HEADER SWEET TASTING PROTEIN 10-JUN-94 1THV TITLE THE STRUCTURES OF THREE CRYSTAL FORMS OF THE SWEET PROTEIN TITLE 2 THAUMATIN COMPND MOL_ID: 1; COMPND 2 MOLECULE: THAUMATIN ISOFORM A; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: THAUMATOCOCCUS DANIELLII; SOURCE 3 ORGANISM_COMMON: MIRACLE FRUIT; SOURCE 4 ORGANISM_TAXID: 4621 KEYWDS SWEET TASTING PROTEIN EXPDTA X-RAY DIFFRACTION AUTHOR T.-P.KO,J.DAY,A.GREENWOOD,A.MCPHERSON REVDAT 2 24-FEB-09 1THV 1 VERSN REVDAT 1 20-DEC-94 1THV 0 JRNL AUTH T.P.KO,J.DAY,A.GREENWOOD,A.MCPHERSON JRNL TITL STRUCTURES OF THREE CRYSTAL FORMS OF THE SWEET JRNL TITL 2 PROTEIN THAUMATIN. JRNL REF ACTA CRYSTALLOGR.,SECT.D V. 50 813 1994 JRNL REFN ISSN 0907-4449 JRNL PMID 15299348 JRNL DOI 10.1107/S0907444994005512 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 1.75 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : TNT REMARK 3 AUTHORS : TRONRUD,TEN EYCK,MATTHEWS REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.75 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 12.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 3.000 REMARK 3 COMPLETENESS FOR RANGE (%) : NULL REMARK 3 NUMBER OF REFLECTIONS : 19668 REMARK 3 REMARK 3 USING DATA ABOVE SIGMA CUTOFF. REMARK 3 CROSS-VALIDATION METHOD : NULL REMARK 3 FREE R VALUE TEST SET SELECTION : NULL REMARK 3 R VALUE (WORKING + TEST SET) : 0.165 REMARK 3 R VALUE (WORKING SET) : NULL 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 REMARK 3 USING ALL DATA, NO SIGMA CUTOFF. REMARK 3 R VALUE (WORKING + TEST SET, NO CUTOFF) : NULL REMARK 3 R VALUE (WORKING SET, NO CUTOFF) : NULL REMARK 3 FREE R VALUE (NO CUTOFF) : NULL REMARK 3 FREE R VALUE TEST SET SIZE (%, NO CUTOFF) : NULL REMARK 3 FREE R VALUE TEST SET COUNT (NO CUTOFF) : NULL REMARK 3 TOTAL NUMBER OF REFLECTIONS (NO CUTOFF) : NULL REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1551 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 123 REMARK 3 REMARK 3 WILSON B VALUE (FROM FCALC, A**2) : NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. RMS WEIGHT COUNT REMARK 3 BOND LENGTHS (A) : 0.019 ; NULL ; NULL REMARK 3 BOND ANGLES (DEGREES) : 2.930 ; NULL ; NULL REMARK 3 TORSION ANGLES (DEGREES) : NULL ; NULL ; NULL REMARK 3 PSEUDOROTATION ANGLES (DEGREES) : NULL ; NULL ; NULL REMARK 3 TRIGONAL CARBON PLANES (A) : NULL ; NULL ; NULL REMARK 3 GENERAL PLANES (A) : NULL ; NULL ; NULL REMARK 3 ISOTROPIC THERMAL FACTORS (A**2) : NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS (A) : NULL ; NULL ; NULL REMARK 3 REMARK 3 INCORRECT CHIRAL-CENTERS (COUNT) : NULL REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : NULL REMARK 3 KSOL : NULL REMARK 3 BSOL : NULL REMARK 3 REMARK 3 RESTRAINT LIBRARIES. REMARK 3 STEREOCHEMISTRY : NULL REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1THV COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : NULL REMARK 200 TEMPERATURE (KELVIN) : NULL REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : NULL REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : NULL REMARK 200 RADIATION SOURCE : NULL REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : NULL REMARK 200 WAVELENGTH OR RANGE (A) : NULL REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : NULL REMARK 200 DETECTOR MANUFACTURER : NULL REMARK 200 INTENSITY-INTEGRATION SOFTWARE : NULL REMARK 200 DATA SCALING SOFTWARE : NULL REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : NULL REMARK 200 RESOLUTION RANGE HIGH (A) : NULL REMARK 200 RESOLUTION RANGE LOW (A) : NULL REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : NULL REMARK 200 DATA REDUNDANCY : NULL REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : NULL 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: NULL REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL REMARK 200 SOFTWARE USED: NULL REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 46.66 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.31 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: NULL 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 22.15000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 36.35000 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 31.85000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 36.35000 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 22.15000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 31.85000 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 LENGTHS REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,2(A3,1X,A1,I4,A1,1X,A4,3X),1X,F6.3) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 RES CSSEQI ATM2 DEVIATION REMARK 500 GLU A 4 CD GLU A 4 OE1 0.084 REMARK 500 ARG A 8 NE ARG A 8 CZ 0.079 REMARK 500 GLU A 42 CD GLU A 42 OE2 0.085 REMARK 500 SER A 61 CB SER A 61 OG -0.093 REMARK 500 GLU A 156 CD GLU A 156 OE1 0.088 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 ARG A 8 NE - CZ - NH1 ANGL. DEV. = 4.2 DEGREES REMARK 500 ASP A 21 CB - CG - OD1 ANGL. DEV. = 7.3 DEGREES REMARK 500 ASP A 21 CB - CG - OD2 ANGL. DEV. = -6.2 DEGREES REMARK 500 ASP A 25 CB - CG - OD1 ANGL. DEV. = -8.4 DEGREES REMARK 500 ASP A 25 CB - CG - OD2 ANGL. DEV. = 5.9 DEGREES REMARK 500 ARG A 29 NE - CZ - NH2 ANGL. DEV. = -3.5 DEGREES REMARK 500 ASP A 55 CB - CG - OD1 ANGL. DEV. = 6.5 DEGREES REMARK 500 TYR A 57 N - CA - CB ANGL. DEV. = 10.9 DEGREES REMARK 500 TYR A 57 CB - CG - CD2 ANGL. DEV. = -3.8 DEGREES REMARK 500 ARG A 76 CG - CD - NE ANGL. DEV. = -16.1 DEGREES REMARK 500 ARG A 76 CD - NE - CZ ANGL. DEV. = 14.9 DEGREES REMARK 500 ARG A 76 NE - CZ - NH1 ANGL. DEV. = -7.0 DEGREES REMARK 500 ARG A 76 NE - CZ - NH2 ANGL. DEV. = 8.2 DEGREES REMARK 500 ARG A 79 NE - CZ - NH1 ANGL. DEV. = 4.4 DEGREES REMARK 500 ARG A 79 NE - CZ - NH2 ANGL. DEV. = -4.3 DEGREES REMARK 500 ARG A 82 NE - CZ - NH1 ANGL. DEV. = 4.0 DEGREES REMARK 500 ARG A 122 NE - CZ - NH1 ANGL. DEV. = 3.4 DEGREES REMARK 500 CYS A 159 CB - CA - C ANGL. DEV. = -12.2 DEGREES REMARK 500 CYS A 159 N - CA - CB ANGL. DEV. = 10.8 DEGREES REMARK 500 ARG A 171 NE - CZ - NH2 ANGL. DEV. = -3.0 DEGREES REMARK 500 ARG A 175 NE - CZ - NH1 ANGL. DEV. = 3.5 DEGREES REMARK 500 ASP A 179 CB - CG - OD2 ANGL. DEV. = -7.1 DEGREES REMARK 500 ASP A 186 CB - CG - OD2 ANGL. DEV. = 5.7 DEGREES REMARK 500 THR A 189 N - CA - CB ANGL. DEV. = -12.6 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ASP A 25 -140.82 58.95 REMARK 500 ARG A 29 143.45 -170.97 REMARK 500 REMARK 500 REMARK: NULL DBREF 1THV A 1 207 UNP P02883 THM1_THADA 1 207 SEQADV 1THV ASP A 113 UNP P02883 ASN 113 CONFLICT SEQRES 1 A 207 ALA THR PHE GLU ILE VAL ASN ARG CYS SER TYR THR VAL SEQRES 2 A 207 TRP ALA ALA ALA SER LYS GLY ASP ALA ALA LEU ASP ALA SEQRES 3 A 207 GLY GLY ARG GLN LEU ASN SER GLY GLU SER TRP THR ILE SEQRES 4 A 207 ASN VAL GLU PRO GLY THR ASN GLY GLY LYS ILE TRP ALA SEQRES 5 A 207 ARG THR ASP CYS TYR PHE ASP ASP SER GLY SER GLY ILE SEQRES 6 A 207 CYS LYS THR GLY ASP CYS GLY GLY LEU LEU ARG CYS LYS SEQRES 7 A 207 ARG PHE GLY ARG PRO PRO THR THR LEU ALA GLU PHE SER SEQRES 8 A 207 LEU ASN GLN TYR GLY LYS ASP TYR ILE ASP ILE SER ASN SEQRES 9 A 207 ILE LYS GLY PHE ASN VAL PRO MET ASP PHE SER PRO THR SEQRES 10 A 207 THR ARG GLY CYS ARG GLY VAL ARG CYS ALA ALA ASP ILE SEQRES 11 A 207 VAL GLY GLN CYS PRO ALA LYS LEU LYS ALA PRO GLY GLY SEQRES 12 A 207 GLY CYS ASN ASP ALA CYS THR VAL PHE GLN THR SER GLU SEQRES 13 A 207 TYR CYS CYS THR THR GLY LYS CYS GLY PRO THR GLU TYR SEQRES 14 A 207 SER ARG PHE PHE LYS ARG LEU CYS PRO ASP ALA PHE SER SEQRES 15 A 207 TYR VAL LEU ASP LYS PRO THR THR VAL THR CYS PRO GLY SEQRES 16 A 207 SER SER ASN TYR ARG VAL THR PHE CYS PRO THR ALA FORMUL 2 HOH *123(H2 O) HELIX 1 1 ASP A 129 CYS A 134 1 6 HELIX 2 2 PRO A 135 LEU A 138 5 4 HELIX 3 3 ASP A 147 GLN A 153 1 7 HELIX 4 4 THR A 154 CYS A 159 1 6 HELIX 5 5 THR A 167 CYS A 177 1 11 SHEET 1 A 5 SER A 36 ASN A 40 0 SHEET 2 A 5 THR A 2 ASN A 7 -1 O PHE A 3 N ILE A 39 SHEET 3 A 5 TYR A 199 PHE A 203 1 N TYR A 199 O THR A 2 SHEET 4 A 5 MET A 112 PRO A 116 -1 O ASP A 113 N THR A 202 SHEET 5 A 5 VAL A 124 CYS A 126 -1 O VAL A 124 N PHE A 114 SSBOND 1 CYS A 9 CYS A 204 1555 1555 2.05 SSBOND 2 CYS A 56 CYS A 66 1555 1555 1.93 SSBOND 3 CYS A 71 CYS A 77 1555 1555 1.93 SSBOND 4 CYS A 121 CYS A 193 1555 1555 2.02 SSBOND 5 CYS A 126 CYS A 177 1555 1555 2.08 SSBOND 6 CYS A 134 CYS A 145 1555 1555 1.98 SSBOND 7 CYS A 149 CYS A 158 1555 1555 2.09 SSBOND 8 CYS A 159 CYS A 164 1555 1555 1.99 CISPEP 1 PRO A 83 PRO A 84 0 3.85 CRYST1 44.300 63.700 72.700 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 0.022573 0.000000 0.000000 0.00000 SCALE2 0.000000 0.015699 0.000000 0.00000 SCALE3 0.000000 0.000000 0.013755 0.00000 ATOM 1 N ALA A 1 -11.329 10.913 8.802 1.00 19.39 N ATOM 2 CA ALA A 1 -10.504 9.810 8.359 1.00 17.83 C ATOM 3 C ALA A 1 -10.905 8.604 9.125 1.00 14.53 C ATOM 4 O ALA A 1 -11.487 8.733 10.144 1.00 15.01 O ATOM 5 CB ALA A 1 -9.024 10.133 8.541 1.00 18.49 C ATOM 6 N THR A 2 -10.648 7.435 8.590 1.00 12.81 N ATOM 7 CA THR A 2 -11.044 6.215 9.286 1.00 12.03 C ATOM 8 C THR A 2 -9.810 5.584 9.910 1.00 10.68 C ATOM 9 O THR A 2 -8.771 5.405 9.262 1.00 10.29 O ATOM 10 CB THR A 2 -11.518 5.173 8.236 1.00 15.46 C ATOM 11 OG1 THR A 2 -12.628 5.702 7.485 1.00 17.22 O ATOM 12 CG2 THR A 2 -11.885 3.873 8.893 1.00 15.90 C ATOM 13 N PHE A 3 -9.965 5.195 11.128 1.00 10.36 N ATOM 14 CA PHE A 3 -8.943 4.449 11.822 1.00 8.70 C ATOM 15 C PHE A 3 -9.576 3.151 12.278 1.00 8.16 C ATOM 16 O PHE A 3 -10.608 3.141 12.970 1.00 9.77 O ATOM 17 CB PHE A 3 -8.495 5.133 13.109 1.00 9.37 C ATOM 18 CG PHE A 3 -7.522 6.279 12.901 1.00 8.83 C ATOM 19 CD1 PHE A 3 -7.944 7.476 12.338 1.00 7.18 C ATOM 20 CD2 PHE A 3 -6.199 6.140 13.351 1.00 11.37 C ATOM 21 CE1 PHE A 3 -7.022 8.516 12.180 1.00 8.89 C ATOM 22 CE2 PHE A 3 -5.257 7.151 13.156 1.00 10.88 C ATOM 23 CZ PHE A 3 -5.701 8.358 12.617 1.00 9.65 C ATOM 24 N GLU A 4 -8.956 2.069 11.891 1.00 5.40 N ATOM 25 CA GLU A 4 -9.374 0.748 12.264 1.00 8.96 C ATOM 26 C GLU A 4 -8.494 0.308 13.436 1.00 10.36 C ATOM 27 O GLU A 4 -7.274 0.336 13.306 1.00 11.38 O ATOM 28 CB GLU A 4 -9.150 -0.140 11.063 1.00 14.19 C ATOM 29 CG GLU A 4 -9.248 -1.528 11.550 1.00 21.90 C ATOM 30 CD GLU A 4 -9.496 -2.469 10.438 1.00 27.77 C ATOM 31 OE1 GLU A 4 -9.304 -1.936 9.228 1.00 27.89 O ATOM 32 OE2 GLU A 4 -9.973 -3.570 10.696 1.00 30.69 O ATOM 33 N ILE A 5 -9.061 0.030 14.590 1.00 9.15 N ATOM 34 CA ILE A 5 -8.215 -0.358 15.725 1.00 10.11 C ATOM 35 C ILE A 5 -8.427 -1.875 15.964 1.00 12.10 C ATOM 36 O ILE A 5 -9.539 -2.328 16.163 1.00 13.71 O ATOM 37 CB ILE A 5 -8.554 0.523 16.917 1.00 9.19 C ATOM 38 CG1 ILE A 5 -8.303 1.993 16.569 1.00 10.55 C ATOM 39 CG2 ILE A 5 -7.676 0.096 18.107 1.00 10.34 C ATOM 40 CD1 ILE A 5 -8.863 2.958 17.598 1.00 12.43 C ATOM 41 N VAL A 6 -7.381 -2.673 15.874 1.00 9.59 N ATOM 42 CA VAL A 6 -7.462 -4.092 15.972 1.00 9.57 C ATOM 43 C VAL A 6 -6.681 -4.665 17.156 1.00 10.48 C ATOM 44 O VAL A 6 -5.481 -4.375 17.312 1.00 10.77 O ATOM 45 CB VAL A 6 -6.821 -4.686 14.728 1.00 10.41 C ATOM 46 CG1 VAL A 6 -7.184 -6.163 14.677 1.00 11.47 C ATOM 47 CG2 VAL A 6 -7.429 -3.998 13.544 1.00 13.18 C ATOM 48 N ASN A 7 -7.340 -5.537 17.935 1.00 9.46 N ATOM 49 CA ASN A 7 -6.666 -6.150 19.058 1.00 9.00 C ATOM 50 C ASN A 7 -6.291 -7.538 18.674 1.00 9.87 C ATOM 51 O ASN A 7 -7.169 -8.398 18.711 1.00 12.01 O ATOM 52 CB ASN A 7 -7.581 -6.274 20.282 1.00 9.11 C ATOM 53 CG ASN A 7 -6.800 -6.864 21.447 1.00 11.32 C ATOM 54 OD1 ASN A 7 -5.586 -6.932 21.346 1.00 11.82 O ATOM 55 ND2 ASN A 7 -7.486 -7.315 22.522 1.00 12.67 N ATOM 56 N ARG A 8 -5.016 -7.785 18.310 1.00 9.74 N ATOM 57 CA ARG A 8 -4.565 -9.129 18.018 1.00 11.61 C ATOM 58 C ARG A 8 -3.933 -9.773 19.289 1.00 11.03 C ATOM 59 O ARG A 8 -3.459 -10.912 19.285 1.00 13.33 O ATOM 60 CB ARG A 8 -3.645 -9.190 16.765 1.00 18.18 C ATOM 61 CG ARG A 8 -4.297 -9.050 15.359 1.00 29.98 C ATOM 62 CD ARG A 8 -3.542 -9.804 14.221 1.00 45.77 C ATOM 63 NE ARG A 8 -2.948 -8.970 13.092 1.00 60.90 N ATOM 64 CZ ARG A 8 -2.108 -9.320 12.022 1.00 71.69 C ATOM 65 NH1 ARG A 8 -1.645 -10.570 11.788 1.00 73.43 N ATOM 66 NH2 ARG A 8 -1.708 -8.361 11.163 1.00 74.23 N ATOM 67 N CYS A 9 -3.917 -9.087 20.421 1.00 7.50 N ATOM 68 CA CYS A 9 -3.350 -9.657 21.578 1.00 7.25 C ATOM 69 C CYS A 9 -4.189 -10.807 22.091 1.00 10.24 C ATOM 70 O CYS A 9 -5.336 -10.968 21.735 1.00 11.57 O ATOM 71 CB CYS A 9 -3.290 -8.605 22.636 1.00 9.05 C ATOM 72 SG CYS A 9 -2.306 -7.135 22.253 1.00 11.72 S ATOM 73 N SER A 10 -3.603 -11.661 22.903 1.00 12.10 N ATOM 74 CA SER A 10 -4.322 -12.765 23.499 1.00 13.95 C ATOM 75 C SER A 10 -5.168 -12.296 24.645 1.00 13.62 C ATOM 76 O SER A 10 -6.089 -12.981 25.018 1.00 15.82 O ATOM 77 CB SER A 10 -3.365 -13.774 24.041 1.00 16.91 C ATOM 78 OG SER A 10 -2.767 -14.411 22.932 1.00 18.71 O ATOM 79 N TYR A 11 -4.828 -11.152 25.234 1.00 11.69 N ATOM 80 CA TYR A 11 -5.565 -10.596 26.331 1.00 9.47 C ATOM 81 C TYR A 11 -6.487 -9.482 25.811 1.00 8.95 C ATOM 82 O TYR A 11 -6.307 -8.886 24.758 1.00 9.45 O ATOM 83 CB TYR A 11 -4.616 -10.111 27.484 1.00 9.09 C ATOM 84 CG TYR A 11 -3.427 -9.312 26.961 1.00 11.65 C ATOM 85 CD1 TYR A 11 -3.522 -7.929 26.761 1.00 12.96 C ATOM 86 CD2 TYR A 11 -2.201 -9.916 26.646 1.00 11.52 C ATOM 87 CE1 TYR A 11 -2.499 -7.136 26.221 1.00 12.67 C ATOM 88 CE2 TYR A 11 -1.155 -9.149 26.116 1.00 10.95 C ATOM 89 CZ TYR A 11 -1.280 -7.757 25.941 1.00 10.69 C ATOM 90 OH TYR A 11 -0.246 -6.996 25.415 1.00 8.35 O ATOM 91 N THR A 12 -7.516 -9.146 26.578 1.00 8.45 N ATOM 92 CA THR A 12 -8.382 -8.029 26.236 1.00 8.52 C ATOM 93 C THR A 12 -7.669 -6.713 26.518 1.00 9.45 C ATOM 94 O THR A 12 -6.844 -6.599 27.420 1.00 9.34 O ATOM 95 CB THR A 12 -9.562 -7.982 27.244 1.00 9.52 C ATOM 96 OG1 THR A 12 -10.288 -9.155 27.146 1.00 12.02 O ATOM 97 CG2 THR A 12 -10.437 -6.771 26.991 1.00 9.83 C ATOM 98 N VAL A 13 -8.002 -5.727 25.729 1.00 9.14 N ATOM 99 CA VAL A 13 -7.522 -4.405 25.943 1.00 9.40 C ATOM 100 C VAL A 13 -8.714 -3.436 25.833 1.00 9.20 C ATOM 101 O VAL A 13 -9.744 -3.721 25.204 1.00 11.71 O ATOM 102 CB VAL A 13 -6.424 -3.939 24.942 1.00 11.80 C ATOM 103 CG1 VAL A 13 -5.195 -4.844 24.982 1.00 12.01 C ATOM 104 CG2 VAL A 13 -6.983 -3.736 23.528 1.00 11.96 C ATOM 105 N TRP A 14 -8.575 -2.308 26.444 1.00 7.06 N ATOM 106 CA TRP A 14 -9.538 -1.259 26.401 1.00 6.35 C ATOM 107 C TRP A 14 -8.872 -0.141 25.605 1.00 7.10 C ATOM 108 O TRP A 14 -8.057 0.614 26.111 1.00 9.31 O ATOM 109 CB TRP A 14 -10.012 -0.764 27.781 1.00 7.05 C ATOM 110 CG TRP A 14 -10.909 -1.801 28.444 1.00 10.59 C ATOM 111 CD1 TRP A 14 -12.288 -1.754 28.548 1.00 12.58 C ATOM 112 CD2 TRP A 14 -10.493 -3.050 29.068 1.00 10.95 C ATOM 113 NE1 TRP A 14 -12.767 -2.900 29.170 1.00 13.72 N ATOM 114 CE2 TRP A 14 -11.690 -3.701 29.517 1.00 13.85 C ATOM 115 CE3 TRP A 14 -9.242 -3.636 29.356 1.00 8.77 C ATOM 116 CZ2 TRP A 14 -11.585 -4.945 30.210 1.00 13.25 C ATOM 117 CZ3 TRP A 14 -9.159 -4.853 29.970 1.00 8.95 C ATOM 118 CH2 TRP A 14 -10.297 -5.490 30.426 1.00 10.49 C ATOM 119 N ALA A 15 -9.224 -0.016 24.339 1.00 7.42 N ATOM 120 CA ALA A 15 -8.696 0.991 23.454 1.00 6.72 C ATOM 121 C ALA A 15 -9.197 2.338 23.826 1.00 8.13 C ATOM 122 O ALA A 15 -10.309 2.499 24.400 1.00 8.14 O ATOM 123 CB ALA A 15 -9.101 0.652 22.010 1.00 6.07 C ATOM 124 N ALA A 16 -8.361 3.358 23.562 1.00 7.70 N ATOM 125 CA ALA A 16 -8.704 4.739 23.899 1.00 6.21 C ATOM 126 C ALA A 16 -8.230 5.594 22.784 1.00 7.70 C ATOM 127 O ALA A 16 -7.174 5.299 22.159 1.00 7.88 O ATOM 128 CB ALA A 16 -8.003 5.144 25.190 1.00 5.35 C ATOM 129 N ALA A 17 -8.966 6.687 22.571 1.00 8.05 N ATOM 130 CA ALA A 17 -8.645 7.657 21.499 1.00 8.73 C ATOM 131 C ALA A 17 -9.108 9.042 21.971 1.00 10.68 C ATOM 132 O ALA A 17 -10.262 9.224 22.443 1.00 11.30 O ATOM 133 CB ALA A 17 -9.338 7.256 20.218 1.00 8.53 C ATOM 134 N SER A 18 -8.182 10.006 21.948 1.00 9.34 N ATOM 135 CA SER A 18 -8.492 11.324 22.451 1.00 8.85 C ATOM 136 C SER A 18 -7.524 12.277 21.824 1.00 9.91 C ATOM 137 O SER A 18 -6.469 11.851 21.312 1.00 9.99 O ATOM 138 CB SER A 18 -8.182 11.309 23.956 1.00 10.18 C ATOM 139 OG SER A 18 -8.082 12.601 24.546 1.00 10.67 O ATOM 140 N LYS A 19 -7.903 13.521 21.899 1.00 10.23 N ATOM 141 CA LYS A 19 -7.098 14.616 21.443 1.00 14.02 C ATOM 142 C LYS A 19 -6.633 15.423 22.607 1.00 14.89 C ATOM 143 O LYS A 19 -6.095 16.499 22.430 1.00 16.54 O ATOM 144 CB LYS A 19 -7.637 15.465 20.282 1.00 18.38 C ATOM 145 CG LYS A 19 -8.983 16.083 20.597 1.00 24.12 C ATOM 146 CD LYS A 19 -9.363 17.218 19.657 1.00 32.04 C ATOM 147 CE LYS A 19 -9.563 18.515 20.453 1.00 39.19 C ATOM 148 NZ LYS A 19 -10.403 19.564 19.839 1.00 42.73 N ATOM 149 N GLY A 20 -6.785 14.898 23.827 1.00 13.81 N ATOM 150 CA GLY A 20 -6.200 15.702 24.858 1.00 13.38 C ATOM 151 C GLY A 20 -7.251 16.435 25.656 1.00 14.21 C ATOM 152 O GLY A 20 -7.211 16.384 26.888 1.00 13.23 O ATOM 153 N ASP A 21 -8.184 17.097 24.961 1.00 16.04 N ATOM 154 CA ASP A 21 -9.217 17.757 25.707 1.00 18.40 C ATOM 155 C ASP A 21 -10.583 17.256 25.261 1.00 18.38 C ATOM 156 O ASP A 21 -11.596 17.883 25.593 1.00 21.48 O ATOM 157 CB ASP A 21 -9.163 19.272 25.518 1.00 22.69 C ATOM 158 CG ASP A 21 -9.225 19.551 24.052 1.00 28.45 C ATOM 159 OD1 ASP A 21 -9.238 18.705 23.164 1.00 28.26 O ATOM 160 OD2 ASP A 21 -9.199 20.816 23.796 1.00 32.47 O ATOM 161 N ALA A 22 -10.648 16.159 24.525 1.00 14.18 N ATOM 162 CA ALA A 22 -11.890 15.586 24.094 1.00 12.97 C ATOM 163 C ALA A 22 -11.626 14.190 23.558 1.00 12.35 C ATOM 164 O ALA A 22 -10.501 13.890 23.124 1.00 12.72 O ATOM 165 CB ALA A 22 -12.485 16.457 22.993 1.00 13.44 C ATOM 166 N ALA A 23 -12.663 13.359 23.574 1.00 11.31 N ATOM 167 CA ALA A 23 -12.567 12.045 23.012 1.00 11.77 C ATOM 168 C ALA A 23 -12.568 12.141 21.510 1.00 12.25 C ATOM 169 O ALA A 23 -13.079 13.091 20.930 1.00 14.15 O ATOM 170 CB ALA A 23 -13.795 11.224 23.392 1.00 12.19 C ATOM 171 N LEU A 24 -12.051 11.145 20.869 1.00 10.55 N ATOM 172 CA LEU A 24 -12.157 11.038 19.479 1.00 11.53 C ATOM 173 C LEU A 24 -13.207 9.899 19.316 1.00 11.91 C ATOM 174 O LEU A 24 -13.112 8.795 19.887 1.00 11.10 O ATOM 175 CB LEU A 24 -10.816 10.618 18.795 1.00 11.93 C ATOM 176 CG LEU A 24 -9.700 11.610 18.977 1.00 13.55 C ATOM 177 CD1 LEU A 24 -8.424 11.053 18.334 1.00 14.77 C ATOM 178 CD2 LEU A 24 -10.114 12.918 18.290 1.00 14.31 C ATOM 179 N ASP A 25 -14.240 10.143 18.521 1.00 11.27 N ATOM 180 CA ASP A 25 -15.250 9.117 18.390 1.00 12.15 C ATOM 181 C ASP A 25 -15.855 8.801 19.787 1.00 12.13 C ATOM 182 O ASP A 25 -16.024 9.760 20.523 1.00 12.67 O ATOM 183 CB ASP A 25 -14.798 7.887 17.585 1.00 14.75 C ATOM 184 CG ASP A 25 -15.941 7.167 16.865 1.00 19.13 C ATOM 185 OD1 ASP A 25 -16.630 6.436 17.730 1.00 20.72 O ATOM 186 OD2 ASP A 25 -16.123 7.198 15.620 1.00 19.85 O ATOM 187 N ALA A 26 -16.155 7.519 20.132 1.00 12.80 N ATOM 188 CA ALA A 26 -16.684 7.174 21.465 1.00 14.29 C ATOM 189 C ALA A 26 -15.612 7.319 22.558 1.00 14.55 C ATOM 190 O ALA A 26 -15.973 7.200 23.716 1.00 16.48 O ATOM 191 CB ALA A 26 -17.152 5.740 21.565 1.00 15.32 C ATOM 192 N GLY A 27 -14.330 7.535 22.205 1.00 11.38 N ATOM 193 CA GLY A 27 -13.263 7.752 23.216 1.00 9.77 C ATOM 194 C GLY A 27 -12.647 6.493 23.827 1.00 9.51 C ATOM 195 O GLY A 27 -11.459 6.507 24.279 1.00 9.21 O ATOM 196 N GLY A 28 -13.425 5.402 23.866 1.00 8.94 N ATOM 197 CA GLY A 28 -12.869 4.183 24.415 1.00 9.68 C ATOM 198 C GLY A 28 -13.802 3.025 24.189 1.00 12.75 C ATOM 199 O GLY A 28 -15.021 3.196 24.003 1.00 14.70 O ATOM 200 N ARG A 29 -13.244 1.841 24.244 1.00 12.40 N ATOM 201 CA ARG A 29 -14.066 0.637 24.042 1.00 13.23 C ATOM 202 C ARG A 29 -13.294 -0.623 24.358 1.00 10.81 C ATOM 203 O ARG A 29 -12.059 -0.729 24.113 1.00 8.20 O ATOM 204 CB ARG A 29 -14.524 0.698 22.615 1.00 15.60 C ATOM 205 CG ARG A 29 -14.586 -0.585 21.921 1.00 21.80 C ATOM 206 CD ARG A 29 -15.963 -0.690 21.302 1.00 30.02 C ATOM 207 NE ARG A 29 -16.020 -1.818 20.425 1.00 39.39 N ATOM 208 CZ ARG A 29 -16.125 -3.093 20.814 1.00 48.09 C ATOM 209 NH1 ARG A 29 -16.303 -3.442 22.115 1.00 50.76 N ATOM 210 NH2 ARG A 29 -16.049 -4.039 19.842 1.00 49.58 N ATOM 211 N GLN A 30 -13.998 -1.566 24.924 1.00 9.13 N ATOM 212 CA GLN A 30 -13.361 -2.833 25.223 1.00 9.93 C ATOM 213 C GLN A 30 -13.132 -3.622 23.990 1.00 10.85 C ATOM 214 O GLN A 30 -14.021 -3.744 23.158 1.00 12.57 O ATOM 215 CB GLN A 30 -14.224 -3.693 26.160 1.00 12.18 C ATOM 216 CG GLN A 30 -13.612 -5.075 26.496 1.00 13.89 C ATOM 217 CD GLN A 30 -14.553 -5.838 27.446 1.00 18.44 C ATOM 218 OE1 GLN A 30 -15.328 -5.238 28.212 1.00 20.11 O ATOM 219 NE2 GLN A 30 -14.549 -7.165 27.369 1.00 19.26 N ATOM 220 N LEU A 31 -11.985 -4.249 23.892 1.00 11.42 N ATOM 221 CA LEU A 31 -11.655 -5.008 22.734 1.00 12.63 C ATOM 222 C LEU A 31 -11.115 -6.382 23.124 1.00 12.84 C ATOM 223 O LEU A 31 -9.970 -6.505 23.539 1.00 10.98 O ATOM 224 CB LEU A 31 -10.589 -4.235 21.980 1.00 14.31 C ATOM 225 CG LEU A 31 -10.888 -3.744 20.591 1.00 18.06 C ATOM 226 CD1 LEU A 31 -12.269 -3.192 20.418 1.00 19.05 C ATOM 227 CD2 LEU A 31 -9.880 -2.725 20.127 1.00 17.77 C ATOM 228 N ASN A 32 -11.952 -7.453 22.977 1.00 13.61 N ATOM 229 CA ASN A 32 -11.485 -8.783 23.296 1.00 13.74 C ATOM 230 C ASN A 32 -10.526 -9.224 22.238 1.00 13.01 C ATOM 231 O ASN A 32 -10.419 -8.605 21.175 1.00 12.57 O ATOM 232 CB ASN A 32 -12.609 -9.797 23.455 1.00 16.57 C ATOM 233 CG ASN A 32 -13.590 -9.350 24.503 1.00 19.27 C ATOM 234 OD1 ASN A 32 -14.770 -9.372 24.230 1.00 23.17 O ATOM 235 ND2 ASN A 32 -13.130 -8.894 25.656 1.00 18.13 N ATOM 236 N SER A 33 -9.800 -10.267 22.564 1.00 11.93 N ATOM 237 CA SER A 33 -8.874 -10.724 21.639 1.00 13.01 C ATOM 238 C SER A 33 -9.509 -10.961 20.291 1.00 15.42 C ATOM 239 O SER A 33 -10.610 -11.601 20.177 1.00 16.46 O ATOM 240 CB SER A 33 -8.403 -12.036 22.176 1.00 14.21 C ATOM 241 OG SER A 33 -7.545 -12.535 21.201 1.00 15.85 O ATOM 242 N GLY A 34 -8.897 -10.408 19.250 1.00 14.14 N ATOM 243 CA GLY A 34 -9.513 -10.606 17.941 1.00 14.77 C ATOM 244 C GLY A 34 -10.489 -9.509 17.464 1.00 16.26 C ATOM 245 O GLY A 34 -10.663 -9.418 16.255 1.00 17.05 O ATOM 246 N GLU A 35 -11.096 -8.658 18.352 1.00 15.29 N ATOM 247 CA GLU A 35 -12.032 -7.658 17.930 1.00 14.13 C ATOM 248 C GLU A 35 -11.359 -6.427 17.389 1.00 14.26 C ATOM 249 O GLU A 35 -10.237 -6.095 17.731 1.00 11.37 O ATOM 250 CB GLU A 35 -13.002 -7.242 19.032 1.00 15.61 C ATOM 251 CG GLU A 35 -13.534 -8.431 19.829 1.00 21.13 C ATOM 252 CD GLU A 35 -14.636 -8.101 20.864 1.00 26.32 C ATOM 253 OE1 GLU A 35 -14.463 -7.023 21.586 1.00 24.61 O ATOM 254 OE2 GLU A 35 -15.636 -8.812 21.027 1.00 30.68 O ATOM 255 N SER A 36 -12.120 -5.690 16.580 1.00 15.87 N ATOM 256 CA SER A 36 -11.695 -4.451 15.986 1.00 16.46 C ATOM 257 C SER A 36 -12.754 -3.396 16.148 1.00 14.72 C ATOM 258 O SER A 36 -13.929 -3.668 16.391 1.00 13.59 O ATOM 259 CB SER A 36 -11.250 -4.612 14.548 1.00 20.17 C ATOM 260 OG SER A 36 -12.295 -5.191 13.864 1.00 22.56 O ATOM 261 N TRP A 37 -12.319 -2.182 16.045 1.00 13.64 N ATOM 262 CA TRP A 37 -13.139 -1.011 16.264 1.00 13.80 C ATOM 263 C TRP A 37 -12.762 0.015 15.248 1.00 13.10 C ATOM 264 O TRP A 37 -11.605 0.409 15.173 1.00 11.98 O ATOM 265 CB TRP A 37 -12.887 -0.464 17.687 1.00 13.95 C ATOM 266 CG TRP A 37 -13.657 0.761 18.083 1.00 13.45 C ATOM 267 CD1 TRP A 37 -14.946 1.126 17.723 1.00 13.40 C ATOM 268 CD2 TRP A 37 -13.179 1.713 18.975 1.00 13.24 C ATOM 269 NE1 TRP A 37 -15.261 2.305 18.380 1.00 13.83 N ATOM 270 CE2 TRP A 37 -14.176 2.696 19.129 1.00 13.73 C ATOM 271 CE3 TRP A 37 -11.959 1.834 19.659 1.00 14.36 C ATOM 272 CZ2 TRP A 37 -13.967 3.822 19.921 1.00 15.74 C ATOM 273 CZ3 TRP A 37 -11.765 2.936 20.464 1.00 15.57 C ATOM 274 CH2 TRP A 37 -12.748 3.946 20.587 1.00 16.46 C ATOM 275 N THR A 38 -13.769 0.422 14.480 1.00 11.88 N ATOM 276 CA THR A 38 -13.515 1.391 13.465 1.00 13.36 C ATOM 277 C THR A 38 -13.983 2.761 13.876 1.00 13.89 C ATOM 278 O THR A 38 -15.167 2.933 14.205 1.00 15.61 O ATOM 279 CB THR A 38 -14.163 0.978 12.154 1.00 15.03 C ATOM 280 OG1 THR A 38 -13.484 -0.194 11.765 1.00 16.61 O ATOM 281 CG2 THR A 38 -13.865 2.053 11.096 1.00 15.08 C ATOM 282 N ILE A 39 -13.085 3.721 13.910 1.00 10.66 N ATOM 283 CA ILE A 39 -13.506 5.030 14.336 1.00 10.92 C ATOM 284 C ILE A 39 -13.321 6.060 13.238 1.00 10.69 C ATOM 285 O ILE A 39 -12.527 5.912 12.314 1.00 11.09 O ATOM 286 CB ILE A 39 -12.853 5.516 15.666 1.00 12.71 C ATOM 287 CG1 ILE A 39 -11.355 5.765 15.496 1.00 11.31 C ATOM 288 CG2 ILE A 39 -13.020 4.474 16.761 1.00 14.77 C ATOM 289 CD1 ILE A 39 -10.640 6.266 16.739 1.00 10.00 C ATOM 290 N ASN A 40 -14.085 7.110 13.380 1.00 13.72 N ATOM 291 CA ASN A 40 -14.009 8.232 12.530 1.00 17.60 C ATOM 292 C ASN A 40 -13.328 9.407 13.210 1.00 16.27 C ATOM 293 O ASN A 40 -13.747 9.854 14.266 1.00 16.44 O ATOM 294 CB ASN A 40 -15.367 8.640 12.044 1.00 25.26 C ATOM 295 CG ASN A 40 -15.146 8.757 10.590 1.00 34.07 C ATOM 296 OD1 ASN A 40 -15.181 7.687 9.862 1.00 37.84 O ATOM 297 ND2 ASN A 40 -14.704 9.986 10.191 1.00 35.43 N ATOM 298 N VAL A 41 -12.257 9.903 12.615 1.00 14.79 N ATOM 299 CA VAL A 41 -11.511 11.024 13.161 1.00 14.28 C ATOM 300 C VAL A 41 -11.608 12.187 12.200 1.00 13.33 C ATOM 301 O VAL A 41 -11.322 12.065 11.024 1.00 11.93 O ATOM 302 CB VAL A 41 -10.026 10.654 13.432 1.00 14.02 C ATOM 303 CG1 VAL A 41 -9.245 11.825 13.990 1.00 13.70 C ATOM 304 CG2 VAL A 41 -9.972 9.460 14.353 1.00 15.14 C ATOM 305 N GLU A 42 -12.050 13.302 12.726 1.00 14.32 N ATOM 306 CA GLU A 42 -12.240 14.453 11.953 1.00 18.77 C ATOM 307 C GLU A 42 -10.977 14.903 11.299 1.00 18.13 C ATOM 308 O GLU A 42 -9.897 15.048 11.887 1.00 18.08 O ATOM 309 CB GLU A 42 -12.400 15.505 13.010 1.00 28.53 C ATOM 310 CG GLU A 42 -13.502 16.458 12.702 1.00 41.34 C ATOM 311 CD GLU A 42 -14.167 16.800 14.004 1.00 53.18 C ATOM 312 OE1 GLU A 42 -14.735 15.937 14.714 1.00 56.55 O ATOM 313 OE2 GLU A 42 -14.064 18.099 14.303 1.00 55.11 O ATOM 314 N PRO A 43 -11.139 15.323 10.116 1.00 18.21 N ATOM 315 CA PRO A 43 -9.997 15.883 9.411 1.00 17.08 C ATOM 316 C PRO A 43 -9.465 17.129 10.139 1.00 14.24 C ATOM 317 O PRO A 43 -10.186 17.926 10.791 1.00 14.20 O ATOM 318 CB PRO A 43 -10.584 16.321 8.065 1.00 18.37 C ATOM 319 CG PRO A 43 -11.972 15.670 7.940 1.00 19.10 C ATOM 320 CD PRO A 43 -12.379 15.194 9.328 1.00 18.67 C ATOM 321 N GLY A 44 -8.193 17.355 10.067 1.00 10.27 N ATOM 322 CA GLY A 44 -7.809 18.545 10.714 1.00 9.25 C ATOM 323 C GLY A 44 -7.399 18.244 12.157 1.00 10.27 C ATOM 324 O GLY A 44 -6.822 19.099 12.829 1.00 11.43 O ATOM 325 N THR A 45 -7.708 17.044 12.624 1.00 10.61 N ATOM 326 CA THR A 45 -7.337 16.746 14.019 1.00 11.89 C ATOM 327 C THR A 45 -5.853 16.846 14.274 1.00 11.24 C ATOM 328 O THR A 45 -5.057 16.179 13.652 1.00 10.84 O ATOM 329 CB THR A 45 -7.842 15.378 14.426 1.00 14.22 C ATOM 330 OG1 THR A 45 -9.250 15.447 14.425 1.00 13.22 O ATOM 331 CG2 THR A 45 -7.311 15.100 15.863 1.00 15.82 C ATOM 332 N ASN A 46 -5.495 17.661 15.224 1.00 11.28 N ATOM 333 CA ASN A 46 -4.106 17.843 15.540 1.00 13.07 C ATOM 334 C ASN A 46 -3.759 17.277 16.920 1.00 12.48 C ATOM 335 O ASN A 46 -4.431 17.543 17.949 1.00 12.63 O ATOM 336 CB ASN A 46 -3.786 19.355 15.422 1.00 18.11 C ATOM 337 CG ASN A 46 -2.293 19.634 15.565 1.00 24.12 C ATOM 338 OD1 ASN A 46 -1.884 20.190 16.599 1.00 28.99 O ATOM 339 ND2 ASN A 46 -1.461 19.044 14.703 1.00 23.10 N ATOM 340 N GLY A 47 -2.725 16.465 17.034 1.00 10.08 N ATOM 341 CA GLY A 47 -2.416 16.035 18.388 1.00 9.21 C ATOM 342 C GLY A 47 -3.270 14.891 18.948 1.00 9.77 C ATOM 343 O GLY A 47 -3.421 14.775 20.191 1.00 11.65 O ATOM 344 N GLY A 48 -3.802 14.026 18.051 1.00 7.46 N ATOM 345 CA GLY A 48 -4.541 12.867 18.437 1.00 7.52 C ATOM 346 C GLY A 48 -3.614 11.722 18.875 1.00 7.45 C ATOM 347 O GLY A 48 -2.514 11.618 18.433 1.00 5.53 O ATOM 348 N LYS A 49 -4.126 10.858 19.776 1.00 6.66 N ATOM 349 CA LYS A 49 -3.415 9.701 20.229 1.00 6.03 C ATOM 350 C LYS A 49 -4.348 8.554 20.393 1.00 7.08 C ATOM 351 O LYS A 49 -5.488 8.745 20.802 1.00 8.26 O ATOM 352 CB LYS A 49 -2.753 9.952 21.552 1.00 7.23 C ATOM 353 CG LYS A 49 -1.859 11.165 21.524 1.00 8.60 C ATOM 354 CD LYS A 49 -0.905 11.181 22.720 1.00 11.42 C ATOM 355 CE LYS A 49 -0.271 12.547 22.985 1.00 15.78 C ATOM 356 NZ LYS A 49 0.588 13.064 21.866 1.00 18.36 N ATOM 357 N ILE A 50 -3.847 7.385 20.148 1.00 6.88 N ATOM 358 CA ILE A 50 -4.580 6.163 20.367 1.00 7.50 C ATOM 359 C ILE A 50 -3.706 5.257 21.264 1.00 8.12 C ATOM 360 O ILE A 50 -2.474 5.148 21.071 1.00 7.99 O ATOM 361 CB ILE A 50 -4.884 5.482 19.047 1.00 6.61 C ATOM 362 CG1 ILE A 50 -6.044 6.221 18.450 1.00 6.99 C ATOM 363 CG2 ILE A 50 -5.242 3.987 19.278 1.00 4.93 C ATOM 364 CD1 ILE A 50 -6.272 5.874 16.995 1.00 6.55 C ATOM 365 N TRP A 51 -4.298 4.603 22.268 1.00 6.48 N ATOM 366 CA TRP A 51 -3.447 3.745 23.052 1.00 5.10 C ATOM 367 C TRP A 51 -4.270 2.623 23.540 1.00 6.60 C ATOM 368 O TRP A 51 -5.540 2.701 23.431 1.00 6.24 O ATOM 369 CB TRP A 51 -2.751 4.495 24.203 1.00 3.55 C ATOM 370 CG TRP A 51 -3.643 5.035 25.288 1.00 4.80 C ATOM 371 CD1 TRP A 51 -3.903 4.490 26.501 1.00 5.95 C ATOM 372 CD2 TRP A 51 -4.385 6.257 25.236 1.00 5.73 C ATOM 373 NE1 TRP A 51 -4.769 5.252 27.212 1.00 5.35 N ATOM 374 CE2 TRP A 51 -5.092 6.361 26.476 1.00 5.67 C ATOM 375 CE3 TRP A 51 -4.624 7.187 24.226 1.00 6.75 C ATOM 376 CZ2 TRP A 51 -5.968 7.415 26.721 1.00 7.26 C ATOM 377 CZ3 TRP A 51 -5.483 8.260 24.489 1.00 9.33 C ATOM 378 CH2 TRP A 51 -6.115 8.380 25.751 1.00 9.71 C ATOM 379 N ALA A 52 -3.594 1.625 24.131 1.00 7.49 N ATOM 380 CA ALA A 52 -4.369 0.528 24.748 1.00 7.68 C ATOM 381 C ALA A 52 -4.276 0.629 26.256 1.00 7.46 C ATOM 382 O ALA A 52 -3.329 1.167 26.809 1.00 8.45 O ATOM 383 CB ALA A 52 -3.871 -0.821 24.308 1.00 9.28 C ATOM 384 N ARG A 53 -5.227 0.139 26.925 1.00 6.63 N ATOM 385 CA ARG A 53 -5.229 0.114 28.385 1.00 6.14 C ATOM 386 C ARG A 53 -5.372 -1.335 28.802 1.00 6.07 C ATOM 387 O ARG A 53 -6.117 -2.110 28.164 1.00 6.00 O ATOM 388 CB ARG A 53 -6.398 0.889 28.990 1.00 3.89 C ATOM 389 CG ARG A 53 -6.391 2.337 28.550 1.00 5.04 C ATOM 390 CD ARG A 53 -7.715 3.044 29.007 1.00 5.98 C ATOM 391 NE ARG A 53 -8.793 2.692 28.073 1.00 6.92 N ATOM 392 CZ ARG A 53 -10.021 3.110 28.274 1.00 7.71 C ATOM 393 NH1 ARG A 53 -10.356 3.750 29.413 1.00 6.99 N ATOM 394 NH2 ARG A 53 -10.914 2.832 27.352 1.00 6.80 N ATOM 395 N THR A 54 -4.675 -1.721 29.885 1.00 5.70 N ATOM 396 CA THR A 54 -4.765 -3.123 30.266 1.00 7.16 C ATOM 397 C THR A 54 -5.369 -3.279 31.658 1.00 6.08 C ATOM 398 O THR A 54 -5.287 -2.323 32.454 1.00 6.92 O ATOM 399 CB THR A 54 -3.336 -3.840 30.208 1.00 8.54 C ATOM 400 OG1 THR A 54 -2.477 -3.134 31.048 1.00 8.96 O ATOM 401 CG2 THR A 54 -2.820 -3.874 28.778 1.00 9.72 C ATOM 402 N ASP A 55 -5.910 -4.466 31.911 1.00 5.93 N ATOM 403 CA ASP A 55 -6.403 -4.768 33.256 1.00 10.23 C ATOM 404 C ASP A 55 -7.374 -3.732 33.826 1.00 8.74 C ATOM 405 O ASP A 55 -7.140 -3.089 34.839 1.00 7.32 O ATOM 406 CB ASP A 55 -5.231 -5.127 34.179 1.00 15.99 C ATOM 407 CG ASP A 55 -4.718 -6.507 33.801 1.00 24.90 C ATOM 408 OD1 ASP A 55 -5.397 -7.534 33.802 1.00 28.18 O ATOM 409 OD2 ASP A 55 -3.470 -6.547 33.396 1.00 28.43 O ATOM 410 N CYS A 56 -8.463 -3.495 33.088 1.00 9.63 N ATOM 411 CA CYS A 56 -9.413 -2.512 33.574 1.00 10.70 C ATOM 412 C CYS A 56 -10.665 -3.207 34.097 1.00 12.71 C ATOM 413 O CYS A 56 -10.952 -4.346 33.756 1.00 11.62 O ATOM 414 CB CYS A 56 -10.005 -1.633 32.440 1.00 9.16 C ATOM 415 SG CYS A 56 -8.781 -0.824 31.370 1.00 9.02 S ATOM 416 N TYR A 57 -11.388 -2.406 34.855 1.00 14.29 N ATOM 417 CA TYR A 57 -12.735 -2.705 35.264 1.00 15.36 C ATOM 418 C TYR A 57 -13.541 -1.479 35.461 1.00 11.62 C ATOM 419 O TYR A 57 -13.069 -0.481 35.989 1.00 10.96 O ATOM 420 CB TYR A 57 -13.020 -3.681 36.356 1.00 18.81 C ATOM 421 CG TYR A 57 -12.536 -3.146 37.623 1.00 21.07 C ATOM 422 CD1 TYR A 57 -13.348 -2.332 38.420 1.00 23.11 C ATOM 423 CD2 TYR A 57 -11.297 -3.593 38.071 1.00 21.49 C ATOM 424 CE1 TYR A 57 -12.931 -1.871 39.670 1.00 23.81 C ATOM 425 CE2 TYR A 57 -10.885 -3.181 39.331 1.00 23.07 C ATOM 426 CZ TYR A 57 -11.698 -2.351 40.120 1.00 25.46 C ATOM 427 OH TYR A 57 -11.215 -1.943 41.339 1.00 27.43 O ATOM 428 N PHE A 58 -14.768 -1.637 34.954 1.00 11.17 N ATOM 429 CA PHE A 58 -15.727 -0.571 35.019 1.00 12.21 C ATOM 430 C PHE A 58 -17.141 -1.022 35.430 1.00 12.42 C ATOM 431 O PHE A 58 -17.582 -2.149 35.268 1.00 12.32 O ATOM 432 CB PHE A 58 -15.867 -0.031 33.613 1.00 12.29 C ATOM 433 CG PHE A 58 -14.544 0.539 33.082 1.00 10.88 C ATOM 434 CD1 PHE A 58 -14.132 1.811 33.483 1.00 11.85 C ATOM 435 CD2 PHE A 58 -13.857 -0.161 32.097 1.00 9.22 C ATOM 436 CE1 PHE A 58 -12.949 2.335 32.960 1.00 12.42 C ATOM 437 CE2 PHE A 58 -12.665 0.358 31.561 1.00 9.85 C ATOM 438 CZ PHE A 58 -12.209 1.583 32.037 1.00 11.97 C ATOM 439 N ASP A 59 -17.846 -0.054 35.943 1.00 12.65 N ATOM 440 CA ASP A 59 -19.193 -0.380 36.320 1.00 14.72 C ATOM 441 C ASP A 59 -20.147 -0.104 35.188 1.00 14.76 C ATOM 442 O ASP A 59 -19.779 0.205 34.088 1.00 13.93 O ATOM 443 CB ASP A 59 -19.584 0.270 37.668 1.00 16.13 C ATOM 444 CG ASP A 59 -19.704 1.774 37.646 1.00 18.36 C ATOM 445 OD1 ASP A 59 -19.697 2.285 36.449 1.00 17.81 O ATOM 446 OD2 ASP A 59 -19.818 2.448 38.662 1.00 20.81 O ATOM 447 N ASP A 60 -21.420 -0.190 35.486 1.00 15.67 N ATOM 448 CA ASP A 60 -22.444 -0.059 34.468 1.00 16.06 C ATOM 449 C ASP A 60 -22.460 1.325 33.995 1.00 14.08 C ATOM 450 O ASP A 60 -22.938 1.584 32.923 1.00 15.30 O ATOM 451 CB ASP A 60 -23.896 -0.413 34.998 1.00 19.22 C ATOM 452 CG ASP A 60 -24.210 -1.897 35.050 1.00 23.16 C ATOM 453 OD1 ASP A 60 -23.457 -2.621 34.256 1.00 24.72 O ATOM 454 OD2 ASP A 60 -25.070 -2.375 35.766 1.00 24.51 O ATOM 455 N SER A 61 -21.976 2.185 34.819 1.00 12.84 N ATOM 456 CA SER A 61 -21.893 3.616 34.561 1.00 13.67 C ATOM 457 C SER A 61 -20.702 4.051 33.627 1.00 13.54 C ATOM 458 O SER A 61 -20.680 5.195 33.194 1.00 14.60 O ATOM 459 CB SER A 61 -21.438 4.221 35.853 1.00 16.55 C ATOM 460 OG SER A 61 -22.238 5.277 35.824 1.00 21.50 O ATOM 461 N GLY A 62 -19.690 3.181 33.445 1.00 11.85 N ATOM 462 CA GLY A 62 -18.492 3.493 32.648 1.00 12.21 C ATOM 463 C GLY A 62 -17.411 4.138 33.488 1.00 12.66 C ATOM 464 O GLY A 62 -16.501 4.844 33.026 1.00 12.09 O ATOM 465 N SER A 63 -17.520 3.854 34.771 1.00 11.86 N ATOM 466 CA SER A 63 -16.618 4.322 35.740 1.00 14.45 C ATOM 467 C SER A 63 -15.797 3.212 36.312 1.00 11.36 C ATOM 468 O SER A 63 -16.331 2.201 36.612 1.00 10.13 O ATOM 469 CB SER A 63 -17.421 4.952 36.817 1.00 20.69 C ATOM 470 OG SER A 63 -16.456 5.700 37.474 1.00 25.11 O ATOM 471 N GLY A 64 -14.485 3.425 36.488 1.00 10.47 N ATOM 472 CA GLY A 64 -13.655 2.331 36.987 1.00 10.93 C ATOM 473 C GLY A 64 -12.157 2.685 37.001 1.00 10.59 C ATOM 474 O GLY A 64 -11.786 3.822 37.341 1.00 10.97 O ATOM 475 N ILE A 65 -11.353 1.693 36.625 1.00 11.06 N ATOM 476 CA ILE A 65 -9.888 1.859 36.637 1.00 13.23 C ATOM 477 C ILE A 65 -9.157 0.800 35.828 1.00 10.63 C ATOM 478 O ILE A 65 -9.593 -0.344 35.760 1.00 9.05 O ATOM 479 CB ILE A 65 -9.376 1.790 38.090 1.00 16.94 C ATOM 480 CG1 ILE A 65 -7.881 2.097 38.155 1.00 20.12 C ATOM 481 CG2 ILE A 65 -9.648 0.387 38.620 1.00 16.96 C ATOM 482 CD1 ILE A 65 -7.593 3.614 38.188 1.00 21.86 C ATOM 483 N CYS A 66 -8.022 1.225 35.249 1.00 10.45 N ATOM 484 CA CYS A 66 -7.148 0.378 34.460 1.00 9.12 C ATOM 485 C CYS A 66 -5.755 0.454 35.059 1.00 8.62 C ATOM 486 O CYS A 66 -5.395 1.529 35.539 1.00 9.27 O ATOM 487 CB CYS A 66 -7.002 0.908 33.049 1.00 8.38 C ATOM 488 SG CYS A 66 -8.598 0.922 32.169 1.00 9.07 S ATOM 489 N LYS A 67 -5.040 -0.649 34.914 1.00 8.89 N ATOM 490 CA LYS A 67 -3.645 -0.816 35.399 1.00 12.02 C ATOM 491 C LYS A 67 -2.606 -0.072 34.606 1.00 11.85 C ATOM 492 O LYS A 67 -1.593 0.397 35.159 1.00 11.23 O ATOM 493 CB LYS A 67 -3.281 -2.244 35.580 1.00 16.68 C ATOM 494 CG LYS A 67 -3.951 -2.619 36.856 1.00 23.99 C ATOM 495 CD LYS A 67 -3.724 -4.044 37.141 1.00 31.41 C ATOM 496 CE LYS A 67 -3.989 -4.279 38.619 1.00 37.66 C ATOM 497 NZ LYS A 67 -4.553 -5.620 38.838 1.00 40.20 N ATOM 498 N THR A 68 -2.878 0.021 33.294 1.00 9.91 N ATOM 499 CA THR A 68 -2.021 0.852 32.466 1.00 9.57 C ATOM 500 C THR A 68 -2.922 1.709 31.611 1.00 9.75 C ATOM 501 O THR A 68 -4.037 1.255 31.238 1.00 9.95 O ATOM 502 CB THR A 68 -1.075 0.058 31.547 1.00 9.61 C ATOM 503 OG1 THR A 68 -1.781 -0.688 30.555 1.00 9.66 O ATOM 504 CG2 THR A 68 -0.232 -0.824 32.430 1.00 8.91 C ATOM 505 N GLY A 69 -2.468 2.943 31.402 1.00 6.93 N ATOM 506 CA GLY A 69 -3.109 3.934 30.590 1.00 8.33 C ATOM 507 C GLY A 69 -4.430 4.484 31.086 1.00 9.35 C ATOM 508 O GLY A 69 -5.171 5.037 30.258 1.00 7.88 O ATOM 509 N ASP A 70 -4.688 4.423 32.411 1.00 9.60 N ATOM 510 CA ASP A 70 -6.009 4.961 32.820 1.00 9.02 C ATOM 511 C ASP A 70 -6.238 6.422 32.464 1.00 9.97 C ATOM 512 O ASP A 70 -5.325 7.222 32.639 1.00 10.04 O ATOM 513 CB ASP A 70 -6.153 4.722 34.294 1.00 9.71 C ATOM 514 CG ASP A 70 -7.558 5.068 34.774 1.00 11.53 C ATOM 515 OD1 ASP A 70 -8.495 4.181 34.562 1.00 13.14 O ATOM 516 OD2 ASP A 70 -7.774 6.096 35.262 1.00 13.38 O ATOM 517 N CYS A 71 -7.428 6.810 31.943 1.00 8.58 N ATOM 518 CA CYS A 71 -7.698 8.198 31.616 1.00 8.99 C ATOM 519 C CYS A 71 -8.761 8.709 32.588 1.00 11.90 C ATOM 520 O CYS A 71 -9.984 8.712 32.305 1.00 12.24 O ATOM 521 CB CYS A 71 -8.249 8.384 30.175 1.00 8.15 C ATOM 522 SG CYS A 71 -9.726 7.347 29.898 1.00 8.17 S ATOM 523 N GLY A 72 -8.313 9.056 33.793 1.00 12.28 N ATOM 524 CA GLY A 72 -9.219 9.584 34.778 1.00 12.64 C ATOM 525 C GLY A 72 -10.401 8.668 35.159 1.00 11.71 C ATOM 526 O GLY A 72 -11.499 9.148 35.531 1.00 11.94 O ATOM 527 N GLY A 73 -10.177 7.380 35.103 1.00 10.30 N ATOM 528 CA GLY A 73 -11.250 6.527 35.582 1.00 13.42 C ATOM 529 C GLY A 73 -12.427 6.321 34.661 1.00 13.22 C ATOM 530 O GLY A 73 -13.425 5.750 35.114 1.00 13.33 O ATOM 531 N LEU A 74 -12.286 6.710 33.406 1.00 9.85 N ATOM 532 CA LEU A 74 -13.389 6.516 32.537 1.00 9.21 C ATOM 533 C LEU A 74 -13.159 5.488 31.507 1.00 9.76 C ATOM 534 O LEU A 74 -12.074 5.186 31.035 1.00 9.76 O ATOM 535 CB LEU A 74 -13.639 7.780 31.750 1.00 10.84 C ATOM 536 CG LEU A 74 -13.971 8.945 32.678 1.00 15.27 C ATOM 537 CD1 LEU A 74 -14.036 10.188 31.806 1.00 17.43 C ATOM 538 CD2 LEU A 74 -15.353 8.760 33.319 1.00 16.35 C ATOM 539 N LEU A 75 -14.239 4.920 31.087 1.00 9.90 N ATOM 540 CA LEU A 75 -14.199 3.961 30.022 1.00 10.35 C ATOM 541 C LEU A 75 -14.039 4.755 28.737 1.00 10.67 C ATOM 542 O LEU A 75 -13.222 4.431 27.901 1.00 11.12 O ATOM 543 CB LEU A 75 -15.561 3.258 29.911 1.00 10.94 C ATOM 544 CG LEU A 75 -15.745 2.419 28.629 1.00 11.78 C ATOM 545 CD1 LEU A 75 -14.696 1.297 28.485 1.00 10.61 C ATOM 546 CD2 LEU A 75 -17.198 1.872 28.657 1.00 13.39 C ATOM 547 N ARG A 76 -14.864 5.803 28.608 1.00 11.35 N ATOM 548 CA ARG A 76 -14.846 6.633 27.412 1.00 11.60 C ATOM 549 C ARG A 76 -13.840 7.729 27.562 1.00 9.97 C ATOM 550 O ARG A 76 -14.129 8.751 28.146 1.00 10.72 O ATOM 551 CB ARG A 76 -16.261 7.121 27.220 1.00 13.80 C ATOM 552 CG ARG A 76 -16.991 6.246 26.287 1.00 17.32 C ATOM 553 CD ARG A 76 -18.012 5.325 26.837 1.00 20.91 C ATOM 554 NE ARG A 76 -17.918 4.369 25.792 1.00 22.93 N ATOM 555 CZ ARG A 76 -18.506 3.234 25.425 1.00 24.54 C ATOM 556 NH1 ARG A 76 -17.969 2.688 24.298 1.00 24.88 N ATOM 557 NH2 ARG A 76 -19.537 2.608 25.999 1.00 24.46 N ATOM 558 N CYS A 77 -12.591 7.565 27.104 1.00 8.62 N ATOM 559 CA CYS A 77 -11.579 8.621 27.392 1.00 10.88 C ATOM 560 C CYS A 77 -11.797 10.001 26.837 1.00 13.63 C ATOM 561 O CYS A 77 -12.039 10.124 25.647 1.00 15.78 O ATOM 562 CB CYS A 77 -10.100 8.198 27.079 1.00 9.43 C ATOM 563 SG CYS A 77 -9.609 6.776 28.063 1.00 9.25 S ATOM 564 N LYS A 78 -11.635 11.035 27.650 1.00 13.47 N ATOM 565 CA LYS A 78 -11.736 12.402 27.167 1.00 16.39 C ATOM 566 C LYS A 78 -10.321 13.031 27.115 1.00 15.58 C ATOM 567 O LYS A 78 -9.959 13.806 26.253 1.00 17.92 O ATOM 568 CB LYS A 78 -12.693 13.147 28.137 1.00 25.55 C ATOM 569 CG LYS A 78 -13.170 14.541 27.800 1.00 39.40 C ATOM 570 CD LYS A 78 -12.188 15.756 27.907 1.00 51.81 C ATOM 571 CE LYS A 78 -11.189 15.860 29.115 1.00 60.24 C ATOM 572 NZ LYS A 78 -11.549 16.658 30.358 1.00 62.84 N ATOM 573 N ARG A 79 -9.495 12.599 28.027 1.00 13.30 N ATOM 574 CA ARG A 79 -8.176 13.041 28.227 1.00 15.67 C ATOM 575 C ARG A 79 -7.137 11.904 28.046 1.00 12.08 C ATOM 576 O ARG A 79 -7.505 10.741 27.799 1.00 11.69 O ATOM 577 CB ARG A 79 -8.215 13.798 29.538 1.00 27.76 C ATOM 578 CG ARG A 79 -6.971 13.565 30.355 1.00 42.22 C ATOM 579 CD ARG A 79 -6.843 14.520 31.555 1.00 55.24 C ATOM 580 NE ARG A 79 -7.327 13.857 32.796 1.00 64.61 N ATOM 581 CZ ARG A 79 -6.706 13.741 33.998 1.00 70.08 C ATOM 582 NH1 ARG A 79 -5.471 14.249 34.289 1.00 71.32 N ATOM 583 NH2 ARG A 79 -7.376 13.070 34.942 1.00 70.65 N ATOM 584 N PHE A 80 -5.831 12.208 28.116 1.00 9.98 N ATOM 585 CA PHE A 80 -4.743 11.216 27.876 1.00 9.66 C ATOM 586 C PHE A 80 -4.558 10.285 29.038 1.00 10.75 C ATOM 587 O PHE A 80 -4.995 10.630 30.131 1.00 13.72 O ATOM 588 CB PHE A 80 -3.453 11.929 27.526 1.00 10.08 C ATOM 589 CG PHE A 80 -3.519 12.588 26.174 1.00 10.83 C ATOM 590 CD1 PHE A 80 -4.152 11.971 25.097 1.00 11.87 C ATOM 591 CD2 PHE A 80 -2.935 13.840 25.976 1.00 12.02 C ATOM 592 CE1 PHE A 80 -4.235 12.625 23.869 1.00 13.16 C ATOM 593 CE2 PHE A 80 -2.982 14.507 24.751 1.00 12.37 C ATOM 594 CZ PHE A 80 -3.614 13.869 23.692 1.00 13.20 C ATOM 595 N GLY A 81 -3.972 9.128 28.861 1.00 9.39 N ATOM 596 CA GLY A 81 -3.887 8.196 29.978 1.00 11.34 C ATOM 597 C GLY A 81 -2.592 8.222 30.752 1.00 11.39 C ATOM 598 O GLY A 81 -1.608 8.804 30.290 1.00 10.07 O ATOM 599 N ARG A 82 -2.624 7.560 31.911 1.00 11.97 N ATOM 600 CA ARG A 82 -1.429 7.488 32.766 1.00 12.01 C ATOM 601 C ARG A 82 -0.422 6.509 32.169 1.00 10.38 C ATOM 602 O ARG A 82 -0.777 5.426 31.746 1.00 9.73 O ATOM 603 CB ARG A 82 -1.717 6.836 34.089 1.00 18.80 C ATOM 604 CG ARG A 82 -2.188 7.787 35.161 1.00 29.61 C ATOM 605 CD ARG A 82 -2.069 7.332 36.655 1.00 38.78 C ATOM 606 NE ARG A 82 -2.480 5.971 37.069 1.00 46.89 N ATOM 607 CZ ARG A 82 -3.731 5.522 37.446 1.00 53.89 C ATOM 608 NH1 ARG A 82 -4.851 6.275 37.416 1.00 55.96 N ATOM 609 NH2 ARG A 82 -3.884 4.244 37.825 1.00 55.13 N ATOM 610 N PRO A 83 0.890 6.807 32.226 1.00 9.98 N ATOM 611 CA PRO A 83 1.907 5.887 31.765 1.00 9.62 C ATOM 612 C PRO A 83 1.908 4.649 32.604 1.00 10.08 C ATOM 613 O PRO A 83 1.429 4.622 33.728 1.00 10.35 O ATOM 614 CB PRO A 83 3.249 6.634 31.967 1.00 10.44 C ATOM 615 CG PRO A 83 2.906 8.120 31.930 1.00 11.90 C ATOM 616 CD PRO A 83 1.437 8.193 32.421 1.00 12.28 C ATOM 617 N PRO A 84 2.441 3.571 32.087 1.00 10.17 N ATOM 618 CA PRO A 84 3.117 3.462 30.785 1.00 9.93 C ATOM 619 C PRO A 84 2.139 3.177 29.669 1.00 8.99 C ATOM 620 O PRO A 84 1.271 2.304 29.792 1.00 10.44 O ATOM 621 CB PRO A 84 3.987 2.171 30.945 1.00 9.82 C ATOM 622 CG PRO A 84 3.331 1.330 32.054 1.00 7.95 C ATOM 623 CD PRO A 84 2.414 2.304 32.830 1.00 7.20 C ATOM 624 N THR A 85 2.351 3.823 28.556 1.00 7.58 N ATOM 625 CA THR A 85 1.493 3.595 27.422 1.00 6.47 C ATOM 626 C THR A 85 2.246 3.809 26.148 1.00 4.97 C ATOM 627 O THR A 85 2.735 4.892 25.925 1.00 6.57 O ATOM 628 CB THR A 85 0.432 4.751 27.336 1.00 9.02 C ATOM 629 OG1 THR A 85 1.097 6.006 27.448 1.00 9.91 O ATOM 630 CG2 THR A 85 -0.675 4.625 28.406 1.00 10.00 C ATOM 631 N THR A 86 2.220 2.797 25.338 1.00 3.87 N ATOM 632 CA THR A 86 2.780 2.853 24.000 1.00 5.93 C ATOM 633 C THR A 86 1.842 3.779 23.254 1.00 7.54 C ATOM 634 O THR A 86 0.622 3.613 23.390 1.00 8.97 O ATOM 635 CB THR A 86 2.711 1.464 23.325 1.00 5.89 C ATOM 636 OG1 THR A 86 3.311 0.501 24.112 1.00 5.76 O ATOM 637 CG2 THR A 86 3.520 1.591 22.076 1.00 5.76 C ATOM 638 N LEU A 87 2.326 4.795 22.552 1.00 6.23 N ATOM 639 CA LEU A 87 1.401 5.669 21.904 1.00 6.72 C ATOM 640 C LEU A 87 1.441 5.736 20.374 1.00 7.75 C ATOM 641 O LEU A 87 2.514 5.889 19.768 1.00 7.31 O ATOM 642 CB LEU A 87 1.594 7.124 22.389 1.00 7.56 C ATOM 643 CG LEU A 87 1.367 7.345 23.903 1.00 8.25 C ATOM 644 CD1 LEU A 87 2.034 8.684 24.319 1.00 8.76 C ATOM 645 CD2 LEU A 87 -0.150 7.325 24.222 1.00 7.47 C ATOM 646 N ALA A 88 0.218 5.748 19.738 1.00 8.00 N ATOM 647 CA ALA A 88 0.115 5.981 18.292 1.00 6.50 C ATOM 648 C ALA A 88 -0.259 7.450 18.257 1.00 6.03 C ATOM 649 O ALA A 88 -1.210 7.871 18.884 1.00 7.36 O ATOM 650 CB ALA A 88 -1.036 5.133 17.681 1.00 3.66 C ATOM 651 N GLU A 89 0.505 8.278 17.608 1.00 3.79 N ATOM 652 CA GLU A 89 0.247 9.703 17.616 1.00 4.90 C ATOM 653 C GLU A 89 0.007 10.219 16.189 1.00 6.48 C ATOM 654 O GLU A 89 0.731 9.808 15.282 1.00 4.86 O ATOM 655 CB GLU A 89 1.470 10.491 18.165 1.00 6.21 C ATOM 656 CG GLU A 89 1.811 9.996 19.617 1.00 8.57 C ATOM 657 CD GLU A 89 2.961 10.734 20.230 1.00 11.41 C ATOM 658 OE1 GLU A 89 4.010 10.936 19.674 1.00 9.71 O ATOM 659 OE2 GLU A 89 2.746 11.120 21.440 1.00 13.89 O ATOM 660 N PHE A 90 -0.928 11.203 16.051 1.00 6.25 N ATOM 661 CA PHE A 90 -1.109 11.711 14.698 1.00 7.72 C ATOM 662 C PHE A 90 -1.627 13.120 14.637 1.00 7.33 C ATOM 663 O PHE A 90 -2.370 13.559 15.520 1.00 8.94 O ATOM 664 CB PHE A 90 -2.097 10.800 13.935 1.00 7.94 C ATOM 665 CG PHE A 90 -3.301 10.481 14.789 1.00 9.10 C ATOM 666 CD1 PHE A 90 -3.276 9.416 15.679 1.00 9.37 C ATOM 667 CD2 PHE A 90 -4.459 11.260 14.705 1.00 11.62 C ATOM 668 CE1 PHE A 90 -4.415 9.095 16.417 1.00 11.87 C ATOM 669 CE2 PHE A 90 -5.577 10.978 15.499 1.00 11.18 C ATOM 670 CZ PHE A 90 -5.559 9.877 16.337 1.00 11.07 C ATOM 671 N SER A 91 -1.237 13.847 13.594 1.00 4.23 N ATOM 672 CA SER A 91 -1.806 15.153 13.330 1.00 6.00 C ATOM 673 C SER A 91 -2.245 15.088 11.875 1.00 7.15 C ATOM 674 O SER A 91 -1.398 14.766 11.047 1.00 6.65 O ATOM 675 CB SER A 91 -0.872 16.329 13.567 1.00 11.08 C ATOM 676 OG SER A 91 -0.598 16.330 14.993 1.00 13.65 O ATOM 677 N LEU A 92 -3.498 15.383 11.554 1.00 8.26 N ATOM 678 CA LEU A 92 -3.949 15.162 10.173 1.00 9.24 C ATOM 679 C LEU A 92 -4.245 16.417 9.399 1.00 7.67 C ATOM 680 O LEU A 92 -4.690 17.396 9.966 1.00 8.05 O ATOM 681 CB LEU A 92 -5.288 14.350 10.258 1.00 11.02 C ATOM 682 CG LEU A 92 -5.259 13.065 11.101 1.00 12.92 C ATOM 683 CD1 LEU A 92 -6.686 12.516 11.259 1.00 14.32 C ATOM 684 CD2 LEU A 92 -4.314 12.014 10.513 1.00 12.20 C ATOM 685 N ASN A 93 -4.073 16.354 8.084 1.00 7.26 N ATOM 686 CA ASN A 93 -4.406 17.534 7.274 1.00 9.70 C ATOM 687 C ASN A 93 -3.736 18.797 7.712 1.00 9.77 C ATOM 688 O ASN A 93 -4.398 19.851 7.891 1.00 9.48 O ATOM 689 CB ASN A 93 -5.941 17.774 7.239 1.00 10.97 C ATOM 690 CG ASN A 93 -6.711 16.496 6.959 1.00 12.77 C ATOM 691 OD1 ASN A 93 -6.803 16.043 5.761 1.00 15.86 O ATOM 692 ND2 ASN A 93 -7.270 15.902 7.984 1.00 11.94 N ATOM 693 N GLN A 94 -2.419 18.684 7.905 1.00 9.27 N ATOM 694 CA GLN A 94 -1.660 19.842 8.336 1.00 9.31 C ATOM 695 C GLN A 94 -0.968 20.345 7.082 1.00 9.87 C ATOM 696 O GLN A 94 -0.004 19.759 6.607 1.00 9.93 O ATOM 697 CB GLN A 94 -0.601 19.356 9.317 1.00 9.94 C ATOM 698 CG GLN A 94 -1.193 18.746 10.602 1.00 9.61 C ATOM 699 CD GLN A 94 -2.046 19.759 11.275 1.00 10.75 C ATOM 700 OE1 GLN A 94 -1.558 20.798 11.745 1.00 9.14 O ATOM 701 NE2 GLN A 94 -3.385 19.522 11.284 1.00 12.69 N ATOM 702 N TYR A 95 -1.465 21.385 6.505 1.00 10.62 N ATOM 703 CA TYR A 95 -0.835 21.850 5.300 1.00 11.81 C ATOM 704 C TYR A 95 -0.695 20.760 4.212 1.00 13.60 C ATOM 705 O TYR A 95 0.334 20.679 3.546 1.00 16.61 O ATOM 706 CB TYR A 95 0.409 22.715 5.549 1.00 10.85 C ATOM 707 CG TYR A 95 -0.041 24.105 5.869 1.00 10.67 C ATOM 708 CD1 TYR A 95 -0.299 25.066 4.889 1.00 11.80 C ATOM 709 CD2 TYR A 95 -0.275 24.472 7.193 1.00 9.99 C ATOM 710 CE1 TYR A 95 -0.766 26.351 5.198 1.00 11.41 C ATOM 711 CE2 TYR A 95 -0.759 25.737 7.537 1.00 9.40 C ATOM 712 CZ TYR A 95 -0.968 26.680 6.537 1.00 10.15 C ATOM 713 OH TYR A 95 -1.374 27.919 6.875 1.00 10.96 O ATOM 714 N GLY A 96 -1.723 19.891 4.078 1.00 10.17 N ATOM 715 CA GLY A 96 -1.830 18.902 3.075 1.00 8.48 C ATOM 716 C GLY A 96 -1.213 17.607 3.417 1.00 10.30 C ATOM 717 O GLY A 96 -1.228 16.731 2.565 1.00 11.31 O ATOM 718 N LYS A 97 -0.629 17.448 4.625 1.00 8.97 N ATOM 719 CA LYS A 97 -0.056 16.159 4.915 1.00 9.44 C ATOM 720 C LYS A 97 -0.522 15.661 6.261 1.00 9.11 C ATOM 721 O LYS A 97 -0.912 16.483 7.107 1.00 10.66 O ATOM 722 CB LYS A 97 1.439 16.308 5.095 1.00 13.90 C ATOM 723 CG LYS A 97 2.145 16.934 3.912 1.00 22.21 C ATOM 724 CD LYS A 97 2.189 16.016 2.726 1.00 32.03 C ATOM 725 CE LYS A 97 2.644 16.725 1.430 1.00 41.35 C ATOM 726 NZ LYS A 97 2.843 18.217 1.542 1.00 45.84 N ATOM 727 N ASP A 98 -0.422 14.335 6.435 1.00 7.40 N ATOM 728 CA ASP A 98 -0.697 13.701 7.716 1.00 8.21 C ATOM 729 C ASP A 98 0.698 13.299 8.308 1.00 8.61 C ATOM 730 O ASP A 98 1.623 12.902 7.578 1.00 8.85 O ATOM 731 CB ASP A 98 -1.496 12.390 7.510 1.00 9.04 C ATOM 732 CG ASP A 98 -2.974 12.629 7.112 1.00 8.31 C ATOM 733 OD1 ASP A 98 -3.453 13.733 7.065 1.00 8.18 O ATOM 734 OD2 ASP A 98 -3.628 11.535 6.921 1.00 8.89 O ATOM 735 N TYR A 99 0.857 13.447 9.616 1.00 7.85 N ATOM 736 CA TYR A 99 2.128 13.096 10.334 1.00 8.70 C ATOM 737 C TYR A 99 1.824 12.076 11.410 1.00 9.01 C ATOM 738 O TYR A 99 0.934 12.336 12.267 1.00 9.35 O ATOM 739 CB TYR A 99 2.653 14.369 11.013 1.00 7.85 C ATOM 740 CG TYR A 99 3.059 15.385 9.990 1.00 9.02 C ATOM 741 CD1 TYR A 99 2.174 16.340 9.483 1.00 10.62 C ATOM 742 CD2 TYR A 99 4.381 15.409 9.558 1.00 9.47 C ATOM 743 CE1 TYR A 99 2.608 17.282 8.547 1.00 12.21 C ATOM 744 CE2 TYR A 99 4.838 16.349 8.637 1.00 11.11 C ATOM 745 CZ TYR A 99 3.950 17.310 8.172 1.00 12.89 C ATOM 746 OH TYR A 99 4.367 18.223 7.238 1.00 13.34 O ATOM 747 N ILE A 100 2.476 10.924 11.347 1.00 6.86 N ATOM 748 CA ILE A 100 2.208 9.868 12.266 1.00 6.47 C ATOM 749 C ILE A 100 3.467 9.378 12.866 1.00 7.56 C ATOM 750 O ILE A 100 4.539 9.544 12.299 1.00 7.87 O ATOM 751 CB ILE A 100 1.455 8.645 11.710 1.00 7.53 C ATOM 752 CG1 ILE A 100 2.280 7.868 10.702 1.00 7.57 C ATOM 753 CG2 ILE A 100 0.152 9.064 10.990 1.00 8.44 C ATOM 754 CD1 ILE A 100 1.709 6.470 10.471 1.00 9.54 C ATOM 755 N ASP A 101 3.314 8.770 14.061 1.00 6.10 N ATOM 756 CA ASP A 101 4.470 8.272 14.738 1.00 4.98 C ATOM 757 C ASP A 101 4.018 7.387 15.868 1.00 6.72 C ATOM 758 O ASP A 101 2.852 7.409 16.302 1.00 4.59 O ATOM 759 CB ASP A 101 5.398 9.405 15.255 1.00 5.65 C ATOM 760 CG ASP A 101 4.879 10.184 16.478 1.00 8.34 C ATOM 761 OD1 ASP A 101 4.917 9.570 17.675 1.00 8.54 O ATOM 762 OD2 ASP A 101 4.332 11.254 16.385 1.00 9.00 O ATOM 763 N ILE A 102 4.980 6.576 16.369 1.00 7.17 N ATOM 764 CA ILE A 102 4.803 5.803 17.602 1.00 6.82 C ATOM 765 C ILE A 102 5.771 6.386 18.624 1.00 6.09 C ATOM 766 O ILE A 102 6.901 6.701 18.243 1.00 5.81 O ATOM 767 CB ILE A 102 5.069 4.346 17.442 1.00 6.97 C ATOM 768 CG1 ILE A 102 3.910 3.764 16.627 1.00 7.17 C ATOM 769 CG2 ILE A 102 5.118 3.765 18.874 1.00 8.22 C ATOM 770 CD1 ILE A 102 4.246 2.316 16.318 1.00 8.20 C ATOM 771 N SER A 103 5.356 6.564 19.857 1.00 5.18 N ATOM 772 CA SER A 103 6.216 7.130 20.851 1.00 5.76 C ATOM 773 C SER A 103 6.298 6.232 22.078 1.00 8.78 C ATOM 774 O SER A 103 5.265 5.670 22.514 1.00 9.84 O ATOM 775 CB SER A 103 5.677 8.482 21.259 1.00 7.37 C ATOM 776 OG SER A 103 6.296 8.998 22.393 1.00 9.32 O ATOM 777 N ASN A 104 7.530 6.140 22.664 1.00 8.01 N ATOM 778 CA ASN A 104 7.773 5.439 23.920 1.00 8.41 C ATOM 779 C ASN A 104 8.146 6.451 24.964 1.00 7.55 C ATOM 780 O ASN A 104 8.626 6.076 26.043 1.00 9.21 O ATOM 781 CB ASN A 104 8.899 4.428 23.797 1.00 10.15 C ATOM 782 CG ASN A 104 8.514 3.198 23.005 1.00 12.10 C ATOM 783 OD1 ASN A 104 9.341 2.670 22.192 1.00 12.76 O ATOM 784 ND2 ASN A 104 7.331 2.652 23.271 1.00 11.89 N ATOM 785 N ILE A 105 7.858 7.729 24.702 1.00 6.57 N ATOM 786 CA ILE A 105 8.157 8.792 25.599 1.00 7.76 C ATOM 787 C ILE A 105 7.406 8.647 26.879 1.00 8.46 C ATOM 788 O ILE A 105 7.908 9.089 27.887 1.00 9.16 O ATOM 789 CB ILE A 105 7.972 10.135 24.973 1.00 10.71 C ATOM 790 CG1 ILE A 105 9.068 10.302 23.912 1.00 11.54 C ATOM 791 CG2 ILE A 105 8.007 11.281 25.978 1.00 11.98 C ATOM 792 CD1 ILE A 105 8.725 11.500 23.042 1.00 12.21 C ATOM 793 N LYS A 106 6.199 8.026 26.851 1.00 9.30 N ATOM 794 CA LYS A 106 5.395 7.759 28.088 1.00 10.18 C ATOM 795 C LYS A 106 5.436 6.320 28.461 1.00 9.00 C ATOM 796 O LYS A 106 4.487 5.795 29.000 1.00 9.53 O ATOM 797 CB LYS A 106 3.925 8.087 27.887 1.00 13.80 C ATOM 798 CG LYS A 106 3.792 9.554 27.646 1.00 18.87 C ATOM 799 CD LYS A 106 4.102 10.165 28.976 1.00 24.33 C ATOM 800 CE LYS A 106 3.660 11.603 29.094 1.00 30.12 C ATOM 801 NZ LYS A 106 4.810 12.519 29.134 1.00 32.96 N ATOM 802 N GLY A 107 6.512 5.638 28.090 1.00 7.64 N ATOM 803 CA GLY A 107 6.646 4.225 28.437 1.00 7.21 C ATOM 804 C GLY A 107 6.036 3.331 27.400 1.00 9.15 C ATOM 805 O GLY A 107 5.577 3.762 26.352 1.00 10.60 O ATOM 806 N PHE A 108 5.992 2.063 27.715 1.00 8.10 N ATOM 807 CA PHE A 108 5.420 1.100 26.788 1.00 8.35 C ATOM 808 C PHE A 108 4.558 0.101 27.566 1.00 8.78 C ATOM 809 O PHE A 108 4.923 -0.314 28.718 1.00 9.34 O ATOM 810 CB PHE A 108 6.640 0.343 26.209 1.00 8.60 C ATOM 811 CG PHE A 108 6.351 -0.794 25.282 1.00 8.62 C ATOM 812 CD1 PHE A 108 6.089 -2.067 25.809 1.00 9.17 C ATOM 813 CD2 PHE A 108 6.279 -0.564 23.895 1.00 7.32 C ATOM 814 CE1 PHE A 108 5.769 -3.161 24.990 1.00 11.03 C ATOM 815 CE2 PHE A 108 6.005 -1.657 23.068 1.00 8.56 C ATOM 816 CZ PHE A 108 5.764 -2.931 23.606 1.00 10.97 C ATOM 817 N ASN A 109 3.401 -0.290 27.004 1.00 6.84 N ATOM 818 CA ASN A 109 2.629 -1.295 27.663 1.00 6.08 C ATOM 819 C ASN A 109 2.288 -2.412 26.711 1.00 6.38 C ATOM 820 O ASN A 109 2.435 -3.624 27.023 1.00 8.10 O ATOM 821 CB ASN A 109 1.395 -0.731 28.410 1.00 6.55 C ATOM 822 CG ASN A 109 0.303 -0.101 27.471 1.00 8.41 C ATOM 823 OD1 ASN A 109 -0.884 0.111 27.955 1.00 10.50 O ATOM 824 ND2 ASN A 109 0.667 0.293 26.237 1.00 3.34 N ATOM 825 N VAL A 110 1.864 -2.058 25.478 1.00 5.52 N ATOM 826 CA VAL A 110 1.450 -3.086 24.577 1.00 6.34 C ATOM 827 C VAL A 110 2.134 -2.848 23.245 1.00 7.87 C ATOM 828 O VAL A 110 2.272 -1.670 22.884 1.00 10.21 O ATOM 829 CB VAL A 110 -0.095 -2.943 24.404 1.00 7.44 C ATOM 830 CG1 VAL A 110 -0.557 -3.834 23.288 1.00 9.42 C ATOM 831 CG2 VAL A 110 -0.852 -3.359 25.668 1.00 7.37 C ATOM 832 N PRO A 111 2.536 -3.937 22.528 1.00 7.72 N ATOM 833 CA PRO A 111 3.198 -3.819 21.254 1.00 6.86 C ATOM 834 C PRO A 111 2.203 -3.293 20.258 1.00 8.00 C ATOM 835 O PRO A 111 1.002 -3.550 20.402 1.00 10.75 O ATOM 836 CB PRO A 111 3.627 -5.181 20.825 1.00 8.01 C ATOM 837 CG PRO A 111 2.943 -6.149 21.735 1.00 8.73 C ATOM 838 CD PRO A 111 2.538 -5.346 22.970 1.00 8.59 C ATOM 839 N MET A 112 2.700 -2.533 19.270 1.00 8.36 N ATOM 840 CA MET A 112 1.801 -1.900 18.347 1.00 9.06 C ATOM 841 C MET A 112 2.379 -1.691 16.975 1.00 8.48 C ATOM 842 O MET A 112 3.573 -1.382 16.834 1.00 6.74 O ATOM 843 CB MET A 112 1.540 -0.510 19.026 1.00 10.48 C ATOM 844 CG MET A 112 0.778 0.498 18.229 1.00 13.09 C ATOM 845 SD MET A 112 0.849 2.150 18.948 1.00 13.98 S ATOM 846 CE MET A 112 -0.332 2.023 20.316 1.00 13.61 C ATOM 847 N ASP A 113 1.476 -1.804 15.965 1.00 7.82 N ATOM 848 CA ASP A 113 1.841 -1.442 14.595 1.00 7.66 C ATOM 849 C ASP A 113 0.904 -0.310 14.194 1.00 9.58 C ATOM 850 O ASP A 113 -0.300 -0.444 14.467 1.00 9.65 O ATOM 851 CB ASP A 113 1.587 -2.599 13.657 1.00 8.38 C ATOM 852 CG ASP A 113 1.949 -2.169 12.242 1.00 10.37 C ATOM 853 OD1 ASP A 113 1.108 -1.637 11.519 1.00 12.21 O ATOM 854 OD2 ASP A 113 3.141 -2.408 11.818 1.00 8.76 O ATOM 855 N PHE A 114 1.417 0.798 13.614 1.00 8.24 N ATOM 856 CA PHE A 114 0.619 1.917 13.173 1.00 7.61 C ATOM 857 C PHE A 114 0.931 2.118 11.695 1.00 8.54 C ATOM 858 O PHE A 114 2.017 2.583 11.339 1.00 7.51 O ATOM 859 CB PHE A 114 0.957 3.132 14.028 1.00 7.12 C ATOM 860 CG PHE A 114 0.134 4.381 13.796 1.00 6.79 C ATOM 861 CD1 PHE A 114 -1.055 4.383 13.041 1.00 8.82 C ATOM 862 CD2 PHE A 114 0.567 5.600 14.343 1.00 7.14 C ATOM 863 CE1 PHE A 114 -1.756 5.582 12.802 1.00 9.41 C ATOM 864 CE2 PHE A 114 -0.163 6.787 14.154 1.00 5.66 C ATOM 865 CZ PHE A 114 -1.345 6.780 13.404 1.00 7.09 C ATOM 866 N SER A 115 -0.033 1.687 10.797 1.00 8.41 N ATOM 867 CA SER A 115 0.209 1.741 9.390 1.00 8.03 C ATOM 868 C SER A 115 -0.939 2.365 8.636 1.00 8.72 C ATOM 869 O SER A 115 -2.086 2.261 9.059 1.00 10.24 O ATOM 870 CB SER A 115 0.241 0.314 8.907 1.00 9.91 C ATOM 871 OG SER A 115 1.457 -0.294 9.287 1.00 11.47 O ATOM 872 N PRO A 116 -0.612 2.953 7.505 1.00 7.52 N ATOM 873 CA PRO A 116 -1.617 3.541 6.616 1.00 8.01 C ATOM 874 C PRO A 116 -2.357 2.401 5.923 1.00 8.69 C ATOM 875 O PRO A 116 -1.788 1.305 5.698 1.00 8.01 O ATOM 876 CB PRO A 116 -0.753 4.275 5.556 1.00 9.51 C ATOM 877 CG PRO A 116 0.631 3.619 5.604 1.00 8.78 C ATOM 878 CD PRO A 116 0.801 3.169 7.026 1.00 7.74 C ATOM 879 N THR A 117 -3.643 2.614 5.561 1.00 8.62 N ATOM 880 CA THR A 117 -4.392 1.564 4.852 1.00 7.91 C ATOM 881 C THR A 117 -4.601 2.110 3.459 1.00 8.56 C ATOM 882 O THR A 117 -5.253 1.488 2.586 1.00 8.61 O ATOM 883 CB THR A 117 -5.726 1.213 5.527 1.00 7.40 C ATOM 884 OG1 THR A 117 -6.461 2.416 5.748 1.00 7.55 O ATOM 885 CG2 THR A 117 -5.480 0.474 6.870 1.00 7.91 C ATOM 886 N THR A 118 -4.014 3.305 3.258 1.00 9.01 N ATOM 887 CA THR A 118 -4.067 4.003 1.970 1.00 11.39 C ATOM 888 C THR A 118 -2.662 4.055 1.393 1.00 12.17 C ATOM 889 O THR A 118 -1.740 3.639 2.063 1.00 13.13 O ATOM 890 CB THR A 118 -4.852 5.361 1.994 1.00 12.24 C ATOM 891 OG1 THR A 118 -4.382 6.131 3.105 1.00 12.55 O ATOM 892 CG2 THR A 118 -6.342 5.096 2.191 1.00 11.94 C ATOM 893 N ARG A 119 -2.482 4.580 0.199 1.00 12.19 N ATOM 894 CA ARG A 119 -1.168 4.552 -0.403 1.00 13.70 C ATOM 895 C ARG A 119 -0.258 5.687 -0.052 1.00 12.45 C ATOM 896 O ARG A 119 -0.682 6.736 0.402 1.00 12.45 O ATOM 897 CB ARG A 119 -1.409 4.572 -1.901 1.00 19.02 C ATOM 898 CG ARG A 119 -1.552 3.176 -2.512 1.00 27.23 C ATOM 899 CD ARG A 119 -1.776 3.371 -4.009 1.00 35.74 C ATOM 900 NE ARG A 119 -2.744 4.469 -4.028 1.00 43.10 N ATOM 901 CZ ARG A 119 -3.359 5.048 -5.054 1.00 48.48 C ATOM 902 NH1 ARG A 119 -3.131 4.674 -6.306 1.00 50.73 N ATOM 903 NH2 ARG A 119 -4.228 6.045 -4.820 1.00 48.55 N ATOM 904 N GLY A 120 1.062 5.517 -0.288 1.00 12.34 N ATOM 905 CA GLY A 120 1.944 6.664 -0.167 1.00 11.50 C ATOM 906 C GLY A 120 2.890 6.839 0.976 1.00 11.17 C ATOM 907 O GLY A 120 3.563 7.834 0.977 1.00 12.72 O ATOM 908 N CYS A 121 2.917 5.969 1.954 1.00 9.79 N ATOM 909 CA CYS A 121 3.850 6.183 3.052 1.00 10.18 C ATOM 910 C CYS A 121 3.987 4.863 3.760 1.00 11.50 C ATOM 911 O CYS A 121 3.213 3.949 3.475 1.00 12.62 O ATOM 912 CB CYS A 121 3.407 7.289 4.045 1.00 11.52 C ATOM 913 SG CYS A 121 1.684 7.037 4.526 1.00 12.25 S ATOM 914 N ARG A 122 4.979 4.756 4.649 1.00 13.03 N ATOM 915 CA ARG A 122 5.241 3.512 5.364 1.00 15.31 C ATOM 916 C ARG A 122 4.557 3.577 6.751 1.00 12.84 C ATOM 917 O ARG A 122 4.145 4.662 7.187 1.00 13.22 O ATOM 918 CB ARG A 122 6.773 3.288 5.547 1.00 21.23 C ATOM 919 CG ARG A 122 7.308 4.259 6.615 1.00 28.38 C ATOM 920 CD ARG A 122 8.820 4.542 6.708 1.00 34.94 C ATOM 921 NE ARG A 122 9.540 3.483 7.415 1.00 39.98 N ATOM 922 CZ ARG A 122 9.483 3.242 8.728 1.00 43.51 C ATOM 923 NH1 ARG A 122 8.767 3.957 9.573 1.00 43.73 N ATOM 924 NH2 ARG A 122 10.172 2.231 9.225 1.00 45.30 N ATOM 925 N GLY A 123 4.410 2.398 7.383 1.00 12.09 N ATOM 926 CA GLY A 123 3.870 2.318 8.735 1.00 13.01 C ATOM 927 C GLY A 123 5.068 2.323 9.710 1.00 14.34 C ATOM 928 O GLY A 123 6.236 2.364 9.317 1.00 15.16 O ATOM 929 N VAL A 124 4.796 2.283 11.012 1.00 12.92 N ATOM 930 CA VAL A 124 5.855 2.249 12.019 1.00 12.20 C ATOM 931 C VAL A 124 5.379 1.198 13.013 1.00 11.30 C ATOM 932 O VAL A 124 4.206 0.952 13.227 1.00 11.91 O ATOM 933 CB VAL A 124 6.161 3.612 12.653 1.00 14.52 C ATOM 934 CG1 VAL A 124 6.936 4.505 11.664 1.00 16.58 C ATOM 935 CG2 VAL A 124 4.891 4.352 13.010 1.00 14.07 C ATOM 936 N ARG A 125 6.308 0.537 13.594 1.00 11.25 N ATOM 937 CA ARG A 125 5.921 -0.469 14.498 1.00 10.91 C ATOM 938 C ARG A 125 6.922 -0.586 15.653 1.00 13.12 C ATOM 939 O ARG A 125 8.131 -0.294 15.519 1.00 15.14 O ATOM 940 CB ARG A 125 5.972 -1.755 13.709 1.00 12.06 C ATOM 941 CG ARG A 125 5.988 -2.943 14.633 1.00 14.38 C ATOM 942 CD ARG A 125 5.984 -4.297 13.901 1.00 16.64 C ATOM 943 NE ARG A 125 4.936 -4.343 12.863 1.00 19.88 N ATOM 944 CZ ARG A 125 4.427 -5.440 12.322 1.00 21.10 C ATOM 945 NH1 ARG A 125 4.841 -6.641 12.628 1.00 20.67 N ATOM 946 NH2 ARG A 125 3.479 -5.328 11.420 1.00 22.24 N ATOM 947 N CYS A 126 6.392 -0.917 16.818 1.00 10.34 N ATOM 948 CA CYS A 126 7.222 -1.183 18.007 1.00 9.97 C ATOM 949 C CYS A 126 6.675 -2.445 18.618 1.00 10.58 C ATOM 950 O CYS A 126 5.698 -2.407 19.361 1.00 13.04 O ATOM 951 CB CYS A 126 7.309 0.002 18.976 1.00 10.23 C ATOM 952 SG CYS A 126 8.231 -0.452 20.487 1.00 11.50 S ATOM 953 N ALA A 127 7.263 -3.567 18.273 1.00 10.06 N ATOM 954 CA ALA A 127 6.753 -4.795 18.777 1.00 11.86 C ATOM 955 C ALA A 127 7.796 -5.686 19.461 1.00 15.45 C ATOM 956 O ALA A 127 7.594 -6.871 19.612 1.00 18.07 O ATOM 957 CB ALA A 127 6.064 -5.559 17.663 1.00 12.45 C ATOM 958 N ALA A 128 8.916 -5.156 19.879 1.00 14.65 N ATOM 959 CA ALA A 128 9.879 -5.948 20.656 1.00 14.78 C ATOM 960 C ALA A 128 9.279 -6.217 22.065 1.00 15.39 C ATOM 961 O ALA A 128 8.358 -5.511 22.500 1.00 17.22 O ATOM 962 CB ALA A 128 11.176 -5.185 20.854 1.00 14.25 C ATOM 963 N ASP A 129 9.822 -7.209 22.787 1.00 13.60 N ATOM 964 CA ASP A 129 9.370 -7.537 24.135 1.00 14.62 C ATOM 965 C ASP A 129 9.942 -6.584 25.117 1.00 14.16 C ATOM 966 O ASP A 129 10.791 -6.959 25.967 1.00 14.82 O ATOM 967 CB ASP A 129 9.727 -8.972 24.571 1.00 16.77 C ATOM 968 CG ASP A 129 9.135 -9.354 25.886 1.00 19.55 C ATOM 969 OD1 ASP A 129 8.097 -8.655 26.261 1.00 20.24 O ATOM 970 OD2 ASP A 129 9.599 -10.217 26.547 1.00 21.04 O ATOM 971 N ILE A 130 9.527 -5.335 24.985 1.00 12.51 N ATOM 972 CA ILE A 130 10.059 -4.336 25.925 1.00 11.95 C ATOM 973 C ILE A 130 9.729 -4.588 27.399 1.00 12.95 C ATOM 974 O ILE A 130 10.517 -4.261 28.268 1.00 14.32 O ATOM 975 CB ILE A 130 9.665 -2.944 25.495 1.00 11.27 C ATOM 976 CG1 ILE A 130 10.553 -2.535 24.325 1.00 10.28 C ATOM 977 CG2 ILE A 130 9.755 -1.960 26.646 1.00 11.52 C ATOM 978 CD1 ILE A 130 10.000 -1.383 23.554 1.00 9.85 C ATOM 979 N VAL A 131 8.546 -5.111 27.665 1.00 12.23 N ATOM 980 CA VAL A 131 8.103 -5.361 28.985 1.00 12.38 C ATOM 981 C VAL A 131 9.029 -6.377 29.612 1.00 12.96 C ATOM 982 O VAL A 131 9.472 -6.221 30.727 1.00 13.97 O ATOM 983 CB VAL A 131 6.611 -5.805 29.029 1.00 11.88 C ATOM 984 CG1 VAL A 131 6.207 -6.242 30.436 1.00 11.47 C ATOM 985 CG2 VAL A 131 5.722 -4.629 28.682 1.00 11.65 C ATOM 986 N GLY A 132 9.254 -7.425 28.855 1.00 14.32 N ATOM 987 CA GLY A 132 10.104 -8.537 29.193 1.00 15.80 C ATOM 988 C GLY A 132 11.560 -8.136 29.447 1.00 17.13 C ATOM 989 O GLY A 132 12.160 -8.717 30.337 1.00 19.31 O ATOM 990 N GLN A 133 12.100 -7.112 28.779 1.00 15.91 N ATOM 991 CA GLN A 133 13.476 -6.681 28.971 1.00 16.05 C ATOM 992 C GLN A 133 13.642 -5.445 29.798 1.00 13.88 C ATOM 993 O GLN A 133 14.728 -4.953 29.996 1.00 12.87 O ATOM 994 CB GLN A 133 14.066 -6.440 27.588 1.00 19.18 C ATOM 995 CG GLN A 133 13.969 -7.794 26.901 1.00 25.42 C ATOM 996 CD GLN A 133 14.779 -7.906 25.633 1.00 32.18 C ATOM 997 OE1 GLN A 133 15.948 -7.489 25.609 1.00 33.95 O ATOM 998 NE2 GLN A 133 14.184 -8.482 24.581 1.00 34.01 N ATOM 999 N CYS A 134 12.539 -4.901 30.257 1.00 11.99 N ATOM 1000 CA CYS A 134 12.500 -3.649 30.965 1.00 9.65 C ATOM 1001 C CYS A 134 13.482 -3.657 32.140 1.00 10.08 C ATOM 1002 O CYS A 134 13.447 -4.610 32.915 1.00 10.68 O ATOM 1003 CB CYS A 134 11.038 -3.486 31.520 1.00 9.02 C ATOM 1004 SG CYS A 134 10.755 -1.841 32.167 1.00 10.15 S ATOM 1005 N PRO A 135 14.320 -2.632 32.215 1.00 10.44 N ATOM 1006 CA PRO A 135 15.300 -2.478 33.308 1.00 11.01 C ATOM 1007 C PRO A 135 14.543 -2.436 34.591 1.00 12.64 C ATOM 1008 O PRO A 135 13.429 -1.921 34.688 1.00 12.24 O ATOM 1009 CB PRO A 135 15.920 -1.109 33.132 1.00 11.24 C ATOM 1010 CG PRO A 135 15.660 -0.736 31.684 1.00 12.43 C ATOM 1011 CD PRO A 135 14.509 -1.588 31.185 1.00 10.58 C ATOM 1012 N ALA A 136 15.181 -2.976 35.604 1.00 13.99 N ATOM 1013 CA ALA A 136 14.556 -3.086 36.899 1.00 14.78 C ATOM 1014 C ALA A 136 13.893 -1.860 37.443 1.00 14.07 C ATOM 1015 O ALA A 136 12.777 -1.926 37.885 1.00 15.76 O ATOM 1016 CB ALA A 136 15.438 -3.883 37.876 1.00 15.19 C ATOM 1017 N LYS A 137 14.521 -0.714 37.387 1.00 12.98 N ATOM 1018 CA LYS A 137 13.956 0.478 37.917 1.00 14.55 C ATOM 1019 C LYS A 137 12.773 0.967 37.165 1.00 13.77 C ATOM 1020 O LYS A 137 12.035 1.823 37.704 1.00 14.13 O ATOM 1021 CB LYS A 137 14.960 1.598 37.844 1.00 20.69 C ATOM 1022 CG LYS A 137 16.136 1.297 38.737 1.00 30.90 C ATOM 1023 CD LYS A 137 16.406 2.400 39.771 1.00 40.41 C ATOM 1024 CE LYS A 137 15.448 2.365 40.996 1.00 46.46 C ATOM 1025 NZ LYS A 137 14.795 3.673 41.345 1.00 48.24 N ATOM 1026 N LEU A 138 12.642 0.476 35.915 1.00 11.71 N ATOM 1027 CA LEU A 138 11.542 0.985 35.045 1.00 11.15 C ATOM 1028 C LEU A 138 10.261 0.163 35.074 1.00 11.50 C ATOM 1029 O LEU A 138 9.224 0.582 34.547 1.00 12.46 O ATOM 1030 CB LEU A 138 11.980 1.236 33.573 1.00 9.57 C ATOM 1031 CG LEU A 138 13.185 2.138 33.403 1.00 9.40 C ATOM 1032 CD1 LEU A 138 13.375 2.313 31.913 1.00 9.72 C ATOM 1033 CD2 LEU A 138 13.008 3.481 34.008 1.00 9.33 C ATOM 1034 N LYS A 139 10.369 -1.030 35.586 1.00 11.94 N ATOM 1035 CA LYS A 139 9.222 -1.867 35.660 1.00 16.21 C ATOM 1036 C LYS A 139 8.037 -1.263 36.464 1.00 18.42 C ATOM 1037 O LYS A 139 8.190 -0.910 37.637 1.00 19.57 O ATOM 1038 CB LYS A 139 9.596 -3.102 36.364 1.00 17.71 C ATOM 1039 CG LYS A 139 10.625 -3.768 35.549 1.00 22.80 C ATOM 1040 CD LYS A 139 10.029 -5.070 35.061 1.00 30.65 C ATOM 1041 CE LYS A 139 10.906 -6.289 35.319 1.00 35.24 C ATOM 1042 NZ LYS A 139 11.787 -5.993 36.442 1.00 37.23 N ATOM 1043 N ALA A 140 6.829 -1.180 35.833 1.00 16.93 N ATOM 1044 CA ALA A 140 5.632 -0.694 36.484 1.00 17.93 C ATOM 1045 C ALA A 140 5.019 -1.818 37.287 1.00 19.65 C ATOM 1046 O ALA A 140 4.861 -2.931 36.847 1.00 18.87 O ATOM 1047 CB ALA A 140 4.628 -0.075 35.518 1.00 17.21 C ATOM 1048 N PRO A 141 4.726 -1.498 38.530 1.00 25.43 N ATOM 1049 CA PRO A 141 4.109 -2.433 39.424 1.00 27.70 C ATOM 1050 C PRO A 141 2.831 -2.949 38.771 1.00 29.03 C ATOM 1051 O PRO A 141 2.525 -4.142 38.873 1.00 31.09 O ATOM 1052 CB PRO A 141 3.728 -1.602 40.643 1.00 28.64 C ATOM 1053 CG PRO A 141 3.635 -0.178 40.151 1.00 28.30 C ATOM 1054 CD PRO A 141 4.624 -0.087 39.006 1.00 26.61 C ATOM 1055 N GLY A 142 2.086 -2.082 38.045 1.00 27.28 N ATOM 1056 CA GLY A 142 0.844 -2.562 37.431 1.00 26.05 C ATOM 1057 C GLY A 142 1.032 -3.270 36.088 1.00 24.41 C ATOM 1058 O GLY A 142 0.048 -3.701 35.430 1.00 23.84 O ATOM 1059 N GLY A 143 2.322 -3.391 35.671 1.00 20.96 N ATOM 1060 CA GLY A 143 2.600 -4.033 34.399 1.00 17.12 C ATOM 1061 C GLY A 143 3.062 -2.953 33.459 1.00 13.35 C ATOM 1062 O GLY A 143 2.796 -1.775 33.714 1.00 13.12 O ATOM 1063 N GLY A 144 3.816 -3.337 32.391 1.00 12.08 N ATOM 1064 CA GLY A 144 4.353 -2.296 31.543 1.00 10.47 C ATOM 1065 C GLY A 144 5.793 -1.872 32.020 1.00 11.99 C ATOM 1066 O GLY A 144 6.361 -2.343 33.045 1.00 11.56 O ATOM 1067 N CYS A 145 6.347 -0.962 31.241 1.00 9.78 N ATOM 1068 CA CYS A 145 7.687 -0.462 31.436 1.00 8.36 C ATOM 1069 C CYS A 145 7.646 1.015 31.312 1.00 6.89 C ATOM 1070 O CYS A 145 7.448 1.589 30.242 1.00 7.68 O ATOM 1071 CB CYS A 145 8.621 -1.076 30.358 1.00 9.00 C ATOM 1072 SG CYS A 145 10.389 -0.747 30.564 1.00 10.29 S ATOM 1073 N ASN A 146 7.791 1.693 32.459 1.00 7.04 N ATOM 1074 CA ASN A 146 7.740 3.120 32.465 1.00 9.25 C ATOM 1075 C ASN A 146 8.885 3.811 31.747 1.00 9.40 C ATOM 1076 O ASN A 146 10.011 3.295 31.729 1.00 9.68 O ATOM 1077 CB ASN A 146 7.834 3.557 33.914 1.00 12.59 C ATOM 1078 CG ASN A 146 6.520 3.419 34.674 1.00 15.54 C ATOM 1079 OD1 ASN A 146 5.475 3.672 34.088 1.00 15.06 O ATOM 1080 ND2 ASN A 146 6.574 3.063 35.975 1.00 17.70 N ATOM 1081 N ASP A 147 8.660 5.029 31.333 1.00 9.48 N ATOM 1082 CA ASP A 147 9.785 5.790 30.821 1.00 9.53 C ATOM 1083 C ASP A 147 10.546 6.351 32.032 1.00 10.67 C ATOM 1084 O ASP A 147 10.056 6.366 33.147 1.00 9.36 O ATOM 1085 CB ASP A 147 9.328 6.984 29.955 1.00 9.34 C ATOM 1086 CG ASP A 147 8.401 7.817 30.753 1.00 11.34 C ATOM 1087 OD1 ASP A 147 7.320 7.430 31.151 1.00 11.92 O ATOM 1088 OD2 ASP A 147 8.903 8.954 31.118 1.00 12.63 O ATOM 1089 N ALA A 148 11.761 6.857 31.804 1.00 11.92 N ATOM 1090 CA ALA A 148 12.552 7.342 32.902 1.00 11.90 C ATOM 1091 C ALA A 148 12.115 8.648 33.537 1.00 12.58 C ATOM 1092 O ALA A 148 12.362 8.863 34.732 1.00 13.42 O ATOM 1093 CB ALA A 148 13.999 7.342 32.464 1.00 12.76 C ATOM 1094 N CYS A 149 11.471 9.509 32.779 1.00 13.63 N ATOM 1095 CA CYS A 149 11.008 10.747 33.338 1.00 15.17 C ATOM 1096 C CYS A 149 9.953 10.490 34.418 1.00 15.22 C ATOM 1097 O CYS A 149 10.018 10.968 35.568 1.00 16.01 O ATOM 1098 CB CYS A 149 10.502 11.631 32.207 1.00 17.28 C ATOM 1099 SG CYS A 149 9.633 13.076 32.815 1.00 21.22 S ATOM 1100 N THR A 150 8.980 9.642 34.043 1.00 15.00 N ATOM 1101 CA THR A 150 7.930 9.219 34.956 1.00 15.56 C ATOM 1102 C THR A 150 8.482 8.671 36.245 1.00 16.51 C ATOM 1103 O THR A 150 7.965 8.885 37.341 1.00 17.11 O ATOM 1104 CB THR A 150 7.052 8.139 34.286 1.00 14.75 C ATOM 1105 OG1 THR A 150 6.402 8.764 33.188 1.00 14.88 O ATOM 1106 CG2 THR A 150 6.070 7.517 35.283 1.00 14.15 C ATOM 1107 N VAL A 151 9.526 7.878 36.104 1.00 16.05 N ATOM 1108 CA VAL A 151 10.081 7.246 37.252 1.00 15.85 C ATOM 1109 C VAL A 151 10.934 8.193 38.068 1.00 17.82 C ATOM 1110 O VAL A 151 10.785 8.270 39.281 1.00 19.54 O ATOM 1111 CB VAL A 151 10.919 6.020 36.910 1.00 16.14 C ATOM 1112 CG1 VAL A 151 11.580 5.502 38.188 1.00 17.27 C ATOM 1113 CG2 VAL A 151 10.141 4.831 36.291 1.00 15.23 C ATOM 1114 N PHE A 152 11.865 8.884 37.438 1.00 19.52 N ATOM 1115 CA PHE A 152 12.836 9.680 38.190 1.00 21.90 C ATOM 1116 C PHE A 152 12.468 11.113 38.361 1.00 27.09 C ATOM 1117 O PHE A 152 12.861 11.757 39.347 1.00 29.48 O ATOM 1118 CB PHE A 152 14.234 9.602 37.516 1.00 20.45 C ATOM 1119 CG PHE A 152 14.768 8.185 37.479 1.00 19.88 C ATOM 1120 CD1 PHE A 152 15.070 7.505 38.662 1.00 22.82 C ATOM 1121 CD2 PHE A 152 14.948 7.496 36.285 1.00 16.67 C ATOM 1122 CE1 PHE A 152 15.581 6.205 38.695 1.00 22.97 C ATOM 1123 CE2 PHE A 152 15.401 6.182 36.318 1.00 17.86 C ATOM 1124 CZ PHE A 152 15.740 5.515 37.494 1.00 20.57 C ATOM 1125 N GLN A 153 11.759 11.602 37.376 1.00 28.97 N ATOM 1126 CA GLN A 153 11.341 12.967 37.333 1.00 32.41 C ATOM 1127 C GLN A 153 12.429 13.974 37.587 1.00 35.28 C ATOM 1128 O GLN A 153 12.281 14.707 38.567 1.00 37.42 O ATOM 1129 CB GLN A 153 10.396 13.335 38.428 1.00 34.71 C ATOM 1130 CG GLN A 153 9.921 12.209 39.296 1.00 38.83 C ATOM 1131 CD GLN A 153 8.429 12.322 39.262 1.00 43.94 C ATOM 1132 OE1 GLN A 153 7.751 11.755 40.141 1.00 46.04 O ATOM 1133 NE2 GLN A 153 7.929 13.081 38.253 1.00 44.40 N ATOM 1134 N THR A 154 13.458 14.037 36.726 1.00 34.32 N ATOM 1135 CA THR A 154 14.552 14.997 36.785 1.00 32.16 C ATOM 1136 C THR A 154 14.726 15.548 35.382 1.00 31.76 C ATOM 1137 O THR A 154 14.330 14.913 34.388 1.00 31.53 O ATOM 1138 CB THR A 154 15.833 14.410 37.394 1.00 30.17 C ATOM 1139 OG1 THR A 154 16.224 13.268 36.664 1.00 30.79 O ATOM 1140 CG2 THR A 154 15.522 13.956 38.804 1.00 28.80 C ATOM 1141 N SER A 155 15.252 16.755 35.306 1.00 31.38 N ATOM 1142 CA SER A 155 15.446 17.427 34.048 1.00 33.51 C ATOM 1143 C SER A 155 16.182 16.581 33.028 1.00 30.73 C ATOM 1144 O SER A 155 15.912 16.679 31.824 1.00 29.08 O ATOM 1145 CB SER A 155 16.220 18.721 34.271 1.00 39.88 C ATOM 1146 OG SER A 155 15.728 19.372 35.442 1.00 43.54 O ATOM 1147 N GLU A 156 17.153 15.801 33.545 1.00 31.53 N ATOM 1148 CA GLU A 156 18.000 14.910 32.761 1.00 33.93 C ATOM 1149 C GLU A 156 17.115 13.897 32.061 1.00 29.92 C ATOM 1150 O GLU A 156 17.293 13.534 30.895 1.00 30.03 O ATOM 1151 CB GLU A 156 18.963 14.148 33.674 1.00 42.05 C ATOM 1152 CG GLU A 156 19.791 13.074 32.924 1.00 50.97 C ATOM 1153 CD GLU A 156 20.899 12.368 33.730 1.00 59.01 C ATOM 1154 OE1 GLU A 156 20.673 12.333 35.050 1.00 60.66 O ATOM 1155 OE2 GLU A 156 21.896 11.841 33.196 1.00 60.96 O ATOM 1156 N TYR A 157 16.120 13.459 32.782 1.00 26.90 N ATOM 1157 CA TYR A 157 15.218 12.504 32.211 1.00 25.71 C ATOM 1158 C TYR A 157 13.955 13.130 31.537 1.00 25.72 C ATOM 1159 O TYR A 157 13.434 12.674 30.504 1.00 24.84 O ATOM 1160 CB TYR A 157 14.917 11.606 33.368 1.00 24.29 C ATOM 1161 CG TYR A 157 16.070 10.746 33.722 1.00 22.93 C ATOM 1162 CD1 TYR A 157 16.686 9.965 32.759 1.00 22.25 C ATOM 1163 CD2 TYR A 157 16.475 10.635 35.050 1.00 24.74 C ATOM 1164 CE1 TYR A 157 17.688 9.061 33.107 1.00 24.20 C ATOM 1165 CE2 TYR A 157 17.482 9.747 35.435 1.00 25.54 C ATOM 1166 CZ TYR A 157 18.075 8.973 34.444 1.00 26.04 C ATOM 1167 OH TYR A 157 19.022 8.104 34.813 1.00 27.91 O ATOM 1168 N CYS A 158 13.527 14.264 32.082 1.00 25.91 N ATOM 1169 CA CYS A 158 12.366 14.941 31.606 1.00 26.08 C ATOM 1170 C CYS A 158 12.584 16.031 30.585 1.00 28.70 C ATOM 1171 O CYS A 158 11.617 16.463 29.953 1.00 29.64 O ATOM 1172 CB CYS A 158 11.545 15.450 32.805 1.00 24.96 C ATOM 1173 SG CYS A 158 11.106 14.080 33.899 1.00 25.05 S ATOM 1174 N CYS A 159 13.818 16.470 30.395 1.00 30.92 N ATOM 1175 CA CYS A 159 14.177 17.571 29.498 1.00 34.55 C ATOM 1176 C CYS A 159 13.435 18.763 29.898 1.00 38.53 C ATOM 1177 O CYS A 159 13.103 19.535 28.996 1.00 38.86 O ATOM 1178 CB CYS A 159 13.791 17.559 28.025 1.00 37.70 C ATOM 1179 SG CYS A 159 14.362 16.114 27.178 1.00 41.04 S ATOM 1180 N THR A 160 13.130 18.820 31.182 1.00 43.35 N ATOM 1181 CA THR A 160 12.433 19.900 31.822 1.00 48.55 C ATOM 1182 C THR A 160 12.973 21.228 31.225 1.00 52.16 C ATOM 1183 O THR A 160 12.219 22.202 31.021 1.00 53.58 O ATOM 1184 CB THR A 160 12.606 19.680 33.374 1.00 50.45 C ATOM 1185 OG1 THR A 160 12.203 18.350 33.700 1.00 51.82 O ATOM 1186 CG2 THR A 160 11.841 20.657 34.280 1.00 50.29 C ATOM 1187 N THR A 161 14.250 21.270 30.826 1.00 53.61 N ATOM 1188 CA THR A 161 14.736 22.522 30.262 1.00 56.03 C ATOM 1189 C THR A 161 15.604 22.421 29.015 1.00 55.50 C ATOM 1190 O THR A 161 16.834 22.683 29.077 1.00 55.42 O ATOM 1191 CB THR A 161 15.523 23.256 31.331 1.00 59.49 C ATOM 1192 OG1 THR A 161 15.859 22.289 32.316 1.00 60.73 O ATOM 1193 CG2 THR A 161 14.672 24.392 31.907 1.00 60.46 C ATOM 1194 N GLY A 162 14.928 22.037 27.910 1.00 54.63 N ATOM 1195 CA GLY A 162 15.502 21.892 26.564 1.00 53.54 C ATOM 1196 C GLY A 162 16.690 20.957 26.438 1.00 53.20 C ATOM 1197 O GLY A 162 16.588 19.938 25.764 1.00 53.82 O ATOM 1198 N LYS A 163 17.804 21.324 27.071 1.00 53.51 N ATOM 1199 CA LYS A 163 19.036 20.546 27.055 1.00 54.38 C ATOM 1200 C LYS A 163 18.783 19.135 27.533 1.00 47.41 C ATOM 1201 O LYS A 163 18.473 18.926 28.718 1.00 48.30 O ATOM 1202 CB LYS A 163 20.044 21.121 28.059 1.00 61.50 C ATOM 1203 CG LYS A 163 21.516 20.846 27.699 1.00 67.51 C ATOM 1204 CD LYS A 163 22.490 20.756 28.892 1.00 71.66 C ATOM 1205 CE LYS A 163 23.858 20.186 28.498 1.00 74.18 C ATOM 1206 NZ LYS A 163 24.906 21.210 28.264 1.00 75.14 N ATOM 1207 N CYS A 164 18.938 18.159 26.687 1.00 39.35 N ATOM 1208 CA CYS A 164 18.779 16.844 27.266 1.00 32.97 C ATOM 1209 C CYS A 164 19.281 15.959 26.190 1.00 28.25 C ATOM 1210 O CYS A 164 19.248 16.398 25.042 1.00 29.06 O ATOM 1211 CB CYS A 164 17.355 16.491 27.815 1.00 33.34 C ATOM 1212 SG CYS A 164 16.176 16.492 26.454 1.00 36.86 S ATOM 1213 N GLY A 165 19.786 14.802 26.521 1.00 23.97 N ATOM 1214 CA GLY A 165 20.267 13.969 25.471 1.00 21.07 C ATOM 1215 C GLY A 165 19.795 12.633 25.871 1.00 17.81 C ATOM 1216 O GLY A 165 18.988 12.530 26.791 1.00 18.00 O ATOM 1217 N PRO A 166 20.286 11.647 25.219 1.00 15.97 N ATOM 1218 CA PRO A 166 19.846 10.343 25.547 1.00 16.55 C ATOM 1219 C PRO A 166 20.444 9.934 26.844 1.00 17.95 C ATOM 1220 O PRO A 166 21.409 10.583 27.330 1.00 17.95 O ATOM 1221 CB PRO A 166 20.336 9.445 24.436 1.00 16.16 C ATOM 1222 CG PRO A 166 21.375 10.242 23.664 1.00 16.30 C ATOM 1223 CD PRO A 166 21.161 11.701 24.039 1.00 16.62 C ATOM 1224 N THR A 167 19.867 8.870 27.380 1.00 16.32 N ATOM 1225 CA THR A 167 20.349 8.287 28.603 1.00 14.86 C ATOM 1226 C THR A 167 20.399 6.808 28.385 1.00 12.02 C ATOM 1227 O THR A 167 19.951 6.298 27.340 1.00 11.80 O ATOM 1228 CB THR A 167 19.499 8.594 29.837 1.00 17.02 C ATOM 1229 OG1 THR A 167 18.185 8.074 29.615 1.00 16.36 O ATOM 1230 CG2 THR A 167 19.493 10.092 30.113 1.00 18.01 C ATOM 1231 N GLU A 168 20.911 6.072 29.389 1.00 9.66 N ATOM 1232 CA GLU A 168 20.900 4.689 29.127 1.00 10.81 C ATOM 1233 C GLU A 168 19.474 4.192 29.071 1.00 10.28 C ATOM 1234 O GLU A 168 19.241 3.143 28.502 1.00 11.96 O ATOM 1235 CB GLU A 168 21.561 3.832 30.222 1.00 14.15 C ATOM 1236 CG GLU A 168 23.051 3.733 30.126 1.00 16.79 C ATOM 1237 CD GLU A 168 23.576 3.616 28.724 1.00 19.66 C ATOM 1238 OE1 GLU A 168 23.503 2.633 28.017 1.00 21.38 O ATOM 1239 OE2 GLU A 168 24.192 4.668 28.406 1.00 20.54 O ATOM 1240 N TYR A 169 18.564 4.826 29.781 1.00 11.75 N ATOM 1241 CA TYR A 169 17.170 4.324 29.802 1.00 12.78 C ATOM 1242 C TYR A 169 16.413 4.614 28.471 1.00 14.63 C ATOM 1243 O TYR A 169 15.658 3.771 27.887 1.00 15.57 O ATOM 1244 CB TYR A 169 16.484 4.943 31.018 1.00 13.45 C ATOM 1245 CG TYR A 169 17.015 4.339 32.302 1.00 14.88 C ATOM 1246 CD1 TYR A 169 17.029 2.953 32.458 1.00 16.82 C ATOM 1247 CD2 TYR A 169 17.485 5.162 33.321 1.00 16.75 C ATOM 1248 CE1 TYR A 169 17.479 2.347 33.628 1.00 19.68 C ATOM 1249 CE2 TYR A 169 17.925 4.573 34.514 1.00 18.22 C ATOM 1250 CZ TYR A 169 17.930 3.183 34.653 1.00 21.57 C ATOM 1251 OH TYR A 169 18.421 2.616 35.832 1.00 25.59 O ATOM 1252 N SER A 170 16.692 5.796 27.915 1.00 13.86 N ATOM 1253 CA SER A 170 16.107 6.128 26.602 1.00 12.64 C ATOM 1254 C SER A 170 16.675 5.184 25.544 1.00 13.66 C ATOM 1255 O SER A 170 15.983 4.667 24.664 1.00 12.35 O ATOM 1256 CB SER A 170 16.258 7.587 26.219 1.00 12.64 C ATOM 1257 OG SER A 170 17.608 7.905 25.804 1.00 14.30 O ATOM 1258 N ARG A 171 18.037 4.957 25.609 1.00 13.70 N ATOM 1259 CA ARG A 171 18.673 4.088 24.622 1.00 12.27 C ATOM 1260 C ARG A 171 18.128 2.678 24.667 1.00 11.23 C ATOM 1261 O ARG A 171 18.155 1.884 23.726 1.00 12.77 O ATOM 1262 CB ARG A 171 20.155 3.983 24.931 1.00 13.63 C ATOM 1263 CG ARG A 171 20.891 5.276 24.780 1.00 16.27 C ATOM 1264 CD ARG A 171 22.378 4.944 24.928 1.00 19.66 C ATOM 1265 NE ARG A 171 23.082 5.753 24.006 1.00 23.88 N ATOM 1266 CZ ARG A 171 23.627 6.883 24.339 1.00 27.26 C ATOM 1267 NH1 ARG A 171 23.646 7.286 25.622 1.00 29.60 N ATOM 1268 NH2 ARG A 171 24.166 7.621 23.354 1.00 27.53 N ATOM 1269 N PHE A 172 17.676 2.274 25.822 1.00 10.84 N ATOM 1270 CA PHE A 172 17.128 0.953 25.955 1.00 9.84 C ATOM 1271 C PHE A 172 15.898 0.859 25.032 1.00 10.09 C ATOM 1272 O PHE A 172 15.755 -0.092 24.280 1.00 12.48 O ATOM 1273 CB PHE A 172 16.666 0.714 27.447 1.00 8.56 C ATOM 1274 CG PHE A 172 15.637 -0.385 27.570 1.00 9.27 C ATOM 1275 CD1 PHE A 172 15.971 -1.734 27.418 1.00 9.11 C ATOM 1276 CD2 PHE A 172 14.292 -0.050 27.781 1.00 9.13 C ATOM 1277 CE1 PHE A 172 15.029 -2.759 27.489 1.00 9.56 C ATOM 1278 CE2 PHE A 172 13.349 -1.073 27.873 1.00 7.00 C ATOM 1279 CZ PHE A 172 13.693 -2.408 27.715 1.00 8.54 C ATOM 1280 N PHE A 173 15.006 1.861 25.119 1.00 9.48 N ATOM 1281 CA PHE A 173 13.807 1.832 24.257 1.00 9.60 C ATOM 1282 C PHE A 173 14.214 1.949 22.829 1.00 10.69 C ATOM 1283 O PHE A 173 13.644 1.262 21.954 1.00 10.24 O ATOM 1284 CB PHE A 173 12.817 2.957 24.558 1.00 9.16 C ATOM 1285 CG PHE A 173 12.112 2.743 25.858 1.00 10.29 C ATOM 1286 CD1 PHE A 173 12.668 3.235 27.044 1.00 12.35 C ATOM 1287 CD2 PHE A 173 10.901 2.063 25.939 1.00 9.01 C ATOM 1288 CE1 PHE A 173 12.015 3.055 28.267 1.00 13.24 C ATOM 1289 CE2 PHE A 173 10.235 1.879 27.159 1.00 9.36 C ATOM 1290 CZ PHE A 173 10.800 2.363 28.340 1.00 12.11 C ATOM 1291 N LYS A 174 15.132 2.876 22.601 1.00 11.06 N ATOM 1292 CA LYS A 174 15.609 3.115 21.232 1.00 10.88 C ATOM 1293 C LYS A 174 16.215 1.860 20.559 1.00 12.23 C ATOM 1294 O LYS A 174 16.018 1.543 19.400 1.00 11.90 O ATOM 1295 CB LYS A 174 16.513 4.303 21.230 1.00 10.34 C ATOM 1296 CG LYS A 174 16.741 4.889 19.855 1.00 12.19 C ATOM 1297 CD LYS A 174 15.409 5.316 19.214 1.00 15.09 C ATOM 1298 CE LYS A 174 15.523 6.137 17.935 1.00 17.00 C ATOM 1299 NZ LYS A 174 14.267 6.825 17.649 1.00 17.81 N ATOM 1300 N ARG A 175 16.947 1.044 21.314 1.00 12.84 N ATOM 1301 CA ARG A 175 17.528 -0.090 20.734 1.00 14.10 C ATOM 1302 C ARG A 175 16.536 -1.085 20.356 1.00 13.95 C ATOM 1303 O ARG A 175 16.680 -1.752 19.298 1.00 14.35 O ATOM 1304 CB ARG A 175 18.537 -0.614 21.753 1.00 17.91 C ATOM 1305 CG ARG A 175 19.134 -1.961 21.530 1.00 22.86 C ATOM 1306 CD ARG A 175 20.255 -2.044 22.563 1.00 30.18 C ATOM 1307 NE ARG A 175 19.901 -2.921 23.663 1.00 37.57 N ATOM 1308 CZ ARG A 175 18.734 -2.913 24.327 1.00 44.50 C ATOM 1309 NH1 ARG A 175 17.720 -2.046 24.065 1.00 45.93 N ATOM 1310 NH2 ARG A 175 18.559 -3.833 25.296 1.00 46.38 N ATOM 1311 N LEU A 176 15.523 -1.204 21.224 1.00 12.64 N ATOM 1312 CA LEU A 176 14.510 -2.171 20.986 1.00 13.20 C ATOM 1313 C LEU A 176 13.509 -1.728 19.900 1.00 12.11 C ATOM 1314 O LEU A 176 13.029 -2.562 19.175 1.00 13.39 O ATOM 1315 CB LEU A 176 13.810 -2.531 22.300 1.00 16.12 C ATOM 1316 CG LEU A 176 14.646 -3.439 23.237 1.00 19.73 C ATOM 1317 CD1 LEU A 176 13.863 -3.850 24.475 1.00 20.74 C ATOM 1318 CD2 LEU A 176 14.814 -4.732 22.486 1.00 20.92 C ATOM 1319 N CYS A 177 13.184 -0.450 19.807 1.00 9.70 N ATOM 1320 CA CYS A 177 12.274 0.037 18.787 1.00 8.09 C ATOM 1321 C CYS A 177 12.811 1.317 18.246 1.00 9.35 C ATOM 1322 O CYS A 177 12.584 2.454 18.664 1.00 9.63 O ATOM 1323 CB CYS A 177 10.895 0.298 19.433 1.00 9.32 C ATOM 1324 SG CYS A 177 10.043 -1.206 19.787 1.00 12.01 S ATOM 1325 N PRO A 178 13.685 1.184 17.275 1.00 10.03 N ATOM 1326 CA PRO A 178 14.315 2.322 16.703 1.00 10.49 C ATOM 1327 C PRO A 178 13.392 3.257 16.020 1.00 11.12 C ATOM 1328 O PRO A 178 13.680 4.429 15.918 1.00 11.99 O ATOM 1329 CB PRO A 178 15.221 1.742 15.620 1.00 12.98 C ATOM 1330 CG PRO A 178 15.323 0.266 15.887 1.00 13.94 C ATOM 1331 CD PRO A 178 14.217 -0.125 16.871 1.00 11.44 C ATOM 1332 N ASP A 179 12.238 2.775 15.568 1.00 11.55 N ATOM 1333 CA ASP A 179 11.311 3.660 14.895 1.00 13.15 C ATOM 1334 C ASP A 179 10.390 4.482 15.774 1.00 13.73 C ATOM 1335 O ASP A 179 9.534 5.179 15.285 1.00 15.51 O ATOM 1336 CB ASP A 179 10.506 2.866 13.879 1.00 17.91 C ATOM 1337 CG ASP A 179 11.404 2.531 12.738 1.00 23.73 C ATOM 1338 OD1 ASP A 179 12.262 3.321 12.308 1.00 25.70 O ATOM 1339 OD2 ASP A 179 11.279 1.272 12.389 1.00 26.43 O ATOM 1340 N ALA A 180 10.537 4.389 17.086 1.00 11.79 N ATOM 1341 CA ALA A 180 9.677 5.106 17.982 1.00 10.02 C ATOM 1342 C ALA A 180 10.481 6.144 18.747 1.00 10.06 C ATOM 1343 O ALA A 180 11.671 5.902 19.062 1.00 12.75 O ATOM 1344 CB ALA A 180 9.085 4.036 18.919 1.00 8.97 C ATOM 1345 N PHE A 181 9.859 7.294 19.110 1.00 7.54 N ATOM 1346 CA PHE A 181 10.558 8.306 19.881 1.00 8.01 C ATOM 1347 C PHE A 181 10.917 7.700 21.191 1.00 11.98 C ATOM 1348 O PHE A 181 10.088 7.007 21.780 1.00 13.12 O ATOM 1349 CB PHE A 181 9.701 9.504 20.223 1.00 9.05 C ATOM 1350 CG PHE A 181 9.501 10.445 19.054 1.00 12.71 C ATOM 1351 CD1 PHE A 181 8.466 10.275 18.138 1.00 14.35 C ATOM 1352 CD2 PHE A 181 10.328 11.563 18.885 1.00 15.86 C ATOM 1353 CE1 PHE A 181 8.302 11.158 17.062 1.00 15.96 C ATOM 1354 CE2 PHE A 181 10.169 12.456 17.817 1.00 18.18 C ATOM 1355 CZ PHE A 181 9.157 12.246 16.875 1.00 18.03 C ATOM 1356 N SER A 182 12.171 7.926 21.671 1.00 11.91 N ATOM 1357 CA SER A 182 12.592 7.330 22.958 1.00 11.64 C ATOM 1358 C SER A 182 12.749 8.390 24.064 1.00 11.44 C ATOM 1359 O SER A 182 12.782 8.045 25.247 1.00 11.44 O ATOM 1360 CB SER A 182 13.883 6.541 22.810 1.00 12.43 C ATOM 1361 OG SER A 182 14.927 7.419 22.387 1.00 13.25 O ATOM 1362 N TYR A 183 12.819 9.664 23.648 1.00 11.00 N ATOM 1363 CA TYR A 183 12.913 10.819 24.501 1.00 13.66 C ATOM 1364 C TYR A 183 12.513 12.002 23.700 1.00 15.53 C ATOM 1365 O TYR A 183 12.513 11.964 22.498 1.00 15.80 O ATOM 1366 CB TYR A 183 14.220 11.045 25.356 1.00 15.48 C ATOM 1367 CG TYR A 183 15.361 11.555 24.525 1.00 16.43 C ATOM 1368 CD1 TYR A 183 16.000 10.647 23.687 1.00 17.14 C ATOM 1369 CD2 TYR A 183 15.737 12.901 24.521 1.00 18.54 C ATOM 1370 CE1 TYR A 183 17.067 11.045 22.886 1.00 16.85 C ATOM 1371 CE2 TYR A 183 16.796 13.337 23.723 1.00 18.80 C ATOM 1372 CZ TYR A 183 17.437 12.385 22.924 1.00 18.38 C ATOM 1373 OH TYR A 183 18.405 12.746 22.061 1.00 20.96 O ATOM 1374 N VAL A 184 12.153 13.019 24.409 1.00 18.73 N ATOM 1375 CA VAL A 184 11.645 14.221 23.875 1.00 22.20 C ATOM 1376 C VAL A 184 12.376 14.761 22.741 1.00 24.24 C ATOM 1377 O VAL A 184 11.708 15.128 21.732 1.00 25.72 O ATOM 1378 CB VAL A 184 11.645 15.304 24.865 1.00 26.94 C ATOM 1379 CG1 VAL A 184 11.347 16.585 24.098 1.00 29.52 C ATOM 1380 CG2 VAL A 184 10.544 15.003 25.856 1.00 26.94 C ATOM 1381 N LEU A 185 13.710 14.845 22.918 1.00 23.47 N ATOM 1382 CA LEU A 185 14.594 15.385 21.886 1.00 22.15 C ATOM 1383 C LEU A 185 15.130 14.371 20.891 1.00 19.05 C ATOM 1384 O LEU A 185 16.058 14.659 20.044 1.00 19.39 O ATOM 1385 CB LEU A 185 15.781 16.127 22.531 1.00 26.60 C ATOM 1386 CG LEU A 185 15.592 17.652 22.561 1.00 31.83 C ATOM 1387 CD1 LEU A 185 14.149 18.082 22.916 1.00 33.11 C ATOM 1388 CD2 LEU A 185 16.588 18.309 23.510 1.00 32.60 C ATOM 1389 N ASP A 186 14.559 13.193 20.941 1.00 15.63 N ATOM 1390 CA ASP A 186 15.035 12.159 20.079 1.00 15.29 C ATOM 1391 C ASP A 186 14.965 12.594 18.641 1.00 18.13 C ATOM 1392 O ASP A 186 14.203 13.514 18.351 1.00 18.88 O ATOM 1393 CB ASP A 186 14.176 10.957 20.336 1.00 16.02 C ATOM 1394 CG ASP A 186 14.788 9.671 19.937 1.00 17.18 C ATOM 1395 OD1 ASP A 186 15.955 9.790 19.398 1.00 17.22 O ATOM 1396 OD2 ASP A 186 14.273 8.603 20.108 1.00 18.34 O ATOM 1397 N LYS A 187 15.796 12.053 17.774 1.00 22.03 N ATOM 1398 CA LYS A 187 15.679 12.502 16.388 1.00 28.36 C ATOM 1399 C LYS A 187 14.352 11.963 15.828 1.00 24.36 C ATOM 1400 O LYS A 187 14.065 10.789 16.001 1.00 21.50 O ATOM 1401 CB LYS A 187 16.883 12.259 15.493 1.00 38.86 C ATOM 1402 CG LYS A 187 17.071 10.801 15.126 1.00 49.31 C ATOM 1403 CD LYS A 187 16.724 9.861 16.288 1.00 57.62 C ATOM 1404 CE LYS A 187 16.528 8.416 15.844 1.00 62.88 C ATOM 1405 NZ LYS A 187 17.710 7.572 16.166 1.00 65.02 N ATOM 1406 N PRO A 188 13.555 12.825 15.197 1.00 24.37 N ATOM 1407 CA PRO A 188 12.237 12.456 14.726 1.00 21.74 C ATOM 1408 C PRO A 188 12.148 11.207 13.952 1.00 18.94 C ATOM 1409 O PRO A 188 12.907 10.915 13.041 1.00 19.18 O ATOM 1410 CB PRO A 188 11.634 13.618 13.968 1.00 23.54 C ATOM 1411 CG PRO A 188 12.429 14.820 14.416 1.00 25.74 C ATOM 1412 CD PRO A 188 13.763 14.283 14.947 1.00 26.51 C ATOM 1413 N THR A 189 11.153 10.473 14.326 1.00 15.75 N ATOM 1414 CA THR A 189 10.884 9.219 13.711 1.00 16.62 C ATOM 1415 C THR A 189 9.501 9.289 13.016 1.00 15.16 C ATOM 1416 O THR A 189 8.933 8.288 12.635 1.00 17.33 O ATOM 1417 CB THR A 189 10.875 8.369 14.978 1.00 21.42 C ATOM 1418 OG1 THR A 189 11.273 7.072 14.775 1.00 27.08 O ATOM 1419 CG2 THR A 189 9.632 8.442 15.804 1.00 20.92 C ATOM 1420 N THR A 190 8.962 10.496 12.946 1.00 12.91 N ATOM 1421 CA THR A 190 7.632 10.794 12.353 1.00 13.09 C ATOM 1422 C THR A 190 7.618 10.438 10.871 1.00 13.61 C ATOM 1423 O THR A 190 8.618 10.639 10.164 1.00 13.24 O ATOM 1424 CB THR A 190 7.468 12.317 12.485 1.00 14.49 C ATOM 1425 OG1 THR A 190 7.663 12.626 13.864 1.00 15.66 O ATOM 1426 CG2 THR A 190 6.131 12.877 11.985 1.00 14.03 C ATOM 1427 N VAL A 191 6.478 9.932 10.385 1.00 12.93 N ATOM 1428 CA VAL A 191 6.306 9.558 8.991 1.00 10.79 C ATOM 1429 C VAL A 191 5.306 10.576 8.424 1.00 9.48 C ATOM 1430 O VAL A 191 4.326 10.971 9.050 1.00 8.48 O ATOM 1431 CB VAL A 191 5.744 8.123 8.886 1.00 13.48 C ATOM 1432 CG1 VAL A 191 5.212 7.769 7.510 1.00 13.59 C ATOM 1433 CG2 VAL A 191 6.783 7.049 9.293 1.00 16.73 C ATOM 1434 N THR A 192 5.616 11.047 7.197 1.00 8.90 N ATOM 1435 CA THR A 192 4.749 11.942 6.541 1.00 10.04 C ATOM 1436 C THR A 192 3.885 11.161 5.583 1.00 11.25 C ATOM 1437 O THR A 192 4.404 10.480 4.721 1.00 11.72 O ATOM 1438 CB THR A 192 5.568 13.015 5.780 1.00 12.61 C ATOM 1439 OG1 THR A 192 6.318 13.703 6.766 1.00 13.67 O ATOM 1440 CG2 THR A 192 4.567 13.983 5.224 1.00 14.85 C ATOM 1441 N CYS A 193 2.588 11.259 5.715 1.00 10.54 N ATOM 1442 CA CYS A 193 1.674 10.615 4.795 1.00 8.79 C ATOM 1443 C CYS A 193 0.837 11.658 4.054 1.00 8.77 C ATOM 1444 O CYS A 193 0.717 12.827 4.421 1.00 9.15 O ATOM 1445 CB CYS A 193 0.716 9.690 5.543 1.00 9.83 C ATOM 1446 SG CYS A 193 1.499 8.197 6.166 1.00 11.27 S ATOM 1447 N PRO A 194 0.248 11.272 2.913 1.00 8.75 N ATOM 1448 CA PRO A 194 -0.549 12.249 2.200 1.00 10.00 C ATOM 1449 C PRO A 194 -1.735 12.646 3.051 1.00 9.72 C ATOM 1450 O PRO A 194 -2.292 11.815 3.799 1.00 11.56 O ATOM 1451 CB PRO A 194 -1.047 11.503 0.953 1.00 10.70 C ATOM 1452 CG PRO A 194 -0.118 10.320 0.760 1.00 10.28 C ATOM 1453 CD PRO A 194 0.401 9.984 2.155 1.00 10.10 C ATOM 1454 N GLY A 195 -2.170 13.871 2.934 1.00 10.21 N ATOM 1455 CA GLY A 195 -3.318 14.304 3.735 1.00 10.69 C ATOM 1456 C GLY A 195 -4.536 13.408 3.475 1.00 11.18 C ATOM 1457 O GLY A 195 -4.705 12.890 2.390 1.00 9.80 O ATOM 1458 N SER A 196 -5.349 13.181 4.510 1.00 10.61 N ATOM 1459 CA SER A 196 -6.558 12.341 4.410 1.00 10.88 C ATOM 1460 C SER A 196 -6.366 10.881 4.156 1.00 9.36 C ATOM 1461 O SER A 196 -7.195 10.260 3.452 1.00 10.33 O ATOM 1462 CB SER A 196 -7.494 12.854 3.357 1.00 13.37 C ATOM 1463 OG SER A 196 -7.919 14.136 3.750 1.00 14.96 O ATOM 1464 N SER A 197 -5.243 10.342 4.723 1.00 8.58 N ATOM 1465 CA SER A 197 -5.010 8.931 4.603 1.00 7.18 C ATOM 1466 C SER A 197 -5.904 8.231 5.626 1.00 5.98 C ATOM 1467 O SER A 197 -6.478 8.928 6.473 1.00 7.51 O ATOM 1468 CB SER A 197 -3.541 8.661 4.883 1.00 7.18 C ATOM 1469 OG SER A 197 -2.807 9.244 3.857 1.00 8.58 O ATOM 1470 N ASN A 198 -6.030 6.906 5.538 1.00 6.21 N ATOM 1471 CA ASN A 198 -6.781 6.111 6.499 1.00 7.43 C ATOM 1472 C ASN A 198 -5.726 5.204 7.164 1.00 7.54 C ATOM 1473 O ASN A 198 -4.667 4.965 6.543 1.00 7.32 O ATOM 1474 CB ASN A 198 -7.910 5.275 5.888 1.00 8.45 C ATOM 1475 CG ASN A 198 -9.023 6.144 5.356 1.00 10.56 C ATOM 1476 OD1 ASN A 198 -9.340 7.239 5.935 1.00 11.06 O ATOM 1477 ND2 ASN A 198 -9.601 5.681 4.215 1.00 10.91 N ATOM 1478 N TYR A 199 -5.973 4.737 8.394 1.00 6.50 N ATOM 1479 CA TYR A 199 -4.923 3.991 9.101 1.00 7.63 C ATOM 1480 C TYR A 199 -5.471 2.801 9.836 1.00 8.80 C ATOM 1481 O TYR A 199 -6.687 2.662 10.033 1.00 9.52 O ATOM 1482 CB TYR A 199 -4.378 4.967 10.183 1.00 7.21 C ATOM 1483 CG TYR A 199 -3.710 6.180 9.607 1.00 4.64 C ATOM 1484 CD1 TYR A 199 -2.415 6.125 9.084 1.00 3.67 C ATOM 1485 CD2 TYR A 199 -4.433 7.356 9.445 1.00 5.73 C ATOM 1486 CE1 TYR A 199 -1.841 7.258 8.517 1.00 4.30 C ATOM 1487 CE2 TYR A 199 -3.884 8.506 8.870 1.00 6.89 C ATOM 1488 CZ TYR A 199 -2.571 8.438 8.402 1.00 6.37 C ATOM 1489 OH TYR A 199 -2.037 9.547 7.810 1.00 8.07 O ATOM 1490 N ARG A 200 -4.571 1.964 10.272 1.00 7.46 N ATOM 1491 CA ARG A 200 -4.927 0.816 11.062 1.00 7.17 C ATOM 1492 C ARG A 200 -3.956 0.763 12.221 1.00 8.50 C ATOM 1493 O ARG A 200 -2.711 0.817 12.016 1.00 9.65 O ATOM 1494 CB ARG A 200 -4.802 -0.525 10.318 1.00 7.49 C ATOM 1495 CG ARG A 200 -5.059 -1.677 11.281 1.00 9.49 C ATOM 1496 CD ARG A 200 -5.146 -3.029 10.599 1.00 12.84 C ATOM 1497 NE ARG A 200 -6.209 -3.033 9.620 1.00 15.13 N ATOM 1498 CZ ARG A 200 -6.029 -3.092 8.276 1.00 18.45 C ATOM 1499 NH1 ARG A 200 -4.794 -3.136 7.725 1.00 18.92 N ATOM 1500 NH2 ARG A 200 -7.133 -3.101 7.473 1.00 18.48 N ATOM 1501 N VAL A 201 -4.470 0.650 13.422 1.00 7.29 N ATOM 1502 CA VAL A 201 -3.550 0.530 14.581 1.00 8.23 C ATOM 1503 C VAL A 201 -3.764 -0.833 15.123 1.00 9.31 C ATOM 1504 O VAL A 201 -4.925 -1.173 15.431 1.00 9.67 O ATOM 1505 CB VAL A 201 -3.899 1.526 15.676 1.00 7.71 C ATOM 1506 CG1 VAL A 201 -3.055 1.240 16.945 1.00 6.26 C ATOM 1507 CG2 VAL A 201 -3.624 2.927 15.177 1.00 7.44 C ATOM 1508 N THR A 202 -2.734 -1.675 15.175 1.00 7.36 N ATOM 1509 CA THR A 202 -2.924 -3.028 15.611 1.00 7.23 C ATOM 1510 C THR A 202 -2.152 -3.278 16.860 1.00 7.94 C ATOM 1511 O THR A 202 -0.935 -3.030 16.821 1.00 9.46 O ATOM 1512 CB THR A 202 -2.369 -4.002 14.523 1.00 10.83 C ATOM 1513 OG1 THR A 202 -3.045 -3.814 13.284 1.00 11.99 O ATOM 1514 CG2 THR A 202 -2.479 -5.491 14.923 1.00 10.62 C ATOM 1515 N PHE A 203 -2.824 -3.845 17.891 1.00 6.06 N ATOM 1516 CA PHE A 203 -2.090 -4.163 19.115 1.00 6.20 C ATOM 1517 C PHE A 203 -1.625 -5.589 18.984 1.00 7.66 C ATOM 1518 O PHE A 203 -2.392 -6.449 18.517 1.00 8.25 O ATOM 1519 CB PHE A 203 -3.018 -4.024 20.334 1.00 6.81 C ATOM 1520 CG PHE A 203 -3.610 -2.667 20.436 1.00 8.65 C ATOM 1521 CD1 PHE A 203 -2.843 -1.521 20.614 1.00 9.24 C ATOM 1522 CD2 PHE A 203 -4.996 -2.528 20.509 1.00 9.72 C ATOM 1523 CE1 PHE A 203 -3.439 -0.273 20.814 1.00 8.91 C ATOM 1524 CE2 PHE A 203 -5.591 -1.276 20.670 1.00 10.60 C ATOM 1525 CZ PHE A 203 -4.829 -0.120 20.771 1.00 10.28 C ATOM 1526 N CYS A 204 -0.352 -5.832 19.348 1.00 7.83 N ATOM 1527 CA CYS A 204 0.222 -7.175 19.239 1.00 8.55 C ATOM 1528 C CYS A 204 0.248 -7.687 17.830 1.00 10.62 C ATOM 1529 O CYS A 204 -0.247 -8.770 17.614 1.00 11.54 O ATOM 1530 CB CYS A 204 -0.429 -8.246 20.127 1.00 10.06 C ATOM 1531 SG CYS A 204 -0.414 -7.844 21.884 1.00 11.03 S ATOM 1532 N PRO A 205 0.849 -6.934 16.913 1.00 9.27 N ATOM 1533 CA PRO A 205 0.915 -7.314 15.537 1.00 11.09 C ATOM 1534 C PRO A 205 1.681 -8.617 15.377 1.00 16.24 C ATOM 1535 O PRO A 205 2.555 -8.935 16.208 1.00 17.06 O ATOM 1536 CB PRO A 205 1.648 -6.143 14.851 1.00 10.60 C ATOM 1537 CG PRO A 205 2.448 -5.459 15.950 1.00 10.38 C ATOM 1538 CD PRO A 205 1.599 -5.676 17.206 1.00 8.53 C ATOM 1539 N THR A 206 1.377 -9.373 14.338 1.00 21.06 N ATOM 1540 CA THR A 206 2.099 -10.620 14.105 1.00 28.36 C ATOM 1541 C THR A 206 2.932 -10.485 12.828 1.00 35.68 C ATOM 1542 O THR A 206 3.935 -11.144 12.542 1.00 36.60 O ATOM 1543 CB THR A 206 1.155 -11.865 14.150 1.00 28.87 C ATOM 1544 OG1 THR A 206 0.012 -11.661 13.309 1.00 29.83 O ATOM 1545 CG2 THR A 206 0.738 -12.215 15.595 1.00 27.58 C ATOM 1546 N ALA A 207 2.505 -9.527 12.083 1.00 43.95 N ATOM 1547 CA ALA A 207 3.057 -9.125 10.810 1.00 54.34 C ATOM 1548 C ALA A 207 1.989 -8.255 10.158 1.00 62.78 C ATOM 1549 O ALA A 207 2.048 -7.026 10.416 1.00 64.22 O ATOM 1550 CB ALA A 207 3.476 -10.300 9.919 1.00 54.83 C ATOM 1551 OXT ALA A 207 1.069 -8.834 9.501 1.00 65.25 O TER 1552 ALA A 207 HETATM 1553 O HOH A 301 -5.215 18.272 20.222 1.00 62.79 O HETATM 1554 O HOH A 302 -3.307 3.364 34.509 1.00 12.20 O HETATM 1555 O HOH A 303 -9.620 4.599 32.098 1.00 9.13 O HETATM 1556 O HOH A 304 -10.693 10.921 30.446 1.00 14.44 O HETATM 1557 O HOH A 305 -16.918 -1.165 25.364 1.00 17.04 O HETATM 1558 O HOH A 306 -9.930 -11.414 25.135 1.00 26.71 O HETATM 1559 O HOH A 307 6.400 -6.696 25.920 1.00 12.38 O HETATM 1560 O HOH A 308 -1.511 -1.784 11.781 1.00 12.44 O HETATM 1561 O HOH A 309 4.814 6.475 25.147 1.00 8.25 O HETATM 1562 O HOH A 310 10.858 0.219 15.914 1.00 13.22 O HETATM 1563 O HOH A 311 -2.661 8.921 26.321 1.00 17.67 O HETATM 1564 O HOH A 312 11.452 6.797 27.029 1.00 17.72 O HETATM 1565 O HOH A 313 11.984 3.856 21.021 1.00 13.46 O HETATM 1566 O HOH A 314 15.980 9.746 29.005 1.00 24.29 O HETATM 1567 O HOH A 315 -5.103 17.598 3.668 1.00 23.24 O HETATM 1568 O HOH A 316 -1.832 -4.373 33.270 1.00 14.84 O HETATM 1569 O HOH A 317 -0.120 8.428 27.867 1.00 15.49 O HETATM 1570 O HOH A 318 -5.095 15.019 28.418 1.00 18.47 O HETATM 1571 O HOH A 319 -10.506 12.619 6.515 1.00 25.54 O HETATM 1572 O HOH A 320 -15.110 14.352 24.911 1.00 27.76 O HETATM 1573 O HOH A 321 -6.969 -13.278 29.693 1.00 38.90 O HETATM 1574 O HOH A 322 -14.280 -2.651 12.702 1.00 28.56 O HETATM 1575 O HOH A 323 5.071 11.153 22.785 1.00 16.01 O HETATM 1576 O HOH A 324 -4.453 20.308 4.784 1.00 29.15 O HETATM 1577 O HOH A 325 -2.108 16.550 21.853 1.00 28.44 O HETATM 1578 O HOH A 326 3.159 4.980 35.935 1.00 39.66 O HETATM 1579 O HOH A 327 7.184 6.997 4.324 1.00 26.74 O HETATM 1580 O HOH A 328 -5.913 -1.080 2.781 1.00 16.55 O HETATM 1581 O HOH A 329 -15.295 -3.952 32.991 1.00 33.38 O HETATM 1582 O HOH A 330 20.528 -0.494 24.837 1.00 28.68 O HETATM 1583 O HOH A 331 16.572 12.570 28.299 1.00 28.03 O HETATM 1584 O HOH A 332 7.575 6.869 14.767 1.00 13.75 O HETATM 1585 O HOH A 333 -9.752 9.709 4.824 1.00 22.02 O HETATM 1586 O HOH A 334 -8.248 13.297 7.745 1.00 13.79 O HETATM 1587 O HOH A 335 -6.110 11.501 7.531 1.00 11.84 O HETATM 1588 O HOH A 336 -0.870 1.405 24.219 1.00 8.42 O HETATM 1589 O HOH A 337 1.954 1.485 37.834 1.00 32.02 O HETATM 1590 O HOH A 338 -5.789 -6.473 29.855 1.00 11.75 O HETATM 1591 O HOH A 339 2.510 12.847 14.802 1.00 18.28 O HETATM 1592 O HOH A 340 -16.984 6.536 30.451 1.00 12.30 O HETATM 1593 O HOH A 341 -0.492 3.353 34.811 1.00 19.26 O HETATM 1594 O HOH A 342 0.984 14.510 16.862 1.00 23.24 O HETATM 1595 O HOH A 343 0.328 11.292 26.896 1.00 28.07 O HETATM 1596 O HOH A 344 -8.492 2.271 7.758 1.00 19.21 O HETATM 1597 O HOH A 345 10.803 9.663 28.189 1.00 21.32 O HETATM 1598 O HOH A 346 -0.803 -11.692 23.019 1.00 17.11 O HETATM 1599 O HOH A 347 13.114 6.560 29.289 1.00 13.58 O HETATM 1600 O HOH A 348 12.551 9.056 17.254 1.00 30.90 O HETATM 1601 O HOH A 349 -1.060 -13.422 20.481 1.00 33.71 O HETATM 1602 O HOH A 350 -7.573 19.441 16.577 1.00 33.64 O HETATM 1603 O HOH A 351 2.185 -8.199 24.951 1.00 18.91 O HETATM 1604 O HOH A 352 4.415 21.966 4.677 1.00 30.63 O HETATM 1605 O HOH A 353 -16.628 -0.811 14.912 1.00 23.22 O HETATM 1606 O HOH A 354 -19.498 0.923 22.236 1.00 42.86 O HETATM 1607 O HOH A 355 4.578 -1.612 9.738 1.00 25.25 O HETATM 1608 O HOH A 356 22.358 7.471 31.796 1.00 35.11 O HETATM 1609 O HOH A 357 7.930 -11.329 28.736 1.00 29.97 O HETATM 1610 O HOH A 358 -12.049 11.498 34.957 1.00 34.04 O HETATM 1611 O HOH A 359 -16.397 12.351 19.995 1.00 32.98 O HETATM 1612 O HOH A 360 -16.336 10.345 28.733 1.00 36.62 O HETATM 1613 O HOH A 361 16.836 -8.361 30.710 1.00 48.94 O HETATM 1614 O HOH A 362 -8.866 -5.657 37.717 1.00 46.41 O HETATM 1615 O HOH A 363 3.512 -6.618 26.515 1.00 24.79 O HETATM 1616 O HOH A 364 5.556 -10.454 24.149 1.00 27.31 O HETATM 1617 O HOH A 365 12.049 -8.673 21.721 1.00 35.78 O HETATM 1618 O HOH A 366 5.873 -9.368 19.513 1.00 38.73 O HETATM 1619 O HOH A 367 3.438 -8.662 28.889 1.00 20.08 O HETATM 1620 O HOH A 368 -3.419 -7.549 30.451 1.00 28.83 O HETATM 1621 O HOH A 369 9.037 0.409 12.276 1.00 26.63 O HETATM 1622 O HOH A 370 6.499 0.150 7.090 1.00 38.59 O HETATM 1623 O HOH A 371 17.254 -0.366 36.552 1.00 21.57 O HETATM 1624 O HOH A 372 -8.110 7.648 -0.458 1.00 52.42 O HETATM 1625 O HOH A 373 9.505 -3.778 16.236 1.00 25.14 O HETATM 1626 O HOH A 374 10.504 -12.731 23.173 1.00 39.87 O HETATM 1627 O HOH A 375 6.336 -5.306 34.289 1.00 47.29 O HETATM 1628 O HOH A 376 -26.463 -4.297 35.333 1.00 23.31 O HETATM 1629 O HOH A 377 -18.969 0.065 31.718 1.00 23.53 O HETATM 1630 O HOH A 378 -22.491 -1.595 37.967 1.00 20.78 O HETATM 1631 O HOH A 379 5.366 9.842 38.276 1.00 32.86 O HETATM 1632 O HOH A 380 -1.186 11.222 30.629 1.00 54.78 O HETATM 1633 O HOH A 381 8.529 12.978 8.307 1.00 27.41 O HETATM 1634 O HOH A 382 4.135 11.090 1.986 1.00 39.48 O HETATM 1635 O HOH A 383 -0.784 -11.645 18.109 1.00 34.59 O HETATM 1636 O HOH A 384 -5.426 4.936 41.015 1.00 65.81 O HETATM 1637 O HOH A 385 -7.834 -2.425 4.326 1.00 30.48 O HETATM 1638 O HOH A 386 -14.241 12.105 16.773 1.00 38.15 O HETATM 1639 O HOH A 387 -7.842 -2.298 37.211 1.00 27.82 O HETATM 1640 O HOH A 388 -17.449 3.835 17.900 1.00 33.03 O HETATM 1641 O HOH A 389 -4.380 -13.712 19.139 1.00 51.42 O HETATM 1642 O HOH A 390 -0.380 13.421 19.054 1.00 15.65 O HETATM 1643 O HOH A 391 12.235 -11.130 25.604 1.00 42.36 O HETATM 1644 O HOH A 392 -12.345 13.794 15.758 1.00 49.89 O HETATM 1645 O HOH A 393 2.901 19.865 6.045 1.00 20.21 O HETATM 1646 O HOH A 394 -8.280 -13.505 26.426 1.00 37.05 O HETATM 1647 O HOH A 395 11.099 11.893 10.603 1.00 38.19 O HETATM 1648 O HOH A 396 8.141 9.831 5.876 1.00 37.20 O HETATM 1649 O HOH A 397 8.622 14.721 20.870 1.00 40.31 O HETATM 1650 O HOH A 398 20.891 1.363 27.308 1.00 16.97 O HETATM 1651 O HOH A 399 -15.854 -6.083 23.752 1.00 33.34 O HETATM 1652 O HOH A 400 -14.874 -7.030 15.841 1.00 36.60 O HETATM 1653 O HOH A 401 1.328 -0.180 35.350 1.00 21.50 O HETATM 1654 O HOH A 402 -13.863 8.223 37.825 1.00 54.77 O HETATM 1655 O HOH A 403 -5.325 10.919 32.877 1.00 47.04 O HETATM 1656 O HOH A 404 -6.058 8.182 36.485 1.00 44.12 O HETATM 1657 O HOH A 405 -5.073 15.649 0.434 1.00 54.62 O HETATM 1658 O HOH A 406 -1.193 14.785 -0.067 1.00 47.07 O HETATM 1659 O HOH A 407 -4.767 5.240 -1.590 1.00 31.39 O HETATM 1660 O HOH A 408 -2.967 7.759 1.498 1.00 21.12 O HETATM 1661 O HOH A 409 -23.001 1.920 38.480 1.00 70.08 O HETATM 1662 O HOH A 410 10.419 6.095 10.655 1.00 41.34 O HETATM 1663 O HOH A 411 5.839 -10.200 27.188 1.00 37.72 O HETATM 1664 O HOH A 412 14.693 -6.924 32.954 1.00 41.94 O HETATM 1665 O HOH A 413 8.821 1.809 38.065 1.00 31.53 O HETATM 1666 O HOH A 414 7.694 11.375 30.127 1.00 26.32 O HETATM 1667 O HOH A 415 7.636 12.977 36.026 1.00 51.50 O HETATM 1668 O HOH A 416 20.017 14.045 29.466 1.00 45.19 O HETATM 1669 O HOH A 417 16.704 18.907 30.499 1.00 64.99 O HETATM 1670 O HOH A 418 19.232 14.816 22.245 1.00 50.60 O HETATM 1671 O HOH A 419 20.360 3.022 21.469 1.00 42.01 O HETATM 1672 O HOH A 420 17.660 7.390 23.335 1.00 20.22 O HETATM 1673 O HOH A 421 12.610 15.008 19.012 1.00 39.43 O HETATM 1674 O HOH A 422 4.392 -12.783 11.008 1.00 62.59 O HETATM 1675 O HOH A 423 -3.918 -6.338 11.781 1.00 28.55 O CONECT 72 1531 CONECT 415 488 CONECT 488 415 CONECT 522 563 CONECT 563 522 CONECT 913 1446 CONECT 952 1324 CONECT 1004 1072 CONECT 1072 1004 CONECT 1099 1173 CONECT 1173 1099 CONECT 1179 1212 CONECT 1212 1179 CONECT 1324 952 CONECT 1446 913 CONECT 1531 72 MASTER 256 1 0 5 5 0 0 6 1674 1 16 16 END