HEADER HYDROLASE 24-NOV-99 1C5H TITLE HYDROGEN BONDING AND CATALYSIS: AN UNEXPECTED EXPLANATION TITLE 2 FOR HOW A SINGLE AMINO ACID SUBSTITUTION CAN CHANGE THE PH TITLE 3 OPTIMUM OF A GLYCOSIDASE COMPND MOL_ID: 1; COMPND 2 MOLECULE: ENDO-1,4-BETA-XYLANASE; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: CATALYTIC DOMAIN; COMPND 5 SYNONYM: BCX; COMPND 6 EC: 3.2.1.8; COMPND 7 ENGINEERED: YES; COMPND 8 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CIRCULANS; SOURCE 3 ORGANISM_TAXID: 1397; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 511693; SOURCE 6 EXPRESSION_SYSTEM_STRAIN: BL21; SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 8 EXPRESSION_SYSTEM_PLASMID: PCW KEYWDS GLYCOSIDASE, PH-DEPENDENT ENZYME MECHANISM, GENERAL ACID/ KEYWDS 2 BASE CATALYSIS, NMR, X-RAY CYRSTALLOGRAPHY, ISOTOPE SHIFT, KEYWDS 3 SHORT HYDROGEN BONDS, XYLAN, HYDROLASE EXPDTA X-RAY DIFFRACTION AUTHOR M.D.JOSHI,G.SIDHU,I.POT,G.D.BRAYER,S.G.WITHERS,L.P.MCINTOSH REVDAT 2 24-FEB-09 1C5H 1 VERSN REVDAT 1 12-MAY-00 1C5H 0 JRNL AUTH M.D.JOSHI,G.SIDHU,I.POT,G.D.BRAYER,S.G.WITHERS, JRNL AUTH 2 L.P.MCINTOSH JRNL TITL HYDROGEN BONDING AND CATALYSIS: A NOVEL JRNL TITL 2 EXPLANATION FOR HOW A SINGLE AMINO ACID JRNL TITL 3 SUBSTITUTION CAN CHANGE THE PH OPTIMUM OF A JRNL TITL 4 GLYCOSIDASE. JRNL REF J.MOL.BIOL. V. 299 255 2000 JRNL REFN ISSN 0022-2836 JRNL PMID 10860737 JRNL DOI 10.1006/JMBI.2000.3722 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 1.55 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.851 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.55 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 10.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 91.0 REMARK 3 NUMBER OF REFLECTIONS : 25023 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : NULL REMARK 3 FREE R VALUE TEST SET SELECTION : NULL REMARK 3 R VALUE (WORKING SET) : 0.194 REMARK 3 FREE R VALUE : NULL REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 FREE R VALUE TEST SET COUNT : NULL 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 : NULL REMARK 3 BIN RESOLUTION RANGE HIGH (A) : NULL REMARK 3 BIN RESOLUTION RANGE LOW (A) : NULL REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 REFLECTIONS IN BIN (WORKING SET) : NULL REMARK 3 BIN R VALUE (WORKING SET) : NULL REMARK 3 BIN FREE R VALUE : NULL REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 BIN FREE R VALUE TEST SET COUNT : NULL 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 : 1448 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 146 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) : 0.007 REMARK 3 BOND ANGLES (DEGREES) : 1.21 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 1C5H COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 02-DEC-99. REMARK 100 THE RCSB ID CODE IS RCSB001361. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : NULL REMARK 200 TEMPERATURE (KELVIN) : 298 REMARK 200 PH : 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : ROTATING ANODE REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : RIGAKU RU300 REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : GRAPHITE REMARK 200 OPTICS : NULL 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 : 27301 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.550 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.9 REMARK 200 DATA REDUNDANCY : 5.500 REMARK 200 R MERGE (I) : 0.05700 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 21.1000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL REMARK 200 SOFTWARE USED: X-PLOR REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 44.95 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.23 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PH 7.5 REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X+1/2,-Y,Z+1/2 REMARK 290 3555 -X,Y+1/2,-Z+1/2 REMARK 290 4555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 22.02500 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 39.30500 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 26.34500 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 39.30500 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 22.02500 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 26.34500 REMARK 290 SMTRY3 4 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: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 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 GLY A 34 N - CA - C ANGL. DEV. = -15.9 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 ASN A 61 57.71 -106.98 REMARK 500 ASP A 121 -168.85 55.31 REMARK 500 ALA A 165 -157.31 -99.05 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: NUC REMARK 800 EVIDENCE_CODE: AUTHOR REMARK 800 SITE_DESCRIPTION: THE NUCLEOPHILE IS RESIDUE GLU 78. REMARK 800 SITE_IDENTIFIER: ABC REMARK 800 EVIDENCE_CODE: AUTHOR REMARK 800 SITE_DESCRIPTION: THE ACID BASE CATALYST IS RESIDUE GLU 172. DBREF 1C5H A 1 185 UNP P09850 XYNA_BACCI 29 213 SEQADV 1C5H ASP A 35 UNP P09850 ASN 63 ENGINEERED SEQRES 1 A 185 ALA SER THR ASP TYR TRP GLN ASN TRP THR ASP GLY GLY SEQRES 2 A 185 GLY ILE VAL ASN ALA VAL ASN GLY SER GLY GLY ASN TYR SEQRES 3 A 185 SER VAL ASN TRP SER ASN THR GLY ASP PHE VAL VAL GLY SEQRES 4 A 185 LYS GLY TRP THR THR GLY SER PRO PHE ARG THR ILE ASN SEQRES 5 A 185 TYR ASN ALA GLY VAL TRP ALA PRO ASN GLY ASN GLY TYR SEQRES 6 A 185 LEU THR LEU TYR GLY TRP THR ARG SER PRO LEU ILE GLU SEQRES 7 A 185 TYR TYR VAL VAL ASP SER TRP GLY THR TYR ARG PRO THR SEQRES 8 A 185 GLY THR TYR LYS GLY THR VAL LYS SER ASP GLY GLY THR SEQRES 9 A 185 TYR ASP ILE TYR THR THR THR ARG TYR ASN ALA PRO SER SEQRES 10 A 185 ILE ASP GLY ASP ARG THR THR PHE THR GLN TYR TRP SER SEQRES 11 A 185 VAL ARG GLN SER LYS ARG PRO THR GLY SER ASN ALA THR SEQRES 12 A 185 ILE THR PHE THR ASN HIS VAL ASN ALA TRP LYS SER HIS SEQRES 13 A 185 GLY MET ASN LEU GLY SER ASN TRP ALA TYR GLN VAL MET SEQRES 14 A 185 ALA THR GLU GLY TYR GLN SER SER GLY SER SER ASN VAL SEQRES 15 A 185 THR VAL TRP FORMUL 2 HOH *146(H2 O) HELIX 1 1 PHE A 146 HIS A 156 1 11 SHEET 1 A 8 TYR A 5 THR A 10 0 SHEET 2 A 8 ASP A 35 TRP A 42 -1 N GLY A 41 O TYR A 5 SHEET 3 A 8 GLN A 167 TYR A 174 -1 N GLY A 173 O PHE A 36 SHEET 4 A 8 GLY A 64 THR A 72 -1 N TYR A 69 O VAL A 168 SHEET 5 A 8 ILE A 77 TRP A 85 -1 N SER A 84 O LEU A 66 SHEET 6 A 8 PHE A 125 ARG A 132 1 N THR A 126 O GLU A 78 SHEET 7 A 8 GLY A 103 ARG A 112 -1 N ARG A 112 O PHE A 125 SHEET 8 A 8 THR A 93 SER A 100 -1 N SER A 100 O GLY A 103 SHEET 1 B 5 ILE A 15 ASN A 20 0 SHEET 2 B 5 ASN A 25 SER A 31 -1 N SER A 31 O ILE A 15 SHEET 3 B 5 SER A 177 TRP A 185 -1 N VAL A 182 O TYR A 26 SHEET 4 B 5 THR A 50 ASN A 61 -1 N ASN A 61 O SER A 177 SHEET 5 B 5 ALA A 142 THR A 145 -1 N ILE A 144 O ILE A 51 CISPEP 1 SER A 74 PRO A 75 0 0.06 SITE 1 NUC 1 GLU A 78 SITE 1 ABC 1 GLU A 172 CRYST1 44.050 52.690 78.610 90.00 90.00 90.00 P 21 21 21 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 0.022701 0.000000 0.000000 0.00000 SCALE2 0.000000 0.018979 0.000000 0.00000 SCALE3 0.000000 0.000000 0.012721 0.00000 ATOM 1 N ALA A 1 33.590 42.077 20.246 1.00 32.18 N ATOM 2 CA ALA A 1 33.616 42.830 21.527 1.00 32.09 C ATOM 3 C ALA A 1 34.866 42.497 22.317 1.00 32.13 C ATOM 4 O ALA A 1 35.525 41.487 22.059 1.00 33.71 O ATOM 5 CB ALA A 1 32.378 42.498 22.354 1.00 32.05 C ATOM 6 N SER A 2 35.202 43.340 23.282 1.00 30.54 N ATOM 7 CA SER A 2 36.382 43.080 24.072 1.00 28.61 C ATOM 8 C SER A 2 36.066 42.156 25.220 1.00 26.17 C ATOM 9 O SER A 2 35.118 42.372 25.980 1.00 25.57 O ATOM 10 CB SER A 2 36.971 44.383 24.616 1.00 30.09 C ATOM 11 OG SER A 2 37.826 44.985 23.659 1.00 34.09 O ATOM 12 N THR A 3 36.841 41.088 25.309 1.00 23.75 N ATOM 13 CA THR A 3 36.685 40.174 26.410 1.00 19.99 C ATOM 14 C THR A 3 37.292 40.796 27.643 1.00 19.07 C ATOM 15 O THR A 3 38.223 41.590 27.526 1.00 20.59 O ATOM 16 CB THR A 3 37.374 38.836 26.100 1.00 20.15 C ATOM 17 OG1 THR A 3 38.749 39.067 25.778 1.00 18.81 O ATOM 18 CG2 THR A 3 36.698 38.160 24.920 1.00 17.25 C ATOM 19 N ASP A 4 36.767 40.487 28.816 1.00 17.90 N ATOM 20 CA ASP A 4 37.306 41.087 30.028 1.00 17.25 C ATOM 21 C ASP A 4 37.576 40.043 31.086 1.00 17.03 C ATOM 22 O ASP A 4 37.897 40.371 32.227 1.00 17.28 O ATOM 23 CB ASP A 4 36.325 42.117 30.579 1.00 18.64 C ATOM 24 CG ASP A 4 34.955 41.534 30.834 1.00 21.33 C ATOM 25 OD1 ASP A 4 34.867 40.414 31.371 1.00 19.60 O ATOM 26 OD2 ASP A 4 33.959 42.202 30.496 1.00 27.51 O ATOM 27 N TYR A 5 37.448 38.779 30.705 1.00 14.11 N ATOM 28 CA TYR A 5 37.665 37.709 31.654 1.00 13.71 C ATOM 29 C TYR A 5 38.633 36.671 31.115 1.00 12.58 C ATOM 30 O TYR A 5 38.567 36.287 29.949 1.00 12.89 O ATOM 31 CB TYR A 5 36.332 37.036 31.998 1.00 13.55 C ATOM 32 CG TYR A 5 36.423 36.146 33.203 1.00 14.73 C ATOM 33 CD1 TYR A 5 36.551 36.689 34.477 1.00 16.72 C ATOM 34 CD2 TYR A 5 36.434 34.761 33.071 1.00 15.69 C ATOM 35 CE1 TYR A 5 36.693 35.877 35.595 1.00 18.93 C ATOM 36 CE2 TYR A 5 36.576 33.938 34.184 1.00 17.57 C ATOM 37 CZ TYR A 5 36.710 34.506 35.442 1.00 18.03 C ATOM 38 OH TYR A 5 36.889 33.715 36.548 1.00 21.54 O ATOM 39 N TRP A 6 39.547 36.246 31.978 1.00 13.14 N ATOM 40 CA TRP A 6 40.513 35.204 31.655 1.00 13.71 C ATOM 41 C TRP A 6 40.338 34.026 32.608 1.00 13.67 C ATOM 42 O TRP A 6 40.508 34.163 33.824 1.00 12.94 O ATOM 43 CB TRP A 6 41.947 35.754 31.736 1.00 13.45 C ATOM 44 CG TRP A 6 43.060 34.712 31.748 1.00 12.71 C ATOM 45 CD1 TRP A 6 43.976 34.512 32.744 1.00 13.13 C ATOM 46 CD2 TRP A 6 43.427 33.811 30.688 1.00 11.12 C ATOM 47 NE1 TRP A 6 44.887 33.556 32.368 1.00 14.00 N ATOM 48 CE2 TRP A 6 44.577 33.109 31.112 1.00 11.84 C ATOM 49 CE3 TRP A 6 42.895 33.534 29.421 1.00 12.10 C ATOM 50 CZ2 TRP A 6 45.209 32.144 30.316 1.00 11.61 C ATOM 51 CZ3 TRP A 6 43.526 32.572 28.627 1.00 12.03 C ATOM 52 CH2 TRP A 6 44.670 31.892 29.080 1.00 11.92 C ATOM 53 N GLN A 7 39.944 32.887 32.050 1.00 13.26 N ATOM 54 CA GLN A 7 39.731 31.680 32.833 1.00 13.53 C ATOM 55 C GLN A 7 40.909 30.725 32.682 1.00 13.43 C ATOM 56 O GLN A 7 41.271 30.338 31.576 1.00 12.56 O ATOM 57 CB GLN A 7 38.432 30.997 32.389 1.00 14.56 C ATOM 58 CG GLN A 7 38.154 29.646 33.033 1.00 17.21 C ATOM 59 CD GLN A 7 38.044 29.716 34.550 1.00 20.97 C ATOM 60 OE1 GLN A 7 37.804 30.779 35.129 1.00 23.02 O ATOM 61 NE2 GLN A 7 38.220 28.573 35.204 1.00 23.35 N ATOM 62 N ASN A 8 41.520 30.369 33.805 1.00 14.00 N ATOM 63 CA ASN A 8 42.661 29.467 33.801 1.00 15.89 C ATOM 64 C ASN A 8 42.665 28.615 35.057 1.00 16.38 C ATOM 65 O ASN A 8 43.318 28.949 36.044 1.00 16.67 O ATOM 66 CB ASN A 8 43.962 30.274 33.706 1.00 17.86 C ATOM 67 CG ASN A 8 45.198 29.395 33.612 1.00 20.42 C ATOM 68 OD1 ASN A 8 46.320 29.856 33.844 1.00 23.29 O ATOM 69 ND2 ASN A 8 45.004 28.126 33.270 1.00 21.79 N ATOM 70 N TRP A 9 41.908 27.524 35.018 1.00 16.09 N ATOM 71 CA TRP A 9 41.797 26.634 36.160 1.00 16.64 C ATOM 72 C TRP A 9 42.292 25.241 35.826 1.00 16.75 C ATOM 73 O TRP A 9 42.041 24.713 34.748 1.00 15.43 O ATOM 74 CB TRP A 9 40.341 26.536 36.621 1.00 18.96 C ATOM 75 CG TRP A 9 40.124 25.515 37.700 1.00 22.73 C ATOM 76 CD1 TRP A 9 40.249 25.708 39.049 1.00 24.71 C ATOM 77 CD2 TRP A 9 39.738 24.141 37.527 1.00 24.69 C ATOM 78 NE1 TRP A 9 39.967 24.543 39.725 1.00 25.96 N ATOM 79 CE2 TRP A 9 39.649 23.566 38.816 1.00 25.84 C ATOM 80 CE3 TRP A 9 39.459 23.343 36.405 1.00 24.91 C ATOM 81 CZ2 TRP A 9 39.293 22.223 39.018 1.00 26.00 C ATOM 82 CZ3 TRP A 9 39.103 22.006 36.606 1.00 24.66 C ATOM 83 CH2 TRP A 9 39.024 21.462 37.905 1.00 25.68 C ATOM 84 N THR A 10 43.012 24.666 36.774 1.00 16.95 N ATOM 85 CA THR A 10 43.526 23.318 36.661 1.00 17.16 C ATOM 86 C THR A 10 43.502 22.653 38.015 1.00 17.56 C ATOM 87 O THR A 10 43.669 23.333 39.027 1.00 16.08 O ATOM 88 CB THR A 10 44.973 23.299 36.140 1.00 18.87 C ATOM 89 OG1 THR A 10 45.471 21.956 36.173 1.00 20.63 O ATOM 90 CG2 THR A 10 45.868 24.168 37.011 1.00 21.01 C ATOM 91 N ASP A 11 43.266 21.346 38.052 1.00 17.55 N ATOM 92 CA ASP A 11 43.253 20.650 39.330 1.00 18.62 C ATOM 93 C ASP A 11 44.674 20.309 39.781 1.00 19.88 C ATOM 94 O ASP A 11 44.866 19.654 40.805 1.00 22.17 O ATOM 95 CB ASP A 11 42.388 19.386 39.259 1.00 18.54 C ATOM 96 CG ASP A 11 42.911 18.361 38.268 1.00 18.39 C ATOM 97 OD1 ASP A 11 44.041 18.512 37.757 1.00 17.42 O ATOM 98 OD2 ASP A 11 42.176 17.395 38.002 1.00 20.35 O ATOM 99 N GLY A 12 45.662 20.768 39.013 1.00 19.47 N ATOM 100 CA GLY A 12 47.057 20.538 39.359 1.00 19.73 C ATOM 101 C GLY A 12 47.752 19.371 38.681 1.00 19.68 C ATOM 102 O GLY A 12 48.968 19.209 38.817 1.00 20.30 O ATOM 103 N GLY A 13 46.992 18.569 37.941 1.00 18.22 N ATOM 104 CA GLY A 13 47.567 17.417 37.272 1.00 16.47 C ATOM 105 C GLY A 13 48.223 17.686 35.931 1.00 16.31 C ATOM 106 O GLY A 13 47.674 18.386 35.082 1.00 17.22 O ATOM 107 N GLY A 14 49.412 17.127 35.744 1.00 14.87 N ATOM 108 CA GLY A 14 50.122 17.285 34.492 1.00 14.63 C ATOM 109 C GLY A 14 50.555 18.696 34.150 1.00 15.59 C ATOM 110 O GLY A 14 50.682 19.557 35.021 1.00 16.48 O ATOM 111 N ILE A 15 50.768 18.932 32.863 1.00 14.88 N ATOM 112 CA ILE A 15 51.214 20.228 32.379 1.00 15.39 C ATOM 113 C ILE A 15 50.111 20.956 31.619 1.00 14.13 C ATOM 114 O ILE A 15 49.505 20.409 30.698 1.00 13.58 O ATOM 115 CB ILE A 15 52.421 20.078 31.408 1.00 17.28 C ATOM 116 CG1 ILE A 15 53.533 19.261 32.070 1.00 18.95 C ATOM 117 CG2 ILE A 15 52.913 21.452 30.960 1.00 18.15 C ATOM 118 CD1 ILE A 15 53.997 19.806 33.392 1.00 20.35 C ATOM 119 N VAL A 16 49.855 22.192 32.030 1.00 13.61 N ATOM 120 CA VAL A 16 48.898 23.059 31.361 1.00 13.13 C ATOM 121 C VAL A 16 49.539 24.415 31.101 1.00 13.39 C ATOM 122 O VAL A 16 49.623 25.248 31.996 1.00 15.89 O ATOM 123 CB VAL A 16 47.603 23.252 32.189 1.00 12.28 C ATOM 124 CG1 VAL A 16 46.627 24.151 31.439 1.00 14.31 C ATOM 125 CG2 VAL A 16 46.956 21.911 32.447 1.00 13.34 C ATOM 126 N ASN A 17 50.052 24.599 29.890 1.00 12.04 N ATOM 127 CA ASN A 17 50.701 25.845 29.507 1.00 12.05 C ATOM 128 C ASN A 17 49.708 26.768 28.814 1.00 12.04 C ATOM 129 O ASN A 17 49.548 26.722 27.593 1.00 12.46 O ATOM 130 CB ASN A 17 51.880 25.550 28.577 1.00 12.46 C ATOM 131 CG ASN A 17 52.567 26.806 28.086 1.00 13.97 C ATOM 132 OD1 ASN A 17 52.794 26.977 26.889 1.00 16.98 O ATOM 133 ND2 ASN A 17 52.904 27.688 29.007 1.00 13.65 N ATOM 134 N ALA A 18 49.030 27.584 29.616 1.00 13.31 N ATOM 135 CA ALA A 18 48.029 28.518 29.118 1.00 14.64 C ATOM 136 C ALA A 18 48.628 29.897 28.916 1.00 14.98 C ATOM 137 O ALA A 18 49.253 30.453 29.816 1.00 16.11 O ATOM 138 CB ALA A 18 46.857 28.596 30.094 1.00 14.26 C ATOM 139 N VAL A 19 48.421 30.453 27.734 1.00 14.12 N ATOM 140 CA VAL A 19 48.959 31.759 27.420 1.00 14.78 C ATOM 141 C VAL A 19 47.851 32.776 27.198 1.00 13.87 C ATOM 142 O VAL A 19 46.988 32.594 26.340 1.00 12.97 O ATOM 143 CB VAL A 19 49.824 31.704 26.145 1.00 15.07 C ATOM 144 CG1 VAL A 19 50.274 33.098 25.761 1.00 17.31 C ATOM 145 CG2 VAL A 19 51.025 30.811 26.376 1.00 18.14 C ATOM 146 N ASN A 20 47.867 33.830 28.007 1.00 13.65 N ATOM 147 CA ASN A 20 46.922 34.922 27.861 1.00 14.29 C ATOM 148 C ASN A 20 47.419 35.858 26.760 1.00 15.41 C ATOM 149 O ASN A 20 48.280 36.702 27.002 1.00 16.33 O ATOM 150 CB ASN A 20 46.808 35.671 29.198 1.00 15.64 C ATOM 151 CG ASN A 20 45.705 36.726 29.202 1.00 17.24 C ATOM 152 OD1 ASN A 20 45.112 37.039 28.173 1.00 16.98 O ATOM 153 ND2 ASN A 20 45.439 37.287 30.376 1.00 18.94 N ATOM 154 N GLY A 21 46.909 35.679 25.543 1.00 14.22 N ATOM 155 CA GLY A 21 47.372 36.485 24.430 1.00 13.98 C ATOM 156 C GLY A 21 46.784 37.874 24.306 1.00 14.74 C ATOM 157 O GLY A 21 46.043 38.335 25.175 1.00 13.99 O ATOM 158 N SER A 22 47.125 38.547 23.212 1.00 15.06 N ATOM 159 CA SER A 22 46.617 39.884 22.961 1.00 16.22 C ATOM 160 C SER A 22 45.132 39.838 22.630 1.00 14.69 C ATOM 161 O SER A 22 44.649 38.893 21.996 1.00 13.76 O ATOM 162 CB SER A 22 47.383 40.546 21.805 1.00 17.42 C ATOM 163 OG SER A 22 47.129 39.882 20.579 1.00 24.67 O ATOM 164 N GLY A 23 44.411 40.856 23.076 1.00 14.44 N ATOM 165 CA GLY A 23 42.990 40.920 22.808 1.00 13.06 C ATOM 166 C GLY A 23 42.247 39.688 23.289 1.00 11.84 C ATOM 167 O GLY A 23 42.364 39.292 24.450 1.00 12.00 O ATOM 168 N GLY A 24 41.488 39.079 22.385 1.00 11.04 N ATOM 169 CA GLY A 24 40.711 37.906 22.742 1.00 11.68 C ATOM 170 C GLY A 24 41.376 36.598 22.370 1.00 11.62 C ATOM 171 O GLY A 24 40.716 35.560 22.317 1.00 12.04 O ATOM 172 N ASN A 25 42.685 36.637 22.144 1.00 9.78 N ATOM 173 CA ASN A 25 43.418 35.439 21.763 1.00 9.62 C ATOM 174 C ASN A 25 44.068 34.753 22.967 1.00 10.32 C ATOM 175 O ASN A 25 44.519 35.388 23.917 1.00 10.44 O ATOM 176 CB ASN A 25 44.504 35.792 20.745 1.00 9.26 C ATOM 177 CG ASN A 25 45.376 34.609 20.399 1.00 9.71 C ATOM 178 OD1 ASN A 25 46.495 34.478 20.895 1.00 11.91 O ATOM 179 ND2 ASN A 25 44.867 33.734 19.549 1.00 9.54 N ATOM 180 N TYR A 26 44.091 33.428 22.918 1.00 10.32 N ATOM 181 CA TYR A 26 44.739 32.626 23.941 1.00 9.90 C ATOM 182 C TYR A 26 45.154 31.297 23.364 1.00 10.58 C ATOM 183 O TYR A 26 44.605 30.865 22.353 1.00 10.43 O ATOM 184 CB TYR A 26 43.827 32.407 25.159 1.00 10.61 C ATOM 185 CG TYR A 26 42.710 31.396 24.965 1.00 10.08 C ATOM 186 CD1 TYR A 26 42.916 30.036 25.213 1.00 11.36 C ATOM 187 CD2 TYR A 26 41.437 31.807 24.572 1.00 10.16 C ATOM 188 CE1 TYR A 26 41.878 29.115 25.072 1.00 10.95 C ATOM 189 CE2 TYR A 26 40.394 30.896 24.429 1.00 11.37 C ATOM 190 CZ TYR A 26 40.618 29.552 24.677 1.00 11.66 C ATOM 191 OH TYR A 26 39.583 28.652 24.510 1.00 10.96 O ATOM 192 N SER A 27 46.140 30.660 23.976 1.00 10.73 N ATOM 193 CA SER A 27 46.578 29.358 23.506 1.00 11.44 C ATOM 194 C SER A 27 46.832 28.438 24.676 1.00 11.18 C ATOM 195 O SER A 27 47.064 28.898 25.789 1.00 11.33 O ATOM 196 CB SER A 27 47.842 29.482 22.646 1.00 13.17 C ATOM 197 OG SER A 27 48.896 30.082 23.373 1.00 16.92 O ATOM 198 N VAL A 28 46.755 27.136 24.432 1.00 11.51 N ATOM 199 CA VAL A 28 46.980 26.161 25.485 1.00 12.10 C ATOM 200 C VAL A 28 47.691 24.938 24.955 1.00 12.27 C ATOM 201 O VAL A 28 47.338 24.408 23.909 1.00 13.37 O ATOM 202 CB VAL A 28 45.657 25.633 26.115 1.00 12.81 C ATOM 203 CG1 VAL A 28 45.947 25.001 27.472 1.00 13.98 C ATOM 204 CG2 VAL A 28 44.650 26.737 26.259 1.00 16.04 C ATOM 205 N ASN A 29 48.729 24.545 25.673 1.00 12.03 N ATOM 206 CA ASN A 29 49.464 23.320 25.423 1.00 14.60 C ATOM 207 C ASN A 29 49.341 22.457 26.650 1.00 13.24 C ATOM 208 O ASN A 29 49.727 22.899 27.727 1.00 13.79 O ATOM 209 CB ASN A 29 50.957 23.574 25.204 1.00 18.42 C ATOM 210 CG ASN A 29 51.228 24.617 24.154 1.00 24.43 C ATOM 211 OD1 ASN A 29 50.920 24.425 22.980 1.00 28.00 O ATOM 212 ND2 ASN A 29 51.815 25.730 24.571 1.00 26.88 N ATOM 213 N TRP A 30 48.792 21.256 26.532 1.00 12.30 N ATOM 214 CA TRP A 30 48.634 20.443 27.728 1.00 8.96 C ATOM 215 C TRP A 30 49.077 19.010 27.500 1.00 9.08 C ATOM 216 O TRP A 30 49.127 18.535 26.369 1.00 9.18 O ATOM 217 CB TRP A 30 47.175 20.499 28.197 1.00 8.72 C ATOM 218 CG TRP A 30 46.166 19.770 27.341 1.00 9.96 C ATOM 219 CD1 TRP A 30 45.672 18.517 27.562 1.00 9.68 C ATOM 220 CD2 TRP A 30 45.453 20.286 26.200 1.00 9.83 C ATOM 221 NE1 TRP A 30 44.696 18.220 26.642 1.00 9.88 N ATOM 222 CE2 TRP A 30 44.537 19.284 25.793 1.00 10.14 C ATOM 223 CE3 TRP A 30 45.491 21.494 25.483 1.00 10.67 C ATOM 224 CZ2 TRP A 30 43.668 19.453 24.702 1.00 10.42 C ATOM 225 CZ3 TRP A 30 44.624 21.662 24.398 1.00 10.20 C ATOM 226 CH2 TRP A 30 43.726 20.643 24.020 1.00 9.87 C ATOM 227 N SER A 31 49.420 18.326 28.581 1.00 11.02 N ATOM 228 CA SER A 31 49.841 16.937 28.470 1.00 13.04 C ATOM 229 C SER A 31 49.708 16.211 29.796 1.00 12.20 C ATOM 230 O SER A 31 50.083 16.737 30.848 1.00 11.32 O ATOM 231 CB SER A 31 51.282 16.846 27.971 1.00 14.85 C ATOM 232 OG SER A 31 52.152 17.561 28.819 1.00 22.53 O ATOM 233 N ASN A 32 49.145 15.008 29.723 1.00 12.34 N ATOM 234 CA ASN A 32 48.946 14.144 30.882 1.00 11.40 C ATOM 235 C ASN A 32 48.369 14.916 32.050 1.00 11.15 C ATOM 236 O ASN A 32 48.885 14.882 33.162 1.00 11.62 O ATOM 237 CB ASN A 32 50.276 13.505 31.264 1.00 12.85 C ATOM 238 CG ASN A 32 50.917 12.788 30.096 1.00 13.74 C ATOM 239 OD1 ASN A 32 50.358 11.835 29.562 1.00 14.91 O ATOM 240 ND2 ASN A 32 52.086 13.253 29.685 1.00 15.14 N ATOM 241 N THR A 33 47.253 15.577 31.788 1.00 10.47 N ATOM 242 CA THR A 33 46.598 16.415 32.777 1.00 11.10 C ATOM 243 C THR A 33 45.528 15.662 33.553 1.00 12.01 C ATOM 244 O THR A 33 45.243 14.486 33.308 1.00 12.50 O ATOM 245 CB THR A 33 45.875 17.580 32.079 1.00 12.38 C ATOM 246 OG1 THR A 33 44.790 17.055 31.295 1.00 12.11 O ATOM 247 CG2 THR A 33 46.826 18.325 31.158 1.00 11.28 C ATOM 248 N GLY A 34 44.955 16.388 34.507 1.00 11.12 N ATOM 249 CA GLY A 34 43.830 15.905 35.274 1.00 10.91 C ATOM 250 C GLY A 34 42.755 16.700 34.554 1.00 11.27 C ATOM 251 O GLY A 34 42.676 16.650 33.318 1.00 10.96 O ATOM 252 N ASP A 35 41.942 17.451 35.287 1.00 12.86 N ATOM 253 CA ASP A 35 40.932 18.284 34.641 1.00 14.56 C ATOM 254 C ASP A 35 41.373 19.750 34.631 1.00 12.89 C ATOM 255 O ASP A 35 42.014 20.222 35.566 1.00 12.26 O ATOM 256 CB ASP A 35 39.570 18.165 35.338 1.00 19.58 C ATOM 257 CG ASP A 35 38.418 18.736 34.492 1.00 26.59 C ATOM 258 OD1 ASP A 35 38.584 18.912 33.261 1.00 27.95 O ATOM 259 OD2 ASP A 35 37.337 19.012 35.057 1.00 31.22 O ATOM 260 N PHE A 36 41.050 20.455 33.555 1.00 11.63 N ATOM 261 CA PHE A 36 41.405 21.865 33.430 1.00 11.19 C ATOM 262 C PHE A 36 40.457 22.583 32.477 1.00 10.44 C ATOM 263 O PHE A 36 39.859 21.965 31.595 1.00 10.68 O ATOM 264 CB PHE A 36 42.850 22.022 32.930 1.00 10.98 C ATOM 265 CG PHE A 36 43.013 21.763 31.463 1.00 11.24 C ATOM 266 CD1 PHE A 36 42.830 22.786 30.531 1.00 11.34 C ATOM 267 CD2 PHE A 36 43.313 20.489 31.004 1.00 11.43 C ATOM 268 CE1 PHE A 36 42.942 22.535 29.157 1.00 12.17 C ATOM 269 CE2 PHE A 36 43.428 20.225 29.637 1.00 13.45 C ATOM 270 CZ PHE A 36 43.241 21.250 28.710 1.00 12.06 C ATOM 271 N VAL A 37 40.303 23.883 32.689 1.00 10.35 N ATOM 272 CA VAL A 37 39.464 24.726 31.846 1.00 11.10 C ATOM 273 C VAL A 37 40.142 26.057 31.612 1.00 10.70 C ATOM 274 O VAL A 37 40.471 26.758 32.566 1.00 11.61 O ATOM 275 CB VAL A 37 38.087 25.014 32.475 1.00 12.34 C ATOM 276 CG1 VAL A 37 37.210 25.756 31.470 1.00 12.57 C ATOM 277 CG2 VAL A 37 37.427 23.730 32.892 1.00 14.52 C ATOM 278 N VAL A 38 40.373 26.382 30.348 1.00 9.20 N ATOM 279 CA VAL A 38 41.026 27.629 29.980 1.00 10.79 C ATOM 280 C VAL A 38 40.236 28.344 28.903 1.00 9.58 C ATOM 281 O VAL A 38 39.732 27.713 27.985 1.00 10.45 O ATOM 282 CB VAL A 38 42.465 27.367 29.450 1.00 10.97 C ATOM 283 CG1 VAL A 38 43.081 28.658 28.912 1.00 11.42 C ATOM 284 CG2 VAL A 38 43.327 26.774 30.563 1.00 11.53 C ATOM 285 N GLY A 39 40.118 29.658 29.014 1.00 10.64 N ATOM 286 CA GLY A 39 39.384 30.382 27.998 1.00 10.57 C ATOM 287 C GLY A 39 39.248 31.862 28.267 1.00 9.89 C ATOM 288 O GLY A 39 39.619 32.356 29.332 1.00 10.32 O ATOM 289 N LYS A 40 38.713 32.562 27.276 1.00 9.85 N ATOM 290 CA LYS A 40 38.496 33.995 27.378 1.00 9.46 C ATOM 291 C LYS A 40 37.042 34.333 27.143 1.00 8.48 C ATOM 292 O LYS A 40 36.360 33.690 26.350 1.00 7.83 O ATOM 293 CB LYS A 40 39.364 34.738 26.366 1.00 9.87 C ATOM 294 CG LYS A 40 40.746 34.999 26.876 1.00 11.26 C ATOM 295 CD LYS A 40 41.498 35.931 25.970 1.00 12.23 C ATOM 296 CE LYS A 40 42.758 36.394 26.659 1.00 13.91 C ATOM 297 NZ LYS A 40 43.645 37.134 25.728 1.00 13.19 N ATOM 298 N GLY A 41 36.564 35.354 27.833 1.00 8.36 N ATOM 299 CA GLY A 41 35.183 35.720 27.665 1.00 8.16 C ATOM 300 C GLY A 41 34.796 36.923 28.483 1.00 9.85 C ATOM 301 O GLY A 41 35.515 37.925 28.524 1.00 10.49 O ATOM 302 N TRP A 42 33.668 36.803 29.168 1.00 9.16 N ATOM 303 CA TRP A 42 33.130 37.906 29.938 1.00 10.26 C ATOM 304 C TRP A 42 32.912 37.533 31.391 1.00 10.86 C ATOM 305 O TRP A 42 32.528 36.409 31.714 1.00 10.52 O ATOM 306 CB TRP A 42 31.832 38.363 29.273 1.00 10.39 C ATOM 307 CG TRP A 42 32.094 38.794 27.870 1.00 11.27 C ATOM 308 CD1 TRP A 42 32.398 40.056 27.452 1.00 13.54 C ATOM 309 CD2 TRP A 42 32.190 37.953 26.706 1.00 13.10 C ATOM 310 NE1 TRP A 42 32.684 40.055 26.110 1.00 14.74 N ATOM 311 CE2 TRP A 42 32.564 38.778 25.626 1.00 13.54 C ATOM 312 CE3 TRP A 42 31.998 36.577 26.476 1.00 12.79 C ATOM 313 CZ2 TRP A 42 32.751 38.278 24.327 1.00 14.25 C ATOM 314 CZ3 TRP A 42 32.187 36.080 25.180 1.00 11.89 C ATOM 315 CH2 TRP A 42 32.559 36.930 24.126 1.00 14.06 C ATOM 316 N THR A 43 33.180 38.501 32.265 1.00 11.57 N ATOM 317 CA THR A 43 33.036 38.333 33.705 1.00 12.62 C ATOM 318 C THR A 43 31.594 38.040 34.079 1.00 12.11 C ATOM 319 O THR A 43 31.319 37.280 35.004 1.00 13.41 O ATOM 320 CB THR A 43 33.500 39.599 34.451 1.00 14.13 C ATOM 321 OG1 THR A 43 34.859 39.875 34.100 1.00 18.44 O ATOM 322 CG2 THR A 43 33.402 39.402 35.953 1.00 16.50 C ATOM 323 N THR A 44 30.671 38.655 33.358 1.00 11.79 N ATOM 324 CA THR A 44 29.266 38.432 33.607 1.00 12.21 C ATOM 325 C THR A 44 28.591 37.909 32.361 1.00 11.48 C ATOM 326 O THR A 44 28.543 38.594 31.338 1.00 11.04 O ATOM 327 CB THR A 44 28.563 39.729 34.075 1.00 15.17 C ATOM 328 OG1 THR A 44 29.141 40.159 35.312 1.00 15.87 O ATOM 329 CG2 THR A 44 27.079 39.487 34.295 1.00 16.91 C ATOM 330 N GLY A 45 28.100 36.679 32.437 1.00 9.38 N ATOM 331 CA GLY A 45 27.441 36.093 31.292 1.00 8.96 C ATOM 332 C GLY A 45 26.088 36.714 31.031 1.00 8.30 C ATOM 333 O GLY A 45 25.500 37.358 31.900 1.00 10.84 O ATOM 334 N SER A 46 25.593 36.507 29.820 1.00 9.08 N ATOM 335 CA SER A 46 24.300 37.025 29.410 1.00 9.46 C ATOM 336 C SER A 46 23.585 36.039 28.493 1.00 9.22 C ATOM 337 O SER A 46 24.206 35.414 27.638 1.00 9.79 O ATOM 338 CB SER A 46 24.475 38.359 28.667 1.00 10.66 C ATOM 339 OG SER A 46 23.275 38.731 28.013 1.00 10.75 O ATOM 340 N PRO A 47 22.270 35.875 28.677 1.00 9.35 N ATOM 341 CA PRO A 47 21.514 34.955 27.830 1.00 10.33 C ATOM 342 C PRO A 47 21.285 35.524 26.425 1.00 10.57 C ATOM 343 O PRO A 47 20.813 34.815 25.539 1.00 11.92 O ATOM 344 CB PRO A 47 20.210 34.765 28.593 1.00 10.92 C ATOM 345 CG PRO A 47 20.040 36.028 29.345 1.00 11.55 C ATOM 346 CD PRO A 47 21.419 36.504 29.702 1.00 11.09 C ATOM 347 N PHE A 48 21.634 36.796 26.218 1.00 10.36 N ATOM 348 CA PHE A 48 21.434 37.434 24.912 1.00 11.13 C ATOM 349 C PHE A 48 22.738 37.611 24.159 1.00 10.99 C ATOM 350 O PHE A 48 22.741 38.173 23.061 1.00 11.25 O ATOM 351 CB PHE A 48 20.817 38.824 25.068 1.00 12.96 C ATOM 352 CG PHE A 48 19.601 38.856 25.926 1.00 13.63 C ATOM 353 CD1 PHE A 48 18.474 38.124 25.579 1.00 16.69 C ATOM 354 CD2 PHE A 48 19.577 39.624 27.081 1.00 15.54 C ATOM 355 CE1 PHE A 48 17.337 38.158 26.376 1.00 18.72 C ATOM 356 CE2 PHE A 48 18.445 39.665 27.884 1.00 16.51 C ATOM 357 CZ PHE A 48 17.325 38.933 27.533 1.00 16.11 C ATOM 358 N ARG A 49 23.842 37.128 24.712 1.00 11.16 N ATOM 359 CA ARG A 49 25.114 37.334 24.048 1.00 10.70 C ATOM 360 C ARG A 49 25.292 36.440 22.826 1.00 10.50 C ATOM 361 O ARG A 49 24.803 35.311 22.766 1.00 9.96 O ATOM 362 CB ARG A 49 26.286 37.096 25.003 1.00 12.07 C ATOM 363 CG ARG A 49 27.604 37.574 24.404 1.00 13.60 C ATOM 364 CD ARG A 49 28.784 37.414 25.334 1.00 15.33 C ATOM 365 NE ARG A 49 28.512 37.904 26.681 1.00 19.78 N ATOM 366 CZ ARG A 49 28.736 39.150 27.085 1.00 20.15 C ATOM 367 NH1 ARG A 49 29.237 40.045 26.248 1.00 21.89 N ATOM 368 NH2 ARG A 49 28.472 39.494 28.335 1.00 20.99 N ATOM 369 N THR A 50 25.971 37.008 21.834 1.00 8.05 N ATOM 370 CA THR A 50 26.364 36.298 20.627 1.00 9.28 C ATOM 371 C THR A 50 27.873 36.169 20.632 1.00 10.67 C ATOM 372 O THR A 50 28.577 37.179 20.594 1.00 11.28 O ATOM 373 CB THR A 50 25.937 37.036 19.345 1.00 8.65 C ATOM 374 OG1 THR A 50 24.514 37.175 19.331 1.00 10.41 O ATOM 375 CG2 THR A 50 26.367 36.252 18.111 1.00 9.29 C ATOM 376 N ILE A 51 28.371 34.945 20.732 1.00 8.66 N ATOM 377 CA ILE A 51 29.805 34.735 20.834 1.00 9.30 C ATOM 378 C ILE A 51 30.424 34.402 19.504 1.00 9.43 C ATOM 379 O ILE A 51 29.916 33.574 18.762 1.00 11.55 O ATOM 380 CB ILE A 51 30.125 33.599 21.834 1.00 9.77 C ATOM 381 CG1 ILE A 51 29.657 34.003 23.235 1.00 11.41 C ATOM 382 CG2 ILE A 51 31.619 33.314 21.860 1.00 10.12 C ATOM 383 CD1 ILE A 51 28.239 33.570 23.545 1.00 12.18 C ATOM 384 N ASN A 52 31.517 35.084 19.199 1.00 10.20 N ATOM 385 CA ASN A 52 32.261 34.831 17.981 1.00 10.21 C ATOM 386 C ASN A 52 33.614 34.276 18.325 1.00 9.16 C ATOM 387 O ASN A 52 34.217 34.672 19.325 1.00 9.32 O ATOM 388 CB ASN A 52 32.471 36.108 17.168 1.00 12.80 C ATOM 389 CG ASN A 52 31.177 36.721 16.704 1.00 18.88 C ATOM 390 OD1 ASN A 52 30.647 36.357 15.651 1.00 22.15 O ATOM 391 ND2 ASN A 52 30.651 37.659 17.490 1.00 21.14 N ATOM 392 N TYR A 53 34.091 33.341 17.526 1.00 8.59 N ATOM 393 CA TYR A 53 35.399 32.793 17.797 1.00 9.06 C ATOM 394 C TYR A 53 36.004 32.189 16.555 1.00 8.01 C ATOM 395 O TYR A 53 35.316 31.920 15.572 1.00 9.20 O ATOM 396 CB TYR A 53 35.338 31.742 18.933 1.00 9.21 C ATOM 397 CG TYR A 53 34.783 30.389 18.520 1.00 8.71 C ATOM 398 CD1 TYR A 53 33.412 30.137 18.557 1.00 8.91 C ATOM 399 CD2 TYR A 53 35.627 29.378 18.053 1.00 10.51 C ATOM 400 CE1 TYR A 53 32.888 28.911 18.130 1.00 8.46 C ATOM 401 CE2 TYR A 53 35.111 28.148 17.624 1.00 8.89 C ATOM 402 CZ TYR A 53 33.743 27.928 17.665 1.00 8.84 C ATOM 403 OH TYR A 53 33.226 26.735 17.214 1.00 9.15 O ATOM 404 N ASN A 54 37.316 32.026 16.615 1.00 7.93 N ATOM 405 CA ASN A 54 38.085 31.407 15.561 1.00 9.92 C ATOM 406 C ASN A 54 39.176 30.541 16.170 1.00 10.70 C ATOM 407 O ASN A 54 40.117 31.058 16.780 1.00 10.38 O ATOM 408 CB ASN A 54 38.714 32.463 14.628 1.00 8.90 C ATOM 409 CG ASN A 54 39.352 31.847 13.385 1.00 9.50 C ATOM 410 OD1 ASN A 54 39.079 32.265 12.254 1.00 13.13 O ATOM 411 ND2 ASN A 54 40.206 30.853 13.586 1.00 9.46 N ATOM 412 N ALA A 55 39.023 29.227 16.053 1.00 10.33 N ATOM 413 CA ALA A 55 40.032 28.316 16.572 1.00 10.76 C ATOM 414 C ALA A 55 41.093 28.055 15.512 1.00 10.11 C ATOM 415 O ALA A 55 40.904 27.212 14.634 1.00 10.03 O ATOM 416 CB ALA A 55 39.388 27.003 17.008 1.00 10.33 C ATOM 417 N GLY A 56 42.184 28.816 15.579 1.00 10.35 N ATOM 418 CA GLY A 56 43.266 28.672 14.621 1.00 10.60 C ATOM 419 C GLY A 56 43.899 27.307 14.749 1.00 11.86 C ATOM 420 O GLY A 56 44.377 26.728 13.774 1.00 12.65 O ATOM 421 N VAL A 57 43.906 26.800 15.973 1.00 10.72 N ATOM 422 CA VAL A 57 44.449 25.490 16.246 1.00 11.07 C ATOM 423 C VAL A 57 43.539 24.717 17.181 1.00 11.09 C ATOM 424 O VAL A 57 43.165 25.202 18.244 1.00 10.02 O ATOM 425 CB VAL A 57 45.845 25.570 16.902 1.00 12.64 C ATOM 426 CG1 VAL A 57 46.311 24.177 17.310 1.00 12.39 C ATOM 427 CG2 VAL A 57 46.842 26.184 15.937 1.00 13.11 C ATOM 428 N TRP A 58 43.145 23.534 16.737 1.00 11.23 N ATOM 429 CA TRP A 58 42.345 22.612 17.530 1.00 10.95 C ATOM 430 C TRP A 58 42.873 21.208 17.316 1.00 10.38 C ATOM 431 O TRP A 58 42.483 20.533 16.367 1.00 10.70 O ATOM 432 CB TRP A 58 40.862 22.678 17.152 1.00 9.75 C ATOM 433 CG TRP A 58 40.020 21.748 17.993 1.00 10.36 C ATOM 434 CD1 TRP A 58 39.215 20.732 17.544 1.00 10.21 C ATOM 435 CD2 TRP A 58 39.949 21.706 19.433 1.00 10.00 C ATOM 436 NE1 TRP A 58 38.656 20.067 18.610 1.00 10.81 N ATOM 437 CE2 TRP A 58 39.088 20.640 19.780 1.00 10.65 C ATOM 438 CE3 TRP A 58 40.531 22.466 20.460 1.00 10.83 C ATOM 439 CZ2 TRP A 58 38.792 20.310 21.112 1.00 9.74 C ATOM 440 CZ3 TRP A 58 40.237 22.138 21.790 1.00 11.00 C ATOM 441 CH2 TRP A 58 39.374 21.069 22.099 1.00 11.25 C ATOM 442 N ALA A 59 43.783 20.794 18.194 1.00 10.25 N ATOM 443 CA ALA A 59 44.459 19.512 18.044 1.00 10.50 C ATOM 444 C ALA A 59 44.483 18.708 19.338 1.00 10.81 C ATOM 445 O ALA A 59 45.540 18.513 19.946 1.00 10.58 O ATOM 446 CB ALA A 59 45.879 19.761 17.564 1.00 11.65 C ATOM 447 N PRO A 60 43.324 18.232 19.790 1.00 11.41 N ATOM 448 CA PRO A 60 43.412 17.456 21.022 1.00 12.25 C ATOM 449 C PRO A 60 43.862 16.026 20.705 1.00 13.95 C ATOM 450 O PRO A 60 43.464 15.463 19.688 1.00 13.95 O ATOM 451 CB PRO A 60 41.988 17.477 21.556 1.00 11.72 C ATOM 452 CG PRO A 60 41.143 17.565 20.317 1.00 12.10 C ATOM 453 CD PRO A 60 41.937 18.360 19.305 1.00 11.75 C ATOM 454 N ASN A 61 44.719 15.477 21.562 1.00 15.23 N ATOM 455 CA ASN A 61 45.187 14.089 21.475 1.00 18.24 C ATOM 456 C ASN A 61 44.530 13.277 22.580 1.00 19.46 C ATOM 457 O ASN A 61 45.208 12.704 23.442 1.00 24.53 O ATOM 458 CB ASN A 61 46.701 13.997 21.686 1.00 19.67 C ATOM 459 CG ASN A 61 47.477 14.206 20.421 1.00 22.01 C ATOM 460 OD1 ASN A 61 46.925 14.145 19.331 1.00 24.76 O ATOM 461 ND2 ASN A 61 48.770 14.461 20.556 1.00 25.57 N ATOM 462 N GLY A 62 43.204 13.273 22.576 1.00 15.75 N ATOM 463 CA GLY A 62 42.464 12.584 23.611 1.00 14.10 C ATOM 464 C GLY A 62 41.190 13.349 23.932 1.00 12.63 C ATOM 465 O GLY A 62 40.641 14.030 23.064 1.00 14.13 O ATOM 466 N ASN A 63 40.737 13.258 25.178 1.00 11.18 N ATOM 467 CA ASN A 63 39.505 13.915 25.614 1.00 12.07 C ATOM 468 C ASN A 63 39.708 15.411 25.835 1.00 10.92 C ATOM 469 O ASN A 63 40.420 15.821 26.747 1.00 11.29 O ATOM 470 CB ASN A 63 39.006 13.282 26.914 1.00 13.88 C ATOM 471 CG ASN A 63 37.576 13.682 27.260 1.00 15.51 C ATOM 472 OD1 ASN A 63 37.005 13.167 28.217 1.00 20.80 O ATOM 473 ND2 ASN A 63 36.993 14.594 26.488 1.00 16.41 N ATOM 474 N GLY A 64 39.058 16.207 24.993 1.00 10.34 N ATOM 475 CA GLY A 64 39.133 17.653 25.096 1.00 9.59 C ATOM 476 C GLY A 64 37.922 18.256 24.404 1.00 9.72 C ATOM 477 O GLY A 64 37.445 17.712 23.407 1.00 8.93 O ATOM 478 N TYR A 65 37.425 19.377 24.919 1.00 8.04 N ATOM 479 CA TYR A 65 36.264 20.026 24.327 1.00 8.46 C ATOM 480 C TYR A 65 36.550 21.478 23.966 1.00 8.31 C ATOM 481 O TYR A 65 37.224 22.197 24.704 1.00 9.09 O ATOM 482 CB TYR A 65 35.071 20.105 25.293 1.00 8.67 C ATOM 483 CG TYR A 65 34.677 18.853 26.026 1.00 11.18 C ATOM 484 CD1 TYR A 65 34.642 17.619 25.382 1.00 11.20 C ATOM 485 CD2 TYR A 65 34.284 18.915 27.359 1.00 12.40 C ATOM 486 CE1 TYR A 65 34.219 16.474 26.051 1.00 12.70 C ATOM 487 CE2 TYR A 65 33.859 17.780 28.040 1.00 13.92 C ATOM 488 CZ TYR A 65 33.828 16.562 27.376 1.00 15.13 C ATOM 489 OH TYR A 65 33.395 15.438 28.046 1.00 16.27 O ATOM 490 N LEU A 66 36.053 21.867 22.798 1.00 7.25 N ATOM 491 CA LEU A 66 36.032 23.252 22.355 1.00 6.77 C ATOM 492 C LEU A 66 34.612 23.733 22.595 1.00 6.34 C ATOM 493 O LEU A 66 33.704 23.361 21.851 1.00 6.31 O ATOM 494 CB LEU A 66 36.394 23.355 20.864 1.00 7.37 C ATOM 495 CG LEU A 66 36.485 24.765 20.260 1.00 8.50 C ATOM 496 CD1 LEU A 66 37.573 25.586 20.973 1.00 10.71 C ATOM 497 CD2 LEU A 66 36.771 24.651 18.772 1.00 8.27 C ATOM 498 N THR A 67 34.395 24.530 23.634 1.00 6.53 N ATOM 499 CA THR A 67 33.007 24.764 23.985 1.00 5.97 C ATOM 500 C THR A 67 32.768 26.093 24.683 1.00 5.80 C ATOM 501 O THR A 67 33.638 26.620 25.369 1.00 7.34 O ATOM 502 CB THR A 67 32.604 23.640 25.000 1.00 5.99 C ATOM 503 OG1 THR A 67 31.276 23.837 25.487 1.00 7.36 O ATOM 504 CG2 THR A 67 33.566 23.657 26.205 1.00 8.13 C ATOM 505 N LEU A 68 31.573 26.634 24.471 1.00 6.41 N ATOM 506 CA LEU A 68 31.169 27.774 25.260 1.00 6.12 C ATOM 507 C LEU A 68 30.971 27.266 26.674 1.00 7.67 C ATOM 508 O LEU A 68 30.405 26.182 26.858 1.00 7.16 O ATOM 509 CB LEU A 68 29.860 28.363 24.743 1.00 7.32 C ATOM 510 CG LEU A 68 29.337 29.545 25.560 1.00 8.94 C ATOM 511 CD1 LEU A 68 30.230 30.750 25.319 1.00 10.33 C ATOM 512 CD2 LEU A 68 27.906 29.851 25.181 1.00 10.54 C ATOM 513 N TYR A 69 31.433 27.993 27.671 1.00 6.16 N ATOM 514 CA TYR A 69 31.356 27.467 29.012 1.00 7.05 C ATOM 515 C TYR A 69 31.022 28.558 30.003 1.00 7.03 C ATOM 516 O TYR A 69 31.560 29.653 29.918 1.00 7.82 O ATOM 517 CB TYR A 69 32.719 26.824 29.326 1.00 6.65 C ATOM 518 CG TYR A 69 32.898 26.311 30.730 1.00 8.22 C ATOM 519 CD1 TYR A 69 32.320 25.106 31.135 1.00 9.37 C ATOM 520 CD2 TYR A 69 33.644 27.031 31.661 1.00 8.91 C ATOM 521 CE1 TYR A 69 32.476 24.633 32.442 1.00 9.85 C ATOM 522 CE2 TYR A 69 33.807 26.567 32.968 1.00 10.44 C ATOM 523 CZ TYR A 69 33.217 25.369 33.353 1.00 9.11 C ATOM 524 OH TYR A 69 33.355 24.930 34.648 1.00 9.39 O ATOM 525 N GLY A 70 30.132 28.254 30.939 1.00 7.42 N ATOM 526 CA GLY A 70 29.758 29.245 31.926 1.00 7.79 C ATOM 527 C GLY A 70 29.015 28.676 33.113 1.00 9.47 C ATOM 528 O GLY A 70 28.711 27.477 33.169 1.00 7.60 O ATOM 529 N TRP A 71 28.719 29.558 34.066 1.00 9.15 N ATOM 530 CA TRP A 71 28.009 29.186 35.281 1.00 9.42 C ATOM 531 C TRP A 71 26.958 30.218 35.659 1.00 9.97 C ATOM 532 O TRP A 71 27.022 31.392 35.287 1.00 9.92 O ATOM 533 CB TRP A 71 28.951 29.119 36.492 1.00 9.18 C ATOM 534 CG TRP A 71 29.942 28.007 36.537 1.00 10.23 C ATOM 535 CD1 TRP A 71 31.166 27.982 35.941 1.00 11.44 C ATOM 536 CD2 TRP A 71 29.851 26.805 37.317 1.00 10.74 C ATOM 537 NE1 TRP A 71 31.848 26.846 36.303 1.00 11.73 N ATOM 538 CE2 TRP A 71 31.066 26.105 37.148 1.00 11.63 C ATOM 539 CE3 TRP A 71 28.862 26.255 38.144 1.00 12.25 C ATOM 540 CZ2 TRP A 71 31.322 24.881 37.775 1.00 11.10 C ATOM 541 CZ3 TRP A 71 29.117 25.036 38.770 1.00 12.92 C ATOM 542 CH2 TRP A 71 30.340 24.364 38.580 1.00 11.41 C ATOM 543 N THR A 72 25.980 29.728 36.403 1.00 10.85 N ATOM 544 CA THR A 72 24.967 30.551 37.030 1.00 11.46 C ATOM 545 C THR A 72 24.800 30.096 38.452 1.00 13.07 C ATOM 546 O THR A 72 25.141 28.960 38.782 1.00 13.33 O ATOM 547 CB THR A 72 23.544 30.482 36.387 1.00 11.94 C ATOM 548 OG1 THR A 72 22.979 29.182 36.598 1.00 12.04 O ATOM 549 CG2 THR A 72 23.578 30.830 34.912 1.00 11.38 C ATOM 550 N ARG A 73 24.351 30.988 39.309 1.00 13.10 N ATOM 551 CA ARG A 73 24.080 30.624 40.676 1.00 14.60 C ATOM 552 C ARG A 73 22.584 30.749 40.929 1.00 15.30 C ATOM 553 O ARG A 73 21.889 31.377 40.129 1.00 14.85 O ATOM 554 CB ARG A 73 24.876 31.525 41.629 1.00 15.50 C ATOM 555 CG ARG A 73 26.395 31.312 41.587 1.00 16.44 C ATOM 556 CD ARG A 73 27.100 32.111 42.690 1.00 17.70 C ATOM 557 NE ARG A 73 28.557 31.949 42.705 1.00 18.54 N ATOM 558 CZ ARG A 73 29.397 32.672 41.968 1.00 20.74 C ATOM 559 NH1 ARG A 73 28.921 33.606 41.158 1.00 22.70 N ATOM 560 NH2 ARG A 73 30.710 32.480 42.048 1.00 21.04 N ATOM 561 N SER A 74 22.083 30.133 41.992 1.00 17.00 N ATOM 562 CA SER A 74 20.658 30.206 42.321 1.00 20.17 C ATOM 563 C SER A 74 19.775 29.834 41.127 1.00 19.62 C ATOM 564 O SER A 74 19.034 30.667 40.605 1.00 20.43 O ATOM 565 CB SER A 74 20.298 31.615 42.797 1.00 20.97 C ATOM 566 OG SER A 74 21.023 31.947 43.964 1.00 26.75 O ATOM 567 N PRO A 75 19.830 28.572 40.695 1.00 19.70 N ATOM 568 CA PRO A 75 20.665 27.520 41.273 1.00 19.31 C ATOM 569 C PRO A 75 22.011 27.428 40.577 1.00 16.89 C ATOM 570 O PRO A 75 22.231 28.055 39.542 1.00 16.96 O ATOM 571 CB PRO A 75 19.842 26.262 41.054 1.00 19.60 C ATOM 572 CG PRO A 75 19.114 26.540 39.763 1.00 21.80 C ATOM 573 CD PRO A 75 18.991 28.047 39.604 1.00 21.03 C ATOM 574 N LEU A 76 22.902 26.639 41.162 1.00 15.98 N ATOM 575 CA LEU A 76 24.223 26.417 40.610 1.00 14.90 C ATOM 576 C LEU A 76 24.136 25.533 39.379 1.00 14.26 C ATOM 577 O LEU A 76 23.702 24.388 39.464 1.00 14.38 O ATOM 578 CB LEU A 76 25.108 25.745 41.657 1.00 15.84 C ATOM 579 CG LEU A 76 26.628 25.870 41.585 1.00 18.13 C ATOM 580 CD1 LEU A 76 27.057 27.336 41.544 1.00 19.03 C ATOM 581 CD2 LEU A 76 27.210 25.177 42.814 1.00 18.93 C ATOM 582 N ILE A 77 24.526 26.072 38.232 1.00 11.95 N ATOM 583 CA ILE A 77 24.475 25.305 37.005 1.00 10.74 C ATOM 584 C ILE A 77 25.694 25.574 36.142 1.00 10.64 C ATOM 585 O ILE A 77 26.096 26.720 35.959 1.00 10.56 O ATOM 586 CB ILE A 77 23.201 25.645 36.178 1.00 11.39 C ATOM 587 CG1 ILE A 77 21.956 25.138 36.907 1.00 12.38 C ATOM 588 CG2 ILE A 77 23.277 25.014 34.789 1.00 9.49 C ATOM 589 CD1 ILE A 77 20.674 25.627 36.314 1.00 16.04 C ATOM 590 N GLU A 78 26.307 24.498 35.671 1.00 9.24 N ATOM 591 CA GLU A 78 27.430 24.567 34.757 1.00 8.23 C ATOM 592 C GLU A 78 26.922 24.255 33.357 1.00 8.70 C ATOM 593 O GLU A 78 26.375 23.176 33.143 1.00 9.35 O ATOM 594 CB GLU A 78 28.494 23.549 35.191 1.00 9.29 C ATOM 595 CG GLU A 78 29.823 23.625 34.462 1.00 9.93 C ATOM 596 CD GLU A 78 30.795 22.551 34.929 1.00 10.95 C ATOM 597 OE1 GLU A 78 30.352 21.406 35.155 1.00 11.01 O ATOM 598 OE2 GLU A 78 32.000 22.845 35.075 1.00 10.62 O ATOM 599 N TYR A 79 27.056 25.175 32.409 1.00 6.90 N ATOM 600 CA TYR A 79 26.502 24.900 31.093 1.00 6.31 C ATOM 601 C TYR A 79 27.562 24.886 30.005 1.00 7.26 C ATOM 602 O TYR A 79 28.644 25.473 30.146 1.00 6.70 O ATOM 603 CB TYR A 79 25.396 25.906 30.762 1.00 7.99 C ATOM 604 CG TYR A 79 25.865 27.339 30.653 1.00 9.48 C ATOM 605 CD1 TYR A 79 26.478 27.804 29.486 1.00 9.37 C ATOM 606 CD2 TYR A 79 25.691 28.233 31.714 1.00 9.63 C ATOM 607 CE1 TYR A 79 26.910 29.127 29.378 1.00 10.96 C ATOM 608 CE2 TYR A 79 26.118 29.561 31.617 1.00 10.68 C ATOM 609 CZ TYR A 79 26.728 29.999 30.447 1.00 10.39 C ATOM 610 OH TYR A 79 27.162 31.302 30.346 1.00 12.06 O ATOM 611 N TYR A 80 27.208 24.239 28.892 1.00 6.52 N ATOM 612 CA TYR A 80 28.113 24.067 27.771 1.00 7.26 C ATOM 613 C TYR A 80 27.400 24.126 26.434 1.00 5.62 C ATOM 614 O TYR A 80 26.256 23.720 26.289 1.00 6.77 O ATOM 615 CB TYR A 80 28.726 22.663 27.771 1.00 6.77 C ATOM 616 CG TYR A 80 29.640 22.303 28.896 1.00 5.59 C ATOM 617 CD1 TYR A 80 29.135 21.886 30.124 1.00 7.72 C ATOM 618 CD2 TYR A 80 31.020 22.292 28.708 1.00 7.31 C ATOM 619 CE1 TYR A 80 29.985 21.459 31.143 1.00 7.21 C ATOM 620 CE2 TYR A 80 31.878 21.873 29.709 1.00 10.08 C ATOM 621 CZ TYR A 80 31.357 21.453 30.927 1.00 9.07 C ATOM 622 OH TYR A 80 32.217 21.022 31.910 1.00 12.15 O ATOM 623 N VAL A 81 28.132 24.637 25.459 1.00 6.01 N ATOM 624 CA VAL A 81 27.759 24.583 24.046 1.00 5.80 C ATOM 625 C VAL A 81 28.975 24.083 23.284 1.00 7.03 C ATOM 626 O VAL A 81 29.884 24.850 22.958 1.00 8.09 O ATOM 627 CB VAL A 81 27.283 25.931 23.450 1.00 6.45 C ATOM 628 CG1 VAL A 81 26.914 25.730 21.974 1.00 6.43 C ATOM 629 CG2 VAL A 81 26.064 26.434 24.201 1.00 6.97 C ATOM 630 N VAL A 82 29.020 22.767 23.090 1.00 6.13 N ATOM 631 CA VAL A 82 30.174 22.105 22.491 1.00 6.31 C ATOM 632 C VAL A 82 30.113 22.072 20.967 1.00 6.46 C ATOM 633 O VAL A 82 29.207 21.476 20.379 1.00 7.13 O ATOM 634 CB VAL A 82 30.306 20.657 23.050 1.00 5.92 C ATOM 635 CG1 VAL A 82 31.588 20.010 22.550 1.00 7.44 C ATOM 636 CG2 VAL A 82 30.300 20.685 24.578 1.00 6.66 C ATOM 637 N ASP A 83 31.112 22.692 20.336 1.00 6.42 N ATOM 638 CA ASP A 83 31.201 22.742 18.878 1.00 6.25 C ATOM 639 C ASP A 83 32.138 21.664 18.336 1.00 7.14 C ATOM 640 O ASP A 83 31.971 21.183 17.220 1.00 7.48 O ATOM 641 CB ASP A 83 31.670 24.117 18.424 1.00 6.04 C ATOM 642 CG ASP A 83 30.517 25.016 18.056 1.00 7.47 C ATOM 643 OD1 ASP A 83 29.359 24.544 18.081 1.00 8.19 O ATOM 644 OD2 ASP A 83 30.765 26.194 17.740 1.00 9.02 O ATOM 645 N SER A 84 33.138 21.302 19.120 1.00 6.97 N ATOM 646 CA SER A 84 34.048 20.250 18.709 1.00 7.38 C ATOM 647 C SER A 84 34.616 19.533 19.914 1.00 7.24 C ATOM 648 O SER A 84 34.524 20.013 21.040 1.00 7.37 O ATOM 649 CB SER A 84 35.181 20.803 17.855 1.00 7.29 C ATOM 650 OG SER A 84 35.890 19.738 17.241 1.00 9.01 O ATOM 651 N TRP A 85 35.200 18.369 19.680 1.00 8.03 N ATOM 652 CA TRP A 85 35.763 17.587 20.765 1.00 8.99 C ATOM 653 C TRP A 85 36.908 16.732 20.263 1.00 9.94 C ATOM 654 O TRP A 85 37.249 16.794 19.081 1.00 10.89 O ATOM 655 CB TRP A 85 34.677 16.703 21.386 1.00 8.70 C ATOM 656 CG TRP A 85 33.966 15.850 20.372 1.00 9.56 C ATOM 657 CD1 TRP A 85 34.333 14.599 19.944 1.00 10.73 C ATOM 658 CD2 TRP A 85 32.801 16.206 19.614 1.00 9.18 C ATOM 659 NE1 TRP A 85 33.470 14.162 18.966 1.00 11.08 N ATOM 660 CE2 TRP A 85 32.523 15.127 18.742 1.00 10.13 C ATOM 661 CE3 TRP A 85 31.966 17.332 19.583 1.00 9.96 C ATOM 662 CZ2 TRP A 85 31.446 15.142 17.851 1.00 9.04 C ATOM 663 CZ3 TRP A 85 30.892 17.346 18.693 1.00 9.51 C ATOM 664 CH2 TRP A 85 30.645 16.255 17.841 1.00 10.52 C ATOM 665 N GLY A 86 37.499 15.947 21.156 1.00 10.28 N ATOM 666 CA GLY A 86 38.603 15.092 20.764 1.00 11.01 C ATOM 667 C GLY A 86 38.159 13.676 20.463 1.00 11.66 C ATOM 668 O GLY A 86 37.448 13.421 19.493 1.00 12.08 O ATOM 669 N THR A 87 38.554 12.750 21.321 1.00 11.78 N ATOM 670 CA THR A 87 38.218 11.349 21.113 1.00 14.07 C ATOM 671 C THR A 87 36.879 10.976 21.741 1.00 15.18 C ATOM 672 O THR A 87 36.352 9.906 21.443 1.00 16.41 O ATOM 673 CB THR A 87 39.290 10.438 21.717 1.00 12.87 C ATOM 674 OG1 THR A 87 39.513 10.818 23.081 1.00 14.47 O ATOM 675 CG2 THR A 87 40.588 10.541 20.921 1.00 12.93 C ATOM 676 N TYR A 88 36.315 11.837 22.584 1.00 13.57 N ATOM 677 CA TYR A 88 35.062 11.495 23.254 1.00 13.64 C ATOM 678 C TYR A 88 33.995 12.571 23.080 1.00 12.85 C ATOM 679 O TYR A 88 34.197 13.722 23.448 1.00 13.10 O ATOM 680 CB TYR A 88 35.328 11.278 24.751 1.00 14.79 C ATOM 681 CG TYR A 88 34.081 11.185 25.599 1.00 18.29 C ATOM 682 CD1 TYR A 88 33.204 10.104 25.470 1.00 21.12 C ATOM 683 CD2 TYR A 88 33.763 12.187 26.511 1.00 19.78 C ATOM 684 CE1 TYR A 88 32.038 10.028 26.225 1.00 22.53 C ATOM 685 CE2 TYR A 88 32.600 12.122 27.273 1.00 22.80 C ATOM 686 CZ TYR A 88 31.740 11.039 27.123 1.00 24.13 C ATOM 687 OH TYR A 88 30.575 10.984 27.857 1.00 27.85 O ATOM 688 N ARG A 89 32.856 12.193 22.513 1.00 11.57 N ATOM 689 CA ARG A 89 31.752 13.133 22.373 1.00 11.50 C ATOM 690 C ARG A 89 30.903 13.130 23.642 1.00 12.11 C ATOM 691 O ARG A 89 30.333 12.105 24.013 1.00 12.13 O ATOM 692 CB ARG A 89 30.873 12.782 21.165 1.00 11.00 C ATOM 693 CG ARG A 89 29.701 13.742 20.977 1.00 9.99 C ATOM 694 CD ARG A 89 28.853 13.429 19.754 1.00 9.93 C ATOM 695 NE ARG A 89 27.803 14.435 19.580 1.00 9.29 N ATOM 696 CZ ARG A 89 26.552 14.301 20.011 1.00 8.44 C ATOM 697 NH1 ARG A 89 26.173 13.193 20.644 1.00 8.62 N ATOM 698 NH2 ARG A 89 25.684 15.288 19.835 1.00 9.07 N ATOM 699 N PRO A 90 30.818 14.277 24.337 1.00 12.14 N ATOM 700 CA PRO A 90 30.015 14.294 25.563 1.00 12.09 C ATOM 701 C PRO A 90 28.522 14.061 25.347 1.00 12.52 C ATOM 702 O PRO A 90 27.923 14.592 24.413 1.00 14.92 O ATOM 703 CB PRO A 90 30.304 15.671 26.172 1.00 11.94 C ATOM 704 CG PRO A 90 30.740 16.513 25.023 1.00 12.06 C ATOM 705 CD PRO A 90 31.425 15.591 24.043 1.00 12.32 C ATOM 706 N THR A 91 27.930 13.242 26.206 1.00 12.54 N ATOM 707 CA THR A 91 26.502 12.962 26.138 1.00 13.94 C ATOM 708 C THR A 91 25.930 12.791 27.536 1.00 14.08 C ATOM 709 O THR A 91 26.679 12.770 28.509 1.00 16.74 O ATOM 710 CB THR A 91 26.188 11.689 25.285 1.00 15.80 C ATOM 711 OG1 THR A 91 26.726 10.522 25.925 1.00 19.14 O ATOM 712 CG2 THR A 91 26.788 11.823 23.884 1.00 15.66 C ATOM 713 N GLY A 92 24.609 12.692 27.636 1.00 13.56 N ATOM 714 CA GLY A 92 23.962 12.521 28.922 1.00 12.09 C ATOM 715 C GLY A 92 22.525 12.136 28.656 1.00 12.95 C ATOM 716 O GLY A 92 22.256 11.354 27.744 1.00 15.67 O ATOM 717 N THR A 93 21.604 12.671 29.449 1.00 12.03 N ATOM 718 CA THR A 93 20.184 12.395 29.267 1.00 12.61 C ATOM 719 C THR A 93 19.616 13.253 28.138 1.00 12.40 C ATOM 720 O THR A 93 19.505 14.474 28.266 1.00 12.49 O ATOM 721 CB THR A 93 19.406 12.663 30.578 1.00 13.91 C ATOM 722 OG1 THR A 93 19.960 11.864 31.634 1.00 16.26 O ATOM 723 CG2 THR A 93 17.937 12.325 30.415 1.00 15.18 C ATOM 724 N TYR A 94 19.271 12.606 27.030 1.00 10.37 N ATOM 725 CA TYR A 94 18.751 13.288 25.849 1.00 10.73 C ATOM 726 C TYR A 94 17.425 13.998 26.128 1.00 11.24 C ATOM 727 O TYR A 94 16.500 13.411 26.686 1.00 12.41 O ATOM 728 CB TYR A 94 18.562 12.284 24.716 1.00 10.56 C ATOM 729 CG TYR A 94 18.030 12.903 23.450 1.00 10.27 C ATOM 730 CD1 TYR A 94 18.873 13.588 22.580 1.00 11.40 C ATOM 731 CD2 TYR A 94 16.684 12.804 23.116 1.00 11.97 C ATOM 732 CE1 TYR A 94 18.390 14.154 21.411 1.00 11.64 C ATOM 733 CE2 TYR A 94 16.192 13.367 21.949 1.00 11.32 C ATOM 734 CZ TYR A 94 17.052 14.039 21.104 1.00 11.36 C ATOM 735 OH TYR A 94 16.571 14.587 19.944 1.00 13.48 O ATOM 736 N LYS A 95 17.335 15.256 25.700 1.00 9.73 N ATOM 737 CA LYS A 95 16.139 16.072 25.892 1.00 10.52 C ATOM 738 C LYS A 95 15.509 16.461 24.559 1.00 11.41 C ATOM 739 O LYS A 95 14.283 16.527 24.430 1.00 13.28 O ATOM 740 CB LYS A 95 16.489 17.344 26.675 1.00 12.43 C ATOM 741 CG LYS A 95 16.866 17.101 28.130 1.00 16.17 C ATOM 742 CD LYS A 95 15.694 16.488 28.895 1.00 20.62 C ATOM 743 CE LYS A 95 15.992 16.365 30.371 1.00 23.27 C ATOM 744 NZ LYS A 95 15.677 17.645 31.053 1.00 29.51 N ATOM 745 N GLY A 96 16.352 16.719 23.566 1.00 10.50 N ATOM 746 CA GLY A 96 15.854 17.106 22.261 1.00 10.16 C ATOM 747 C GLY A 96 16.982 17.704 21.457 1.00 9.63 C ATOM 748 O GLY A 96 18.142 17.467 21.767 1.00 9.70 O ATOM 749 N THR A 97 16.652 18.467 20.418 1.00 10.05 N ATOM 750 CA THR A 97 17.676 19.096 19.594 1.00 10.28 C ATOM 751 C THR A 97 17.355 20.562 19.329 1.00 11.08 C ATOM 752 O THR A 97 16.238 21.028 19.541 1.00 10.79 O ATOM 753 CB THR A 97 17.810 18.419 18.212 1.00 11.21 C ATOM 754 OG1 THR A 97 16.599 18.613 17.470 1.00 12.46 O ATOM 755 CG2 THR A 97 18.091 16.927 18.361 1.00 11.29 C ATOM 756 N VAL A 98 18.366 21.285 18.867 1.00 11.02 N ATOM 757 CA VAL A 98 18.205 22.683 18.505 1.00 11.06 C ATOM 758 C VAL A 98 19.104 23.023 17.339 1.00 9.72 C ATOM 759 O VAL A 98 20.259 22.612 17.311 1.00 10.16 O ATOM 760 CB VAL A 98 18.534 23.649 19.690 1.00 10.90 C ATOM 761 CG1 VAL A 98 19.957 23.432 20.178 1.00 11.35 C ATOM 762 CG2 VAL A 98 18.356 25.095 19.246 1.00 11.73 C ATOM 763 N LYS A 99 18.558 23.711 16.344 1.00 11.10 N ATOM 764 CA LYS A 99 19.366 24.146 15.214 1.00 12.65 C ATOM 765 C LYS A 99 19.821 25.576 15.432 1.00 12.05 C ATOM 766 O LYS A 99 19.013 26.452 15.735 1.00 12.68 O ATOM 767 CB LYS A 99 18.586 24.070 13.903 1.00 17.08 C ATOM 768 CG LYS A 99 18.356 22.663 13.403 1.00 25.81 C ATOM 769 CD LYS A 99 17.091 22.107 14.034 1.00 34.38 C ATOM 770 CE LYS A 99 16.985 20.594 13.919 1.00 37.14 C ATOM 771 NZ LYS A 99 15.943 20.109 14.860 1.00 39.26 N ATOM 772 N SER A 100 21.117 25.810 15.301 1.00 10.95 N ATOM 773 CA SER A 100 21.639 27.143 15.511 1.00 10.53 C ATOM 774 C SER A 100 22.977 27.325 14.820 1.00 9.96 C ATOM 775 O SER A 100 23.824 26.434 14.843 1.00 9.88 O ATOM 776 CB SER A 100 21.789 27.395 17.016 1.00 10.04 C ATOM 777 OG SER A 100 22.104 28.752 17.271 1.00 11.77 O ATOM 778 N ASP A 101 23.149 28.481 14.190 1.00 9.31 N ATOM 779 CA ASP A 101 24.394 28.838 13.520 1.00 9.77 C ATOM 780 C ASP A 101 24.859 27.766 12.538 1.00 9.64 C ATOM 781 O ASP A 101 26.037 27.416 12.514 1.00 10.71 O ATOM 782 CB ASP A 101 25.475 29.109 14.566 1.00 8.98 C ATOM 783 CG ASP A 101 25.022 30.106 15.601 1.00 10.77 C ATOM 784 OD1 ASP A 101 24.980 31.312 15.279 1.00 12.70 O ATOM 785 OD2 ASP A 101 24.692 29.684 16.731 1.00 10.32 O ATOM 786 N GLY A 102 23.937 27.252 11.731 1.00 10.52 N ATOM 787 CA GLY A 102 24.295 26.259 10.732 1.00 11.82 C ATOM 788 C GLY A 102 24.470 24.818 11.176 1.00 13.28 C ATOM 789 O GLY A 102 24.727 23.944 10.345 1.00 16.70 O ATOM 790 N GLY A 103 24.341 24.552 12.468 1.00 11.49 N ATOM 791 CA GLY A 103 24.500 23.188 12.926 1.00 11.31 C ATOM 792 C GLY A 103 23.330 22.715 13.758 1.00 11.67 C ATOM 793 O GLY A 103 22.469 23.503 14.148 1.00 11.44 O ATOM 794 N THR A 104 23.283 21.407 13.996 1.00 10.57 N ATOM 795 CA THR A 104 22.245 20.816 14.829 1.00 9.61 C ATOM 796 C THR A 104 22.865 20.283 16.098 1.00 8.62 C ATOM 797 O THR A 104 23.874 19.571 16.048 1.00 8.92 O ATOM 798 CB THR A 104 21.492 19.674 14.093 1.00 11.28 C ATOM 799 OG1 THR A 104 20.892 20.194 12.899 1.00 13.71 O ATOM 800 CG2 THR A 104 20.401 19.070 14.986 1.00 12.23 C ATOM 801 N TYR A 105 22.275 20.634 17.232 1.00 6.65 N ATOM 802 CA TYR A 105 22.831 20.226 18.506 1.00 6.89 C ATOM 803 C TYR A 105 21.868 19.362 19.286 1.00 6.75 C ATOM 804 O TYR A 105 20.667 19.586 19.278 1.00 7.74 O ATOM 805 CB TYR A 105 23.144 21.455 19.375 1.00 6.90 C ATOM 806 CG TYR A 105 24.177 22.414 18.813 1.00 5.80 C ATOM 807 CD1 TYR A 105 23.872 23.245 17.733 1.00 6.42 C ATOM 808 CD2 TYR A 105 25.444 22.523 19.391 1.00 6.42 C ATOM 809 CE1 TYR A 105 24.795 24.166 17.243 1.00 6.95 C ATOM 810 CE2 TYR A 105 26.380 23.447 18.908 1.00 7.52 C ATOM 811 CZ TYR A 105 26.041 24.265 17.833 1.00 7.88 C ATOM 812 OH TYR A 105 26.941 25.187 17.358 1.00 8.95 O ATOM 813 N ASP A 106 22.415 18.357 19.952 1.00 7.37 N ATOM 814 CA ASP A 106 21.622 17.540 20.848 1.00 7.12 C ATOM 815 C ASP A 106 21.618 18.189 22.218 1.00 7.63 C ATOM 816 O ASP A 106 22.634 18.749 22.625 1.00 10.67 O ATOM 817 CB ASP A 106 22.223 16.146 20.989 1.00 7.25 C ATOM 818 CG ASP A 106 22.107 15.337 19.730 1.00 6.93 C ATOM 819 OD1 ASP A 106 21.025 15.347 19.114 1.00 9.39 O ATOM 820 OD2 ASP A 106 23.109 14.693 19.366 1.00 10.47 O ATOM 821 N ILE A 107 20.502 18.139 22.925 1.00 8.28 N ATOM 822 CA ILE A 107 20.439 18.739 24.248 1.00 7.76 C ATOM 823 C ILE A 107 20.477 17.663 25.315 1.00 8.12 C ATOM 824 O ILE A 107 19.701 16.712 25.254 1.00 9.68 O ATOM 825 CB ILE A 107 19.152 19.584 24.414 1.00 7.32 C ATOM 826 CG1 ILE A 107 19.143 20.709 23.375 1.00 8.22 C ATOM 827 CG2 ILE A 107 19.077 20.170 25.824 1.00 5.93 C ATOM 828 CD1 ILE A 107 17.794 21.382 23.207 1.00 10.97 C ATOM 829 N TYR A 108 21.382 17.802 26.280 1.00 6.52 N ATOM 830 CA TYR A 108 21.509 16.814 27.344 1.00 6.88 C ATOM 831 C TYR A 108 21.624 17.467 28.695 1.00 8.21 C ATOM 832 O TYR A 108 22.026 18.622 28.820 1.00 7.72 O ATOM 833 CB TYR A 108 22.788 15.983 27.209 1.00 6.80 C ATOM 834 CG TYR A 108 22.976 15.251 25.913 1.00 7.89 C ATOM 835 CD1 TYR A 108 22.208 14.128 25.607 1.00 9.23 C ATOM 836 CD2 TYR A 108 23.959 15.651 25.005 1.00 7.82 C ATOM 837 CE1 TYR A 108 22.415 13.411 24.424 1.00 8.80 C ATOM 838 CE2 TYR A 108 24.175 14.945 23.818 1.00 9.82 C ATOM 839 CZ TYR A 108 23.398 13.826 23.535 1.00 9.78 C ATOM 840 OH TYR A 108 23.600 13.133 22.364 1.00 10.34 O ATOM 841 N THR A 109 21.268 16.691 29.705 1.00 8.28 N ATOM 842 CA THR A 109 21.452 17.090 31.078 1.00 9.54 C ATOM 843 C THR A 109 22.211 16.009 31.813 1.00 10.86 C ATOM 844 O THR A 109 22.060 14.824 31.521 1.00 11.16 O ATOM 845 CB THR A 109 20.136 17.332 31.852 1.00 12.88 C ATOM 846 OG1 THR A 109 19.373 16.122 31.904 1.00 13.93 O ATOM 847 CG2 THR A 109 19.329 18.429 31.207 1.00 14.21 C ATOM 848 N THR A 110 23.075 16.425 32.719 1.00 10.96 N ATOM 849 CA THR A 110 23.832 15.506 33.538 1.00 10.85 C ATOM 850 C THR A 110 23.990 16.083 34.925 1.00 11.65 C ATOM 851 O THR A 110 23.654 17.238 35.155 1.00 11.16 O ATOM 852 CB THR A 110 25.248 15.205 32.962 1.00 11.52 C ATOM 853 OG1 THR A 110 26.000 16.419 32.857 1.00 12.87 O ATOM 854 CG2 THR A 110 25.149 14.546 31.593 1.00 12.94 C ATOM 855 N THR A 111 24.472 15.275 35.852 1.00 11.90 N ATOM 856 CA THR A 111 24.682 15.732 37.202 1.00 11.89 C ATOM 857 C THR A 111 26.073 15.370 37.666 1.00 13.29 C ATOM 858 O THR A 111 26.601 14.312 37.322 1.00 13.02 O ATOM 859 CB THR A 111 23.647 15.105 38.159 1.00 13.12 C ATOM 860 OG1 THR A 111 22.330 15.368 37.663 1.00 16.04 O ATOM 861 CG2 THR A 111 23.776 15.679 39.573 1.00 13.07 C ATOM 862 N ARG A 112 26.689 16.288 38.394 1.00 12.23 N ATOM 863 CA ARG A 112 27.997 16.058 38.967 1.00 13.82 C ATOM 864 C ARG A 112 27.860 15.869 40.470 1.00 12.09 C ATOM 865 O ARG A 112 27.152 16.631 41.129 1.00 12.52 O ATOM 866 CB ARG A 112 28.919 17.235 38.650 1.00 15.98 C ATOM 867 CG ARG A 112 29.230 17.360 37.176 1.00 19.07 C ATOM 868 CD ARG A 112 30.464 16.559 36.825 1.00 24.03 C ATOM 869 NE ARG A 112 31.662 17.335 37.108 1.00 30.07 N ATOM 870 CZ ARG A 112 32.783 16.844 37.629 1.00 33.26 C ATOM 871 NH1 ARG A 112 32.870 15.556 37.937 1.00 35.14 N ATOM 872 NH2 ARG A 112 33.817 17.649 37.849 1.00 34.53 N ATOM 873 N TYR A 113 28.512 14.848 41.006 1.00 12.18 N ATOM 874 CA TYR A 113 28.404 14.548 42.427 1.00 13.30 C ATOM 875 C TYR A 113 29.715 14.775 43.146 1.00 14.32 C ATOM 876 O TYR A 113 30.754 14.248 42.741 1.00 15.51 O ATOM 877 CB TYR A 113 27.963 13.097 42.609 1.00 13.68 C ATOM 878 CG TYR A 113 26.637 12.816 41.957 1.00 13.33 C ATOM 879 CD1 TYR A 113 25.451 13.012 42.660 1.00 14.53 C ATOM 880 CD2 TYR A 113 26.562 12.394 40.629 1.00 12.55 C ATOM 881 CE1 TYR A 113 24.224 12.799 42.068 1.00 14.58 C ATOM 882 CE2 TYR A 113 25.328 12.175 40.022 1.00 13.71 C ATOM 883 CZ TYR A 113 24.168 12.384 40.755 1.00 13.59 C ATOM 884 OH TYR A 113 22.937 12.181 40.186 1.00 16.71 O ATOM 885 N ASN A 114 29.651 15.555 44.223 1.00 13.91 N ATOM 886 CA ASN A 114 30.827 15.871 45.026 1.00 15.02 C ATOM 887 C ASN A 114 31.986 16.319 44.151 1.00 15.39 C ATOM 888 O ASN A 114 33.104 15.821 44.283 1.00 15.90 O ATOM 889 CB ASN A 114 31.259 14.654 45.835 1.00 15.93 C ATOM 890 CG ASN A 114 32.260 15.008 46.909 1.00 18.14 C ATOM 891 OD1 ASN A 114 32.087 15.989 47.634 1.00 19.16 O ATOM 892 ND2 ASN A 114 33.324 14.217 47.013 1.00 20.22 N ATOM 893 N ALA A 115 31.709 17.258 43.253 1.00 13.84 N ATOM 894 CA ALA A 115 32.719 17.771 42.339 1.00 14.31 C ATOM 895 C ALA A 115 33.022 19.237 42.626 1.00 13.62 C ATOM 896 O ALA A 115 32.207 19.947 43.205 1.00 12.51 O ATOM 897 CB ALA A 115 32.235 17.607 40.895 1.00 12.54 C ATOM 898 N PRO A 116 34.207 19.710 42.216 1.00 15.41 N ATOM 899 CA PRO A 116 34.531 21.116 42.472 1.00 15.09 C ATOM 900 C PRO A 116 33.621 22.045 41.665 1.00 14.66 C ATOM 901 O PRO A 116 33.320 21.788 40.497 1.00 13.60 O ATOM 902 CB PRO A 116 36.001 21.245 42.049 1.00 16.93 C ATOM 903 CG PRO A 116 36.478 19.851 41.755 1.00 18.90 C ATOM 904 CD PRO A 116 35.275 19.010 41.482 1.00 17.05 C ATOM 905 N SER A 117 33.163 23.115 42.298 1.00 13.99 N ATOM 906 CA SER A 117 32.316 24.073 41.613 1.00 14.95 C ATOM 907 C SER A 117 33.000 25.425 41.534 1.00 15.21 C ATOM 908 O SER A 117 34.136 25.578 41.981 1.00 15.35 O ATOM 909 CB SER A 117 30.973 24.214 42.328 1.00 15.49 C ATOM 910 OG SER A 117 31.118 24.949 43.529 1.00 18.81 O ATOM 911 N ILE A 118 32.304 26.401 40.976 1.00 15.17 N ATOM 912 CA ILE A 118 32.851 27.736 40.819 1.00 16.75 C ATOM 913 C ILE A 118 33.221 28.364 42.167 1.00 18.15 C ATOM 914 O ILE A 118 34.166 29.141 42.242 1.00 19.28 O ATOM 915 CB ILE A 118 31.837 28.643 40.065 1.00 15.77 C ATOM 916 CG1 ILE A 118 32.437 30.029 39.830 1.00 17.16 C ATOM 917 CG2 ILE A 118 30.531 28.718 40.829 1.00 12.89 C ATOM 918 CD1 ILE A 118 31.609 30.903 38.897 1.00 16.70 C ATOM 919 N ASP A 119 32.515 27.998 43.231 1.00 20.51 N ATOM 920 CA ASP A 119 32.753 28.594 44.550 1.00 23.59 C ATOM 921 C ASP A 119 33.832 27.865 45.338 1.00 24.22 C ATOM 922 O ASP A 119 34.029 28.166 46.516 1.00 26.21 O ATOM 923 CB ASP A 119 31.469 28.573 45.374 1.00 26.94 C ATOM 924 CG ASP A 119 30.531 29.691 45.007 1.00 30.29 C ATOM 925 OD1 ASP A 119 31.027 30.770 44.610 1.00 33.36 O ATOM 926 OD2 ASP A 119 29.302 29.484 45.116 1.00 33.21 O ATOM 927 N GLY A 120 34.531 26.922 44.718 1.00 23.35 N ATOM 928 CA GLY A 120 35.544 26.186 45.455 1.00 22.27 C ATOM 929 C GLY A 120 34.890 25.033 46.199 1.00 22.23 C ATOM 930 O GLY A 120 33.667 24.868 46.154 1.00 24.17 O ATOM 931 N ASP A 121 35.686 24.232 46.894 1.00 21.39 N ATOM 932 CA ASP A 121 35.141 23.088 47.615 1.00 20.39 C ATOM 933 C ASP A 121 34.342 22.181 46.668 1.00 20.45 C ATOM 934 O ASP A 121 34.393 22.361 45.450 1.00 22.75 O ATOM 935 CB ASP A 121 34.281 23.572 48.793 1.00 18.40 C ATOM 936 CG ASP A 121 35.116 24.262 49.873 1.00 18.41 C ATOM 937 OD1 ASP A 121 36.300 23.898 50.029 1.00 16.58 O ATOM 938 OD2 ASP A 121 34.600 25.168 50.563 1.00 16.94 O ATOM 939 N ARG A 122 33.597 21.224 47.205 1.00 18.29 N ATOM 940 CA ARG A 122 32.865 20.300 46.344 1.00 17.28 C ATOM 941 C ARG A 122 31.387 20.287 46.655 1.00 15.39 C ATOM 942 O ARG A 122 30.972 20.522 47.783 1.00 15.10 O ATOM 943 CB ARG A 122 33.395 18.881 46.519 1.00 18.79 C ATOM 944 CG ARG A 122 34.800 18.680 46.037 1.00 24.35 C ATOM 945 CD ARG A 122 35.392 17.436 46.659 1.00 29.98 C ATOM 946 NE ARG A 122 36.731 17.180 46.144 1.00 37.18 N ATOM 947 CZ ARG A 122 36.987 16.560 44.995 1.00 41.09 C ATOM 948 NH1 ARG A 122 35.993 16.125 44.230 1.00 42.15 N ATOM 949 NH2 ARG A 122 38.243 16.386 44.600 1.00 44.22 N ATOM 950 N THR A 123 30.596 19.978 45.637 1.00 13.36 N ATOM 951 CA THR A 123 29.160 19.892 45.798 1.00 13.08 C ATOM 952 C THR A 123 28.527 19.135 44.635 1.00 12.36 C ATOM 953 O THR A 123 29.218 18.671 43.728 1.00 12.24 O ATOM 954 CB THR A 123 28.518 21.308 45.923 1.00 13.16 C ATOM 955 OG1 THR A 123 27.206 21.192 46.491 1.00 13.91 O ATOM 956 CG2 THR A 123 28.418 21.989 44.560 1.00 13.51 C ATOM 957 N THR A 124 27.211 18.997 44.686 1.00 11.65 N ATOM 958 CA THR A 124 26.466 18.320 43.641 1.00 12.47 C ATOM 959 C THR A 124 25.690 19.333 42.819 1.00 12.16 C ATOM 960 O THR A 124 24.950 20.136 43.380 1.00 12.49 O ATOM 961 CB THR A 124 25.496 17.311 44.261 1.00 12.47 C ATOM 962 OG1 THR A 124 26.251 16.263 44.881 1.00 15.03 O ATOM 963 CG2 THR A 124 24.583 16.715 43.206 1.00 13.15 C ATOM 964 N PHE A 125 25.860 19.320 41.502 1.00 11.18 N ATOM 965 CA PHE A 125 25.160 20.294 40.677 1.00 11.24 C ATOM 966 C PHE A 125 24.813 19.729 39.311 1.00 11.00 C ATOM 967 O PHE A 125 25.382 18.733 38.863 1.00 11.38 O ATOM 968 CB PHE A 125 26.012 21.559 40.508 1.00 10.70 C ATOM 969 CG PHE A 125 27.403 21.297 39.994 1.00 9.98 C ATOM 970 CD1 PHE A 125 27.664 21.271 38.621 1.00 9.54 C ATOM 971 CD2 PHE A 125 28.456 21.083 40.883 1.00 9.69 C ATOM 972 CE1 PHE A 125 28.953 21.036 38.144 1.00 10.00 C ATOM 973 CE2 PHE A 125 29.748 20.847 40.419 1.00 9.44 C ATOM 974 CZ PHE A 125 29.998 20.824 39.044 1.00 9.96 C ATOM 975 N THR A 126 23.876 20.397 38.650 1.00 11.19 N ATOM 976 CA THR A 126 23.420 19.993 37.334 1.00 11.80 C ATOM 977 C THR A 126 24.214 20.686 36.228 1.00 11.02 C ATOM 978 O THR A 126 24.692 21.806 36.394 1.00 10.24 O ATOM 979 CB THR A 126 21.935 20.350 37.133 1.00 14.68 C ATOM 980 OG1 THR A 126 21.155 19.784 38.193 1.00 18.03 O ATOM 981 CG2 THR A 126 21.436 19.804 35.805 1.00 17.01 C ATOM 982 N GLN A 127 24.354 19.991 35.104 1.00 9.55 N ATOM 983 CA GLN A 127 25.029 20.524 33.928 1.00 9.44 C ATOM 984 C GLN A 127 24.077 20.538 32.750 1.00 9.33 C ATOM 985 O GLN A 127 23.338 19.576 32.540 1.00 10.14 O ATOM 986 CB GLN A 127 26.243 19.672 33.535 1.00 9.74 C ATOM 987 CG GLN A 127 27.317 19.512 34.602 1.00 11.38 C ATOM 988 CD GLN A 127 28.409 18.556 34.168 1.00 12.72 C ATOM 989 OE1 GLN A 127 28.168 17.359 34.011 1.00 12.97 O ATOM 990 NE2 GLN A 127 29.612 19.077 33.962 1.00 12.27 N ATOM 991 N TYR A 128 24.069 21.637 32.008 1.00 8.63 N ATOM 992 CA TYR A 128 23.244 21.762 30.816 1.00 8.32 C ATOM 993 C TYR A 128 24.124 21.674 29.599 1.00 7.50 C ATOM 994 O TYR A 128 25.166 22.319 29.568 1.00 7.42 O ATOM 995 CB TYR A 128 22.527 23.109 30.781 1.00 8.70 C ATOM 996 CG TYR A 128 21.396 23.272 31.768 1.00 10.33 C ATOM 997 CD1 TYR A 128 20.967 22.212 32.571 1.00 10.41 C ATOM 998 CD2 TYR A 128 20.762 24.507 31.911 1.00 10.22 C ATOM 999 CE1 TYR A 128 19.936 22.384 33.493 1.00 10.66 C ATOM 1000 CE2 TYR A 128 19.737 24.688 32.824 1.00 10.42 C ATOM 1001 CZ TYR A 128 19.329 23.628 33.614 1.00 10.09 C ATOM 1002 OH TYR A 128 18.326 23.819 34.534 1.00 11.73 O ATOM 1003 N TRP A 129 23.727 20.904 28.589 1.00 6.78 N ATOM 1004 CA TRP A 129 24.589 20.755 27.429 1.00 6.89 C ATOM 1005 C TRP A 129 23.852 20.843 26.132 1.00 7.32 C ATOM 1006 O TRP A 129 22.725 20.400 25.963 1.00 7.24 O ATOM 1007 CB TRP A 129 25.239 19.375 27.337 1.00 6.81 C ATOM 1008 CG TRP A 129 26.005 18.873 28.496 1.00 6.81 C ATOM 1009 CD1 TRP A 129 25.505 18.392 29.673 1.00 6.57 C ATOM 1010 CD2 TRP A 129 27.427 18.727 28.571 1.00 6.37 C ATOM 1011 NE1 TRP A 129 26.531 17.956 30.475 1.00 8.63 N ATOM 1012 CE2 TRP A 129 27.723 18.149 29.824 1.00 6.91 C ATOM 1013 CE3 TRP A 129 28.482 19.029 27.694 1.00 6.38 C ATOM 1014 CZ2 TRP A 129 29.033 17.865 30.227 1.00 7.46 C ATOM 1015 CZ3 TRP A 129 29.778 18.748 28.089 1.00 6.32 C ATOM 1016 CH2 TRP A 129 30.045 18.170 29.351 1.00 7.80 C ATOM 1017 N SER A 130 24.585 21.419 25.203 1.00 6.80 N ATOM 1018 CA SER A 130 24.236 21.567 23.808 1.00 7.19 C ATOM 1019 C SER A 130 25.426 21.039 23.050 1.00 7.67 C ATOM 1020 O SER A 130 26.499 21.634 23.124 1.00 7.98 O ATOM 1021 CB SER A 130 23.946 23.029 23.448 1.00 8.29 C ATOM 1022 OG SER A 130 22.545 23.250 23.382 1.00 7.62 O ATOM 1023 N VAL A 131 25.290 19.872 22.431 1.00 6.27 N ATOM 1024 CA VAL A 131 26.437 19.255 21.773 1.00 5.68 C ATOM 1025 C VAL A 131 26.185 19.050 20.298 1.00 6.04 C ATOM 1026 O VAL A 131 25.226 18.381 19.915 1.00 6.08 O ATOM 1027 CB VAL A 131 26.784 17.879 22.435 1.00 6.57 C ATOM 1028 CG1 VAL A 131 28.101 17.334 21.890 1.00 7.67 C ATOM 1029 CG2 VAL A 131 26.889 18.044 23.964 1.00 7.37 C ATOM 1030 N ARG A 132 27.037 19.645 19.466 1.00 6.38 N ATOM 1031 CA ARG A 132 26.857 19.513 18.032 1.00 6.77 C ATOM 1032 C ARG A 132 26.843 18.043 17.632 1.00 7.62 C ATOM 1033 O ARG A 132 27.591 17.236 18.188 1.00 7.40 O ATOM 1034 CB ARG A 132 27.961 20.246 17.275 1.00 6.72 C ATOM 1035 CG ARG A 132 27.482 20.925 16.003 1.00 7.35 C ATOM 1036 CD ARG A 132 28.555 21.874 15.500 1.00 9.06 C ATOM 1037 NE ARG A 132 28.195 22.558 14.260 1.00 10.07 N ATOM 1038 CZ ARG A 132 28.353 22.052 13.041 1.00 11.70 C ATOM 1039 NH1 ARG A 132 28.865 20.837 12.876 1.00 12.04 N ATOM 1040 NH2 ARG A 132 28.031 22.772 11.978 1.00 10.42 N ATOM 1041 N GLN A 133 25.992 17.701 16.669 1.00 9.06 N ATOM 1042 CA GLN A 133 25.877 16.317 16.237 1.00 9.52 C ATOM 1043 C GLN A 133 27.141 15.856 15.535 1.00 10.37 C ATOM 1044 O GLN A 133 27.529 14.696 15.645 1.00 10.27 O ATOM 1045 CB GLN A 133 24.623 16.147 15.378 1.00 9.23 C ATOM 1046 CG GLN A 133 23.369 16.233 16.238 1.00 8.01 C ATOM 1047 CD GLN A 133 22.096 15.899 15.501 1.00 8.50 C ATOM 1048 OE1 GLN A 133 21.059 15.648 16.122 1.00 12.11 O ATOM 1049 NE2 GLN A 133 22.157 15.896 14.179 1.00 7.69 N ATOM 1050 N SER A 134 27.782 16.771 14.819 1.00 9.57 N ATOM 1051 CA SER A 134 29.058 16.507 14.168 1.00 11.15 C ATOM 1052 C SER A 134 30.020 17.646 14.477 1.00 10.26 C ATOM 1053 O SER A 134 29.567 18.762 14.711 1.00 10.91 O ATOM 1054 CB SER A 134 28.886 16.321 12.649 1.00 12.34 C ATOM 1055 OG SER A 134 28.231 17.420 12.045 1.00 18.85 O ATOM 1056 N LYS A 135 31.318 17.376 14.522 1.00 9.54 N ATOM 1057 CA LYS A 135 32.295 18.411 14.858 1.00 9.33 C ATOM 1058 C LYS A 135 32.237 19.571 13.898 1.00 10.25 C ATOM 1059 O LYS A 135 32.181 19.379 12.683 1.00 10.84 O ATOM 1060 CB LYS A 135 33.714 17.852 14.832 1.00 9.14 C ATOM 1061 CG LYS A 135 33.977 16.844 15.908 1.00 9.67 C ATOM 1062 CD LYS A 135 35.389 16.319 15.824 1.00 10.06 C ATOM 1063 CE LYS A 135 35.584 15.146 16.768 1.00 12.47 C ATOM 1064 NZ LYS A 135 37.030 14.851 16.970 1.00 14.56 N ATOM 1065 N ARG A 136 32.243 20.782 14.453 1.00 9.77 N ATOM 1066 CA ARG A 136 32.269 21.983 13.634 1.00 9.69 C ATOM 1067 C ARG A 136 33.678 22.218 13.104 1.00 9.26 C ATOM 1068 O ARG A 136 34.648 22.144 13.859 1.00 10.26 O ATOM 1069 CB ARG A 136 31.820 23.202 14.452 1.00 7.66 C ATOM 1070 CG ARG A 136 31.508 24.438 13.620 1.00 7.59 C ATOM 1071 CD ARG A 136 31.115 25.598 14.532 1.00 8.62 C ATOM 1072 NE ARG A 136 30.480 26.693 13.801 1.00 9.55 N ATOM 1073 CZ ARG A 136 29.682 27.601 14.356 1.00 9.03 C ATOM 1074 NH1 ARG A 136 29.412 27.556 15.656 1.00 7.92 N ATOM 1075 NH2 ARG A 136 29.153 28.559 13.608 1.00 9.73 N ATOM 1076 N PRO A 137 33.821 22.461 11.792 1.00 10.99 N ATOM 1077 CA PRO A 137 35.172 22.692 11.270 1.00 10.55 C ATOM 1078 C PRO A 137 35.805 23.881 11.994 1.00 11.07 C ATOM 1079 O PRO A 137 35.105 24.800 12.394 1.00 13.27 O ATOM 1080 CB PRO A 137 34.940 22.988 9.789 1.00 11.60 C ATOM 1081 CG PRO A 137 33.593 22.391 9.484 1.00 13.08 C ATOM 1082 CD PRO A 137 32.794 22.544 10.740 1.00 11.22 C ATOM 1083 N THR A 138 37.116 23.859 12.190 1.00 11.05 N ATOM 1084 CA THR A 138 37.777 24.973 12.857 1.00 11.98 C ATOM 1085 C THR A 138 38.639 25.765 11.872 1.00 12.26 C ATOM 1086 O THR A 138 38.795 25.371 10.713 1.00 14.10 O ATOM 1087 CB THR A 138 38.640 24.484 14.042 1.00 12.99 C ATOM 1088 OG1 THR A 138 39.513 23.435 13.608 1.00 12.86 O ATOM 1089 CG2 THR A 138 37.746 23.958 15.165 1.00 13.51 C ATOM 1090 N GLY A 139 39.180 26.891 12.325 1.00 12.21 N ATOM 1091 CA GLY A 139 40.006 27.704 11.454 1.00 11.42 C ATOM 1092 C GLY A 139 39.200 28.783 10.751 1.00 12.93 C ATOM 1093 O GLY A 139 39.746 29.602 10.014 1.00 15.08 O ATOM 1094 N SER A 140 37.892 28.780 10.974 1.00 11.69 N ATOM 1095 CA SER A 140 37.008 29.767 10.371 1.00 12.19 C ATOM 1096 C SER A 140 36.341 30.618 11.439 1.00 10.38 C ATOM 1097 O SER A 140 36.359 30.262 12.618 1.00 10.38 O ATOM 1098 CB SER A 140 35.910 29.068 9.565 1.00 14.19 C ATOM 1099 OG SER A 140 36.398 28.596 8.323 1.00 20.32 O ATOM 1100 N ASN A 141 35.778 31.751 11.027 1.00 9.38 N ATOM 1101 CA ASN A 141 35.043 32.613 11.944 1.00 10.36 C ATOM 1102 C ASN A 141 33.704 31.974 12.272 1.00 10.98 C ATOM 1103 O ASN A 141 32.845 31.853 11.397 1.00 11.95 O ATOM 1104 CB ASN A 141 34.805 33.986 11.311 1.00 10.38 C ATOM 1105 CG ASN A 141 36.078 34.775 11.147 1.00 12.48 C ATOM 1106 OD1 ASN A 141 37.056 34.558 11.866 1.00 11.03 O ATOM 1107 ND2 ASN A 141 36.080 35.695 10.193 1.00 15.20 N ATOM 1108 N ALA A 142 33.540 31.553 13.520 1.00 10.46 N ATOM 1109 CA ALA A 142 32.325 30.870 13.940 1.00 10.70 C ATOM 1110 C ALA A 142 31.511 31.722 14.895 1.00 10.18 C ATOM 1111 O ALA A 142 32.051 32.562 15.615 1.00 11.81 O ATOM 1112 CB ALA A 142 32.687 29.537 14.605 1.00 9.87 C ATOM 1113 N THR A 143 30.206 31.479 14.899 1.00 9.69 N ATOM 1114 CA THR A 143 29.288 32.197 15.762 1.00 9.87 C ATOM 1115 C THR A 143 28.416 31.240 16.564 1.00 9.46 C ATOM 1116 O THR A 143 27.991 30.194 16.075 1.00 8.91 O ATOM 1117 CB THR A 143 28.345 33.095 14.946 1.00 11.53 C ATOM 1118 OG1 THR A 143 29.115 34.046 14.205 1.00 16.00 O ATOM 1119 CG2 THR A 143 27.408 33.844 15.857 1.00 13.90 C ATOM 1120 N ILE A 144 28.199 31.598 17.819 1.00 8.23 N ATOM 1121 CA ILE A 144 27.313 30.863 18.690 1.00 8.50 C ATOM 1122 C ILE A 144 26.250 31.805 19.212 1.00 8.38 C ATOM 1123 O ILE A 144 26.542 32.672 20.035 1.00 9.36 O ATOM 1124 CB ILE A 144 28.038 30.234 19.909 1.00 8.13 C ATOM 1125 CG1 ILE A 144 28.955 29.094 19.458 1.00 9.43 C ATOM 1126 CG2 ILE A 144 27.001 29.692 20.900 1.00 9.26 C ATOM 1127 CD1 ILE A 144 29.742 28.452 20.589 1.00 8.86 C ATOM 1128 N THR A 145 25.051 31.700 18.659 1.00 8.17 N ATOM 1129 CA THR A 145 23.937 32.526 19.100 1.00 8.41 C ATOM 1130 C THR A 145 23.311 31.893 20.334 1.00 9.28 C ATOM 1131 O THR A 145 22.392 31.075 20.248 1.00 9.08 O ATOM 1132 CB THR A 145 22.911 32.685 17.952 1.00 8.45 C ATOM 1133 OG1 THR A 145 23.592 33.129 16.766 1.00 10.45 O ATOM 1134 CG2 THR A 145 21.834 33.696 18.323 1.00 9.47 C ATOM 1135 N PHE A 146 23.853 32.273 21.487 1.00 8.98 N ATOM 1136 CA PHE A 146 23.476 31.694 22.771 1.00 8.71 C ATOM 1137 C PHE A 146 21.977 31.763 23.065 1.00 9.95 C ATOM 1138 O PHE A 146 21.462 30.838 23.702 1.00 9.80 O ATOM 1139 CB PHE A 146 24.274 32.339 23.902 1.00 8.87 C ATOM 1140 CG PHE A 146 24.216 31.572 25.191 1.00 8.52 C ATOM 1141 CD1 PHE A 146 24.347 30.180 25.202 1.00 8.21 C ATOM 1142 CD2 PHE A 146 24.017 32.235 26.396 1.00 9.41 C ATOM 1143 CE1 PHE A 146 24.280 29.471 26.399 1.00 9.85 C ATOM 1144 CE2 PHE A 146 23.948 31.534 27.599 1.00 9.68 C ATOM 1145 CZ PHE A 146 24.079 30.149 27.600 1.00 9.14 C ATOM 1146 N THR A 147 21.269 32.811 22.633 1.00 9.42 N ATOM 1147 CA THR A 147 19.834 32.897 22.937 1.00 12.02 C ATOM 1148 C THR A 147 19.068 31.698 22.388 1.00 10.57 C ATOM 1149 O THR A 147 18.084 31.271 22.991 1.00 11.40 O ATOM 1150 CB THR A 147 19.162 34.194 22.387 1.00 14.34 C ATOM 1151 OG1 THR A 147 19.332 34.272 20.967 1.00 19.31 O ATOM 1152 CG2 THR A 147 19.749 35.415 23.045 1.00 17.33 C ATOM 1153 N ASN A 148 19.506 31.168 21.245 1.00 10.77 N ATOM 1154 CA ASN A 148 18.854 30.006 20.641 1.00 10.41 C ATOM 1155 C ASN A 148 18.920 28.804 21.570 1.00 9.79 C ATOM 1156 O ASN A 148 17.956 28.060 21.704 1.00 10.49 O ATOM 1157 CB ASN A 148 19.512 29.646 19.309 1.00 11.72 C ATOM 1158 CG ASN A 148 19.140 30.604 18.195 1.00 14.86 C ATOM 1159 OD1 ASN A 148 19.816 30.664 17.165 1.00 17.07 O ATOM 1160 ND2 ASN A 148 18.067 31.358 18.391 1.00 14.50 N ATOM 1161 N HIS A 149 20.067 28.624 22.211 1.00 9.14 N ATOM 1162 CA HIS A 149 20.246 27.515 23.135 1.00 9.00 C ATOM 1163 C HIS A 149 19.465 27.741 24.412 1.00 9.62 C ATOM 1164 O HIS A 149 18.784 26.839 24.890 1.00 10.38 O ATOM 1165 CB HIS A 149 21.730 27.322 23.428 1.00 7.74 C ATOM 1166 CG HIS A 149 22.518 26.941 22.219 1.00 9.35 C ATOM 1167 ND1 HIS A 149 22.701 25.630 21.829 1.00 9.00 N ATOM 1168 CD2 HIS A 149 23.132 27.700 21.277 1.00 8.74 C ATOM 1169 CE1 HIS A 149 23.395 25.599 20.707 1.00 9.76 C ATOM 1170 NE2 HIS A 149 23.669 26.839 20.352 1.00 9.15 N ATOM 1171 N VAL A 150 19.549 28.952 24.957 1.00 9.40 N ATOM 1172 CA VAL A 150 18.825 29.278 26.178 1.00 9.23 C ATOM 1173 C VAL A 150 17.326 29.047 26.010 1.00 9.51 C ATOM 1174 O VAL A 150 16.669 28.485 26.891 1.00 10.04 O ATOM 1175 CB VAL A 150 19.069 30.747 26.590 1.00 8.99 C ATOM 1176 CG1 VAL A 150 18.209 31.115 27.800 1.00 10.52 C ATOM 1177 CG2 VAL A 150 20.542 30.941 26.910 1.00 8.36 C ATOM 1178 N ASN A 151 16.788 29.478 24.877 1.00 10.03 N ATOM 1179 CA ASN A 151 15.366 29.319 24.613 1.00 12.93 C ATOM 1180 C ASN A 151 14.992 27.844 24.436 1.00 12.35 C ATOM 1181 O ASN A 151 13.948 27.399 24.926 1.00 12.52 O ATOM 1182 CB ASN A 151 14.972 30.138 23.382 1.00 16.27 C ATOM 1183 CG ASN A 151 14.942 31.637 23.671 1.00 21.13 C ATOM 1184 OD1 ASN A 151 14.957 32.053 24.832 1.00 25.39 O ATOM 1185 ND2 ASN A 151 14.901 32.451 22.617 1.00 23.22 N ATOM 1186 N ALA A 152 15.838 27.091 23.739 1.00 11.75 N ATOM 1187 CA ALA A 152 15.579 25.671 23.548 1.00 10.78 C ATOM 1188 C ALA A 152 15.624 24.937 24.881 1.00 10.25 C ATOM 1189 O ALA A 152 14.771 24.094 25.164 1.00 11.28 O ATOM 1190 CB ALA A 152 16.591 25.072 22.588 1.00 11.38 C ATOM 1191 N TRP A 153 16.617 25.261 25.701 1.00 9.02 N ATOM 1192 CA TRP A 153 16.747 24.631 27.014 1.00 9.67 C ATOM 1193 C TRP A 153 15.525 24.916 27.871 1.00 11.42 C ATOM 1194 O TRP A 153 15.044 24.058 28.616 1.00 11.84 O ATOM 1195 CB TRP A 153 17.984 25.153 27.742 1.00 9.38 C ATOM 1196 CG TRP A 153 19.285 24.760 27.120 1.00 8.43 C ATOM 1197 CD1 TRP A 153 19.477 23.863 26.107 1.00 7.49 C ATOM 1198 CD2 TRP A 153 20.585 25.255 27.472 1.00 8.49 C ATOM 1199 NE1 TRP A 153 20.815 23.769 25.809 1.00 7.78 N ATOM 1200 CE2 TRP A 153 21.518 24.611 26.631 1.00 8.29 C ATOM 1201 CE3 TRP A 153 21.051 26.180 28.418 1.00 7.02 C ATOM 1202 CZ2 TRP A 153 22.896 24.862 26.706 1.00 7.54 C ATOM 1203 CZ3 TRP A 153 22.423 26.429 28.493 1.00 7.78 C ATOM 1204 CH2 TRP A 153 23.327 25.771 27.641 1.00 8.22 C ATOM 1205 N LYS A 154 15.039 26.144 27.767 1.00 12.47 N ATOM 1206 CA LYS A 154 13.876 26.570 28.521 1.00 14.57 C ATOM 1207 C LYS A 154 12.658 25.715 28.189 1.00 14.45 C ATOM 1208 O LYS A 154 11.923 25.316 29.092 1.00 14.38 O ATOM 1209 CB LYS A 154 13.573 28.030 28.207 1.00 18.27 C ATOM 1210 CG LYS A 154 12.741 28.743 29.243 1.00 24.74 C ATOM 1211 CD LYS A 154 12.986 30.260 29.258 1.00 30.16 C ATOM 1212 CE LYS A 154 13.810 30.775 28.067 1.00 34.64 C ATOM 1213 NZ LYS A 154 12.969 31.280 26.927 1.00 39.94 N ATOM 1214 N SER A 155 12.452 25.401 26.913 1.00 14.56 N ATOM 1215 CA SER A 155 11.275 24.616 26.550 1.00 16.54 C ATOM 1216 C SER A 155 11.379 23.178 27.054 1.00 17.48 C ATOM 1217 O SER A 155 10.401 22.448 27.007 1.00 18.82 O ATOM 1218 CB SER A 155 11.049 24.607 25.048 1.00 18.75 C ATOM 1219 OG SER A 155 12.132 24.024 24.394 1.00 21.81 O ATOM 1220 N HIS A 156 12.552 22.766 27.532 1.00 17.07 N ATOM 1221 CA HIS A 156 12.716 21.416 28.079 1.00 16.76 C ATOM 1222 C HIS A 156 12.828 21.448 29.591 1.00 17.36 C ATOM 1223 O HIS A 156 13.318 20.503 30.209 1.00 19.21 O ATOM 1224 CB HIS A 156 13.945 20.735 27.488 1.00 16.68 C ATOM 1225 CG HIS A 156 13.771 20.355 26.061 1.00 17.11 C ATOM 1226 ND1 HIS A 156 14.445 20.983 25.036 1.00 18.87 N ATOM 1227 CD2 HIS A 156 12.947 19.455 25.469 1.00 17.02 C ATOM 1228 CE1 HIS A 156 14.044 20.490 23.880 1.00 18.27 C ATOM 1229 NE2 HIS A 156 13.136 19.564 24.115 1.00 18.68 N ATOM 1230 N GLY A 157 12.366 22.542 30.183 1.00 16.13 N ATOM 1231 CA GLY A 157 12.420 22.673 31.623 1.00 15.65 C ATOM 1232 C GLY A 157 13.815 22.928 32.156 1.00 14.72 C ATOM 1233 O GLY A 157 14.041 22.810 33.351 1.00 16.68 O ATOM 1234 N MET A 158 14.754 23.268 31.276 1.00 12.91 N ATOM 1235 CA MET A 158 16.121 23.553 31.694 1.00 12.20 C ATOM 1236 C MET A 158 16.324 25.057 31.873 1.00 12.47 C ATOM 1237 O MET A 158 16.762 25.756 30.957 1.00 12.48 O ATOM 1238 CB MET A 158 17.118 23.010 30.662 1.00 11.53 C ATOM 1239 CG MET A 158 17.208 21.490 30.606 1.00 11.78 C ATOM 1240 SD MET A 158 17.817 20.926 29.011 1.00 12.81 S ATOM 1241 CE MET A 158 19.527 21.385 29.123 1.00 10.61 C ATOM 1242 N ASN A 159 16.002 25.545 33.063 1.00 12.96 N ATOM 1243 CA ASN A 159 16.112 26.965 33.351 1.00 14.02 C ATOM 1244 C ASN A 159 17.402 27.292 34.091 1.00 13.26 C ATOM 1245 O ASN A 159 17.789 26.606 35.040 1.00 13.38 O ATOM 1246 CB ASN A 159 14.893 27.408 34.156 1.00 17.33 C ATOM 1247 CG ASN A 159 13.592 27.094 33.446 1.00 18.34 C ATOM 1248 OD1 ASN A 159 12.821 26.240 33.881 1.00 24.41 O ATOM 1249 ND2 ASN A 159 13.345 27.781 32.342 1.00 20.59 N ATOM 1250 N LEU A 160 18.056 28.360 33.651 1.00 12.62 N ATOM 1251 CA LEU A 160 19.316 28.788 34.241 1.00 14.52 C ATOM 1252 C LEU A 160 19.087 29.590 35.530 1.00 15.24 C ATOM 1253 O LEU A 160 17.973 30.037 35.796 1.00 16.90 O ATOM 1254 CB LEU A 160 20.094 29.615 33.212 1.00 12.85 C ATOM 1255 CG LEU A 160 20.622 28.762 32.054 1.00 11.97 C ATOM 1256 CD1 LEU A 160 20.975 29.642 30.883 1.00 14.47 C ATOM 1257 CD2 LEU A 160 21.835 27.985 32.506 1.00 11.73 C ATOM 1258 N GLY A 161 20.141 29.756 36.328 1.00 15.49 N ATOM 1259 CA GLY A 161 20.035 30.509 37.569 1.00 17.59 C ATOM 1260 C GLY A 161 19.861 31.999 37.329 1.00 18.95 C ATOM 1261 O GLY A 161 19.964 32.467 36.198 1.00 18.23 O ATOM 1262 N SER A 162 19.622 32.756 38.397 1.00 20.96 N ATOM 1263 CA SER A 162 19.400 34.201 38.278 1.00 22.42 C ATOM 1264 C SER A 162 20.695 35.006 38.417 1.00 21.95 C ATOM 1265 O SER A 162 20.768 36.147 37.961 1.00 23.95 O ATOM 1266 CB SER A 162 18.389 34.670 39.330 1.00 23.72 C ATOM 1267 OG SER A 162 18.537 34.026 40.574 1.00 27.53 O ATOM 1268 N ASN A 163 21.690 34.447 39.098 1.00 20.10 N ATOM 1269 CA ASN A 163 22.962 35.137 39.255 1.00 18.95 C ATOM 1270 C ASN A 163 23.959 34.610 38.239 1.00 17.31 C ATOM 1271 O ASN A 163 24.426 33.483 38.350 1.00 16.54 O ATOM 1272 CB ASN A 163 23.490 34.955 40.690 1.00 24.19 C ATOM 1273 CG ASN A 163 24.944 35.391 40.851 1.00 29.70 C ATOM 1274 OD1 ASN A 163 25.852 34.785 40.274 1.00 34.43 O ATOM 1275 ND2 ASN A 163 25.171 36.433 41.640 1.00 32.58 N ATOM 1276 N TRP A 164 24.276 35.424 37.241 1.00 14.19 N ATOM 1277 CA TRP A 164 25.178 34.999 36.182 1.00 12.73 C ATOM 1278 C TRP A 164 26.643 35.215 36.536 1.00 12.96 C ATOM 1279 O TRP A 164 27.053 36.306 36.939 1.00 14.00 O ATOM 1280 CB TRP A 164 24.865 35.756 34.891 1.00 12.31 C ATOM 1281 CG TRP A 164 23.619 35.298 34.247 1.00 12.67 C ATOM 1282 CD1 TRP A 164 22.346 35.569 34.645 1.00 13.71 C ATOM 1283 CD2 TRP A 164 23.516 34.446 33.102 1.00 12.38 C ATOM 1284 NE1 TRP A 164 21.449 34.935 33.819 1.00 16.11 N ATOM 1285 CE2 TRP A 164 22.140 34.238 32.862 1.00 13.41 C ATOM 1286 CE3 TRP A 164 24.449 33.836 32.256 1.00 11.34 C ATOM 1287 CZ2 TRP A 164 21.675 33.445 31.808 1.00 12.72 C ATOM 1288 CZ3 TRP A 164 23.988 33.050 31.214 1.00 10.91 C ATOM 1289 CH2 TRP A 164 22.614 32.862 30.998 1.00 10.51 C ATOM 1290 N ALA A 165 27.428 34.156 36.365 1.00 11.28 N ATOM 1291 CA ALA A 165 28.866 34.205 36.584 1.00 9.58 C ATOM 1292 C ALA A 165 29.580 34.367 35.249 1.00 9.48 C ATOM 1293 O ALA A 165 28.954 34.811 34.288 1.00 10.36 O ATOM 1294 CB ALA A 165 29.344 32.955 37.292 1.00 10.62 C ATOM 1295 N TYR A 166 30.849 33.987 35.149 1.00 8.30 N ATOM 1296 CA TYR A 166 31.556 34.197 33.889 1.00 8.39 C ATOM 1297 C TYR A 166 31.006 33.327 32.756 1.00 8.59 C ATOM 1298 O TYR A 166 30.273 32.356 32.956 1.00 9.53 O ATOM 1299 CB TYR A 166 33.058 33.973 34.058 1.00 8.48 C ATOM 1300 CG TYR A 166 33.440 32.581 34.481 1.00 10.78 C ATOM 1301 CD1 TYR A 166 33.499 31.541 33.551 1.00 10.67 C ATOM 1302 CD2 TYR A 166 33.766 32.306 35.806 1.00 11.36 C ATOM 1303 CE1 TYR A 166 33.874 30.263 33.929 1.00 12.06 C ATOM 1304 CE2 TYR A 166 34.144 31.028 36.201 1.00 12.58 C ATOM 1305 CZ TYR A 166 34.196 30.014 35.253 1.00 12.81 C ATOM 1306 OH TYR A 166 34.570 28.753 35.631 1.00 14.02 O ATOM 1307 N GLN A 167 31.375 33.732 31.552 1.00 8.06 N ATOM 1308 CA GLN A 167 30.979 33.102 30.309 1.00 7.81 C ATOM 1309 C GLN A 167 32.138 33.174 29.329 1.00 9.00 C ATOM 1310 O GLN A 167 32.529 34.265 28.915 1.00 8.81 O ATOM 1311 CB GLN A 167 29.749 33.847 29.777 1.00 9.05 C ATOM 1312 CG GLN A 167 29.117 33.339 28.490 1.00 10.78 C ATOM 1313 CD GLN A 167 27.856 34.132 28.150 1.00 12.36 C ATOM 1314 OE1 GLN A 167 27.911 35.348 27.982 1.00 11.54 O ATOM 1315 NE2 GLN A 167 26.720 33.450 28.066 1.00 11.81 N ATOM 1316 N VAL A 168 32.709 32.032 28.960 1.00 7.55 N ATOM 1317 CA VAL A 168 33.878 32.080 28.091 1.00 7.42 C ATOM 1318 C VAL A 168 33.867 30.988 27.020 1.00 8.04 C ATOM 1319 O VAL A 168 33.168 29.988 27.135 1.00 9.19 O ATOM 1320 CB VAL A 168 35.169 31.869 28.928 1.00 8.25 C ATOM 1321 CG1 VAL A 168 35.232 32.875 30.080 1.00 7.79 C ATOM 1322 CG2 VAL A 168 35.197 30.429 29.485 1.00 8.98 C ATOM 1323 N MET A 169 34.629 31.226 25.956 1.00 6.80 N ATOM 1324 CA MET A 169 34.857 30.211 24.929 1.00 7.59 C ATOM 1325 C MET A 169 36.087 29.436 25.347 1.00 7.63 C ATOM 1326 O MET A 169 37.209 29.945 25.251 1.00 8.07 O ATOM 1327 CB MET A 169 35.097 30.850 23.566 1.00 7.08 C ATOM 1328 CG MET A 169 35.009 29.859 22.426 1.00 9.20 C ATOM 1329 SD MET A 169 33.369 29.139 22.308 1.00 10.97 S ATOM 1330 CE MET A 169 33.731 27.700 21.329 1.00 9.95 C ATOM 1331 N ALA A 170 35.893 28.217 25.832 1.00 8.27 N ATOM 1332 CA ALA A 170 37.018 27.536 26.437 1.00 8.01 C ATOM 1333 C ALA A 170 37.435 26.251 25.756 1.00 7.54 C ATOM 1334 O ALA A 170 36.811 25.691 24.856 1.00 7.92 O ATOM 1335 CB ALA A 170 36.675 27.230 27.886 1.00 10.76 C ATOM 1336 N THR A 171 38.582 25.840 26.262 1.00 8.34 N ATOM 1337 CA THR A 171 39.222 24.588 25.975 1.00 8.30 C ATOM 1338 C THR A 171 39.270 23.792 27.263 1.00 9.99 C ATOM 1339 O THR A 171 39.902 24.226 28.232 1.00 9.44 O ATOM 1340 CB THR A 171 40.670 24.763 25.511 1.00 9.39 C ATOM 1341 OG1 THR A 171 40.695 25.463 24.264 1.00 9.57 O ATOM 1342 CG2 THR A 171 41.336 23.391 25.333 1.00 9.38 C ATOM 1343 N GLU A 172 38.528 22.695 27.317 1.00 10.16 N ATOM 1344 CA GLU A 172 38.529 21.861 28.508 1.00 11.05 C ATOM 1345 C GLU A 172 39.126 20.504 28.198 1.00 11.45 C ATOM 1346 O GLU A 172 38.842 19.928 27.156 1.00 10.81 O ATOM 1347 CB GLU A 172 37.113 21.669 29.058 1.00 13.36 C ATOM 1348 CG GLU A 172 37.072 20.616 30.167 1.00 18.25 C ATOM 1349 CD GLU A 172 35.789 20.615 30.971 1.00 20.72 C ATOM 1350 OE1 GLU A 172 34.785 21.181 30.503 1.00 20.95 O ATOM 1351 OE2 GLU A 172 35.791 20.037 32.081 1.00 25.57 O ATOM 1352 N GLY A 173 39.957 19.997 29.094 1.00 11.19 N ATOM 1353 CA GLY A 173 40.558 18.707 28.848 1.00 11.33 C ATOM 1354 C GLY A 173 40.474 17.834 30.073 1.00 12.00 C ATOM 1355 O GLY A 173 40.380 18.325 31.197 1.00 12.64 O ATOM 1356 N TYR A 174 40.489 16.530 29.852 1.00 12.29 N ATOM 1357 CA TYR A 174 40.443 15.584 30.946 1.00 13.57 C ATOM 1358 C TYR A 174 41.380 14.419 30.678 1.00 12.69 C ATOM 1359 O TYR A 174 41.181 13.673 29.721 1.00 12.51 O ATOM 1360 CB TYR A 174 39.022 15.064 31.156 1.00 17.83 C ATOM 1361 CG TYR A 174 38.927 14.175 32.368 1.00 22.73 C ATOM 1362 CD1 TYR A 174 39.401 14.610 33.607 1.00 25.44 C ATOM 1363 CD2 TYR A 174 38.425 12.879 32.272 1.00 26.13 C ATOM 1364 CE1 TYR A 174 39.382 13.775 34.725 1.00 28.92 C ATOM 1365 CE2 TYR A 174 38.400 12.032 33.384 1.00 27.56 C ATOM 1366 CZ TYR A 174 38.882 12.487 34.607 1.00 29.09 C ATOM 1367 OH TYR A 174 38.871 11.658 35.710 1.00 32.02 O ATOM 1368 N GLN A 175 42.406 14.292 31.517 1.00 12.47 N ATOM 1369 CA GLN A 175 43.409 13.239 31.387 1.00 13.87 C ATOM 1370 C GLN A 175 43.810 13.036 29.925 1.00 13.56 C ATOM 1371 O GLN A 175 43.652 11.953 29.358 1.00 13.62 O ATOM 1372 CB GLN A 175 42.875 11.938 32.008 1.00 16.75 C ATOM 1373 CG GLN A 175 42.424 12.119 33.461 1.00 19.51 C ATOM 1374 CD GLN A 175 42.367 10.818 34.256 1.00 24.95 C ATOM 1375 OE1 GLN A 175 42.509 10.818 35.485 1.00 27.70 O ATOM 1376 NE2 GLN A 175 42.151 9.705 33.562 1.00 26.39 N ATOM 1377 N SER A 176 44.337 14.094 29.314 1.00 12.21 N ATOM 1378 CA SER A 176 44.735 14.041 27.917 1.00 10.70 C ATOM 1379 C SER A 176 45.878 15.010 27.623 1.00 9.61 C ATOM 1380 O SER A 176 46.465 15.600 28.530 1.00 10.16 O ATOM 1381 CB SER A 176 43.538 14.400 27.035 1.00 13.22 C ATOM 1382 OG SER A 176 43.107 15.732 27.278 1.00 11.86 O ATOM 1383 N SER A 177 46.180 15.141 26.337 1.00 9.33 N ATOM 1384 CA SER A 177 47.207 16.040 25.834 1.00 8.71 C ATOM 1385 C SER A 177 46.725 16.713 24.573 1.00 9.15 C ATOM 1386 O SER A 177 45.800 16.227 23.933 1.00 9.50 O ATOM 1387 CB SER A 177 48.493 15.289 25.509 1.00 10.21 C ATOM 1388 OG SER A 177 48.982 14.618 26.649 1.00 13.98 O ATOM 1389 N GLY A 178 47.335 17.828 24.203 1.00 8.76 N ATOM 1390 CA GLY A 178 46.895 18.482 22.990 1.00 9.01 C ATOM 1391 C GLY A 178 47.268 19.938 22.928 1.00 9.33 C ATOM 1392 O GLY A 178 48.009 20.446 23.768 1.00 9.03 O ATOM 1393 N SER A 179 46.740 20.609 21.914 1.00 10.38 N ATOM 1394 CA SER A 179 47.010 22.021 21.706 1.00 12.48 C ATOM 1395 C SER A 179 45.804 22.726 21.129 1.00 11.58 C ATOM 1396 O SER A 179 44.995 22.134 20.420 1.00 12.02 O ATOM 1397 CB SER A 179 48.174 22.203 20.730 1.00 14.28 C ATOM 1398 OG SER A 179 49.415 22.115 21.404 1.00 23.75 O ATOM 1399 N SER A 180 45.683 24.000 21.459 1.00 11.33 N ATOM 1400 CA SER A 180 44.625 24.820 20.926 1.00 10.68 C ATOM 1401 C SER A 180 45.030 26.276 20.937 1.00 10.81 C ATOM 1402 O SER A 180 45.839 26.716 21.754 1.00 11.14 O ATOM 1403 CB SER A 180 43.330 24.643 21.718 1.00 11.95 C ATOM 1404 OG SER A 180 43.366 25.395 22.912 1.00 15.30 O ATOM 1405 N ASN A 181 44.495 26.992 19.966 1.00 10.46 N ATOM 1406 CA ASN A 181 44.689 28.416 19.804 1.00 9.47 C ATOM 1407 C ASN A 181 43.375 29.020 19.385 1.00 8.87 C ATOM 1408 O ASN A 181 42.864 28.699 18.314 1.00 9.32 O ATOM 1409 CB ASN A 181 45.769 28.697 18.758 1.00 9.86 C ATOM 1410 CG ASN A 181 46.255 30.131 18.800 1.00 11.68 C ATOM 1411 OD1 ASN A 181 45.469 31.057 18.654 1.00 12.18 O ATOM 1412 ND2 ASN A 181 47.553 30.317 19.010 1.00 11.33 N ATOM 1413 N VAL A 182 42.809 29.852 20.246 1.00 8.77 N ATOM 1414 CA VAL A 182 41.491 30.399 19.984 1.00 8.50 C ATOM 1415 C VAL A 182 41.437 31.905 20.205 1.00 9.61 C ATOM 1416 O VAL A 182 42.067 32.446 21.116 1.00 8.94 O ATOM 1417 CB VAL A 182 40.447 29.744 20.927 1.00 9.86 C ATOM 1418 CG1 VAL A 182 39.036 30.139 20.518 1.00 10.35 C ATOM 1419 CG2 VAL A 182 40.608 28.220 20.908 1.00 10.60 C ATOM 1420 N THR A 183 40.659 32.558 19.350 1.00 8.98 N ATOM 1421 CA THR A 183 40.421 33.992 19.431 1.00 8.61 C ATOM 1422 C THR A 183 38.941 34.245 19.630 1.00 8.24 C ATOM 1423 O THR A 183 38.113 33.750 18.868 1.00 9.06 O ATOM 1424 CB THR A 183 40.930 34.697 18.156 1.00 9.43 C ATOM 1425 OG1 THR A 183 42.332 34.434 18.010 1.00 10.42 O ATOM 1426 CG2 THR A 183 40.702 36.202 18.235 1.00 9.47 C ATOM 1427 N VAL A 184 38.609 34.998 20.667 1.00 7.48 N ATOM 1428 CA VAL A 184 37.223 35.252 21.010 1.00 9.17 C ATOM 1429 C VAL A 184 36.881 36.731 20.929 1.00 9.76 C ATOM 1430 O VAL A 184 37.689 37.584 21.294 1.00 10.29 O ATOM 1431 CB VAL A 184 36.952 34.788 22.458 1.00 8.59 C ATOM 1432 CG1 VAL A 184 35.463 34.800 22.746 1.00 9.95 C ATOM 1433 CG2 VAL A 184 37.559 33.405 22.678 1.00 9.81 C ATOM 1434 N TRP A 185 35.668 37.016 20.469 1.00 9.64 N ATOM 1435 CA TRP A 185 35.175 38.384 20.383 1.00 11.14 C ATOM 1436 C TRP A 185 33.639 38.421 20.340 1.00 12.62 C ATOM 1437 O TRP A 185 33.001 37.343 20.354 1.00 13.20 O ATOM 1438 CB TRP A 185 35.786 39.109 19.169 1.00 10.40 C ATOM 1439 CG TRP A 185 35.287 38.672 17.825 1.00 10.44 C ATOM 1440 CD1 TRP A 185 34.308 39.266 17.080 1.00 11.88 C ATOM 1441 CD2 TRP A 185 35.807 37.599 17.020 1.00 12.34 C ATOM 1442 NE1 TRP A 185 34.192 38.638 15.861 1.00 12.22 N ATOM 1443 CE2 TRP A 185 35.097 37.610 15.796 1.00 12.41 C ATOM 1444 CE3 TRP A 185 36.807 36.631 17.213 1.00 12.62 C ATOM 1445 CZ2 TRP A 185 35.354 36.683 14.764 1.00 13.02 C ATOM 1446 CZ3 TRP A 185 37.064 35.710 16.183 1.00 12.54 C ATOM 1447 CH2 TRP A 185 36.338 35.747 14.977 1.00 11.32 C ATOM 1448 OXT TRP A 185 33.073 39.529 20.319 1.00 14.45 O TER 1449 TRP A 185 HETATM 1450 O HOH A 200 25.410 27.553 18.203 1.00 10.35 O HETATM 1451 O HOH A 201 37.013 28.128 14.222 1.00 9.44 O HETATM 1452 O HOH A 202 24.108 39.379 20.994 1.00 12.62 O HETATM 1453 O HOH A 203 23.544 12.457 17.835 1.00 10.96 O HETATM 1454 O HOH A 204 20.638 36.801 19.561 1.00 15.32 O HETATM 1455 O HOH A 205 26.767 39.907 21.978 1.00 13.23 O HETATM 1456 O HOH A 206 27.474 32.604 32.751 1.00 9.33 O HETATM 1457 O HOH A 207 27.103 25.217 14.526 1.00 9.62 O HETATM 1458 O HOH A 208 26.349 12.423 17.097 1.00 13.87 O HETATM 1459 O HOH A 209 36.549 20.299 14.602 1.00 15.51 O HETATM 1460 O HOH A 210 36.682 14.616 23.898 1.00 12.45 O HETATM 1461 O HOH A 211 34.926 26.213 14.934 1.00 11.93 O HETATM 1462 O HOH A 212 21.713 11.259 21.921 1.00 13.24 O HETATM 1463 O HOH A 213 50.063 13.845 17.524 1.00 15.15 O HETATM 1464 O HOH A 214 17.419 28.135 29.752 1.00 13.40 O HETATM 1465 O HOH A 215 18.311 14.852 14.995 1.00 14.79 O HETATM 1466 O HOH A 216 22.312 35.208 21.240 1.00 15.19 O HETATM 1467 O HOH A 217 23.504 16.962 12.066 1.00 22.11 O HETATM 1468 O HOH A 218 38.429 35.968 7.909 1.00 20.03 O HETATM 1469 O HOH A 219 16.797 30.046 31.510 1.00 19.14 O HETATM 1470 O HOH A 220 42.059 11.195 26.767 1.00 21.97 O HETATM 1471 O HOH A 221 29.542 40.560 23.429 1.00 23.89 O HETATM 1472 O HOH A 222 22.294 22.413 40.428 1.00 21.10 O HETATM 1473 O HOH A 223 32.120 14.606 13.721 1.00 19.18 O HETATM 1474 O HOH A 224 24.708 14.232 46.125 1.00 19.04 O HETATM 1475 O HOH A 225 32.448 19.860 36.248 1.00 21.07 O HETATM 1476 O HOH A 226 15.895 28.003 20.023 1.00 21.84 O HETATM 1477 O HOH A 227 45.013 19.383 35.032 1.00 18.84 O HETATM 1478 O HOH A 228 41.868 24.831 13.169 1.00 22.54 O HETATM 1479 O HOH A 229 27.472 10.258 20.556 1.00 22.97 O HETATM 1480 O HOH A 231 43.867 35.811 16.221 1.00 21.58 O HETATM 1481 O HOH A 232 31.325 41.238 31.544 1.00 22.01 O HETATM 1482 O HOH A 233 28.082 25.811 11.404 1.00 24.09 O HETATM 1483 O HOH A 234 29.619 12.912 15.035 1.00 26.23 O HETATM 1484 O HOH A 235 20.080 14.559 12.861 1.00 20.33 O HETATM 1485 O HOH A 236 25.602 19.471 12.938 1.00 25.96 O HETATM 1486 O HOH A 237 30.525 38.931 21.366 1.00 20.37 O HETATM 1487 O HOH A 238 32.334 9.563 21.564 1.00 26.26 O HETATM 1488 O HOH A 239 40.234 38.028 34.299 1.00 35.84 O HETATM 1489 O HOH A 240 44.037 22.677 14.034 1.00 24.86 O HETATM 1490 O HOH A 241 49.491 28.112 19.248 1.00 27.40 O HETATM 1491 O HOH A 242 48.352 33.231 18.958 1.00 24.08 O HETATM 1492 O HOH A 243 22.260 25.657 43.861 1.00 44.99 O HETATM 1493 O HOH A 244 29.764 9.667 22.977 1.00 33.11 O HETATM 1494 O HOH A 245 21.130 30.683 13.687 1.00 37.94 O HETATM 1495 O HOH A 246 39.389 41.382 23.989 1.00 29.34 O HETATM 1496 O HOH A 247 24.472 12.369 35.115 1.00 28.46 O HETATM 1497 O HOH A 248 28.666 14.839 29.217 1.00 28.53 O HETATM 1498 O HOH A 249 19.533 9.605 26.602 1.00 25.84 O HETATM 1499 O HOH A 250 32.518 15.747 30.667 1.00 27.69 O HETATM 1500 O HOH A 251 43.354 31.756 16.936 1.00 27.47 O HETATM 1501 O HOH A 252 32.519 36.131 37.312 1.00 39.77 O HETATM 1502 O HOH A 253 39.415 35.905 12.508 1.00 25.74 O HETATM 1503 O HOH A 254 15.652 24.495 16.475 1.00 31.63 O HETATM 1504 O HOH A 255 48.810 26.187 20.995 1.00 28.29 O HETATM 1505 O HOH A 256 27.058 19.191 48.555 1.00 36.56 O HETATM 1506 O HOH A 257 35.777 27.702 48.789 1.00 33.06 O HETATM 1507 O HOH A 258 35.625 28.161 38.112 1.00 41.42 O HETATM 1508 O HOH A 260 47.830 12.244 27.573 1.00 39.28 O HETATM 1509 O HOH A 261 28.470 31.089 12.141 1.00 27.97 O HETATM 1510 O HOH A 262 49.086 11.941 24.061 1.00 29.59 O HETATM 1511 O HOH A 263 32.561 18.240 32.519 1.00 30.42 O HETATM 1512 O HOH A 264 16.721 27.830 17.134 1.00 33.97 O HETATM 1513 O HOH A 265 23.717 28.857 44.024 1.00 37.07 O HETATM 1514 O HOH A 266 53.643 12.549 27.259 1.00 56.83 O HETATM 1515 O HOH A 267 48.170 21.405 35.764 1.00 23.51 O HETATM 1516 O HOH A 268 30.142 13.152 39.245 1.00 32.69 O HETATM 1517 O HOH A 269 34.339 21.193 34.348 1.00 26.01 O HETATM 1518 O HOH A 270 53.469 15.485 31.086 1.00 32.37 O HETATM 1519 O HOH A 271 47.503 26.677 33.920 1.00 35.00 O HETATM 1520 O HOH A 272 39.142 16.919 16.757 1.00 28.72 O HETATM 1521 O HOH A 273 23.348 38.287 37.316 1.00 25.47 O HETATM 1522 O HOH A 274 47.129 33.443 16.493 1.00 43.23 O HETATM 1523 O HOH A 275 38.350 21.381 10.889 1.00 38.32 O HETATM 1524 O HOH A 276 39.212 20.662 13.820 1.00 25.53 O HETATM 1525 O HOH A 277 49.996 28.079 32.524 1.00 40.05 O HETATM 1526 O HOH A 278 13.518 17.994 19.290 1.00 35.39 O HETATM 1527 O HOH A 279 44.025 26.688 38.970 1.00 38.55 O HETATM 1528 O HOH A 280 23.307 38.889 32.723 1.00 28.20 O HETATM 1529 O HOH A 281 40.571 10.853 29.163 1.00 47.42 O HETATM 1530 O HOH A 282 29.433 15.019 33.326 1.00 29.65 O HETATM 1531 O HOH A 283 18.276 33.689 33.887 1.00 57.48 O HETATM 1532 O HOH A 284 19.876 14.144 33.969 1.00 45.51 O HETATM 1533 O HOH A 285 17.601 34.226 25.832 1.00 34.96 O HETATM 1534 O HOH A 286 37.089 16.976 28.264 1.00 30.42 O HETATM 1535 O HOH A 287 20.423 13.139 41.386 1.00 32.87 O HETATM 1536 O HOH A 288 35.181 18.809 11.234 1.00 37.17 O HETATM 1537 O HOH A 289 48.961 36.909 21.554 1.00 40.59 O HETATM 1538 O HOH A 290 25.654 32.168 12.387 1.00 50.52 O HETATM 1539 O HOH A 291 48.511 33.210 22.846 1.00 38.24 O HETATM 1540 O HOH A 292 51.300 16.366 37.896 1.00 40.55 O HETATM 1541 O HOH A 293 8.681 20.372 26.820 1.00 39.52 O HETATM 1542 O HOH A 294 15.050 24.207 35.490 1.00 39.21 O HETATM 1543 O HOH A 295 46.889 11.148 29.913 1.00 37.98 O HETATM 1544 O HOH A 296 11.347 17.864 27.688 1.00 46.44 O HETATM 1545 O HOH A 298 27.353 11.068 30.703 1.00 45.31 O HETATM 1546 O HOH A 299 16.656 17.283 14.529 1.00 39.38 O HETATM 1547 O HOH A 300 51.418 13.411 26.014 1.00 43.61 O HETATM 1548 O HOH A 301 50.206 14.134 22.907 1.00 45.45 O HETATM 1549 O HOH A 302 36.067 30.345 47.228 1.00 58.30 O HETATM 1550 O HOH A 303 32.270 26.452 49.346 1.00 49.06 O HETATM 1551 O HOH A 304 38.670 17.816 39.468 1.00 68.93 O HETATM 1552 O HOH A 305 53.858 30.230 29.318 1.00 56.59 O HETATM 1553 O HOH A 306 34.202 27.357 12.167 1.00 58.86 O HETATM 1554 O HOH A 307 30.519 33.262 11.209 1.00 43.95 O HETATM 1555 O HOH A 310 34.024 22.046 37.734 1.00 49.59 O HETATM 1556 O HOH A 311 41.571 29.429 38.742 1.00 48.21 O HETATM 1557 O HOH A 312 30.830 42.564 34.062 1.00 51.19 O HETATM 1558 O HOH A 313 33.144 15.826 50.333 1.00 60.95 O HETATM 1559 O HOH A 314 51.831 31.063 30.643 1.00 66.11 O HETATM 1560 O HOH A 315 51.304 23.240 34.536 1.00 33.66 O HETATM 1561 O HOH A 316 46.877 36.796 33.005 1.00 47.34 O HETATM 1562 O HOH A 317 19.124 35.750 17.574 1.00 52.68 O HETATM 1563 O HOH A 318 14.049 12.600 25.207 1.00 58.67 O HETATM 1564 O HOH A 320 38.006 12.367 44.643 1.00 55.30 O HETATM 1565 O HOH A 321 10.790 26.068 31.598 1.00 35.70 O HETATM 1566 O HOH A 322 30.007 42.010 29.610 1.00 58.78 O HETATM 1567 O HOH A 324 31.270 11.239 43.757 1.00 47.79 O HETATM 1568 O HOH A 325 11.090 28.700 25.298 1.00 48.91 O HETATM 1569 O HOH A 326 13.858 14.612 19.731 1.00 33.74 O HETATM 1570 O HOH A 327 40.684 15.170 37.935 1.00 55.34 O HETATM 1571 O HOH A 328 25.125 23.882 46.525 1.00 66.74 O HETATM 1572 O HOH A 329 45.460 42.872 24.882 1.00 45.53 O HETATM 1573 O HOH A 330 35.896 17.015 31.064 1.00 64.55 O HETATM 1574 O HOH A 332 25.858 38.667 38.419 1.00 43.11 O HETATM 1575 O HOH A 333 31.059 35.383 40.276 1.00 58.62 O HETATM 1576 O HOH A 334 50.255 27.813 24.822 1.00 41.00 O HETATM 1577 O HOH A 335 28.489 36.343 39.762 1.00 54.45 O HETATM 1578 O HOH A 336 45.785 24.273 12.410 1.00 52.37 O HETATM 1579 O HOH A 337 30.871 35.564 11.270 1.00 54.21 O HETATM 1580 O HOH A 338 26.444 34.583 12.603 1.00 64.83 O HETATM 1581 O HOH A 339 45.802 27.682 37.242 1.00 49.62 O HETATM 1582 O HOH A 342 42.519 30.695 11.745 1.00 51.50 O HETATM 1583 O HOH A 343 48.045 17.601 19.336 1.00 61.74 O HETATM 1584 O HOH A 344 50.973 19.256 24.304 1.00 37.89 O HETATM 1585 O HOH A 345 41.765 34.615 13.959 1.00 59.56 O HETATM 1586 O HOH A 346 32.181 39.858 14.312 1.00 54.93 O HETATM 1587 O HOH A 347 23.113 22.198 43.007 1.00 50.11 O HETATM 1588 O HOH A 348 26.678 40.686 30.964 1.00 55.06 O HETATM 1589 O HOH A 349 39.515 23.160 49.095 1.00 44.16 O HETATM 1590 O HOH A 353 50.268 19.072 21.915 1.00 60.37 O HETATM 1591 O HOH A 355 43.131 31.407 37.558 1.00 73.55 O HETATM 1592 O HOH A 356 23.597 19.774 45.840 1.00 71.61 O HETATM 1593 O HOH A 357 14.309 21.225 21.332 1.00 61.35 O HETATM 1594 O HOH A 358 37.538 13.162 14.779 1.00 60.48 O HETATM 1595 O HOH A 359 22.543 10.257 38.407 1.00 41.94 O MASTER 246 0 0 1 13 0 2 6 1594 1 0 15 END