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*** HYDROLASE (SULFHYDRYL PROTEINASE) 31-MAR-86 9PAP ***elNémo ID: 240110231955690154Job options:ID = 240110231955690154 JOBID = HYDROLASE (SULFHYDRYL PROTEINASE) 31-MAR-86 9PAP USERID = unknown PRIVAT = 0 NMODES = 5 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = 0 CUTOFF = 0 CAONLY = 0 Input data for this run:HEADER HYDROLASE (SULFHYDRYL PROTEINASE) 31-MAR-86 9PAP TITLE STRUCTURE OF PAPAIN REFINED AT 1.65 ANGSTROMS RESOLUTION COMPND MOL_ID: 1; COMPND 2 MOLECULE: PAPAIN; COMPND 3 CHAIN: A; COMPND 4 EC: 3.4.22.2; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: CARICA PAPAYA; SOURCE 3 ORGANISM_COMMON: PAPAYA; SOURCE 4 ORGANISM_TAXID: 3649 KEYWDS HYDROLASE (SULFHYDRYL PROTEINASE) EXPDTA X-RAY DIFFRACTION AUTHOR I.G.KAMPHUIS,J.DRENTH REVDAT 7 29-NOV-17 9PAP 1 HELIX REVDAT 6 24-FEB-09 9PAP 1 VERSN REVDAT 5 01-APR-03 9PAP 1 JRNL REVDAT 4 15-JAN-95 9PAP 1 SPRSDE REVDAT 3 31-OCT-93 9PAP 1 HET REVDAT 2 15-OCT-92 9PAP 1 SHEET REVDAT 1 24-OCT-86 9PAP 0 SPRSDE 24-OCT-86 9PAP 3PAD 8PAP JRNL AUTH I.G.KAMPHUIS,K.H.KALK,M.B.SWARTE,J.DRENTH JRNL TITL STRUCTURE OF PAPAIN REFINED AT 1.65 A RESOLUTION JRNL REF J.MOL.BIOL. V. 179 233 1984 JRNL REFN ISSN 0022-2836 JRNL PMID 6502713 JRNL DOI 10.1016/0022-2836(84)90467-4 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH I.G.KAMPHUIS,J.DRENTH,E.N.BAKER REMARK 1 TITL THIOL PROTEASES. COMPARATIVE STUDIES BASED ON THE REMARK 1 TITL 2 HIGH-RESOLUTION STRUCTURES OF PAPAIN AND ACTINIDIN, AND ON REMARK 1 TITL 3 AMINO ACID SEQUENCE INFORMATION FOR CATHEPSINS B AND H, AND REMARK 1 TITL 4 STEM BROMELAIN REMARK 1 REF J.MOL.BIOL. V. 182 317 1985 REMARK 1 REFN ISSN 0022-2836 REMARK 1 REFERENCE 2 REMARK 1 AUTH J.DRENTH,K.H.KALK,H.M.SWEN REMARK 1 TITL BINDING OF CHLOROMETHYL KETONE SUBSTRATE ANALOGUES TO REMARK 1 TITL 2 CRYSTALLINE PAPAIN REMARK 1 REF BIOCHEMISTRY V. 15 3731 1976 REMARK 1 REFN ISSN 0006-2960 REMARK 1 REFERENCE 3 REMARK 1 AUTH J.DRENTH,J.N.JANSONIUS,R.KOEKOEK,B.G.WOLTHERS REMARK 1 TITL THE STRUCTURE OF PAPAIN REMARK 1 REF ADV.PROTEIN CHEM. V. 25 79 1971 REMARK 1 REFN ISSN 0065-3233 REMARK 1 REFERENCE 4 REMARK 1 AUTH J.DRENTH,J.N.JANSONIUS,R.KOEKOEK,L.A.A.SLUYTERMAN, REMARK 1 AUTH 2 B.G.WOLTHERS REMARK 1 TITL THE STRUCTURE OF THE PAPAIN MOLECULE REMARK 1 REF PHILOS.TRANS.R.SOC.LONDON, V. 257 231 1970 REMARK 1 REF 2 SER.B REMARK 1 REFN ISSN 0080-4622 REMARK 1 REFERENCE 5 REMARK 1 AUTH J.DRENTH,J.N.JANSONIUS,R.KOEKOEK,H.M.SWEN,B.G.WOLTHERS REMARK 1 TITL STRUCTURE OF PAPAIN REMARK 1 REF NATURE V. 218 929 1968 REMARK 1 REFN ISSN 0028-0836 REMARK 2 REMARK 2 RESOLUTION. 1.65 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PROLSQ REMARK 3 AUTHORS : KONNERT,HENDRICKSON REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.65 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : NULL REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : NULL REMARK 3 NUMBER OF REFLECTIONS : NULL REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : NULL REMARK 3 FREE R VALUE TEST SET SELECTION : NULL REMARK 3 R VALUE (WORKING + TEST SET) : 0.161 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 FIT/AGREEMENT OF MODEL WITH ALL DATA. 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 : 1655 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 58 REMARK 3 SOLVENT ATOMS : 195 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM SIGMAA (A) : NULL REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 DISTANCE RESTRAINTS. RMS SIGMA REMARK 3 BOND LENGTH (A) : 0.022 ; NULL REMARK 3 ANGLE DISTANCE (A) : 0.047 ; NULL REMARK 3 INTRAPLANAR 1-4 DISTANCE (A) : NULL ; NULL REMARK 3 H-BOND OR METAL COORDINATION (A) : NULL ; NULL REMARK 3 REMARK 3 PLANE RESTRAINT (A) : NULL ; NULL REMARK 3 CHIRAL-CENTER RESTRAINT (A**3) : NULL ; NULL REMARK 3 REMARK 3 NON-BONDED CONTACT RESTRAINTS. REMARK 3 SINGLE TORSION (A) : NULL ; NULL REMARK 3 MULTIPLE TORSION (A) : NULL ; NULL REMARK 3 H-BOND (X...Y) (A) : NULL ; NULL REMARK 3 H-BOND (X-H...Y) (A) : NULL ; NULL REMARK 3 REMARK 3 CONFORMATIONAL TORSION ANGLE RESTRAINTS. REMARK 3 SPECIFIED (DEGREES) : NULL ; NULL REMARK 3 PLANAR (DEGREES) : NULL ; NULL REMARK 3 STAGGERED (DEGREES) : NULL ; NULL REMARK 3 TRANSVERSE (DEGREES) : NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 9PAP COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 100 THE DEPOSITION ID IS D_1000180069. 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 (%): 52.04 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.56 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 22.60000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 25.44000 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 52.32000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 25.44000 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 22.60000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 52.32000 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 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 LYS A 139 CD CE NZ REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 ND2 ASN A 46 O HOH A 384 1.97 REMARK 500 O MOH A 225 O HOH A 282 2.04 REMARK 500 O HOH A 284 O HOH A 339 2.07 REMARK 500 O HOH A 314 O HOH A 322 2.07 REMARK 500 REMARK 500 REMARK: NULL 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 TRP A 26 NE1 TRP A 26 CE2 -0.093 REMARK 500 GLU A 52 CD GLU A 52 OE2 -0.076 REMARK 500 TRP A 69 NE1 TRP A 69 CE2 -0.095 REMARK 500 TYR A 86 CD1 TYR A 86 CE1 0.096 REMARK 500 TYR A 88 CD1 TYR A 88 CE1 0.090 REMARK 500 CYS A 95 CA CYS A 95 CB -0.101 REMARK 500 GLU A 99 CG GLU A 99 CD 0.102 REMARK 500 TYR A 166 CD1 TYR A 166 CE1 0.090 REMARK 500 TYR A 170 CD1 TYR A 170 CE1 0.091 REMARK 500 GLU A 183 CD GLU A 183 OE2 -0.066 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 GLU A 3 OE1 - CD - OE2 ANGL. DEV. = 11.0 DEGREES REMARK 500 ARG A 8 NE - CZ - NH1 ANGL. DEV. = -5.1 DEGREES REMARK 500 ARG A 8 NE - CZ - NH2 ANGL. DEV. = 5.8 DEGREES REMARK 500 GLN A 9 CA - CB - CG ANGL. DEV. = -15.2 DEGREES REMARK 500 GLN A 9 CB - CG - CD ANGL. DEV. = 17.8 DEGREES REMARK 500 GLY A 23 O - C - N ANGL. DEV. = 10.6 DEGREES REMARK 500 VAL A 32 CA - CB - CG2 ANGL. DEV. = 12.1 DEGREES REMARK 500 GLU A 35 OE1 - CD - OE2 ANGL. DEV. = 8.5 DEGREES REMARK 500 ARG A 41 NE - CZ - NH2 ANGL. DEV. = -3.2 DEGREES REMARK 500 LEU A 45 CB - CG - CD2 ANGL. DEV. = -11.1 DEGREES REMARK 500 TYR A 48 CB - CG - CD1 ANGL. DEV. = -5.5 DEGREES REMARK 500 GLU A 52 OE1 - CD - OE2 ANGL. DEV. = 8.8 DEGREES REMARK 500 ARG A 58 CB - CG - CD ANGL. DEV. = 15.7 DEGREES REMARK 500 ARG A 59 CB - CG - CD ANGL. DEV. = 17.4 DEGREES REMARK 500 ARG A 59 CG - CD - NE ANGL. DEV. = 13.3 DEGREES REMARK 500 TYR A 61 CB - CG - CD1 ANGL. DEV. = -5.3 DEGREES REMARK 500 TYR A 67 CB - CG - CD2 ANGL. DEV. = -7.2 DEGREES REMARK 500 TYR A 82 CB - CG - CD1 ANGL. DEV. = -4.6 DEGREES REMARK 500 ARG A 83 NH1 - CZ - NH2 ANGL. DEV. = 7.2 DEGREES REMARK 500 ARG A 83 NE - CZ - NH2 ANGL. DEV. = -5.9 DEGREES REMARK 500 ASN A 84 CA - CB - CG ANGL. DEV. = -16.7 DEGREES REMARK 500 TYR A 88 CB - CG - CD1 ANGL. DEV. = -4.3 DEGREES REMARK 500 GLU A 89 OE1 - CD - OE2 ANGL. DEV. = 8.2 DEGREES REMARK 500 ARG A 93 CA - CB - CG ANGL. DEV. = 14.2 DEGREES REMARK 500 TYR A 94 CA - CB - CG ANGL. DEV. = -12.7 DEGREES REMARK 500 CYS A 95 CA - CB - SG ANGL. DEV. = 6.9 DEGREES REMARK 500 ARG A 98 CD - NE - CZ ANGL. DEV. = 9.4 DEGREES REMARK 500 GLU A 99 CG - CD - OE1 ANGL. DEV. = -16.2 DEGREES REMARK 500 ASP A 108 CA - CB - CG ANGL. DEV. = -14.3 DEGREES REMARK 500 ASP A 108 CB - CG - OD1 ANGL. DEV. = 12.2 DEGREES REMARK 500 ASP A 108 CB - CG - OD2 ANGL. DEV. = -6.4 DEGREES REMARK 500 VAL A 110 CA - CB - CG1 ANGL. DEV. = 9.8 DEGREES REMARK 500 ARG A 111 NE - CZ - NH2 ANGL. DEV. = -3.8 DEGREES REMARK 500 GLN A 142 CA - CB - CG ANGL. DEV. = -13.8 DEGREES REMARK 500 ARG A 145 CD - NE - CZ ANGL. DEV. = 13.7 DEGREES REMARK 500 ARG A 145 NH1 - CZ - NH2 ANGL. DEV. = 8.7 DEGREES REMARK 500 ARG A 145 NE - CZ - NH1 ANGL. DEV. = -7.6 DEGREES REMARK 500 PHE A 149 CB - CG - CD1 ANGL. DEV. = -5.5 DEGREES REMARK 500 ASN A 155 CA - CB - CG ANGL. DEV. = 15.7 DEGREES REMARK 500 TYR A 166 CB - CG - CD2 ANGL. DEV. = 3.9 DEGREES REMARK 500 TYR A 166 CB - CG - CD1 ANGL. DEV. = -8.5 DEGREES REMARK 500 ASN A 169 CB - CG - OD1 ANGL. DEV. = 14.7 DEGREES REMARK 500 TYR A 170 CB - CG - CD1 ANGL. DEV. = -6.8 DEGREES REMARK 500 GLU A 183 OE1 - CD - OE2 ANGL. DEV. = 14.3 DEGREES REMARK 500 TYR A 186 CB - CG - CD1 ANGL. DEV. = -4.7 DEGREES REMARK 500 TYR A 186 CG - CD1 - CE1 ANGL. DEV. = -5.9 DEGREES REMARK 500 ARG A 188 NE - CZ - NH1 ANGL. DEV. = -3.5 DEGREES REMARK 500 VAL A 199 CA - CB - CG2 ANGL. DEV. = 10.1 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 PRO A 15 156.49 -47.68 REMARK 500 SER A 21 52.05 -94.68 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 ARG A 111 0.11 SIDE CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: MAIN CHAIN PLANARITY REMARK 500 REMARK 500 THE FOLLOWING RESIDUES HAVE A PSEUDO PLANARITY REMARK 500 TORSION ANGLE, C(I) - CA(I) - N(I+1) - O(I), GREATER REMARK 500 10.0 DEGREES. (M=MODEL NUMBER; RES=RESIDUE NAME; REMARK 500 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 500 I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI ANGLE REMARK 500 ARG A 58 -13.52 REMARK 500 ARG A 59 10.44 REMARK 500 CYS A 200 -10.43 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: ACT REMARK 800 EVIDENCE_CODE: UNKNOWN REMARK 800 SITE_DESCRIPTION: NULL REMARK 800 REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 214 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 215 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 216 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 217 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 218 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 219 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 220 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 221 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 222 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 223 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 224 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 225 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 227 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 228 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 229 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 230 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 231 REMARK 800 REMARK 800 SITE_IDENTIFIER: BC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 232 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 233 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 234 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 235 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 236 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 237 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 238 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 239 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 240 REMARK 800 REMARK 800 SITE_IDENTIFIER: CC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 241 REMARK 800 REMARK 800 SITE_IDENTIFIER: DC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOH A 242 DBREF 9PAP A 1 212 UNP P00784 PAPA_CARPA 134 345 SEQADV 9PAP GLN A 47 UNP P00784 GLU 180 CONFLICT SEQADV 9PAP GLN A 118 UNP P00784 GLU 251 CONFLICT SEQADV 9PAP GLN A 135 UNP P00784 GLU 268 CONFLICT SEQRES 1 A 212 ILE PRO GLU TYR VAL ASP TRP ARG GLN LYS GLY ALA VAL SEQRES 2 A 212 THR PRO VAL LYS ASN GLN GLY SER CYS GLY SER OCS TRP SEQRES 3 A 212 ALA PHE SER ALA VAL VAL THR ILE GLU GLY ILE ILE LYS SEQRES 4 A 212 ILE ARG THR GLY ASN LEU ASN GLN TYR SER GLU GLN GLU SEQRES 5 A 212 LEU LEU ASP CYS ASP ARG ARG SER TYR GLY CYS ASN GLY SEQRES 6 A 212 GLY TYR PRO TRP SER ALA LEU GLN LEU VAL ALA GLN TYR SEQRES 7 A 212 GLY ILE HIS TYR ARG ASN THR TYR PRO TYR GLU GLY VAL SEQRES 8 A 212 GLN ARG TYR CYS ARG SER ARG GLU LYS GLY PRO TYR ALA SEQRES 9 A 212 ALA LYS THR ASP GLY VAL ARG GLN VAL GLN PRO TYR ASN SEQRES 10 A 212 GLN GLY ALA LEU LEU TYR SER ILE ALA ASN GLN PRO VAL SEQRES 11 A 212 SER VAL VAL LEU GLN ALA ALA GLY LYS ASP PHE GLN LEU SEQRES 12 A 212 TYR ARG GLY GLY ILE PHE VAL GLY PRO CYS GLY ASN LYS SEQRES 13 A 212 VAL ASP HIS ALA VAL ALA ALA VAL GLY TYR GLY PRO ASN SEQRES 14 A 212 TYR ILE LEU ILE LYS ASN SER TRP GLY THR GLY TRP GLY SEQRES 15 A 212 GLU ASN GLY TYR ILE ARG ILE LYS ARG GLY THR GLY ASN SEQRES 16 A 212 SER TYR GLY VAL CYS GLY LEU TYR THR SER SER PHE TYR SEQRES 17 A 212 PRO VAL LYS ASN MODRES 9PAP OCS A 25 CYS CYSTEINESULFONIC ACID HET OCS A 25 9 HET MOH A 214 2 HET MOH A 215 2 HET MOH A 216 2 HET MOH A 217 2 HET MOH A 218 2 HET MOH A 219 2 HET MOH A 220 2 HET MOH A 221 2 HET MOH A 222 2 HET MOH A 223 2 HET MOH A 224 2 HET MOH A 225 2 HET MOH A 226 2 HET MOH A 227 2 HET MOH A 228 2 HET MOH A 229 2 HET MOH A 230 2 HET MOH A 231 2 HET MOH A 232 2 HET MOH A 233 2 HET MOH A 234 2 HET MOH A 235 2 HET MOH A 236 2 HET MOH A 237 2 HET MOH A 238 2 HET MOH A 239 2 HET MOH A 240 2 HET MOH A 241 2 HET MOH A 242 2 HETNAM OCS CYSTEINESULFONIC ACID HETNAM MOH METHANOL FORMUL 1 OCS C3 H7 N O5 S FORMUL 2 MOH 29(C H4 O) FORMUL 31 HOH *195(H2 O) HELIX 1 L1 SER A 24 GLY A 43 1DISRUPTION IN THE CENTER 20 HELIX 2 L2 GLU A 50 ASP A 57 1 8 HELIX 3 L3 TYR A 67 TYR A 78 1 12 HELIX 4 R1 ASN A 117 GLN A 128 1 12 HELIX 5 R2 GLY A 138 LEU A 143 1 6 SHEET 1 S1 4 VAL A 5 TRP A 7 0 SHEET 2 S1 4 VAL A 164 GLY A 167 -1 O TYR A 166 N VAL A 5 SHEET 3 S1 4 TYR A 170 ASN A 175 -1 O LEU A 172 N VAL A 164 SHEET 4 S1 4 GLY A 185 ARG A 191 -1 O ILE A 187 N ILE A 173 SHEET 1 S2 4 ASP A 108 VAL A 113 0 SHEET 2 S2 4 SER A 206 VAL A 210 -1 O TYR A 208 N ARG A 111 SHEET 3 S2 4 VAL A 130 LEU A 134 -1 O SER A 131 N PHE A 207 SHEET 4 S2 4 ASP A 158 ALA A 163 -1 O VAL A 161 N VAL A 132 SSBOND 1 CYS A 22 CYS A 63 1555 1555 2.08 SSBOND 2 CYS A 56 CYS A 95 1555 1555 2.07 SSBOND 3 CYS A 153 CYS A 200 1555 1555 2.05 LINK C SER A 24 N OCS A 25 1555 1555 1.31 LINK C OCS A 25 N TRP A 26 1555 1555 1.28 CISPEP 1 GLY A 151 PRO A 152 0 2.09 SITE 1 ACT 2 HIS A 159 ASN A 175 SITE 1 AC1 4 TYR A 78 LYS A 106 HOH A 341 HOH A 432 SITE 1 AC2 3 LEU A 143 ARG A 145 GLY A 146 SITE 1 AC3 2 ILE A 40 ARG A 41 SITE 1 AC4 2 ALA A 126 ASN A 127 SITE 1 AC5 3 SER A 97 GLY A 101 TYR A 103 SITE 1 AC6 5 CYS A 153 GLY A 154 CYS A 200 HOH A 299 SITE 2 AC6 5 HOH A 413 SITE 1 AC7 3 SER A 124 ASN A 127 GLN A 128 SITE 1 AC8 3 OCS A 25 GLY A 65 GLY A 66 SITE 1 AC9 1 HOH A 383 SITE 1 BC1 2 ARG A 145 GLY A 194 SITE 1 BC2 3 ARG A 111 GLN A 112 HOH A 336 SITE 1 BC3 2 PRO A 68 HOH A 282 SITE 1 BC4 1 HOH A 363 SITE 1 BC5 4 ASP A 140 GLY A 151 PRO A 152 HOH A 390 SITE 1 BC6 2 PRO A 15 HOH A 379 SITE 1 BC7 3 GLY A 20 SER A 21 HOH A 414 SITE 1 BC8 1 TYR A 78 SITE 1 BC9 2 ASN A 18 GLY A 20 SITE 1 CC1 3 ARG A 188 MOH A 235 HOH A 404 SITE 1 CC2 1 ASN A 64 SITE 1 CC3 4 GLY A 147 GLU A 183 ARG A 188 MOH A 233 SITE 1 CC4 1 TYR A 208 SITE 1 CC5 6 THR A 42 ASN A 44 ASN A 46 TYR A 82 SITE 2 CC5 6 HOH A 287 HOH A 328 SITE 1 CC6 2 TYR A 82 HOH A 416 SITE 1 CC7 5 ILE A 37 ARG A 41 ASN A 127 GLN A 128 SITE 2 CC7 5 HOH A 388 SITE 1 CC8 2 TYR A 116 SER A 196 SITE 1 CC9 2 GLN A 142 HOH A 381 SITE 1 DC1 3 ARG A 59 TYR A 61 TYR A 67 CRYST1 45.200 104.640 50.880 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 0.022124 0.000000 0.000000 0.00000 SCALE2 0.000000 0.009557 0.000000 0.00000 SCALE3 0.000000 0.000000 0.019654 0.00000 ATOM 1 N ILE A 1 35.777 56.566 -4.248 1.00 27.36 N ATOM 2 CA ILE A 1 36.362 57.401 -3.154 1.00 18.63 C ATOM 3 C ILE A 1 37.586 56.660 -2.600 1.00 26.92 C ATOM 4 O ILE A 1 37.724 55.421 -2.562 1.00 24.50 O ATOM 5 CB ILE A 1 35.313 57.630 -2.080 1.00 13.60 C ATOM 6 CG1 ILE A 1 34.791 56.335 -1.379 1.00 16.35 C ATOM 7 CG2 ILE A 1 34.186 58.464 -2.701 1.00 15.83 C ATOM 8 CD1 ILE A 1 33.606 56.698 -0.492 1.00 10.98 C ATOM 9 N PRO A 2 38.564 57.482 -2.182 1.00 21.14 N ATOM 10 CA PRO A 2 39.810 57.032 -1.652 1.00 20.36 C ATOM 11 C PRO A 2 39.558 56.197 -0.370 1.00 13.98 C ATOM 12 O PRO A 2 38.561 56.333 0.372 1.00 13.68 O ATOM 13 CB PRO A 2 40.585 58.275 -1.299 1.00 24.67 C ATOM 14 CG PRO A 2 39.791 59.433 -1.786 1.00 18.03 C ATOM 15 CD PRO A 2 38.369 58.931 -2.057 1.00 12.40 C ATOM 16 N GLU A 3 40.632 55.472 -0.127 1.00 10.22 N ATOM 17 CA GLU A 3 40.770 54.630 1.055 1.00 19.67 C ATOM 18 C GLU A 3 40.948 55.426 2.354 1.00 21.18 C ATOM 19 O GLU A 3 40.433 55.020 3.416 1.00 14.60 O ATOM 20 CB GLU A 3 42.049 53.745 0.855 1.00 19.54 C ATOM 21 CG GLU A 3 42.074 52.634 1.908 1.00 8.43 C ATOM 22 CD GLU A 3 43.333 51.695 1.794 1.00 32.67 C ATOM 23 OE1 GLU A 3 44.160 52.240 1.035 1.00 29.56 O ATOM 24 OE2 GLU A 3 43.312 50.671 2.406 1.00 20.68 O ATOM 25 N TYR A 4 41.694 56.563 2.189 1.00 13.38 N ATOM 26 CA TYR A 4 41.967 57.533 3.235 1.00 14.45 C ATOM 27 C TYR A 4 41.457 58.933 2.818 1.00 12.89 C ATOM 28 O TYR A 4 41.815 59.430 1.718 1.00 12.74 O ATOM 29 CB TYR A 4 43.545 57.646 3.534 1.00 15.37 C ATOM 30 CG TYR A 4 44.051 56.438 4.319 1.00 22.91 C ATOM 31 CD1 TYR A 4 44.002 56.462 5.715 1.00 27.55 C ATOM 32 CD2 TYR A 4 44.546 55.317 3.658 1.00 33.04 C ATOM 33 CE1 TYR A 4 44.489 55.270 6.432 1.00 24.63 C ATOM 34 CE2 TYR A 4 45.029 54.151 4.333 1.00 14.58 C ATOM 35 CZ TYR A 4 44.966 54.220 5.713 1.00 13.60 C ATOM 36 OH TYR A 4 45.400 53.150 6.486 1.00 23.99 O ATOM 37 N VAL A 5 40.772 59.646 3.732 1.00 11.75 N ATOM 38 CA VAL A 5 40.482 61.062 3.472 1.00 12.05 C ATOM 39 C VAL A 5 40.860 61.854 4.717 1.00 12.69 C ATOM 40 O VAL A 5 40.524 61.390 5.797 1.00 9.66 O ATOM 41 CB VAL A 5 39.044 61.273 3.037 1.00 11.57 C ATOM 42 CG1 VAL A 5 38.612 62.748 3.258 1.00 19.37 C ATOM 43 CG2 VAL A 5 38.752 60.861 1.566 1.00 11.69 C ATOM 44 N ASP A 6 41.652 62.918 4.639 1.00 10.79 N ATOM 45 CA ASP A 6 41.971 63.791 5.743 1.00 6.65 C ATOM 46 C ASP A 6 41.908 65.238 5.259 1.00 11.42 C ATOM 47 O ASP A 6 42.946 65.659 4.758 1.00 9.96 O ATOM 48 CB ASP A 6 43.435 63.557 6.178 1.00 9.97 C ATOM 49 CG ASP A 6 43.702 64.245 7.492 1.00 19.09 C ATOM 50 OD1 ASP A 6 43.108 65.266 7.788 1.00 14.00 O ATOM 51 OD2 ASP A 6 44.504 63.793 8.260 1.00 17.84 O ATOM 52 N TRP A 7 40.851 65.989 5.537 1.00 10.30 N ATOM 53 CA TRP A 7 40.741 67.366 5.117 1.00 9.60 C ATOM 54 C TRP A 7 41.756 68.305 5.787 1.00 8.45 C ATOM 55 O TRP A 7 41.979 69.404 5.259 1.00 8.84 O ATOM 56 CB TRP A 7 39.280 67.841 5.351 1.00 7.06 C ATOM 57 CG TRP A 7 38.344 67.166 4.307 1.00 12.95 C ATOM 58 CD1 TRP A 7 37.374 66.241 4.482 1.00 9.46 C ATOM 59 CD2 TRP A 7 38.385 67.452 2.924 1.00 11.25 C ATOM 60 NE1 TRP A 7 36.776 65.923 3.172 1.00 9.66 N ATOM 61 CE2 TRP A 7 37.398 66.657 2.293 1.00 14.00 C ATOM 62 CE3 TRP A 7 39.160 68.307 2.181 1.00 12.31 C ATOM 63 CZ2 TRP A 7 37.161 66.686 0.913 1.00 12.31 C ATOM 64 CZ3 TRP A 7 38.921 68.333 0.788 1.00 9.87 C ATOM 65 CH2 TRP A 7 37.961 67.543 0.208 1.00 4.94 C ATOM 66 N ARG A 8 42.359 67.801 6.897 1.00 10.06 N ATOM 67 CA ARG A 8 43.359 68.640 7.572 1.00 11.68 C ATOM 68 C ARG A 8 44.622 68.695 6.671 1.00 7.18 C ATOM 69 O ARG A 8 45.136 69.778 6.351 1.00 15.79 O ATOM 70 CB ARG A 8 43.807 68.181 8.960 1.00 13.89 C ATOM 71 CG ARG A 8 42.599 67.960 9.918 1.00 12.88 C ATOM 72 CD ARG A 8 43.390 67.360 11.159 1.00 18.02 C ATOM 73 NE ARG A 8 43.852 66.038 10.722 1.00 29.61 N ATOM 74 CZ ARG A 8 44.275 65.035 11.486 1.00 33.59 C ATOM 75 NH1 ARG A 8 44.315 65.293 12.789 1.00 16.15 N ATOM 76 NH2 ARG A 8 44.789 63.895 11.060 1.00 18.67 N ATOM 77 N GLN A 9 44.902 67.537 6.082 1.00 12.47 N ATOM 78 CA GLN A 9 46.060 67.372 5.227 1.00 17.22 C ATOM 79 C GLN A 9 45.830 68.172 3.971 1.00 16.10 C ATOM 80 O GLN A 9 46.840 68.593 3.413 1.00 19.22 O ATOM 81 CB GLN A 9 46.312 65.899 4.769 1.00 16.64 C ATOM 82 CG GLN A 9 46.840 65.373 6.033 1.00 63.11 C ATOM 83 CD GLN A 9 47.263 63.975 6.380 1.00 65.48 C ATOM 84 OE1 GLN A 9 47.186 63.036 5.502 1.00 60.52 O ATOM 85 NE2 GLN A 9 47.688 63.824 7.591 1.00 43.03 N ATOM 86 N LYS A 10 44.603 68.293 3.518 1.00 11.48 N ATOM 87 CA LYS A 10 44.282 69.013 2.307 1.00 8.64 C ATOM 88 C LYS A 10 44.147 70.473 2.563 1.00 13.28 C ATOM 89 O LYS A 10 44.026 71.178 1.542 1.00 14.81 O ATOM 90 CB LYS A 10 43.069 68.378 1.638 1.00 19.10 C ATOM 91 CG LYS A 10 43.467 67.164 0.817 1.00 25.71 C ATOM 92 CD LYS A 10 42.362 66.152 0.574 1.00 49.16 C ATOM 93 CE LYS A 10 41.989 65.204 1.691 1.00 61.87 C ATOM 94 NZ LYS A 10 42.605 63.844 1.697 1.00 19.23 N ATOM 95 N GLY A 11 44.378 70.969 3.775 1.00 7.26 N ATOM 96 CA GLY A 11 44.337 72.395 4.060 1.00 7.35 C ATOM 97 C GLY A 11 42.926 72.952 4.211 1.00 10.62 C ATOM 98 O GLY A 11 42.807 74.230 4.077 1.00 13.31 O ATOM 99 N ALA A 12 41.923 72.132 4.537 1.00 7.81 N ATOM 100 CA ALA A 12 40.514 72.597 4.603 1.00 5.19 C ATOM 101 C ALA A 12 40.000 72.716 6.057 1.00 7.80 C ATOM 102 O ALA A 12 38.785 72.851 6.238 1.00 9.18 O ATOM 103 CB ALA A 12 39.526 71.694 3.812 1.00 6.99 C ATOM 104 N VAL A 13 40.853 72.584 7.017 1.00 5.51 N ATOM 105 CA VAL A 13 40.502 72.565 8.462 1.00 9.31 C ATOM 106 C VAL A 13 41.383 73.450 9.314 1.00 2.03 C ATOM 107 O VAL A 13 42.584 73.546 9.140 1.00 8.32 O ATOM 108 CB VAL A 13 40.563 71.104 8.984 1.00 4.10 C ATOM 109 CG1 VAL A 13 40.040 71.015 10.490 1.00 9.07 C ATOM 110 CG2 VAL A 13 39.965 70.048 8.155 1.00 12.20 C ATOM 111 N THR A 14 40.717 74.341 10.067 1.00 5.83 N ATOM 112 CA THR A 14 41.366 75.304 10.969 1.00 2.66 C ATOM 113 C THR A 14 41.658 74.678 12.324 1.00 10.98 C ATOM 114 O THR A 14 41.133 73.577 12.603 1.00 9.32 O ATOM 115 CB THR A 14 40.488 76.569 10.984 1.00 5.28 C ATOM 116 OG1 THR A 14 39.358 76.203 11.799 1.00 9.44 O ATOM 117 CG2 THR A 14 40.058 77.069 9.648 1.00 8.98 C ATOM 118 N PRO A 15 42.479 75.348 13.114 1.00 9.61 N ATOM 119 CA PRO A 15 42.899 74.904 14.480 1.00 7.60 C ATOM 120 C PRO A 15 41.686 74.475 15.276 1.00 9.92 C ATOM 121 O PRO A 15 40.527 74.942 15.169 1.00 9.23 O ATOM 122 CB PRO A 15 43.581 76.132 15.045 1.00 14.51 C ATOM 123 CG PRO A 15 44.286 76.643 13.805 1.00 9.95 C ATOM 124 CD PRO A 15 43.111 76.662 12.807 1.00 8.75 C ATOM 125 N VAL A 16 41.948 73.640 16.258 1.00 8.44 N ATOM 126 CA VAL A 16 40.888 73.066 17.133 1.00 15.90 C ATOM 127 C VAL A 16 40.448 74.178 18.055 1.00 10.96 C ATOM 128 O VAL A 16 41.375 74.893 18.547 1.00 10.81 O ATOM 129 CB VAL A 16 41.543 71.860 17.851 1.00 11.85 C ATOM 130 CG1 VAL A 16 40.968 71.645 19.201 1.00 12.21 C ATOM 131 CG2 VAL A 16 41.473 70.587 16.949 1.00 8.46 C ATOM 132 N LYS A 17 39.159 74.292 18.413 1.00 8.36 N ATOM 133 CA LYS A 17 38.681 75.313 19.351 1.00 5.82 C ATOM 134 C LYS A 17 38.155 74.617 20.615 1.00 7.46 C ATOM 135 O LYS A 17 37.893 73.446 20.578 1.00 7.85 O ATOM 136 CB LYS A 17 37.580 76.217 18.843 1.00 11.80 C ATOM 137 CG LYS A 17 37.675 76.644 17.392 1.00 14.31 C ATOM 138 CD LYS A 17 38.964 77.225 17.046 1.00 14.06 C ATOM 139 CE LYS A 17 39.066 78.044 15.794 1.00 6.30 C ATOM 140 NZ LYS A 17 39.049 77.376 14.473 1.00 10.43 N ATOM 141 N ASN A 18 37.913 75.431 21.634 1.00 14.72 N ATOM 142 CA ASN A 18 37.294 74.991 22.912 1.00 10.27 C ATOM 143 C ASN A 18 36.007 75.755 23.158 1.00 8.74 C ATOM 144 O ASN A 18 36.029 77.063 23.142 1.00 17.04 O ATOM 145 CB ASN A 18 38.351 75.286 24.014 1.00 10.44 C ATOM 146 CG ASN A 18 37.869 74.603 25.285 1.00 14.25 C ATOM 147 OD1 ASN A 18 36.719 74.205 25.399 1.00 12.36 O ATOM 148 ND2 ASN A 18 38.784 74.460 26.278 1.00 21.59 N ATOM 149 N GLN A 19 34.838 75.110 23.256 1.00 6.16 N ATOM 150 CA GLN A 19 33.575 75.807 23.358 1.00 6.64 C ATOM 151 C GLN A 19 33.431 76.299 24.846 1.00 8.64 C ATOM 152 O GLN A 19 32.554 77.127 25.084 1.00 11.00 O ATOM 153 CB GLN A 19 32.386 74.933 23.104 1.00 10.30 C ATOM 154 CG GLN A 19 32.307 73.728 23.957 1.00 11.36 C ATOM 155 CD GLN A 19 31.241 72.724 23.468 1.00 11.12 C ATOM 156 OE1 GLN A 19 31.470 72.028 22.433 1.00 14.03 O ATOM 157 NE2 GLN A 19 30.151 72.573 24.058 1.00 12.41 N ATOM 158 N GLY A 20 34.256 75.685 25.675 1.00 16.41 N ATOM 159 CA GLY A 20 34.238 76.074 27.125 1.00 11.26 C ATOM 160 C GLY A 20 32.959 75.594 27.743 1.00 16.53 C ATOM 161 O GLY A 20 32.464 74.515 27.301 1.00 20.66 O ATOM 162 N SER A 21 32.407 76.299 28.727 1.00 22.43 N ATOM 163 CA SER A 21 31.173 75.829 29.408 1.00 29.16 C ATOM 164 C SER A 21 29.860 76.385 28.868 1.00 32.58 C ATOM 165 O SER A 21 29.019 76.954 29.605 1.00 53.86 O ATOM 166 CB SER A 21 31.309 76.220 30.872 1.00 22.05 C ATOM 167 OG SER A 21 32.185 77.340 30.934 1.00 63.06 O ATOM 168 N CYS A 22 29.664 76.272 27.581 1.00 11.60 N ATOM 169 CA CYS A 22 28.518 76.841 26.880 1.00 4.52 C ATOM 170 C CYS A 22 28.232 75.702 25.897 1.00 8.91 C ATOM 171 O CYS A 22 29.250 75.170 25.465 1.00 13.72 O ATOM 172 CB CYS A 22 28.922 78.106 26.237 1.00 18.10 C ATOM 173 SG CYS A 22 27.709 78.666 24.932 1.00 14.04 S ATOM 174 N GLY A 23 27.021 75.307 25.781 1.00 4.59 N ATOM 175 CA GLY A 23 26.687 74.108 24.942 1.00 13.11 C ATOM 176 C GLY A 23 26.385 74.697 23.511 1.00 7.82 C ATOM 177 O GLY A 23 25.254 74.653 23.072 1.00 11.27 O ATOM 178 N SER A 24 27.525 75.141 23.025 1.00 10.35 N ATOM 179 CA SER A 24 27.622 75.774 21.726 1.00 7.80 C ATOM 180 C SER A 24 28.194 74.863 20.638 1.00 5.05 C ATOM 181 O SER A 24 28.305 75.318 19.496 1.00 11.85 O ATOM 182 CB SER A 24 28.460 77.037 21.765 1.00 11.68 C ATOM 183 OG SER A 24 29.782 76.847 22.238 1.00 9.19 O HETATM 184 N OCS A 25 28.275 73.587 20.928 1.00 5.83 N HETATM 185 CA OCS A 25 28.795 72.582 19.999 1.00 1.95 C HETATM 186 CB OCS A 25 28.752 71.158 20.610 1.00 11.35 C HETATM 187 SG OCS A 25 27.218 70.786 21.442 1.00 16.15 S HETATM 188 C OCS A 25 28.113 72.682 18.650 1.00 4.66 C HETATM 189 O OCS A 25 28.882 72.580 17.639 1.00 11.59 O HETATM 190 OD1 OCS A 25 27.433 71.478 22.772 1.00 14.24 O HETATM 191 OD2 OCS A 25 26.057 71.420 20.892 1.00 20.03 O HETATM 192 OD3 OCS A 25 27.128 69.383 21.436 1.00 25.97 O ATOM 193 N TRP A 26 26.847 72.854 18.585 1.00 8.53 N ATOM 194 CA TRP A 26 26.082 72.965 17.359 1.00 1.76 C ATOM 195 C TRP A 26 26.652 74.015 16.413 1.00 8.69 C ATOM 196 O TRP A 26 26.702 73.726 15.227 1.00 8.08 O ATOM 197 CB TRP A 26 24.597 73.074 17.632 1.00 5.23 C ATOM 198 CG TRP A 26 24.336 74.326 18.554 1.00 7.76 C ATOM 199 CD1 TRP A 26 24.427 74.429 19.898 1.00 5.95 C ATOM 200 CD2 TRP A 26 23.965 75.606 18.094 1.00 7.66 C ATOM 201 NE1 TRP A 26 24.097 75.798 20.258 1.00 6.71 N ATOM 202 CE2 TRP A 26 23.825 76.482 19.213 1.00 8.83 C ATOM 203 CE3 TRP A 26 23.734 76.075 16.791 1.00 11.30 C ATOM 204 CZ2 TRP A 26 23.476 77.784 19.107 1.00 7.53 C ATOM 205 CZ3 TRP A 26 23.371 77.420 16.710 1.00 4.69 C ATOM 206 CH2 TRP A 26 23.249 78.241 17.839 1.00 7.17 C ATOM 207 N ALA A 27 27.162 75.137 16.911 1.00 7.97 N ATOM 208 CA ALA A 27 27.613 76.305 16.212 1.00 8.05 C ATOM 209 C ALA A 27 29.041 76.031 15.775 1.00 4.93 C ATOM 210 O ALA A 27 29.391 76.243 14.588 1.00 5.29 O ATOM 211 CB ALA A 27 27.688 77.527 17.158 1.00 7.27 C ATOM 212 N PHE A 28 29.768 75.375 16.651 1.00 4.68 N ATOM 213 CA PHE A 28 31.168 74.950 16.362 1.00 3.57 C ATOM 214 C PHE A 28 31.173 73.956 15.210 1.00 11.91 C ATOM 215 O PHE A 28 31.983 74.059 14.240 1.00 10.72 O ATOM 216 CB PHE A 28 31.847 74.369 17.596 1.00 6.33 C ATOM 217 CG PHE A 28 32.429 75.493 18.394 1.00 19.43 C ATOM 218 CD1 PHE A 28 31.670 76.129 19.370 1.00 12.15 C ATOM 219 CD2 PHE A 28 33.705 75.905 18.165 1.00 12.26 C ATOM 220 CE1 PHE A 28 32.299 77.212 20.105 1.00 6.44 C ATOM 221 CE2 PHE A 28 34.251 76.983 18.936 1.00 17.25 C ATOM 222 CZ PHE A 28 33.587 77.620 19.886 1.00 3.71 C ATOM 223 N SER A 29 30.272 73.029 15.311 1.00 5.86 N ATOM 224 CA SER A 29 30.128 71.956 14.253 1.00 6.33 C ATOM 225 C SER A 29 29.800 72.573 12.901 1.00 13.77 C ATOM 226 O SER A 29 30.375 72.207 11.848 1.00 2.97 O ATOM 227 CB SER A 29 28.966 71.095 14.820 1.00 9.55 C ATOM 228 OG SER A 29 28.621 70.062 13.873 1.00 18.48 O ATOM 229 N ALA A 30 28.793 73.422 12.811 1.00 7.28 N ATOM 230 CA ALA A 30 28.328 74.063 11.608 1.00 8.85 C ATOM 231 C ALA A 30 29.501 74.846 11.011 1.00 12.88 C ATOM 232 O ALA A 30 29.804 74.785 9.752 1.00 5.47 O ATOM 233 CB ALA A 30 27.172 74.993 11.982 1.00 5.93 C ATOM 234 N VAL A 31 30.245 75.531 11.877 1.00 6.16 N ATOM 235 CA VAL A 31 31.357 76.400 11.370 1.00 11.35 C ATOM 236 C VAL A 31 32.460 75.552 10.734 1.00 5.27 C ATOM 237 O VAL A 31 32.948 75.993 9.621 1.00 7.95 O ATOM 238 CB VAL A 31 31.857 77.420 12.367 1.00 1.00 C ATOM 239 CG1 VAL A 31 33.249 78.010 12.165 1.00 1.46 C ATOM 240 CG2 VAL A 31 30.847 78.564 12.533 1.00 8.21 C ATOM 241 N VAL A 32 32.770 74.364 11.267 1.00 4.62 N ATOM 242 CA VAL A 32 33.802 73.574 10.556 1.00 5.93 C ATOM 243 C VAL A 32 33.378 73.309 9.107 1.00 6.33 C ATOM 244 O VAL A 32 34.276 73.299 8.242 1.00 9.34 O ATOM 245 CB VAL A 32 34.409 72.424 11.343 1.00 12.11 C ATOM 246 CG1 VAL A 32 34.060 72.524 12.801 1.00 14.37 C ATOM 247 CG2 VAL A 32 34.707 71.058 10.726 1.00 9.34 C ATOM 248 N THR A 33 32.123 72.956 8.829 1.00 5.23 N ATOM 249 CA THR A 33 31.565 72.609 7.546 1.00 6.27 C ATOM 250 C THR A 33 31.582 73.834 6.590 1.00 12.78 C ATOM 251 O THR A 33 31.886 73.651 5.387 1.00 7.27 O ATOM 252 CB THR A 33 30.194 71.994 7.638 1.00 5.60 C ATOM 253 OG1 THR A 33 29.289 73.032 7.930 1.00 9.10 O ATOM 254 CG2 THR A 33 30.125 70.875 8.645 1.00 2.81 C ATOM 255 N ILE A 34 31.371 75.005 7.190 1.00 6.41 N ATOM 256 CA ILE A 34 31.492 76.257 6.371 1.00 5.04 C ATOM 257 C ILE A 34 32.936 76.574 6.002 1.00 7.56 C ATOM 258 O ILE A 34 33.295 76.953 4.836 1.00 6.50 O ATOM 259 CB ILE A 34 30.746 77.405 7.142 1.00 6.41 C ATOM 260 CG1 ILE A 34 29.222 77.057 7.195 1.00 8.73 C ATOM 261 CG2 ILE A 34 31.184 78.712 6.464 1.00 4.03 C ATOM 262 CD1 ILE A 34 28.393 77.730 8.263 1.00 35.20 C ATOM 263 N GLU A 35 33.862 76.567 6.992 1.00 7.07 N ATOM 264 CA GLU A 35 35.315 76.745 6.657 1.00 7.76 C ATOM 265 C GLU A 35 35.811 75.783 5.583 1.00 8.02 C ATOM 266 O GLU A 35 36.553 76.086 4.666 1.00 11.15 O ATOM 267 CB GLU A 35 36.174 76.459 7.947 1.00 4.76 C ATOM 268 CG GLU A 35 35.823 77.513 9.003 1.00 1.00 C ATOM 269 CD GLU A 35 36.431 77.408 10.413 1.00 5.44 C ATOM 270 OE1 GLU A 35 36.827 76.246 10.651 1.00 8.99 O ATOM 271 OE2 GLU A 35 36.446 78.437 11.094 1.00 9.28 O ATOM 272 N GLY A 36 35.370 74.492 5.690 1.00 3.94 N ATOM 273 CA GLY A 36 35.654 73.447 4.737 1.00 2.24 C ATOM 274 C GLY A 36 35.137 73.703 3.339 1.00 5.12 C ATOM 275 O GLY A 36 35.931 73.543 2.417 1.00 7.17 O ATOM 276 N ILE A 37 33.871 74.008 3.158 1.00 6.07 N ATOM 277 CA ILE A 37 33.284 74.186 1.799 1.00 8.11 C ATOM 278 C ILE A 37 33.773 75.482 1.158 1.00 8.12 C ATOM 279 O ILE A 37 34.005 75.560 -0.094 1.00 6.17 O ATOM 280 CB ILE A 37 31.743 74.004 1.815 1.00 9.62 C ATOM 281 CG1 ILE A 37 31.173 73.732 0.350 1.00 7.34 C ATOM 282 CG2 ILE A 37 31.097 75.262 2.429 1.00 4.09 C ATOM 283 CD1 ILE A 37 31.812 72.436 -0.267 1.00 11.03 C ATOM 284 N ILE A 38 34.049 76.526 1.902 1.00 3.13 N ATOM 285 CA ILE A 38 34.582 77.785 1.286 1.00 15.71 C ATOM 286 C ILE A 38 35.994 77.453 0.788 1.00 13.95 C ATOM 287 O ILE A 38 36.441 77.899 -0.315 1.00 12.69 O ATOM 288 CB ILE A 38 34.535 78.946 2.287 1.00 9.76 C ATOM 289 CG1 ILE A 38 33.077 79.235 2.739 1.00 13.78 C ATOM 290 CG2 ILE A 38 35.149 80.170 1.647 1.00 6.27 C ATOM 291 CD1 ILE A 38 32.133 79.497 1.522 1.00 11.45 C ATOM 292 N LYS A 39 36.748 76.704 1.645 1.00 10.74 N ATOM 293 CA LYS A 39 38.127 76.362 1.161 1.00 4.26 C ATOM 294 C LYS A 39 38.005 75.565 -0.132 1.00 8.78 C ATOM 295 O LYS A 39 38.693 75.851 -1.111 1.00 8.56 O ATOM 296 CB LYS A 39 38.945 75.732 2.251 1.00 5.99 C ATOM 297 CG LYS A 39 40.187 75.045 1.752 1.00 8.69 C ATOM 298 CD LYS A 39 41.185 76.046 1.136 1.00 16.76 C ATOM 299 CE LYS A 39 42.337 75.300 0.414 1.00 13.60 C ATOM 300 NZ LYS A 39 43.492 76.249 0.303 1.00 6.55 N ATOM 301 N ILE A 40 37.172 74.508 -0.144 1.00 6.89 N ATOM 302 CA ILE A 40 37.016 73.596 -1.310 1.00 5.98 C ATOM 303 C ILE A 40 36.644 74.373 -2.563 1.00 9.72 C ATOM 304 O ILE A 40 37.154 74.129 -3.698 1.00 11.81 O ATOM 305 CB ILE A 40 36.020 72.432 -0.995 1.00 8.34 C ATOM 306 CG1 ILE A 40 36.589 71.418 0.008 1.00 14.22 C ATOM 307 CG2 ILE A 40 35.692 71.761 -2.338 1.00 12.14 C ATOM 308 CD1 ILE A 40 35.631 70.453 0.701 1.00 11.01 C ATOM 309 N ARG A 41 35.612 75.261 -2.419 1.00 11.03 N ATOM 310 CA ARG A 41 35.152 76.028 -3.561 1.00 10.04 C ATOM 311 C ARG A 41 35.919 77.256 -3.955 1.00 19.82 C ATOM 312 O ARG A 41 35.798 77.545 -5.189 1.00 20.45 O ATOM 313 CB ARG A 41 33.658 76.408 -3.279 1.00 7.34 C ATOM 314 CG ARG A 41 32.849 75.102 -3.240 1.00 18.70 C ATOM 315 CD ARG A 41 32.310 74.974 -4.709 1.00 24.31 C ATOM 316 NE ARG A 41 31.411 73.842 -4.531 1.00 27.05 N ATOM 317 CZ ARG A 41 31.696 72.572 -4.765 1.00 36.08 C ATOM 318 NH1 ARG A 41 32.809 72.304 -5.479 1.00 40.63 N ATOM 319 NH2 ARG A 41 30.784 71.673 -4.413 1.00 39.07 N ATOM 320 N THR A 42 36.623 77.991 -3.096 1.00 19.02 N ATOM 321 CA THR A 42 37.287 79.252 -3.427 1.00 9.81 C ATOM 322 C THR A 42 38.834 79.116 -3.447 1.00 6.85 C ATOM 323 O THR A 42 39.506 80.015 -3.894 1.00 15.12 O ATOM 324 CB THR A 42 36.877 80.407 -2.467 1.00 7.88 C ATOM 325 OG1 THR A 42 37.418 80.203 -1.163 1.00 9.39 O ATOM 326 CG2 THR A 42 35.324 80.398 -2.460 1.00 12.47 C ATOM 327 N GLY A 43 39.271 78.094 -2.653 1.00 7.69 N ATOM 328 CA GLY A 43 40.672 77.944 -2.347 1.00 10.46 C ATOM 329 C GLY A 43 41.070 78.682 -1.086 1.00 8.03 C ATOM 330 O GLY A 43 42.288 78.659 -0.803 1.00 9.88 O ATOM 331 N ASN A 44 40.188 79.493 -0.491 1.00 9.87 N ATOM 332 CA ASN A 44 40.676 80.378 0.631 1.00 8.72 C ATOM 333 C ASN A 44 40.333 79.649 1.985 1.00 12.46 C ATOM 334 O ASN A 44 39.122 79.360 2.101 1.00 8.55 O ATOM 335 CB ASN A 44 40.005 81.741 0.657 1.00 15.69 C ATOM 336 CG ASN A 44 40.441 82.641 -0.506 1.00 16.88 C ATOM 337 OD1 ASN A 44 39.629 83.254 -1.136 1.00 19.07 O ATOM 338 ND2 ASN A 44 41.739 82.715 -0.789 1.00 11.27 N ATOM 339 N LEU A 45 41.302 79.585 2.899 1.00 9.16 N ATOM 340 CA LEU A 45 40.982 79.008 4.216 1.00 12.54 C ATOM 341 C LEU A 45 40.770 80.135 5.225 1.00 13.58 C ATOM 342 O LEU A 45 41.766 80.870 5.449 1.00 13.24 O ATOM 343 CB LEU A 45 42.077 78.105 4.778 1.00 12.36 C ATOM 344 CG LEU A 45 41.733 77.356 6.096 1.00 10.54 C ATOM 345 CD1 LEU A 45 40.640 76.363 5.951 1.00 11.95 C ATOM 346 CD2 LEU A 45 43.094 76.679 6.381 1.00 19.16 C ATOM 347 N ASN A 46 39.523 80.245 5.717 1.00 6.89 N ATOM 348 CA ASN A 46 39.227 81.364 6.673 1.00 5.12 C ATOM 349 C ASN A 46 38.656 80.772 7.951 1.00 10.00 C ATOM 350 O ASN A 46 38.149 79.650 7.841 1.00 11.19 O ATOM 351 CB ASN A 46 38.207 82.333 6.089 1.00 9.02 C ATOM 352 CG ASN A 46 38.552 82.865 4.715 1.00 11.52 C ATOM 353 OD1 ASN A 46 37.972 82.675 3.672 1.00 19.77 O ATOM 354 ND2 ASN A 46 39.668 83.633 4.796 1.00 9.43 N ATOM 355 N GLN A 47 38.606 81.500 9.084 1.00 9.49 N ATOM 356 CA GLN A 47 37.786 81.042 10.207 1.00 5.96 C ATOM 357 C GLN A 47 36.547 81.953 10.229 1.00 8.08 C ATOM 358 O GLN A 47 36.641 83.190 10.007 1.00 9.44 O ATOM 359 CB GLN A 47 38.473 81.149 11.536 1.00 3.43 C ATOM 360 CG GLN A 47 39.652 80.288 11.578 1.00 8.24 C ATOM 361 CD GLN A 47 40.536 80.461 12.825 1.00 22.27 C ATOM 362 OE1 GLN A 47 41.071 79.487 13.397 1.00 11.46 O ATOM 363 NE2 GLN A 47 40.690 81.645 13.239 1.00 17.57 N ATOM 364 N TYR A 48 35.403 81.274 10.538 1.00 12.37 N ATOM 365 CA TYR A 48 34.106 81.952 10.672 1.00 9.65 C ATOM 366 C TYR A 48 33.538 81.865 12.099 1.00 4.19 C ATOM 367 O TYR A 48 34.031 81.091 12.952 1.00 8.14 O ATOM 368 CB TYR A 48 33.162 81.290 9.669 1.00 8.88 C ATOM 369 CG TYR A 48 33.647 81.651 8.248 1.00 6.27 C ATOM 370 CD1 TYR A 48 34.127 80.577 7.484 1.00 4.48 C ATOM 371 CD2 TYR A 48 33.593 82.974 7.780 1.00 9.11 C ATOM 372 CE1 TYR A 48 34.589 80.855 6.151 1.00 14.57 C ATOM 373 CE2 TYR A 48 34.058 83.228 6.457 1.00 12.94 C ATOM 374 CZ TYR A 48 34.539 82.138 5.713 1.00 14.49 C ATOM 375 OH TYR A 48 35.005 82.341 4.410 1.00 12.04 O ATOM 376 N SER A 49 32.485 82.708 12.281 1.00 10.10 N ATOM 377 CA SER A 49 32.032 82.996 13.672 1.00 5.90 C ATOM 378 C SER A 49 31.006 82.038 14.200 1.00 2.72 C ATOM 379 O SER A 49 29.776 82.095 13.901 1.00 10.39 O ATOM 380 CB SER A 49 31.596 84.444 13.727 1.00 7.98 C ATOM 381 OG SER A 49 31.133 84.797 15.017 1.00 9.53 O ATOM 382 N GLU A 50 31.484 81.352 15.310 1.00 8.71 N ATOM 383 CA GLU A 50 30.536 80.526 16.112 1.00 13.43 C ATOM 384 C GLU A 50 29.590 81.427 16.965 1.00 4.39 C ATOM 385 O GLU A 50 28.410 81.074 17.124 1.00 6.99 O ATOM 386 CB GLU A 50 31.260 79.554 17.084 1.00 7.58 C ATOM 387 CG GLU A 50 32.202 78.553 16.344 1.00 12.28 C ATOM 388 CD GLU A 50 33.697 78.976 16.093 1.00 17.90 C ATOM 389 OE1 GLU A 50 33.934 80.131 16.451 1.00 10.79 O ATOM 390 OE2 GLU A 50 34.428 78.162 15.589 1.00 12.25 O ATOM 391 N GLN A 51 30.144 82.540 17.433 1.00 9.06 N ATOM 392 CA GLN A 51 29.494 83.422 18.372 1.00 9.66 C ATOM 393 C GLN A 51 28.291 83.954 17.620 1.00 11.40 C ATOM 394 O GLN A 51 27.168 84.011 18.174 1.00 8.32 O ATOM 395 CB GLN A 51 30.341 84.552 18.859 1.00 9.17 C ATOM 396 CG GLN A 51 29.563 85.402 19.861 1.00 7.39 C ATOM 397 CD GLN A 51 29.375 84.804 21.281 1.00 8.02 C ATOM 398 OE1 GLN A 51 30.264 84.051 21.678 1.00 8.84 O ATOM 399 NE2 GLN A 51 28.323 85.125 21.936 1.00 7.83 N ATOM 400 N GLU A 52 28.519 84.204 16.305 1.00 12.18 N ATOM 401 CA GLU A 52 27.425 84.766 15.490 1.00 12.42 C ATOM 402 C GLU A 52 26.205 83.908 15.368 1.00 8.25 C ATOM 403 O GLU A 52 25.032 84.321 15.521 1.00 10.28 O ATOM 404 CB GLU A 52 27.988 85.136 14.090 1.00 9.58 C ATOM 405 CG GLU A 52 26.858 85.767 13.177 1.00 20.45 C ATOM 406 CD GLU A 52 27.546 86.532 11.974 1.00 9.93 C ATOM 407 OE1 GLU A 52 28.626 86.061 11.669 1.00 16.85 O ATOM 408 OE2 GLU A 52 26.933 87.441 11.548 1.00 18.84 O ATOM 409 N LEU A 53 26.426 82.580 15.282 1.00 5.00 N ATOM 410 CA LEU A 53 25.317 81.635 15.254 1.00 8.30 C ATOM 411 C LEU A 53 24.651 81.518 16.610 1.00 4.84 C ATOM 412 O LEU A 53 23.391 81.390 16.642 1.00 14.43 O ATOM 413 CB LEU A 53 25.780 80.309 14.722 1.00 9.16 C ATOM 414 CG LEU A 53 26.378 80.362 13.355 1.00 10.60 C ATOM 415 CD1 LEU A 53 27.108 79.036 13.175 1.00 13.97 C ATOM 416 CD2 LEU A 53 25.319 80.462 12.287 1.00 17.09 C ATOM 417 N LEU A 54 25.467 81.455 17.642 1.00 10.03 N ATOM 418 CA LEU A 54 25.037 81.465 19.044 1.00 20.10 C ATOM 419 C LEU A 54 24.060 82.625 19.367 1.00 8.94 C ATOM 420 O LEU A 54 22.973 82.403 19.897 1.00 17.22 O ATOM 421 CB LEU A 54 26.191 81.644 20.059 1.00 17.14 C ATOM 422 CG LEU A 54 26.402 80.718 21.213 1.00 25.57 C ATOM 423 CD1 LEU A 54 27.391 81.282 22.193 1.00 16.15 C ATOM 424 CD2 LEU A 54 25.103 80.361 21.827 1.00 16.52 C ATOM 425 N ASP A 55 24.395 83.780 18.921 1.00 9.42 N ATOM 426 CA ASP A 55 23.619 84.992 19.184 1.00 13.87 C ATOM 427 C ASP A 55 22.341 84.980 18.346 1.00 25.96 C ATOM 428 O ASP A 55 21.296 85.483 18.777 1.00 19.47 O ATOM 429 CB ASP A 55 24.420 86.275 18.834 1.00 13.21 C ATOM 430 CG ASP A 55 25.528 86.472 19.819 1.00 16.19 C ATOM 431 OD1 ASP A 55 25.635 85.816 20.894 1.00 15.03 O ATOM 432 OD2 ASP A 55 26.349 87.318 19.526 1.00 9.93 O ATOM 433 N CYS A 56 22.498 84.545 17.087 1.00 11.58 N ATOM 434 CA CYS A 56 21.526 84.793 16.056 1.00 13.79 C ATOM 435 C CYS A 56 20.653 83.628 15.674 1.00 11.81 C ATOM 436 O CYS A 56 19.594 83.968 15.035 1.00 15.99 O ATOM 437 CB CYS A 56 22.134 85.366 14.782 1.00 17.62 C ATOM 438 SG CYS A 56 23.298 86.769 15.079 1.00 14.96 S ATOM 439 N ASP A 57 20.960 82.389 16.061 1.00 7.88 N ATOM 440 CA ASP A 57 20.037 81.341 15.639 1.00 18.73 C ATOM 441 C ASP A 57 18.976 81.262 16.715 1.00 18.83 C ATOM 442 O ASP A 57 19.268 80.638 17.763 1.00 22.95 O ATOM 443 CB ASP A 57 20.800 80.034 15.416 1.00 16.81 C ATOM 444 CG ASP A 57 19.785 78.941 14.982 1.00 23.37 C ATOM 445 OD1 ASP A 57 18.614 79.225 14.793 1.00 12.27 O ATOM 446 OD2 ASP A 57 20.220 77.821 14.852 1.00 18.74 O ATOM 447 N ARG A 58 17.807 81.775 16.436 1.00 19.09 N ATOM 448 CA ARG A 58 16.771 81.739 17.515 1.00 34.18 C ATOM 449 C ARG A 58 15.907 80.527 17.398 1.00 26.45 C ATOM 450 O ARG A 58 15.200 80.234 18.385 1.00 27.68 O ATOM 451 CB ARG A 58 16.144 83.113 17.798 1.00 21.18 C ATOM 452 CG ARG A 58 17.145 84.114 18.402 1.00 42.88 C ATOM 453 CD ARG A 58 17.798 84.045 19.749 1.00 28.89 C ATOM 454 NE ARG A 58 18.756 85.134 20.048 1.00 66.36 N ATOM 455 CZ ARG A 58 18.792 85.974 21.125 1.00 69.54 C ATOM 456 NH1 ARG A 58 17.834 85.883 22.072 1.00 47.60 N ATOM 457 NH2 ARG A 58 19.796 86.832 21.308 1.00 31.97 N ATOM 458 N ARG A 59 16.190 79.548 16.547 1.00 14.68 N ATOM 459 CA ARG A 59 15.577 78.213 16.538 1.00 21.68 C ATOM 460 C ARG A 59 16.270 77.325 17.550 1.00 14.69 C ATOM 461 O ARG A 59 15.835 76.221 17.800 1.00 22.29 O ATOM 462 CB ARG A 59 15.781 77.473 15.184 1.00 19.54 C ATOM 463 CG ARG A 59 14.647 77.231 14.270 1.00 27.67 C ATOM 464 CD ARG A 59 14.622 77.257 12.813 1.00 46.78 C ATOM 465 NE ARG A 59 15.744 77.583 11.972 1.00 34.09 N ATOM 466 CZ ARG A 59 15.903 78.758 11.312 1.00 69.47 C ATOM 467 NH1 ARG A 59 14.880 79.646 11.273 1.00 69.54 N ATOM 468 NH2 ARG A 59 17.037 79.018 10.672 1.00 40.74 N ATOM 469 N SER A 60 17.552 77.662 17.791 1.00 15.63 N ATOM 470 CA SER A 60 18.486 76.929 18.674 1.00 14.97 C ATOM 471 C SER A 60 18.366 77.561 20.073 1.00 13.53 C ATOM 472 O SER A 60 17.711 78.642 20.247 1.00 11.70 O ATOM 473 CB SER A 60 19.872 76.928 18.119 1.00 8.06 C ATOM 474 OG SER A 60 20.097 76.129 16.968 1.00 11.39 O ATOM 475 N TYR A 61 19.171 77.022 21.036 1.00 22.81 N ATOM 476 CA TYR A 61 18.968 77.440 22.429 1.00 18.56 C ATOM 477 C TYR A 61 20.157 78.025 23.101 1.00 8.80 C ATOM 478 O TYR A 61 20.278 77.708 24.292 1.00 13.44 O ATOM 479 CB TYR A 61 18.561 76.212 23.280 1.00 10.66 C ATOM 480 CG TYR A 61 17.458 75.470 22.535 1.00 16.21 C ATOM 481 CD1 TYR A 61 16.235 76.139 22.440 1.00 17.07 C ATOM 482 CD2 TYR A 61 17.641 74.238 21.979 1.00 24.05 C ATOM 483 CE1 TYR A 61 15.142 75.491 21.739 1.00 25.69 C ATOM 484 CE2 TYR A 61 16.573 73.599 21.282 1.00 48.82 C ATOM 485 CZ TYR A 61 15.347 74.274 21.199 1.00 54.47 C ATOM 486 OH TYR A 61 14.280 73.688 20.537 1.00 42.44 O ATOM 487 N GLY A 62 20.989 78.749 22.400 1.00 14.26 N ATOM 488 CA GLY A 62 22.236 79.329 22.845 1.00 20.74 C ATOM 489 C GLY A 62 23.171 78.321 23.494 1.00 14.10 C ATOM 490 O GLY A 62 23.587 77.305 22.923 1.00 17.07 O ATOM 491 N CYS A 63 23.528 78.681 24.732 1.00 14.58 N ATOM 492 CA CYS A 63 24.441 77.845 25.545 1.00 6.78 C ATOM 493 C CYS A 63 23.835 76.593 26.061 1.00 8.47 C ATOM 494 O CYS A 63 24.540 75.725 26.636 1.00 19.17 O ATOM 495 CB CYS A 63 24.976 78.654 26.745 1.00 12.89 C ATOM 496 SG CYS A 63 26.326 79.714 26.085 1.00 16.60 S ATOM 497 N ASN A 64 22.613 76.319 25.694 1.00 11.23 N ATOM 498 CA ASN A 64 21.815 75.169 26.092 1.00 13.24 C ATOM 499 C ASN A 64 21.609 74.235 24.925 1.00 15.77 C ATOM 500 O ASN A 64 20.723 73.386 25.093 1.00 27.06 O ATOM 501 CB ASN A 64 20.485 75.735 26.597 1.00 11.18 C ATOM 502 CG ASN A 64 20.715 76.496 27.900 1.00 26.82 C ATOM 503 OD1 ASN A 64 20.604 77.713 28.000 1.00 33.73 O ATOM 504 ND2 ASN A 64 21.078 75.688 28.958 1.00 29.26 N ATOM 505 N GLY A 65 22.472 74.293 23.903 1.00 22.56 N ATOM 506 CA GLY A 65 22.265 73.332 22.795 1.00 14.95 C ATOM 507 C GLY A 65 21.503 74.032 21.660 1.00 9.63 C ATOM 508 O GLY A 65 21.015 75.167 21.756 1.00 17.24 O ATOM 509 N GLY A 66 21.415 73.232 20.578 1.00 9.80 N ATOM 510 CA GLY A 66 20.853 73.859 19.332 1.00 5.85 C ATOM 511 C GLY A 66 21.092 72.898 18.197 1.00 5.70 C ATOM 512 O GLY A 66 21.379 71.696 18.507 1.00 12.83 O ATOM 513 N TYR A 67 20.816 73.376 16.996 1.00 11.75 N ATOM 514 CA TYR A 67 20.762 72.420 15.820 1.00 8.13 C ATOM 515 C TYR A 67 21.720 72.829 14.763 1.00 11.97 C ATOM 516 O TYR A 67 21.602 73.964 14.217 1.00 12.85 O ATOM 517 CB TYR A 67 19.339 72.423 15.266 1.00 10.46 C ATOM 518 CG TYR A 67 18.203 72.295 16.281 1.00 11.19 C ATOM 519 CD1 TYR A 67 17.530 73.395 16.807 1.00 19.15 C ATOM 520 CD2 TYR A 67 17.913 70.998 16.628 1.00 11.65 C ATOM 521 CE1 TYR A 67 16.473 73.129 17.770 1.00 26.77 C ATOM 522 CE2 TYR A 67 16.879 70.712 17.572 1.00 23.71 C ATOM 523 CZ TYR A 67 16.211 71.840 18.093 1.00 36.11 C ATOM 524 OH TYR A 67 15.230 71.478 18.987 1.00 47.25 O ATOM 525 N PRO A 68 22.629 71.902 14.376 1.00 13.90 N ATOM 526 CA PRO A 68 23.648 72.259 13.336 1.00 9.09 C ATOM 527 C PRO A 68 23.011 72.639 11.990 1.00 6.22 C ATOM 528 O PRO A 68 23.329 73.649 11.340 1.00 9.48 O ATOM 529 CB PRO A 68 24.501 71.045 13.263 1.00 15.71 C ATOM 530 CG PRO A 68 24.414 70.414 14.627 1.00 8.46 C ATOM 531 CD PRO A 68 22.931 70.582 15.031 1.00 8.06 C ATOM 532 N TRP A 69 21.853 71.920 11.761 1.00 14.67 N ATOM 533 CA TRP A 69 21.014 72.140 10.522 1.00 8.87 C ATOM 534 C TRP A 69 20.295 73.484 10.525 1.00 5.41 C ATOM 535 O TRP A 69 20.305 74.188 9.478 1.00 10.69 O ATOM 536 CB TRP A 69 20.069 70.957 10.485 1.00 16.57 C ATOM 537 CG TRP A 69 19.018 70.777 11.651 1.00 15.68 C ATOM 538 CD1 TRP A 69 18.984 69.919 12.668 1.00 17.12 C ATOM 539 CD2 TRP A 69 17.851 71.592 11.794 1.00 24.05 C ATOM 540 NE1 TRP A 69 17.779 70.181 13.472 1.00 18.96 N ATOM 541 CE2 TRP A 69 17.146 71.155 12.944 1.00 26.64 C ATOM 542 CE3 TRP A 69 17.358 72.649 11.048 1.00 51.95 C ATOM 543 CZ2 TRP A 69 15.942 71.730 13.401 1.00 40.91 C ATOM 544 CZ3 TRP A 69 16.153 73.244 11.478 1.00 23.45 C ATOM 545 CH2 TRP A 69 15.482 72.785 12.623 1.00 28.97 C ATOM 546 N SER A 70 19.957 73.998 11.721 1.00 8.23 N ATOM 547 CA SER A 70 19.358 75.342 11.800 1.00 4.05 C ATOM 548 C SER A 70 20.416 76.389 11.570 1.00 6.11 C ATOM 549 O SER A 70 20.264 77.415 10.875 1.00 8.85 O ATOM 550 CB SER A 70 18.793 75.363 13.207 1.00 10.84 C ATOM 551 OG SER A 70 18.384 76.647 13.409 1.00 23.05 O ATOM 552 N ALA A 71 21.626 76.161 12.167 1.00 12.83 N ATOM 553 CA ALA A 71 22.763 77.077 11.972 1.00 9.61 C ATOM 554 C ALA A 71 23.212 77.170 10.497 1.00 18.92 C ATOM 555 O ALA A 71 23.435 78.248 9.915 1.00 10.61 O ATOM 556 CB ALA A 71 23.968 76.658 12.776 1.00 6.72 C ATOM 557 N LEU A 72 23.158 76.034 9.832 1.00 7.92 N ATOM 558 CA LEU A 72 23.572 75.907 8.404 1.00 7.69 C ATOM 559 C LEU A 72 22.546 76.639 7.570 1.00 11.81 C ATOM 560 O LEU A 72 22.876 77.332 6.604 1.00 9.28 O ATOM 561 CB LEU A 72 23.751 74.423 8.029 1.00 6.10 C ATOM 562 CG LEU A 72 25.005 73.645 8.441 1.00 6.25 C ATOM 563 CD1 LEU A 72 25.012 72.245 7.924 1.00 8.86 C ATOM 564 CD2 LEU A 72 26.207 74.412 8.007 1.00 9.64 C ATOM 565 N GLN A 73 21.292 76.508 7.999 1.00 8.34 N ATOM 566 CA GLN A 73 20.164 77.180 7.256 1.00 11.69 C ATOM 567 C GLN A 73 20.305 78.685 7.327 1.00 7.25 C ATOM 568 O GLN A 73 20.221 79.396 6.336 1.00 8.81 O ATOM 569 CB GLN A 73 18.865 76.645 7.778 1.00 8.19 C ATOM 570 CG GLN A 73 17.702 77.433 7.305 1.00 16.92 C ATOM 571 CD GLN A 73 16.386 76.795 7.852 1.00 21.40 C ATOM 572 OE1 GLN A 73 15.456 77.668 7.986 1.00 35.24 O ATOM 573 NE2 GLN A 73 16.384 75.550 8.089 1.00 31.63 N ATOM 574 N LEU A 74 20.740 79.191 8.505 1.00 7.54 N ATOM 575 CA LEU A 74 20.977 80.608 8.757 1.00 12.78 C ATOM 576 C LEU A 74 22.090 81.135 7.868 1.00 12.06 C ATOM 577 O LEU A 74 21.889 82.286 7.414 1.00 13.61 O ATOM 578 CB LEU A 74 21.408 80.871 10.199 1.00 12.29 C ATOM 579 CG LEU A 74 20.708 81.775 11.159 1.00 41.81 C ATOM 580 CD1 LEU A 74 21.727 82.733 11.719 1.00 28.03 C ATOM 581 CD2 LEU A 74 19.506 82.497 10.594 1.00 19.04 C ATOM 582 N VAL A 75 23.167 80.360 7.704 1.00 7.96 N ATOM 583 CA VAL A 75 24.305 80.882 6.868 1.00 6.67 C ATOM 584 C VAL A 75 23.936 80.939 5.363 1.00 13.19 C ATOM 585 O VAL A 75 24.421 81.845 4.672 1.00 12.54 O ATOM 586 CB VAL A 75 25.598 80.096 7.104 1.00 11.49 C ATOM 587 CG1 VAL A 75 26.751 80.460 6.200 1.00 6.22 C ATOM 588 CG2 VAL A 75 26.012 80.161 8.590 1.00 11.33 C ATOM 589 N ALA A 76 23.025 80.029 4.975 1.00 15.10 N ATOM 590 CA ALA A 76 22.390 80.046 3.616 1.00 8.51 C ATOM 591 C ALA A 76 21.369 81.162 3.415 1.00 9.71 C ATOM 592 O ALA A 76 21.217 81.729 2.303 1.00 11.71 O ATOM 593 CB ALA A 76 21.704 78.720 3.339 1.00 7.70 C ATOM 594 N GLN A 77 20.729 81.628 4.469 1.00 14.77 N ATOM 595 CA GLN A 77 19.738 82.690 4.424 1.00 13.81 C ATOM 596 C GLN A 77 20.437 84.029 4.492 1.00 13.99 C ATOM 597 O GLN A 77 20.148 84.947 3.670 1.00 13.78 O ATOM 598 CB GLN A 77 18.709 82.577 5.522 1.00 10.58 C ATOM 599 CG GLN A 77 17.673 81.610 5.257 1.00 15.31 C ATOM 600 CD GLN A 77 16.780 81.402 6.504 1.00 34.33 C ATOM 601 OE1 GLN A 77 17.327 81.478 7.642 1.00 31.09 O ATOM 602 NE2 GLN A 77 15.563 81.177 6.333 1.00 20.69 N ATOM 603 N TYR A 78 21.276 84.172 5.486 1.00 7.72 N ATOM 604 CA TYR A 78 21.915 85.471 5.720 1.00 6.79 C ATOM 605 C TYR A 78 23.407 85.584 5.346 1.00 25.73 C ATOM 606 O TYR A 78 23.870 86.595 4.758 1.00 44.74 O ATOM 607 CB TYR A 78 21.741 85.822 7.225 1.00 15.79 C ATOM 608 CG TYR A 78 20.261 86.026 7.509 1.00 19.09 C ATOM 609 CD1 TYR A 78 19.631 87.185 7.017 1.00 35.71 C ATOM 610 CD2 TYR A 78 19.583 85.092 8.235 1.00 51.55 C ATOM 611 CE1 TYR A 78 18.214 87.379 7.288 1.00 24.49 C ATOM 612 CE2 TYR A 78 18.186 85.267 8.513 1.00 31.02 C ATOM 613 CZ TYR A 78 17.566 86.431 8.012 1.00 56.99 C ATOM 614 OH TYR A 78 16.223 86.524 8.323 1.00 39.29 O ATOM 615 N GLY A 79 24.189 84.670 5.893 1.00 13.25 N ATOM 616 CA GLY A 79 25.597 84.526 5.739 1.00 9.77 C ATOM 617 C GLY A 79 26.234 84.535 7.113 1.00 8.20 C ATOM 618 O GLY A 79 25.503 84.405 8.113 1.00 11.30 O ATOM 619 N ILE A 80 27.559 84.658 7.073 1.00 12.89 N ATOM 620 CA ILE A 80 28.350 84.608 8.323 1.00 17.66 C ATOM 621 C ILE A 80 29.508 85.569 8.239 1.00 9.55 C ATOM 622 O ILE A 80 30.016 85.755 7.140 1.00 9.23 O ATOM 623 CB ILE A 80 28.799 83.131 8.596 1.00 14.00 C ATOM 624 CG1 ILE A 80 29.278 83.013 10.098 1.00 7.04 C ATOM 625 CG2 ILE A 80 29.679 82.660 7.461 1.00 9.04 C ATOM 626 CD1 ILE A 80 29.156 81.512 10.500 1.00 8.39 C ATOM 627 N HIS A 81 29.953 86.157 9.322 1.00 7.61 N ATOM 628 CA HIS A 81 31.165 87.004 9.381 1.00 7.76 C ATOM 629 C HIS A 81 32.392 86.144 9.688 1.00 9.14 C ATOM 630 O HIS A 81 32.265 85.027 10.258 1.00 10.69 O ATOM 631 CB HIS A 81 30.881 88.009 10.553 1.00 13.52 C ATOM 632 CG HIS A 81 30.072 89.209 10.102 1.00 21.56 C ATOM 633 ND1 HIS A 81 28.781 89.432 10.478 1.00 16.03 N ATOM 634 CD2 HIS A 81 30.376 90.265 9.297 1.00 16.52 C ATOM 635 CE1 HIS A 81 28.324 90.551 9.945 1.00 15.42 C ATOM 636 NE2 HIS A 81 29.272 91.049 9.238 1.00 16.71 N ATOM 637 N TYR A 82 33.629 86.674 9.475 1.00 10.80 N ATOM 638 CA TYR A 82 34.875 86.107 9.956 1.00 9.59 C ATOM 639 C TYR A 82 34.881 86.087 11.491 1.00 10.26 C ATOM 640 O TYR A 82 34.244 86.927 12.214 1.00 10.87 O ATOM 641 CB TYR A 82 36.156 86.916 9.584 1.00 12.35 C ATOM 642 CG TYR A 82 36.395 86.931 8.069 1.00 12.72 C ATOM 643 CD1 TYR A 82 36.461 85.675 7.433 1.00 19.76 C ATOM 644 CD2 TYR A 82 36.546 88.074 7.339 1.00 25.36 C ATOM 645 CE1 TYR A 82 36.687 85.640 5.996 1.00 12.26 C ATOM 646 CE2 TYR A 82 36.763 88.056 5.927 1.00 12.59 C ATOM 647 CZ TYR A 82 36.827 86.819 5.327 1.00 17.83 C ATOM 648 OH TYR A 82 37.041 86.718 3.959 1.00 25.84 O ATOM 649 N ARG A 83 35.587 85.052 11.980 1.00 8.85 N ATOM 650 CA ARG A 83 35.694 84.801 13.408 1.00 8.21 C ATOM 651 C ARG A 83 36.285 86.043 14.136 1.00 12.33 C ATOM 652 O ARG A 83 35.941 86.358 15.265 1.00 17.85 O ATOM 653 CB ARG A 83 36.553 83.588 13.745 1.00 10.68 C ATOM 654 CG ARG A 83 36.340 83.159 15.208 1.00 9.15 C ATOM 655 CD ARG A 83 36.976 81.746 15.307 1.00 17.02 C ATOM 656 NE ARG A 83 36.408 80.987 16.439 1.00 16.97 N ATOM 657 CZ ARG A 83 37.078 80.839 17.645 1.00 16.01 C ATOM 658 NH1 ARG A 83 38.384 81.224 17.715 1.00 14.99 N ATOM 659 NH2 ARG A 83 36.398 80.181 18.573 1.00 16.24 N ATOM 660 N ASN A 84 37.262 86.630 13.507 1.00 12.91 N ATOM 661 CA ASN A 84 37.982 87.831 13.804 1.00 17.09 C ATOM 662 C ASN A 84 37.143 89.065 14.024 1.00 15.67 C ATOM 663 O ASN A 84 37.390 89.903 14.954 1.00 20.09 O ATOM 664 CB ASN A 84 38.583 88.175 12.324 1.00 43.55 C ATOM 665 CG ASN A 84 40.019 88.396 12.763 1.00 63.15 C ATOM 666 OD1 ASN A 84 40.591 87.463 13.311 1.00 61.76 O ATOM 667 ND2 ASN A 84 40.494 89.669 12.487 1.00 73.25 N ATOM 668 N THR A 85 36.085 89.133 13.187 1.00 11.64 N ATOM 669 CA THR A 85 35.207 90.333 13.285 1.00 9.16 C ATOM 670 C THR A 85 34.138 90.122 14.346 1.00 21.06 C ATOM 671 O THR A 85 33.490 91.103 14.804 1.00 21.27 O ATOM 672 CB THR A 85 34.630 90.580 11.852 1.00 15.80 C ATOM 673 OG1 THR A 85 33.695 89.544 11.741 1.00 42.02 O ATOM 674 CG2 THR A 85 35.668 90.544 10.796 1.00 23.28 C ATOM 675 N TYR A 86 33.940 88.812 14.652 1.00 14.56 N ATOM 676 CA TYR A 86 32.845 88.457 15.622 1.00 8.27 C ATOM 677 C TYR A 86 33.295 87.277 16.505 1.00 9.67 C ATOM 678 O TYR A 86 32.770 86.162 16.366 1.00 12.25 O ATOM 679 CB TYR A 86 31.605 88.185 14.771 1.00 16.82 C ATOM 680 CG TYR A 86 30.244 88.255 15.479 1.00 23.19 C ATOM 681 CD1 TYR A 86 29.128 88.594 14.702 1.00 9.81 C ATOM 682 CD2 TYR A 86 30.101 87.990 16.838 1.00 14.53 C ATOM 683 CE1 TYR A 86 27.809 88.656 15.382 1.00 4.99 C ATOM 684 CE2 TYR A 86 28.839 88.058 17.454 1.00 11.22 C ATOM 685 CZ TYR A 86 27.733 88.395 16.699 1.00 12.91 C ATOM 686 OH TYR A 86 26.506 88.461 17.277 1.00 9.50 O ATOM 687 N PRO A 87 34.213 87.516 17.421 1.00 17.46 N ATOM 688 CA PRO A 87 34.917 86.545 18.249 1.00 11.97 C ATOM 689 C PRO A 87 34.067 85.906 19.338 1.00 30.02 C ATOM 690 O PRO A 87 33.009 86.464 19.749 1.00 13.98 O ATOM 691 CB PRO A 87 36.048 87.364 18.862 1.00 11.81 C ATOM 692 CG PRO A 87 35.495 88.739 18.959 1.00 15.37 C ATOM 693 CD PRO A 87 34.550 88.892 17.791 1.00 7.76 C ATOM 694 N TYR A 88 34.533 84.697 19.750 1.00 13.28 N ATOM 695 CA TYR A 88 33.734 83.838 20.652 1.00 11.79 C ATOM 696 C TYR A 88 33.788 84.390 22.063 1.00 12.08 C ATOM 697 O TYR A 88 34.921 84.636 22.557 1.00 13.02 O ATOM 698 CB TYR A 88 34.384 82.452 20.591 1.00 9.29 C ATOM 699 CG TYR A 88 33.565 81.441 21.433 1.00 12.29 C ATOM 700 CD1 TYR A 88 32.198 81.302 21.105 1.00 8.37 C ATOM 701 CD2 TYR A 88 34.135 80.717 22.467 1.00 8.71 C ATOM 702 CE1 TYR A 88 31.399 80.347 21.904 1.00 15.03 C ATOM 703 CE2 TYR A 88 33.385 79.805 23.238 1.00 7.34 C ATOM 704 CZ TYR A 88 32.014 79.666 22.898 1.00 14.28 C ATOM 705 OH TYR A 88 31.297 78.771 23.657 1.00 11.83 O ATOM 706 N GLU A 89 32.669 84.426 22.739 1.00 7.44 N ATOM 707 CA GLU A 89 32.579 84.779 24.152 1.00 14.16 C ATOM 708 C GLU A 89 32.089 83.694 25.080 1.00 15.98 C ATOM 709 O GLU A 89 32.166 83.833 26.349 1.00 20.80 O ATOM 710 CB GLU A 89 31.642 86.043 24.280 1.00 11.35 C ATOM 711 CG GLU A 89 31.749 87.109 23.198 1.00 10.09 C ATOM 712 CD GLU A 89 30.894 88.402 23.523 1.00 21.86 C ATOM 713 OE1 GLU A 89 30.891 89.080 22.514 1.00 18.96 O ATOM 714 OE2 GLU A 89 30.386 88.573 24.598 1.00 44.17 O ATOM 715 N GLY A 90 31.432 82.653 24.648 1.00 10.79 N ATOM 716 CA GLY A 90 30.975 81.530 25.417 1.00 14.79 C ATOM 717 C GLY A 90 29.745 81.930 26.224 1.00 18.28 C ATOM 718 O GLY A 90 29.457 81.240 27.216 1.00 17.03 O ATOM 719 N VAL A 91 29.021 82.959 25.793 1.00 12.45 N ATOM 720 CA VAL A 91 27.776 83.443 26.413 1.00 11.53 C ATOM 721 C VAL A 91 26.878 83.953 25.247 1.00 17.62 C ATOM 722 O VAL A 91 27.452 84.680 24.412 1.00 16.07 O ATOM 723 CB VAL A 91 28.121 84.686 27.283 1.00 17.85 C ATOM 724 CG1 VAL A 91 26.931 85.531 27.561 1.00 27.86 C ATOM 725 CG2 VAL A 91 28.935 84.363 28.534 1.00 20.93 C ATOM 726 N GLN A 92 25.555 83.683 25.304 1.00 11.69 N ATOM 727 CA GLN A 92 24.651 84.250 24.311 1.00 11.20 C ATOM 728 C GLN A 92 24.379 85.734 24.623 1.00 12.33 C ATOM 729 O GLN A 92 24.068 86.219 25.704 1.00 21.97 O ATOM 730 CB GLN A 92 23.360 83.548 24.197 1.00 12.95 C ATOM 731 CG GLN A 92 22.367 84.141 23.235 1.00 22.42 C ATOM 732 CD GLN A 92 21.108 83.280 22.985 1.00 24.02 C ATOM 733 OE1 GLN A 92 20.745 82.951 21.756 1.00 20.33 O ATOM 734 NE2 GLN A 92 20.461 82.906 24.007 1.00 21.70 N ATOM 735 N ARG A 93 24.474 86.467 23.485 1.00 19.26 N ATOM 736 CA ARG A 93 24.305 87.944 23.500 1.00 22.89 C ATOM 737 C ARG A 93 23.244 88.257 22.430 1.00 13.34 C ATOM 738 O ARG A 93 22.642 87.382 21.800 1.00 18.63 O ATOM 739 CB ARG A 93 25.620 88.649 23.160 1.00 31.74 C ATOM 740 CG ARG A 93 26.799 88.860 24.054 1.00 21.06 C ATOM 741 CD ARG A 93 26.761 88.341 25.438 1.00 22.18 C ATOM 742 NE ARG A 93 27.943 88.736 26.233 1.00 48.26 N ATOM 743 CZ ARG A 93 27.817 89.070 27.535 1.00 53.04 C ATOM 744 NH1 ARG A 93 26.602 89.060 28.116 1.00 50.06 N ATOM 745 NH2 ARG A 93 28.868 89.440 28.241 1.00 41.12 N ATOM 746 N TYR A 94 23.104 89.539 22.197 1.00 14.76 N ATOM 747 CA TYR A 94 22.268 90.199 21.196 1.00 24.02 C ATOM 748 C TYR A 94 22.797 89.744 19.866 1.00 15.41 C ATOM 749 O TYR A 94 24.035 89.618 19.772 1.00 13.51 O ATOM 750 CB TYR A 94 22.456 91.786 21.611 1.00 34.75 C ATOM 751 CG TYR A 94 21.509 92.462 20.593 1.00 63.36 C ATOM 752 CD1 TYR A 94 20.117 92.431 20.831 1.00 61.22 C ATOM 753 CD2 TYR A 94 22.043 93.055 19.483 1.00 41.51 C ATOM 754 CE1 TYR A 94 19.237 93.061 19.853 1.00 37.84 C ATOM 755 CE2 TYR A 94 21.165 93.673 18.525 1.00 74.37 C ATOM 756 CZ TYR A 94 19.773 93.644 18.763 1.00 66.69 C ATOM 757 OH TYR A 94 18.995 94.257 17.796 1.00 48.95 O ATOM 758 N CYS A 95 22.069 89.512 18.783 1.00 11.10 N ATOM 759 CA CYS A 95 22.669 89.244 17.460 1.00 12.60 C ATOM 760 C CYS A 95 23.168 90.618 16.888 1.00 15.39 C ATOM 761 O CYS A 95 22.401 91.568 16.687 1.00 21.32 O ATOM 762 CB CYS A 95 21.695 88.658 16.600 1.00 5.48 C ATOM 763 SG CYS A 95 22.041 88.397 14.814 1.00 15.20 S ATOM 764 N ARG A 96 24.478 90.638 16.600 1.00 9.43 N ATOM 765 CA ARG A 96 25.146 91.889 16.243 1.00 17.41 C ATOM 766 C ARG A 96 25.549 91.846 14.777 1.00 13.94 C ATOM 767 O ARG A 96 26.419 92.650 14.492 1.00 17.19 O ATOM 768 CB ARG A 96 26.349 92.116 17.189 1.00 11.88 C ATOM 769 CG ARG A 96 25.886 92.398 18.664 1.00 10.91 C ATOM 770 CD ARG A 96 27.076 92.209 19.614 1.00 13.75 C ATOM 771 NE ARG A 96 27.096 90.753 20.000 1.00 12.07 N ATOM 772 CZ ARG A 96 28.047 90.177 20.744 1.00 17.77 C ATOM 773 NH1 ARG A 96 29.047 90.963 21.253 1.00 12.18 N ATOM 774 NH2 ARG A 96 27.990 88.877 20.907 1.00 14.72 N ATOM 775 N SER A 97 25.046 90.885 14.024 1.00 9.57 N ATOM 776 CA SER A 97 25.473 90.755 12.600 1.00 10.21 C ATOM 777 C SER A 97 25.581 92.131 11.901 1.00 10.02 C ATOM 778 O SER A 97 26.471 92.545 11.181 1.00 24.70 O ATOM 779 CB SER A 97 24.491 89.936 11.778 1.00 9.72 C ATOM 780 OG SER A 97 24.527 88.633 12.359 1.00 17.03 O ATOM 781 N ARG A 98 24.446 92.759 11.997 1.00 19.26 N ATOM 782 CA ARG A 98 23.972 94.024 11.454 1.00 25.95 C ATOM 783 C ARG A 98 24.983 95.108 11.676 1.00 18.28 C ATOM 784 O ARG A 98 25.395 95.821 10.746 1.00 21.11 O ATOM 785 CB ARG A 98 22.635 94.282 12.247 1.00 66.31 C ATOM 786 CG ARG A 98 22.124 92.977 12.990 1.00 60.42 C ATOM 787 CD ARG A 98 22.427 93.036 14.494 1.00 36.22 C ATOM 788 NE ARG A 98 22.157 94.349 15.042 1.00 67.65 N ATOM 789 CZ ARG A 98 22.930 95.266 15.658 1.00 62.01 C ATOM 790 NH1 ARG A 98 24.153 94.898 16.030 1.00 60.81 N ATOM 791 NH2 ARG A 98 22.411 96.462 15.898 1.00 62.59 N ATOM 792 N GLU A 99 25.510 95.162 12.877 1.00 13.15 N ATOM 793 CA GLU A 99 26.563 96.080 13.260 1.00 23.74 C ATOM 794 C GLU A 99 27.972 95.745 12.810 1.00 23.25 C ATOM 795 O GLU A 99 28.875 96.531 13.192 1.00 37.28 O ATOM 796 CB GLU A 99 26.719 96.119 14.809 1.00 23.87 C ATOM 797 CG GLU A 99 25.503 96.470 15.665 1.00 26.20 C ATOM 798 CD GLU A 99 25.899 96.476 17.233 1.00 39.78 C ATOM 799 OE1 GLU A 99 24.832 96.708 17.765 1.00 44.85 O ATOM 800 OE2 GLU A 99 26.981 96.295 17.742 1.00 38.05 O ATOM 801 N LYS A 100 28.249 94.678 12.089 1.00 18.66 N ATOM 802 CA LYS A 100 29.624 94.253 11.821 1.00 25.28 C ATOM 803 C LYS A 100 29.922 94.442 10.327 1.00 25.81 C ATOM 804 O LYS A 100 30.955 93.922 9.800 1.00 35.98 O ATOM 805 CB LYS A 100 29.853 92.765 12.121 1.00 37.62 C ATOM 806 CG LYS A 100 29.758 92.204 13.485 1.00 28.59 C ATOM 807 CD LYS A 100 30.611 92.901 14.512 1.00 20.16 C ATOM 808 CE LYS A 100 30.266 92.290 15.932 1.00 11.27 C ATOM 809 NZ LYS A 100 31.603 92.477 16.595 1.00 22.41 N ATOM 810 N GLY A 101 28.891 94.957 9.650 1.00 17.99 N ATOM 811 CA GLY A 101 29.125 95.070 8.167 1.00 14.87 C ATOM 812 C GLY A 101 28.595 93.795 7.517 1.00 12.10 C ATOM 813 O GLY A 101 27.907 92.891 8.018 1.00 23.07 O ATOM 814 N PRO A 102 28.843 93.838 6.192 1.00 27.66 N ATOM 815 CA PRO A 102 28.458 92.792 5.251 1.00 57.26 C ATOM 816 C PRO A 102 29.041 91.487 5.839 1.00 13.64 C ATOM 817 O PRO A 102 30.195 91.423 6.295 1.00 16.53 O ATOM 818 CB PRO A 102 29.060 93.232 3.943 1.00 28.52 C ATOM 819 CG PRO A 102 29.657 94.600 4.192 1.00 29.58 C ATOM 820 CD PRO A 102 30.069 94.470 5.674 1.00 38.44 C ATOM 821 N TYR A 103 28.350 90.462 5.445 1.00 18.36 N ATOM 822 CA TYR A 103 28.769 89.071 5.760 1.00 19.56 C ATOM 823 C TYR A 103 29.984 88.793 4.918 1.00 13.58 C ATOM 824 O TYR A 103 30.084 89.351 3.779 1.00 19.16 O ATOM 825 CB TYR A 103 27.540 88.258 5.331 1.00 13.35 C ATOM 826 CG TYR A 103 26.397 88.428 6.329 1.00 39.09 C ATOM 827 CD1 TYR A 103 25.181 89.012 5.920 1.00 25.31 C ATOM 828 CD2 TYR A 103 26.571 88.002 7.627 1.00 13.80 C ATOM 829 CE1 TYR A 103 24.126 89.146 6.907 1.00 33.05 C ATOM 830 CE2 TYR A 103 25.526 88.135 8.590 1.00 21.54 C ATOM 831 CZ TYR A 103 24.324 88.721 8.169 1.00 57.79 C ATOM 832 OH TYR A 103 23.306 88.858 9.090 1.00 61.59 O ATOM 833 N ALA A 104 30.774 87.819 5.397 1.00 10.34 N ATOM 834 CA ALA A 104 31.976 87.407 4.704 1.00 8.38 C ATOM 835 C ALA A 104 31.747 86.181 3.819 1.00 13.09 C ATOM 836 O ALA A 104 32.454 86.061 2.778 1.00 24.64 O ATOM 837 CB ALA A 104 33.119 87.123 5.656 1.00 12.51 C ATOM 838 N ALA A 105 30.735 85.367 4.057 1.00 11.33 N ATOM 839 CA ALA A 105 30.442 84.193 3.226 1.00 14.57 C ATOM 840 C ALA A 105 28.962 83.909 3.302 1.00 15.02 C ATOM 841 O ALA A 105 28.249 84.299 4.249 1.00 14.20 O ATOM 842 CB ALA A 105 31.305 82.982 3.652 1.00 12.14 C ATOM 843 N LYS A 106 28.449 83.192 2.310 1.00 12.24 N ATOM 844 CA LYS A 106 27.015 82.792 2.311 1.00 13.04 C ATOM 845 C LYS A 106 26.958 81.516 1.482 1.00 11.19 C ATOM 846 O LYS A 106 27.789 81.438 0.545 1.00 23.89 O ATOM 847 CB LYS A 106 26.121 83.920 1.787 1.00 9.35 C ATOM 848 CG LYS A 106 24.634 83.642 1.757 1.00 11.11 C ATOM 849 CD LYS A 106 23.854 84.854 1.269 1.00 20.76 C ATOM 850 CE LYS A 106 22.351 84.546 1.301 1.00 29.75 C ATOM 851 NZ LYS A 106 21.538 85.784 1.349 1.00 17.81 N ATOM 852 N THR A 107 26.101 80.584 1.819 1.00 9.73 N ATOM 853 CA THR A 107 26.053 79.315 1.034 1.00 8.26 C ATOM 854 C THR A 107 24.759 79.271 0.232 1.00 18.04 C ATOM 855 O THR A 107 23.896 80.116 0.497 1.00 10.56 O ATOM 856 CB THR A 107 26.200 78.147 2.007 1.00 14.94 C ATOM 857 OG1 THR A 107 25.263 78.315 3.029 1.00 13.00 O ATOM 858 CG2 THR A 107 27.560 78.111 2.684 1.00 7.02 C ATOM 859 N ASP A 108 24.607 78.201 -0.567 1.00 18.84 N ATOM 860 CA ASP A 108 23.441 78.011 -1.426 1.00 11.13 C ATOM 861 C ASP A 108 22.448 76.994 -0.978 1.00 10.50 C ATOM 862 O ASP A 108 21.413 76.800 -1.699 1.00 13.16 O ATOM 863 CB ASP A 108 23.918 77.754 -2.946 1.00 7.59 C ATOM 864 CG ASP A 108 24.793 78.993 -3.137 1.00 11.44 C ATOM 865 OD1 ASP A 108 24.554 80.151 -2.946 1.00 32.57 O ATOM 866 OD2 ASP A 108 25.933 78.698 -3.522 1.00 15.92 O ATOM 867 N GLY A 109 22.636 76.503 0.299 1.00 9.13 N ATOM 868 CA GLY A 109 21.540 75.623 0.815 1.00 14.26 C ATOM 869 C GLY A 109 22.124 74.643 1.854 1.00 7.66 C ATOM 870 O GLY A 109 23.278 74.867 2.281 1.00 7.69 O ATOM 871 N VAL A 110 21.416 73.638 2.193 1.00 13.83 N ATOM 872 CA VAL A 110 21.840 72.643 3.240 1.00 9.77 C ATOM 873 C VAL A 110 21.301 71.334 2.763 1.00 8.92 C ATOM 874 O VAL A 110 20.240 71.362 2.172 1.00 13.08 O ATOM 875 CB VAL A 110 21.551 73.072 4.650 1.00 11.26 C ATOM 876 CG1 VAL A 110 20.552 74.149 4.931 1.00 17.42 C ATOM 877 CG2 VAL A 110 21.422 71.963 5.756 1.00 8.63 C ATOM 878 N ARG A 111 21.985 70.232 2.966 1.00 7.12 N ATOM 879 CA ARG A 111 21.477 68.921 2.645 1.00 10.52 C ATOM 880 C ARG A 111 21.737 68.026 3.864 1.00 17.19 C ATOM 881 O ARG A 111 22.675 68.312 4.628 1.00 13.56 O ATOM 882 CB ARG A 111 22.120 68.304 1.389 1.00 14.59 C ATOM 883 CG ARG A 111 21.964 69.164 0.175 1.00 15.26 C ATOM 884 CD ARG A 111 21.201 68.730 -1.069 1.00 64.85 C ATOM 885 NE ARG A 111 20.929 70.048 -1.707 1.00 49.06 N ATOM 886 CZ ARG A 111 19.762 70.705 -1.609 1.00 42.34 C ATOM 887 NH1 ARG A 111 18.616 70.022 -1.430 1.00 44.45 N ATOM 888 NH2 ARG A 111 19.790 71.995 -1.875 1.00 49.72 N ATOM 889 N GLN A 112 20.926 67.004 3.951 1.00 11.19 N ATOM 890 CA GLN A 112 21.040 66.001 5.020 1.00 18.68 C ATOM 891 C GLN A 112 21.558 64.724 4.371 1.00 12.96 C ATOM 892 O GLN A 112 21.207 64.481 3.187 1.00 17.66 O ATOM 893 CB GLN A 112 19.626 65.765 5.561 1.00 11.13 C ATOM 894 CG GLN A 112 19.700 64.941 6.766 1.00 33.45 C ATOM 895 CD GLN A 112 18.495 64.509 7.582 1.00 22.32 C ATOM 896 OE1 GLN A 112 17.363 64.917 7.175 1.00 27.95 O ATOM 897 NE2 GLN A 112 18.671 63.779 8.609 1.00 20.49 N ATOM 898 N VAL A 113 22.453 64.033 5.023 1.00 10.52 N ATOM 899 CA VAL A 113 22.876 62.715 4.455 1.00 15.55 C ATOM 900 C VAL A 113 21.827 61.689 4.901 1.00 9.18 C ATOM 901 O VAL A 113 21.276 61.742 5.985 1.00 10.02 O ATOM 902 CB VAL A 113 24.322 62.370 4.625 1.00 22.54 C ATOM 903 CG1 VAL A 113 25.169 63.516 5.222 1.00 12.13 C ATOM 904 CG2 VAL A 113 24.670 60.932 4.930 1.00 8.33 C ATOM 905 N GLN A 114 21.645 60.696 3.971 1.00 14.14 N ATOM 906 CA GLN A 114 20.721 59.581 4.357 1.00 17.94 C ATOM 907 C GLN A 114 21.101 59.027 5.725 1.00 10.72 C ATOM 908 O GLN A 114 22.238 58.488 5.797 1.00 13.75 O ATOM 909 CB GLN A 114 20.998 58.524 3.301 1.00 15.66 C ATOM 910 CG GLN A 114 19.726 57.786 3.067 1.00 31.26 C ATOM 911 CD GLN A 114 19.974 56.420 2.403 1.00 63.73 C ATOM 912 OE1 GLN A 114 21.102 56.286 1.805 1.00 59.73 O ATOM 913 NE2 GLN A 114 19.062 55.550 2.497 1.00 59.89 N ATOM 914 N PRO A 115 20.241 58.926 6.724 1.00 13.69 N ATOM 915 CA PRO A 115 20.667 58.494 8.047 1.00 15.09 C ATOM 916 C PRO A 115 20.841 56.977 8.024 1.00 15.16 C ATOM 917 O PRO A 115 20.320 56.296 7.121 1.00 18.05 O ATOM 918 CB PRO A 115 19.656 58.868 9.058 1.00 11.92 C ATOM 919 CG PRO A 115 18.431 59.226 8.228 1.00 18.74 C ATOM 920 CD PRO A 115 18.922 59.517 6.808 1.00 13.36 C ATOM 921 N TYR A 116 21.560 56.584 9.070 1.00 16.87 N ATOM 922 CA TYR A 116 21.822 55.145 9.324 1.00 19.06 C ATOM 923 C TYR A 116 22.503 54.425 8.177 1.00 13.93 C ATOM 924 O TYR A 116 22.157 53.308 7.826 1.00 20.90 O ATOM 925 CB TYR A 116 20.419 54.574 9.667 1.00 13.97 C ATOM 926 CG TYR A 116 19.759 55.341 10.800 1.00 25.61 C ATOM 927 CD1 TYR A 116 20.447 55.427 12.012 1.00 25.37 C ATOM 928 CD2 TYR A 116 18.538 55.937 10.643 1.00 14.78 C ATOM 929 CE1 TYR A 116 19.839 56.162 13.126 1.00 28.65 C ATOM 930 CE2 TYR A 116 17.936 56.653 11.720 1.00 17.67 C ATOM 931 CZ TYR A 116 18.632 56.729 12.935 1.00 35.42 C ATOM 932 OH TYR A 116 18.022 57.429 13.951 1.00 36.01 O ATOM 933 N ASN A 117 23.420 55.108 7.508 1.00 10.18 N ATOM 934 CA ASN A 117 24.065 54.530 6.316 1.00 12.45 C ATOM 935 C ASN A 117 25.515 54.964 6.353 1.00 11.09 C ATOM 936 O ASN A 117 25.727 56.159 6.122 1.00 13.74 O ATOM 937 CB ASN A 117 23.265 55.106 5.153 1.00 9.22 C ATOM 938 CG ASN A 117 23.683 54.558 3.828 1.00 13.61 C ATOM 939 OD1 ASN A 117 24.840 54.369 3.403 1.00 15.63 O ATOM 940 ND2 ASN A 117 22.638 54.236 3.002 1.00 33.36 N ATOM 941 N GLN A 118 26.425 54.041 6.648 1.00 11.93 N ATOM 942 CA GLN A 118 27.848 54.363 6.752 1.00 12.54 C ATOM 943 C GLN A 118 28.304 54.817 5.366 1.00 13.23 C ATOM 944 O GLN A 118 29.032 55.799 5.294 1.00 10.82 O ATOM 945 CB GLN A 118 28.652 53.188 7.211 1.00 10.81 C ATOM 946 CG GLN A 118 30.104 53.555 7.572 1.00 16.68 C ATOM 947 CD GLN A 118 30.799 52.313 8.196 1.00 14.46 C ATOM 948 OE1 GLN A 118 31.648 51.684 7.605 1.00 8.56 O ATOM 949 NE2 GLN A 118 30.434 51.972 9.398 1.00 11.36 N ATOM 950 N GLY A 119 27.919 54.113 4.357 1.00 12.22 N ATOM 951 CA GLY A 119 28.325 54.371 2.983 1.00 8.78 C ATOM 952 C GLY A 119 28.018 55.804 2.574 1.00 7.41 C ATOM 953 O GLY A 119 28.891 56.487 1.995 1.00 14.96 O ATOM 954 N ALA A 120 26.788 56.227 2.780 1.00 10.33 N ATOM 955 CA ALA A 120 26.361 57.586 2.421 1.00 8.32 C ATOM 956 C ALA A 120 27.108 58.668 3.177 1.00 9.68 C ATOM 957 O ALA A 120 27.429 59.715 2.598 1.00 13.62 O ATOM 958 CB ALA A 120 24.901 57.763 2.790 1.00 14.78 C ATOM 959 N LEU A 121 27.379 58.389 4.463 1.00 13.80 N ATOM 960 CA LEU A 121 28.229 59.269 5.267 1.00 10.39 C ATOM 961 C LEU A 121 29.624 59.380 4.691 1.00 11.78 C ATOM 962 O LEU A 121 30.229 60.478 4.614 1.00 7.52 O ATOM 963 CB LEU A 121 28.251 58.815 6.778 1.00 7.58 C ATOM 964 CG LEU A 121 29.202 59.707 7.624 1.00 14.45 C ATOM 965 CD1 LEU A 121 28.838 61.138 7.377 1.00 11.05 C ATOM 966 CD2 LEU A 121 29.182 59.386 9.080 1.00 11.72 C ATOM 967 N LEU A 122 30.343 58.302 4.328 1.00 7.85 N ATOM 968 CA LEU A 122 31.706 58.243 3.831 1.00 15.47 C ATOM 969 C LEU A 122 31.798 58.938 2.440 1.00 8.02 C ATOM 970 O LEU A 122 32.743 59.717 2.260 1.00 9.84 O ATOM 971 CB LEU A 122 32.251 56.806 3.666 1.00 9.42 C ATOM 972 CG LEU A 122 32.392 55.942 4.908 1.00 10.57 C ATOM 973 CD1 LEU A 122 32.731 54.524 4.526 1.00 8.70 C ATOM 974 CD2 LEU A 122 33.444 56.527 5.812 1.00 14.96 C ATOM 975 N TYR A 123 30.709 58.801 1.673 1.00 8.76 N ATOM 976 CA TYR A 123 30.773 59.482 0.332 1.00 10.47 C ATOM 977 C TYR A 123 30.705 60.983 0.518 1.00 5.21 C ATOM 978 O TYR A 123 31.397 61.753 -0.194 1.00 10.08 O ATOM 979 CB TYR A 123 29.700 58.907 -0.487 1.00 12.00 C ATOM 980 CG TYR A 123 29.634 59.524 -1.890 1.00 15.49 C ATOM 981 CD1 TYR A 123 30.319 58.917 -2.943 1.00 23.28 C ATOM 982 CD2 TYR A 123 28.897 60.655 -2.075 1.00 26.09 C ATOM 983 CE1 TYR A 123 30.217 59.535 -4.257 1.00 39.69 C ATOM 984 CE2 TYR A 123 28.790 61.269 -3.351 1.00 53.63 C ATOM 985 CZ TYR A 123 29.482 60.650 -4.397 1.00 32.13 C ATOM 986 OH TYR A 123 29.366 61.258 -5.632 1.00 70.89 O ATOM 987 N SER A 124 29.898 61.372 1.514 1.00 10.36 N ATOM 988 CA SER A 124 29.852 62.831 1.881 1.00 5.91 C ATOM 989 C SER A 124 31.221 63.317 2.322 1.00 9.51 C ATOM 990 O SER A 124 31.578 64.424 1.923 1.00 12.06 O ATOM 991 CB SER A 124 28.720 63.171 2.852 1.00 11.98 C ATOM 992 OG SER A 124 27.520 62.782 2.187 1.00 18.03 O ATOM 993 N ILE A 125 31.838 62.734 3.335 1.00 6.06 N ATOM 994 CA ILE A 125 33.171 63.143 3.833 1.00 2.05 C ATOM 995 C ILE A 125 34.190 63.240 2.728 1.00 5.71 C ATOM 996 O ILE A 125 35.068 64.138 2.780 1.00 12.30 O ATOM 997 CB ILE A 125 33.601 62.204 4.999 1.00 7.73 C ATOM 998 CG1 ILE A 125 32.529 62.109 6.116 1.00 8.59 C ATOM 999 CG2 ILE A 125 34.969 62.826 5.397 1.00 10.16 C ATOM 1000 CD1 ILE A 125 32.846 61.075 7.246 1.00 4.09 C ATOM 1001 N ALA A 126 34.135 62.335 1.755 1.00 8.21 N ATOM 1002 CA ALA A 126 35.027 62.337 0.605 1.00 11.05 C ATOM 1003 C ALA A 126 34.879 63.617 -0.189 1.00 12.90 C ATOM 1004 O ALA A 126 35.846 64.079 -0.794 1.00 10.38 O ATOM 1005 CB ALA A 126 34.703 61.190 -0.340 1.00 5.52 C ATOM 1006 N ASN A 127 33.769 64.319 -0.063 1.00 8.83 N ATOM 1007 CA ASN A 127 33.432 65.505 -0.800 1.00 10.65 C ATOM 1008 C ASN A 127 33.665 66.731 0.062 1.00 11.96 C ATOM 1009 O ASN A 127 34.145 67.729 -0.486 1.00 9.70 O ATOM 1010 CB ASN A 127 31.954 65.455 -1.273 1.00 14.51 C ATOM 1011 CG ASN A 127 31.607 64.548 -2.429 1.00 35.35 C ATOM 1012 OD1 ASN A 127 30.823 63.634 -2.476 1.00 26.76 O ATOM 1013 ND2 ASN A 127 32.275 64.802 -3.605 1.00 25.67 N ATOM 1014 N GLN A 128 33.451 66.639 1.398 1.00 6.94 N ATOM 1015 CA GLN A 128 33.672 67.803 2.222 1.00 5.03 C ATOM 1016 C GLN A 128 33.432 67.452 3.730 1.00 5.39 C ATOM 1017 O GLN A 128 32.784 66.438 3.900 1.00 9.42 O ATOM 1018 CB GLN A 128 32.678 68.885 1.788 1.00 10.23 C ATOM 1019 CG GLN A 128 31.323 68.440 2.032 1.00 12.45 C ATOM 1020 CD GLN A 128 30.226 69.313 1.426 1.00 11.44 C ATOM 1021 OE1 GLN A 128 29.711 68.835 0.356 1.00 15.02 O ATOM 1022 NE2 GLN A 128 29.896 70.417 1.996 1.00 10.87 N ATOM 1023 N PRO A 129 33.844 68.350 4.599 1.00 14.40 N ATOM 1024 CA PRO A 129 33.551 68.101 6.036 1.00 11.42 C ATOM 1025 C PRO A 129 32.052 68.134 6.208 1.00 11.26 C ATOM 1026 O PRO A 129 31.308 68.944 5.608 1.00 8.94 O ATOM 1027 CB PRO A 129 34.313 69.225 6.742 1.00 11.42 C ATOM 1028 CG PRO A 129 35.513 69.591 5.838 1.00 7.33 C ATOM 1029 CD PRO A 129 34.856 69.484 4.481 1.00 7.07 C ATOM 1030 N VAL A 130 31.588 67.292 7.119 1.00 9.18 N ATOM 1031 CA VAL A 130 30.130 67.089 7.411 1.00 8.16 C ATOM 1032 C VAL A 130 29.935 67.228 8.940 1.00 4.27 C ATOM 1033 O VAL A 130 30.690 66.774 9.742 1.00 7.64 O ATOM 1034 CB VAL A 130 29.649 65.698 6.928 1.00 13.67 C ATOM 1035 CG1 VAL A 130 28.257 65.278 7.281 1.00 6.55 C ATOM 1036 CG2 VAL A 130 29.805 65.418 5.395 1.00 10.00 C ATOM 1037 N SER A 131 28.734 67.739 9.273 1.00 10.68 N ATOM 1038 CA SER A 131 28.302 67.860 10.654 1.00 3.64 C ATOM 1039 C SER A 131 27.547 66.584 11.039 1.00 2.17 C ATOM 1040 O SER A 131 26.597 66.126 10.383 1.00 9.53 O ATOM 1041 CB SER A 131 27.260 68.986 10.670 1.00 8.86 C ATOM 1042 OG SER A 131 26.781 69.046 11.989 1.00 18.12 O ATOM 1043 N VAL A 132 27.953 65.994 12.187 1.00 4.67 N ATOM 1044 CA VAL A 132 27.410 64.765 12.733 1.00 9.50 C ATOM 1045 C VAL A 132 27.201 64.915 14.274 1.00 9.92 C ATOM 1046 O VAL A 132 27.688 65.826 14.857 1.00 6.68 O ATOM 1047 CB VAL A 132 28.347 63.578 12.413 1.00 5.67 C ATOM 1048 CG1 VAL A 132 28.677 63.464 10.883 1.00 7.48 C ATOM 1049 CG2 VAL A 132 29.590 63.621 13.218 1.00 5.36 C ATOM 1050 N VAL A 133 26.351 64.042 14.798 1.00 9.14 N ATOM 1051 CA VAL A 133 26.014 63.934 16.224 1.00 11.47 C ATOM 1052 C VAL A 133 26.411 62.521 16.685 1.00 9.75 C ATOM 1053 O VAL A 133 26.609 61.561 15.967 1.00 7.57 O ATOM 1054 CB VAL A 133 24.523 64.276 16.475 1.00 12.66 C ATOM 1055 CG1 VAL A 133 24.161 65.651 15.991 1.00 11.50 C ATOM 1056 CG2 VAL A 133 23.507 63.191 15.970 1.00 5.37 C ATOM 1057 N LEU A 134 26.607 62.416 18.048 1.00 7.86 N ATOM 1058 CA LEU A 134 26.989 61.234 18.776 1.00 5.52 C ATOM 1059 C LEU A 134 26.686 61.472 20.256 1.00 10.56 C ATOM 1060 O LEU A 134 26.312 62.604 20.650 1.00 7.67 O ATOM 1061 CB LEU A 134 28.508 60.907 18.536 1.00 8.55 C ATOM 1062 CG LEU A 134 29.432 62.086 18.747 1.00 9.50 C ATOM 1063 CD1 LEU A 134 29.398 62.539 20.181 1.00 21.32 C ATOM 1064 CD2 LEU A 134 30.839 61.721 18.285 1.00 23.06 C ATOM 1065 N GLN A 135 26.699 60.363 20.970 1.00 7.01 N ATOM 1066 CA GLN A 135 26.501 60.344 22.436 1.00 5.28 C ATOM 1067 C GLN A 135 27.839 60.702 23.064 1.00 7.76 C ATOM 1068 O GLN A 135 28.761 59.843 23.017 1.00 13.60 O ATOM 1069 CB GLN A 135 26.061 58.945 22.777 1.00 12.55 C ATOM 1070 CG GLN A 135 25.593 59.034 24.183 1.00 13.21 C ATOM 1071 CD GLN A 135 25.444 57.610 24.787 1.00 9.52 C ATOM 1072 OE1 GLN A 135 26.448 57.043 25.227 1.00 12.83 O ATOM 1073 NE2 GLN A 135 24.295 57.131 24.775 1.00 9.69 N ATOM 1074 N ALA A 136 27.909 61.813 23.759 1.00 11.69 N ATOM 1075 CA ALA A 136 29.202 62.178 24.394 1.00 9.71 C ATOM 1076 C ALA A 136 29.134 62.028 25.919 1.00 7.63 C ATOM 1077 O ALA A 136 30.177 62.258 26.559 1.00 16.27 O ATOM 1078 CB ALA A 136 29.583 63.641 24.018 1.00 7.58 C ATOM 1079 N ALA A 137 27.948 61.745 26.419 1.00 12.68 N ATOM 1080 CA ALA A 137 27.747 61.799 27.896 1.00 28.07 C ATOM 1081 C ALA A 137 28.426 60.664 28.607 1.00 19.44 C ATOM 1082 O ALA A 137 28.632 60.785 29.865 1.00 20.35 O ATOM 1083 CB ALA A 137 26.257 61.802 28.169 1.00 19.02 C ATOM 1084 N GLY A 138 28.771 59.565 27.969 1.00 10.75 N ATOM 1085 CA GLY A 138 29.431 58.408 28.575 1.00 7.59 C ATOM 1086 C GLY A 138 30.846 58.780 29.000 1.00 17.57 C ATOM 1087 O GLY A 138 31.529 59.630 28.421 1.00 13.96 O ATOM 1088 N LYS A 139 31.283 58.188 30.117 1.00 14.49 N ATOM 1089 CA LYS A 139 32.564 58.487 30.779 1.00 17.45 C ATOM 1090 C LYS A 139 33.723 58.160 29.831 1.00 11.15 C ATOM 1091 O LYS A 139 34.714 58.817 29.901 1.00 12.78 O ATOM 1092 CB LYS A 139 32.673 57.701 32.079 1.00 32.08 C ATOM 1093 CG LYS A 139 32.019 58.259 33.257 1.00 42.20 C ATOM 1094 N ASP A 140 33.511 57.119 29.010 1.00 7.79 N ATOM 1095 CA ASP A 140 34.577 56.639 28.139 1.00 10.57 C ATOM 1096 C ASP A 140 34.890 57.699 27.053 1.00 8.77 C ATOM 1097 O ASP A 140 36.085 57.888 26.823 1.00 7.65 O ATOM 1098 CB ASP A 140 34.040 55.362 27.457 1.00 12.56 C ATOM 1099 CG ASP A 140 33.664 54.413 28.585 1.00 30.00 C ATOM 1100 OD1 ASP A 140 34.544 53.793 29.136 1.00 15.62 O ATOM 1101 OD2 ASP A 140 32.516 54.287 28.917 1.00 14.85 O ATOM 1102 N PHE A 141 33.828 58.224 26.515 1.00 7.45 N ATOM 1103 CA PHE A 141 34.004 59.308 25.495 1.00 6.33 C ATOM 1104 C PHE A 141 34.667 60.559 26.095 1.00 10.69 C ATOM 1105 O PHE A 141 35.719 61.010 25.536 1.00 13.16 O ATOM 1106 CB PHE A 141 32.646 59.643 24.884 1.00 11.34 C ATOM 1107 CG PHE A 141 32.859 60.626 23.761 1.00 8.67 C ATOM 1108 CD1 PHE A 141 32.956 60.127 22.500 1.00 13.65 C ATOM 1109 CD2 PHE A 141 32.946 61.980 24.017 1.00 10.38 C ATOM 1110 CE1 PHE A 141 33.160 60.987 21.405 1.00 8.32 C ATOM 1111 CE2 PHE A 141 33.148 62.835 22.880 1.00 14.22 C ATOM 1112 CZ PHE A 141 33.240 62.297 21.606 1.00 5.80 C ATOM 1113 N GLN A 142 34.155 60.925 27.286 1.00 16.39 N ATOM 1114 CA GLN A 142 34.824 62.030 28.043 1.00 17.58 C ATOM 1115 C GLN A 142 36.253 61.902 28.455 1.00 10.11 C ATOM 1116 O GLN A 142 37.039 62.881 28.375 1.00 12.64 O ATOM 1117 CB GLN A 142 33.923 62.244 29.268 1.00 10.64 C ATOM 1118 CG GLN A 142 32.805 63.006 28.626 1.00 23.59 C ATOM 1119 CD GLN A 142 32.017 63.784 29.670 1.00 60.71 C ATOM 1120 OE1 GLN A 142 32.120 63.368 30.869 1.00 37.18 O ATOM 1121 NE2 GLN A 142 31.334 64.763 29.262 1.00 73.08 N ATOM 1122 N LEU A 143 36.717 60.734 28.824 1.00 12.61 N ATOM 1123 CA LEU A 143 38.077 60.439 29.285 1.00 12.32 C ATOM 1124 C LEU A 143 38.981 59.933 28.180 1.00 20.80 C ATOM 1125 O LEU A 143 40.147 59.612 28.441 1.00 18.03 O ATOM 1126 CB LEU A 143 38.011 59.380 30.442 1.00 14.24 C ATOM 1127 CG LEU A 143 37.309 59.833 31.706 1.00 18.55 C ATOM 1128 CD1 LEU A 143 37.450 58.830 32.809 1.00 21.96 C ATOM 1129 CD2 LEU A 143 37.797 61.139 32.199 1.00 19.25 C ATOM 1130 N TYR A 144 38.558 59.974 26.925 1.00 16.90 N ATOM 1131 CA TYR A 144 39.358 59.505 25.772 1.00 15.21 C ATOM 1132 C TYR A 144 40.577 60.429 25.571 1.00 11.57 C ATOM 1133 O TYR A 144 40.523 61.686 25.631 1.00 11.07 O ATOM 1134 CB TYR A 144 38.490 59.544 24.525 1.00 13.57 C ATOM 1135 CG TYR A 144 39.217 59.348 23.206 1.00 9.29 C ATOM 1136 CD1 TYR A 144 39.514 60.493 22.444 1.00 9.74 C ATOM 1137 CD2 TYR A 144 39.582 58.135 22.731 1.00 9.02 C ATOM 1138 CE1 TYR A 144 40.188 60.293 21.188 1.00 8.08 C ATOM 1139 CE2 TYR A 144 40.238 57.935 21.520 1.00 5.79 C ATOM 1140 CZ TYR A 144 40.514 59.077 20.775 1.00 6.57 C ATOM 1141 OH TYR A 144 41.162 58.962 19.539 1.00 9.10 O ATOM 1142 N ARG A 145 41.668 59.723 25.381 1.00 13.34 N ATOM 1143 CA ARG A 145 42.982 60.286 25.184 1.00 15.76 C ATOM 1144 C ARG A 145 43.677 59.774 23.960 1.00 13.17 C ATOM 1145 O ARG A 145 44.809 60.218 23.836 1.00 21.15 O ATOM 1146 CB ARG A 145 43.873 60.029 26.463 1.00 22.42 C ATOM 1147 CG ARG A 145 43.193 60.754 27.691 1.00 23.08 C ATOM 1148 CD ARG A 145 43.490 59.915 28.959 1.00 48.35 C ATOM 1149 NE ARG A 145 44.359 60.690 29.775 1.00 66.93 N ATOM 1150 CZ ARG A 145 45.287 60.467 30.716 1.00 70.88 C ATOM 1151 NH1 ARG A 145 45.294 59.201 31.144 1.00 65.61 N ATOM 1152 NH2 ARG A 145 46.109 61.458 31.064 1.00 50.84 N ATOM 1153 N GLY A 146 43.160 58.898 23.142 1.00 14.25 N ATOM 1154 CA GLY A 146 43.820 58.557 21.876 1.00 9.18 C ATOM 1155 C GLY A 146 43.455 57.114 21.531 1.00 19.48 C ATOM 1156 O GLY A 146 42.969 56.342 22.372 1.00 21.65 O ATOM 1157 N GLY A 147 43.732 56.763 20.265 1.00 21.93 N ATOM 1158 CA GLY A 147 43.438 55.384 19.756 1.00 18.86 C ATOM 1159 C GLY A 147 42.056 55.391 19.087 1.00 18.18 C ATOM 1160 O GLY A 147 41.411 56.460 18.926 1.00 21.88 O ATOM 1161 N ILE A 148 41.756 54.231 18.457 1.00 12.19 N ATOM 1162 CA ILE A 148 40.470 54.123 17.753 1.00 12.05 C ATOM 1163 C ILE A 148 39.463 53.785 18.800 1.00 16.35 C ATOM 1164 O ILE A 148 39.594 52.803 19.563 1.00 14.81 O ATOM 1165 CB ILE A 148 40.651 53.035 16.654 1.00 10.92 C ATOM 1166 CG1 ILE A 148 41.821 53.561 15.765 1.00 17.25 C ATOM 1167 CG2 ILE A 148 39.233 52.955 16.087 1.00 11.97 C ATOM 1168 CD1 ILE A 148 41.768 53.134 14.328 1.00 19.46 C ATOM 1169 N PHE A 149 38.479 54.659 18.915 1.00 10.09 N ATOM 1170 CA PHE A 149 37.413 54.559 19.940 1.00 17.90 C ATOM 1171 C PHE A 149 36.313 53.663 19.402 1.00 9.28 C ATOM 1172 O PHE A 149 35.646 53.807 18.400 1.00 13.65 O ATOM 1173 CB PHE A 149 36.925 55.969 20.250 1.00 10.63 C ATOM 1174 CG PHE A 149 35.865 55.986 21.326 1.00 12.73 C ATOM 1175 CD1 PHE A 149 36.339 55.969 22.619 1.00 16.75 C ATOM 1176 CD2 PHE A 149 34.504 56.010 21.048 1.00 18.30 C ATOM 1177 CE1 PHE A 149 35.389 55.983 23.712 1.00 14.34 C ATOM 1178 CE2 PHE A 149 33.640 56.024 22.170 1.00 14.13 C ATOM 1179 CZ PHE A 149 34.072 56.016 23.461 1.00 14.09 C ATOM 1180 N VAL A 150 36.086 52.700 20.294 1.00 13.51 N ATOM 1181 CA VAL A 150 35.173 51.546 20.034 1.00 13.65 C ATOM 1182 C VAL A 150 34.019 51.572 21.028 1.00 21.20 C ATOM 1183 O VAL A 150 33.030 50.796 20.854 1.00 23.75 O ATOM 1184 CB VAL A 150 36.166 50.377 20.127 1.00 23.03 C ATOM 1185 CG1 VAL A 150 35.990 49.359 21.191 1.00 25.62 C ATOM 1186 CG2 VAL A 150 36.631 49.775 18.772 1.00 14.90 C ATOM 1187 N GLY A 151 33.971 52.608 21.873 1.00 12.28 N ATOM 1188 CA GLY A 151 32.938 52.607 22.937 1.00 7.03 C ATOM 1189 C GLY A 151 33.532 52.112 24.239 1.00 13.37 C ATOM 1190 O GLY A 151 34.751 51.985 24.460 1.00 16.48 O ATOM 1191 N PRO A 152 32.680 51.737 25.161 1.00 8.76 N ATOM 1192 CA PRO A 152 31.229 51.671 25.149 1.00 8.17 C ATOM 1193 C PRO A 152 30.585 53.061 25.093 1.00 17.28 C ATOM 1194 O PRO A 152 31.088 54.076 25.591 1.00 22.07 O ATOM 1195 CB PRO A 152 30.871 51.044 26.491 1.00 10.19 C ATOM 1196 CG PRO A 152 32.147 50.815 27.256 1.00 11.54 C ATOM 1197 CD PRO A 152 33.291 51.382 26.458 1.00 11.58 C ATOM 1198 N CYS A 153 29.414 53.064 24.467 1.00 15.47 N ATOM 1199 CA CYS A 153 28.546 54.232 24.312 1.00 15.54 C ATOM 1200 C CYS A 153 27.262 53.719 23.651 1.00 19.46 C ATOM 1201 O CYS A 153 27.206 52.608 23.025 1.00 21.58 O ATOM 1202 CB CYS A 153 29.208 55.308 23.502 1.00 10.27 C ATOM 1203 SG CYS A 153 29.735 54.685 21.836 1.00 13.17 S ATOM 1204 N GLY A 154 26.163 54.428 23.981 1.00 18.01 N ATOM 1205 CA GLY A 154 24.833 54.060 23.463 1.00 15.88 C ATOM 1206 C GLY A 154 24.636 54.935 22.181 1.00 10.24 C ATOM 1207 O GLY A 154 25.609 55.489 21.703 1.00 12.55 O ATOM 1208 N ASN A 155 23.387 55.239 22.047 1.00 7.84 N ATOM 1209 CA ASN A 155 22.905 56.065 20.937 1.00 25.04 C ATOM 1210 C ASN A 155 21.989 57.225 21.309 1.00 12.21 C ATOM 1211 O ASN A 155 21.207 57.744 20.463 1.00 17.39 O ATOM 1212 CB ASN A 155 22.138 55.285 19.900 1.00 34.77 C ATOM 1213 CG ASN A 155 22.275 53.890 19.514 1.00 60.34 C ATOM 1214 OD1 ASN A 155 21.308 53.122 19.471 1.00 33.55 O ATOM 1215 ND2 ASN A 155 23.558 53.486 19.193 1.00 44.01 N ATOM 1216 N LYS A 156 22.151 57.735 22.528 1.00 12.56 N ATOM 1217 CA LYS A 156 21.367 58.851 23.019 1.00 13.82 C ATOM 1218 C LYS A 156 22.253 60.095 22.666 1.00 9.45 C ATOM 1219 O LYS A 156 22.942 60.626 23.506 1.00 13.48 O ATOM 1220 CB LYS A 156 21.159 58.742 24.512 1.00 29.67 C ATOM 1221 CG LYS A 156 21.076 57.413 25.227 1.00 62.91 C ATOM 1222 CD LYS A 156 21.860 57.318 26.547 1.00 70.39 C ATOM 1223 CE LYS A 156 22.766 56.060 26.633 1.00 17.23 C ATOM 1224 NZ LYS A 156 21.911 54.867 26.369 1.00 55.21 N ATOM 1225 N VAL A 157 22.212 60.346 21.337 1.00 16.26 N ATOM 1226 CA VAL A 157 23.050 61.418 20.771 1.00 9.33 C ATOM 1227 C VAL A 157 22.728 62.720 21.476 1.00 10.30 C ATOM 1228 O VAL A 157 21.543 63.145 21.664 1.00 12.18 O ATOM 1229 CB VAL A 157 22.923 61.476 19.225 1.00 7.96 C ATOM 1230 CG1 VAL A 157 23.281 60.192 18.480 1.00 6.82 C ATOM 1231 CG2 VAL A 157 21.584 62.019 18.816 1.00 13.90 C ATOM 1232 N ASP A 158 23.771 63.446 21.883 1.00 8.13 N ATOM 1233 CA ASP A 158 23.649 64.703 22.580 1.00 12.32 C ATOM 1234 C ASP A 158 24.701 65.731 22.277 1.00 19.51 C ATOM 1235 O ASP A 158 24.838 66.710 23.029 1.00 16.05 O ATOM 1236 CB ASP A 158 23.649 64.426 24.118 1.00 6.21 C ATOM 1237 CG ASP A 158 24.892 63.669 24.472 1.00 24.21 C ATOM 1238 OD1 ASP A 158 25.888 63.663 23.745 1.00 12.63 O ATOM 1239 OD2 ASP A 158 24.908 63.044 25.513 1.00 27.65 O ATOM 1240 N HIS A 159 25.592 65.493 21.338 1.00 14.54 N ATOM 1241 CA HIS A 159 26.713 66.378 21.046 1.00 3.57 C ATOM 1242 C HIS A 159 26.942 66.469 19.553 1.00 15.86 C ATOM 1243 O HIS A 159 26.838 65.437 18.889 1.00 12.72 O ATOM 1244 CB HIS A 159 27.895 65.686 21.747 1.00 9.07 C ATOM 1245 CG HIS A 159 29.115 66.576 21.748 1.00 17.09 C ATOM 1246 ND1 HIS A 159 29.140 67.820 22.342 1.00 18.34 N ATOM 1247 CD2 HIS A 159 30.343 66.404 21.220 1.00 13.00 C ATOM 1248 CE1 HIS A 159 30.326 68.375 22.176 1.00 19.98 C ATOM 1249 NE2 HIS A 159 31.075 67.534 21.503 1.00 15.03 N ATOM 1250 N ALA A 160 27.190 67.687 19.074 1.00 8.81 N ATOM 1251 CA ALA A 160 27.418 67.878 17.621 1.00 7.63 C ATOM 1252 C ALA A 160 28.906 68.165 17.431 1.00 9.05 C ATOM 1253 O ALA A 160 29.520 69.055 18.058 1.00 10.00 O ATOM 1254 CB ALA A 160 26.551 69.047 17.208 1.00 4.83 C ATOM 1255 N VAL A 161 29.502 67.475 16.434 1.00 9.89 N ATOM 1256 CA VAL A 161 30.935 67.487 16.086 1.00 7.48 C ATOM 1257 C VAL A 161 31.051 67.463 14.530 1.00 11.46 C ATOM 1258 O VAL A 161 30.000 67.658 13.892 1.00 7.50 O ATOM 1259 CB VAL A 161 31.733 66.345 16.710 1.00 10.22 C ATOM 1260 CG1 VAL A 161 31.905 66.577 18.188 1.00 9.26 C ATOM 1261 CG2 VAL A 161 31.148 64.948 16.421 1.00 1.92 C ATOM 1262 N ALA A 162 32.260 67.449 14.036 1.00 5.96 N ATOM 1263 CA ALA A 162 32.421 67.534 12.541 1.00 4.60 C ATOM 1264 C ALA A 162 33.278 66.389 12.097 1.00 7.11 C ATOM 1265 O ALA A 162 34.334 66.114 12.714 1.00 12.61 O ATOM 1266 CB ALA A 162 32.867 68.906 12.117 1.00 7.08 C ATOM 1267 N ALA A 163 32.882 65.654 11.030 1.00 4.28 N ATOM 1268 CA ALA A 163 33.635 64.544 10.516 1.00 1.00 C ATOM 1269 C ALA A 163 34.537 65.121 9.399 1.00 6.66 C ATOM 1270 O ALA A 163 33.979 65.782 8.500 1.00 7.99 O ATOM 1271 CB ALA A 163 32.774 63.424 9.938 1.00 3.96 C ATOM 1272 N VAL A 164 35.857 64.981 9.559 1.00 5.63 N ATOM 1273 CA VAL A 164 36.759 65.637 8.634 1.00 6.45 C ATOM 1274 C VAL A 164 37.620 64.621 7.873 1.00 11.06 C ATOM 1275 O VAL A 164 38.591 65.070 7.205 1.00 12.85 O ATOM 1276 CB VAL A 164 37.661 66.700 9.356 1.00 11.57 C ATOM 1277 CG1 VAL A 164 36.844 67.915 9.789 1.00 9.58 C ATOM 1278 CG2 VAL A 164 38.588 66.133 10.436 1.00 7.34 C ATOM 1279 N GLY A 165 37.242 63.315 8.018 1.00 8.14 N ATOM 1280 CA GLY A 165 38.072 62.339 7.286 1.00 6.61 C ATOM 1281 C GLY A 165 37.637 60.943 7.705 1.00 8.79 C ATOM 1282 O GLY A 165 36.760 60.771 8.535 1.00 9.07 O ATOM 1283 N TYR A 166 38.385 59.992 7.100 1.00 8.73 N ATOM 1284 CA TYR A 166 38.189 58.552 7.364 1.00 5.02 C ATOM 1285 C TYR A 166 39.442 57.824 6.866 1.00 7.41 C ATOM 1286 O TYR A 166 40.293 58.268 6.114 1.00 8.76 O ATOM 1287 CB TYR A 166 36.857 58.014 6.851 1.00 4.76 C ATOM 1288 CG TYR A 166 36.786 58.116 5.309 1.00 6.29 C ATOM 1289 CD1 TYR A 166 37.393 57.003 4.662 1.00 6.73 C ATOM 1290 CD2 TYR A 166 36.218 59.155 4.617 1.00 16.45 C ATOM 1291 CE1 TYR A 166 37.398 56.983 3.183 1.00 9.46 C ATOM 1292 CE2 TYR A 166 36.228 59.114 3.187 1.00 14.54 C ATOM 1293 CZ TYR A 166 36.816 58.025 2.534 1.00 9.39 C ATOM 1294 OH TYR A 166 36.821 58.012 1.154 1.00 12.18 O ATOM 1295 N GLY A 167 39.416 56.560 7.366 1.00 15.91 N ATOM 1296 CA GLY A 167 40.381 55.531 6.973 1.00 15.34 C ATOM 1297 C GLY A 167 39.658 54.188 7.072 1.00 7.01 C ATOM 1298 O GLY A 167 38.470 54.077 7.308 1.00 13.21 O ATOM 1299 N PRO A 168 40.457 53.151 6.900 1.00 13.01 N ATOM 1300 CA PRO A 168 39.966 51.769 6.718 1.00 20.97 C ATOM 1301 C PRO A 168 39.050 51.393 7.847 1.00 16.15 C ATOM 1302 O PRO A 168 38.094 50.622 7.698 1.00 16.18 O ATOM 1303 CB PRO A 168 41.281 51.034 6.562 1.00 17.19 C ATOM 1304 CG PRO A 168 42.248 52.051 6.077 1.00 10.86 C ATOM 1305 CD PRO A 168 41.889 53.320 6.853 1.00 7.69 C ATOM 1306 N ASN A 169 39.377 51.787 9.094 1.00 10.94 N ATOM 1307 CA ASN A 169 38.651 51.391 10.287 1.00 9.43 C ATOM 1308 C ASN A 169 38.172 52.563 11.112 1.00 8.08 C ATOM 1309 O ASN A 169 37.886 52.256 12.334 1.00 9.80 O ATOM 1310 CB ASN A 169 39.660 50.560 11.128 1.00 25.72 C ATOM 1311 CG ASN A 169 41.027 51.160 11.192 1.00 34.00 C ATOM 1312 OD1 ASN A 169 41.847 51.627 10.375 1.00 35.82 O ATOM 1313 ND2 ASN A 169 41.434 51.160 12.539 1.00 70.88 N ATOM 1314 N TYR A 170 38.187 53.806 10.702 1.00 9.80 N ATOM 1315 CA TYR A 170 37.801 54.875 11.663 1.00 10.75 C ATOM 1316 C TYR A 170 37.144 55.971 10.837 1.00 18.83 C ATOM 1317 O TYR A 170 37.292 56.010 9.622 1.00 12.00 O ATOM 1318 CB TYR A 170 39.026 55.332 12.575 1.00 8.98 C ATOM 1319 CG TYR A 170 40.051 55.983 11.666 1.00 3.84 C ATOM 1320 CD1 TYR A 170 41.030 55.114 11.196 1.00 17.51 C ATOM 1321 CD2 TYR A 170 40.003 57.330 11.316 1.00 3.63 C ATOM 1322 CE1 TYR A 170 42.051 55.687 10.290 1.00 14.99 C ATOM 1323 CE2 TYR A 170 40.980 57.841 10.457 1.00 10.77 C ATOM 1324 CZ TYR A 170 41.970 56.977 9.986 1.00 17.31 C ATOM 1325 OH TYR A 170 42.929 57.470 9.142 1.00 18.43 O ATOM 1326 N ILE A 171 36.447 56.890 11.512 1.00 11.15 N ATOM 1327 CA ILE A 171 35.964 58.146 10.919 1.00 9.33 C ATOM 1328 C ILE A 171 36.677 59.195 11.793 1.00 11.95 C ATOM 1329 O ILE A 171 36.677 58.958 13.049 1.00 8.05 O ATOM 1330 CB ILE A 171 34.398 58.244 10.924 1.00 12.26 C ATOM 1331 CG1 ILE A 171 33.817 57.303 9.813 1.00 6.25 C ATOM 1332 CG2 ILE A 171 34.026 59.740 10.763 1.00 12.48 C ATOM 1333 CD1 ILE A 171 32.342 57.055 9.948 1.00 13.36 C ATOM 1334 N LEU A 172 37.250 60.184 11.166 1.00 6.92 N ATOM 1335 CA LEU A 172 38.037 61.185 11.904 1.00 4.66 C ATOM 1336 C LEU A 172 37.160 62.362 12.244 1.00 1.93 C ATOM 1337 O LEU A 172 36.554 62.986 11.377 1.00 5.05 O ATOM 1338 CB LEU A 172 39.259 61.656 11.107 1.00 6.16 C ATOM 1339 CG LEU A 172 40.153 62.852 11.556 1.00 4.43 C ATOM 1340 CD1 LEU A 172 40.937 62.436 12.722 1.00 7.18 C ATOM 1341 CD2 LEU A 172 41.057 63.250 10.437 1.00 7.12 C ATOM 1342 N ILE A 173 37.063 62.595 13.564 1.00 1.97 N ATOM 1343 CA ILE A 173 36.152 63.669 14.083 1.00 11.12 C ATOM 1344 C ILE A 173 36.908 64.829 14.717 1.00 6.84 C ATOM 1345 O ILE A 173 37.753 64.607 15.608 1.00 12.15 O ATOM 1346 CB ILE A 173 35.204 63.053 15.143 1.00 6.24 C ATOM 1347 CG1 ILE A 173 34.222 61.953 14.598 1.00 16.36 C ATOM 1348 CG2 ILE A 173 34.571 64.149 15.997 1.00 6.06 C ATOM 1349 CD1 ILE A 173 33.384 62.381 13.416 1.00 14.43 C ATOM 1350 N LYS A 174 36.540 66.092 14.360 1.00 3.80 N ATOM 1351 CA LYS A 174 37.068 67.259 15.018 1.00 2.80 C ATOM 1352 C LYS A 174 36.053 67.648 16.114 1.00 5.28 C ATOM 1353 O LYS A 174 34.911 67.959 15.916 1.00 6.75 O ATOM 1354 CB LYS A 174 37.123 68.442 14.012 1.00 8.12 C ATOM 1355 CG LYS A 174 37.928 69.594 14.578 1.00 6.57 C ATOM 1356 CD LYS A 174 37.807 70.858 13.689 1.00 4.42 C ATOM 1357 CE LYS A 174 38.699 71.971 13.982 1.00 10.25 C ATOM 1358 NZ LYS A 174 38.552 73.267 13.147 1.00 5.27 N ATOM 1359 N ASN A 175 36.503 67.613 17.378 1.00 8.42 N ATOM 1360 CA ASN A 175 35.703 68.042 18.522 1.00 8.56 C ATOM 1361 C ASN A 175 36.015 69.511 18.842 1.00 10.80 C ATOM 1362 O ASN A 175 36.953 70.116 18.273 1.00 12.02 O ATOM 1363 CB ASN A 175 35.917 67.058 19.693 1.00 6.79 C ATOM 1364 CG ASN A 175 34.772 67.076 20.672 1.00 17.58 C ATOM 1365 OD1 ASN A 175 33.720 67.662 20.695 1.00 4.08 O ATOM 1366 ND2 ASN A 175 34.980 66.242 21.762 1.00 14.50 N ATOM 1367 N SER A 176 35.190 70.016 19.821 1.00 4.06 N ATOM 1368 CA SER A 176 35.339 71.438 20.190 1.00 5.17 C ATOM 1369 C SER A 176 35.590 71.475 21.719 1.00 10.01 C ATOM 1370 O SER A 176 35.095 72.388 22.416 1.00 8.66 O ATOM 1371 CB SER A 176 34.169 72.246 19.822 1.00 5.87 C ATOM 1372 OG SER A 176 32.927 71.665 20.138 1.00 12.44 O ATOM 1373 N TRP A 177 36.450 70.578 22.171 1.00 14.64 N ATOM 1374 CA TRP A 177 36.828 70.613 23.581 1.00 4.62 C ATOM 1375 C TRP A 177 38.285 70.942 23.760 1.00 13.40 C ATOM 1376 O TRP A 177 38.738 70.644 24.872 1.00 11.94 O ATOM 1377 CB TRP A 177 36.594 69.211 24.165 1.00 7.30 C ATOM 1378 CG TRP A 177 35.070 68.930 24.370 1.00 8.24 C ATOM 1379 CD1 TRP A 177 34.014 69.747 24.150 1.00 6.01 C ATOM 1380 CD2 TRP A 177 34.491 67.705 24.842 1.00 10.05 C ATOM 1381 NE1 TRP A 177 32.772 69.071 24.478 1.00 14.58 N ATOM 1382 CE2 TRP A 177 33.081 67.879 24.881 1.00 15.29 C ATOM 1383 CE3 TRP A 177 35.085 66.536 25.214 1.00 10.79 C ATOM 1384 CZ2 TRP A 177 32.151 66.916 25.289 1.00 13.67 C ATOM 1385 CZ3 TRP A 177 34.118 65.566 25.634 1.00 15.74 C ATOM 1386 CH2 TRP A 177 32.747 65.736 25.672 1.00 15.67 C ATOM 1387 N GLY A 178 38.898 71.727 22.906 1.00 9.38 N ATOM 1388 CA GLY A 178 40.249 72.119 22.961 1.00 9.60 C ATOM 1389 C GLY A 178 41.196 70.938 22.696 1.00 7.09 C ATOM 1390 O GLY A 178 40.829 69.870 22.296 1.00 11.81 O ATOM 1391 N THR A 179 42.505 71.291 22.811 1.00 10.51 N ATOM 1392 CA THR A 179 43.649 70.437 22.496 1.00 7.60 C ATOM 1393 C THR A 179 43.844 69.319 23.540 1.00 8.90 C ATOM 1394 O THR A 179 44.590 68.382 23.207 1.00 15.49 O ATOM 1395 CB THR A 179 44.962 71.180 22.269 1.00 17.02 C ATOM 1396 OG1 THR A 179 45.203 72.187 23.245 1.00 13.06 O ATOM 1397 CG2 THR A 179 44.922 71.850 20.929 1.00 20.10 C ATOM 1398 N GLY A 180 43.373 69.647 24.702 1.00 10.72 N ATOM 1399 CA GLY A 180 43.579 68.845 25.883 1.00 8.86 C ATOM 1400 C GLY A 180 42.747 67.573 25.931 1.00 30.84 C ATOM 1401 O GLY A 180 42.663 66.946 27.001 1.00 28.69 O ATOM 1402 N TRP A 181 41.976 67.276 24.881 1.00 17.45 N ATOM 1403 CA TRP A 181 41.122 66.098 24.815 1.00 11.70 C ATOM 1404 C TRP A 181 41.411 65.298 23.526 1.00 8.71 C ATOM 1405 O TRP A 181 41.735 65.851 22.493 1.00 10.91 O ATOM 1406 CB TRP A 181 39.652 66.577 24.853 1.00 14.13 C ATOM 1407 CG TRP A 181 38.646 65.364 24.780 1.00 11.87 C ATOM 1408 CD1 TRP A 181 38.097 64.643 25.743 1.00 7.78 C ATOM 1409 CD2 TRP A 181 38.154 64.825 23.588 1.00 9.47 C ATOM 1410 NE1 TRP A 181 37.247 63.642 25.187 1.00 17.84 N ATOM 1411 CE2 TRP A 181 37.281 63.752 23.894 1.00 11.78 C ATOM 1412 CE3 TRP A 181 38.358 65.147 22.239 1.00 6.90 C ATOM 1413 CZ2 TRP A 181 36.604 62.981 22.975 1.00 6.72 C ATOM 1414 CZ3 TRP A 181 37.666 64.365 21.347 1.00 12.22 C ATOM 1415 CH2 TRP A 181 36.822 63.327 21.661 1.00 10.34 C ATOM 1416 N GLY A 182 41.412 63.981 23.691 1.00 13.40 N ATOM 1417 CA GLY A 182 41.595 63.106 22.501 1.00 10.92 C ATOM 1418 C GLY A 182 42.965 63.267 21.952 1.00 11.15 C ATOM 1419 O GLY A 182 43.947 63.470 22.689 1.00 14.15 O ATOM 1420 N GLU A 183 43.086 63.138 20.664 1.00 8.53 N ATOM 1421 CA GLU A 183 44.364 63.272 19.932 1.00 6.88 C ATOM 1422 C GLU A 183 44.512 64.689 19.402 1.00 10.38 C ATOM 1423 O GLU A 183 44.085 64.955 18.253 1.00 9.54 O ATOM 1424 CB GLU A 183 44.261 62.311 18.710 1.00 8.54 C ATOM 1425 CG GLU A 183 43.957 60.886 19.137 1.00 11.37 C ATOM 1426 CD GLU A 183 44.111 59.743 18.076 1.00 19.85 C ATOM 1427 OE1 GLU A 183 43.767 60.056 16.976 1.00 16.32 O ATOM 1428 OE2 GLU A 183 44.546 58.782 18.617 1.00 19.13 O ATOM 1429 N ASN A 184 44.904 65.584 20.296 1.00 13.51 N ATOM 1430 CA ASN A 184 45.026 67.020 20.034 1.00 10.58 C ATOM 1431 C ASN A 184 43.704 67.622 19.659 1.00 9.84 C ATOM 1432 O ASN A 184 43.678 68.496 18.784 1.00 13.04 O ATOM 1433 CB ASN A 184 46.146 67.342 19.007 1.00 10.28 C ATOM 1434 CG ASN A 184 47.500 67.270 19.700 1.00 28.60 C ATOM 1435 OD1 ASN A 184 48.123 66.268 19.927 1.00 35.64 O ATOM 1436 ND2 ASN A 184 48.051 68.475 20.107 1.00 65.19 N ATOM 1437 N GLY A 185 42.642 67.152 20.268 1.00 7.07 N ATOM 1438 CA GLY A 185 41.286 67.669 19.987 1.00 5.48 C ATOM 1439 C GLY A 185 40.461 66.814 19.003 1.00 5.92 C ATOM 1440 O GLY A 185 39.295 67.155 18.806 1.00 7.96 O ATOM 1441 N TYR A 186 40.954 65.767 18.435 1.00 7.59 N ATOM 1442 CA TYR A 186 40.348 64.906 17.442 1.00 6.40 C ATOM 1443 C TYR A 186 40.012 63.586 18.081 1.00 4.44 C ATOM 1444 O TYR A 186 40.711 63.196 19.076 1.00 6.80 O ATOM 1445 CB TYR A 186 41.319 64.617 16.300 1.00 8.94 C ATOM 1446 CG TYR A 186 41.454 65.860 15.429 1.00 9.71 C ATOM 1447 CD1 TYR A 186 40.554 65.967 14.347 1.00 10.95 C ATOM 1448 CD2 TYR A 186 42.391 66.811 15.698 1.00 7.68 C ATOM 1449 CE1 TYR A 186 40.701 67.178 13.521 1.00 17.06 C ATOM 1450 CE2 TYR A 186 42.526 67.965 14.905 1.00 8.30 C ATOM 1451 CZ TYR A 186 41.627 68.091 13.809 1.00 19.99 C ATOM 1452 OH TYR A 186 41.710 69.197 13.000 1.00 16.58 O ATOM 1453 N ILE A 187 39.081 62.824 17.444 1.00 11.66 N ATOM 1454 CA ILE A 187 38.850 61.434 17.919 1.00 6.52 C ATOM 1455 C ILE A 187 38.792 60.625 16.629 1.00 6.09 C ATOM 1456 O ILE A 187 38.211 61.057 15.670 1.00 8.21 O ATOM 1457 CB ILE A 187 37.669 61.228 18.851 1.00 10.89 C ATOM 1458 CG1 ILE A 187 37.257 59.708 19.155 1.00 2.74 C ATOM 1459 CG2 ILE A 187 36.463 61.973 18.337 1.00 9.70 C ATOM 1460 CD1 ILE A 187 36.328 59.657 20.369 1.00 8.15 C ATOM 1461 N ARG A 188 39.337 59.415 16.668 1.00 4.67 N ATOM 1462 CA ARG A 188 39.070 58.406 15.609 1.00 8.45 C ATOM 1463 C ARG A 188 38.059 57.380 16.119 1.00 10.66 C ATOM 1464 O ARG A 188 38.368 56.694 17.123 1.00 10.21 O ATOM 1465 CB ARG A 188 40.386 57.718 15.172 1.00 11.80 C ATOM 1466 CG ARG A 188 41.309 58.801 14.511 1.00 9.63 C ATOM 1467 CD ARG A 188 42.591 58.036 14.142 1.00 10.29 C ATOM 1468 NE ARG A 188 43.334 57.671 15.346 1.00 24.69 N ATOM 1469 CZ ARG A 188 44.244 56.674 15.421 1.00 52.30 C ATOM 1470 NH1 ARG A 188 44.557 56.049 14.271 1.00 41.93 N ATOM 1471 NH2 ARG A 188 44.909 56.454 16.562 1.00 16.62 N ATOM 1472 N ILE A 189 36.888 57.364 15.466 1.00 6.77 N ATOM 1473 CA ILE A 189 35.779 56.471 15.995 1.00 7.37 C ATOM 1474 C ILE A 189 35.736 55.261 15.078 1.00 6.54 C ATOM 1475 O ILE A 189 35.795 55.430 13.822 1.00 9.43 O ATOM 1476 CB ILE A 189 34.440 57.184 16.167 1.00 11.69 C ATOM 1477 CG1 ILE A 189 34.490 58.309 17.291 1.00 20.72 C ATOM 1478 CG2 ILE A 189 33.293 56.254 16.633 1.00 15.23 C ATOM 1479 CD1 ILE A 189 33.137 59.030 17.505 1.00 35.11 C ATOM 1480 N LYS A 190 35.653 54.069 15.652 1.00 7.62 N ATOM 1481 CA LYS A 190 35.521 52.854 14.842 1.00 7.16 C ATOM 1482 C LYS A 190 34.329 52.949 13.865 1.00 7.95 C ATOM 1483 O LYS A 190 33.174 53.277 14.201 1.00 12.31 O ATOM 1484 CB LYS A 190 35.252 51.630 15.763 1.00 10.59 C ATOM 1485 CG LYS A 190 35.303 50.389 14.895 1.00 23.92 C ATOM 1486 CD LYS A 190 36.509 49.510 14.881 1.00 32.20 C ATOM 1487 CE LYS A 190 36.734 48.837 13.551 1.00 64.99 C ATOM 1488 NZ LYS A 190 36.660 47.410 13.386 1.00 35.23 N ATOM 1489 N ARG A 191 34.642 52.390 12.632 1.00 7.17 N ATOM 1490 CA ARG A 191 33.545 52.184 11.661 1.00 8.13 C ATOM 1491 C ARG A 191 33.580 50.715 11.217 1.00 6.80 C ATOM 1492 O ARG A 191 34.440 49.974 11.600 1.00 12.56 O ATOM 1493 CB ARG A 191 33.753 53.071 10.444 1.00 8.61 C ATOM 1494 CG ARG A 191 34.967 52.765 9.570 1.00 9.47 C ATOM 1495 CD ARG A 191 34.859 53.686 8.385 1.00 10.04 C ATOM 1496 NE ARG A 191 35.668 53.332 7.253 1.00 12.47 N ATOM 1497 CZ ARG A 191 35.325 52.537 6.184 1.00 7.01 C ATOM 1498 NH1 ARG A 191 34.148 51.941 6.137 1.00 9.83 N ATOM 1499 NH2 ARG A 191 36.156 52.450 5.212 1.00 8.38 N ATOM 1500 N GLY A 192 32.617 50.399 10.360 1.00 11.90 N ATOM 1501 CA GLY A 192 32.539 49.155 9.618 1.00 14.54 C ATOM 1502 C GLY A 192 32.268 47.944 10.448 1.00 20.70 C ATOM 1503 O GLY A 192 32.897 46.917 10.171 1.00 27.18 O ATOM 1504 N THR A 193 31.433 48.077 11.437 1.00 18.72 N ATOM 1505 CA THR A 193 31.051 47.006 12.338 1.00 35.12 C ATOM 1506 C THR A 193 29.639 46.520 12.015 1.00 44.69 C ATOM 1507 O THR A 193 29.225 45.616 12.767 1.00 41.48 O ATOM 1508 CB THR A 193 31.086 47.462 13.810 1.00 22.08 C ATOM 1509 OG1 THR A 193 30.079 48.475 13.863 1.00 28.58 O ATOM 1510 CG2 THR A 193 32.418 47.990 14.204 1.00 60.77 C ATOM 1511 N GLY A 194 28.979 47.094 11.026 1.00 27.98 N ATOM 1512 CA GLY A 194 27.618 46.633 10.677 1.00 29.77 C ATOM 1513 C GLY A 194 26.527 47.239 11.519 1.00 17.06 C ATOM 1514 O GLY A 194 25.313 47.059 11.224 1.00 34.07 O ATOM 1515 N ASN A 195 26.855 47.985 12.550 1.00 19.30 N ATOM 1516 CA ASN A 195 25.917 48.760 13.389 1.00 34.76 C ATOM 1517 C ASN A 195 25.405 49.972 12.567 1.00 26.37 C ATOM 1518 O ASN A 195 26.217 50.796 12.113 1.00 22.84 O ATOM 1519 CB ASN A 195 26.586 49.326 14.663 1.00 28.57 C ATOM 1520 CG ASN A 195 25.552 49.914 15.586 1.00 31.78 C ATOM 1521 OD1 ASN A 195 24.360 49.975 15.347 1.00 38.47 O ATOM 1522 ND2 ASN A 195 25.991 50.408 16.801 1.00 41.43 N ATOM 1523 N SER A 196 24.084 50.040 12.383 1.00 35.18 N ATOM 1524 CA SER A 196 23.339 51.050 11.668 1.00 28.16 C ATOM 1525 C SER A 196 23.245 52.451 12.237 1.00 9.92 C ATOM 1526 O SER A 196 23.175 53.468 11.489 1.00 15.55 O ATOM 1527 CB SER A 196 21.875 50.524 11.562 1.00 23.53 C ATOM 1528 OG SER A 196 21.732 50.379 10.135 1.00 56.88 O ATOM 1529 N TYR A 197 23.196 52.511 13.590 1.00 18.49 N ATOM 1530 CA TYR A 197 23.266 53.747 14.322 1.00 12.50 C ATOM 1531 C TYR A 197 24.660 54.351 14.182 1.00 7.70 C ATOM 1532 O TYR A 197 24.771 55.567 14.425 1.00 15.82 O ATOM 1533 CB TYR A 197 23.068 53.578 15.869 1.00 15.51 C ATOM 1534 CG TYR A 197 21.739 52.818 16.007 1.00 24.35 C ATOM 1535 CD1 TYR A 197 20.569 53.468 15.589 1.00 33.32 C ATOM 1536 CD2 TYR A 197 21.720 51.555 16.518 1.00 40.48 C ATOM 1537 CE1 TYR A 197 19.306 52.744 15.720 1.00 69.11 C ATOM 1538 CE2 TYR A 197 20.489 50.839 16.653 1.00 64.52 C ATOM 1539 CZ TYR A 197 19.317 51.485 16.235 1.00 66.71 C ATOM 1540 OH TYR A 197 18.138 50.767 16.376 1.00 63.31 O ATOM 1541 N GLY A 198 25.664 53.469 14.041 1.00 9.30 N ATOM 1542 CA GLY A 198 27.077 53.902 14.048 1.00 8.58 C ATOM 1543 C GLY A 198 27.476 53.892 15.542 1.00 5.85 C ATOM 1544 O GLY A 198 26.602 53.807 16.396 1.00 8.60 O ATOM 1545 N VAL A 199 28.773 53.803 15.789 1.00 10.64 N ATOM 1546 CA VAL A 199 29.274 53.809 17.165 1.00 14.56 C ATOM 1547 C VAL A 199 28.976 55.183 17.760 1.00 9.54 C ATOM 1548 O VAL A 199 29.154 56.186 17.096 1.00 6.88 O ATOM 1549 CB VAL A 199 30.645 53.244 17.497 1.00 26.90 C ATOM 1550 CG1 VAL A 199 31.229 52.233 16.524 1.00 19.16 C ATOM 1551 CG2 VAL A 199 31.721 54.117 18.175 1.00 29.21 C ATOM 1552 N CYS A 200 28.374 55.113 18.979 1.00 10.58 N ATOM 1553 CA CYS A 200 27.837 56.280 19.688 1.00 21.27 C ATOM 1554 C CYS A 200 26.785 57.098 18.868 1.00 14.61 C ATOM 1555 O CYS A 200 26.503 58.249 19.269 1.00 8.71 O ATOM 1556 CB CYS A 200 28.815 57.278 20.254 1.00 11.62 C ATOM 1557 SG CYS A 200 30.292 56.461 20.977 1.00 14.45 S ATOM 1558 N GLY A 201 26.021 56.373 18.084 1.00 10.36 N ATOM 1559 CA GLY A 201 24.981 56.757 17.258 1.00 10.61 C ATOM 1560 C GLY A 201 25.400 57.762 16.148 1.00 13.07 C ATOM 1561 O GLY A 201 24.644 58.722 15.885 1.00 11.36 O ATOM 1562 N LEU A 202 26.602 57.633 15.648 1.00 11.57 N ATOM 1563 CA LEU A 202 27.215 58.588 14.723 1.00 11.53 C ATOM 1564 C LEU A 202 26.429 58.722 13.432 1.00 7.04 C ATOM 1565 O LEU A 202 26.655 59.807 12.765 1.00 8.52 O ATOM 1566 CB LEU A 202 28.652 58.013 14.446 1.00 6.89 C ATOM 1567 CG LEU A 202 29.582 58.770 13.522 1.00 21.63 C ATOM 1568 CD1 LEU A 202 29.781 60.188 14.059 1.00 14.91 C ATOM 1569 CD2 LEU A 202 30.890 57.977 13.473 1.00 17.51 C ATOM 1570 N TYR A 203 25.582 57.731 13.070 1.00 8.08 N ATOM 1571 CA TYR A 203 24.880 57.906 11.730 1.00 3.81 C ATOM 1572 C TYR A 203 23.461 58.388 11.852 1.00 9.05 C ATOM 1573 O TYR A 203 22.662 58.386 10.925 1.00 12.06 O ATOM 1574 CB TYR A 203 24.976 56.639 10.890 1.00 7.97 C ATOM 1575 CG TYR A 203 26.369 55.994 10.844 1.00 11.41 C ATOM 1576 CD1 TYR A 203 26.435 54.596 10.766 1.00 13.98 C ATOM 1577 CD2 TYR A 203 27.505 56.759 10.893 1.00 11.58 C ATOM 1578 CE1 TYR A 203 27.760 53.995 10.743 1.00 6.79 C ATOM 1579 CE2 TYR A 203 28.804 56.181 10.864 1.00 13.60 C ATOM 1580 CZ TYR A 203 28.848 54.768 10.784 1.00 12.05 C ATOM 1581 OH TYR A 203 30.073 54.167 10.755 1.00 13.01 O ATOM 1582 N THR A 204 23.156 59.111 12.958 1.00 8.20 N ATOM 1583 CA THR A 204 21.867 59.583 13.356 1.00 12.86 C ATOM 1584 C THR A 204 21.422 60.825 12.543 1.00 10.78 C ATOM 1585 O THR A 204 20.281 60.804 12.034 1.00 13.89 O ATOM 1586 CB THR A 204 21.745 59.917 14.873 1.00 16.89 C ATOM 1587 OG1 THR A 204 21.904 58.619 15.519 1.00 10.19 O ATOM 1588 CG2 THR A 204 20.365 60.442 15.125 1.00 13.09 C ATOM 1589 N SER A 205 22.273 61.831 12.534 1.00 9.02 N ATOM 1590 CA SER A 205 21.817 63.072 11.873 1.00 9.35 C ATOM 1591 C SER A 205 23.003 63.851 11.364 1.00 10.74 C ATOM 1592 O SER A 205 23.602 64.520 12.212 1.00 15.05 O ATOM 1593 CB SER A 205 21.056 63.794 12.930 1.00 10.36 C ATOM 1594 OG SER A 205 20.346 64.909 12.363 1.00 21.42 O ATOM 1595 N SER A 206 23.153 63.835 9.998 1.00 9.29 N ATOM 1596 CA SER A 206 24.352 64.460 9.397 1.00 6.11 C ATOM 1597 C SER A 206 23.945 65.355 8.229 1.00 9.40 C ATOM 1598 O SER A 206 23.015 65.046 7.507 1.00 11.53 O ATOM 1599 CB SER A 206 25.198 63.311 8.873 1.00 14.42 C ATOM 1600 OG SER A 206 25.454 62.386 9.953 1.00 15.28 O ATOM 1601 N PHE A 207 24.509 66.563 8.253 1.00 12.21 N ATOM 1602 CA PHE A 207 24.153 67.659 7.315 1.00 12.69 C ATOM 1603 C PHE A 207 25.478 68.253 6.805 1.00 17.20 C ATOM 1604 O PHE A 207 26.493 68.224 7.498 1.00 7.36 O ATOM 1605 CB PHE A 207 23.393 68.805 8.009 1.00 4.05 C ATOM 1606 CG PHE A 207 21.990 68.468 8.383 1.00 9.23 C ATOM 1607 CD1 PHE A 207 21.789 67.977 9.642 1.00 14.65 C ATOM 1608 CD2 PHE A 207 20.947 68.634 7.489 1.00 6.40 C ATOM 1609 CE1 PHE A 207 20.480 67.609 10.097 1.00 13.72 C ATOM 1610 CE2 PHE A 207 19.646 68.257 7.958 1.00 10.92 C ATOM 1611 CZ PHE A 207 19.464 67.772 9.220 1.00 11.64 C ATOM 1612 N TYR A 208 25.330 69.071 5.703 1.00 14.34 N ATOM 1613 CA TYR A 208 26.470 69.820 5.148 1.00 13.30 C ATOM 1614 C TYR A 208 25.836 70.917 4.248 1.00 1.98 C ATOM 1615 O TYR A 208 24.734 70.752 3.705 1.00 11.32 O ATOM 1616 CB TYR A 208 27.448 68.949 4.350 1.00 10.88 C ATOM 1617 CG TYR A 208 26.693 68.257 3.228 1.00 9.23 C ATOM 1618 CD1 TYR A 208 26.126 66.986 3.500 1.00 9.93 C ATOM 1619 CD2 TYR A 208 26.538 68.842 1.973 1.00 15.69 C ATOM 1620 CE1 TYR A 208 25.399 66.271 2.498 1.00 13.81 C ATOM 1621 CE2 TYR A 208 25.813 68.156 0.949 1.00 15.44 C ATOM 1622 CZ TYR A 208 25.281 66.894 1.277 1.00 16.66 C ATOM 1623 OH TYR A 208 24.590 66.220 0.324 1.00 16.44 O ATOM 1624 N PRO A 209 26.548 71.994 4.211 1.00 11.41 N ATOM 1625 CA PRO A 209 26.235 73.149 3.357 1.00 12.36 C ATOM 1626 C PRO A 209 26.528 72.799 1.898 1.00 10.68 C ATOM 1627 O PRO A 209 27.422 72.020 1.563 1.00 15.21 O ATOM 1628 CB PRO A 209 27.185 74.190 3.924 1.00 10.16 C ATOM 1629 CG PRO A 209 28.423 73.482 4.414 1.00 6.99 C ATOM 1630 CD PRO A 209 27.896 72.083 4.812 1.00 6.08 C ATOM 1631 N VAL A 210 25.872 73.472 0.977 1.00 8.42 N ATOM 1632 CA VAL A 210 25.981 73.468 -0.477 1.00 9.97 C ATOM 1633 C VAL A 210 26.465 74.876 -0.859 1.00 12.89 C ATOM 1634 O VAL A 210 26.060 75.938 -0.293 1.00 10.37 O ATOM 1635 CB VAL A 210 24.525 73.172 -0.999 1.00 6.09 C ATOM 1636 CG1 VAL A 210 24.408 73.351 -2.474 1.00 31.20 C ATOM 1637 CG2 VAL A 210 24.089 71.775 -0.505 1.00 17.56 C ATOM 1638 N LYS A 211 27.472 74.879 -1.716 1.00 14.85 N ATOM 1639 CA LYS A 211 28.020 76.126 -2.248 1.00 11.73 C ATOM 1640 C LYS A 211 28.344 75.874 -3.710 1.00 26.83 C ATOM 1641 O LYS A 211 29.158 74.994 -3.976 1.00 21.43 O ATOM 1642 CB LYS A 211 29.295 76.411 -1.488 1.00 13.36 C ATOM 1643 CG LYS A 211 29.949 77.730 -1.804 1.00 16.42 C ATOM 1644 CD LYS A 211 29.014 78.901 -1.553 1.00 16.59 C ATOM 1645 CE LYS A 211 29.802 80.171 -1.869 1.00 23.46 C ATOM 1646 NZ LYS A 211 28.820 81.215 -2.231 1.00 41.82 N ATOM 1647 N ASN A 212 27.763 76.613 -4.617 1.00 20.22 N ATOM 1648 CA ASN A 212 27.901 76.625 -6.054 1.00 22.34 C ATOM 1649 C ASN A 212 29.192 77.323 -6.538 1.00 25.26 C ATOM 1650 O ASN A 212 29.586 76.876 -7.654 1.00 52.91 O ATOM 1651 CB ASN A 212 26.737 77.444 -6.755 1.00 24.69 C ATOM 1652 CG ASN A 212 25.438 76.681 -6.709 1.00 62.61 C ATOM 1653 OD1 ASN A 212 25.369 75.458 -6.623 1.00 39.30 O ATOM 1654 ND2 ASN A 212 24.266 77.441 -6.763 1.00 57.82 N ATOM 1655 OXT ASN A 212 29.688 78.197 -5.848 1.00 27.70 O TER 1656 ASN A 212 HETATM 1657 C MOH A 214 44.699 68.604 -3.792 1.00 34.21 C HETATM 1658 O MOH A 214 45.059 69.119 -2.471 1.00 28.01 O HETATM 1659 C MOH A 215 41.741 56.759 26.822 1.00 47.76 C HETATM 1660 O MOH A 215 42.225 56.578 25.467 1.00 27.75 O HETATM 1661 C MOH A 216 34.867 73.138 -6.348 1.00 45.86 C HETATM 1662 O MOH A 216 35.644 71.914 -6.142 1.00 64.58 O HETATM 1663 C MOH A 217 34.195 61.876 -4.706 1.00 62.81 C HETATM 1664 O MOH A 217 34.817 62.221 -3.449 1.00 60.39 O HETATM 1665 C MOH A 218 25.260 91.948 8.019 1.00 36.28 C HETATM 1666 O MOH A 218 25.050 92.208 6.607 1.00 44.79 O HETATM 1667 C MOH A 219 27.620 51.266 20.025 1.00 36.61 C HETATM 1668 O MOH A 219 27.215 52.633 20.226 1.00 22.41 O HETATM 1669 C MOH A 220 28.492 65.889 -1.107 1.00 42.70 C HETATM 1670 O MOH A 220 28.745 65.953 0.321 1.00 30.93 O HETATM 1671 C MOH A 221 23.198 70.041 22.119 1.00 52.42 C HETATM 1672 O MOH A 221 23.460 70.424 20.769 1.00 26.97 O HETATM 1673 C MOH A 222 40.029 48.046 16.924 1.00 36.52 C HETATM 1674 O MOH A 222 40.415 49.235 16.211 1.00 42.21 O HETATM 1675 C MOH A 223 42.166 58.615 32.003 1.00 64.31 C HETATM 1676 O MOH A 223 41.596 57.560 32.836 1.00 48.11 O HETATM 1677 C MOH A 224 18.111 67.556 2.167 1.00 49.09 C HETATM 1678 O MOH A 224 18.999 66.672 1.457 1.00 52.95 O HETATM 1679 C MOH A 225 20.775 68.325 16.309 1.00 31.98 C HETATM 1680 O MOH A 225 20.628 67.508 15.126 1.00 32.10 O HETATM 1681 C MOH A 226 33.671 94.364 31.979 1.00 60.13 C HETATM 1682 O MOH A 226 32.716 93.356 32.436 1.00 63.47 O HETATM 1683 C MOH A 227 38.991 93.870 30.417 1.00 50.36 C HETATM 1684 O MOH A 227 39.688 94.959 31.102 1.00 68.97 O HETATM 1685 C MOH A 228 36.687 52.560 26.947 1.00 42.17 C HETATM 1686 O MOH A 228 36.811 53.413 28.132 1.00 47.58 O HETATM 1687 C MOH A 229 45.257 78.339 10.320 1.00 62.03 C HETATM 1688 O MOH A 229 45.684 77.051 9.823 1.00 58.53 O HETATM 1689 C MOH A 230 34.319 78.396 30.035 1.00 55.21 C HETATM 1690 O MOH A 230 33.624 79.168 29.003 1.00 60.10 O HETATM 1691 C MOH A 231 14.959 83.304 9.897 1.00 66.92 C HETATM 1692 O MOH A 231 15.219 84.730 10.036 1.00 68.35 O HETATM 1693 C MOH A 232 33.843 71.438 27.768 1.00 61.58 C HETATM 1694 O MOH A 232 34.912 72.149 27.072 1.00 42.14 O HETATM 1695 C MOH A 233 48.026 54.930 16.696 1.00 46.55 C HETATM 1696 O MOH A 233 46.757 54.229 16.578 1.00 50.27 O HETATM 1697 C MOH A 234 19.762 73.264 29.645 1.00 61.24 C HETATM 1698 O MOH A 234 19.740 72.131 28.712 1.00 65.62 O HETATM 1699 C MOH A 235 47.830 57.691 19.039 1.00 37.49 C HETATM 1700 O MOH A 235 46.488 57.139 18.814 1.00 79.42 O HETATM 1701 C MOH A 236 23.310 66.620 -3.264 1.00 64.59 C HETATM 1702 O MOH A 236 24.631 66.909 -2.740 1.00 54.82 O HETATM 1703 C MOH A 237 36.852 83.513 0.307 1.00 41.06 C HETATM 1704 O MOH A 237 37.365 84.262 1.445 1.00 50.35 O HETATM 1705 C MOH A 238 35.451 89.161 2.550 1.00 63.00 C HETATM 1706 O MOH A 238 36.900 89.057 2.394 1.00 60.21 O HETATM 1707 C MOH A 239 31.754 69.331 -3.604 1.00 63.77 C HETATM 1708 O MOH A 239 32.006 69.574 -2.193 1.00 47.33 O HETATM 1709 C MOH A 240 19.415 51.131 8.170 1.00 63.75 C HETATM 1710 O MOH A 240 20.277 51.346 7.002 1.00 63.23 O HETATM 1711 C MOH A 241 37.945 65.506 30.187 1.00 49.26 C HETATM 1712 O MOH A 241 38.534 66.589 29.419 1.00 62.14 O HETATM 1713 C MOH A 242 35.841 81.513 33.285 1.00 51.28 C HETATM 1714 O MOH A 242 36.060 82.904 33.653 1.00 56.61 O HETATM 1715 O HOH A 243 36.842 72.392 8.126 1.00 6.65 O HETATM 1716 O HOH A 244 38.434 68.845 21.154 1.00 7.19 O HETATM 1717 O HOH A 245 34.433 75.747 14.786 1.00 8.13 O HETATM 1718 O HOH A 246 37.812 73.937 10.291 1.00 9.04 O HETATM 1719 O HOH A 247 31.589 71.080 4.139 1.00 9.10 O HETATM 1720 O HOH A 248 36.609 78.686 13.724 1.00 9.45 O HETATM 1721 O HOH A 249 36.646 75.326 13.384 1.00 9.60 O HETATM 1722 O HOH A 250 37.421 72.645 17.157 1.00 10.09 O HETATM 1723 O HOH A 251 44.497 75.974 2.649 1.00 10.12 O HETATM 1724 O HOH A 252 33.069 83.198 17.188 1.00 10.12 O HETATM 1725 O HOH A 253 25.047 62.049 12.821 1.00 10.46 O HETATM 1726 O HOH A 254 28.931 58.228 25.336 1.00 10.59 O HETATM 1727 O HOH A 255 33.457 70.590 15.666 1.00 10.81 O HETATM 1728 O HOH A 256 37.552 78.755 4.472 1.00 10.97 O HETATM 1729 O HOH A 257 44.077 72.214 7.236 1.00 11.79 O HETATM 1730 O HOH A 258 31.952 70.492 18.056 1.00 11.92 O HETATM 1731 O HOH A 259 21.006 80.216 19.857 1.00 12.18 O HETATM 1732 O HOH A 260 21.603 61.906 8.512 1.00 12.51 O HETATM 1733 O HOH A 261 24.439 58.028 7.339 1.00 13.12 O HETATM 1734 O HOH A 262 24.499 76.205 4.494 1.00 13.20 O HETATM 1735 O HOH A 263 30.976 56.953 26.112 1.00 13.50 O HETATM 1736 O HOH A 264 38.771 53.252 3.874 1.00 13.60 O HETATM 1737 O HOH A 265 46.605 74.319 23.273 1.00 14.43 O HETATM 1738 O HOH A 266 33.504 89.570 8.760 1.00 14.51 O HETATM 1739 O HOH A 267 31.599 88.686 19.980 1.00 14.87 O HETATM 1740 O HOH A 268 37.207 83.970 19.104 1.00 15.05 O HETATM 1741 O HOH A 269 30.624 53.677 13.437 1.00 15.33 O HETATM 1742 O HOH A 270 35.336 72.935 16.127 1.00 15.91 O HETATM 1743 O HOH A 271 24.133 67.386 12.347 1.00 17.46 O HETATM 1744 O HOH A 272 38.825 50.457 2.947 1.00 17.79 O HETATM 1745 O HOH A 273 22.068 80.421 26.530 1.00 18.27 O HETATM 1746 O HOH A 274 38.870 85.246 11.067 1.00 18.58 O HETATM 1747 O HOH A 275 23.975 60.139 9.128 1.00 18.70 O HETATM 1748 O HOH A 276 18.145 81.270 21.539 1.00 19.48 O HETATM 1749 O HOH A 277 43.256 71.148 13.493 1.00 19.66 O HETATM 1750 O HOH A 278 22.816 60.693 1.496 1.00 19.89 O HETATM 1751 O HOH A 279 37.498 52.620 22.844 1.00 20.19 O HETATM 1752 O HOH A 280 23.166 61.231 26.187 1.00 20.83 O HETATM 1753 O HOH A 281 28.090 72.320 -2.729 1.00 21.57 O HETATM 1754 O HOH A 282 21.737 67.353 13.423 1.00 21.90 O HETATM 1755 O HOH A 283 29.746 50.888 12.546 1.00 22.18 O HETATM 1756 O HOH A 284 27.166 67.817 24.664 1.00 24.02 O HETATM 1757 O HOH A 285 29.966 69.723 25.413 1.00 24.36 O HETATM 1758 O HOH A 286 31.995 91.336 19.026 1.00 24.42 O HETATM 1759 O HOH A 287 34.898 84.466 2.999 1.00 24.54 O HETATM 1760 O HOH A 288 29.646 55.896 30.880 1.00 24.54 O HETATM 1761 O HOH A 289 40.847 49.072 2.204 1.00 25.15 O HETATM 1762 O HOH A 290 25.230 51.228 7.325 1.00 26.57 O HETATM 1763 O HOH A 291 41.083 76.023 26.095 1.00 26.99 O HETATM 1764 O HOH A 292 42.468 79.839 15.897 1.00 27.20 O HETATM 1765 O HOH A 293 18.623 85.258 0.707 1.00 27.71 O HETATM 1766 O HOH A 294 23.114 86.965 11.067 1.00 28.04 O HETATM 1767 O HOH A 295 27.919 70.249 -1.589 1.00 28.05 O HETATM 1768 O HOH A 296 18.844 85.574 24.589 1.00 28.14 O HETATM 1769 O HOH A 297 19.069 89.612 19.126 1.00 28.46 O HETATM 1770 O HOH A 298 19.981 82.653 27.102 1.00 28.49 O HETATM 1771 O HOH A 299 25.359 52.105 19.036 1.00 29.39 O HETATM 1772 O HOH A 300 39.589 84.315 8.693 1.00 30.55 O HETATM 1773 O HOH A 301 44.785 72.973 16.741 1.00 30.69 O HETATM 1774 O HOH A 302 42.209 60.024 8.014 1.00 30.76 O HETATM 1775 O HOH A 303 44.962 70.210 16.933 1.00 30.95 O HETATM 1776 O HOH A 304 20.402 74.319 -2.764 1.00 31.93 O HETATM 1777 O HOH A 305 26.294 51.171 4.195 1.00 32.65 O HETATM 1778 O HOH A 306 45.269 64.499 15.603 1.00 33.12 O HETATM 1779 O HOH A 307 40.276 82.347 16.247 1.00 33.41 O HETATM 1780 O HOH A 308 23.896 84.727 10.293 1.00 33.48 O HETATM 1781 O HOH A 309 34.799 81.049 26.389 1.00 33.56 O HETATM 1782 O HOH A 310 39.736 77.812 22.056 1.00 33.80 O HETATM 1783 O HOH A 311 46.390 66.377 23.497 1.00 34.01 O HETATM 1784 O HOH A 312 44.679 62.052 14.731 1.00 35.17 O HETATM 1785 O HOH A 313 44.043 57.112 -0.317 1.00 35.46 O HETATM 1786 O HOH A 314 29.379 83.399 -0.333 1.00 35.96 O HETATM 1787 O HOH A 315 42.435 61.431 0.585 1.00 36.39 O HETATM 1788 O HOH A 316 32.511 86.208 28.163 1.00 36.59 O HETATM 1789 O HOH A 317 19.492 81.666 29.049 1.00 36.71 O HETATM 1790 O HOH A 318 43.750 52.791 11.130 1.00 36.91 O HETATM 1791 O HOH A 319 47.848 75.821 21.272 1.00 37.12 O HETATM 1792 O HOH A 320 40.763 50.616 20.202 1.00 37.29 O HETATM 1793 O HOH A 321 38.267 63.245 -1.709 1.00 37.35 O HETATM 1794 O HOH A 322 31.309 82.731 0.029 1.00 37.78 O HETATM 1795 O HOH A 323 25.967 91.566 3.282 1.00 38.45 O HETATM 1796 O HOH A 324 41.767 47.635 4.658 1.00 38.78 O HETATM 1797 O HOH A 325 43.387 52.381 18.897 1.00 39.56 O HETATM 1798 O HOH A 326 44.576 60.621 8.455 1.00 39.57 O HETATM 1799 O HOH A 327 38.092 56.307 27.178 1.00 39.58 O HETATM 1800 O HOH A 328 16.628 71.658 -2.056 1.00 40.07 O HETATM 1801 O HOH A 329 37.140 79.200 20.963 1.00 40.44 O HETATM 1802 O HOH A 330 28.856 49.632 9.456 1.00 40.64 O HETATM 1803 O HOH A 331 26.938 63.197 -0.551 1.00 41.05 O HETATM 1804 O HOH A 332 17.727 65.126 12.082 1.00 41.15 O HETATM 1805 O HOH A 333 45.113 57.330 33.794 1.00 41.20 O HETATM 1806 O HOH A 334 44.431 71.510 11.028 1.00 41.71 O HETATM 1807 O HOH A 335 28.444 80.599 29.467 1.00 42.30 O HETATM 1808 O HOH A 336 17.355 70.020 1.728 1.00 42.73 O HETATM 1809 O HOH A 337 18.557 51.521 12.566 1.00 42.95 O HETATM 1810 O HOH A 338 47.534 57.935 23.389 1.00 43.63 O HETATM 1811 O HOH A 339 27.527 66.302 26.027 1.00 43.86 O HETATM 1812 O HOH A 340 33.678 90.589 6.033 1.00 44.01 O HETATM 1813 O HOH A 341 24.501 88.400 0.443 1.00 44.05 O HETATM 1814 O HOH A 342 30.491 72.092 27.521 1.00 44.18 O HETATM 1815 O HOH A 343 36.865 78.939 25.385 1.00 44.34 O HETATM 1816 O HOH A 344 24.560 71.074 25.182 1.00 44.59 O HETATM 1817 O HOH A 345 28.715 49.356 17.340 1.00 44.64 O HETATM 1818 O HOH A 346 42.572 78.134 18.520 1.00 44.77 O HETATM 1819 O HOH A 347 16.371 82.809 13.878 1.00 45.48 O HETATM 1820 O HOH A 348 44.210 63.898 26.004 1.00 45.52 O HETATM 1821 O HOH A 349 40.107 46.981 6.414 1.00 45.62 O HETATM 1822 O HOH A 350 17.674 62.205 3.760 1.00 45.79 O HETATM 1823 O HOH A 351 35.194 67.839 -3.629 1.00 45.85 O HETATM 1824 O HOH A 352 19.308 95.427 15.470 1.00 45.96 O HETATM 1825 O HOH A 353 19.140 54.446 5.449 1.00 45.96 O HETATM 1826 O HOH A 354 17.028 67.427 14.560 1.00 46.02 O HETATM 1827 O HOH A 355 25.427 82.970 -2.081 1.00 46.42 O HETATM 1828 O HOH A 356 40.220 63.379 -0.351 1.00 47.40 O HETATM 1829 O HOH A 357 32.647 83.010 29.057 1.00 47.40 O HETATM 1830 O HOH A 358 44.525 74.772 18.810 1.00 47.70 O HETATM 1831 O HOH A 359 25.344 61.337 0.663 1.00 47.87 O HETATM 1832 O HOH A 360 19.840 87.098 11.281 1.00 47.88 O HETATM 1833 O HOH A 361 28.717 64.541 -4.827 1.00 48.06 O HETATM 1834 O HOH A 362 16.450 60.622 15.899 1.00 48.15 O HETATM 1835 O HOH A 363 18.829 60.963 21.591 1.00 48.67 O HETATM 1836 O HOH A 364 45.789 66.469 25.743 1.00 48.76 O HETATM 1837 O HOH A 365 17.128 61.472 12.187 1.00 49.11 O HETATM 1838 O HOH A 366 21.192 46.958 11.771 1.00 49.78 O HETATM 1839 O HOH A 367 21.569 54.084 23.793 1.00 50.39 O HETATM 1840 O HOH A 368 25.436 49.812 22.004 1.00 50.46 O HETATM 1841 O HOH A 369 42.870 80.343 8.860 1.00 50.73 O HETATM 1842 O HOH A 370 17.197 66.641 17.484 1.00 50.99 O HETATM 1843 O HOH A 371 23.631 49.977 19.080 1.00 51.32 O HETATM 1844 O HOH A 372 20.879 90.149 9.251 1.00 51.38 O HETATM 1845 O HOH A 373 30.353 44.544 15.300 1.00 51.38 O HETATM 1846 O HOH A 374 20.213 54.596 21.505 1.00 51.53 O HETATM 1847 O HOH A 375 14.856 81.334 21.665 1.00 51.59 O HETATM 1848 O HOH A 376 18.088 86.931 14.957 1.00 52.05 O HETATM 1849 O HOH A 377 21.911 67.159 19.224 1.00 52.25 O HETATM 1850 O HOH A 378 18.693 94.520 13.115 1.00 52.56 O HETATM 1851 O HOH A 379 44.865 74.541 10.498 1.00 52.74 O HETATM 1852 O HOH A 380 22.650 63.877 0.401 1.00 52.75 O HETATM 1853 O HOH A 381 41.204 67.461 28.868 1.00 53.30 O HETATM 1854 O HOH A 382 46.883 73.365 13.948 1.00 53.73 O HETATM 1855 O HOH A 383 40.403 48.226 13.525 1.00 54.14 O HETATM 1856 O HOH A 384 40.216 84.932 6.176 1.00 54.61 O HETATM 1857 O HOH A 385 25.459 65.054 30.083 1.00 54.76 O HETATM 1858 O HOH A 386 22.538 51.451 22.249 1.00 55.49 O HETATM 1859 O HOH A 387 30.047 54.724 -0.664 1.00 56.22 O HETATM 1860 O HOH A 388 29.120 68.621 -3.252 1.00 57.19 O HETATM 1861 O HOH A 389 46.754 55.070 22.123 1.00 57.24 O HETATM 1862 O HOH A 390 30.667 49.626 5.290 1.00 57.72 O HETATM 1863 O HOH A 391 33.374 83.593 -0.541 1.00 57.94 O HETATM 1864 O HOH A 392 47.679 63.607 16.812 1.00 57.96 O HETATM 1865 O HOH A 393 28.955 74.050 -8.632 1.00 58.14 O HETATM 1866 O HOH A 394 28.620 82.682 -6.076 1.00 58.90 O HETATM 1867 O HOH A 395 26.869 72.722 -5.151 1.00 59.08 O HETATM 1868 O HOH A 396 19.982 56.625 17.138 1.00 59.11 O HETATM 1869 O HOH A 397 18.390 57.481 18.602 1.00 59.44 O HETATM 1870 O HOH A 398 24.501 81.771 -6.529 1.00 59.58 O HETATM 1871 O HOH A 399 33.652 91.070 22.619 1.00 59.73 O HETATM 1872 O HOH A 400 40.484 80.971 20.069 1.00 59.90 O HETATM 1873 O HOH A 401 27.159 70.943 26.162 1.00 60.15 O HETATM 1874 O HOH A 402 27.366 80.144 -4.579 1.00 60.20 O HETATM 1875 O HOH A 403 16.664 60.325 -5.628 1.00 60.35 O HETATM 1876 O HOH A 404 47.285 53.826 19.110 1.00 60.39 O HETATM 1877 O HOH A 405 17.730 63.634 15.691 1.00 60.42 O HETATM 1878 O HOH A 406 37.576 58.559 -6.321 1.00 60.55 O HETATM 1879 O HOH A 407 31.782 88.618 27.091 1.00 60.59 O HETATM 1880 O HOH A 408 39.395 88.847 9.809 1.00 60.89 O HETATM 1881 O HOH A 409 47.841 71.188 5.499 1.00 61.31 O HETATM 1882 O HOH A 410 18.507 47.705 11.233 1.00 61.35 O HETATM 1883 O HOH A 411 40.147 83.917 12.796 1.00 61.45 O HETATM 1884 O HOH A 412 27.438 62.269 31.951 1.00 61.49 O HETATM 1885 O HOH A 413 37.827 53.667 -4.559 1.00 61.93 O HETATM 1886 O HOH A 414 14.678 79.135 21.154 1.00 62.12 O HETATM 1887 O HOH A 415 24.672 77.658 29.819 1.00 62.22 O HETATM 1888 O HOH A 416 16.946 67.174 -2.337 1.00 62.47 O HETATM 1889 O HOH A 417 18.786 87.296 18.138 1.00 62.94 O HETATM 1890 O HOH A 418 48.315 59.334 27.592 1.00 62.96 O HETATM 1891 O HOH A 419 32.999 96.433 -2.613 1.00 62.97 O HETATM 1892 O HOH A 420 40.046 87.054 7.922 1.00 63.67 O HETATM 1893 O HOH A 421 39.645 44.869 10.066 1.00 64.06 O HETATM 1894 O HOH A 422 19.730 47.679 14.340 1.00 64.17 O HETATM 1895 O HOH A 423 31.114 95.411 17.172 1.00 64.19 O HETATM 1896 O HOH A 424 45.044 60.757 11.274 1.00 64.26 O HETATM 1897 O HOH A 425 29.855 94.345 18.956 1.00 64.30 O HETATM 1898 O HOH A 426 32.173 74.846 -7.205 1.00 64.68 O HETATM 1899 O HOH A 427 19.249 96.880 12.875 1.00 65.08 O HETATM 1900 O HOH A 428 34.742 44.875 12.689 1.00 65.13 O HETATM 1901 O HOH A 429 14.839 52.068 14.669 1.00 65.82 O HETATM 1902 O HOH A 430 44.783 80.090 19.276 1.00 66.35 O HETATM 1903 O HOH A 431 43.397 45.432 4.821 1.00 66.61 O HETATM 1904 O HOH A 432 22.915 91.201 3.531 1.00 67.13 O HETATM 1905 O HOH A 433 20.029 65.286 24.267 1.00 67.41 O HETATM 1906 O HOH A 434 12.633 50.226 17.422 1.00 68.01 O HETATM 1907 O HOH A 435 39.743 78.260 24.711 1.00 68.69 O HETATM 1908 O HOH A 436 39.376 61.000 -4.843 1.00 69.00 O HETATM 1909 O HOH A 437 32.824 98.004 15.869 1.00 76.84 O CONECT 173 496 CONECT 180 184 CONECT 184 180 185 CONECT 185 184 186 188 CONECT 186 185 187 CONECT 187 186 190 191 192 CONECT 188 185 189 193 CONECT 189 188 CONECT 190 187 CONECT 191 187 CONECT 192 187 CONECT 193 188 CONECT 438 763 CONECT 496 173 CONECT 763 438 CONECT 1203 1557 CONECT 1557 1203 CONECT 1657 1658 CONECT 1658 1657 CONECT 1659 1660 CONECT 1660 1659 CONECT 1661 1662 CONECT 1662 1661 CONECT 1663 1664 CONECT 1664 1663 CONECT 1665 1666 CONECT 1666 1665 CONECT 1667 1668 CONECT 1668 1667 CONECT 1669 1670 CONECT 1670 1669 CONECT 1671 1672 CONECT 1672 1671 CONECT 1673 1674 CONECT 1674 1673 CONECT 1675 1676 CONECT 1676 1675 CONECT 1677 1678 CONECT 1678 1677 CONECT 1679 1680 CONECT 1680 1679 CONECT 1681 1682 CONECT 1682 1681 CONECT 1683 1684 CONECT 1684 1683 CONECT 1685 1686 CONECT 1686 1685 CONECT 1687 1688 CONECT 1688 1687 CONECT 1689 1690 CONECT 1690 1689 CONECT 1691 1692 CONECT 1692 1691 CONECT 1693 1694 CONECT 1694 1693 CONECT 1695 1696 CONECT 1696 1695 CONECT 1697 1698 CONECT 1698 1697 CONECT 1699 1700 CONECT 1700 1699 CONECT 1701 1702 CONECT 1702 1701 CONECT 1703 1704 CONECT 1704 1703 CONECT 1705 1706 CONECT 1706 1705 CONECT 1707 1708 CONECT 1708 1707 CONECT 1709 1710 CONECT 1710 1709 CONECT 1711 1712 CONECT 1712 1711 CONECT 1713 1714 CONECT 1714 1713 MASTER 507 0 30 5 8 0 32 6 1908 1 75 17 END If you find results from this site helpful for your research, please cite one of our papers:
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