58 O ATOM 941 CB GLN A 58 18.227 -12.705 6.727 1.00 30.45 C ATOM 942 CG GLN A 58 18.048 -13.902 7.619 1.00 43.49 C ATOM 943 CD GLN A 58 18.411 -15.201 6.945 1.00 51.99 C ATOM 944 OE1 GLN A 58 19.565 -15.411 6.557 1.00 54.11 O ATOM 945 NE2 GLN A 58 17.433 -16.102 6.819 1.00 54.44 N ATOM 946 N ASN A 59 16.555 -9.489 6.407 1.00 28.78 N ATOM 947 CA ASN A 59 16.408 -8.339 5.514 1.00 24.44 C ATOM 948 C ASN A 59 17.337 -7.194 5.938 1.00 21.66 C ATOM 949 O ASN A 59 17.133 -6.552 6.967 1.00 20.42 O ATOM 950 CB ASN A 59 14.935 -7.870 5.503 1.00 25.77 C ATOM 951 CG ASN A 59 14.608 -6.950 4.320 1.00 28.81 C ATOM 952 OD1 ASN A 59 15.381 -6.861 3.372 1.00 36.43 O ATOM 953 ND2 ASN A 59 13.456 -6.284 4.368 1.00 23.65 N ATOM 954 N VAL A 60 18.359 -6.929 5.144 1.00 18.66 N ATOM 955 CA VAL A 60 19.287 -5.862 5.492 1.00 19.10 C ATOM 956 C VAL A 60 18.562 -4.563 5.636 1.00 14.80 C ATOM 957 O VAL A 60 18.902 -3.746 6.454 1.00 18.41 O ATOM 958 CB VAL A 60 20.384 -5.637 4.423 1.00 21.82 C ATOM 959 CG1 VAL A 60 21.238 -4.408 4.784 1.00 21.08 C ATOM 960 CG2 VAL A 60 21.277 -6.881 4.293 1.00 28.70 C ATOM 961 N ASN A 61 17.560 -4.330 4.830 1.00 20.48 N ATOM 962 CA ASN A 61 16.923 -3.047 4.979 1.00 29.86 C ATOM 963 C ASN A 61 15.719 -3.029 5.899 1.00 33.45 C ATOM 964 O ASN A 61 14.563 -2.791 5.497 1.00 37.27 O ATOM 965 CB ASN A 61 16.701 -2.310 3.635 1.00 32.20 C ATOM 966 CG ASN A 61 15.955 -3.126 2.640 1.00 31.99 C ATOM 967 OD1 ASN A 61 15.668 -4.295 2.866 1.00 38.36 O ATOM 968 ND2 ASN A 61 15.649 -2.524 1.514 1.00 35.84 N ATOM 969 N THR A 62 16.017 -3.351 7.149 1.00 31.18 N ATOM 970 CA THR A 62 15.039 -3.329 8.219 1.00 30.26 C ATOM 971 C THR A 62 15.351 -2.021 8.962 1.00 32.99 C ATOM 972 O THR A 62 16.398 -1.386 8.711 1.00 34.61 O ATOM 973 CB THR A 62 15.225 -4.541 9.167 1.00 27.30 C ATOM 974 OG1 THR A 62 16.532 -5.098 8.980 1.00 29.42 O ATOM 975 CG2 THR A 62 14.198 -5.614 8.893 1.00 20.87 C ATOM 976 N LYS A 63 14.449 -1.590 9.840 1.00 31.07 N ATOM 977 CA LYS A 63 14.671 -0.365 10.597 1.00 24.66 C ATOM 978 C LYS A 63 15.910 -0.573 11.509 1.00 25.66 C ATOM 979 O LYS A 63 16.396 -1.699 11.727 1.00 18.19 O ATOM 980 CB LYS A 63 13.456 -0.033 11.471 1.00 25.65 C ATOM 981 CG LYS A 63 12.178 0.340 10.756 1.00 29.50 C ATOM 982 CD LYS A 63 11.374 -0.882 10.268 1.00 37.70 C ATOM 983 CE LYS A 63 11.146 -1.987 11.319 1.00 28.04 C ATOM 984 NZ LYS A 63 12.265 -2.969 11.295 1.00 19.92 N ATOM 985 N CYS A 64 16.440 0.523 12.019 1.00 19.04 N ATOM 986 CA CYS A 64 17.563 0.429 12.881 1.00 13.16 C ATOM 987 C CYS A 64 16.947 0.105 14.216 1.00 17.91 C ATOM 988 O CYS A 64 15.971 0.742 14.590 1.00 21.08 O ATOM 989 CB CYS A 64 18.322 1.753 12.908 1.00 15.34 C ATOM 990 SG CYS A 64 19.870 1.641 11.969 1.00 12.87 S ATOM 991 N ILE A 65 17.393 -1.017 14.795 1.00 17.76 N ATOM 992 CA ILE A 65 16.990 -1.521 16.113 1.00 9.96 C ATOM 993 C ILE A 65 17.993 -0.788 17.006 1.00 11.17 C ATOM 994 O ILE A 65 19.178 -1.068 17.008 1.00 18.83 O ATOM 995 CB ILE A 65 17.232 -3.044 16.226 1.00 12.08 C ATOM 996 CG1 ILE A 65 16.178 -3.836 15.456 1.00 14.53 C ATOM 997 CG2 ILE A 65 17.181 -3.468 17.668 1.00 18.41 C ATOM 998 CD1 ILE A 65 16.127 -3.599 13.964 1.00 16.47 C ATOM 999 N THR A 66 17.509 0.097 17.834 1.00 13.88 N ATOM 1000 CA THR A 66 18.353 0.920 18.633 1.00 11.45 C ATOM 1001 C THR A 66 18.341 0.706 20.125 1.00 15.84 C ATOM 1002 O THR A 66 17.288 0.536 20.734 1.00 23.75 O ATOM 1003 CB THR A 66 17.951 2.340 18.303 1.00 15.12 C ATOM 1004 OG1 THR A 66 18.681 2.788 17.162 1.00 23.55 O ATOM 1005 CG2 THR A 66 18.118 3.259 19.445 1.00 23.10 C ATOM 1006 N ILE A 67 19.523 0.811 20.719 1.00 18.19 N ATOM 1007 CA ILE A 67 19.742 0.697 22.158 1.00 20.06 C ATOM 1008 C ILE A 67 20.562 1.966 22.563 1.00 29.09 C ATOM 1009 O ILE A 67 21.436 2.415 21.806 1.00 33.34 O ATOM 1010 CB ILE A 67 20.440 -0.651 22.475 1.00 16.45 C ATOM 1011 CG1 ILE A 67 19.463 -1.551 23.219 1.00 19.61 C ATOM 1012 CG2 ILE A 67 21.746 -0.482 23.253 1.00 11.48 C ATOM 1013 CD1 ILE A 67 18.340 -2.014 22.368 1.00 15.50 C ATOM 1014 N PRO A 68 20.266 2.582 23.734 1.00 30.35 N ATOM 1015 CA PRO A 68 20.952 3.794 24.231 1.00 26.40 C ATOM 1016 C PRO A 68 22.416 3.573 24.452 1.00 23.25 C ATOM 1017 O PRO A 68 22.788 2.533 24.968 1.00 33.75 O ATOM 1018 CB PRO A 68 20.305 4.037 25.601 1.00 23.49 C ATOM 1019 CG PRO A 68 19.041 3.249 25.576 1.00 30.08 C ATOM 1020 CD PRO A 68 19.408 2.018 24.789 1.00 31.16 C ATOM 1021 N ARG A 69 23.255 4.539 24.113 1.00 20.91 N ATOM 1022 CA ARG A 69 24.667 4.342 24.363 1.00 18.17 C ATOM 1023 C ARG A 69 25.045 4.810 25.779 1.00 18.64 C ATOM 1024 O ARG A 69 24.294 5.522 26.466 1.00 22.49 O ATOM 1025 CB ARG A 69 25.541 4.982 23.272 1.00 17.07 C ATOM 1026 CG ARG A 69 26.031 6.402 23.514 1.00 20.62 C ATOM 1027 CD ARG A 69 27.376 6.620 22.826 1.00 16.85 C ATOM 1028 NE ARG A 69 27.268 6.385 21.394 1.00 22.81 N ATOM 1029 CZ ARG A 69 28.113 5.649 20.687 1.00 28.45 C ATOM 1030 NH1 ARG A 69 29.144 5.066 21.286 1.00 33.84 N ATOM 1031 NH2 ARG A 69 27.924 5.502 19.377 1.00 24.69 N ATOM 1032 N SER A 70 26.207 4.373 26.224 1.00 16.11 N ATOM 1033 CA SER A 70 26.713 4.685 27.532 1.00 9.83 C ATOM 1034 C SER A 70 27.979 5.516 27.366 1.00 13.91 C ATOM 1035 O SER A 70 28.552 5.534 26.286 1.00 19.10 O ATOM 1036 CB SER A 70 27.004 3.352 28.206 1.00 10.76 C ATOM 1037 OG SER A 70 27.414 2.380 27.257 1.00 14.16 O ATOM 1038 N LEU A 71 28.417 6.209 28.411 1.00 15.04 N ATOM 1039 CA LEU A 71 29.621 7.018 28.309 1.00 19.52 C ATOM 1040 C LEU A 71 30.763 6.305 27.593 1.00 20.49 C ATOM 1041 O LEU A 71 31.261 6.798 26.576 1.00 31.16 O ATOM 1042 CB LEU A 71 30.084 7.499 29.683 1.00 29.35 C ATOM 1043 CG LEU A 71 29.433 8.739 30.318 1.00 34.10 C ATOM 1044 CD1 LEU A 71 29.066 9.741 29.221 1.00 38.85 C ATOM 1045 CD2 LEU A 71 28.205 8.360 31.136 1.00 32.64 C ATOM 1046 N ASP A 72 31.168 5.140 28.080 1.00 14.36 N ATOM 1047 CA ASP A 72 32.248 4.440 27.398 1.00 21.32 C ATOM 1048 C ASP A 72 31.790 3.661 26.156 1.00 23.44 C ATOM 1049 O ASP A 72 32.614 3.184 25.364 1.00 26.76 O ATOM 1050 CB ASP A 72 33.100 3.575 28.366 1.00 24.46 C ATOM 1051 CG ASP A 72 32.332 2.423 29.030 1.00 29.86 C ATOM 1052 OD1 ASP A 72 31.124 2.233 28.785 1.00 39.45 O ATOM 1053 OD2 ASP A 72 32.961 1.684 29.822 1.00 31.40 O ATOM 1054 N GLY A 73 30.472 3.534 26.003 1.00 21.95 N ATOM 1055 CA GLY A 73 29.906 2.825 24.876 1.00 20.10 C ATOM 1056 C GLY A 73 29.850 1.323 25.029 1.00 20.54 C ATOM 1057 O GLY A 73 29.518 0.624 24.075 1.00 26.83 O ATOM 1058 N ARG A 74 30.190 0.814 26.209 1.00 19.64 N ATOM 1059 CA ARG A 74 30.162 -0.628 26.467 1.00 15.66 C ATOM 1060 C ARG A 74 28.828 -1.074 27.029 1.00 14.52 C ATOM 1061 O ARG A 74 28.039 -0.255 27.517 1.00 23.34 O ATOM 1062 CB ARG A 74 31.279 -1.021 27.416 1.00 12.71 C ATOM 1063 CG ARG A 74 32.628 -0.903 26.771 1.00 17.64 C ATOM 1064 CD ARG A 74 33.683 -1.568 27.583 1.00 15.79 C ATOM 1065 NE ARG A 74 33.971 -0.821 28.797 1.00 12.94 N ATOM 1066 CZ ARG A 74 34.718 -1.300 29.790 1.00 15.12 C ATOM 1067 NH1 ARG A 74 35.239 -2.523 29.714 1.00 15.79 N ATOM 1068 NH2 ARG A 74 34.989 -0.539 30.834 1.00 8.36 N ATOM 1069 N LEU A 75 28.574 -2.369 26.981 1.00 8.43 N ATOM 1070 CA LEU A 75 27.327 -2.918 27.475 1.00 4.66 C ATOM 1071 C LEU A 75 27.800 -4.044 28.310 1.00 4.72 C ATOM 1072 O LEU A 75 28.797 -4.683 27.970 1.00 10.70 O ATOM 1073 CB LEU A 75 26.478 -3.472 26.334 1.00 6.52 C ATOM 1074 CG LEU A 75 25.211 -4.235 26.690 1.00 2.06 C ATOM 1075 CD1 LEU A 75 24.272 -3.325 27.388 1.00 5.32 C ATOM 1076 CD2 LEU A 75 24.548 -4.787 25.475 1.00 2.12 C ATOM 1077 N GLN A 76 27.162 -4.232 29.451 1.00 6.19 N ATOM 1078 CA GLN A 76 27.521 -5.300 30.342 1.00 2.39 C ATOM 1079 C GLN A 76 26.367 -6.251 30.416 1.00 5.87 C ATOM 1080 O GLN A 76 25.224 -5.839 30.543 1.00 8.40 O ATOM 1081 CB GLN A 76 27.829 -4.793 31.741 1.00 2.00 C ATOM 1082 CG GLN A 76 28.056 -5.936 32.694 1.00 2.07 C ATOM 1083 CD GLN A 76 28.554 -5.520 34.030 1.00 2.08 C ATOM 1084 OE1 GLN A 76 29.312 -4.566 34.156 1.00 2.10 O ATOM 1085 NE2 GLN A 76 28.141 -6.248 35.053 1.00 2.03 N ATOM 1086 N VAL A 77 26.658 -7.527 30.242 1.00 10.35 N ATOM 1087 CA VAL A 77 25.648 -8.547 30.352 1.00 13.60 C ATOM 1088 C VAL A 77 26.289 -9.600 31.222 1.00 16.86 C ATOM 1089 O VAL A 77 27.447 -9.941 31.037 1.00 20.04 O ATOM 1090 CB VAL A 77 25.256 -9.130 28.995 1.00 9.07 C ATOM 1091 CG1 VAL A 77 24.360 -10.328 29.203 1.00 9.55 C ATOM 1092 CG2 VAL A 77 24.517 -8.116 28.213 1.00 2.09 C ATOM 1093 N SER A 78 25.597 -9.982 32.275 1.00 26.91 N ATOM 1094 CA SER A 78 26.083 -11.010 33.188 1.00 37.53 C ATOM 1095 C SER A 78 27.319 -10.754 33.987 1.00 38.28 C ATOM 1096 O SER A 78 27.506 -11.445 34.962 1.00 52.87 O ATOM 1097 CB SER A 78 26.280 -12.359 32.474 1.00 43.67 C ATOM 1098 OG SER A 78 27.245 -13.192 33.125 1.00 43.57 O ATOM 1099 N HIS A 79 28.168 -9.835 33.576 1.00 36.98 N ATOM 1100 CA HIS A 79 29.443 -9.526 34.251 1.00 44.40 C ATOM 1101 C HIS A 79 30.364 -8.948 33.180 1.00 40.83 C ATOM 1102 O HIS A 79 31.482 -8.520 33.459 1.00 41.42 O ATOM 1103 CB HIS A 79 30.135 -10.742 34.948 1.00 53.20 C ATOM 1104 CG HIS A 79 29.634 -11.013 36.351 1.00 64.33 C ATOM 1105 ND1 HIS A 79 28.923 -12.151 36.683 1.00 65.91 N ATOM 1106 CD2 HIS A 79 29.663 -10.253 37.476 1.00 65.72 C ATOM 1107 CE1 HIS A 79 28.521 -12.074 37.941 1.00 65.98 C ATOM 1108 NE2 HIS A 79 28.955 -10.932 38.444 1.00 66.31 N ATOM 1109 N ARG A 80 29.890 -8.959 31.945 1.00 33.64 N ATOM 1110 CA ARG A 80 30.940 -9.457 30.796 1.00 27.78 C ATOM 1111 C ARG A 80 30.595 -8.098 30.280 1.00 22.98 C ATOM 1112 O ARG A 80 29.446 -7.688 30.352 1.00 22.84 O ATOM 1113 CB ARG A 80 30.629 -10.482 29.730 1.00 33.60 C ATOM 1114 CG ARG A 80 31.218 -11.810 29.993 1.00 44.12 C ATOM 1115 CD ARG A 80 32.354 -12.028 29.034 1.00 53.32 C ATOM 1116 NE ARG A 80 32.238 -13.343 28.421 1.00 64.14 N ATOM 1117 CZ ARG A 80 31.466 -13.618 27.374 1.00 66.81 C ATOM 1118 NH1 ARG A 80 30.740 -12.660 26.803 1.00 68.05 N ATOM 1119 NH2 ARG A 80 31.379 -14.866 26.937 1.00 68.99 N ATOM 1120 N LYS A 81 31.596 -7.398 29.776 1.00 21.03 N ATOM 1121 CA LYS A 81 31.436 -6.068 29.214 1.00 18.29 C ATOM 1122 C LYS A 81 31.735 -6.217 27.725 1.00 21.88 C ATOM 1123 O LYS A 81 32.582 -7.030 27.333 1.00 25.12 O ATOM 1124 CB LYS A 81 32.474 -5.118 29.823 1.00 15.28 C ATOM 1125 CG LYS A 81 31.916 -3.806 30.370 1.00 9.77 C ATOM 1126 CD LYS A 81 32.121 -3.697 31.875 1.00 6.02 C ATOM 1127 CE LYS A 81 31.531 -2.416 32.408 1.00 12.64 C ATOM 1128 NZ LYS A 81 30.051 -2.361 32.244 1.00 10.77 N ATOM 1129 N GLY A 82 31.097 -5.407 26.890 1.00 19.79 N ATOM 1130 CA GLY A 82 31.362 -5.505 25.471 1.00 8.36 C ATOM 1131 C GLY A 82 30.700 -4.388 24.734 1.00 8.44 C ATOM 1132 O GLY A 82 29.979 -3.606 25.345 1.00 14.56 O ATOM 1133 N LEU A 83 30.994 -4.276 23.446 1.00 2.83 N ATOM 1134 CA LEU A 83 30.395 -3.260 22.602 1.00 2.00 C ATOM 1135 C LEU A 83 29.063 -3.823 22.112 1.00 5.18 C ATOM 1136 O LEU A 83 29.024 -4.920 21.540 1.00 5.81 O ATOM 1137 CB LEU A 83 31.311 -3.004 21.444 1.00 6.74 C ATOM 1138 CG LEU A 83 32.568 -2.374 21.964 1.00 2.00 C ATOM 1139 CD1 LEU A 83 33.542 -2.276 20.835 1.00 6.03 C ATOM 1140 CD2 LEU A 83 32.235 -1.034 22.548 1.00 3.73 C ATOM 1141 N PRO A 84 27.990 -3.018 22.181 1.00 6.40 N ATOM 1142 CA PRO A 84 26.662 -3.486 21.761 1.00 9.29 C ATOM 1143 C PRO A 84 26.614 -4.275 20.451 1.00 10.20 C ATOM 1144 O PRO A 84 26.375 -5.483 20.423 1.00 8.99 O ATOM 1145 CB PRO A 84 25.858 -2.187 21.679 1.00 7.35 C ATOM 1146 CG PRO A 84 26.579 -1.272 22.645 1.00 3.44 C ATOM 1147 CD PRO A 84 28.002 -1.549 22.324 1.00 2.04 C ATOM 1148 N HIS A 85 26.928 -3.590 19.372 1.00 9.09 N ATOM 1149 CA HIS A 85 26.870 -4.198 18.076 1.00 8.17 C ATOM 1150 C HIS A 85 27.766 -5.411 17.877 1.00 13.52 C ATOM 1151 O HIS A 85 27.498 -6.216 16.986 1.00 17.87 O ATOM 1152 CB HIS A 85 27.151 -3.143 17.045 1.00 8.16 C ATOM 1153 CG HIS A 85 28.439 -2.439 17.273 1.00 8.86 C ATOM 1154 ND1 HIS A 85 29.623 -2.872 16.733 1.00 9.96 N ATOM 1155 CD2 HIS A 85 28.733 -1.330 17.986 1.00 14.14 C ATOM 1156 CE1 HIS A 85 30.596 -2.057 17.093 1.00 9.98 C ATOM 1157 NE2 HIS A 85 30.082 -1.113 17.855 1.00 10.54 N ATOM 1158 N VAL A 86 28.822 -5.566 18.674 1.00 15.33 N ATOM 1159 CA VAL A 86 29.689 -6.743 18.502 1.00 11.25 C ATOM 1160 C VAL A 86 29.076 -7.986 19.170 1.00 10.61 C ATOM 1161 O VAL A 86 29.087 -9.076 18.615 1.00 13.16 O ATOM 1162 CB VAL A 86 31.123 -6.531 19.045 1.00 13.63 C ATOM 1163 CG1 VAL A 86 31.873 -7.840 18.976 1.00 14.26 C ATOM 1164 CG2 VAL A 86 31.886 -5.472 18.234 1.00 6.31 C ATOM 1165 N ILE A 87 28.536 -7.808 20.364 1.00 9.12 N ATOM 1166 CA ILE A 87 27.912 -8.888 21.106 1.00 4.17 C ATOM 1167 C ILE A 87 26.755 -9.499 20.285 1.00 4.35 C ATOM 1168 O ILE A 87 26.556 -10.706 20.295 1.00 6.42 O ATOM 1169 CB ILE A 87 27.326 -8.334 22.412 1.00 5.01 C ATOM 1170 CG1 ILE A 87 28.368 -7.613 23.222 1.00 2.00 C ATOM 1171 CG2 ILE A 87 26.780 -9.418 23.270 1.00 10.79 C ATOM 1172 CD1 ILE A 87 27.735 -7.029 24.431 1.00 9.09 C ATOM 1173 N TYR A 88 25.992 -8.663 19.577 1.00 7.04 N ATOM 1174 CA TYR A 88 24.839 -9.130 18.784 1.00 8.74 C ATOM 1175 C TYR A 88 25.118 -9.597 17.353 1.00 14.45 C ATOM 1176 O TYR A 88 24.474 -10.529 16.868 1.00 13.32 O ATOM 1177 CB TYR A 88 23.688 -8.117 18.835 1.00 5.49 C ATOM 1178 CG TYR A 88 23.149 -7.981 20.241 1.00 5.19 C ATOM 1179 CD1 TYR A 88 22.568 -9.068 20.882 1.00 2.00 C ATOM 1180 CD2 TYR A 88 23.371 -6.815 20.985 1.00 3.60 C ATOM 1181 CE1 TYR A 88 22.244 -9.003 22.222 1.00 4.31 C ATOM 1182 CE2 TYR A 88 23.050 -6.753 22.309 1.00 2.00 C ATOM 1183 CZ TYR A 88 22.495 -7.855 22.927 1.00 2.03 C ATOM 1184 OH TYR A 88 22.262 -7.836 24.278 1.00 5.72 O ATOM 1185 N CYS A 89 26.052 -8.959 16.653 1.00 16.19 N ATOM 1186 CA CYS A 89 26.392 -9.452 15.330 1.00 9.42 C ATOM 1187 C CYS A 89 27.012 -10.849 15.555 1.00 9.00 C ATOM 1188 O CYS A 89 26.652 -11.800 14.876 1.00 9.77 O ATOM 1189 CB CYS A 89 27.370 -8.514 14.652 1.00 6.03 C ATOM 1190 SG CYS A 89 26.580 -7.014 14.158 1.00 14.87 S ATOM 1191 N ARG A 90 27.831 -10.994 16.591 1.00 5.01 N ATOM 1192 CA ARG A 90 28.449 -12.276 16.896 1.00 10.35 C ATOM 1193 C ARG A 90 27.450 -13.350 17.295 1.00 15.47 C ATOM 1194 O ARG A 90 27.694 -14.541 17.118 1.00 23.05 O ATOM 1195 CB ARG A 90 29.431 -12.105 18.031 1.00 13.18 C ATOM 1196 CG ARG A 90 30.060 -13.381 18.485 1.00 12.31 C ATOM 1197 CD ARG A 90 30.712 -13.180 19.825 1.00 22.24 C ATOM 1198 NE ARG A 90 31.923 -12.373 19.732 1.00 31.00 N ATOM 1199 CZ ARG A 90 32.387 -11.595 20.710 1.00 37.04 C ATOM 1200 NH1 ARG A 90 31.722 -11.501 21.871 1.00 33.81 N ATOM 1201 NH2 ARG A 90 33.554 -10.963 20.544 1.00 33.47 N ATOM 1202 N LEU A 91 26.327 -12.929 17.849 1.00 20.19 N ATOM 1203 CA LEU A 91 25.296 -13.861 18.303 1.00 23.21 C ATOM 1204 C LEU A 91 24.448 -14.457 17.170 1.00 28.73 C ATOM 1205 O LEU A 91 24.166 -15.639 17.167 1.00 37.98 O ATOM 1206 CB LEU A 91 24.377 -13.154 19.331 1.00 19.23 C ATOM 1207 CG LEU A 91 23.728 -13.813 20.562 1.00 15.98 C ATOM 1208 CD1 LEU A 91 22.881 -12.776 21.313 1.00 4.91 C ATOM 1209 CD2 LEU A 91 22.877 -15.006 20.164 1.00 9.26 C ATOM 1210 N TRP A 92 24.073 -13.676 16.175 1.00 29.90 N ATOM 1211 CA TRP A 92 23.199 -14.240 15.160 1.00 31.31 C ATOM 1212 C TRP A 92 23.772 -14.055 13.774 1.00 30.94 C ATOM 1213 O TRP A 92 23.054 -14.133 12.785 1.00 37.15 O ATOM 1214 CB TRP A 92 21.705 -13.749 15.304 1.00 35.65 C ATOM 1215 CG TRP A 92 21.471 -12.872 16.503 1.00 41.62 C ATOM 1216 CD1 TRP A 92 22.367 -12.069 16.987 1.00 44.27 C ATOM 1217 CD2 TRP A 92 20.300 -12.693 17.349 1.00 43.48 C ATOM 1218 NE1 TRP A 92 21.919 -11.383 18.055 1.00 45.75 N ATOM 1219 CE2 TRP A 92 20.640 -11.736 18.312 1.00 44.49 C ATOM 1220 CE3 TRP A 92 19.031 -13.215 17.379 1.00 41.97 C ATOM 1221 CZ2 TRP A 92 19.768 -11.279 19.307 1.00 40.81 C ATOM 1222 CZ3 TRP A 92 18.149 -12.746 18.383 1.00 45.43 C ATOM 1223 CH2 TRP A 92 18.533 -11.789 19.325 1.00 41.79 C ATOM 1224 N ARG A 93 25.082 -13.871 13.697 1.00 24.96 N ATOM 1225 CA ARG A 93 25.706 -13.707 12.401 1.00 26.95 C ATOM 1226 C ARG A 93 27.086 -14.390 12.361 1.00 31.70 C ATOM 1227 O ARG A 93 27.234 -15.485 11.804 1.00 36.30 O ATOM 1228 CB ARG A 93 25.859 -12.214 12.040 1.00 27.51 C ATOM 1229 CG ARG A 93 24.599 -11.346 11.915 1.00 25.54 C ATOM 1230 CD ARG A 93 23.885 -11.463 10.573 1.00 33.63 C ATOM 1231 NE ARG A 93 24.691 -11.187 9.374 1.00 45.72 N ATOM 1232 CZ ARG A 93 24.719 -10.030 8.702 1.00 50.29 C ATOM 1233 NH1 ARG A 93 24.001 -8.995 9.103 1.00 51.03 N ATOM 1234 NH2 ARG A 93 25.389 -9.934 7.559 1.00 51.47 N ATOM 1235 N TRP A 94 28.083 -13.765 12.988 1.00 32.72 N ATOM 1236 CA TRP A 94 29.458 -14.263 12.988 1.00 29.97 C ATOM 1237 C TRP A 94 30.050 -14.552 14.377 1.00 34.05 C ATOM 1238 O TRP A 94 30.743 -13.719 14.971 1.00 33.60 O ATOM 1239 CB TRP A 94 30.352 -13.271 12.241 1.00 26.39 C ATOM 1240 CG TRP A 94 29.710 -12.723 11.016 1.00 25.43 C ATOM 1241 CD1 TRP A 94 29.249 -13.431 9.929 1.00 29.56 C ATOM 1242 CD2 TRP A 94 29.363 -11.364 10.779 1.00 27.04 C ATOM 1243 NE1 TRP A 94 28.620 -12.593 9.039 1.00 28.50 N ATOM 1244 CE2 TRP A 94 28.672 -11.316 9.535 1.00 28.72 C ATOM 1245 CE3 TRP A 94 29.558 -10.178 11.495 1.00 25.51 C ATOM 1246 CZ2 TRP A 94 28.169 -10.131 9.001 1.00 29.19 C ATOM 1247 CZ3 TRP A 94 29.055 -8.993 10.963 1.00 32.66 C ATOM 1248 CH2 TRP A 94 28.366 -8.979 9.721 1.00 32.01 C ATOM 1249 N PRO A 95 29.876 -15.784 14.856 1.00 35.13 N ATOM 1250 CA PRO A 95 30.376 -16.229 16.159 1.00 39.22 C ATOM 1251 C PRO A 95 31.908 -16.125 16.264 1.00 39.73 C ATOM 1252 O PRO A 95 32.490 -16.208 17.355 1.00 39.89 O ATOM 1253 CB PRO A 95 29.910 -17.678 16.206 1.00 40.32 C ATOM 1254 CG PRO A 95 29.934 -18.068 14.756 1.00 39.91 C ATOM 1255 CD PRO A 95 29.277 -16.901 14.115 1.00 35.27 C ATOM 1256 N ASP A 96 32.533 -15.937 15.110 1.00 37.92 N ATOM 1257 CA ASP A 96 33.980 -15.812 14.975 1.00 36.56 C ATOM 1258 C ASP A 96 34.438 -14.383 15.295 1.00 32.34 C ATOM 1259 O ASP A 96 35.582 -14.169 15.696 1.00 29.24 O ATOM 1260 CB ASP A 96 34.343 -16.152 13.520 1.00 39.35 C ATOM 1261 CG ASP A 96 35.813 -16.420 13.319 1.00 43.86 C ATOM 1262 OD1 ASP A 96 36.659 -15.600 13.728 1.00 46.48 O ATOM 1263 OD2 ASP A 96 36.127 -17.462 12.708 1.00 52.60 O ATOM 1264 N LEU A 97 33.539 -13.419 15.099 1.00 30.87 N ATOM 1265 CA LEU A 97 33.823 -11.999 15.292 1.00 26.32 C ATOM 1266 C LEU A 97 34.780 -11.691 16.431 1.00 29.43 C ATOM 1267 O LEU A 97 34.454 -11.867 17.597 1.00 32.38 O ATOM 1268 CB LEU A 97 32.526 -11.238 15.482 1.00 22.56 C ATOM 1269 CG LEU A 97 32.754 -9.750 15.440 1.00 21.19 C ATOM 1270 CD1 LEU A 97 33.168 -9.421 14.066 1.00 22.59 C ATOM 1271 CD2 LEU A 97 31.496 -9.021 15.783 1.00 24.61 C ATOM 1272 N HIS A 98 35.965 -11.209 16.101 1.00 33.76 N ATOM 1273 CA HIS A 98 36.937 -10.915 17.149 1.00 40.76 C ATOM 1274 C HIS A 98 36.690 -9.553 17.816 1.00 41.03 C ATOM 1275 O HIS A 98 36.542 -9.475 19.026 1.00 44.30 O ATOM 1276 CB HIS A 98 38.396 -10.986 16.624 1.00 48.33 C ATOM 1277 CG HIS A 98 38.773 -12.285 15.949 1.00 55.88 C ATOM 1278 ND1 HIS A 98 38.213 -13.506 16.280 1.00 57.65 N ATOM 1279 CD2 HIS A 98 39.684 -12.544 14.975 1.00 54.88 C ATOM 1280 CE1 HIS A 98 38.763 -14.457 15.543 1.00 57.53 C ATOM 1281 NE2 HIS A 98 39.656 -13.899 14.743 1.00 56.63 N ATOM 1282 N SER A 99 36.645 -8.483 17.030 1.00 44.01 N ATOM 1283 CA SER A 99 36.458 -7.138 17.576 1.00 43.22 C ATOM 1284 C SER A 99 35.589 -6.258 16.684 1.00 44.38 C ATOM 1285 O SER A 99 35.145 -6.683 15.615 1.00 47.57 O ATOM 1286 CB SER A 99 37.820 -6.442 17.771 1.00 49.32 C ATOM 1287 OG SER A 99 38.359 -5.909 16.556 1.00 44.66 O ATOM 1288 N HIS A 100 35.436 -5.001 17.085 1.00 40.52 N ATOM 1289 CA HIS A 100 34.638 -4.051 16.330 1.00 38.83 C ATOM 1290 C HIS A 100 35.361 -3.462 15.143 1.00 41.97 C ATOM 1291 O HIS A 100 34.985 -2.367 14.710 1.00 45.90 O ATOM 1292 CB HIS A 100 34.215 -2.893 17.196 1.00 35.96 C ATOM 1293 CG HIS A 100 35.360 -2.112 17.738 1.00 32.37 C ATOM 1294 ND1 HIS A 100 35.542 -0.779 17.457 1.00 33.36 N ATOM 1295 CD2 HIS A 100 36.355 -2.462 18.587 1.00 31.73 C ATOM 1296 CE1 HIS A 100 36.596 -0.333 18.117 1.00 33.16 C ATOM 1297 NE2 HIS A 100 37.106 -1.336 18.811 1.00 36.71 N ATOM 1298 N HIS A 101 36.452 -4.107 14.708 1.00 40.45 N ATOM 1299 CA HIS A 101 37.221 -3.654 13.539 1.00 31.68 C ATOM 1300 C HIS A 101 36.850 -4.496 12.335 1.00 27.74 C ATOM 1301 O HIS A 101 36.819 -4.020 11.210 1.00 33.07 O ATOM 1302 CB HIS A 101 38.737 -3.683 13.791 1.00 25.67 C ATOM 1303 CG HIS A 101 39.220 -2.510 14.582 1.00 24.69 C ATOM 1304 ND1 HIS A 101 39.757 -2.637 15.847 1.00 21.12 N ATOM 1305 CD2 HIS A 101 39.152 -1.179 14.326 1.00 20.13 C ATOM 1306 CE1 HIS A 101 39.992 -1.434 16.341 1.00 23.65 C ATOM 1307 NE2 HIS A 101 39.630 -0.533 15.439 1.00 25.59 N ATOM 1308 N GLU A 102 36.428 -5.714 12.591 1.00 20.49 N ATOM 1309 CA GLU A 102 36.058 -6.577 11.507 1.00 18.29 C ATOM 1310 C GLU A 102 34.633 -6.238 11.089 1.00 20.65 C ATOM 1311 O GLU A 102 34.004 -6.993 10.331 1.00 21.87 O ATOM 1312 CB GLU A 102 36.142 -8.015 11.980 1.00 20.55 C ATOM 1313 CG GLU A 102 37.073 -8.214 13.155 1.00 19.64 C ATOM 1314 CD GLU A 102 37.566 -9.633 13.265 1.00 30.18 C ATOM 1315 OE1 GLU A 102 36.906 -10.572 12.740 1.00 29.13 O ATOM 1316 OE2 GLU A 102 38.655 -9.800 13.853 1.00 34.65 O ATOM 1317 N LEU A 103 34.155 -5.066 11.503 1.00 18.45 N ATOM 1318 CA LEU A 103 32.778 -4.658 11.228 1.00 19.02 C ATOM 1319 C LEU A 103 32.660 -3.280 10.631 1.00 21.72 C ATOM 1320 O LEU A 103 33.489 -2.416 10.883 1.00 27.11 O ATOM 1321 CB LEU A 103 32.004 -4.634 12.529 1.00 12.44 C ATOM 1322 CG LEU A 103 30.898 -5.588 12.914 1.00 2.01 C ATOM 1323 CD1 LEU A 103 31.268 -7.002 12.934 1.00 3.53 C ATOM 1324 CD2 LEU A 103 30.630 -5.194 14.309 1.00 12.21 C ATOM 1325 N ARG A 104 31.580 -3.058 9.899 1.00 25.72 N ATOM 1326 CA ARG A 104 31.339 -1.764 9.302 1.00 35.34 C ATOM 1327 C ARG A 104 29.897 -1.650 8.842 1.00 32.38 C ATOM 1328 O ARG A 104 29.351 -2.582 8.251 1.00 33.68 O ATOM 1329 CB ARG A 104 32.315 -1.511 8.153 1.00 50.44 C ATOM 1330 CG ARG A 104 32.680 -0.022 7.949 1.00 67.06 C ATOM 1331 CD ARG A 104 32.761 0.771 9.281 1.00 71.96 C ATOM 1332 NE ARG A 104 31.508 1.471 9.605 1.00 78.92 N ATOM 1333 CZ ARG A 104 31.138 1.827 10.834 1.00 80.68 C ATOM 1334 NH1 ARG A 104 31.915 1.545 11.863 1.00 83.12 N ATOM 1335 NH2 ARG A 104 30.001 2.485 11.038 1.00 82.65 N ATOM 1336 N ALA A 105 29.289 -0.509 9.162 1.00 28.14 N ATOM 1337 CA ALA A 105 27.896 -0.215 8.860 1.00 27.74 C ATOM 1338 C ALA A 105 27.615 -0.204 7.403 1.00 33.22 C ATOM 1339 O ALA A 105 28.535 -0.281 6.603 1.00 36.31 O ATOM 1340 CB ALA A 105 27.509 1.103 9.438 1.00 25.11 C ATOM 1341 N MET A 106 26.349 0.011 7.059 1.00 39.52 N ATOM 1342 CA MET A 106 25.934 0.022 5.671 1.00 46.61 C ATOM 1343 C MET A 106 25.352 1.307 5.104 1.00 50.93 C ATOM 1344 O MET A 106 24.549 1.265 4.171 1.00 56.64 O ATOM 1345 CB MET A 106 24.971 -1.122 5.414 1.00 45.59 C ATOM 1346 CG MET A 106 25.629 -2.450 5.462 1.00 50.25 C ATOM 1347 SD MET A 106 24.528 -3.644 4.815 1.00 58.02 S ATOM 1348 CE MET A 106 25.621 -4.364 3.496 1.00 56.89 C ATOM 1349 N GLU A 107 25.774 2.451 5.620 1.00 52.83 N ATOM 1350 CA GLU A 107 25.275 3.728 5.117 1.00 55.00 C ATOM 1351 C GLU A 107 23.799 3.936 5.453 1.00 50.95 C ATOM 1352 O GLU A 107 23.341 5.074 5.592 1.00 50.12 O ATOM 1353 CB GLU A 107 25.498 3.842 3.600 1.00 62.39 C ATOM 1354 CG GLU A 107 26.965 3.976 3.167 1.00 76.22 C ATOM 1355 CD GLU A 107 27.169 3.840 1.650 1.00 85.06 C ATOM 1356 OE1 GLU A 107 26.274 4.244 0.870 1.00 91.06 O ATOM 1357 OE2 GLU A 107 28.234 3.326 1.231 1.00 88.55 O ATOM 1358 N LEU A 108 23.057 2.846 5.599 1.00 44.10 N ATOM 1359 CA LEU A 108 21.598 3.012 5.614 1.00 42.62 C ATOM 1360 C LEU A 108 21.352 3.101 7.116 1.00 44.65 C ATOM 1361 O LEU A 108 20.226 3.439 7.515 1.00 43.06 O ATOM 1362 CB LEU A 108 20.794 1.870 4.997 1.00 44.80 C ATOM 1363 CG LEU A 108 20.608 0.488 5.626 1.00 46.00 C ATOM 1364 CD1 LEU A 108 19.687 -0.288 4.710 1.00 46.23 C ATOM 1365 CD2 LEU A 108 21.914 -0.262 5.793 1.00 47.79 C ATOM 1366 N CYS A 109 22.371 2.782 7.946 1.00 42.59 N ATOM 1367 CA CYS A 109 22.218 2.864 9.420 1.00 38.57 C ATOM 1368 C CYS A 109 22.659 4.240 9.876 1.00 42.73 C ATOM 1369 O CYS A 109 23.809 4.622 9.662 1.00 40.16 O ATOM 1370 CB CYS A 109 22.957 1.749 10.220 1.00 32.89 C ATOM 1371 SG CYS A 109 21.854 0.818 11.466 1.00 7.51 S ATOM 1372 N GLU A 110 21.698 4.997 10.420 1.00 46.58 N ATOM 1373 CA GLU A 110 21.921 6.353 10.908 1.00 47.55 C ATOM 1374 C GLU A 110 22.707 6.350 12.198 1.00 46.24 C ATOM 1375 O GLU A 110 23.570 7.193 12.404 1.00 47.73 O ATOM 1376 CB GLU A 110 20.596 7.044 11.200 1.00 52.28 C ATOM 1377 CG GLU A 110 19.611 7.091 10.052 1.00 64.54 C ATOM 1378 CD GLU A 110 18.436 8.038 10.327 1.00 74.26 C ATOM 1379 OE1 GLU A 110 18.139 8.324 11.524 1.00 77.45 O ATOM 1380 OE2 GLU A 110 17.821 8.510 9.334 1.00 77.22 O ATOM 1381 N PHE A 111 22.368 5.405 13.075 1.00 45.33 N ATOM 1382 CA PHE A 111 22.989 5.256 14.397 1.00 41.69 C ATOM 1383 C PHE A 111 24.017 4.129 14.378 1.00 38.21 C ATOM 1384 O PHE A 111 24.074 3.325 15.291 1.00 39.94 O ATOM 1385 CB PHE A 111 21.904 4.888 15.423 1.00 38.35 C ATOM 1386 CG PHE A 111 20.658 5.760 15.380 1.00 37.38 C ATOM 1387 CD1 PHE A 111 19.770 5.702 14.303 1.00 31.70 C ATOM 1388 CD2 PHE A 111 20.343 6.590 16.461 1.00 37.66 C ATOM 1389 CE1 PHE A 111 18.597 6.446 14.309 1.00 27.27 C ATOM 1390 CE2 PHE A 111 19.167 7.336 16.471 1.00 32.75 C ATOM 1391 CZ PHE A 111 18.297 7.264 15.391 1.00 29.81 C ATOM 1392 N ALA A 112 24.861 4.083 13.369 1.00 35.29 N ATOM 1393 CA ALA A 112 25.796 2.990 13.264 1.00 34.77 C ATOM 1394 C ALA A 112 26.996 2.988 14.177 1.00 39.31 C ATOM 1395 O ALA A 112 28.109 2.747 13.726 1.00 50.50 O ATOM 1396 CB ALA A 112 26.225 2.833 11.843 1.00 34.04 C ATOM 1397 N PHE A 113 26.794 3.273 15.453 1.00 40.69 N ATOM 1398 CA PHE A 113 27.876 3.261 16.444 1.00 41.22 C ATOM 1399 C PHE A 113 29.006 4.255 16.217 1.00 44.80 C ATOM 1400 O PHE A 113 29.664 4.657 17.176 1.00 49.44 O ATOM 1401 CB PHE A 113 28.443 1.841 16.639 1.00 33.63 C ATOM 1402 CG PHE A 113 29.398 1.729 17.801 1.00 33.99 C ATOM 1403 CD1 PHE A 113 28.918 1.647 19.105 1.00 36.91 C ATOM 1404 CD2 PHE A 113 30.771 1.783 17.605 1.00 34.23 C ATOM 1405 CE1 PHE A 113 29.783 1.625 20.194 1.00 29.82 C ATOM 1406 CE2 PHE A 113 31.647 1.763 18.687 1.00 30.83 C ATOM 1407 CZ PHE A 113 31.146 1.687 19.981 1.00 32.85 C ATOM 1408 N ASN A 114 29.243 4.636 14.961 1.00 49.45 N ATOM 1409 CA ASN A 114 30.817 5.033 14.736 1.00 55.87 C ATOM 1410 C ASN A 114 30.410 6.488 14.690 1.00 55.24 C ATOM 1411 O ASN A 114 31.254 7.383 14.626 1.00 57.30 O ATOM 1412 CB ASN A 114 31.393 4.657 13.373 1.00 62.53 C ATOM 1413 CG ASN A 114 32.547 3.681 13.482 1.00 70.47 C ATOM 1414 OD1 ASN A 114 32.623 2.892 14.435 1.00 73.70 O ATOM 1415 ND2 ASN A 114 33.444 3.703 12.491 1.00 72.58 N ATOM 1416 N MET A 115 29.104 6.702 14.698 1.00 52.43 N ATOM 1417 CA MET A 115 28.524 8.018 14.647 1.00 51.67 C ATOM 1418 C MET A 115 28.329 8.615 16.031 1.00 52.75 C ATOM 1419 O MET A 115 27.665 9.634 16.182 1.00 56.02 O ATOM 1420 CB MET A 115 27.203 7.924 13.903 1.00 54.47 C ATOM 1421 CG MET A 115 27.371 7.154 12.608 1.00 58.61 C ATOM 1422 SD MET A 115 25.962 7.187 11.508 1.00 66.95 S ATOM 1423 CE MET A 115 26.648 6.266 10.032 1.00 67.08 C ATOM 1424 N LYS A 116 28.874 7.957 17.045 1.00 53.00 N ATOM 1425 CA LYS A 116 28.776 8.434 18.421 1.00 55.31 C ATOM 1426 C LYS A 116 27.440 9.080 18.836 1.00 53.13 C ATOM 1427 O LYS A 116 27.423 9.980 19.687 1.00 51.14 O ATOM 1428 CB LYS A 116 29.924 9.401 18.716 1.00 60.89 C ATOM 1429 CG LYS A 116 31.320 8.774 18.740 1.00 69.65 C ATOM 1430 CD LYS A 116 32.354 9.825 19.174 1.00 76.56 C ATOM 1431 CE LYS A 116 33.791 9.294 19.155 1.00 79.31 C ATOM 1432 NZ LYS A 116 34.784 10.423 19.151 1.00 80.44 N ATOM 1433 N LYS A 117 26.329 8.600 18.277 1.00 50.88 N ATOM 1434 CA LYS A 117 25.009 9.150 18.611 1.00 48.48 C ATOM 1435 C LYS A 117 24.514 8.712 20.005 1.00 48.13 C ATOM 1436 O LYS A 117 25.210 7.992 20.719 1.00 53.84 O ATOM 1437 CB LYS A 117 23.972 8.767 17.548 1.00 46.66 C ATOM 1438 CG LYS A 117 24.269 9.250 16.148 1.00 43.00 C ATOM 1439 CD LYS A 117 23.003 9.211 15.292 1.00 44.74 C ATOM 1440 CE LYS A 117 23.262 9.701 13.856 1.00 47.80 C ATOM 1441 NZ LYS A 117 22.059 9.691 12.953 1.00 45.25 N ATOM 1442 N ASP A 118 23.324 9.172 20.390 1.00 43.90 N ATOM 1443 CA ASP A 118 22.720 8.838 21.685 1.00 41.04 C ATOM 1444 C ASP A 118 22.199 7.412 21.702 1.00 35.63 C ATOM 1445 O ASP A 118 22.016 6.823 22.760 1.00 39.57 O ATOM 1446 CB ASP A 118 21.547 9.785 21.997 1.00 48.62 C ATOM 1447 CG ASP A 118 21.992 11.124 22.604 1.00 53.50 C ATOM 1448 OD1 ASP A 118 22.970 11.738 22.102 1.00 57.61 O ATOM 1449 OD2 ASP A 118 21.334 11.570 23.581 1.00 52.18 O ATOM 1450 N GLU A 119 21.893 6.893 20.525 1.00 28.73 N ATOM 1451 CA GLU A 119 21.389 5.548 20.376 1.00 26.79 C ATOM 1452 C GLU A 119 22.412 4.778 19.566 1.00 23.73 C ATOM 1453 O GLU A 119 23.172 5.365 18.799 1.00 23.49 O ATOM 1454 CB GLU A 119 20.098 5.586 19.603 1.00 34.40 C ATOM 1455 CG GLU A 119 19.121 6.590 20.107 1.00 50.66 C ATOM 1456 CD GLU A 119 18.681 6.306 21.511 1.00 57.62 C ATOM 1457 OE1 GLU A 119 17.768 5.467 21.673 1.00 65.47 O ATOM 1458 OE2 GLU A 119 19.233 6.932 22.448 1.00 65.89 O ATOM 1459 N VAL A 120 22.393 3.460 19.677 1.00 15.91 N ATOM 1460 CA VAL A 120 23.324 2.623 18.954 1.00 12.82 C ATOM 1461 C VAL A 120 22.499 1.566 18.232 1.00 19.22 C ATOM 1462 O VAL A 120 21.619 0.958 18.849 1.00 23.26 O ATOM 1463 CB VAL A 120 24.259 1.912 19.912 1.00 11.56 C ATOM 1464 CG1 VAL A 120 25.374 1.302 19.161 1.00 12.83 C ATOM 1465 CG2 VAL A 120 24.789 2.864 20.924 1.00 12.27 C ATOM 1466 N CYS A 121 22.728 1.391 16.924 1.00 19.22 N ATOM 1467 CA CYS A 121 21.990 0.395 16.141 1.00 19.38 C ATOM 1468 C CYS A 121 22.624 -0.958 16.365 1.00 17.77 C ATOM 1469 O CYS A 121 23.793 -1.159 16.052 1.00 21.44 O ATOM 1470 CB CYS A 121 22.018 0.723 14.643 1.00 21.74 C ATOM 1471 SG CYS A 121 21.083 -0.428 13.509 1.00 21.96 S ATOM 1472 N VAL A 122 21.886 -1.859 16.986 1.00 11.24 N ATOM 1473 CA VAL A 122 22.390 -3.187 17.229 1.00 8.04 C ATOM 1474 C VAL A 122 21.798 -4.196 16.240 1.00 10.38 C ATOM 1475 O VAL A 122 21.982 -5.392 16.411 1.00 13.13 O ATOM 1476 CB VAL A 122 22.102 -3.640 18.661 1.00 7.73 C ATOM 1477 CG1 VAL A 122 22.871 -2.796 19.628 1.00 2.00 C ATOM 1478 CG2 VAL A 122 20.596 -3.590 18.938 1.00 8.12 C ATOM 1479 N ASN A 123 21.081 -3.725 15.218 1.00 11.78 N ATOM 1480 CA ASN A 123 20.494 -4.611 14.199 1.00 12.27 C ATOM 1481 C ASN A 123 21.688 -5.348 13.524 1.00 16.63 C ATOM 1482 O ASN A 123 22.449 -4.720 12.779 1.00 14.11 O ATOM 1483 CB ASN A 123 19.721 -3.745 13.186 1.00 8.75 C ATOM 1484 CG ASN A 123 19.026 -4.558 12.084 1.00 14.38 C ATOM 1485 OD1 ASN A 123 19.452 -5.656 11.747 1.00 20.90 O ATOM 1486 ND2 ASN A 123 17.966 -4.002 11.505 1.00 11.53 N ATOM 1487 N PRO A 124 21.863 -6.682 13.750 1.00 17.44 N ATOM 1488 CA PRO A 124 23.008 -7.338 13.108 1.00 12.59 C ATOM 1489 C PRO A 124 23.055 -7.298 11.611 1.00 11.96 C ATOM 1490 O PRO A 124 24.083 -7.524 11.033 1.00 18.02 O ATOM 1491 CB PRO A 124 22.961 -8.769 13.648 1.00 13.87 C ATOM 1492 CG PRO A 124 21.543 -8.971 14.056 1.00 11.31 C ATOM 1493 CD PRO A 124 21.123 -7.639 14.603 1.00 15.83 C ATOM 1494 N TYR A 125 21.955 -6.984 10.958 1.00 19.05 N ATOM 1495 CA TYR A 125 21.966 -6.930 9.494 1.00 20.12 C ATOM 1496 C TYR A 125 22.290 -5.578 8.878 1.00 21.61 C ATOM 1497 O TYR A 125 22.051 -5.370 7.695 1.00 23.22 O ATOM 1498 CB TYR A 125 20.671 -7.510 8.926 1.00 12.35 C ATOM 1499 CG TYR A 125 20.624 -8.989 9.182 1.00 14.84 C ATOM 1500 CD1 TYR A 125 21.355 -9.877 8.383 1.00 15.58 C ATOM 1501 CD2 TYR A 125 19.926 -9.503 10.266 1.00 18.76 C ATOM 1502 CE1 TYR A 125 21.394 -11.223 8.666 1.00 17.67 C ATOM 1503 CE2 TYR A 125 19.961 -10.860 10.563 1.00 20.79 C ATOM 1504 CZ TYR A 125 20.694 -11.702 9.763 1.00 20.93 C ATOM 1505 OH TYR A 125 20.770 -13.019 10.102 1.00 30.95 O ATOM 1506 N HIS A 126 22.788 -4.643 9.688 1.00 23.05 N ATOM 1507 CA HIS A 126 23.162 -3.316 9.198 1.00 15.46 C ATOM 1508 C HIS A 126 24.664 -3.208 9.248 1.00 16.06 C ATOM 1509 O HIS A 126 25.207 -2.120 9.085 1.00 22.08 O ATOM 1510 CB HIS A 126 22.544 -2.191 10.036 1.00 12.03 C ATOM 1511 CG HIS A 126 21.162 -1.802 9.604 1.00 20.10 C ATOM 1512 ND1 HIS A 126 20.396 -0.862 10.275 1.00 20.03 N ATOM 1513 CD2 HIS A 126 20.424 -2.200 8.538 1.00 16.07 C ATOM 1514 CE1 HIS A 126 19.249 -0.699 9.633 1.00 19.71 C ATOM 1515 NE2 HIS A 126 19.242 -1.500 8.580 1.00 14.31 N ATOM 1516 N TYR A 127 25.341 -4.317 9.521 1.00 13.17 N ATOM 1517 CA TYR A 127 26.787 -4.318 9.572 1.00 8.38 C ATOM 1518 C TYR A 127 27.263 -5.429 8.671 1.00 14.07 C ATOM 1519 O TYR A 127 26.593 -6.449 8.453 1.00 16.03 O ATOM 1520 CB TYR A 127 27.328 -4.561 10.990 1.00 2.00 C ATOM 1521 CG TYR A 127 26.991 -3.512 12.027 1.00 5.94 C ATOM 1522 CD1 TYR A 127 27.778 -2.396 12.198 1.00 2.01 C ATOM 1523 CD2 TYR A 127 25.823 -3.607 12.796 1.00 7.77 C ATOM 1524 CE1 TYR A 127 27.396 -1.383 13.092 1.00 2.00 C ATOM 1525 CE2 TYR A 127 25.456 -2.612 13.680 1.00 2.12 C ATOM 1526 CZ TYR A 127 26.230 -1.509 13.811 1.00 2.00 C ATOM 1527 OH TYR A 127 25.797 -0.486 14.597 1.00 4.19 O ATOM 1528 N GLN A 128 28.438 -5.219 8.133 1.00 17.24 N ATOM 1529 CA GLN A 128 29.018 -6.202 7.292 1.00 22.61 C ATOM 1530 C GLN A 128 30.390 -6.415 7.881 1.00 22.39 C ATOM 1531 O GLN A 128 30.970 -5.502 8.461 1.00 19.18 O ATOM 1532 CB GLN A 128 29.064 -5.691 5.863 1.00 30.96 C ATOM 1533 CG GLN A 128 29.694 -4.330 5.659 1.00 41.11 C ATOM 1534 CD GLN A 128 29.436 -3.799 4.244 1.00 53.63 C ATOM 1535 OE1 GLN A 128 28.952 -4.527 3.353 1.00 54.95 O ATOM 1536 NE2 GLN A 128 29.743 -2.523 4.034 1.00 56.56 N ATOM 1537 N ARG A 129 30.870 -7.642 7.790 1.00 26.27 N ATOM 1538 CA ARG A 129 32.162 -8.026 8.322 1.00 29.95 C ATOM 1539 C ARG A 129 33.250 -7.780 7.305 1.00 32.48 C ATOM 1540 O ARG A 129 33.198 -8.324 6.209 1.00 34.42 O ATOM 1541 CB ARG A 129 32.127 -9.512 8.666 1.00 33.13 C ATOM 1542 CG ARG A 129 33.349 -9.990 9.360 1.00 40.35 C ATOM 1543 CD ARG A 129 33.300 -11.480 9.599 1.00 43.12 C ATOM 1544 NE ARG A 129 34.379 -11.860 10.511 1.00 54.38 N ATOM 1545 CZ ARG A 129 34.427 -12.998 11.199 1.00 56.92 C ATOM 1546 NH1 ARG A 129 33.452 -13.890 11.074 1.00 58.09 N ATOM 1547 NH2 ARG A 129 35.441 -13.231 12.032 1.00 58.68 N ATOM 1548 N VAL A 130 34.235 -6.965 7.646 1.00 34.98 N ATOM 1549 CA VAL A 130 35.322 -6.710 6.717 1.00 38.11 C ATOM 1550 C VAL A 130 36.459 -7.603 7.129 1.00 45.16 C ATOM 1551 O VAL A 130 36.712 -7.740 8.314 1.00 50.61 O ATOM 1552 CB VAL A 130 35.810 -5.247 6.772 1.00 35.76 C ATOM 1553 CG1 VAL A 130 34.640 -4.311 6.908 1.00 36.95 C ATOM 1554 CG2 VAL A 130 36.813 -5.029 7.876 1.00 29.02 C ATOM 1555 N GLU A 131 37.089 -8.278 6.177 1.00 54.81 N ATOM 1556 CA GLU A 131 38.240 -9.132 6.488 1.00 65.07 C ATOM 1557 C GLU A 131 39.508 -8.291 6.468 1.00 68.65 C ATOM 1558 O GLU A 131 40.619 -8.815 6.337 1.00 63.08 O ATOM 1559 CB GLU A 131 38.341 -10.284 5.491 1.00 69.52 C ATOM 1560 CG GLU A 131 37.598 -11.541 5.927 1.00 76.38 C ATOM 1561 CD GLU A 131 36.414 -11.245 6.838 1.00 80.73 C ATOM 1562 OE1 GLU A 131 35.407 -10.665 6.375 1.00 80.34 O ATOM 1563 OE2 GLU A 131 36.510 -11.576 8.039 1.00 84.86 O ATOM 1564 N THR A 132 39.284 -6.984 6.630 1.00 78.04 N ATOM 1565 CA THR A 132 40.274 -5.901 6.642 1.00 87.40 C ATOM 1566 C THR A 132 40.953 -5.660 5.281 1.00 86.78 C ATOM 1567 O THR A 132 41.670 -4.637 5.130 1.00 87.69 O ATOM 1568 CB THR A 132 41.305 -6.012 7.840 1.00 91.94 C ATOM 1569 OG1 THR A 132 41.883 -4.720 8.102 1.00 96.47 O ATOM 1570 CG2 THR A 132 42.432 -7.015 7.538 1.00 94.09 C ATOM 1571 OXT THR A 132 40.660 -6.439 4.343 1.00 85.78 O TER 1572 THR A 132 ATOM 1573 N PRO B 10 48.912 -7.282 56.309 1.00 58.51 N ATOM 1574 CA PRO B 10 49.060 -5.927 56.893 1.00 55.73 C ATOM 1575 C PRO B 10 47.891 -5.730 57.875 1.00 51.89 C ATOM 1576 O PRO B 10 47.394 -6.706 58.450 1.00 51.35 O ATOM 1577 CB PRO B 10 48.950 -4.957 55.722 1.00 59.89 C ATOM 1578 CG PRO B 10 47.899 -5.710 54.818 1.00 56.82 C ATOM 1579 CD PRO B 10 48.260 -7.208 54.982 1.00 57.64 C ATOM 1580 N ILE B 11 47.431 -4.486 58.014 1.00 45.93 N ATOM 1581 CA ILE B 11 46.318 -4.136 58.889 1.00 36.15 C ATOM 1582 C ILE B 11 45.166 -5.111 58.727 1.00 31.46 C ATOM 1583 O ILE B 11 44.638 -5.582 59.718 1.00 35.92 O ATOM 1584 CB ILE B 11 45.850 -2.675 58.641 1.00 35.53 C ATOM 1585 CG1 ILE B 11 44.786 -2.275 59.651 1.00 38.38 C ATOM 1586 CG2 ILE B 11 45.330 -2.492 57.235 1.00 37.67 C ATOM 1587 CD1 ILE B 11 45.315 -1.969 61.010 1.00 38.09 C ATOM 1588 N VAL B 12 44.825 -5.441 57.479 1.00 24.39 N ATOM 1589 CA VAL B 12 43.758 -6.390 57.150 1.00 20.56 C ATOM 1590 C VAL B 12 43.986 -7.743 57.816 1.00 22.76 C ATOM 1591 O VAL B 12 43.147 -8.214 58.563 1.00 26.80 O ATOM 1592 CB VAL B 12 43.659 -6.617 55.630 1.00 17.96 C ATOM 1593 CG1 VAL B 12 42.776 -7.774 55.340 1.00 16.90 C ATOM 1594 CG2 VAL B 12 43.149 -5.369 54.928 1.00 12.37 C ATOM 1595 N LYS B 13 45.124 -8.369 57.559 1.00 29.80 N ATOM 1596 CA LYS B 13 45.405 -9.670 58.167 1.00 33.19 C ATOM 1597 C LYS B 13 45.334 -9.617 59.679 1.00 35.18 C ATOM 1598 O LYS B 13 44.858 -10.567 60.321 1.00 33.30 O ATOM 1599 CB LYS B 13 46.763 -10.221 57.738 1.00 35.14 C ATOM 1600 CG LYS B 13 46.824 -10.661 56.266 1.00 43.12 C ATOM 1601 CD LYS B 13 45.627 -11.527 55.839 1.00 44.56 C ATOM 1602 CE LYS B 13 45.615 -12.919 56.491 1.00 48.01 C ATOM 1603 NZ LYS B 13 45.339 -12.930 57.964 1.00 47.35 N ATOM 1604 N ARG B 14 45.781 -8.494 60.242 1.00 36.99 N ATOM 1605 CA ARG B 14 45.753 -8.308 61.696 1.00 37.21 C ATOM 1606 C ARG B 14 44.296 -8.220 62.183 1.00 37.53 C ATOM 1607 O ARG B 14 43.859 -9.074 62.958 1.00 39.27 O ATOM 1608 CB ARG B 14 46.539 -7.054 62.135 1.00 41.14 C ATOM 1609 CG ARG B 14 47.970 -6.957 61.605 1.00 44.37 C ATOM 1610 CD ARG B 14 48.785 -5.848 62.292 1.00 47.68 C ATOM 1611 NE ARG B 14 50.041 -5.518 61.595 1.00 55.66 N ATOM 1612 CZ ARG B 14 50.918 -6.397 61.086 1.00 58.50 C ATOM 1613 NH1 ARG B 14 50.727 -7.713 61.160 1.00 61.68 N ATOM 1614 NH2 ARG B 14 52.021 -5.958 60.499 1.00 56.95 N ATOM 1615 N LEU B 15 43.536 -7.230 61.691 1.00 32.46 N ATOM 1616 CA LEU B 15 42.129 -7.040 62.070 1.00 21.33 C ATOM 1617 C LEU B 15 41.327 -8.312 61.889 1.00 19.82 C ATOM 1618 O LEU B 15 40.415 -8.596 62.656 1.00 20.78 O ATOM 1619 CB LEU B 15 41.492 -5.934 61.245 1.00 12.14 C ATOM 1620 CG LEU B 15 42.128 -4.569 61.434 1.00 8.50 C ATOM 1621 CD1 LEU B 15 41.413 -3.602 60.537 1.00 2.00 C ATOM 1622 CD2 LEU B 15 42.071 -4.157 62.898 1.00 4.08 C ATOM 1623 N LEU B 16 41.651 -9.061 60.850 1.00 21.66 N ATOM 1624 CA LEU B 16 40.968 -10.316 60.591 1.00 27.96 C ATOM 1625 C LEU B 16 41.276 -11.260 61.731 1.00 32.00 C ATOM 1626 O LEU B 16 40.433 -12.063 62.127 1.00 30.84 O ATOM 1627 CB LEU B 16 41.472 -10.938 59.303 1.00 30.87 C ATOM 1628 CG LEU B 16 40.647 -10.759 58.032 1.00 31.96 C ATOM 1629 CD1 LEU B 16 41.394 -11.448 56.879 1.00 36.21 C ATOM 1630 CD2 LEU B 16 39.268 -11.369 58.208 1.00 29.05 C ATOM 1631 N GLY B 17 42.507 -11.167 62.236 1.00 34.47 N ATOM 1632 CA GLY B 17 42.941 -12.000 63.345 1.00 34.50 C ATOM 1633 C GLY B 17 41.918 -12.031 64.461 1.00 36.13 C ATOM 1634 O GLY B 17 41.669 -13.078 65.046 1.00 41.60 O ATOM 1635 N TRP B 18 41.318 -10.889 64.769 1.00 38.77 N ATOM 1636 CA TRP B 18 40.298 -10.837 65.812 1.00 40.98 C ATOM 1637 C TRP B 18 38.956 -11.298 65.231 1.00 45.80 C ATOM 1638 O TRP B 18 38.059 -10.504 64.968 1.00 49.00 O ATOM 1639 CB TRP B 18 40.191 -9.432 66.363 1.00 34.97 C ATOM 1640 CG TRP B 18 41.436 -8.981 67.011 1.00 32.38 C ATOM 1641 CD1 TRP B 18 42.543 -8.517 66.397 1.00 32.09 C ATOM 1642 CD2 TRP B 18 41.666 -8.848 68.409 1.00 31.83 C ATOM 1643 NE1 TRP B 18 43.448 -8.077 67.318 1.00 32.90 N ATOM 1644 CE2 TRP B 18 42.929 -8.265 68.567 1.00 31.24 C ATOM 1645 CE3 TRP B 18 40.917 -9.155 69.545 1.00 35.70 C ATOM 1646 CZ2 TRP B 18 43.468 -7.980 69.812 1.00 33.92 C ATOM 1647 CZ3 TRP B 18 41.455 -8.873 70.788 1.00 37.85 C ATOM 1648 CH2 TRP B 18 42.715 -8.289 70.913 1.00 36.20 C ATOM 1649 N LYS B 19 38.861 -12.608 65.033 1.00 50.28 N ATOM 1650 CA LYS B 19 37.706 -13.282 64.470 1.00 51.03 C ATOM 1651 C LYS B 19 37.680 -13.191 62.933 1.00 55.11 C ATOM 1652 O LYS B 19 36.904 -12.459 62.335 1.00 54.09 O ATOM 1653 CB LYS B 19 36.424 -12.795 65.114 1.00 49.25 C ATOM 1654 CG LYS B 19 35.265 -13.685 64.807 1.00 52.23 C ATOM 1655 CD LYS B 19 34.456 -14.021 66.041 1.00 51.34 C ATOM 1656 CE LYS B 19 33.199 -14.752 65.611 1.00 54.99 C ATOM 1657 NZ LYS B 19 33.416 -15.591 64.382 1.00 54.39 N ATOM 1658 N LYS B 20 38.549 -13.992 62.321 1.00 61.99 N ATOM 1659 CA LYS B 20 38.717 -14.082 60.873 1.00 66.78 C ATOM 1660 C LYS B 20 37.407 -14.128 60.105 1.00 68.10 C ATOM 1661 O LYS B 20 37.144 -13.264 59.276 1.00 67.90 O ATOM 1662 CB LYS B 20 39.565 -15.314 60.518 1.00 72.18 C ATOM 1663 CG LYS B 20 38.951 -16.658 60.974 1.00 79.72 C ATOM 1664 CD LYS B 20 39.553 -17.875 60.266 1.00 79.39 C ATOM 1665 CE LYS B 20 38.722 -19.131 60.508 1.00 76.21 C ATOM 1666 NZ LYS B 20 39.227 -20.257 59.677 1.00 77.34 N ATOM 1667 N GLY B 21 36.597 -15.144 60.369 1.00 72.43 N ATOM 1668 CA GLY B 21 35.331 -15.268 59.677 1.00 81.68 C ATOM 1669 C GLY B 21 34.729 -16.646 59.814 1.00 87.06 C ATOM 1670 O GLY B 21 35.315 -17.623 59.345 1.00 89.33 O ATOM 1671 N GLU B 22 33.581 -16.728 60.485 1.00 92.79 N ATOM 1672 CA GLU B 22 32.893 -18.001 60.680 1.00 99.50 C ATOM 1673 C GLU B 22 31.869 -18.300 59.592 1.00103.64 C ATOM 1674 O GLU B 22 31.073 -17.436 59.210 1.00105.33 O ATOM 1675 CB GLU B 22 32.228 -18.079 62.059 1.00 98.56 C ATOM 1676 CG GLU B 22 32.796 -19.186 62.953 1.00 96.42 C ATOM 1677 CD GLU B 22 34.235 -18.919 63.386 1.00 94.16 C ATOM 1678 OE1 GLU B 22 34.425 -18.146 64.346 1.00 89.88 O ATOM 1679 OE2 GLU B 22 35.171 -19.477 62.770 1.00 93.96 O ATOM 1680 N GLN B 23 31.890 -19.565 59.175 1.00107.53 N ATOM 1681 CA GLN B 23 31.062 -20.196 58.137 1.00110.24 C ATOM 1682 C GLN B 23 32.099 -20.958 57.324 1.00110.17 C ATOM 1683 O GLN B 23 33.183 -20.447 57.013 1.00109.64 O ATOM 1684 CB GLN B 23 30.273 -19.213 57.255 1.00112.08 C ATOM 1685 CG GLN B 23 29.099 -19.828 56.443 1.00115.75 C ATOM 1686 CD GLN B 23 29.535 -20.680 55.246 1.00117.15 C ATOM 1687 OE1 GLN B 23 30.270 -20.217 54.369 1.00116.75 O ATOM 1688 NE2 GLN B 23 29.059 -21.922 55.198 1.00117.69 N ATOM 1689 N ASN B 24 31.774 -22.208 57.043 1.00109.25 N ATOM 1690 CA ASN B 24 32.771 -22.897 56.129 1.00105.98 C ATOM 1691 C ASN B 24 32.760 -22.570 54.648 1.00101.67 C ATOM 1692 O ASN B 24 31.713 -22.633 53.996 1.00 99.77 O ATOM 1693 CB ASN B 24 32.469 -24.387 56.348 1.00111.09 C ATOM 1694 CG ASN B 24 32.307 -24.746 57.834 1.00113.77 C ATOM 1695 OD1 ASN B 24 33.292 -24.945 58.551 1.00115.43 O ATOM 1696 ND2 ASN B 24 31.059 -24.823 58.297 1.00113.47 N ATOM 1697 N GLY B 25 33.920 -22.164 54.138 1.00 98.06 N ATOM 1698 CA GLY B 25 34.043 -21.889 52.716 1.00 93.24 C ATOM 1699 C GLY B 25 34.391 -20.500 52.223 1.00 87.56 C ATOM 1700 O GLY B 25 35.304 -19.837 52.723 1.00 85.33 O ATOM 1701 N GLN B 26 33.632 -20.076 51.214 1.00 84.68 N ATOM 1702 CA GLN B 26 33.786 -18.779 50.566 1.00 79.05 C ATOM 1703 C GLN B 26 33.609 -17.687 51.608 1.00 74.83 C ATOM 1704 O GLN B 26 33.838 -16.505 51.325 1.00 77.96 O ATOM 1705 CB GLN B 26 32.738 -18.630 49.447 1.00 81.98 C ATOM 1706 CG GLN B 26 33.196 -17.889 48.161 1.00 81.73 C ATOM 1707 CD GLN B 26 34.174 -18.685 47.273 1.00 82.06 C ATOM 1708 OE1 GLN B 26 34.891 -18.099 46.458 1.00 81.25 O ATOM 1709 NE2 GLN B 26 34.175 -20.014 47.403 1.00 79.17 N ATOM 1710 N GLU B 27 33.204 -18.086 52.812 1.00 66.91 N ATOM 1711 CA GLU B 27 33.011 -17.150 53.900 1.00 58.36 C ATOM 1712 C GLU B 27 34.300 -16.507 54.400 1.00 55.45 C ATOM 1713 O GLU B 27 34.359 -15.293 54.536 1.00 58.79 O ATOM 1714 CB GLU B 27 32.277 -17.803 55.050 1.00 54.51 C ATOM 1715 CG GLU B 27 31.523 -16.785 55.891 1.00 52.75 C ATOM 1716 CD GLU B 27 30.244 -16.284 55.228 1.00 51.64 C ATOM 1717 OE1 GLU B 27 29.780 -16.920 54.250 1.00 47.61 O ATOM 1718 OE2 GLU B 27 29.692 -15.263 55.710 1.00 47.89 O ATOM 1719 N GLU B 28 35.337 -17.287 54.661 1.00 51.75 N ATOM 1720 CA GLU B 28 36.588 -16.687 55.123 1.00 53.66 C ATOM 1721 C GLU B 28 37.118 -15.676 54.106 1.00 49.66 C ATOM 1722 O GLU B 28 37.650 -14.626 54.474 1.00 45.67 O ATOM 1723 CB GLU B 28 37.648 -17.758 55.386 1.00 62.61 C ATOM 1724 CG GLU B 28 38.975 -17.212 55.934 1.00 70.46 C ATOM 1725 CD GLU B 28 38.800 -16.337 57.183 1.00 76.47 C ATOM 1726 OE1 GLU B 28 37.858 -16.586 57.982 1.00 76.00 O ATOM 1727 OE2 GLU B 28 39.614 -15.396 57.359 1.00 76.48 O ATOM 1728 N LYS B 29 36.959 -16.005 52.826 1.00 48.23 N ATOM 1729 CA LYS B 29 37.398 -15.144 51.729 1.00 48.29 C ATOM 1730 C LYS B 29 36.540 -13.883 51.704 1.00 42.59 C ATOM 1731 O LYS B 29 37.058 -12.777 51.551 1.00 41.67 O ATOM 1732 CB LYS B 29 37.297 -15.895 50.393 1.00 57.03 C ATOM 1733 CG LYS B 29 37.738 -15.098 49.140 1.00 67.48 C ATOM 1734 CD LYS B 29 37.713 -15.995 47.885 1.00 74.66 C ATOM 1735 CE LYS B 29 37.374 -15.240 46.586 1.00 75.28 C ATOM 1736 NZ LYS B 29 38.542 -14.572 45.957 1.00 74.54 N ATOM 1737 N TRP B 30 35.231 -14.056 51.861 1.00 35.62 N ATOM 1738 CA TRP B 30 34.312 -12.928 51.908 1.00 30.96 C ATOM 1739 C TRP B 30 34.553 -12.007 53.112 1.00 33.83 C ATOM 1740 O TRP B 30 34.392 -10.799 52.993 1.00 40.12 O ATOM 1741 CB TRP B 30 32.895 -13.409 51.976 1.00 28.12 C ATOM 1742 CG TRP B 30 31.924 -12.267 51.975 1.00 30.45 C ATOM 1743 CD1 TRP B 30 31.300 -11.721 50.880 1.00 27.41 C ATOM 1744 CD2 TRP B 30 31.391 -11.583 53.118 1.00 23.02 C ATOM 1745 NE1 TRP B 30 30.402 -10.759 51.276 1.00 22.06 N ATOM 1746 CE2 TRP B 30 30.441 -10.651 52.640 1.00 21.50 C ATOM 1747 CE3 TRP B 30 31.624 -11.667 54.492 1.00 18.38 C ATOM 1748 CZ2 TRP B 30 29.733 -9.817 53.488 1.00 18.41 C ATOM 1749 CZ3 TRP B 30 30.927 -10.840 55.325 1.00 19.48 C ATOM 1750 CH2 TRP B 30 29.989 -9.924 54.821 1.00 21.74 C ATOM 1751 N CYS B 31 34.876 -12.581 54.276 1.00 32.01 N ATOM 1752 CA CYS B 31 35.163 -11.813 55.494 1.00 27.29 C ATOM 1753 C CYS B 31 36.379 -10.930 55.274 1.00 22.53 C ATOM 1754 O CYS B 31 36.479 -9.812 55.786 1.00 16.50 O ATOM 1755 CB CYS B 31 35.390 -12.770 56.669 1.00 29.05 C ATOM 1756 SG CYS B 31 33.899 -13.743 57.083 1.00 30.69 S ATOM 1757 N GLU B 32 37.288 -11.453 54.469 1.00 23.19 N ATOM 1758 CA GLU B 32 38.501 -10.765 54.114 1.00 25.04 C ATOM 1759 C GLU B 32 38.141 -9.594 53.208 1.00 23.22 C ATOM 1760 O GLU B 32 38.637 -8.486 53.386 1.00 21.20 O ATOM 1761 CB GLU B 32 39.413 -11.748 53.401 1.00 28.66 C ATOM 1762 CG GLU B 32 40.688 -11.144 52.896 1.00 44.13 C ATOM 1763 CD GLU B 32 41.704 -12.194 52.501 1.00 50.95 C ATOM 1764 OE1 GLU B 32 41.286 -13.347 52.221 1.00 48.89 O ATOM 1765 OE2 GLU B 32 42.920 -11.858 52.483 1.00 58.47 O ATOM 1766 N LYS B 33 37.244 -9.836 52.258 1.00 20.26 N ATOM 1767 CA LYS B 33 36.824 -8.796 51.347 1.00 19.51 C ATOM 1768 C LYS B 33 36.124 -7.725 52.145 1.00 23.32 C ATOM 1769 O LYS B 33 36.386 -6.534 51.962 1.00 28.22 O ATOM 1770 CB LYS B 33 35.876 -9.347 50.297 1.00 21.91 C ATOM 1771 CG LYS B 33 36.514 -10.328 49.336 1.00 29.25 C ATOM 1772 CD LYS B 33 37.698 -9.696 48.660 1.00 39.16 C ATOM 1773 CE LYS B 33 38.452 -10.680 47.778 1.00 46.63 C ATOM 1774 NZ LYS B 33 39.783 -10.113 47.367 1.00 43.47 N ATOM 1775 N ALA B 34 35.290 -8.149 53.089 1.00 22.63 N ATOM 1776 CA ALA B 34 34.537 -7.208 53.919 1.00 20.54 C ATOM 1777 C ALA B 34 35.459 -6.333 54.784 1.00 21.01 C ATOM 1778 O ALA B 34 35.147 -5.183 55.097 1.00 16.48 O ATOM 1779 CB ALA B 34 33.504 -7.956 54.791 1.00 17.50 C ATOM 1780 N VAL B 35 36.611 -6.862 55.166 1.00 21.25 N ATOM 1781 CA VAL B 35 37.485 -6.072 56.003 1.00 18.14 C ATOM 1782 C VAL B 35 38.203 -5.116 55.091 1.00 21.45 C ATOM 1783 O VAL B 35 38.418 -3.960 55.439 1.00 21.83 O ATOM 1784 CB VAL B 35 38.459 -6.964 56.780 1.00 18.94 C ATOM 1785 CG1 VAL B 35 39.366 -6.109 57.683 1.00 14.02 C ATOM 1786 CG2 VAL B 35 37.668 -8.016 57.599 1.00 7.02 C ATOM 1787 N LYS B 36 38.495 -5.588 53.884 1.00 23.58 N ATOM 1788 CA LYS B 36 39.177 -4.772 52.891 1.00 25.09 C ATOM 1789 C LYS B 36 38.396 -3.515 52.553 1.00 24.54 C ATOM 1790 O LYS B 36 39.005 -2.452 52.426 1.00 27.91 O ATOM 1791 CB LYS B 36 39.437 -5.564 51.610 1.00 33.01 C ATOM 1792 CG LYS B 36 40.688 -6.417 51.635 1.00 41.30 C ATOM 1793 CD LYS B 36 41.272 -6.576 50.227 1.00 45.30 C ATOM 1794 CE LYS B 36 40.970 -7.950 49.646 1.00 50.55 C ATOM 1795 NZ LYS B 36 41.617 -9.068 50.424 1.00 48.70 N ATOM 1796 N SER B 37 37.075 -3.629 52.360 1.00 20.13 N ATOM 1797 CA SER B 37 36.261 -2.447 52.046 1.00 19.73 C ATOM 1798 C SER B 37 36.368 -1.460 53.179 1.00 23.67 C ATOM 1799 O SER B 37 36.645 -0.285 52.958 1.00 32.72 O ATOM 1800 CB SER B 37 34.766 -2.743 51.909 1.00 12.08 C ATOM 1801 OG SER B 37 34.503 -3.779 51.004 1.00 24.81 O ATOM 1802 N LEU B 38 36.137 -1.932 54.399 1.00 22.54 N ATOM 1803 CA LEU B 38 36.173 -1.050 55.541 1.00 16.49 C ATOM 1804 C LEU B 38 37.494 -0.339 55.613 1.00 16.37 C ATOM 1805 O LEU B 38 37.526 0.870 55.686 1.00 22.49 O ATOM 1806 CB LEU B 38 35.940 -1.814 56.828 1.00 12.44 C ATOM 1807 CG LEU B 38 35.788 -0.828 57.965 1.00 8.53 C ATOM 1808 CD1 LEU B 38 34.543 -0.012 57.765 1.00 9.73 C ATOM 1809 CD2 LEU B 38 35.739 -1.565 59.241 1.00 10.86 C ATOM 1810 N VAL B 39 38.586 -1.084 55.536 1.00 16.61 N ATOM 1811 CA VAL B 39 39.924 -0.490 55.622 1.00 16.94 C ATOM 1812 C VAL B 39 40.212 0.539 54.517 1.00 17.00 C ATOM 1813 O VAL B 39 40.789 1.594 54.767 1.00 14.31 O ATOM 1814 CB VAL B 39 41.037 -1.595 55.634 1.00 19.07 C ATOM 1815 CG1 VAL B 39 42.424 -0.965 55.750 1.00 15.06 C ATOM 1816 CG2 VAL B 39 40.799 -2.569 56.792 1.00 16.72 C ATOM 1817 N LYS B 40 39.801 0.244 53.297 1.00 17.82 N ATOM 1818 CA LYS B 40 40.052 1.167 52.222 1.00 20.33 C ATOM 1819 C LYS B 40 39.367 2.503 52.488 1.00 22.91 C ATOM 1820 O LYS B 40 39.965 3.570 52.312 1.00 26.60 O ATOM 1821 CB LYS B 40 39.591 0.583 50.891 1.00 24.04 C ATOM 1822 CG LYS B 40 39.823 1.551 49.725 1.00 39.60 C ATOM 1823 CD LYS B 40 39.241 1.055 48.398 1.00 49.77 C ATOM 1824 CE LYS B 40 39.804 -0.304 48.007 1.00 53.33 C ATOM 1825 NZ LYS B 40 41.285 -0.251 47.888 1.00 60.39 N ATOM 1826 N LYS B 41 38.132 2.440 52.972 1.00 23.23 N ATOM 1827 CA LYS B 41 37.342 3.640 53.226 1.00 23.93 C ATOM 1828 C LYS B 41 37.895 4.443 54.408 1.00 27.69 C ATOM 1829 O LYS B 41 37.973 5.669 54.355 1.00 28.56 O ATOM 1830 CB LYS B 41 35.857 3.269 53.474 1.00 23.29 C ATOM 1831 CG LYS B 41 35.195 2.333 52.426 1.00 23.57 C ATOM 1832 CD LYS B 41 33.655 2.246 52.570 1.00 19.05 C ATOM 1833 CE LYS B 41 33.062 0.906 52.058 1.00 23.44 C ATOM 1834 NZ LYS B 41 32.983 -0.245 53.097 1.00 21.99 N ATOM 1835 N LEU B 42 38.260 3.742 55.481 1.00 32.29 N ATOM 1836 CA LEU B 42 38.795 4.375 56.686 1.00 27.75 C ATOM 1837 C LEU B 42 40.114 5.073 56.404 1.00 31.54 C ATOM 1838 O LEU B 42 40.345 6.150 56.940 1.00 32.46 O ATOM 1839 CB LEU B 42 38.975 3.361 57.814 1.00 19.47 C ATOM 1840 CG LEU B 42 37.651 2.795 58.300 1.00 18.07 C ATOM 1841 CD1 LEU B 42 37.844 1.809 59.432 1.00 10.10 C ATOM 1842 CD2 LEU B 42 36.805 3.949 58.730 1.00 17.01 C ATOM 1843 N LYS B 43 40.988 4.468 55.593 1.00 33.34 N ATOM 1844 CA LYS B 43 42.260 5.114 55.252 1.00 35.42 C ATOM 1845 C LYS B 43 41.952 6.498 54.710 1.00 40.39 C ATOM 1846 O LYS B 43 42.475 7.497 55.206 1.00 45.93 O ATOM 1847 CB LYS B 43 43.001 4.368 54.163 1.00 33.34 C ATOM 1848 CG LYS B 43 43.849 3.245 54.621 1.00 38.23 C ATOM 1849 CD LYS B 43 44.551 2.670 53.403 1.00 47.68 C ATOM 1850 CE LYS B 43 45.453 1.479 53.741 1.00 54.64 C ATOM 1851 NZ LYS B 43 44.733 0.166 53.846 1.00 57.89 N ATOM 1852 N LYS B 44 41.075 6.549 53.711 1.00 42.71 N ATOM 1853 CA LYS B 44 40.678 7.808 53.087 1.00 46.45 C ATOM 1854 C LYS B 44 40.242 8.898 54.092 1.00 46.48 C ATOM 1855 O LYS B 44 40.427 10.093 53.843 1.00 44.02 O ATOM 1856 CB LYS B 44 39.545 7.563 52.081 1.00 47.02 C ATOM 1857 CG LYS B 44 39.856 6.570 50.964 1.00 54.01 C ATOM 1858 CD LYS B 44 38.648 6.467 50.009 1.00 60.03 C ATOM 1859 CE LYS B 44 38.732 5.267 49.063 1.00 58.72 C ATOM 1860 NZ LYS B 44 37.470 5.105 48.286 1.00 59.35 N ATOM 1861 N THR B 45 39.652 8.487 55.211 1.00 46.28 N ATOM 1862 CA THR B 45 39.186 9.435 56.220 1.00 44.17 C ATOM 1863 C THR B 45 39.990 9.429 57.516 1.00 43.49 C ATOM 1864 O THR B 45 39.640 10.132 58.456 1.00 41.59 O ATOM 1865 CB THR B 45 37.678 9.226 56.543 1.00 42.67 C ATOM 1866 OG1 THR B 45 37.383 7.824 56.672 1.00 44.76 O ATOM 1867 CG2 THR B 45 36.828 9.815 55.456 1.00 39.48 C ATOM 1868 N GLY B 46 41.069 8.651 57.559 1.00 44.26 N ATOM 1869 CA GLY B 46 41.897 8.588 58.749 1.00 44.08 C ATOM 1870 C GLY B 46 41.194 8.116 60.011 1.00 45.86 C ATOM 1871 O GLY B 46 41.121 8.850 60.999 1.00 54.88 O ATOM 1872 N GLN B 47 40.637 6.909 59.978 1.00 43.06 N ATOM 1873 CA GLN B 47 39.977 6.327 61.153 1.00 35.50 C ATOM 1874 C GLN B 47 40.469 4.887 61.318 1.00 34.15 C ATOM 1875 O GLN B 47 40.069 4.199 62.256 1.00 31.27 O ATOM 1876 CB GLN B 47 38.455 6.316 61.006 1.00 28.62 C ATOM 1877 CG GLN B 47 37.869 7.622 60.618 1.00 29.80 C ATOM 1878 CD GLN B 47 36.361 7.590 60.567 1.00 36.57 C ATOM 1879 OE1 GLN B 47 35.692 7.473 61.596 1.00 40.98 O ATOM 1880 NE2 GLN B 47 35.810 7.715 59.368 1.00 39.44 N ATOM 1881 N LEU B 48 41.383 4.452 60.452 1.00 32.33 N ATOM 1882 CA LEU B 48 41.855 3.085 60.530 1.00 37.08 C ATOM 1883 C LEU B 48 42.435 2.767 61.902 1.00 42.17 C ATOM 1884 O LEU B 48 42.263 1.657 62.422 1.00 44.70 O ATOM 1885 CB LEU B 48 42.870 2.768 59.428 1.00 33.47 C ATOM 1886 CG LEU B 48 42.833 1.322 58.865 1.00 34.91 C ATOM 1887 CD1 LEU B 48 44.246 0.794 58.702 1.00 32.26 C ATOM 1888 CD2 LEU B 48 42.015 0.340 59.749 1.00 30.30 C ATOM 1889 N ASP B 49 43.079 3.744 62.517 1.00 43.30 N ATOM 1890 CA ASP B 49 43.654 3.491 63.825 1.00 47.43 C ATOM 1891 C ASP B 49 42.619 3.436 64.952 1.00 48.29 C ATOM 1892 O ASP B 49 42.767 2.633 65.872 1.00 52.49 O ATOM 1893 CB ASP B 49 44.798 4.467 64.130 1.00 48.13 C ATOM 1894 CG ASP B 49 46.052 4.191 63.281 1.00 47.68 C ATOM 1895 OD1 ASP B 49 46.600 3.068 63.343 1.00 44.12 O ATOM 1896 OD2 ASP B 49 46.496 5.103 62.554 1.00 44.75 O ATOM 1897 N GLU B 50 41.566 4.252 64.889 1.00 48.63 N ATOM 1898 CA GLU B 50 40.542 4.200 65.939 1.00 46.79 C ATOM 1899 C GLU B 50 39.794 2.887 65.808 1.00 41.91 C ATOM 1900 O GLU B 50 39.179 2.423 66.763 1.00 41.36 O ATOM 1901 CB GLU B 50 39.583 5.387 65.870 1.00 54.24 C ATOM 1902 CG GLU B 50 38.840 5.567 64.558 1.00 69.81 C ATOM 1903 CD GLU B 50 38.161 6.941 64.433 1.00 76.91 C ATOM 1904 OE1 GLU B 50 38.815 7.974 64.741 1.00 80.06 O ATOM 1905 OE2 GLU B 50 36.975 6.983 64.010 1.00 78.60 O ATOM 1906 N LEU B 51 39.871 2.293 64.617 1.00 36.83 N ATOM 1907 CA LEU B 51 39.261 0.995 64.336 1.00 31.96 C ATOM 1908 C LEU B 51 40.161 -0.029 65.042 1.00 34.90 C ATOM 1909 O LEU B 51 39.685 -0.891 65.799 1.00 34.29 O ATOM 1910 CB LEU B 51 39.278 0.717 62.829 1.00 22.31 C ATOM 1911 CG LEU B 51 38.347 -0.314 62.190 1.00 15.23 C ATOM 1912 CD1 LEU B 51 39.075 -1.086 61.132 1.00 15.86 C ATOM 1913 CD2 LEU B 51 37.829 -1.239 63.184 1.00 11.15 C ATOM 1914 N GLU B 52 41.466 0.094 64.790 1.00 34.33 N ATOM 1915 CA GLU B 52 42.498 -0.775 65.354 1.00 32.24 C ATOM 1916 C GLU B 52 42.399 -0.786 66.876 1.00 28.36 C ATOM 1917 O GLU B 52 42.398 -1.846 67.496 1.00 25.13 O ATOM 1918 CB GLU B 52 43.838 -0.220 64.947 1.00 41.81 C ATOM 1919 CG GLU B 52 44.950 -1.184 64.815 1.00 51.39 C ATOM 1920 CD GLU B 52 46.171 -0.444 64.353 1.00 63.31 C ATOM 1921 OE1 GLU B 52 46.180 0.057 63.197 1.00 71.00 O ATOM 1922 OE2 GLU B 52 47.097 -0.294 65.176 1.00 73.52 O ATOM 1923 N LYS B 53 42.290 0.394 67.477 1.00 23.91 N ATOM 1924 CA LYS B 53 42.157 0.491 68.923 1.00 26.04 C ATOM 1925 C LYS B 53 40.910 -0.235 69.425 1.00 25.14 C ATOM 1926 O LYS B 53 41.001 -1.124 70.265 1.00 22.37 O ATOM 1927 CB LYS B 53 42.073 1.948 69.375 1.00 30.74 C ATOM 1928 CG LYS B 53 41.889 2.046 70.900 1.00 42.54 C ATOM 1929 CD LYS B 53 41.602 3.463 71.435 1.00 45.45 C ATOM 1930 CE LYS B 53 41.585 3.485 72.987 1.00 42.90 C ATOM 1931 NZ LYS B 53 40.606 2.524 73.605 1.00 32.08 N ATOM 1932 N ALA B 54 39.752 0.148 68.892 1.00 26.74 N ATOM 1933 CA ALA B 54 38.478 -0.424 69.291 1.00 27.44 C ATOM 1934 C ALA B 54 38.406 -1.936 69.193 1.00 30.99 C ATOM 1935 O ALA B 54 37.959 -2.573 70.133 1.00 35.35 O ATOM 1936 CB ALA B 54 37.331 0.226 68.521 1.00 26.63 C ATOM 1937 N ILE B 55 38.868 -2.524 68.092 1.00 32.83 N ATOM 1938 CA ILE B 55 38.811 -3.980 67.950 1.00 31.02 C ATOM 1939 C ILE B 55 39.708 -4.669 68.950 1.00 30.93 C ATOM 1940 O ILE B 55 39.297 -5.623 69.604 1.00 32.95 O ATOM 1941 CB ILE B 55 39.175 -4.461 66.525 1.00 28.87 C ATOM 1942 CG1 ILE B 55 38.077 -4.062 65.559 1.00 28.23 C ATOM 1943 CG2 ILE B 55 39.255 -5.970 66.476 1.00 26.27 C ATOM 1944 CD1 ILE B 55 36.697 -4.397 66.101 1.00 27.26 C ATOM 1945 N THR B 56 40.917 -4.162 69.107 1.00 29.97 N ATOM 1946 CA THR B 56 41.855 -4.766 70.049 1.00 36.88 C ATOM 1947 C THR B 56 41.566 -4.500 71.540 1.00 35.59 C ATOM 1948 O THR B 56 41.402 -5.444 72.327 1.00 35.51 O ATOM 1949 CB THR B 56 43.274 -4.336 69.732 1.00 36.90 C ATOM 1950 OG1 THR B 56 43.377 -2.907 69.875 1.00 43.05 O ATOM 1951 CG2 THR B 56 43.627 -4.763 68.306 1.00 30.23 C ATOM 1952 N THR B 57 41.520 -3.228 71.927 1.00 32.34 N ATOM 1953 CA THR B 57 41.237 -2.865 73.317 1.00 34.93 C ATOM 1954 C THR B 57 39.788 -3.105 73.769 1.00 36.50 C ATOM 1955 O THR B 57 39.507 -3.106 74.967 1.00 33.37 O ATOM 1956 CB THR B 57 41.589 -1.399 73.613 1.00 35.31 C ATOM 1957 OG1 THR B 57 40.640 -0.528 72.991 1.00 34.82 O ATOM 1958 CG2 THR B 57 42.952 -1.079 73.074 1.00 41.99 C ATOM 1959 N GLN B 58 38.868 -3.232 72.809 1.00 40.61 N ATOM 1960 CA GLN B 58 37.448 -3.483 73.086 1.00 40.51 C ATOM 1961 C GLN B 58 36.808 -2.384 73.943 1.00 39.59 C ATOM 1962 O GLN B 58 35.789 -2.592 74.614 1.00 35.08 O ATOM 1963 CB GLN B 58 37.314 -4.848 73.745 1.00 43.82 C ATOM 1964 CG GLN B 58 38.133 -5.885 73.031 1.00 49.90 C ATOM 1965 CD GLN B 58 38.401 -7.082 73.884 1.00 58.05 C ATOM 1966 OE1 GLN B 58 37.465 -7.752 74.334 1.00 65.91 O ATOM 1967 NE2 GLN B 58 39.684 -7.372 74.126 1.00 57.23 N ATOM 1968 N ASN B 59 37.394 -1.198 73.865 1.00 39.04 N ATOM 1969 CA ASN B 59 36.940 -0.054 74.626 1.00 40.23 C ATOM 1970 C ASN B 59 35.681 0.529 74.021 1.00 35.91 C ATOM 1971 O ASN B 59 35.714 1.116 72.947 1.00 34.93 O ATOM 1972 CB ASN B 59 38.053 0.996 74.672 1.00 49.72 C ATOM 1973 CG ASN B 59 37.848 2.013 75.774 1.00 56.30 C ATOM 1974 OD1 ASN B 59 37.136 1.755 76.746 1.00 59.52 O ATOM 1975 ND2 ASN B 59 38.490 3.171 75.643 1.00 61.44 N ATOM 1976 N VAL B 60 34.569 0.364 74.716 1.00 33.60 N ATOM 1977 CA VAL B 60 33.306 0.874 74.239 1.00 35.59 C ATOM 1978 C VAL B 60 33.375 2.348 73.975 1.00 37.23 C ATOM 1979 O VAL B 60 32.790 2.838 73.021 1.00 38.70 O ATOM 1980 CB VAL B 60 32.173 0.605 75.228 1.00 40.53 C ATOM 1981 CG1 VAL B 60 30.882 1.334 74.803 1.00 42.38 C ATOM 1982 CG2 VAL B 60 31.903 -0.882 75.286 1.00 43.75 C ATOM 1983 N ASN B 61 34.115 3.078 74.779 1.00 44.15 N ATOM 1984 CA ASN B 61 34.140 4.497 74.510 1.00 53.42 C ATOM 1985 C ASN B 61 35.259 4.962 73.609 1.00 52.58 C ATOM 1986 O ASN B 61 36.151 5.712 74.013 1.00 55.69 O ATOM 1987 CB ASN B 61 34.027 5.327 75.788 1.00 65.83 C ATOM 1988 CG ASN B 61 35.070 4.967 76.807 1.00 75.45 C ATOM 1989 OD1 ASN B 61 35.726 3.931 76.705 1.00 81.68 O ATOM 1990 ND2 ASN B 61 35.234 5.821 77.805 1.00 82.73 N ATOM 1991 N THR B 62 35.226 4.446 72.388 1.00 48.95 N ATOM 1992 CA THR B 62 36.172 4.837 71.355 1.00 42.04 C ATOM 1993 C THR B 62 35.390 5.812 70.473 1.00 40.44 C ATOM 1994 O THR B 62 34.165 5.952 70.647 1.00 40.48 O ATOM 1995 CB THR B 62 36.604 3.640 70.542 1.00 36.67 C ATOM 1996 OG1 THR B 62 35.643 2.593 70.703 1.00 31.95 O ATOM 1997 CG2 THR B 62 37.949 3.178 71.009 1.00 36.48 C ATOM 1998 N LYS B 63 36.071 6.521 69.577 1.00 34.99 N ATOM 1999 CA LYS B 63 35.381 7.460 68.697 1.00 34.85 C ATOM 2000 C LYS B 63 34.480 6.645 67.770 1.00 36.54 C ATOM 2001 O LYS B 63 34.622 5.414 67.673 1.00 40.88 O ATOM 2002 CB LYS B 63 36.358 8.260 67.828 1.00 38.91 C ATOM 2003 CG LYS B 63 37.346 9.163 68.534 1.00 45.83 C ATOM 2004 CD LYS B 63 38.465 8.387 69.269 1.00 55.83 C ATOM 2005 CE LYS B 63 39.247 7.391 68.378 1.00 54.14 C ATOM 2006 NZ LYS B 63 38.836 5.966 68.593 1.00 47.69 N ATOM 2007 N CYS B 64 33.542 7.321 67.105 1.00 34.74 N ATOM 2008 CA CYS B 64 32.636 6.659 66.177 1.00 28.10 C ATOM 2009 C CYS B 64 33.415 6.456 64.873 1.00 33.80 C ATOM 2010 O CYS B 64 34.023 7.408 64.340 1.00 35.30 O ATOM 2011 CB CYS B 64 31.352 7.481 65.974 1.00 17.41 C ATOM 2012 SG CYS B 64 29.902 6.829 66.925 1.00 19.85 S ATOM 2013 N ILE B 65 33.573 5.180 64.507 1.00 32.23 N ATOM 2014 CA ILE B 65 34.266 4.811 63.281 1.00 31.51 C ATOM 2015 C ILE B 65 33.125 4.952 62.295 1.00 32.61 C ATOM 2016 O ILE B 65 32.132 4.227 62.370 1.00 37.84 O ATOM 2017 CB ILE B 65 34.797 3.338 63.312 1.00 31.09 C ATOM 2018 CG1 ILE B 65 36.048 3.203 64.184 1.00 25.48 C ATOM 2019 CG2 ILE B 65 35.209 2.908 61.923 1.00 29.42 C ATOM 2020 CD1 ILE B 65 35.830 3.355 65.654 1.00 26.46 C ATOM 2021 N THR B 66 33.252 5.892 61.382 1.00 31.06 N ATOM 2022 CA THR B 66 32.179 6.155 60.462 1.00 33.44 C ATOM 2023 C THR B 66 32.376 5.846 58.958 1.00 38.28 C ATOM 2024 O THR B 66 33.455 6.071 58.394 1.00 39.23 O ATOM 2025 CB THR B 66 31.732 7.593 60.712 1.00 31.68 C ATOM 2026 OG1 THR B 66 30.657 7.592 61.653 1.00 27.09 O ATOM 2027 CG2 THR B 66 31.335 8.284 59.447 1.00 37.54 C ATOM 2028 N ILE B 67 31.308 5.336 58.331 1.00 37.11 N ATOM 2029 CA ILE B 67 31.262 4.993 56.912 1.00 29.33 C ATOM 2030 C ILE B 67 29.994 5.685 56.369 1.00 33.44 C ATOM 2031 O ILE B 67 28.964 5.742 57.061 1.00 36.95 O ATOM 2032 CB ILE B 67 31.274 3.442 56.741 1.00 27.75 C ATOM 2033 CG1 ILE B 67 32.545 3.040 56.017 1.00 27.52 C ATOM 2034 CG2 ILE B 67 30.022 2.888 56.081 1.00 22.06 C ATOM 2035 CD1 ILE B 67 33.769 3.294 56.844 1.00 31.33 C ATOM 2036 N PRO B 68 30.060 6.251 55.148 1.00 29.94 N ATOM 2037 CA PRO B 68 28.943 6.961 54.501 1.00 27.76 C ATOM 2038 C PRO B 68 27.737 6.092 54.229 1.00 23.04 C ATOM 2039 O PRO B 68 27.890 4.975 53.768 1.00 25.01 O ATOM 2040 CB PRO B 68 29.546 7.420 53.172 1.00 27.86 C ATOM 2041 CG PRO B 68 31.039 7.277 53.361 1.00 30.73 C ATOM 2042 CD PRO B 68 31.156 6.052 54.193 1.00 29.28 C ATOM 2043 N ARG B 69 26.535 6.594 54.465 1.00 22.82 N ATOM 2044 CA ARG B 69 25.366 5.765 54.178 1.00 26.31 C ATOM 2045 C ARG B 69 24.926 5.866 52.733 1.00 27.18 C ATOM 2046 O ARG B 69 25.322 6.767 51.994 1.00 34.02 O ATOM 2047 CB ARG B 69 24.172 6.042 55.105 1.00 26.39 C ATOM 2048 CG ARG B 69 23.120 7.014 54.602 1.00 25.34 C ATOM 2049 CD ARG B 69 21.833 6.761 55.334 1.00 22.23 C ATOM 2050 NE ARG B 69 22.072 6.661 56.768 1.00 28.30 N ATOM 2051 CZ ARG B 69 21.570 5.718 57.559 1.00 30.79 C ATOM 2052 NH1 ARG B 69 20.784 4.771 57.046 1.00 30.45 N ATOM 2053 NH2 ARG B 69 21.841 5.743 58.867 1.00 25.12 N ATOM 2054 N SER B 70 24.061 4.948 52.355 1.00 20.58 N ATOM 2055 CA SER B 70 23.564 4.892 51.011 1.00 17.64 C ATOM 2056 C SER B 70 22.057 5.112 51.079 1.00 18.42 C ATOM 2057 O SER B 70 21.489 4.958 52.145 1.00 15.57 O ATOM 2058 CB SER B 70 23.890 3.509 50.463 1.00 14.49 C ATOM 2059 OG SER B 70 23.592 2.525 51.428 1.00 10.27 O ATOM 2060 N LEU B 71 21.414 5.474 49.963 1.00 19.31 N ATOM 2061 CA LEU B 71 19.968 5.691 49.954 1.00 18.15 C ATOM 2062 C LEU B 71 19.240 4.597 50.719 1.00 20.50 C ATOM 2063 O LEU B 71 18.551 4.885 51.686 1.00 24.23 O ATOM 2064 CB LEU B 71 19.390 5.803 48.533 1.00 19.53 C ATOM 2065 CG LEU B 71 19.329 7.178 47.857 1.00 14.07 C ATOM 2066 CD1 LEU B 71 19.182 8.214 48.942 1.00 15.30 C ATOM 2067 CD2 LEU B 71 20.578 7.460 47.054 1.00 15.63 C ATOM 2068 N ASP B 72 19.391 3.343 50.320 1.00 24.36 N ATOM 2069 CA ASP B 72 18.707 2.291 51.067 1.00 29.45 C ATOM 2070 C ASP B 72 19.382 1.900 52.373 1.00 27.59 C ATOM 2071 O ASP B 72 18.809 1.185 53.190 1.00 28.42 O ATOM 2072 CB ASP B 72 18.396 1.047 50.212 1.00 38.36 C ATOM 2073 CG ASP B 72 19.628 0.332 49.685 1.00 41.96 C ATOM 2074 OD1 ASP B 72 20.780 0.655 50.049 1.00 47.26 O ATOM 2075 OD2 ASP B 72 19.409 -0.592 48.872 1.00 51.25 O ATOM 2076 N GLY B 73 20.611 2.357 52.555 1.00 28.12 N ATOM 2077 CA GLY B 73 21.331 2.051 53.771 1.00 22.18 C ATOM 2078 C GLY B 73 22.054 0.734 53.791 1.00 14.78 C ATOM 2079 O GLY B 73 22.557 0.368 54.835 1.00 17.63 O ATOM 2080 N ARG B 74 22.073 0.011 52.675 1.00 10.40 N ATOM 2081 CA ARG B 74 22.785 -1.261 52.608 1.00 11.35 C ATOM 2082 C ARG B 74 24.228 -1.088 52.102 1.00 13.71 C ATOM 2083 O ARG B 74 24.593 -0.049 51.524 1.00 18.44 O ATOM 2084 CB ARG B 74 22.033 -2.275 51.743 1.00 2.00 C ATOM 2085 CG ARG B 74 20.723 -2.694 52.370 1.00 5.37 C ATOM 2086 CD ARG B 74 20.074 -3.890 51.704 1.00 2.05 C ATOM 2087 NE ARG B 74 19.490 -3.539 50.419 1.00 8.63 N ATOM 2088 CZ ARG B 74 18.995 -4.412 49.548 1.00 10.91 C ATOM 2089 NH1 ARG B 74 19.018 -5.705 49.831 1.00 14.54 N ATOM 2090 NH2 ARG B 74 18.469 -3.986 48.399 1.00 11.41 N ATOM 2091 N LEU B 75 25.052 -2.103 52.327 1.00 8.94 N ATOM 2092 CA LEU B 75 26.439 -2.094 51.899 1.00 3.48 C ATOM 2093 C LEU B 75 26.565 -3.392 51.152 1.00 6.60 C ATOM 2094 O LEU B 75 25.963 -4.394 51.521 1.00 12.76 O ATOM 2095 CB LEU B 75 27.369 -2.131 53.097 1.00 2.01 C ATOM 2096 CG LEU B 75 28.874 -2.209 52.916 1.00 2.00 C ATOM 2097 CD1 LEU B 75 29.341 -0.971 52.264 1.00 2.02 C ATOM 2098 CD2 LEU B 75 29.579 -2.375 54.236 1.00 2.00 C ATOM 2099 N GLN B 76 27.293 -3.373 50.057 1.00 4.95 N ATOM 2100 CA GLN B 76 27.475 -4.572 49.296 1.00 7.10 C ATOM 2101 C GLN B 76 28.939 -4.933 49.377 1.00 12.75 C ATOM 2102 O GLN B 76 29.791 -4.056 49.218 1.00 16.98 O ATOM 2103 CB GLN B 76 27.109 -4.340 47.829 1.00 3.98 C ATOM 2104 CG GLN B 76 27.327 -5.572 46.989 1.00 2.26 C ATOM 2105 CD GLN B 76 26.962 -5.423 45.530 1.00 6.89 C ATOM 2106 OE1 GLN B 76 25.870 -4.959 45.184 1.00 2.51 O ATOM 2107 NE2 GLN B 76 27.863 -5.887 44.649 1.00 11.81 N ATOM 2108 N VAL B 77 29.244 -6.185 49.713 1.00 15.01 N ATOM 2109 CA VAL B 77 30.630 -6.640 49.706 1.00 11.65 C ATOM 2110 C VAL B 77 30.556 -7.922 48.957 1.00 14.19 C ATOM 2111 O VAL B 77 29.594 -8.675 49.123 1.00 16.35 O ATOM 2112 CB VAL B 77 31.218 -6.961 51.059 1.00 9.37 C ATOM 2113 CG1 VAL B 77 32.555 -7.586 50.833 1.00 2.00 C ATOM 2114 CG2 VAL B 77 31.390 -5.696 51.913 1.00 12.63 C ATOM 2115 N SER B 78 31.469 -8.096 48.018 1.00 18.33 N ATOM 2116 CA SER B 78 31.526 -9.314 47.222 1.00 25.62 C ATOM 2117 C SER B 78 30.327 -9.747 46.388 1.00 26.45 C ATOM 2118 O SER B 78 30.506 -10.608 45.565 1.00 42.58 O ATOM 2119 CB SER B 78 31.951 -10.502 48.103 1.00 29.44 C ATOM 2120 OG SER B 78 31.376 -11.743 47.675 1.00 33.02 O ATOM 2121 N HIS B 79 29.236 -9.367 46.670 1.00 28.74 N ATOM 2122 CA HIS B 79 27.971 -9.889 46.094 1.00 29.33 C ATOM 2123 C HIS B 79 26.835 -9.667 47.001 1.00 32.96 C ATOM 2124 O HIS B 79 25.672 -9.747 46.627 1.00 35.32 O ATOM 2125 CB HIS B 79 27.924 -11.409 45.847 1.00 35.91 C ATOM 2126 CG HIS B 79 28.587 -11.768 44.529 1.00 49.91 C ATOM 2127 ND1 HIS B 79 29.697 -12.597 44.467 1.00 54.13 N ATOM 2128 CD2 HIS B 79 28.299 -11.404 43.256 1.00 58.54 C ATOM 2129 CE1 HIS B 79 30.055 -12.702 43.201 1.00 60.42 C ATOM 2130 NE2 HIS B 79 29.233 -11.993 42.465 1.00 62.95 N ATOM 2131 N ARG B 80 27.174 -9.391 48.175 1.00 29.68 N ATOM 2132 CA ARG B 80 26.341 -9.853 49.318 1.00 25.43 C ATOM 2133 C ARG B 80 26.007 -8.446 49.695 1.00 19.03 C ATOM 2134 O ARG B 80 26.876 -7.573 49.681 1.00 16.30 O ATOM 2135 CB ARG B 80 27.014 -10.527 50.500 1.00 34.17 C ATOM 2136 CG ARG B 80 26.997 -12.019 50.439 1.00 46.33 C ATOM 2137 CD ARG B 80 26.000 -12.623 51.412 1.00 52.68 C ATOM 2138 NE ARG B 80 26.645 -13.737 52.098 1.00 63.81 N ATOM 2139 CZ ARG B 80 27.544 -13.586 53.071 1.00 67.32 C ATOM 2140 NH1 ARG B 80 27.893 -12.373 53.485 1.00 70.95 N ATOM 2141 NH2 ARG B 80 28.135 -14.645 53.601 1.00 69.09 N ATOM 2142 N LYS B 81 24.748 -8.238 50.031 1.00 11.15 N ATOM 2143 CA LYS B 81 24.244 -6.941 50.410 1.00 9.53 C ATOM 2144 C LYS B 81 23.852 -7.023 51.893 1.00 13.57 C ATOM 2145 O LYS B 81 23.361 -8.063 52.352 1.00 13.52 O ATOM 2146 CB LYS B 81 23.037 -6.644 49.543 1.00 4.56 C ATOM 2147 CG LYS B 81 23.137 -5.362 48.850 1.00 2.01 C ATOM 2148 CD LYS B 81 22.553 -5.485 47.505 1.00 3.56 C ATOM 2149 CE LYS B 81 22.635 -4.168 46.810 1.00 6.84 C ATOM 2150 NZ LYS B 81 24.027 -3.664 46.880 1.00 16.28 N ATOM 2151 N GLY B 82 24.061 -5.937 52.640 1.00 12.79 N ATOM 2152 CA GLY B 82 23.738 -5.939 54.057 1.00 7.44 C ATOM 2153 C GLY B 82 23.838 -4.589 54.737 1.00 11.56 C ATOM 2154 O GLY B 82 24.231 -3.587 54.136 1.00 14.88 O ATOM 2155 N LEU B 83 23.438 -4.546 55.997 1.00 6.70 N ATOM 2156 CA LEU B 83 23.494 -3.319 56.749 1.00 8.18 C ATOM 2157 C LEU B 83 24.926 -3.193 57.307 1.00 15.40 C ATOM 2158 O LEU B 83 25.423 -4.125 57.956 1.00 15.95 O ATOM 2159 CB LEU B 83 22.446 -3.387 57.847 1.00 10.13 C ATOM 2160 CG LEU B 83 21.035 -3.546 57.298 1.00 3.98 C ATOM 2161 CD1 LEU B 83 20.093 -3.792 58.410 1.00 5.16 C ATOM 2162 CD2 LEU B 83 20.659 -2.289 56.565 1.00 8.51 C ATOM 2163 N PRO B 84 25.571 -2.005 57.155 1.00 16.20 N ATOM 2164 CA PRO B 84 26.942 -1.796 57.630 1.00 14.78 C ATOM 2165 C PRO B 84 27.203 -2.353 59.008 1.00 17.24 C ATOM 2166 O PRO B 84 27.931 -3.321 59.166 1.00 23.30 O ATOM 2167 CB PRO B 84 27.084 -0.271 57.617 1.00 8.55 C ATOM 2168 CG PRO B 84 26.196 0.141 56.554 1.00 6.57 C ATOM 2169 CD PRO B 84 24.975 -0.703 56.816 1.00 14.20 C ATOM 2170 N HIS B 85 26.528 -1.789 59.994 1.00 17.28 N ATOM 2171 CA HIS B 85 26.712 -2.187 61.360 1.00 12.73 C ATOM 2172 C HIS B 85 26.448 -3.645 61.688 1.00 14.77 C ATOM 2173 O HIS B 85 27.008 -4.152 62.648 1.00 18.66 O ATOM 2174 CB HIS B 85 25.893 -1.288 62.250 1.00 18.55 C ATOM 2175 CG HIS B 85 24.423 -1.324 61.969 1.00 19.56 C ATOM 2176 ND1 HIS B 85 23.537 -2.068 62.723 1.00 18.28 N ATOM 2177 CD2 HIS B 85 23.668 -0.601 61.113 1.00 18.99 C ATOM 2178 CE1 HIS B 85 22.304 -1.784 62.362 1.00 12.62 C ATOM 2179 NE2 HIS B 85 22.357 -0.897 61.385 1.00 18.01 N ATOM 2180 N VAL B 86 25.573 -4.315 60.946 1.00 14.50 N ATOM 2181 CA VAL B 86 25.317 -5.729 61.209 1.00 9.88 C ATOM 2182 C VAL B 86 26.461 -6.602 60.680 1.00 18.56 C ATOM 2183 O VAL B 86 26.864 -7.580 61.304 1.00 26.41 O ATOM 2184 CB VAL B 86 24.052 -6.182 60.573 1.00 2.00 C ATOM 2185 CG1 VAL B 86 23.877 -7.642 60.789 1.00 2.03 C ATOM 2186 CG2 VAL B 86 22.928 -5.471 61.190 1.00 2.52 C ATOM 2187 N ILE B 87 26.979 -6.250 59.514 1.00 23.76 N ATOM 2188 CA ILE B 87 28.075 -6.980 58.893 1.00 19.82 C ATOM 2189 C ILE B 87 29.287 -6.992 59.835 1.00 23.65 C ATOM 2190 O ILE B 87 29.890 -8.041 60.073 1.00 30.47 O ATOM 2191 CB ILE B 87 28.484 -6.296 57.588 1.00 15.27 C ATOM 2192 CG1 ILE B 87 27.346 -6.315 56.588 1.00 11.63 C ATOM 2193 CG2 ILE B 87 29.629 -7.008 56.953 1.00 23.40 C ATOM 2194 CD1 ILE B 87 27.699 -5.583 55.346 1.00 11.50 C ATOM 2195 N TYR B 88 29.615 -5.838 60.406 1.00 23.71 N ATOM 2196 CA TYR B 88 30.769 -5.735 61.307 1.00 21.43 C ATOM 2197 C TYR B 88 30.588 -6.169 62.765 1.00 22.92 C ATOM 2198 O TYR B 88 31.531 -6.699 63.341 1.00 31.14 O ATOM 2199 CB TYR B 88 31.429 -4.365 61.170 1.00 15.20 C ATOM 2200 CG TYR B 88 31.869 -4.158 59.746 1.00 13.04 C ATOM 2201 CD1 TYR B 88 32.811 -5.010 59.167 1.00 16.44 C ATOM 2202 CD2 TYR B 88 31.269 -3.201 58.933 1.00 13.06 C ATOM 2203 CE1 TYR B 88 33.140 -4.923 57.803 1.00 7.72 C ATOM 2204 CE2 TYR B 88 31.595 -3.104 57.569 1.00 7.28 C ATOM 2205 CZ TYR B 88 32.526 -3.973 57.013 1.00 7.74 C ATOM 2206 OH TYR B 88 32.816 -3.911 55.666 1.00 6.33 O ATOM 2207 N CYS B 89 29.420 -5.946 63.374 1.00 20.01 N ATOM 2208 CA CYS B 89 29.208 -6.429 64.742 1.00 18.82 C ATOM 2209 C CYS B 89 29.247 -7.947 64.692 1.00 21.69 C ATOM 2210 O CYS B 89 29.746 -8.586 65.597 1.00 32.08 O ATOM 2211 CB CYS B 89 27.870 -6.008 65.320 1.00 11.45 C ATOM 2212 SG CYS B 89 27.865 -4.301 65.728 1.00 15.30 S ATOM 2213 N ARG B 90 28.745 -8.521 63.614 1.00 20.18 N ATOM 2214 CA ARG B 90 28.743 -9.958 63.446 1.00 20.17 C ATOM 2215 C ARG B 90 30.152 -10.498 63.206 1.00 25.10 C ATOM 2216 O ARG B 90 30.457 -11.655 63.505 1.00 28.96 O ATOM 2217 CB ARG B 90 27.874 -10.305 62.254 1.00 22.06 C ATOM 2218 CG ARG B 90 28.009 -11.726 61.818 1.00 31.00 C ATOM 2219 CD ARG B 90 27.360 -11.944 60.477 1.00 40.18 C ATOM 2220 NE ARG B 90 25.917 -11.729 60.500 1.00 45.40 N ATOM 2221 CZ ARG B 90 25.209 -11.353 59.442 1.00 49.60 C ATOM 2222 NH1 ARG B 90 25.814 -11.129 58.278 1.00 52.88 N ATOM 2223 NH2 ARG B 90 23.889 -11.266 59.527 1.00 50.58 N ATOM 2224 N LEU B 91 31.015 -9.661 62.648 1.00 26.60 N ATOM 2225 CA LEU B 91 32.388 -10.074 62.355 1.00 24.63 C ATOM 2226 C LEU B 91 33.277 -10.110 63.580 1.00 24.58 C ATOM 2227 O LEU B 91 34.003 -11.061 63.780 1.00 28.16 O ATOM 2228 CB LEU B 91 33.027 -9.107 61.352 1.00 23.23 C ATOM 2229 CG LEU B 91 33.840 -9.650 60.178 1.00 26.44 C ATOM 2230 CD1 LEU B 91 34.223 -8.488 59.267 1.00 27.52 C ATOM 2231 CD2 LEU B 91 35.057 -10.398 60.649 1.00 22.89 C ATOM 2232 N TRP B 92 33.198 -9.071 64.401 1.00 21.81 N ATOM 2233 CA TRP B 92 34.068 -8.926 65.554 1.00 22.34 C ATOM 2234 C TRP B 92 33.424 -9.036 66.918 1.00 23.01 C ATOM 2235 O TRP B 92 34.052 -8.711 67.925 1.00 23.77 O ATOM 2236 CB TRP B 92 34.816 -7.572 65.427 1.00 26.57 C ATOM 2237 CG TRP B 92 35.692 -7.546 64.210 1.00 30.27 C ATOM 2238 CD1 TRP B 92 36.260 -8.612 63.675 1.00 28.60 C ATOM 2239 CD2 TRP B 92 35.957 -6.466 63.295 1.00 31.31 C ATOM 2240 NE1 TRP B 92 36.849 -8.312 62.495 1.00 25.58 N ATOM 2241 CE2 TRP B 92 36.675 -6.994 62.229 1.00 29.57 C ATOM 2242 CE3 TRP B 92 35.656 -5.130 63.267 1.00 35.40 C ATOM 2243 CZ2 TRP B 92 37.084 -6.242 61.135 1.00 32.13 C ATOM 2244 CZ3 TRP B 92 36.077 -4.375 62.162 1.00 35.31 C ATOM 2245 CH2 TRP B 92 36.780 -4.938 61.124 1.00 31.12 C ATOM 2246 N ARG B 93 32.171 -9.471 66.964 1.00 25.11 N ATOM 2247 CA ARG B 93 31.458 -9.599 68.243 1.00 24.28 C ATOM 2248 C ARG B 93 30.489 -10.782 68.291 1.00 24.98 C ATOM 2249 O ARG B 93 30.704 -11.740 69.029 1.00 31.62 O ATOM 2250 CB ARG B 93 30.653 -8.341 68.556 1.00 18.65 C ATOM 2251 CG ARG B 93 31.412 -7.055 68.548 1.00 22.29 C ATOM 2252 CD ARG B 93 32.011 -6.717 69.871 1.00 26.08 C ATOM 2253 NE ARG B 93 31.059 -6.669 70.984 1.00 33.34 N ATOM 2254 CZ ARG B 93 30.445 -5.571 71.419 1.00 38.10 C ATOM 2255 NH1 ARG B 93 30.643 -4.407 70.823 1.00 39.01 N ATOM 2256 NH2 ARG B 93 29.758 -5.603 72.557 1.00 39.32 N ATOM 2257 N TRP B 94 29.442 -10.722 67.480 1.00 22.15 N ATOM 2258 CA TRP B 94 28.425 -11.751 67.470 1.00 23.75 C ATOM 2259 C TRP B 94 28.155 -12.438 66.138 1.00 23.87 C ATOM 2260 O TRP B 94 27.200 -12.117 65.443 1.00 24.58 O ATOM 2261 CB TRP B 94 27.124 -11.157 68.000 1.00 18.99 C ATOM 2262 CG TRP B 94 27.368 -10.312 69.171 1.00 22.55 C ATOM 2263 CD1 TRP B 94 27.850 -10.711 70.376 1.00 22.48 C ATOM 2264 CD2 TRP B 94 27.132 -8.905 69.273 1.00 19.27 C ATOM 2265 NE1 TRP B 94 27.919 -9.639 71.226 1.00 24.90 N ATOM 2266 CE2 TRP B 94 27.482 -8.518 70.572 1.00 18.48 C ATOM 2267 CE3 TRP B 94 26.659 -7.938 68.391 1.00 19.97 C ATOM 2268 CZ2 TRP B 94 27.370 -7.207 71.015 1.00 19.28 C ATOM 2269 CZ3 TRP B 94 26.546 -6.635 68.831 1.00 23.62 C ATOM 2270 CH2 TRP B 94 26.901 -6.280 70.133 1.00 20.66 C ATOM 2271 N PRO B 95 28.875 -13.522 65.864 1.00 26.56 N ATOM 2272 CA PRO B 95 28.693 -14.262 64.609 1.00 30.34 C ATOM 2273 C PRO B 95 27.301 -14.864 64.474 1.00 33.27 C ATOM 2274 O PRO B 95 26.915 -15.329 63.410 1.00 41.92 O ATOM 2275 CB PRO B 95 29.766 -15.350 64.701 1.00 30.12 C ATOM 2276 CG PRO B 95 29.878 -15.585 66.187 1.00 29.75 C ATOM 2277 CD PRO B 95 29.839 -14.188 66.754 1.00 26.11 C ATOM 2278 N ASP B 96 26.569 -14.859 65.575 1.00 37.88 N ATOM 2279 CA ASP B 96 25.216 -15.400 65.680 1.00 39.76 C ATOM 2280 C ASP B 96 24.209 -14.341 65.194 1.00 38.80 C ATOM 2281 O ASP B 96 23.119 -14.680 64.737 1.00 42.14 O ATOM 2282 CB ASP B 96 24.970 -15.736 67.173 1.00 43.72 C ATOM 2283 CG ASP B 96 23.781 -16.674 67.424 1.00 50.05 C ATOM 2284 OD1 ASP B 96 22.660 -16.422 66.929 1.00 59.27 O ATOM 2285 OD2 ASP B 96 23.951 -17.645 68.200 1.00 50.99 O ATOM 2286 N LEU B 97 24.590 -13.070 65.269 1.00 33.41 N ATOM 2287 CA LEU B 97 23.719 -11.965 64.899 1.00 30.75 C ATOM 2288 C LEU B 97 22.772 -12.240 63.734 1.00 33.10 C ATOM 2289 O LEU B 97 23.213 -12.390 62.605 1.00 32.33 O ATOM 2290 CB LEU B 97 24.569 -10.752 64.569 1.00 26.44 C ATOM 2291 CG LEU B 97 23.765 -9.468 64.519 1.00 22.09 C ATOM 2292 CD1 LEU B 97 23.216 -9.288 65.864 1.00 19.34 C ATOM 2293 CD2 LEU B 97 24.613 -8.285 64.142 1.00 23.02 C ATOM 2294 N HIS B 98 21.471 -12.276 63.992 1.00 34.94 N ATOM 2295 CA HIS B 98 20.528 -12.535 62.905 1.00 39.84 C ATOM 2296 C HIS B 98 20.182 -11.277 62.099 1.00 36.73 C ATOM 2297 O HIS B 98 20.341 -11.258 60.875 1.00 36.90 O ATOM 2298 CB HIS B 98 19.233 -13.185 63.417 1.00 51.88 C ATOM 2299 CG HIS B 98 19.441 -14.436 64.227 1.00 65.40 C ATOM 2300 ND1 HIS B 98 20.486 -15.314 64.007 1.00 71.69 N ATOM 2301 CD2 HIS B 98 18.722 -14.964 65.248 1.00 68.77 C ATOM 2302 CE1 HIS B 98 20.396 -16.328 64.851 1.00 70.74 C ATOM 2303 NE2 HIS B 98 19.336 -16.139 65.616 1.00 72.56 N ATOM 2304 N SER B 99 19.716 -10.228 62.777 1.00 30.27 N ATOM 2305 CA SER B 99 19.338 -8.997 62.088 1.00 22.46 C ATOM 2306 C SER B 99 19.670 -7.761 62.882 1.00 18.96 C ATOM 2307 O SER B 99 20.167 -7.853 63.995 1.00 21.10 O ATOM 2308 CB SER B 99 17.843 -8.988 61.795 1.00 24.88 C ATOM 2309 OG SER B 99 17.089 -8.466 62.885 1.00 32.34 O ATOM 2310 N HIS B 100 19.256 -6.619 62.350 1.00 19.01 N ATOM 2311 CA HIS B 100 19.496 -5.319 62.967 1.00 26.73 C ATOM 2312 C HIS B 100 18.510 -5.009 64.069 1.00 27.58 C ATOM 2313 O HIS B 100 18.347 -3.863 64.470 1.00 31.11 O ATOM 2314 CB HIS B 100 19.454 -4.192 61.922 1.00 31.00 C ATOM 2315 CG HIS B 100 18.138 -4.052 61.224 1.00 32.28 C ATOM 2316 ND1 HIS B 100 17.253 -3.033 61.504 1.00 36.60 N ATOM 2317 CD2 HIS B 100 17.546 -4.811 60.268 1.00 33.79 C ATOM 2318 CE1 HIS B 100 16.173 -3.169 60.755 1.00 35.47 C ATOM 2319 NE2 HIS B 100 16.326 -4.241 59.996 1.00 34.63 N ATOM 2320 N HIS B 101 17.773 -6.021 64.478 1.00 34.51 N ATOM 2321 CA HIS B 101 16.818 -5.855 65.559 1.00 39.00 C ATOM 2322 C HIS B 101 17.450 -6.324 66.843 1.00 41.01 C ATOM 2323 O HIS B 101 17.102 -5.845 67.918 1.00 50.10 O ATOM 2324 CB HIS B 101 15.526 -6.634 65.282 1.00 39.46 C ATOM 2325 CG HIS B 101 14.624 -5.932 64.322 1.00 37.38 C ATOM 2326 ND1 HIS B 101 14.118 -6.535 63.193 1.00 32.08 N ATOM 2327 CD2 HIS B 101 14.241 -4.636 64.263 1.00 34.52 C ATOM 2328 CE1 HIS B 101 13.474 -5.636 62.473 1.00 33.27 C ATOM 2329 NE2 HIS B 101 13.537 -4.475 63.100 1.00 32.58 N ATOM 2330 N GLU B 102 18.421 -7.226 66.727 1.00 34.73 N ATOM 2331 CA GLU B 102 19.089 -7.735 67.894 1.00 26.83 C ATOM 2332 C GLU B 102 20.154 -6.724 68.319 1.00 23.40 C ATOM 2333 O GLU B 102 20.980 -7.002 69.180 1.00 27.33 O ATOM 2334 CB GLU B 102 19.728 -9.068 67.555 1.00 25.29 C ATOM 2335 CG GLU B 102 18.988 -9.862 66.535 1.00 30.75 C ATOM 2336 CD GLU B 102 19.348 -11.344 66.558 1.00 39.05 C ATOM 2337 OE1 GLU B 102 20.477 -11.710 66.948 1.00 40.17 O ATOM 2338 OE2 GLU B 102 18.480 -12.163 66.194 1.00 45.93 O ATOM 2339 N LEU B 103 20.066 -5.510 67.812 1.00 14.49 N ATOM 2340 CA LEU B 103 21.092 -4.534 68.100 1.00 19.18 C ATOM 2341 C LEU B 103 20.547 -3.189 68.546 1.00 24.34 C ATOM 2342 O LEU B 103 19.474 -2.748 68.102 1.00 23.20 O ATOM 2343 CB LEU B 103 21.876 -4.297 66.812 1.00 14.52 C ATOM 2344 CG LEU B 103 23.290 -4.681 66.427 1.00 11.04 C ATOM 2345 CD1 LEU B 103 23.641 -6.119 66.656 1.00 7.02 C ATOM 2346 CD2 LEU B 103 23.366 -4.371 64.972 1.00 7.74 C ATOM 2347 N ARG B 104 21.352 -2.483 69.324 1.00 25.14 N ATOM 2348 CA ARG B 104 20.963 -1.177 69.760 1.00 31.61 C ATOM 2349 C ARG B 104 22.185 -0.366 70.174 1.00 34.64 C ATOM 2350 O ARG B 104 23.091 -0.894 70.816 1.00 40.60 O ATOM 2351 CB ARG B 104 19.944 -1.302 70.873 1.00 39.66 C ATOM 2352 CG ARG B 104 19.016 -0.113 70.936 1.00 60.69 C ATOM 2353 CD ARG B 104 18.738 0.477 69.535 1.00 74.08 C ATOM 2354 NE ARG B 104 19.728 1.478 69.104 1.00 82.53 N ATOM 2355 CZ ARG B 104 19.675 2.107 67.932 1.00 85.94 C ATOM 2356 NH1 ARG B 104 18.697 1.832 67.105 1.00 88.79 N ATOM 2357 NH2 ARG B 104 20.592 2.996 67.567 1.00 87.44 N ATOM 2358 N ALA B 105 22.257 0.881 69.711 1.00 35.94 N ATOM 2359 CA ALA B 105 23.381 1.782 70.017 1.00 41.11 C ATOM 2360 C ALA B 105 23.528 2.105 71.487 1.00 43.04 C ATOM 2361 O ALA B 105 22.687 1.724 72.297 1.00 50.14 O ATOM 2362 CB ALA B 105 23.259 3.057 69.237 1.00 37.12 C ATOM 2363 N MET B 106 24.531 2.898 71.823 1.00 42.93 N ATOM 2364 CA MET B 106 24.746 3.198 73.220 1.00 50.34 C ATOM 2365 C MET B 106 24.670 4.646 73.635 1.00 53.56 C ATOM 2366 O MET B 106 25.368 5.048 74.561 1.00 59.42 O ATOM 2367 CB MET B 106 26.079 2.618 73.697 1.00 51.41 C ATOM 2368 CG MET B 106 26.114 1.121 73.841 1.00 54.66 C ATOM 2369 SD MET B 106 27.659 0.572 74.603 1.00 61.68 S ATOM 2370 CE MET B 106 27.003 -0.471 75.940 1.00 64.45 C ATOM 2371 N GLU B 107 23.802 5.424 73.005 1.00 55.83 N ATOM 2372 CA GLU B 107 23.669 6.843 73.349 1.00 54.81 C ATOM 2373 C GLU B 107 24.924 7.639 73.032 1.00 53.89 C ATOM 2374 O GLU B 107 24.831 8.835 72.745 1.00 59.97 O ATOM 2375 CB GLU B 107 23.314 7.037 74.819 1.00 56.94 C ATOM 2376 CG GLU B 107 21.967 6.473 75.213 1.00 68.93 C ATOM 2377 CD GLU B 107 21.748 6.445 76.728 1.00 74.09 C ATOM 2378 OE1 GLU B 107 22.111 7.433 77.414 1.00 75.99 O ATOM 2379 OE2 GLU B 107 21.209 5.425 77.227 1.00 76.49 O ATOM 2380 N LEU B 108 26.092 6.993 73.044 1.00 48.90 N ATOM 2381 CA LEU B 108 27.338 7.789 73.029 1.00 44.20 C ATOM 2382 C LEU B 108 27.631 7.821 71.540 1.00 45.31 C ATOM 2383 O LEU B 108 28.518 8.558 71.128 1.00 51.98 O ATOM 2384 CB LEU B 108 28.519 7.223 73.823 1.00 38.47 C ATOM 2385 CG LEU B 108 29.295 5.978 73.412 1.00 38.32 C ATOM 2386 CD1 LEU B 108 30.371 5.720 74.442 1.00 39.65 C ATOM 2387 CD2 LEU B 108 28.402 4.784 73.324 1.00 37.84 C ATOM 2388 N CYS B 109 26.903 7.026 70.736 1.00 44.76 N ATOM 2389 CA CYS B 109 27.093 7.005 69.268 1.00 42.99 C ATOM 2390 C CYS B 109 26.164 8.036 68.627 1.00 44.17 C ATOM 2391 O CYS B 109 24.941 7.923 68.725 1.00 45.03 O ATOM 2392 CB CYS B 109 26.846 5.601 68.646 1.00 35.44 C ATOM 2393 SG CYS B 109 28.161 5.056 67.472 1.00 17.87 S ATOM 2394 N GLU B 110 26.756 9.065 68.026 1.00 45.43 N ATOM 2395 CA GLU B 110 25.993 10.125 67.371 1.00 52.19 C ATOM 2396 C GLU B 110 25.354 9.663 66.070 1.00 51.71 C ATOM 2397 O GLU B 110 24.224 10.021 65.761 1.00 52.93 O ATOM 2398 CB GLU B 110 26.900 11.295 67.021 1.00 55.64 C ATOM 2399 CG GLU B 110 27.620 11.937 68.163 1.00 60.92 C ATOM 2400 CD GLU B 110 28.121 13.308 67.775 1.00 66.08 C ATOM 2401 OE1 GLU B 110 28.439 13.535 66.581 1.00 66.48 O ATOM 2402 OE2 GLU B 110 28.172 14.181 68.660 1.00 72.06 O ATOM 2403 N PHE B 111 26.127 8.918 65.287 1.00 52.13 N ATOM 2404 CA PHE B 111 25.707 8.392 63.990 1.00 50.09 C ATOM 2405 C PHE B 111 25.256 6.932 64.089 1.00 47.17 C ATOM 2406 O PHE B 111 25.529 6.137 63.206 1.00 45.13 O ATOM 2407 CB PHE B 111 26.894 8.443 63.037 1.00 55.66 C ATOM 2408 CG PHE B 111 27.591 9.772 62.991 1.00 61.76 C ATOM 2409 CD1 PHE B 111 28.356 10.209 64.065 1.00 63.56 C ATOM 2410 CD2 PHE B 111 27.543 10.557 61.835 1.00 64.42 C ATOM 2411 CE1 PHE B 111 29.070 11.406 63.990 1.00 66.25 C ATOM 2412 CE2 PHE B 111 28.253 11.754 61.747 1.00 65.22 C ATOM 2413 CZ PHE B 111 29.021 12.178 62.829 1.00 66.46 C ATOM 2414 N ALA B 112 24.501 6.594 65.118 1.00 45.86 N ATOM 2415 CA ALA B 112 24.104 5.218 65.331 1.00 45.92 C ATOM 2416 C ALA B 112 23.135 4.560 64.369 1.00 47.02 C ATOM 2417 O ALA B 112 22.267 3.806 64.813 1.00 52.34 O ATOM 2418 CB ALA B 112 23.612 5.058 66.739 1.00 45.29 C ATOM 2419 N PHE B 113 23.256 4.837 63.075 1.00 44.93 N ATOM 2420 CA PHE B 113 22.387 4.229 62.057 1.00 44.63 C ATOM 2421 C PHE B 113 20.905 4.610 62.162 1.00 47.61 C ATOM 2422 O PHE B 113 20.196 4.606 61.160 1.00 49.64 O ATOM 2423 CB PHE B 113 22.544 2.703 62.027 1.00 38.50 C ATOM 2424 CG PHE B 113 21.863 2.050 60.852 1.00 38.47 C ATOM 2425 CD1 PHE B 113 22.496 1.978 59.608 1.00 34.49 C ATOM 2426 CD2 PHE B 113 20.565 1.543 60.971 1.00 39.73 C ATOM 2427 CE1 PHE B 113 21.844 1.422 58.509 1.00 32.60 C ATOM 2428 CE2 PHE B 113 19.896 0.976 59.861 1.00 34.87 C ATOM 2429 CZ PHE B 113 20.534 0.920 58.639 1.00 34.06 C ATOM 2430 N ASN B 114 20.428 4.930 63.362 1.00 50.87 N ATOM 2431 CA ASN B 114 18.845 4.619 63.479 1.00 52.30 C ATOM 2432 C ASN B 114 18.588 6.115 63.375 1.00 49.24 C ATOM 2433 O ASN B 114 17.451 6.567 63.297 1.00 51.31 O ATOM 2434 CB ASN B 114 18.395 4.158 64.859 1.00 57.85 C ATOM 2435 CG ASN B 114 17.766 2.794 64.829 1.00 64.76 C ATOM 2436 OD1 ASN B 114 18.233 1.899 64.119 1.00 70.07 O ATOM 2437 ND2 ASN B 114 16.748 2.589 65.671 1.00 65.97 N ATOM 2438 N MET B 115 19.656 6.885 63.409 1.00 44.85 N ATOM 2439 CA MET B 115 19.538 8.315 63.339 1.00 45.25 C ATOM 2440 C MET B 115 19.521 8.799 61.903 1.00 45.25 C ATOM 2441 O MET B 115 19.575 9.987 61.655 1.00 52.02 O ATOM 2442 CB MET B 115 20.688 8.939 64.119 1.00 46.88 C ATOM 2443 CG MET B 115 20.891 8.250 65.442 1.00 48.53 C ATOM 2444 SD MET B 115 22.023 9.068 66.535 1.00 52.94 S ATOM 2445 CE MET B 115 21.758 8.024 68.067 1.00 50.67 C ATOM 2446 N LYS B 116 19.479 7.876 60.957 1.00 46.20 N ATOM 2447 CA LYS B 116 19.457 8.226 59.530 1.00 48.86 C ATOM 2448 C LYS B 116 20.412 9.333 59.070 1.00 42.93 C ATOM 2449 O LYS B 116 20.090 10.064 58.142 1.00 44.01 O ATOM 2450 CB LYS B 116 18.025 8.576 59.090 1.00 51.96 C ATOM 2451 CG LYS B 116 17.050 7.393 59.085 1.00 60.51 C ATOM 2452 CD LYS B 116 15.727 7.790 58.437 1.00 68.37 C ATOM 2453 CE LYS B 116 14.666 6.702 58.580 1.00 73.24 C ATOM 2454 NZ LYS B 116 13.278 7.244 58.379 1.00 76.31 N ATOM 2455 N LYS B 117 21.594 9.416 59.670 1.00 38.78 N ATOM 2456 CA LYS B 117 22.547 10.468 59.312 1.00 41.98 C ATOM 2457 C LYS B 117 23.241 10.172 57.998 1.00 38.91 C ATOM 2458 O LYS B 117 22.932 9.182 57.357 1.00 38.61 O ATOM 2459 CB LYS B 117 23.595 10.672 60.427 1.00 46.84 C ATOM 2460 CG LYS B 117 23.024 11.187 61.749 1.00 48.34 C ATOM 2461 CD LYS B 117 24.102 11.733 62.677 1.00 53.70 C ATOM 2462 CE LYS B 117 23.490 12.227 63.996 1.00 59.74 C ATOM 2463 NZ LYS B 117 24.485 12.789 64.972 1.00 60.87 N ATOM 2464 N ASP B 118 24.145 11.055 57.579 1.00 39.62 N ATOM 2465 CA ASP B 118 24.908 10.861 56.337 1.00 42.15 C ATOM 2466 C ASP B 118 26.076 9.880 56.519 1.00 35.08 C ATOM 2467 O ASP B 118 26.646 9.399 55.555 1.00 35.75 O ATOM 2468 CB ASP B 118 25.466 12.194 55.827 1.00 57.00 C ATOM 2469 CG ASP B 118 24.429 13.027 55.074 1.00 67.56 C ATOM 2470 OD1 ASP B 118 23.286 13.192 55.582 1.00 73.63 O ATOM 2471 OD2 ASP B 118 24.776 13.536 53.974 1.00 72.65 O ATOM 2472 N GLU B 119 26.463 9.638 57.759 1.00 24.69 N ATOM 2473 CA GLU B 119 27.533 8.730 58.062 1.00 20.67 C ATOM 2474 C GLU B 119 26.901 7.679 58.921 1.00 23.36 C ATOM 2475 O GLU B 119 25.844 7.915 59.518 1.00 29.26 O ATOM 2476 CB GLU B 119 28.574 9.441 58.881 1.00 26.25 C ATOM 2477 CG GLU B 119 29.074 10.704 58.260 1.00 40.35 C ATOM 2478 CD GLU B 119 29.695 10.455 56.909 1.00 48.29 C ATOM 2479 OE1 GLU B 119 30.900 10.105 56.898 1.00 49.94 O ATOM 2480 OE2 GLU B 119 28.992 10.599 55.869 1.00 49.61 O ATOM 2481 N VAL B 120 27.538 6.526 59.022 1.00 20.45 N ATOM 2482 CA VAL B 120 27.009 5.451 59.835 1.00 20.98 C ATOM 2483 C VAL B 120 28.166 4.918 60.664 1.00 23.31 C ATOM 2484 O VAL B 120 29.255 4.658 60.143 1.00 26.76 O ATOM 2485 CB VAL B 120 26.452 4.318 58.976 1.00 20.85 C ATOM 2486 CG1 VAL B 120 25.599 3.389 59.814 1.00 25.62 C ATOM 2487 CG2 VAL B 120 25.637 4.870 57.886 1.00 26.83 C ATOM 2488 N CYS B 121 27.935 4.774 61.956 1.00 18.88 N ATOM 2489 CA CYS B 121 28.944 4.276 62.873 1.00 18.39 C ATOM 2490 C CYS B 121 28.960 2.767 62.776 1.00 15.62 C ATOM 2491 O CYS B 121 27.985 2.115 63.106 1.00 16.10 O ATOM 2492 CB CYS B 121 28.594 4.705 64.317 1.00 22.18 C ATOM 2493 SG CYS B 121 29.778 4.412 65.689 1.00 28.62 S ATOM 2494 N VAL B 122 30.052 2.207 62.276 1.00 17.29 N ATOM 2495 CA VAL B 122 30.179 0.763 62.213 1.00 14.37 C ATOM 2496 C VAL B 122 31.111 0.233 63.313 1.00 15.72 C ATOM 2497 O VAL B 122 31.466 -0.932 63.285 1.00 21.59 O ATOM 2498 CB VAL B 122 30.722 0.305 60.881 1.00 15.36 C ATOM 2499 CG1 VAL B 122 29.779 0.670 59.769 1.00 13.82 C ATOM 2500 CG2 VAL B 122 32.077 0.900 60.679 1.00 17.32 C ATOM 2501 N ASN B 123 31.542 1.076 64.254 1.00 17.01 N ATOM 2502 CA ASN B 123 32.396 0.641 65.372 1.00 14.09 C ATOM 2503 C ASN B 123 31.595 -0.417 66.131 1.00 17.17 C ATOM 2504 O ASN B 123 30.602 -0.073 66.785 1.00 21.04 O ATOM 2505 CB ASN B 123 32.679 1.842 66.280 1.00 20.15 C ATOM 2506 CG ASN B 123 33.539 1.493 67.503 1.00 28.17 C ATOM 2507 OD1 ASN B 123 33.543 0.354 67.977 1.00 34.45 O ATOM 2508 ND2 ASN B 123 34.252 2.485 68.030 1.00 28.79 N ATOM 2509 N PRO B 124 32.018 -1.708 66.088 1.00 21.22 N ATOM 2510 CA PRO B 124 31.276 -2.774 66.788 1.00 22.92 C ATOM 2511 C PRO B 124 31.043 -2.623 68.269 1.00 23.91 C ATOM 2512 O PRO B 124 30.111 -3.195 68.817 1.00 27.21 O ATOM 2513 CB PRO B 124 32.062 -4.048 66.438 1.00 17.94 C ATOM 2514 CG PRO B 124 33.410 -3.558 66.131 1.00 20.33 C ATOM 2515 CD PRO B 124 33.176 -2.281 65.376 1.00 21.94 C ATOM 2516 N TYR B 125 31.842 -1.796 68.917 1.00 29.36 N ATOM 2517 CA TYR B 125 31.698 -1.598 70.347 1.00 34.03 C ATOM 2518 C TYR B 125 30.740 -0.476 70.758 1.00 38.99 C ATOM 2519 O TYR B 125 30.711 -0.083 71.927 1.00 47.24 O ATOM 2520 CB TYR B 125 33.086 -1.477 71.006 1.00 31.40 C ATOM 2521 CG TYR B 125 33.808 -2.806 70.983 1.00 29.58 C ATOM 2522 CD1 TYR B 125 33.501 -3.793 71.911 1.00 26.10 C ATOM 2523 CD2 TYR B 125 34.691 -3.127 69.947 1.00 30.89 C ATOM 2524 CE1 TYR B 125 34.021 -5.062 71.812 1.00 29.14 C ATOM 2525 CE2 TYR B 125 35.223 -4.406 69.836 1.00 31.14 C ATOM 2526 CZ TYR B 125 34.872 -5.376 70.774 1.00 31.40 C ATOM 2527 OH TYR B 125 35.286 -6.688 70.645 1.00 34.93 O ATOM 2528 N HIS B 126 29.954 0.039 69.812 1.00 37.96 N ATOM 2529 CA HIS B 126 28.980 1.086 70.120 1.00 32.74 C ATOM 2530 C HIS B 126 27.573 0.523 70.070 1.00 32.81 C ATOM 2531 O HIS B 126 26.582 1.260 70.156 1.00 38.03 O ATOM 2532 CB HIS B 126 29.089 2.252 69.161 1.00 28.97 C ATOM 2533 CG HIS B 126 30.179 3.195 69.514 1.00 27.70 C ATOM 2534 ND1 HIS B 126 30.386 4.384 68.845 1.00 22.75 N ATOM 2535 CD2 HIS B 126 31.121 3.126 70.481 1.00 22.97 C ATOM 2536 CE1 HIS B 126 31.414 5.008 69.390 1.00 26.09 C ATOM 2537 NE2 HIS B 126 31.877 4.266 70.381 1.00 27.27 N ATOM 2538 N TYR B 127 27.483 -0.785 69.919 1.00 24.75 N ATOM 2539 CA TYR B 127 26.189 -1.424 69.865 1.00 24.99 C ATOM 2540 C TYR B 127 26.199 -2.561 70.863 1.00 27.30 C ATOM 2541 O TYR B 127 27.252 -3.164 71.163 1.00 29.98 O ATOM 2542 CB TYR B 127 25.883 -1.979 68.454 1.00 17.97 C ATOM 2543 CG TYR B 127 25.857 -0.940 67.359 1.00 12.87 C ATOM 2544 CD1 TYR B 127 27.033 -0.532 66.724 1.00 7.87 C ATOM 2545 CD2 TYR B 127 24.667 -0.361 66.961 1.00 6.36 C ATOM 2546 CE1 TYR B 127 27.005 0.412 65.735 1.00 2.00 C ATOM 2547 CE2 TYR B 127 24.633 0.581 65.977 1.00 2.04 C ATOM 2548 CZ TYR B 127 25.814 0.961 65.368 1.00 4.60 C ATOM 2549 OH TYR B 127 25.793 1.907 64.384 1.00 10.30 O ATOM 2550 N GLN B 128 25.021 -2.839 71.388 1.00 19.44 N ATOM 2551 CA GLN B 128 24.882 -3.907 72.317 1.00 20.75 C ATOM 2552 C GLN B 128 23.791 -4.750 71.722 1.00 18.33 C ATOM 2553 O GLN B 128 22.930 -4.244 70.990 1.00 16.04 O ATOM 2554 CB GLN B 128 24.533 -3.380 73.703 1.00 25.35 C ATOM 2555 CG GLN B 128 23.357 -2.455 73.751 1.00 36.22 C ATOM 2556 CD GLN B 128 23.301 -1.678 75.047 1.00 43.56 C ATOM 2557 OE1 GLN B 128 23.889 -2.077 76.060 1.00 48.15 O ATOM 2558 NE2 GLN B 128 22.610 -0.549 75.021 1.00 45.44 N ATOM 2559 N ARG B 129 23.884 -6.047 71.964 1.00 15.43 N ATOM 2560 CA ARG B 129 22.932 -6.982 71.439 1.00 18.26 C ATOM 2561 C ARG B 129 21.777 -7.182 72.413 1.00 25.94 C ATOM 2562 O ARG B 129 21.982 -7.600 73.550 1.00 26.12 O ATOM 2563 CB ARG B 129 23.628 -8.313 71.173 1.00 16.34 C ATOM 2564 CG ARG B 129 22.801 -9.274 70.376 1.00 13.48 C ATOM 2565 CD ARG B 129 23.361 -10.640 70.493 1.00 15.77 C ATOM 2566 NE ARG B 129 22.654 -11.550 69.603 1.00 23.51 N ATOM 2567 CZ ARG B 129 23.143 -12.724 69.208 1.00 29.33 C ATOM 2568 NH1 ARG B 129 24.340 -13.137 69.644 1.00 30.98 N ATOM 2569 NH2 ARG B 129 22.475 -13.445 68.312 1.00 25.73 N ATOM 2570 N VAL B 130 20.559 -6.875 71.972 1.00 31.93 N ATOM 2571 CA VAL B 130 19.384 -7.063 72.811 1.00 33.31 C ATOM 2572 C VAL B 130 18.774 -8.406 72.455 1.00 39.70 C ATOM 2573 O VAL B 130 18.666 -8.748 71.291 1.00 42.23 O ATOM 2574 CB VAL B 130 18.342 -5.939 72.622 1.00 27.40 C ATOM 2575 CG1 VAL B 130 19.051 -4.621 72.314 1.00 24.69 C ATOM 2576 CG2 VAL B 130 17.329 -6.293 71.572 1.00 16.88 C ATOM 2577 N GLU B 131 18.451 -9.204 73.461 1.00 51.66 N ATOM 2578 CA GLU B 131 17.832 -10.510 73.241 1.00 60.34 C ATOM 2579 C GLU B 131 16.336 -10.290 73.136 1.00 65.93 C ATOM 2580 O GLU B 131 15.552 -11.215 73.363 1.00 69.09 O ATOM 2581 CB GLU B 131 18.162 -11.472 74.394 1.00 60.49 C ATOM 2582 CG GLU B 131 19.410 -12.326 74.156 1.00 69.32 C ATOM 2583 CD GLU B 131 20.430 -11.651 73.240 1.00 74.35 C ATOM 2584 OE1 GLU B 131 20.980 -10.596 73.622 1.00 76.77 O ATOM 2585 OE2 GLU B 131 20.665 -12.162 72.119 1.00 79.07 O ATOM 2586 N THR B 132 15.989 -9.051 72.768 1.00 71.59 N ATOM 2587 CA THR B 132 14.640 -8.519 72.604 1.00 77.20 C ATOM 2588 C THR B 132 13.809 -8.500 73.883 1.00 83.81 C ATOM 2589 O THR B 132 12.767 -7.809 73.861 1.00 90.83 O ATOM 2590 CB THR B 132 13.863 -9.157 71.423 1.00 75.25 C ATOM 2591 OG1 THR B 132 12.805 -8.276 71.024 1.00 77.42 O ATOM 2592 CG2 THR B 132 13.258 -10.512 71.777 1.00 76.32 C ATOM 2593 OXT THR B 132 14.230 -9.104 74.905 1.00 88.94 O TER 2594 THR B 132 HETATM 2595 O HOH C 4 26.326 -7.494 41.966 1.00 16.92 O HETATM 2596 O HOH C 5 52.645 -1.212 29.429 1.00 25.81 O HETATM 2597 O HOH C 7 38.055 -0.624 40.340 1.00 38.78 O HETATM 2598 O HOH C 8 48.868 2.208 26.712 1.00 23.02 O HETATM 2599 O HOH C 24 24.119 8.355 29.425 1.00 42.57 O HETATM 2600 O HOH D 2 32.266 -2.207 49.725 1.00 8.45 O HETATM 2601 O HOH D 10 29.336 -6.769 38.509 1.00 22.65 O HETATM 2602 O HOH D 12 40.177 7.761 21.473 1.00 28.54 O HETATM 2603 O HOH D 14 45.269 6.556 24.551 1.00 37.27 O HETATM 2604 O HOH D 16 24.484 3.012 40.809 1.00 39.33 O HETATM 2605 O HOH D 19 36.464 -10.689 28.676 1.00 44.44 O HETATM 2606 O HOH A 133 22.247 -5.616 29.600 1.00 17.20 O HETATM 2607 O HOH A 134 27.313 -16.929 32.400 1.00 37.60 O HETATM 2608 O HOH A 135 29.493 11.259 21.127 1.00 31.47 O HETATM 2609 O HOH A 136 9.198 -0.454 15.779 1.00 27.36 O HETATM 2610 O HOH B 133 46.964 -7.548 52.526 1.00 22.86 O HETATM 2611 O HOH B 134 13.938 -9.804 68.850 1.00 27.76 O HETATM 2612 O HOH B 135 19.916 -0.937 64.420 1.00 40.43 O HETATM 2613 O HOH B 136 22.177 -7.694 57.652 1.00 24.08 O HETATM 2614 O HOH B 137 23.967 11.067 70.665 1.00 25.17 O HETATM 2615 O HOH B 138 34.447 -8.758 45.935 1.00 43.82 O HETATM 2616 O HOH B 139 43.135 2.763 50.201 1.00 34.22 O HETATM 2617 O HOH B 140 18.491 2.984 47.000 1.00 39.11 O HETATM 2618 O HOH B 141 36.253 -5.895 48.633 1.00 23.16 O CONECT 990 1371 CONECT 1371 990 CONECT 2393 2493 CONECT 2493 2393 MASTER 339 0 0 10 12 0 0 6 2614 4 4 25 END
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Entry Information
PDB ID
1mhd
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
SMAD3 MH1 DOMAIN
Ligand Name
DNA
EC.Number
E.C.-.-.-.-
Resolution
2.8(Å)
Affinity (Kd/Ki/IC50)
Kd=114nM
Release Year
1999
Protein/NA Sequence
Check fasta file
Primary Reference
Cell. (1998) 94, pp. 585-94
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
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UniProtKB AC
UniProt accession number (AC):
P84022
Entrez Gene ID
NCBI Entrez Gene ID:
4088
ASD
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