USER MOD reduce.3.24.130724 H: found=0, std=0, add=1555, rem=0, adj=45 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER OXIDOREDUCTASE 04-NOV-97 1HFQ TITLE COMPARISON OF TERNARY CRYSTAL COMPLEXES OF HUMAN DIHYDROFOLATE TITLE 2 REDUCTASE WITH NADPH AND A CLASSICAL ANTITUMOR FUROPYRIMDINE COMPND MOL_ID: 1; COMPND 2 MOLECULE: DIHYDROFOLATE REDUCTASE; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: DHFR; COMPND 5 EC: 1.5.1.3; COMPND 6 ENGINEERED: YES; COMPND 7 MUTATION: YES; COMPND 8 OTHER_DETAILS: COMPLEXED WITH NADPH AND FURO[2,3D]FUROPYRIMIDINE SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: POTENTIAL; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: JM107, F31S MUTANT KEYWDS OXIDOREDUCTASE, ONE-CARBON METABOLISM EXPDTA X-RAY DIFFRACTION AUTHOR V.CODY,N.GALITSKY,J.R.LUFT,W.PANGBORN,R.L.BLAKLEY,A.GANGJEE REVDAT 3 11-DEC-13 1HFQ 1 HET HETATM HETNAM REMARK REVDAT 3 2 1 VERSN REVDAT 2 24-FEB-09 1HFQ 1 VERSN REVDAT 1 28-JAN-98 1HFQ 0 JRNL AUTH V.CODY,N.GALITSKY,J.R.LUFT,W.PANGBORN,R.L.BLAKLEY,A.GANGJEE JRNL TITL COMPARISON OF TERNARY CRYSTAL COMPLEXES OF F31 VARIANTS OF JRNL TITL 2 HUMAN DIHYDROFOLATE REDUCTASE WITH NADPH AND A CLASSICAL JRNL TITL 3 ANTITUMOR FUROPYRIMIDINE. JRNL REF ANTI-CANCER DRUG DES. V. 13 307 1998 JRNL REFN ISSN 0266-9536 JRNL PMID 9627670 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH V.CODY,N.GALITSKY,J.R.LUFT,W.PANGBORN,A.GANGJEE,R.DEVRAJ, REMARK 1 AUTH 2 S.F.QUEENER,R.L.BLAKLEY REMARK 1 TITL COMPARISON OF TERNARY COMPLEXES OF PNEUMOCYSTIS CARINII AND REMARK 1 TITL 2 WILD-TYPE HUMAN DIHYDROFOLATE REDUCTASE WITH A NOVEL REMARK 1 TITL 3 CLASSICAL ANTITUMOR FURO[2,3-D]PYRIMIDINE ANTIFOLATE REMARK 1 REF ACTA CRYSTALLOGR.,SECT.D V. 53 638 1997 REMARK 1 REFN ISSN 0907-4449 REMARK 1 REFERENCE 2 REMARK 1 AUTH W.S.LEWIS,V.CODY,N.GALITSKY,J.R.LUFT,W.PANGBORN, REMARK 1 AUTH 2 S.K.CHUNDURU,H.T.SPENCER,J.R.APPLEMAN,R.L.BLAKLEY REMARK 1 TITL METHOTREXATE-RESISTANT VARIANTS OF HUMAN DIHYDROFOLATE REMARK 1 TITL 2 REDUCTASE WITH SUBSTITUTIONS OF LEUCINE 22. KINETICS, REMARK 1 TITL 3 CRYSTALLOGRAPHY, AND POTENTIAL AS SELECTABLE MARKERS REMARK 1 REF J.BIOL.CHEM. V. 270 5057 1995 REMARK 1 REFN ISSN 0021-9258 REMARK 1 REFERENCE 3 REMARK 1 AUTH S.K.CHUNDURU,V.CODY,J.R.LUFT,W.PANGBORN,J.R.APPLEMAN, REMARK 1 AUTH 2 R.L.BLAKLEY REMARK 1 TITL METHOTREXATE-RESISTANT VARIANTS OF HUMAN DIHYDROFOLATE REMARK 1 TITL 2 REDUCTASE. EFFECTS OF PHE31 SUBSTITUTIONS REMARK 1 REF J.BIOL.CHEM. V. 269 9547 1994 REMARK 1 REFN ISSN 0021-9258 REMARK 1 REFERENCE 4 REMARK 1 AUTH V.CODY,J.R.LUFT,E.CISZAK,T.I.KALMAN,J.H.FREISHEIM REMARK 1 TITL CRYSTAL STRUCTURE DETERMINATION AT 2.3 A OF RECOMBINANT REMARK 1 TITL 2 HUMAN DIHYDROFOLATE REDUCTASE TERNARY COMPLEX WITH NADPH AND REMARK 1 TITL 3 METHOTREXATE-GAMMA-TETRAZOLE REMARK 1 REF ANTI-CANCER DRUG DES. V. 7 483 1992 REMARK 1 REFN ISSN 0266-9536 REMARK 2 REMARK 2 RESOLUTION. 2.10 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PROFFT REMARK 3 AUTHORS : KONNERT,HENDRICKSON,FINZEL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.10 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) : NULL REMARK 3 R VALUE (WORKING SET) : 0.175 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) : 0.1750 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 : 1497 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 80 REMARK 3 SOLVENT ATOMS : 51 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 30.42 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) : 0.025 ; 0.020 REMARK 3 ANGLE DISTANCE (A) : 0.058 ; 0.040 REMARK 3 INTRAPLANAR 1-4 DISTANCE (A) : 0.062 ; 0.050 REMARK 3 H-BOND OR METAL COORDINATION (A) : NULL ; NULL REMARK 3 REMARK 3 PLANE RESTRAINT (A) : 0.021 ; 0.020 REMARK 3 CHIRAL-CENTER RESTRAINT (A**3) : 0.218 ; 0.150 REMARK 3 REMARK 3 NON-BONDED CONTACT RESTRAINTS. REMARK 3 SINGLE TORSION (A) : 0.197 ; 0.500 REMARK 3 MULTIPLE TORSION (A) : 0.277 ; 0.500 REMARK 3 H-BOND (X...Y) (A) : 0.224 ; 0.500 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) : 3.600 ; 3.000 REMARK 3 STAGGERED (DEGREES) : 18.400; 15.000 REMARK 3 TRANSVERSE (DEGREES) : 21.600; 20.000 REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : 1.539 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 2.003 ; 1.500 REMARK 3 SIDE-CHAIN BOND (A**2) : 1.609 ; 1.000 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 2.399 ; 1.500 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1HFQ COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 10-MAY-93 REMARK 200 TEMPERATURE (KELVIN) : NULL REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : NULL REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N 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) : 1.5418 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : RIGAKU REMARK 200 INTENSITY-INTEGRATION SOFTWARE : R-AXIS II REMARK 200 DATA SCALING SOFTWARE : NULL REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 13350 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.900 REMARK 200 RESOLUTION RANGE LOW (A) : 8.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 2.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 78.0 REMARK 200 DATA REDUNDANCY : 3.090 REMARK 200 R MERGE (I) : 0.04100 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 (%): 48.00 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.54 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: NULL REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: H 3 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z REMARK 290 3555 -X+Y,-X,Z REMARK 290 4555 X+2/3,Y+1/3,Z+1/3 REMARK 290 5555 -Y+2/3,X-Y+1/3,Z+1/3 REMARK 290 6555 -X+Y+2/3,-X+1/3,Z+1/3 REMARK 290 7555 X+1/3,Y+2/3,Z+2/3 REMARK 290 8555 -Y+1/3,X-Y+2/3,Z+2/3 REMARK 290 9555 -X+Y+1/3,-X+2/3,Z+2/3 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 43.56000 REMARK 290 SMTRY2 4 0.000000 1.000000 0.000000 25.14938 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 25.67133 REMARK 290 SMTRY1 5 -0.500000 -0.866025 0.000000 43.56000 REMARK 290 SMTRY2 5 0.866025 -0.500000 0.000000 25.14938 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 25.67133 REMARK 290 SMTRY1 6 -0.500000 0.866025 0.000000 43.56000 REMARK 290 SMTRY2 6 -0.866025 -0.500000 0.000000 25.14938 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 25.67133 REMARK 290 SMTRY1 7 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 7 0.000000 1.000000 0.000000 50.29876 REMARK 290 SMTRY3 7 0.000000 0.000000 1.000000 51.34267 REMARK 290 SMTRY1 8 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 8 0.866025 -0.500000 0.000000 50.29876 REMARK 290 SMTRY3 8 0.000000 0.000000 1.000000 51.34267 REMARK 290 SMTRY1 9 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 9 -0.866025 -0.500000 0.000000 50.29876 REMARK 290 SMTRY3 9 0.000000 0.000000 1.000000 51.34267 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: 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 OG SER A 42 OD2 ASP A 110 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 ALA A 9 C ALA A 9 O 0.161 REMARK 500 ILE A 16 CB ILE A 16 CG1 0.173 REMARK 500 SER A 31 CA SER A 31 CB 0.117 REMARK 500 PHE A 34 N PHE A 34 CA 0.138 REMARK 500 SER A 59 CB SER A 59 OG -0.079 REMARK 500 ARG A 91 CZ ARG A 91 NH1 0.097 REMARK 500 ARG A 91 CZ ARG A 91 NH2 0.089 REMARK 500 SER A 119 CB SER A 119 OG 0.196 REMARK 500 TYR A 121 CD1 TYR A 121 CE1 0.103 REMARK 500 PHE A 134 CG PHE A 134 CD2 0.101 REMARK 500 THR A 136 C THR A 136 O 0.117 REMARK 500 GLU A 172 CD GLU A 172 OE2 0.084 REMARK 500 GLU A 183 CD GLU A 183 OE2 -0.088 REMARK 500 ASN A 185 CG ASN A 185 OD1 0.133 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 CYS A 6 N - CA - CB ANGL. DEV. = 12.7 DEGREES REMARK 500 ALA A 9 N - CA - CB ANGL. DEV. = 8.9 DEGREES REMARK 500 VAL A 10 CG1 - CB - CG2 ANGL. DEV. = -10.3 DEGREES REMARK 500 VAL A 10 CA - CB - CG2 ANGL. DEV. = 14.2 DEGREES REMARK 500 ALA A 9 CA - C - N ANGL. DEV. = 17.5 DEGREES REMARK 500 ALA A 9 O - C - N ANGL. DEV. = -11.0 DEGREES REMARK 500 VAL A 10 C - N - CA ANGL. DEV. = 17.6 DEGREES REMARK 500 ILE A 16 CA - C - N ANGL. DEV. = 12.9 DEGREES REMARK 500 ASN A 19 OD1 - CG - ND2 ANGL. DEV. = -20.6 DEGREES REMARK 500 ASN A 19 CB - CG - ND2 ANGL. DEV. = 18.2 DEGREES REMARK 500 LYS A 18 O - C - N ANGL. DEV. = -11.2 DEGREES REMARK 500 ASP A 21 CB - CG - OD1 ANGL. DEV. = 6.0 DEGREES REMARK 500 LEU A 22 CB - CG - CD1 ANGL. DEV. = 15.9 DEGREES REMARK 500 LEU A 22 CB - CG - CD2 ANGL. DEV. = -13.8 DEGREES REMARK 500 PRO A 25 CB - CA - C ANGL. DEV. = 15.9 DEGREES REMARK 500 PRO A 26 C - N - CA ANGL. DEV. = 11.3 DEGREES REMARK 500 LEU A 27 CA - C - O ANGL. DEV. = -12.6 DEGREES REMARK 500 ARG A 28 N - CA - CB ANGL. DEV. = 12.1 DEGREES REMARK 500 ARG A 28 NE - CZ - NH1 ANGL. DEV. = 5.6 DEGREES REMARK 500 ARG A 28 NE - CZ - NH2 ANGL. DEV. = -4.4 DEGREES REMARK 500 SER A 31 CB - CA - C ANGL. DEV. = -11.8 DEGREES REMARK 500 SER A 31 N - CA - CB ANGL. DEV. = 13.6 DEGREES REMARK 500 ARG A 32 CD - NE - CZ ANGL. DEV. = 9.4 DEGREES REMARK 500 ARG A 32 NE - CZ - NH2 ANGL. DEV. = 3.6 DEGREES REMARK 500 ARG A 32 O - C - N ANGL. DEV. = -12.1 DEGREES REMARK 500 PHE A 34 CB - CG - CD2 ANGL. DEV. = -8.3 DEGREES REMARK 500 TYR A 33 O - C - N ANGL. DEV. = 11.7 DEGREES REMARK 500 ARG A 36 CG - CD - NE ANGL. DEV. = 13.0 DEGREES REMARK 500 ARG A 36 NE - CZ - NH1 ANGL. DEV. = 5.9 DEGREES REMARK 500 GLU A 44 CB - CA - C ANGL. DEV. = -12.8 DEGREES REMARK 500 GLU A 44 CA - CB - CG ANGL. DEV. = 15.8 DEGREES REMARK 500 GLU A 44 OE1 - CD - OE2 ANGL. DEV. = 7.6 DEGREES REMARK 500 GLU A 44 CG - CD - OE2 ANGL. DEV. = -12.2 DEGREES REMARK 500 GLU A 44 CA - C - O ANGL. DEV. = -13.0 DEGREES REMARK 500 GLU A 44 O - C - N ANGL. DEV. = 13.2 DEGREES REMARK 500 LEU A 49 CB - CG - CD2 ANGL. DEV. = -10.8 DEGREES REMARK 500 GLY A 53 CA - C - O ANGL. DEV. = 16.1 DEGREES REMARK 500 LYS A 54 CD - CE - NZ ANGL. DEV. = 16.6 DEGREES REMARK 500 GLY A 53 O - C - N ANGL. DEV. = -11.2 DEGREES REMARK 500 THR A 56 CA - CB - OG1 ANGL. DEV. = -13.4 DEGREES REMARK 500 PHE A 58 CB - CG - CD1 ANGL. DEV. = -4.6 DEGREES REMARK 500 PHE A 58 CA - C - O ANGL. DEV. = -13.3 DEGREES REMARK 500 PHE A 58 O - C - N ANGL. DEV. = 10.0 DEGREES REMARK 500 ARG A 65 CD - NE - CZ ANGL. DEV. = 9.4 DEGREES REMARK 500 ARG A 65 NH1 - CZ - NH2 ANGL. DEV. = -10.1 DEGREES REMARK 500 ARG A 65 NE - CZ - NH2 ANGL. DEV. = 11.1 DEGREES REMARK 500 ARG A 70 NE - CZ - NH2 ANGL. DEV. = -5.2 DEGREES REMARK 500 VAL A 74 CA - CB - CG2 ANGL. DEV. = 10.3 DEGREES REMARK 500 ARG A 77 CG - CD - NE ANGL. DEV. = -22.4 DEGREES REMARK 500 ARG A 77 CD - NE - CZ ANGL. DEV. = -11.5 DEGREES REMARK 500 REMARK 500 THIS ENTRY HAS 134 ANGLE DEVIATIONS. 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 SER A 76 144.02 -173.80 REMARK 500 GLU A 104 -70.73 -53.21 REMARK 500 ASP A 110 -95.63 -90.85 REMARK 500 ASN A 185 101.83 -164.59 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 65 0.08 SIDE CHAIN REMARK 500 TYR A 156 0.07 SIDE CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CHIRAL CENTERS REMARK 500 REMARK 500 UNEXPECTED CONFIGURATION OF THE FOLLOWING CHIRAL REMARK 500 CENTER(S) USING IMPROPER CA--C--CB--N CHIRALITY REMARK 500 FOR AMINO ACIDS AND C1'--O4'--N1(N9)--C2' FOR REMARK 500 NUCLEIC ACIDS OR EQUIVALENT ANGLE REMARK 500 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,A1,6X,F5.1,6X,A1,10X,A1,3X,A16) REMARK 500 REMARK 500 M RES CSSEQI IMPROPER EXPECTED FOUND DETAILS REMARK 500 VAL A 10 24.2 L L OUTSIDE RANGE REMARK 500 PRO A 25 48.0 L L OUTSIDE RANGE REMARK 500 ARG A 28 23.0 L L OUTSIDE RANGE REMARK 500 SER A 31 24.0 L L OUTSIDE RANGE REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NDP A 187 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE MOT A 188 DBREF 1HFQ A 1 186 UNP P00374 DYR_HUMAN 1 186 SEQADV 1HFQ SER A 31 UNP P00374 PHE 31 ENGINEERED SEQRES 1 A 186 VAL GLY SER LEU ASN CYS ILE VAL ALA VAL SER GLN ASN SEQRES 2 A 186 MET GLY ILE GLY LYS ASN GLY ASP LEU PRO TRP PRO PRO SEQRES 3 A 186 LEU ARG ASN GLU SER ARG TYR PHE GLN ARG MET THR THR SEQRES 4 A 186 THR SER SER VAL GLU GLY LYS GLN ASN LEU VAL ILE MET SEQRES 5 A 186 GLY LYS LYS THR TRP PHE SER ILE PRO GLU LYS ASN ARG SEQRES 6 A 186 PRO LEU LYS GLY ARG ILE ASN LEU VAL LEU SER ARG GLU SEQRES 7 A 186 LEU LYS GLU PRO PRO GLN GLY ALA HIS PHE LEU SER ARG SEQRES 8 A 186 SER LEU ASP ASP ALA LEU LYS LEU THR GLU GLN PRO GLU SEQRES 9 A 186 LEU ALA ASN LYS VAL ASP MET VAL TRP ILE VAL GLY GLY SEQRES 10 A 186 SER SER VAL TYR LYS GLU ALA MET ASN HIS PRO GLY HIS SEQRES 11 A 186 LEU LYS LEU PHE VAL THR ARG ILE MET GLN ASP PHE GLU SEQRES 12 A 186 SER ASP THR PHE PHE PRO GLU ILE ASP LEU GLU LYS TYR SEQRES 13 A 186 LYS LEU LEU PRO GLU TYR PRO GLY VAL LEU SER ASP VAL SEQRES 14 A 186 GLN GLU GLU LYS GLY ILE LYS TYR LYS PHE GLU VAL TYR SEQRES 15 A 186 GLU LYS ASN ASP HET NDP A 187 48 HET MOT A 188 32 HETNAM NDP NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE HETNAM 2 NDP PHOSPHATE HETNAM MOT N-[4-[(2,4-DIAMINOFURO[2,3D]PYRIMIDIN-5-YL) HETNAM 2 MOT METHYL]METHYLAMINO]-BENZOYL]-L-GLUTAMATE FORMUL 2 NDP C21 H30 N7 O17 P3 FORMUL 3 MOT C20 H22 N6 O6 FORMUL 4 HOH *51(H2 O) HELIX 1 1 ARG A 28 THR A 39 1 12 HELIX 2 2 LYS A 54 SER A 59 1 6 HELIX 3 3 GLU A 62 ASN A 64 5 3 HELIX 4 4 LEU A 93 GLU A 101 1 9 HELIX 5 5 PRO A 103 ALA A 106 1 4 HELIX 6 6 SER A 118 ALA A 124 1 7 SHEET 1 A 8 GLN A 170 GLU A 172 0 SHEET 2 A 8 ILE A 175 ASN A 185 -1 N TYR A 177 O GLN A 170 SHEET 3 A 8 HIS A 130 ILE A 138 -1 N ARG A 137 O LYS A 178 SHEET 4 A 8 LEU A 4 VAL A 10 1 N CYS A 6 O LYS A 132 SHEET 5 A 8 VAL A 112 ILE A 114 1 N VAL A 112 O ASN A 5 SHEET 6 A 8 LEU A 49 GLY A 53 1 N LEU A 49 O TRP A 113 SHEET 7 A 8 ILE A 71 LEU A 75 1 N ILE A 71 O VAL A 50 SHEET 8 A 8 PHE A 88 SER A 90 1 N PHE A 88 O VAL A 74 CISPEP 1 ARG A 65 PRO A 66 0 -4.34 CISPEP 2 GLY A 116 GLY A 117 0 0.03 SITE *** AC1 28 VAL A 8 ALA A 9 ILE A 16 GLY A 17 SITE *** AC1 28 GLY A 20 ASP A 21 LEU A 22 GLY A 53 SITE *** AC1 28 LYS A 54 LYS A 55 THR A 56 SER A 59 SITE *** AC1 28 LEU A 75 SER A 76 ARG A 77 GLU A 78 SITE *** AC1 28 ARG A 91 SER A 92 VAL A 115 GLY A 117 SITE *** AC1 28 SER A 118 SER A 119 VAL A 120 TYR A 121 SITE *** AC1 28 THR A 146 MOT A 188 HOH A 195 HOH A 219 SITE *** AC2 17 ILE A 7 VAL A 8 ALA A 9 GLU A 30 SITE *** AC2 17 SER A 31 PHE A 34 GLN A 35 ILE A 60 SITE *** AC2 17 ASN A 64 LEU A 67 ARG A 70 VAL A 115 SITE *** AC2 17 TYR A 121 THR A 136 NDP A 187 HOH A 193 SITE *** AC2 17 HOH A 203 CRYST1 87.120 87.120 77.014 90.00 90.00 120.00 H 3 9 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 0.011478 0.006627 0.000000 0.00000 SCALE2 0.000000 0.013254 0.000000 0.00000 SCALE3 0.000000 0.000000 0.012985 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 134 PHE H : A 134 PHE N : A 133 LEU C :(H bumps) USER MOD NoAdj-H: A 188 MOTHOE2 : A 188 MOT OE2 : A 188 MOT CD :(short bond) USER MOD NoAdj-H: A 188 MOT HO2 : A 188 MOT O2 : A 188 MOT CT :(short bond) USER MOD Set 1.1: A 59 SER OG : rot -45:sc= 0.393 USER MOD Set 1.2: A 187 NDP O2D : rot 180:sc= 0 USER MOD Set 2.1: A 48 ASN : amide:sc= 1.36 K(o=-2.2,f=-5.9!) USER MOD Set 2.2: A 111 MET CE :methyl 137:sc= -3.59! (180deg=-4.05!) USER MOD Set 3.1: A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 64 ASN : amide:sc= 0.121 K(o=0.12,f=-0.66) USER MOD Set 4.1: A 11 SER OG : rot 116:sc= 1.07 USER MOD Set 4.2: A 13 ASN : amide:sc= 2.61 K(o=3.7,f=-6.9!) USER MOD Set 5.1: A 1 VAL N :NH3+ -114:sc= -1.56 (180deg=-2.38!) USER MOD Set 5.2: A 100 THR OG1 : rot 180:sc= -0.723 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -0.462 K(o=-0.46,f=-1.8!) USER MOD Single : A 6 CYS SG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= 0 X(o=0,f=-0.056) USER MOD Single : A 14 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.0296) USER MOD Single : A 19 ASN : amide:sc= 0.859 K(o=0.86,f=0.16) USER MOD Single : A 29 ASN : amide:sc= -0.104 K(o=-0.1,f=-0.89) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 33 TYR OH : rot 119:sc= 1.68 USER MOD Single : A 35 GLN : amide:sc= -5.22! C(o=-5.2!,f=-2.6!) USER MOD Single : A 37 MET CE :methyl 158:sc= -9.09! (180deg=-11.4!) USER MOD Single : A 38 THR OG1 : rot -67:sc= 0.655 USER MOD Single : A 39 THR OG1 : rot 88:sc= 0.943 USER MOD Single : A 40 THR OG1 : rot 97:sc= 0.412 USER MOD Single : A 41 SER OG : rot 45:sc= 0.305 USER MOD Single : A 42 SER OG : rot 14:sc= -1.69! USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 GLN : amide:sc= -0.136 K(o=-0.14,f=-3!) USER MOD Single : A 52 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ -151:sc= 1.03 (180deg=0.258) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 1.44 (180deg=1.44) USER MOD Single : A 56 THR OG1 : rot 80:sc= 0.866 USER MOD Single : A 68 LYS NZ :NH3+ -160:sc=-0.00777 (180deg=-0.163) USER MOD Single : A 72 ASN : amide:sc= 0.654 K(o=0.65,f=-5.2!) USER MOD Single : A 76 SER OG : rot 60:sc= 1.26 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN : amide:sc=-0.00315 X(o=-0.0031,f=0) USER MOD Single : A 87 HIS : no HD1:sc= -5.26! K(o=-5.3!,f=0.9) USER MOD Single : A 90 SER OG : rot -169:sc= 0 USER MOD Single : A 92 SER OG : rot -68:sc= 0.229 USER MOD Single : A 98 LYS NZ :NH3+ -138:sc= 1.33 (180deg=-1.35!) USER MOD Single : A 102 GLN : amide:sc= -0.0857 X(o=-0.086,f=-0.086) USER MOD Single : A 107 ASN : amide:sc= -0.775 K(o=-0.78,f=-6.8!) USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot -102:sc= 0.576 USER MOD Single : A 119 SER OG : rot 106:sc= 0.243 USER MOD Single : A 121 TYR OH : rot -23:sc= 0.707 USER MOD Single : A 122 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.25) USER MOD Single : A 125 MET CE :methyl -149:sc= -16.1! (180deg=-18.2!) USER MOD Single : A 126 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=-0.0063) USER MOD Single : A 130 HIS : no HE2:sc= -8.99! C(o=-7.7!,f=-13!) USER MOD Single : A 132 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0125) USER MOD Single : A 136 THR OG1 : rot 173:sc= 1.95 USER MOD Single : A 139 MET CE :methyl 168:sc= 0 (180deg=-0.239) USER MOD Single : A 140 GLN : amide:sc= -2.62! C(o=-2.6!,f=-0.68!) USER MOD Single : A 144 SER OG : rot 71:sc= 0.018 USER MOD Single : A 146 THR OG1 : rot 75:sc= 1.25 USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 TYR OH : rot 171:sc= -0.0188 USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 162 TYR OH : rot 180:sc= 0 USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : A 170 GLN : amide:sc= -0.963! C(o=-0.96!,f=-3.8!) USER MOD Single : A 173 LYS NZ :NH3+ 151:sc= 0.474 (180deg=0.078) USER MOD Single : A 176 LYS NZ :NH3+ -148:sc= -0.471 (180deg=-2.91!) USER MOD Single : A 177 TYR OH : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 182 TYR OH : rot -29:sc= 1.36 USER MOD Single : A 184 LYS NZ :NH3+ 136:sc= -0.215 (180deg=-4.1!) USER MOD Single : A 185 ASN : amide:sc= -0.12 X(o=-0.12,f=0) USER MOD Single : A 187 NDP O3B : rot 70:sc= 1.21 USER MOD Single : A 187 NDP O3D : rot -88:sc= 1.23 USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 8.913 19.923 2.845 1.00 40.67 N ATOM 2 CA VAL A 1 7.993 20.988 2.234 1.00 41.35 C ATOM 3 C VAL A 1 7.807 20.677 0.747 1.00 42.80 C ATOM 4 O VAL A 1 6.677 20.507 0.257 1.00 44.80 O ATOM 5 CB VAL A 1 8.714 22.279 2.634 1.00 42.66 C ATOM 6 CG1 VAL A 1 8.841 22.442 4.150 1.00 44.66 C ATOM 7 CG2 VAL A 1 10.137 22.357 2.077 1.00 44.71 C ATOM 0 H1 VAL A 1 8.455 19.438 3.434 1.00 40.67 H new ATOM 0 H2 VAL A 1 9.222 19.393 2.201 1.00 40.67 H new ATOM 0 H3 VAL A 1 9.596 20.320 3.255 1.00 40.67 H new ATOM 0 HA VAL A 1 7.073 21.041 2.537 1.00 41.35 H new ATOM 0 HB VAL A 1 8.159 22.981 2.260 1.00 42.66 H new ATOM 0 HG11 VAL A 1 9.303 23.271 4.349 1.00 44.66 H new ATOM 0 HG12 VAL A 1 7.957 22.461 4.549 1.00 44.66 H new ATOM 0 HG13 VAL A 1 9.344 21.697 4.515 1.00 44.66 H new ATOM 0 HG21 VAL A 1 10.549 23.189 2.357 1.00 44.71 H new ATOM 0 HG22 VAL A 1 10.657 21.610 2.412 1.00 44.71 H new ATOM 0 HG23 VAL A 1 10.108 22.321 1.108 1.00 44.71 H new ATOM 8 N GLY A 2 8.915 20.634 0.051 1.00 41.64 N ATOM 9 CA GLY A 2 8.891 20.649 -1.404 1.00 36.40 C ATOM 10 C GLY A 2 9.301 19.207 -1.746 1.00 38.94 C ATOM 11 O GLY A 2 8.753 18.240 -1.189 1.00 37.60 O ATOM 0 H GLY A 2 9.702 20.595 0.396 1.00 41.64 H new ATOM 0 HA2 GLY A 2 8.012 20.868 -1.750 1.00 36.40 H new ATOM 0 HA3 GLY A 2 9.510 21.299 -1.771 1.00 36.40 H new ATOM 12 N SER A 3 10.302 19.089 -2.592 1.00 37.12 N ATOM 13 CA SER A 3 10.863 17.786 -3.048 1.00 34.68 C ATOM 14 C SER A 3 11.878 17.173 -2.042 1.00 32.14 C ATOM 15 O SER A 3 12.656 17.888 -1.401 1.00 30.35 O ATOM 16 CB SER A 3 11.653 18.009 -4.337 1.00 35.70 C ATOM 17 OG SER A 3 10.800 17.883 -5.455 1.00 41.22 O ATOM 0 H SER A 3 10.699 19.769 -2.938 1.00 37.12 H new ATOM 0 HA SER A 3 10.106 17.188 -3.152 1.00 34.68 H new ATOM 0 HB2 SER A 3 12.059 18.890 -4.328 1.00 35.70 H new ATOM 0 HB3 SER A 3 12.375 17.365 -4.398 1.00 35.70 H new ATOM 0 HG SER A 3 11.240 18.008 -6.159 1.00 41.22 H new ATOM 18 N LEU A 4 11.839 15.832 -1.948 1.00 28.13 N ATOM 19 CA LEU A 4 12.781 15.020 -1.118 1.00 26.71 C ATOM 20 C LEU A 4 13.656 14.200 -2.076 1.00 23.88 C ATOM 21 O LEU A 4 13.134 13.416 -2.883 1.00 24.00 O ATOM 22 CB LEU A 4 12.012 14.074 -0.191 1.00 26.61 C ATOM 23 CG LEU A 4 12.919 13.268 0.745 1.00 28.20 C ATOM 24 CD1 LEU A 4 13.733 14.149 1.697 1.00 26.32 C ATOM 25 CD2 LEU A 4 12.119 12.311 1.627 1.00 27.49 C ATOM 0 H LEU A 4 11.260 15.355 -2.367 1.00 28.13 H new ATOM 0 HA LEU A 4 13.322 15.606 -0.566 1.00 26.71 H new ATOM 0 HB2 LEU A 4 11.387 14.591 0.341 1.00 26.61 H new ATOM 0 HB3 LEU A 4 11.487 13.461 -0.729 1.00 26.61 H new ATOM 0 HG LEU A 4 13.512 12.786 0.148 1.00 28.20 H new ATOM 0 HD11 LEU A 4 14.286 13.589 2.263 1.00 26.32 H new ATOM 0 HD12 LEU A 4 14.298 14.746 1.182 1.00 26.32 H new ATOM 0 HD13 LEU A 4 13.131 14.671 2.249 1.00 26.32 H new ATOM 0 HD21 LEU A 4 12.725 11.820 2.204 1.00 27.49 H new ATOM 0 HD22 LEU A 4 11.495 12.817 2.170 1.00 27.49 H new ATOM 0 HD23 LEU A 4 11.629 11.688 1.068 1.00 27.49 H new ATOM 26 N ASN A 5 14.958 14.422 -1.966 1.00 23.12 N ATOM 27 CA ASN A 5 15.965 13.797 -2.853 1.00 24.05 C ATOM 28 C ASN A 5 17.152 13.239 -2.010 1.00 24.67 C ATOM 29 O ASN A 5 17.482 13.871 -1.078 1.00 22.23 O ATOM 30 CB ASN A 5 16.457 14.850 -3.861 1.00 24.50 C ATOM 31 CG ASN A 5 15.313 15.675 -4.488 1.00 27.79 C ATOM 32 OD1 ASN A 5 14.611 15.188 -5.377 1.00 26.60 O ATOM 33 ND2 ASN A 5 15.071 16.910 -4.078 1.00 29.10 N ATOM 0 H ASN A 5 15.297 14.943 -1.372 1.00 23.12 H new ATOM 0 HA ASN A 5 15.567 13.054 -3.334 1.00 24.05 H new ATOM 0 HB2 ASN A 5 17.075 15.451 -3.416 1.00 24.50 H new ATOM 0 HB3 ASN A 5 16.952 14.406 -4.567 1.00 24.50 H new ATOM 0 HD21 ASN A 5 14.431 17.363 -4.431 1.00 29.10 H new ATOM 0 HD22 ASN A 5 15.554 17.260 -3.459 1.00 29.10 H new ATOM 34 N CYS A 6 17.762 12.169 -2.570 1.00 21.64 N ATOM 35 CA CYS A 6 18.970 11.537 -2.063 1.00 21.98 C ATOM 36 C CYS A 6 19.974 11.790 -3.182 1.00 22.56 C ATOM 37 O CYS A 6 19.613 11.784 -4.372 1.00 21.84 O ATOM 38 CB CYS A 6 19.022 10.134 -1.587 1.00 21.62 C ATOM 39 SG CYS A 6 17.715 9.641 -0.486 1.00 24.99 S ATOM 0 H CYS A 6 17.460 11.790 -3.280 1.00 21.64 H new ATOM 0 HA CYS A 6 19.127 11.933 -1.191 1.00 21.98 H new ATOM 0 HB2 CYS A 6 19.010 9.548 -2.360 1.00 21.62 H new ATOM 0 HB3 CYS A 6 19.870 9.994 -1.138 1.00 21.62 H new ATOM 0 HG CYS A 6 17.865 8.492 -0.175 1.00 24.99 H new ATOM 40 N ILE A 7 21.225 12.018 -2.797 1.00 22.39 N ATOM 41 CA ILE A 7 22.326 12.256 -3.768 1.00 20.72 C ATOM 42 C ILE A 7 23.566 11.500 -3.226 1.00 20.25 C ATOM 43 O ILE A 7 23.685 11.514 -1.972 1.00 20.53 O ATOM 44 CB ILE A 7 22.682 13.757 -4.030 1.00 18.73 C ATOM 45 CG1 ILE A 7 23.744 13.855 -5.190 1.00 18.09 C ATOM 46 CG2 ILE A 7 23.129 14.513 -2.734 1.00 18.66 C ATOM 47 CD1 ILE A 7 23.855 15.366 -5.686 1.00 20.94 C ATOM 0 H ILE A 7 21.472 12.042 -1.974 1.00 22.39 H new ATOM 0 HA ILE A 7 22.029 11.933 -4.633 1.00 20.72 H new ATOM 0 HB ILE A 7 21.875 14.214 -4.316 1.00 18.73 H new ATOM 0 HG12 ILE A 7 24.608 13.543 -4.878 1.00 18.09 H new ATOM 0 HG13 ILE A 7 23.485 13.281 -5.928 1.00 18.09 H new ATOM 0 HG21 ILE A 7 23.337 15.435 -2.952 1.00 18.66 H new ATOM 0 HG22 ILE A 7 22.411 14.490 -2.082 1.00 18.66 H new ATOM 0 HG23 ILE A 7 23.916 14.084 -2.364 1.00 18.66 H new ATOM 0 HD11 ILE A 7 24.509 15.425 -6.400 1.00 20.94 H new ATOM 0 HD12 ILE A 7 22.992 15.664 -6.013 1.00 20.94 H new ATOM 0 HD13 ILE A 7 24.132 15.930 -4.947 1.00 20.94 H new ATOM 48 N VAL A 8 24.273 10.664 -3.999 1.00 20.38 N ATOM 49 CA VAL A 8 25.333 9.741 -3.604 1.00 17.61 C ATOM 50 C VAL A 8 26.244 9.437 -4.852 1.00 19.39 C ATOM 51 O VAL A 8 25.769 9.566 -6.025 1.00 17.70 O ATOM 52 CB VAL A 8 24.786 8.291 -3.165 1.00 19.57 C ATOM 53 CG1 VAL A 8 23.958 7.583 -4.354 1.00 17.98 C ATOM 54 CG2 VAL A 8 25.833 7.422 -2.627 1.00 17.99 C ATOM 0 H VAL A 8 24.126 10.624 -4.845 1.00 20.38 H new ATOM 0 HA VAL A 8 25.789 10.172 -2.864 1.00 17.61 H new ATOM 0 HB VAL A 8 24.168 8.442 -2.433 1.00 19.57 H new ATOM 0 HG11 VAL A 8 23.644 6.715 -4.057 1.00 17.98 H new ATOM 0 HG12 VAL A 8 23.198 8.137 -4.594 1.00 17.98 H new ATOM 0 HG13 VAL A 8 24.533 7.471 -5.127 1.00 17.98 H new ATOM 0 HG21 VAL A 8 25.448 6.566 -2.380 1.00 17.99 H new ATOM 0 HG22 VAL A 8 26.518 7.286 -3.300 1.00 17.99 H new ATOM 0 HG23 VAL A 8 26.227 7.837 -1.844 1.00 17.99 H new ATOM 55 N ALA A 9 27.509 9.235 -4.635 1.00 19.69 N ATOM 56 CA ALA A 9 28.537 8.766 -5.618 1.00 21.93 C ATOM 57 C ALA A 9 28.836 7.363 -5.236 1.00 21.21 C ATOM 58 O ALA A 9 29.389 7.248 -3.966 1.00 19.45 O ATOM 59 CB ALA A 9 29.670 9.667 -5.963 1.00 18.21 C ATOM 0 H ALA A 9 27.851 9.369 -3.858 1.00 19.69 H new ATOM 0 HA ALA A 9 28.173 8.801 -6.516 1.00 21.93 H new ATOM 0 HB1 ALA A 9 30.248 9.228 -6.607 1.00 18.21 H new ATOM 0 HB2 ALA A 9 29.325 10.489 -6.346 1.00 18.21 H new ATOM 0 HB3 ALA A 9 30.176 9.872 -5.161 1.00 18.21 H new ATOM 60 N VAL A 10 28.823 6.206 -5.870 1.00 21.65 N ATOM 61 CA VAL A 10 29.020 4.876 -5.608 1.00 21.67 C ATOM 62 C VAL A 10 30.006 4.230 -6.579 1.00 25.68 C ATOM 63 O VAL A 10 29.806 4.396 -7.818 1.00 25.56 O ATOM 64 CB VAL A 10 27.718 4.021 -5.252 1.00 21.87 C ATOM 65 CG1 VAL A 10 26.694 3.821 -6.462 1.00 23.51 C ATOM 66 CG2 VAL A 10 27.727 2.626 -4.662 1.00 25.50 C ATOM 0 H VAL A 10 28.638 6.257 -6.708 1.00 21.65 H new ATOM 0 HA VAL A 10 29.466 4.858 -4.747 1.00 21.67 H new ATOM 0 HB VAL A 10 27.500 4.640 -4.537 1.00 21.87 H new ATOM 0 HG11 VAL A 10 25.937 3.294 -6.162 1.00 23.51 H new ATOM 0 HG12 VAL A 10 26.383 4.687 -6.770 1.00 23.51 H new ATOM 0 HG13 VAL A 10 27.139 3.360 -7.190 1.00 23.51 H new ATOM 0 HG21 VAL A 10 26.815 2.321 -4.537 1.00 25.50 H new ATOM 0 HG22 VAL A 10 28.189 2.023 -5.265 1.00 25.50 H new ATOM 0 HG23 VAL A 10 28.183 2.639 -3.806 1.00 25.50 H new ATOM 67 N SER A 11 30.859 3.353 -6.116 1.00 23.54 N ATOM 68 CA SER A 11 31.836 2.509 -6.913 1.00 27.57 C ATOM 69 C SER A 11 30.974 1.341 -7.420 1.00 27.24 C ATOM 70 O SER A 11 29.845 1.019 -7.105 1.00 25.73 O ATOM 71 CB SER A 11 33.071 2.227 -6.055 1.00 27.03 C ATOM 72 OG SER A 11 32.678 1.230 -5.110 1.00 27.48 O ATOM 0 H SER A 11 30.917 3.195 -5.273 1.00 23.54 H new ATOM 0 HA SER A 11 32.247 2.910 -7.695 1.00 27.57 H new ATOM 0 HB2 SER A 11 33.809 1.915 -6.602 1.00 27.03 H new ATOM 0 HB3 SER A 11 33.372 3.032 -5.605 1.00 27.03 H new ATOM 0 HG SER A 11 33.116 0.526 -5.246 1.00 27.48 H new ATOM 73 N GLN A 12 31.596 0.521 -8.266 1.00 27.36 N ATOM 74 CA GLN A 12 30.963 -0.592 -8.959 1.00 29.60 C ATOM 75 C GLN A 12 30.705 -1.660 -7.910 1.00 27.15 C ATOM 76 O GLN A 12 29.774 -2.414 -8.105 1.00 29.65 O ATOM 77 CB GLN A 12 31.972 -1.203 -9.983 1.00 31.93 C ATOM 78 CG GLN A 12 31.084 -1.983 -10.917 1.00 39.30 C ATOM 79 CD GLN A 12 31.651 -2.877 -11.951 1.00 41.42 C ATOM 80 OE1 GLN A 12 32.612 -2.357 -12.601 1.00 44.21 O ATOM 81 NE2 GLN A 12 31.064 -4.138 -12.113 1.00 43.70 N ATOM 0 H GLN A 12 32.430 0.604 -8.457 1.00 27.36 H new ATOM 0 HA GLN A 12 30.156 -0.300 -9.412 1.00 29.60 H new ATOM 0 HB2 GLN A 12 32.468 -0.514 -10.452 1.00 31.93 H new ATOM 0 HB3 GLN A 12 32.623 -1.774 -9.547 1.00 31.93 H new ATOM 0 HG2 GLN A 12 30.500 -2.525 -10.364 1.00 39.30 H new ATOM 0 HG3 GLN A 12 30.523 -1.339 -11.377 1.00 39.30 H new ATOM 0 HE21 GLN A 12 30.412 -4.377 -11.605 1.00 43.70 H new ATOM 0 HE22 GLN A 12 31.355 -4.673 -12.720 1.00 43.70 H new ATOM 82 N ASN A 13 31.453 -1.727 -6.880 1.00 27.39 N ATOM 83 CA ASN A 13 31.168 -2.736 -5.775 1.00 26.68 C ATOM 84 C ASN A 13 30.290 -2.094 -4.700 1.00 26.95 C ATOM 85 O ASN A 13 30.391 -2.632 -3.532 1.00 24.68 O ATOM 86 CB ASN A 13 32.483 -3.167 -5.082 1.00 30.86 C ATOM 87 CG ASN A 13 33.549 -2.201 -4.725 1.00 30.92 C ATOM 88 OD1 ASN A 13 33.992 -1.190 -5.285 1.00 31.52 O ATOM 89 ND2 ASN A 13 34.218 -2.389 -3.528 1.00 32.69 N ATOM 0 H ASN A 13 32.140 -1.228 -6.745 1.00 27.39 H new ATOM 0 HA ASN A 13 30.728 -3.500 -6.179 1.00 26.68 H new ATOM 0 HB2 ASN A 13 32.229 -3.616 -4.261 1.00 30.86 H new ATOM 0 HB3 ASN A 13 32.893 -3.834 -5.655 1.00 30.86 H new ATOM 0 HD21 ASN A 13 34.834 -1.838 -3.288 1.00 32.69 H new ATOM 0 HD22 ASN A 13 34.018 -3.056 -3.024 1.00 32.69 H new ATOM 90 N MET A 14 29.521 -1.116 -4.966 1.00 27.61 N ATOM 91 CA MET A 14 28.532 -0.353 -4.130 1.00 27.55 C ATOM 92 C MET A 14 29.308 0.312 -2.911 1.00 27.17 C ATOM 93 O MET A 14 28.579 0.604 -1.923 1.00 26.52 O ATOM 94 CB MET A 14 27.351 -1.108 -3.621 1.00 32.06 C ATOM 95 CG MET A 14 26.508 -1.782 -4.848 1.00 37.09 C ATOM 96 SD MET A 14 25.719 -0.400 -5.687 1.00 41.22 S ATOM 97 CE MET A 14 24.253 0.022 -4.827 1.00 38.25 C ATOM 0 H MET A 14 29.530 -0.792 -5.763 1.00 27.61 H new ATOM 0 HA MET A 14 28.144 0.300 -4.734 1.00 27.55 H new ATOM 0 HB2 MET A 14 27.646 -1.800 -3.009 1.00 32.06 H new ATOM 0 HB3 MET A 14 26.775 -0.511 -3.118 1.00 32.06 H new ATOM 0 HG2 MET A 14 27.092 -2.270 -5.449 1.00 37.09 H new ATOM 0 HG3 MET A 14 25.850 -2.413 -4.517 1.00 37.09 H new ATOM 0 HE1 MET A 14 23.820 0.767 -5.272 1.00 38.25 H new ATOM 0 HE2 MET A 14 23.653 -0.740 -4.816 1.00 38.25 H new ATOM 0 HE3 MET A 14 24.473 0.273 -3.916 1.00 38.25 H new ATOM 98 N GLY A 15 30.516 0.712 -3.081 1.00 26.20 N ATOM 99 CA GLY A 15 31.212 1.419 -2.058 1.00 23.10 C ATOM 100 C GLY A 15 31.090 2.922 -2.046 1.00 19.95 C ATOM 101 O GLY A 15 31.106 3.685 -3.103 1.00 21.57 O ATOM 0 H GLY A 15 30.970 0.584 -3.800 1.00 26.20 H new ATOM 0 HA2 GLY A 15 30.903 1.086 -1.201 1.00 23.10 H new ATOM 0 HA3 GLY A 15 32.153 1.195 -2.127 1.00 23.10 H new ATOM 102 N ILE A 16 30.892 3.496 -0.811 1.00 19.50 N ATOM 103 CA ILE A 16 30.791 4.928 -0.666 1.00 18.54 C ATOM 104 C ILE A 16 31.844 5.512 0.213 1.00 18.13 C ATOM 105 O ILE A 16 32.054 6.764 0.072 1.00 19.51 O ATOM 106 CB ILE A 16 29.234 5.439 -0.379 1.00 18.61 C ATOM 107 CG1 ILE A 16 29.008 4.954 1.244 1.00 16.86 C ATOM 108 CG2 ILE A 16 28.106 4.889 -1.214 1.00 19.31 C ATOM 109 CD1 ILE A 16 27.725 5.875 1.754 1.00 21.19 C ATOM 0 H ILE A 16 30.819 3.054 -0.077 1.00 19.50 H new ATOM 0 HA ILE A 16 31.000 5.312 -1.532 1.00 18.54 H new ATOM 0 HB ILE A 16 29.179 6.382 -0.599 1.00 18.61 H new ATOM 0 HG12 ILE A 16 28.814 4.006 1.309 1.00 16.86 H new ATOM 0 HG13 ILE A 16 29.800 5.119 1.779 1.00 16.86 H new ATOM 0 HG21 ILE A 16 27.268 5.282 -0.925 1.00 19.31 H new ATOM 0 HG22 ILE A 16 28.259 5.104 -2.147 1.00 19.31 H new ATOM 0 HG23 ILE A 16 28.064 3.926 -1.107 1.00 19.31 H new ATOM 0 HD11 ILE A 16 27.522 5.664 2.679 1.00 21.19 H new ATOM 0 HD12 ILE A 16 27.951 6.815 1.679 1.00 21.19 H new ATOM 0 HD13 ILE A 16 26.950 5.685 1.202 1.00 21.19 H new ATOM 110 N GLY A 17 32.621 4.895 1.157 1.00 20.22 N ATOM 111 CA GLY A 17 33.514 5.708 2.004 1.00 20.56 C ATOM 112 C GLY A 17 34.544 4.563 2.454 1.00 19.63 C ATOM 113 O GLY A 17 34.309 3.394 2.256 1.00 23.82 O ATOM 0 H GLY A 17 32.638 4.048 1.308 1.00 20.22 H new ATOM 0 HA2 GLY A 17 33.943 6.427 1.514 1.00 20.56 H new ATOM 0 HA3 GLY A 17 33.052 6.113 2.755 1.00 20.56 H new ATOM 114 N LYS A 18 35.710 5.006 2.794 1.00 24.11 N ATOM 115 CA LYS A 18 36.784 4.107 3.343 1.00 25.78 C ATOM 116 C LYS A 18 37.502 5.017 4.390 1.00 23.09 C ATOM 117 O LYS A 18 38.033 6.115 4.093 1.00 23.51 O ATOM 118 CB LYS A 18 37.917 3.710 2.394 1.00 25.44 C ATOM 119 CG LYS A 18 38.513 2.356 2.803 1.00 29.37 C ATOM 120 CD LYS A 18 40.011 2.313 2.532 1.00 33.59 C ATOM 121 CE LYS A 18 40.663 3.282 1.620 1.00 35.45 C ATOM 122 NZ LYS A 18 41.895 2.466 1.099 1.00 39.13 N ATOM 0 H LYS A 18 35.943 5.831 2.729 1.00 24.11 H new ATOM 0 HA LYS A 18 36.351 3.286 3.624 1.00 25.78 H new ATOM 0 HB2 LYS A 18 37.582 3.661 1.485 1.00 25.44 H new ATOM 0 HB3 LYS A 18 38.608 4.390 2.405 1.00 25.44 H new ATOM 0 HG2 LYS A 18 38.347 2.198 3.745 1.00 29.37 H new ATOM 0 HG3 LYS A 18 38.072 1.644 2.314 1.00 29.37 H new ATOM 0 HD2 LYS A 18 40.455 2.392 3.391 1.00 33.59 H new ATOM 0 HD3 LYS A 18 40.210 1.427 2.190 1.00 33.59 H new ATOM 0 HE2 LYS A 18 40.075 3.552 0.897 1.00 35.45 H new ATOM 0 HE3 LYS A 18 40.933 4.090 2.083 1.00 35.45 H new ATOM 0 HZ1 LYS A 18 42.388 2.981 0.566 1.00 39.13 H new ATOM 0 HZ2 LYS A 18 42.387 2.197 1.790 1.00 39.13 H new ATOM 0 HZ3 LYS A 18 41.610 1.756 0.644 1.00 39.13 H new ATOM 123 N ASN A 19 37.666 4.730 5.679 1.00 26.21 N ATOM 124 CA ASN A 19 38.290 5.614 6.699 1.00 26.47 C ATOM 125 C ASN A 19 37.897 7.086 6.782 1.00 25.48 C ATOM 126 O ASN A 19 38.913 7.868 6.677 1.00 23.25 O ATOM 127 CB ASN A 19 39.858 5.429 6.617 1.00 28.77 C ATOM 128 CG ASN A 19 40.224 3.961 6.975 1.00 30.46 C ATOM 129 OD1 ASN A 19 39.642 3.294 7.869 1.00 33.43 O ATOM 130 ND2 ASN A 19 41.080 3.089 6.521 1.00 31.64 N ATOM 0 H ASN A 19 37.408 3.980 6.011 1.00 26.21 H new ATOM 0 HA ASN A 19 37.906 5.305 7.534 1.00 26.47 H new ATOM 0 HB2 ASN A 19 40.173 5.643 5.725 1.00 28.77 H new ATOM 0 HB3 ASN A 19 40.298 6.041 7.228 1.00 28.77 H new ATOM 0 HD21 ASN A 19 41.109 2.299 6.859 1.00 31.64 H new ATOM 0 HD22 ASN A 19 41.616 3.304 5.883 1.00 31.64 H new ATOM 131 N GLY A 20 36.590 7.363 6.769 1.00 23.29 N ATOM 132 CA GLY A 20 36.256 8.762 6.920 1.00 27.46 C ATOM 133 C GLY A 20 36.363 9.531 5.638 1.00 25.67 C ATOM 134 O GLY A 20 36.297 10.793 5.679 1.00 31.02 O ATOM 0 H GLY A 20 35.940 6.807 6.682 1.00 23.29 H new ATOM 0 HA2 GLY A 20 35.352 8.838 7.263 1.00 27.46 H new ATOM 0 HA3 GLY A 20 36.844 9.160 7.580 1.00 27.46 H new ATOM 135 N ASP A 21 36.718 8.934 4.551 1.00 27.02 N ATOM 136 CA ASP A 21 36.815 9.700 3.315 1.00 28.46 C ATOM 137 C ASP A 21 36.260 8.850 2.142 1.00 26.56 C ATOM 138 O ASP A 21 35.607 7.849 2.273 1.00 25.74 O ATOM 139 CB ASP A 21 38.252 10.142 3.091 1.00 32.17 C ATOM 140 CG ASP A 21 38.374 11.525 2.405 1.00 37.42 C ATOM 141 OD1 ASP A 21 37.491 12.033 1.678 1.00 39.06 O ATOM 142 OD2 ASP A 21 39.426 12.139 2.687 1.00 38.98 O ATOM 0 H ASP A 21 36.909 8.098 4.485 1.00 27.02 H new ATOM 0 HA ASP A 21 36.278 10.506 3.372 1.00 28.46 H new ATOM 0 HB2 ASP A 21 38.711 10.171 3.945 1.00 32.17 H new ATOM 0 HB3 ASP A 21 38.706 9.479 2.548 1.00 32.17 H new ATOM 143 N LEU A 22 36.422 9.534 0.980 1.00 26.43 N ATOM 144 CA LEU A 22 35.950 8.811 -0.251 1.00 28.39 C ATOM 145 C LEU A 22 36.926 7.692 -0.662 1.00 27.43 C ATOM 146 O LEU A 22 38.131 7.852 -0.433 1.00 29.62 O ATOM 147 CB LEU A 22 35.853 9.844 -1.434 1.00 28.82 C ATOM 148 CG LEU A 22 34.603 10.609 -1.645 1.00 30.57 C ATOM 149 CD1 LEU A 22 33.265 10.309 -1.070 1.00 30.69 C ATOM 150 CD2 LEU A 22 35.050 11.894 -0.973 1.00 32.00 C ATOM 0 H LEU A 22 36.758 10.319 0.878 1.00 26.43 H new ATOM 0 HA LEU A 22 35.088 8.411 -0.056 1.00 28.39 H new ATOM 0 HB2 LEU A 22 36.569 10.488 -1.315 1.00 28.82 H new ATOM 0 HB3 LEU A 22 36.039 9.362 -2.255 1.00 28.82 H new ATOM 0 HG LEU A 22 34.373 10.486 -2.579 1.00 30.57 H new ATOM 0 HD11 LEU A 22 32.626 10.973 -1.373 1.00 30.69 H new ATOM 0 HD12 LEU A 22 32.978 9.429 -1.360 1.00 30.69 H new ATOM 0 HD13 LEU A 22 33.317 10.329 -0.102 1.00 30.69 H new ATOM 0 HD21 LEU A 22 34.333 12.546 -1.012 1.00 32.00 H new ATOM 0 HD22 LEU A 22 35.273 11.714 -0.046 1.00 32.00 H new ATOM 0 HD23 LEU A 22 35.830 12.244 -1.430 1.00 32.00 H new ATOM 151 N PRO A 23 36.549 6.521 -1.247 1.00 25.77 N ATOM 152 CA PRO A 23 37.456 5.487 -1.678 1.00 26.63 C ATOM 153 C PRO A 23 38.357 5.863 -2.871 1.00 27.58 C ATOM 154 O PRO A 23 39.483 5.310 -3.020 1.00 28.89 O ATOM 155 CB PRO A 23 36.543 4.315 -2.007 1.00 26.83 C ATOM 156 CG PRO A 23 35.162 4.777 -1.374 1.00 24.14 C ATOM 157 CD PRO A 23 35.109 6.227 -1.479 1.00 25.39 C ATOM 0 HA PRO A 23 38.105 5.295 -0.983 1.00 26.63 H new ATOM 0 HB2 PRO A 23 36.472 4.168 -2.963 1.00 26.83 H new ATOM 0 HB3 PRO A 23 36.862 3.487 -1.616 1.00 26.83 H new ATOM 0 HG2 PRO A 23 34.417 4.372 -1.844 1.00 24.14 H new ATOM 0 HG3 PRO A 23 35.099 4.498 -0.447 1.00 24.14 H new ATOM 0 HD2 PRO A 23 34.798 6.530 -2.346 1.00 25.39 H new ATOM 0 HD3 PRO A 23 34.531 6.631 -0.813 1.00 25.39 H new ATOM 158 N TRP A 24 37.997 6.877 -3.619 1.00 27.27 N ATOM 159 CA TRP A 24 38.731 7.219 -4.831 1.00 27.31 C ATOM 160 C TRP A 24 39.289 8.610 -4.520 1.00 31.65 C ATOM 161 O TRP A 24 38.868 9.369 -3.653 1.00 33.02 O ATOM 162 CB TRP A 24 37.712 7.016 -6.069 1.00 25.09 C ATOM 163 CG TRP A 24 36.366 7.763 -5.864 1.00 22.23 C ATOM 164 CD1 TRP A 24 36.203 9.163 -5.833 1.00 21.45 C ATOM 165 CD2 TRP A 24 35.169 7.182 -5.312 1.00 20.83 C ATOM 166 NE1 TRP A 24 34.846 9.388 -5.450 1.00 23.08 N ATOM 167 CE2 TRP A 24 34.204 8.244 -5.147 1.00 21.11 C ATOM 168 CE3 TRP A 24 34.777 5.885 -5.067 1.00 21.57 C ATOM 169 CZ2 TRP A 24 32.895 8.049 -4.649 1.00 21.75 C ATOM 170 CZ3 TRP A 24 33.468 5.561 -4.551 1.00 22.33 C ATOM 171 CH2 TRP A 24 32.512 6.646 -4.446 1.00 19.68 C ATOM 0 H TRP A 24 37.327 7.389 -3.449 1.00 27.27 H new ATOM 0 HA TRP A 24 39.491 6.677 -5.096 1.00 27.31 H new ATOM 0 HB2 TRP A 24 38.132 7.332 -6.884 1.00 25.09 H new ATOM 0 HB3 TRP A 24 37.538 6.069 -6.188 1.00 25.09 H new ATOM 0 HD1 TRP A 24 36.846 9.807 -6.023 1.00 21.45 H new ATOM 0 HE1 TRP A 24 34.480 10.166 -5.417 1.00 23.08 H new ATOM 0 HE3 TRP A 24 35.376 5.194 -5.240 1.00 21.57 H new ATOM 0 HZ2 TRP A 24 32.320 8.756 -4.464 1.00 21.75 H new ATOM 0 HZ3 TRP A 24 33.248 4.694 -4.297 1.00 22.33 H new ATOM 0 HH2 TRP A 24 31.627 6.447 -4.243 1.00 19.68 H new ATOM 172 N PRO A 25 40.302 8.951 -5.385 1.00 31.16 N ATOM 173 CA PRO A 25 41.003 10.152 -5.420 1.00 32.06 C ATOM 174 C PRO A 25 39.883 11.143 -5.778 1.00 32.89 C ATOM 175 O PRO A 25 38.804 10.918 -6.327 1.00 35.83 O ATOM 176 CB PRO A 25 42.151 9.662 -6.327 1.00 32.10 C ATOM 177 CG PRO A 25 41.529 8.782 -7.375 1.00 32.37 C ATOM 178 CD PRO A 25 40.797 7.889 -6.355 1.00 32.03 C ATOM 0 HA PRO A 25 41.443 10.635 -4.703 1.00 32.06 H new ATOM 0 HB2 PRO A 25 42.611 10.412 -6.736 1.00 32.10 H new ATOM 0 HB3 PRO A 25 42.811 9.171 -5.812 1.00 32.10 H new ATOM 0 HG2 PRO A 25 40.936 9.253 -7.981 1.00 32.37 H new ATOM 0 HG3 PRO A 25 42.174 8.306 -7.921 1.00 32.37 H new ATOM 0 HD2 PRO A 25 40.071 7.385 -6.756 1.00 32.03 H new ATOM 0 HD3 PRO A 25 41.388 7.247 -5.932 1.00 32.03 H new ATOM 179 N PRO A 26 39.994 12.376 -5.396 1.00 33.75 N ATOM 180 CA PRO A 26 39.078 13.520 -5.564 1.00 32.20 C ATOM 181 C PRO A 26 38.897 13.791 -7.035 1.00 33.04 C ATOM 182 O PRO A 26 39.835 13.788 -7.881 1.00 35.73 O ATOM 183 CB PRO A 26 39.688 14.747 -4.844 1.00 34.04 C ATOM 184 CG PRO A 26 40.879 14.271 -4.160 1.00 29.45 C ATOM 185 CD PRO A 26 41.262 12.880 -4.669 1.00 33.81 C ATOM 0 HA PRO A 26 38.209 13.329 -5.178 1.00 32.20 H new ATOM 0 HB2 PRO A 26 39.910 15.445 -5.479 1.00 34.04 H new ATOM 0 HB3 PRO A 26 39.056 15.127 -4.214 1.00 34.04 H new ATOM 0 HG2 PRO A 26 41.612 14.889 -4.306 1.00 29.45 H new ATOM 0 HG3 PRO A 26 40.720 14.240 -3.204 1.00 29.45 H new ATOM 0 HD2 PRO A 26 42.022 12.920 -5.270 1.00 33.81 H new ATOM 0 HD3 PRO A 26 41.509 12.291 -3.939 1.00 33.81 H new ATOM 186 N LEU A 27 37.570 13.966 -7.255 1.00 32.33 N ATOM 187 CA LEU A 27 37.051 14.247 -8.580 1.00 30.43 C ATOM 188 C LEU A 27 36.533 15.685 -8.539 1.00 30.24 C ATOM 189 O LEU A 27 35.417 15.656 -8.073 1.00 28.57 O ATOM 190 CB LEU A 27 36.055 13.210 -9.081 1.00 30.27 C ATOM 191 CG LEU A 27 36.657 11.828 -9.052 1.00 31.13 C ATOM 192 CD1 LEU A 27 35.531 10.861 -9.410 1.00 31.96 C ATOM 193 CD2 LEU A 27 37.830 11.543 -10.077 1.00 31.59 C ATOM 0 H LEU A 27 36.971 13.922 -6.640 1.00 32.33 H new ATOM 0 HA LEU A 27 37.748 14.175 -9.251 1.00 30.43 H new ATOM 0 HB2 LEU A 27 35.256 13.231 -8.531 1.00 30.27 H new ATOM 0 HB3 LEU A 27 35.782 13.429 -9.986 1.00 30.27 H new ATOM 0 HG LEU A 27 37.045 11.727 -8.169 1.00 31.13 H new ATOM 0 HD11 LEU A 27 35.871 9.952 -9.405 1.00 31.96 H new ATOM 0 HD12 LEU A 27 34.816 10.942 -8.760 1.00 31.96 H new ATOM 0 HD13 LEU A 27 35.190 11.073 -10.293 1.00 31.96 H new ATOM 0 HD21 LEU A 27 38.139 10.630 -9.970 1.00 31.59 H new ATOM 0 HD22 LEU A 27 37.507 11.671 -10.983 1.00 31.59 H new ATOM 0 HD23 LEU A 27 38.564 12.154 -9.907 1.00 31.59 H new ATOM 194 N ARG A 28 37.232 16.671 -8.946 1.00 30.68 N ATOM 195 CA ARG A 28 36.737 18.047 -8.835 1.00 35.00 C ATOM 196 C ARG A 28 35.401 18.328 -9.547 1.00 32.79 C ATOM 197 O ARG A 28 34.604 19.107 -8.987 1.00 31.33 O ATOM 198 CB ARG A 28 37.635 19.315 -9.182 1.00 38.74 C ATOM 199 CG ARG A 28 36.946 20.633 -8.852 1.00 42.61 C ATOM 200 CD ARG A 28 37.702 21.921 -9.174 1.00 46.64 C ATOM 201 NE ARG A 28 36.872 23.124 -8.782 1.00 47.34 N ATOM 202 CZ ARG A 28 37.396 24.375 -9.001 1.00 49.34 C ATOM 203 NH1 ARG A 28 38.678 24.651 -9.448 1.00 50.23 N ATOM 204 NH2 ARG A 28 36.599 25.435 -8.625 1.00 51.35 N ATOM 0 H ARG A 28 38.012 16.598 -9.300 1.00 30.68 H new ATOM 0 HA ARG A 28 36.694 17.995 -7.867 1.00 35.00 H new ATOM 0 HB2 ARG A 28 38.470 19.259 -8.691 1.00 38.74 H new ATOM 0 HB3 ARG A 28 37.859 19.299 -10.126 1.00 38.74 H new ATOM 0 HG2 ARG A 28 36.100 20.656 -9.326 1.00 42.61 H new ATOM 0 HG3 ARG A 28 36.741 20.635 -7.904 1.00 42.61 H new ATOM 0 HD2 ARG A 28 38.548 21.935 -8.700 1.00 46.64 H new ATOM 0 HD3 ARG A 28 37.907 21.956 -10.121 1.00 46.64 H new ATOM 0 HE ARG A 28 36.093 23.027 -8.431 1.00 47.34 H new ATOM 0 HH11 ARG A 28 39.223 24.007 -9.614 1.00 50.23 H new ATOM 0 HH12 ARG A 28 38.928 25.466 -9.560 1.00 50.23 H new ATOM 0 HH21 ARG A 28 35.826 25.290 -8.277 1.00 51.35 H new ATOM 0 HH22 ARG A 28 36.875 26.242 -8.738 1.00 51.35 H new ATOM 205 N ASN A 29 35.107 17.708 -10.665 1.00 33.58 N ATOM 206 CA ASN A 29 33.908 17.968 -11.405 1.00 32.25 C ATOM 207 C ASN A 29 32.712 17.202 -10.763 1.00 29.61 C ATOM 208 O ASN A 29 31.597 17.682 -10.930 1.00 29.47 O ATOM 209 CB ASN A 29 34.042 17.750 -12.935 1.00 36.85 C ATOM 210 CG ASN A 29 34.992 18.632 -13.718 1.00 40.05 C ATOM 211 OD1 ASN A 29 35.098 19.818 -13.492 1.00 42.85 O ATOM 212 ND2 ASN A 29 35.588 18.034 -14.781 1.00 41.38 N ATOM 0 H ASN A 29 35.613 17.110 -11.021 1.00 33.58 H new ATOM 0 HA ASN A 29 33.726 18.918 -11.337 1.00 32.25 H new ATOM 0 HB2 ASN A 29 34.311 16.829 -13.078 1.00 36.85 H new ATOM 0 HB3 ASN A 29 33.159 17.851 -13.324 1.00 36.85 H new ATOM 0 HD21 ASN A 29 36.063 18.500 -15.326 1.00 41.38 H new ATOM 0 HD22 ASN A 29 35.490 17.189 -14.910 1.00 41.38 H new ATOM 213 N GLU A 30 32.948 16.094 -10.267 1.00 29.34 N ATOM 214 CA GLU A 30 31.951 15.249 -9.453 1.00 25.78 C ATOM 215 C GLU A 30 31.657 16.156 -8.263 1.00 26.02 C ATOM 216 O GLU A 30 30.432 16.304 -8.034 1.00 22.78 O ATOM 217 CB GLU A 30 32.452 13.845 -9.114 1.00 24.07 C ATOM 218 CG GLU A 30 31.282 12.860 -9.013 1.00 23.16 C ATOM 219 CD GLU A 30 30.316 13.061 -7.888 1.00 23.60 C ATOM 220 OE1 GLU A 30 30.861 13.178 -6.699 1.00 23.57 O ATOM 221 OE2 GLU A 30 29.094 13.010 -7.974 1.00 24.66 O ATOM 0 H GLU A 30 33.714 15.712 -10.350 1.00 29.34 H new ATOM 0 HA GLU A 30 31.145 15.017 -9.941 1.00 25.78 H new ATOM 0 HB2 GLU A 30 33.074 13.546 -9.795 1.00 24.07 H new ATOM 0 HB3 GLU A 30 32.938 13.864 -8.275 1.00 24.07 H new ATOM 0 HG2 GLU A 30 30.786 12.896 -9.846 1.00 23.16 H new ATOM 0 HG3 GLU A 30 31.648 11.965 -8.939 1.00 23.16 H new ATOM 222 N SER A 31 32.567 16.767 -7.469 1.00 27.48 N ATOM 223 CA SER A 31 32.288 17.685 -6.399 1.00 28.92 C ATOM 224 C SER A 31 31.521 18.931 -6.806 1.00 25.93 C ATOM 225 O SER A 31 30.578 19.406 -6.057 1.00 23.44 O ATOM 226 CB SER A 31 33.442 18.405 -5.480 1.00 30.69 C ATOM 227 OG SER A 31 34.063 17.193 -5.085 1.00 34.31 O ATOM 0 H SER A 31 33.411 16.631 -7.567 1.00 27.48 H new ATOM 0 HA SER A 31 31.847 16.987 -5.890 1.00 28.92 H new ATOM 0 HB2 SER A 31 34.026 18.996 -5.981 1.00 30.69 H new ATOM 0 HB3 SER A 31 33.085 18.919 -4.739 1.00 30.69 H new ATOM 0 HG SER A 31 34.715 17.363 -4.583 1.00 34.31 H new ATOM 228 N ARG A 32 31.931 19.484 -7.926 1.00 26.08 N ATOM 229 CA ARG A 32 31.176 20.667 -8.462 1.00 28.43 C ATOM 230 C ARG A 32 29.703 20.371 -8.684 1.00 25.73 C ATOM 231 O ARG A 32 28.753 21.194 -8.577 1.00 24.85 O ATOM 232 CB ARG A 32 31.720 21.276 -9.800 1.00 32.16 C ATOM 233 CG ARG A 32 33.018 22.006 -9.797 1.00 37.62 C ATOM 234 CD ARG A 32 33.500 22.558 -11.145 1.00 38.87 C ATOM 235 NE ARG A 32 34.940 22.955 -10.911 1.00 39.84 N ATOM 236 CZ ARG A 32 36.044 22.888 -11.672 1.00 41.89 C ATOM 237 NH1 ARG A 32 35.936 22.494 -12.966 1.00 43.71 N ATOM 238 NH2 ARG A 32 37.332 23.045 -11.183 1.00 42.61 N ATOM 0 H ARG A 32 32.606 19.227 -8.392 1.00 26.08 H new ATOM 0 HA ARG A 32 31.308 21.319 -7.756 1.00 28.43 H new ATOM 0 HB2 ARG A 32 31.795 20.551 -10.440 1.00 32.16 H new ATOM 0 HB3 ARG A 32 31.045 21.884 -10.139 1.00 32.16 H new ATOM 0 HG2 ARG A 32 32.948 22.746 -9.174 1.00 37.62 H new ATOM 0 HG3 ARG A 32 33.701 21.409 -9.452 1.00 37.62 H new ATOM 0 HD2 ARG A 32 33.429 21.889 -11.844 1.00 38.87 H new ATOM 0 HD3 ARG A 32 32.967 23.319 -11.424 1.00 38.87 H new ATOM 0 HE ARG A 32 35.080 23.292 -10.132 1.00 39.84 H new ATOM 0 HH11 ARG A 32 35.166 22.290 -13.291 1.00 43.71 H new ATOM 0 HH12 ARG A 32 36.637 22.448 -13.461 1.00 43.71 H new ATOM 0 HH21 ARG A 32 37.459 23.195 -10.346 1.00 42.61 H new ATOM 0 HH22 ARG A 32 38.004 22.992 -11.717 1.00 42.61 H new ATOM 239 N TYR A 33 29.302 19.277 -9.298 1.00 25.27 N ATOM 240 CA TYR A 33 27.965 18.757 -9.634 1.00 24.58 C ATOM 241 C TYR A 33 27.168 18.534 -8.247 1.00 23.97 C ATOM 242 O TYR A 33 26.055 19.006 -8.223 1.00 24.53 O ATOM 243 CB TYR A 33 27.972 17.426 -10.351 1.00 22.89 C ATOM 244 CG TYR A 33 26.702 16.587 -10.531 1.00 22.96 C ATOM 245 CD1 TYR A 33 25.776 16.896 -11.561 1.00 22.46 C ATOM 246 CD2 TYR A 33 26.381 15.503 -9.673 1.00 23.58 C ATOM 247 CE1 TYR A 33 24.478 16.255 -11.608 1.00 25.28 C ATOM 248 CE2 TYR A 33 25.070 14.833 -9.751 1.00 24.26 C ATOM 249 CZ TYR A 33 24.231 15.211 -10.820 1.00 25.90 C ATOM 250 OH TYR A 33 23.047 14.489 -11.041 1.00 28.40 O ATOM 0 H TYR A 33 29.899 18.724 -9.577 1.00 25.27 H new ATOM 0 HA TYR A 33 27.558 19.405 -10.230 1.00 24.58 H new ATOM 0 HB2 TYR A 33 28.326 17.590 -11.239 1.00 22.89 H new ATOM 0 HB3 TYR A 33 28.614 16.864 -9.889 1.00 22.89 H new ATOM 0 HD1 TYR A 33 26.005 17.518 -12.214 1.00 22.46 H new ATOM 0 HD2 TYR A 33 27.008 15.211 -9.051 1.00 23.58 H new ATOM 0 HE1 TYR A 33 23.821 16.571 -12.185 1.00 25.28 H new ATOM 0 HE2 TYR A 33 24.810 14.194 -9.127 1.00 24.26 H new ATOM 0 HH TYR A 33 23.236 13.695 -11.240 1.00 28.40 H new ATOM 251 N PHE A 34 27.968 17.955 -7.327 1.00 24.14 N ATOM 252 CA PHE A 34 27.181 17.818 -5.944 1.00 21.67 C ATOM 253 C PHE A 34 26.780 19.195 -5.457 1.00 21.09 C ATOM 254 O PHE A 34 25.662 19.503 -4.978 1.00 18.41 O ATOM 255 CB PHE A 34 28.199 17.056 -5.012 1.00 24.41 C ATOM 256 CG PHE A 34 27.704 17.275 -3.497 1.00 22.79 C ATOM 257 CD1 PHE A 34 27.963 18.417 -2.803 1.00 23.33 C ATOM 258 CD2 PHE A 34 26.842 16.276 -3.071 1.00 22.96 C ATOM 259 CE1 PHE A 34 27.475 18.612 -1.453 1.00 23.53 C ATOM 260 CE2 PHE A 34 26.304 16.462 -1.717 1.00 20.81 C ATOM 261 CZ PHE A 34 26.615 17.607 -0.951 1.00 22.87 C ATOM 0 H PHE A 34 28.779 17.676 -7.393 1.00 24.14 H new ATOM 0 HA PHE A 34 26.345 17.328 -5.989 1.00 21.67 H new ATOM 0 HB2 PHE A 34 28.225 16.112 -5.232 1.00 24.41 H new ATOM 0 HB3 PHE A 34 29.098 17.400 -5.132 1.00 24.41 H new ATOM 0 HD1 PHE A 34 28.465 19.088 -3.205 1.00 23.33 H new ATOM 0 HD2 PHE A 34 26.622 15.545 -3.602 1.00 22.96 H new ATOM 0 HE1 PHE A 34 27.713 19.354 -0.946 1.00 23.53 H new ATOM 0 HE2 PHE A 34 25.746 15.811 -1.356 1.00 20.81 H new ATOM 0 HZ PHE A 34 26.248 17.702 -0.102 1.00 22.87 H new ATOM 262 N GLN A 35 27.649 20.143 -5.598 1.00 20.45 N ATOM 263 CA GLN A 35 27.496 21.514 -5.107 1.00 23.08 C ATOM 264 C GLN A 35 26.304 22.245 -5.817 1.00 24.04 C ATOM 265 O GLN A 35 25.381 22.967 -5.319 1.00 25.07 O ATOM 266 CB GLN A 35 28.802 22.286 -5.241 1.00 27.56 C ATOM 267 CG GLN A 35 28.473 23.811 -5.137 1.00 33.07 C ATOM 268 CD GLN A 35 29.744 24.565 -5.309 1.00 38.32 C ATOM 269 OE1 GLN A 35 29.870 25.756 -5.612 1.00 42.92 O ATOM 270 NE2 GLN A 35 30.931 23.980 -5.261 1.00 41.48 N ATOM 0 H GLN A 35 28.397 20.019 -6.004 1.00 20.45 H new ATOM 0 HA GLN A 35 27.278 21.474 -4.163 1.00 23.08 H new ATOM 0 HB2 GLN A 35 29.424 22.025 -4.544 1.00 27.56 H new ATOM 0 HB3 GLN A 35 29.228 22.088 -6.090 1.00 27.56 H new ATOM 0 HG2 GLN A 35 27.831 24.067 -5.818 1.00 33.07 H new ATOM 0 HG3 GLN A 35 28.071 24.014 -4.278 1.00 33.07 H new ATOM 0 HE21 GLN A 35 30.991 23.146 -5.061 1.00 41.48 H new ATOM 0 HE22 GLN A 35 31.641 24.434 -5.430 1.00 41.48 H new ATOM 271 N ARG A 36 26.327 22.060 -7.157 1.00 26.23 N ATOM 272 CA ARG A 36 25.289 22.687 -8.006 1.00 25.98 C ATOM 273 C ARG A 36 23.928 22.080 -7.716 1.00 24.13 C ATOM 274 O ARG A 36 22.977 22.916 -7.608 1.00 24.46 O ATOM 275 CB ARG A 36 25.787 22.471 -9.403 1.00 28.73 C ATOM 276 CG ARG A 36 24.792 23.084 -10.474 1.00 34.67 C ATOM 277 CD ARG A 36 25.436 22.806 -11.813 1.00 34.84 C ATOM 278 NE ARG A 36 25.489 21.471 -12.468 1.00 37.56 N ATOM 279 CZ ARG A 36 24.379 20.804 -12.875 1.00 38.88 C ATOM 280 NH1 ARG A 36 23.095 21.226 -12.738 1.00 40.36 N ATOM 281 NH2 ARG A 36 24.489 19.560 -13.514 1.00 38.18 N ATOM 0 H ARG A 36 26.913 21.593 -7.579 1.00 26.23 H new ATOM 0 HA ARG A 36 25.155 23.634 -7.842 1.00 25.98 H new ATOM 0 HB2 ARG A 36 26.662 22.877 -9.502 1.00 28.73 H new ATOM 0 HB3 ARG A 36 25.895 21.521 -9.566 1.00 28.73 H new ATOM 0 HG2 ARG A 36 23.915 22.673 -10.414 1.00 34.67 H new ATOM 0 HG3 ARG A 36 24.669 24.036 -10.334 1.00 34.67 H new ATOM 0 HD2 ARG A 36 25.001 23.398 -12.447 1.00 34.84 H new ATOM 0 HD3 ARG A 36 26.356 23.102 -11.734 1.00 34.84 H new ATOM 0 HE ARG A 36 26.257 21.106 -12.594 1.00 37.56 H new ATOM 0 HH11 ARG A 36 22.928 21.982 -12.363 1.00 40.36 H new ATOM 0 HH12 ARG A 36 22.449 20.737 -13.026 1.00 40.36 H new ATOM 0 HH21 ARG A 36 25.264 19.214 -13.651 1.00 38.18 H new ATOM 0 HH22 ARG A 36 23.781 19.143 -13.769 1.00 38.18 H new ATOM 282 N MET A 37 23.737 20.776 -7.570 1.00 24.33 N ATOM 283 CA MET A 37 22.464 20.094 -7.395 1.00 26.39 C ATOM 284 C MET A 37 21.794 20.528 -6.045 1.00 24.04 C ATOM 285 O MET A 37 20.647 20.926 -5.918 1.00 21.85 O ATOM 286 CB MET A 37 22.586 18.553 -7.556 1.00 27.43 C ATOM 287 CG MET A 37 22.916 18.060 -8.927 1.00 30.29 C ATOM 288 SD MET A 37 21.682 18.653 -10.154 1.00 35.23 S ATOM 289 CE MET A 37 22.009 20.299 -10.554 1.00 35.55 C ATOM 0 H MET A 37 24.398 20.226 -7.571 1.00 24.33 H new ATOM 0 HA MET A 37 21.872 20.371 -8.112 1.00 26.39 H new ATOM 0 HB2 MET A 37 23.269 18.235 -6.945 1.00 27.43 H new ATOM 0 HB3 MET A 37 21.748 18.150 -7.280 1.00 27.43 H new ATOM 0 HG2 MET A 37 23.801 18.365 -9.180 1.00 30.29 H new ATOM 0 HG3 MET A 37 22.939 17.090 -8.929 1.00 30.29 H new ATOM 0 HE1 MET A 37 21.614 20.508 -11.415 1.00 35.55 H new ATOM 0 HE2 MET A 37 21.630 20.879 -9.875 1.00 35.55 H new ATOM 0 HE3 MET A 37 22.968 20.437 -10.597 1.00 35.55 H new ATOM 290 N THR A 38 22.684 20.397 -4.994 1.00 24.28 N ATOM 291 CA THR A 38 22.201 20.742 -3.647 1.00 22.45 C ATOM 292 C THR A 38 21.968 22.272 -3.389 1.00 22.17 C ATOM 293 O THR A 38 21.059 22.550 -2.591 1.00 24.56 O ATOM 294 CB THR A 38 23.113 20.119 -2.485 1.00 19.93 C ATOM 295 OG1 THR A 38 24.494 20.579 -2.593 1.00 20.57 O ATOM 296 CG2 THR A 38 23.195 18.596 -2.573 1.00 19.48 C ATOM 0 H THR A 38 23.500 20.131 -5.051 1.00 24.28 H new ATOM 0 HA THR A 38 21.324 20.329 -3.617 1.00 22.45 H new ATOM 0 HB THR A 38 22.696 20.403 -1.656 1.00 19.93 H new ATOM 0 HG1 THR A 38 24.841 20.265 -3.291 1.00 20.57 H new ATOM 0 HG21 THR A 38 23.754 18.260 -1.855 1.00 19.48 H new ATOM 0 HG22 THR A 38 22.305 18.219 -2.493 1.00 19.48 H new ATOM 0 HG23 THR A 38 23.578 18.341 -3.427 1.00 19.48 H new ATOM 297 N THR A 39 22.738 23.109 -3.993 1.00 25.90 N ATOM 298 CA THR A 39 22.595 24.575 -3.781 1.00 28.44 C ATOM 299 C THR A 39 21.421 25.219 -4.602 1.00 31.57 C ATOM 300 O THR A 39 20.657 26.072 -4.125 1.00 34.00 O ATOM 301 CB THR A 39 23.906 25.360 -4.155 1.00 29.47 C ATOM 302 OG1 THR A 39 24.966 24.713 -3.316 1.00 31.80 O ATOM 303 CG2 THR A 39 23.928 26.885 -3.781 1.00 31.65 C ATOM 0 H THR A 39 23.363 22.884 -4.539 1.00 25.90 H new ATOM 0 HA THR A 39 22.404 24.655 -2.833 1.00 28.44 H new ATOM 0 HB THR A 39 24.010 25.322 -5.119 1.00 29.47 H new ATOM 0 HG1 THR A 39 25.291 24.059 -3.731 1.00 31.80 H new ATOM 0 HG21 THR A 39 24.775 27.273 -4.052 1.00 31.65 H new ATOM 0 HG22 THR A 39 23.203 27.341 -4.237 1.00 31.65 H new ATOM 0 HG23 THR A 39 23.820 26.985 -2.822 1.00 31.65 H new ATOM 304 N THR A 40 21.228 24.723 -5.809 1.00 30.30 N ATOM 305 CA THR A 40 20.134 25.397 -6.599 1.00 31.83 C ATOM 306 C THR A 40 18.739 25.241 -6.108 1.00 30.82 C ATOM 307 O THR A 40 18.146 24.160 -6.194 1.00 32.07 O ATOM 308 CB THR A 40 20.414 24.934 -8.104 1.00 31.00 C ATOM 309 OG1 THR A 40 21.755 25.450 -8.297 1.00 33.53 O ATOM 310 CG2 THR A 40 19.390 25.640 -9.027 1.00 34.24 C ATOM 0 H THR A 40 21.649 24.073 -6.182 1.00 30.30 H new ATOM 0 HA THR A 40 20.177 26.361 -6.499 1.00 31.83 H new ATOM 0 HB THR A 40 20.337 23.984 -8.287 1.00 31.00 H new ATOM 0 HG1 THR A 40 22.314 24.840 -8.153 1.00 33.53 H new ATOM 0 HG21 THR A 40 19.544 25.371 -9.946 1.00 34.24 H new ATOM 0 HG22 THR A 40 18.491 25.390 -8.764 1.00 34.24 H new ATOM 0 HG23 THR A 40 19.494 26.601 -8.950 1.00 34.24 H new ATOM 311 N SER A 41 18.079 26.407 -5.849 0.50 31.25 N ATOM 312 CA SER A 41 16.690 26.433 -5.450 0.50 31.80 C ATOM 313 C SER A 41 15.779 26.924 -6.583 0.50 37.49 C ATOM 314 O SER A 41 16.028 28.026 -7.107 0.50 34.92 O ATOM 315 CB SER A 41 16.294 27.298 -4.243 0.50 32.49 C ATOM 316 OG SER A 41 14.843 27.162 -4.215 0.50 33.53 O ATOM 0 H SER A 41 18.443 27.184 -5.906 0.50 31.25 H new ATOM 0 HA SER A 41 16.572 25.502 -5.204 0.50 31.80 H new ATOM 0 HB2 SER A 41 16.702 26.980 -3.422 0.50 32.49 H new ATOM 0 HB3 SER A 41 16.567 28.222 -4.356 0.50 32.49 H new ATOM 0 HG SER A 41 14.635 26.356 -4.327 0.50 33.53 H new ATOM 317 N SER A 42 14.745 26.120 -6.779 0.50 36.10 N ATOM 318 CA SER A 42 13.722 26.378 -7.771 0.50 36.22 C ATOM 319 C SER A 42 12.823 27.578 -7.427 0.50 37.01 C ATOM 320 O SER A 42 12.290 27.961 -8.482 0.50 37.57 O ATOM 321 CB SER A 42 12.706 25.187 -7.927 0.50 36.77 C ATOM 322 OG SER A 42 12.451 24.771 -6.560 0.50 37.11 O ATOM 0 H SER A 42 14.618 25.397 -6.330 0.50 36.10 H new ATOM 0 HA SER A 42 14.242 26.532 -8.575 0.50 36.22 H new ATOM 0 HB2 SER A 42 11.891 25.469 -8.371 0.50 36.77 H new ATOM 0 HB3 SER A 42 13.081 24.465 -8.455 0.50 36.77 H new ATOM 0 HG SER A 42 12.729 25.361 -6.031 0.50 37.11 H new ATOM 323 N VAL A 43 12.672 28.083 -6.230 0.50 36.79 N ATOM 324 CA VAL A 43 11.831 29.203 -5.812 0.50 36.95 C ATOM 325 C VAL A 43 12.568 30.444 -5.285 0.50 37.31 C ATOM 326 O VAL A 43 13.712 30.437 -4.832 0.50 38.80 O ATOM 327 CB VAL A 43 10.823 28.723 -4.710 0.50 35.43 C ATOM 328 CG1 VAL A 43 10.182 29.934 -3.997 0.50 35.30 C ATOM 329 CG2 VAL A 43 9.721 27.806 -5.196 0.50 34.95 C ATOM 0 H VAL A 43 13.100 27.752 -5.562 0.50 36.79 H new ATOM 0 HA VAL A 43 11.388 29.487 -6.627 0.50 36.95 H new ATOM 0 HB VAL A 43 11.365 28.198 -4.101 0.50 35.43 H new ATOM 0 HG11 VAL A 43 9.562 29.620 -3.320 0.50 35.30 H new ATOM 0 HG12 VAL A 43 10.875 30.467 -3.578 0.50 35.30 H new ATOM 0 HG13 VAL A 43 9.705 30.476 -4.645 0.50 35.30 H new ATOM 0 HG21 VAL A 43 9.150 27.562 -4.451 0.50 34.95 H new ATOM 0 HG22 VAL A 43 9.194 28.262 -5.871 0.50 34.95 H new ATOM 0 HG23 VAL A 43 10.112 27.005 -5.579 0.50 34.95 H new ATOM 330 N GLU A 44 11.934 31.616 -5.272 0.50 38.02 N ATOM 331 CA GLU A 44 12.593 32.873 -4.847 0.50 38.49 C ATOM 332 C GLU A 44 12.652 33.205 -3.422 0.50 35.42 C ATOM 333 O GLU A 44 11.486 33.137 -2.980 0.50 35.98 O ATOM 334 CB GLU A 44 11.852 34.140 -5.322 0.50 38.28 C ATOM 335 CG GLU A 44 11.623 34.628 -6.697 0.50 41.14 C ATOM 336 CD GLU A 44 12.517 35.792 -7.154 0.50 40.33 C ATOM 337 OE1 GLU A 44 12.915 36.671 -6.390 0.50 41.54 O ATOM 338 OE2 GLU A 44 12.700 35.628 -8.401 0.50 41.16 O ATOM 0 H GLU A 44 11.112 31.714 -5.507 0.50 38.02 H new ATOM 0 HA GLU A 44 13.466 32.676 -5.220 0.50 38.49 H new ATOM 0 HB2 GLU A 44 10.966 34.068 -4.934 0.50 38.28 H new ATOM 0 HB3 GLU A 44 12.300 34.872 -4.871 0.50 38.28 H new ATOM 0 HG2 GLU A 44 11.749 33.887 -7.310 0.50 41.14 H new ATOM 0 HG3 GLU A 44 10.697 34.905 -6.773 0.50 41.14 H new ATOM 339 N GLY A 45 13.844 33.577 -2.952 0.50 34.94 N ATOM 340 CA GLY A 45 13.784 33.924 -1.497 0.50 33.31 C ATOM 341 C GLY A 45 13.814 32.596 -0.745 0.50 35.26 C ATOM 342 O GLY A 45 13.597 32.716 0.468 0.50 33.66 O ATOM 0 H GLY A 45 14.596 33.636 -3.366 0.50 34.94 H new ATOM 0 HA2 GLY A 45 14.534 34.484 -1.243 0.50 33.31 H new ATOM 0 HA3 GLY A 45 12.977 34.421 -1.292 0.50 33.31 H new ATOM 343 N LYS A 46 14.081 31.485 -1.409 0.50 33.74 N ATOM 344 CA LYS A 46 14.133 30.142 -0.736 0.50 31.98 C ATOM 345 C LYS A 46 15.542 29.534 -0.987 0.50 34.04 C ATOM 346 O LYS A 46 16.284 29.795 -1.954 0.50 34.02 O ATOM 347 CB LYS A 46 13.032 29.200 -1.068 0.50 35.06 C ATOM 348 CG LYS A 46 11.611 29.444 -0.540 0.50 35.10 C ATOM 349 CD LYS A 46 10.661 28.306 -0.899 0.50 36.21 C ATOM 350 CE LYS A 46 9.280 28.418 -0.288 0.50 36.60 C ATOM 351 NZ LYS A 46 8.406 27.325 -0.840 0.50 37.75 N ATOM 0 H LYS A 46 14.239 31.461 -2.254 0.50 33.74 H new ATOM 0 HA LYS A 46 13.984 30.291 0.211 0.50 31.98 H new ATOM 0 HB2 LYS A 46 12.974 29.157 -2.035 0.50 35.06 H new ATOM 0 HB3 LYS A 46 13.305 28.321 -0.760 0.50 35.06 H new ATOM 0 HG2 LYS A 46 11.639 29.548 0.424 0.50 35.10 H new ATOM 0 HG3 LYS A 46 11.270 30.275 -0.905 0.50 35.10 H new ATOM 0 HD2 LYS A 46 10.572 28.267 -1.864 0.50 36.21 H new ATOM 0 HD3 LYS A 46 11.059 27.468 -0.617 0.50 36.21 H new ATOM 0 HE2 LYS A 46 9.335 28.347 0.678 0.50 36.60 H new ATOM 0 HE3 LYS A 46 8.896 29.286 -0.487 0.50 36.60 H new ATOM 0 HZ1 LYS A 46 7.593 27.387 -0.484 0.50 37.75 H new ATOM 0 HZ2 LYS A 46 8.349 27.408 -1.724 0.50 37.75 H new ATOM 0 HZ3 LYS A 46 8.758 26.533 -0.639 0.50 37.75 H new ATOM 352 N GLN A 47 15.940 28.739 -0.013 1.00 33.85 N ATOM 353 CA GLN A 47 17.144 27.911 0.162 1.00 34.27 C ATOM 354 C GLN A 47 16.834 26.391 0.319 1.00 28.36 C ATOM 355 O GLN A 47 15.831 25.941 0.893 1.00 31.25 O ATOM 356 CB GLN A 47 18.060 28.119 1.482 1.00 35.34 C ATOM 357 CG GLN A 47 19.314 28.883 0.926 1.00 40.37 C ATOM 358 CD GLN A 47 19.924 29.495 2.187 1.00 41.37 C ATOM 359 OE1 GLN A 47 19.502 29.043 3.212 1.00 44.61 O ATOM 360 NE2 GLN A 47 20.650 30.573 2.165 1.00 43.99 N ATOM 0 H GLN A 47 15.434 28.653 0.677 1.00 33.85 H new ATOM 0 HA GLN A 47 17.601 28.198 -0.644 1.00 34.27 H new ATOM 0 HB2 GLN A 47 17.598 28.634 2.162 1.00 35.34 H new ATOM 0 HB3 GLN A 47 18.306 27.272 1.886 1.00 35.34 H new ATOM 0 HG2 GLN A 47 19.933 28.283 0.481 1.00 40.37 H new ATOM 0 HG3 GLN A 47 19.064 29.563 0.280 1.00 40.37 H new ATOM 0 HE21 GLN A 47 20.942 30.879 1.416 1.00 43.99 H new ATOM 0 HE22 GLN A 47 20.838 30.980 2.899 1.00 43.99 H new ATOM 361 N ASN A 48 17.734 25.554 -0.028 1.00 27.66 N ATOM 362 CA ASN A 48 17.635 24.070 0.096 1.00 25.76 C ATOM 363 C ASN A 48 18.125 23.591 1.582 1.00 25.77 C ATOM 364 O ASN A 48 19.109 24.169 2.007 1.00 27.44 O ATOM 365 CB ASN A 48 18.427 23.347 -0.940 1.00 27.30 C ATOM 366 CG ASN A 48 17.862 23.435 -2.455 1.00 27.35 C ATOM 367 OD1 ASN A 48 16.753 23.789 -2.479 1.00 29.82 O ATOM 368 ND2 ASN A 48 18.695 23.138 -3.448 1.00 28.05 N ATOM 0 H ASN A 48 18.482 25.807 -0.368 1.00 27.66 H new ATOM 0 HA ASN A 48 16.701 23.844 -0.040 1.00 25.76 H new ATOM 0 HB2 ASN A 48 19.332 23.695 -0.931 1.00 27.30 H new ATOM 0 HB3 ASN A 48 18.480 22.412 -0.687 1.00 27.30 H new ATOM 0 HD21 ASN A 48 18.430 23.198 -4.264 1.00 28.05 H new ATOM 0 HD22 ASN A 48 19.499 22.886 -3.274 1.00 28.05 H new ATOM 369 N LEU A 49 17.536 22.605 2.031 1.00 26.35 N ATOM 370 CA LEU A 49 17.983 21.899 3.350 1.00 26.89 C ATOM 371 C LEU A 49 18.924 20.722 3.017 1.00 25.68 C ATOM 372 O LEU A 49 18.569 19.829 2.196 1.00 26.61 O ATOM 373 CB LEU A 49 16.807 21.587 4.205 1.00 29.96 C ATOM 374 CG LEU A 49 17.105 20.652 5.431 1.00 30.52 C ATOM 375 CD1 LEU A 49 17.589 21.658 6.445 1.00 30.41 C ATOM 376 CD2 LEU A 49 15.644 20.198 5.796 1.00 32.45 C ATOM 0 H LEU A 49 16.851 22.246 1.654 1.00 26.35 H new ATOM 0 HA LEU A 49 18.515 22.492 3.903 1.00 26.89 H new ATOM 0 HB2 LEU A 49 16.434 22.420 4.534 1.00 29.96 H new ATOM 0 HB3 LEU A 49 16.126 21.169 3.655 1.00 29.96 H new ATOM 0 HG LEU A 49 17.717 19.905 5.336 1.00 30.52 H new ATOM 0 HD11 LEU A 49 17.813 21.202 7.272 1.00 30.41 H new ATOM 0 HD12 LEU A 49 18.375 22.111 6.102 1.00 30.41 H new ATOM 0 HD13 LEU A 49 16.890 22.309 6.614 1.00 30.41 H new ATOM 0 HD21 LEU A 49 15.672 19.599 6.558 1.00 32.45 H new ATOM 0 HD22 LEU A 49 15.109 20.976 6.017 1.00 32.45 H new ATOM 0 HD23 LEU A 49 15.249 19.739 5.039 1.00 32.45 H new ATOM 377 N VAL A 50 20.065 20.556 3.686 1.00 24.64 N ATOM 378 CA VAL A 50 21.005 19.409 3.444 1.00 21.10 C ATOM 379 C VAL A 50 20.966 18.632 4.709 1.00 23.98 C ATOM 380 O VAL A 50 21.210 19.300 5.782 1.00 23.01 O ATOM 381 CB VAL A 50 22.382 19.629 2.751 1.00 22.52 C ATOM 382 CG1 VAL A 50 22.129 20.259 1.402 1.00 23.49 C ATOM 383 CG2 VAL A 50 23.361 20.519 3.554 1.00 24.74 C ATOM 0 H VAL A 50 20.333 21.097 4.298 1.00 24.64 H new ATOM 0 HA VAL A 50 20.693 18.897 2.682 1.00 21.10 H new ATOM 0 HB VAL A 50 22.810 18.761 2.679 1.00 22.52 H new ATOM 0 HG11 VAL A 50 22.974 20.406 0.950 1.00 23.49 H new ATOM 0 HG12 VAL A 50 21.575 19.668 0.868 1.00 23.49 H new ATOM 0 HG13 VAL A 50 21.674 21.108 1.521 1.00 23.49 H new ATOM 0 HG21 VAL A 50 24.192 20.611 3.063 1.00 24.74 H new ATOM 0 HG22 VAL A 50 22.967 21.395 3.688 1.00 24.74 H new ATOM 0 HG23 VAL A 50 23.538 20.110 4.415 1.00 24.74 H new ATOM 384 N ILE A 51 20.635 17.393 4.716 1.00 20.57 N ATOM 385 CA ILE A 51 20.525 16.479 5.867 1.00 22.01 C ATOM 386 C ILE A 51 21.651 15.374 5.768 1.00 22.62 C ATOM 387 O ILE A 51 21.815 14.638 4.736 1.00 25.47 O ATOM 388 CB ILE A 51 19.089 15.891 5.995 1.00 22.52 C ATOM 389 CG1 ILE A 51 17.932 16.933 6.301 1.00 19.54 C ATOM 390 CG2 ILE A 51 19.255 14.631 7.095 1.00 24.62 C ATOM 391 CD1 ILE A 51 16.512 16.296 6.281 1.00 21.39 C ATOM 0 H ILE A 51 20.441 16.990 3.981 1.00 20.57 H new ATOM 0 HA ILE A 51 20.671 16.972 6.689 1.00 22.01 H new ATOM 0 HB ILE A 51 18.762 15.572 5.139 1.00 22.52 H new ATOM 0 HG12 ILE A 51 18.088 17.334 7.170 1.00 19.54 H new ATOM 0 HG13 ILE A 51 17.968 17.649 5.647 1.00 19.54 H new ATOM 0 HG21 ILE A 51 18.394 14.206 7.233 1.00 24.62 H new ATOM 0 HG22 ILE A 51 19.885 13.980 6.749 1.00 24.62 H new ATOM 0 HG23 ILE A 51 19.582 14.979 7.939 1.00 24.62 H new ATOM 0 HD11 ILE A 51 15.849 16.977 6.474 1.00 21.39 H new ATOM 0 HD12 ILE A 51 16.340 15.916 5.405 1.00 21.39 H new ATOM 0 HD13 ILE A 51 16.461 15.597 6.952 1.00 21.39 H new ATOM 392 N MET A 52 22.452 15.264 6.782 1.00 23.19 N ATOM 393 CA MET A 52 23.563 14.261 6.864 1.00 19.20 C ATOM 394 C MET A 52 23.799 13.593 8.308 1.00 21.89 C ATOM 395 O MET A 52 23.468 14.362 9.229 1.00 22.52 O ATOM 396 CB MET A 52 24.829 14.944 6.442 1.00 20.00 C ATOM 397 CG MET A 52 25.479 15.921 7.372 1.00 21.04 C ATOM 398 SD MET A 52 26.592 17.009 6.449 1.00 26.23 S ATOM 399 CE MET A 52 25.439 18.292 5.920 1.00 25.12 C ATOM 0 H MET A 52 22.394 15.766 7.478 1.00 23.19 H new ATOM 0 HA MET A 52 23.305 13.528 6.284 1.00 19.20 H new ATOM 0 HB2 MET A 52 25.480 14.253 6.243 1.00 20.00 H new ATOM 0 HB3 MET A 52 24.646 15.410 5.611 1.00 20.00 H new ATOM 0 HG2 MET A 52 24.802 16.448 7.825 1.00 21.04 H new ATOM 0 HG3 MET A 52 25.974 15.446 8.058 1.00 21.04 H new ATOM 0 HE1 MET A 52 25.914 18.960 5.401 1.00 25.12 H new ATOM 0 HE2 MET A 52 24.741 17.896 5.375 1.00 25.12 H new ATOM 0 HE3 MET A 52 25.042 18.711 6.699 1.00 25.12 H new ATOM 400 N GLY A 53 24.332 12.374 8.315 1.00 19.91 N ATOM 401 CA GLY A 53 24.792 11.697 9.571 1.00 19.74 C ATOM 402 C GLY A 53 26.057 12.432 9.888 1.00 17.07 C ATOM 403 O GLY A 53 26.710 13.382 9.392 1.00 18.37 O ATOM 0 H GLY A 53 24.445 11.903 7.604 1.00 19.91 H new ATOM 0 HA2 GLY A 53 24.139 11.776 10.284 1.00 19.74 H new ATOM 0 HA3 GLY A 53 24.949 10.750 9.434 1.00 19.74 H new ATOM 404 N LYS A 54 26.429 12.194 11.238 1.00 18.95 N ATOM 405 CA LYS A 54 27.580 12.832 11.819 1.00 17.88 C ATOM 406 C LYS A 54 28.940 12.496 11.266 1.00 16.34 C ATOM 407 O LYS A 54 29.848 13.327 11.093 1.00 18.29 O ATOM 408 CB LYS A 54 27.488 12.294 13.355 1.00 22.53 C ATOM 409 CG LYS A 54 28.685 12.972 14.065 1.00 23.76 C ATOM 410 CD LYS A 54 28.649 12.557 15.562 1.00 27.86 C ATOM 411 CE LYS A 54 28.776 11.052 15.842 1.00 29.72 C ATOM 412 NZ LYS A 54 28.776 10.358 17.150 1.00 27.43 N ATOM 0 H LYS A 54 26.002 11.671 11.771 1.00 18.95 H new ATOM 0 HA LYS A 54 27.535 13.787 11.655 1.00 17.88 H new ATOM 0 HB2 LYS A 54 26.645 12.540 13.767 1.00 22.53 H new ATOM 0 HB3 LYS A 54 27.552 11.327 13.397 1.00 22.53 H new ATOM 0 HG2 LYS A 54 29.521 12.698 13.657 1.00 23.76 H new ATOM 0 HG3 LYS A 54 28.629 13.937 13.979 1.00 23.76 H new ATOM 0 HD2 LYS A 54 29.367 13.017 16.025 1.00 27.86 H new ATOM 0 HD3 LYS A 54 27.816 12.871 15.947 1.00 27.86 H new ATOM 0 HE2 LYS A 54 28.055 10.641 15.339 1.00 29.72 H new ATOM 0 HE3 LYS A 54 29.606 10.786 15.416 1.00 29.72 H new ATOM 0 HZ1 LYS A 54 29.258 9.612 17.091 1.00 27.43 H new ATOM 0 HZ2 LYS A 54 29.130 10.891 17.769 1.00 27.43 H new ATOM 0 HZ3 LYS A 54 27.940 10.153 17.378 1.00 27.43 H new ATOM 413 N LYS A 55 29.122 11.188 10.854 1.00 18.60 N ATOM 414 CA LYS A 55 30.451 10.883 10.239 1.00 21.94 C ATOM 415 C LYS A 55 30.508 11.540 8.889 1.00 21.04 C ATOM 416 O LYS A 55 31.618 11.948 8.552 1.00 19.75 O ATOM 417 CB LYS A 55 30.623 9.337 10.097 1.00 22.51 C ATOM 418 CG LYS A 55 32.080 9.041 9.565 1.00 25.50 C ATOM 419 CD LYS A 55 32.194 7.492 9.621 1.00 26.86 C ATOM 420 CE LYS A 55 33.532 7.169 8.967 1.00 27.05 C ATOM 421 NZ LYS A 55 33.713 5.649 9.253 1.00 26.86 N ATOM 0 H LYS A 55 28.558 10.542 10.914 1.00 18.60 H new ATOM 0 HA LYS A 55 31.168 11.220 10.799 1.00 21.94 H new ATOM 0 HB2 LYS A 55 30.482 8.902 10.953 1.00 22.51 H new ATOM 0 HB3 LYS A 55 29.961 8.979 9.484 1.00 22.51 H new ATOM 0 HG2 LYS A 55 32.203 9.374 8.662 1.00 25.50 H new ATOM 0 HG3 LYS A 55 32.753 9.467 10.118 1.00 25.50 H new ATOM 0 HD2 LYS A 55 32.164 7.171 10.536 1.00 26.86 H new ATOM 0 HD3 LYS A 55 31.461 7.069 9.148 1.00 26.86 H new ATOM 0 HE2 LYS A 55 33.519 7.355 8.015 1.00 27.05 H new ATOM 0 HE3 LYS A 55 34.253 7.693 9.349 1.00 27.05 H new ATOM 0 HZ1 LYS A 55 34.481 5.370 8.901 1.00 26.86 H new ATOM 0 HZ2 LYS A 55 33.722 5.511 10.132 1.00 26.86 H new ATOM 0 HZ3 LYS A 55 33.039 5.196 8.889 1.00 26.86 H new ATOM 422 N THR A 56 29.342 11.744 8.145 1.00 21.56 N ATOM 423 CA THR A 56 29.403 12.528 6.887 1.00 18.77 C ATOM 424 C THR A 56 29.795 13.996 7.081 1.00 19.72 C ATOM 425 O THR A 56 30.729 14.571 6.542 1.00 18.45 O ATOM 426 CB THR A 56 28.033 12.451 6.008 1.00 19.52 C ATOM 427 OG1 THR A 56 28.094 11.007 5.776 1.00 19.47 O ATOM 428 CG2 THR A 56 28.227 13.360 4.800 1.00 19.54 C ATOM 0 H THR A 56 28.563 11.446 8.356 1.00 21.56 H new ATOM 0 HA THR A 56 30.115 12.093 6.392 1.00 18.77 H new ATOM 0 HB THR A 56 27.176 12.742 6.357 1.00 19.52 H new ATOM 0 HG1 THR A 56 27.818 10.602 6.458 1.00 19.47 H new ATOM 0 HG21 THR A 56 27.429 13.341 4.249 1.00 19.54 H new ATOM 0 HG22 THR A 56 28.391 14.268 5.101 1.00 19.54 H new ATOM 0 HG23 THR A 56 28.985 13.050 4.280 1.00 19.54 H new ATOM 429 N TRP A 57 29.219 14.682 8.110 1.00 19.42 N ATOM 430 CA TRP A 57 29.600 16.002 8.472 1.00 21.15 C ATOM 431 C TRP A 57 31.135 16.096 8.670 1.00 20.64 C ATOM 432 O TRP A 57 31.801 17.149 8.202 1.00 23.51 O ATOM 433 CB TRP A 57 28.828 16.408 9.774 1.00 19.14 C ATOM 434 CG TRP A 57 29.419 17.756 10.306 1.00 20.65 C ATOM 435 CD1 TRP A 57 30.199 17.916 11.458 1.00 22.10 C ATOM 436 CD2 TRP A 57 29.058 19.094 9.882 1.00 21.82 C ATOM 437 NE1 TRP A 57 30.408 19.269 11.657 1.00 21.03 N ATOM 438 CE2 TRP A 57 29.748 20.050 10.717 1.00 23.99 C ATOM 439 CE3 TRP A 57 28.233 19.642 8.835 1.00 23.31 C ATOM 440 CZ2 TRP A 57 29.596 21.451 10.592 1.00 23.41 C ATOM 441 CZ3 TRP A 57 28.122 21.053 8.704 1.00 24.13 C ATOM 442 CH2 TRP A 57 28.776 21.988 9.550 1.00 21.77 C ATOM 0 H TRP A 57 28.592 14.356 8.600 1.00 19.42 H new ATOM 0 HA TRP A 57 29.368 16.619 7.760 1.00 21.15 H new ATOM 0 HB2 TRP A 57 27.881 16.506 9.587 1.00 19.14 H new ATOM 0 HB3 TRP A 57 28.914 15.714 10.446 1.00 19.14 H new ATOM 0 HD1 TRP A 57 30.521 17.230 11.997 1.00 22.10 H new ATOM 0 HE1 TRP A 57 30.892 19.590 12.291 1.00 21.03 H new ATOM 0 HE3 TRP A 57 27.778 19.079 8.251 1.00 23.31 H new ATOM 0 HZ2 TRP A 57 30.028 22.022 11.186 1.00 23.41 H new ATOM 0 HZ3 TRP A 57 27.587 21.386 8.020 1.00 24.13 H new ATOM 0 HH2 TRP A 57 28.676 22.905 9.432 1.00 21.77 H new ATOM 443 N PHE A 58 31.768 15.318 9.470 1.00 23.07 N ATOM 444 CA PHE A 58 33.210 15.237 9.831 1.00 23.25 C ATOM 445 C PHE A 58 34.070 14.812 8.615 1.00 25.24 C ATOM 446 O PHE A 58 35.216 15.347 8.770 1.00 28.72 O ATOM 447 CB PHE A 58 33.502 14.481 11.157 1.00 22.94 C ATOM 448 CG PHE A 58 32.999 15.362 12.362 1.00 19.28 C ATOM 449 CD1 PHE A 58 33.686 16.521 12.589 1.00 23.32 C ATOM 450 CD2 PHE A 58 31.935 14.971 13.049 1.00 21.71 C ATOM 451 CE1 PHE A 58 33.250 17.376 13.631 1.00 23.80 C ATOM 452 CE2 PHE A 58 31.431 15.724 14.129 1.00 21.57 C ATOM 453 CZ PHE A 58 32.207 16.839 14.452 1.00 23.81 C ATOM 0 H PHE A 58 31.327 14.718 9.900 1.00 23.07 H new ATOM 0 HA PHE A 58 33.497 16.137 10.053 1.00 23.25 H new ATOM 0 HB2 PHE A 58 33.054 13.621 11.159 1.00 22.94 H new ATOM 0 HB3 PHE A 58 34.452 14.306 11.242 1.00 22.94 H new ATOM 0 HD1 PHE A 58 34.425 16.744 12.070 1.00 23.32 H new ATOM 0 HD2 PHE A 58 31.510 14.179 12.812 1.00 21.71 H new ATOM 0 HE1 PHE A 58 33.613 18.221 13.771 1.00 23.80 H new ATOM 0 HE2 PHE A 58 30.652 15.499 14.585 1.00 21.57 H new ATOM 0 HZ PHE A 58 32.034 17.265 15.261 1.00 23.81 H new ATOM 454 N SER A 59 33.475 14.239 7.572 1.00 25.84 N ATOM 455 CA SER A 59 34.329 14.045 6.353 1.00 27.29 C ATOM 456 C SER A 59 34.303 15.316 5.456 1.00 26.49 C ATOM 457 O SER A 59 35.090 15.289 4.472 1.00 29.20 O ATOM 458 CB SER A 59 33.837 12.774 5.765 1.00 27.69 C ATOM 459 OG SER A 59 32.688 12.905 5.090 1.00 28.60 O ATOM 0 H SER A 59 32.659 13.971 7.526 1.00 25.84 H new ATOM 0 HA SER A 59 35.280 13.952 6.519 1.00 27.29 H new ATOM 0 HB2 SER A 59 34.515 12.418 5.169 1.00 27.69 H new ATOM 0 HB3 SER A 59 33.714 12.124 6.475 1.00 27.69 H new ATOM 0 HG SER A 59 32.151 13.371 5.538 1.00 28.60 H new ATOM 460 N ILE A 60 33.628 16.418 5.631 1.00 24.94 N ATOM 461 CA ILE A 60 33.685 17.583 4.765 1.00 27.02 C ATOM 462 C ILE A 60 34.888 18.366 5.293 1.00 28.24 C ATOM 463 O ILE A 60 35.021 18.556 6.518 1.00 29.51 O ATOM 464 CB ILE A 60 32.385 18.487 4.815 1.00 26.66 C ATOM 465 CG1 ILE A 60 31.153 17.673 4.382 1.00 28.76 C ATOM 466 CG2 ILE A 60 32.483 19.712 3.904 1.00 25.99 C ATOM 467 CD1 ILE A 60 29.826 18.222 4.896 1.00 29.75 C ATOM 0 H ILE A 60 33.090 16.523 6.294 1.00 24.94 H new ATOM 0 HA ILE A 60 33.755 17.315 3.835 1.00 27.02 H new ATOM 0 HB ILE A 60 32.300 18.789 5.733 1.00 26.66 H new ATOM 0 HG12 ILE A 60 31.124 17.641 3.413 1.00 28.76 H new ATOM 0 HG13 ILE A 60 31.256 16.760 4.693 1.00 28.76 H new ATOM 0 HG21 ILE A 60 31.666 20.231 3.970 1.00 25.99 H new ATOM 0 HG22 ILE A 60 33.236 20.259 4.177 1.00 25.99 H new ATOM 0 HG23 ILE A 60 32.609 19.424 2.986 1.00 25.99 H new ATOM 0 HD11 ILE A 60 29.100 17.659 4.584 1.00 29.75 H new ATOM 0 HD12 ILE A 60 29.833 18.231 5.866 1.00 29.75 H new ATOM 0 HD13 ILE A 60 29.700 19.125 4.566 1.00 29.75 H new ATOM 468 N PRO A 61 35.841 18.812 4.461 1.00 28.57 N ATOM 469 CA PRO A 61 36.966 19.582 4.965 1.00 28.93 C ATOM 470 C PRO A 61 36.439 20.782 5.733 1.00 32.81 C ATOM 471 O PRO A 61 35.436 21.423 5.298 1.00 32.51 O ATOM 472 CB PRO A 61 37.777 19.889 3.724 1.00 31.09 C ATOM 473 CG PRO A 61 37.078 19.241 2.536 1.00 27.64 C ATOM 474 CD PRO A 61 35.822 18.580 3.018 1.00 27.53 C ATOM 0 HA PRO A 61 37.536 19.131 5.608 1.00 28.93 H new ATOM 0 HB2 PRO A 61 37.849 20.848 3.594 1.00 31.09 H new ATOM 0 HB3 PRO A 61 38.680 19.546 3.815 1.00 31.09 H new ATOM 0 HG2 PRO A 61 36.870 19.908 1.864 1.00 27.64 H new ATOM 0 HG3 PRO A 61 37.662 18.589 2.117 1.00 27.64 H new ATOM 0 HD2 PRO A 61 35.034 18.967 2.605 1.00 27.53 H new ATOM 0 HD3 PRO A 61 35.815 17.633 2.809 1.00 27.53 H new ATOM 475 N GLU A 62 37.102 21.054 6.841 1.00 32.03 N ATOM 476 CA GLU A 62 36.722 22.115 7.792 1.00 34.86 C ATOM 477 C GLU A 62 36.508 23.471 7.119 1.00 34.23 C ATOM 478 O GLU A 62 35.639 24.260 7.517 1.00 35.95 O ATOM 479 CB GLU A 62 37.822 22.285 8.829 1.00 35.15 C ATOM 480 CG GLU A 62 37.930 21.107 9.784 1.00 38.54 C ATOM 481 CD GLU A 62 38.989 21.315 10.861 1.00 41.96 C ATOM 482 OE1 GLU A 62 39.826 22.295 10.765 1.00 42.35 O ATOM 483 OE2 GLU A 62 39.038 20.505 11.858 1.00 41.65 O ATOM 0 H GLU A 62 37.807 20.622 7.078 1.00 32.03 H new ATOM 0 HA GLU A 62 35.884 21.837 8.194 1.00 34.86 H new ATOM 0 HB2 GLU A 62 38.671 22.405 8.375 1.00 35.15 H new ATOM 0 HB3 GLU A 62 37.656 23.093 9.339 1.00 35.15 H new ATOM 0 HG2 GLU A 62 37.070 20.959 10.207 1.00 38.54 H new ATOM 0 HG3 GLU A 62 38.140 20.305 9.280 1.00 38.54 H new ATOM 484 N LYS A 63 37.299 23.741 6.114 1.00 36.44 N ATOM 485 CA LYS A 63 37.211 25.024 5.428 1.00 36.54 C ATOM 486 C LYS A 63 35.904 25.119 4.632 1.00 36.04 C ATOM 487 O LYS A 63 35.472 26.250 4.434 1.00 32.21 O ATOM 488 CB LYS A 63 38.416 25.225 4.523 1.00 39.75 C ATOM 489 CG LYS A 63 38.129 24.890 3.072 1.00 42.64 C ATOM 490 CD LYS A 63 39.368 24.391 2.340 1.00 44.80 C ATOM 491 CE LYS A 63 39.033 23.531 1.125 1.00 46.29 C ATOM 492 NZ LYS A 63 38.738 24.328 -0.074 1.00 47.76 N ATOM 0 H LYS A 63 37.896 23.204 5.805 1.00 36.44 H new ATOM 0 HA LYS A 63 37.210 25.731 6.092 1.00 36.54 H new ATOM 0 HB2 LYS A 63 38.710 26.147 4.585 1.00 39.75 H new ATOM 0 HB3 LYS A 63 39.147 24.672 4.839 1.00 39.75 H new ATOM 0 HG2 LYS A 63 37.436 24.213 3.029 1.00 42.64 H new ATOM 0 HG3 LYS A 63 37.785 25.677 2.622 1.00 42.64 H new ATOM 0 HD2 LYS A 63 39.899 25.152 2.056 1.00 44.80 H new ATOM 0 HD3 LYS A 63 39.916 23.877 2.954 1.00 44.80 H new ATOM 0 HE2 LYS A 63 39.778 22.938 0.939 1.00 46.29 H new ATOM 0 HE3 LYS A 63 38.269 22.971 1.332 1.00 46.29 H new ATOM 0 HZ1 LYS A 63 38.549 23.784 -0.753 1.00 47.76 H new ATOM 0 HZ2 LYS A 63 38.040 24.857 0.085 1.00 47.76 H new ATOM 0 HZ3 LYS A 63 39.446 24.826 -0.281 1.00 47.76 H new ATOM 493 N ASN A 64 35.280 24.003 4.270 1.00 33.92 N ATOM 494 CA ASN A 64 33.993 23.990 3.604 1.00 34.18 C ATOM 495 C ASN A 64 32.798 23.774 4.542 1.00 34.15 C ATOM 496 O ASN A 64 31.754 23.421 3.922 1.00 36.37 O ATOM 497 CB ASN A 64 33.980 22.857 2.583 1.00 33.46 C ATOM 498 CG ASN A 64 34.988 23.113 1.454 1.00 35.00 C ATOM 499 OD1 ASN A 64 35.332 24.264 1.136 1.00 35.06 O ATOM 500 ND2 ASN A 64 35.451 22.103 0.719 1.00 35.02 N ATOM 0 H ASN A 64 35.603 23.218 4.410 1.00 33.92 H new ATOM 0 HA ASN A 64 33.892 24.867 3.202 1.00 34.18 H new ATOM 0 HB2 ASN A 64 34.191 22.019 3.024 1.00 33.46 H new ATOM 0 HB3 ASN A 64 33.089 22.765 2.210 1.00 33.46 H new ATOM 0 HD21 ASN A 64 35.969 22.260 0.051 1.00 35.02 H new ATOM 0 HD22 ASN A 64 35.232 21.294 0.913 1.00 35.02 H new ATOM 501 N ARG A 65 32.870 23.821 5.861 1.00 34.39 N ATOM 502 CA ARG A 65 31.819 23.577 6.814 1.00 33.05 C ATOM 503 C ARG A 65 31.314 24.902 7.398 1.00 32.49 C ATOM 504 O ARG A 65 32.255 25.583 7.762 1.00 35.77 O ATOM 505 CB ARG A 65 32.299 22.522 7.866 1.00 33.76 C ATOM 506 CG ARG A 65 32.122 21.168 7.244 1.00 34.99 C ATOM 507 CD ARG A 65 32.355 20.100 8.234 1.00 35.54 C ATOM 508 NE ARG A 65 33.042 20.426 9.398 1.00 37.32 N ATOM 509 CZ ARG A 65 34.154 19.914 9.993 1.00 38.28 C ATOM 510 NH1 ARG A 65 35.049 19.255 9.244 1.00 39.14 N ATOM 511 NH2 ARG A 65 34.623 20.035 11.234 1.00 38.62 N ATOM 0 H ARG A 65 33.610 24.016 6.253 1.00 34.39 H new ATOM 0 HA ARG A 65 31.043 23.183 6.385 1.00 33.05 H new ATOM 0 HB2 ARG A 65 33.228 22.672 8.103 1.00 33.76 H new ATOM 0 HB3 ARG A 65 31.783 22.594 8.684 1.00 33.76 H new ATOM 0 HG2 ARG A 65 31.226 21.089 6.882 1.00 34.99 H new ATOM 0 HG3 ARG A 65 32.738 21.066 6.501 1.00 34.99 H new ATOM 0 HD2 ARG A 65 31.492 19.739 8.490 1.00 35.54 H new ATOM 0 HD3 ARG A 65 32.841 19.386 7.792 1.00 35.54 H new ATOM 0 HE ARG A 65 32.694 21.084 9.829 1.00 37.32 H new ATOM 0 HH11 ARG A 65 34.917 19.160 8.400 1.00 39.14 H new ATOM 0 HH12 ARG A 65 35.756 18.927 9.608 1.00 39.14 H new ATOM 0 HH21 ARG A 65 34.195 20.507 11.811 1.00 38.62 H new ATOM 0 HH22 ARG A 65 35.354 19.641 11.458 1.00 38.62 H new ATOM 512 N PRO A 66 30.045 25.304 7.417 1.00 31.61 N ATOM 513 CA PRO A 66 28.903 24.596 6.803 1.00 31.15 C ATOM 514 C PRO A 66 28.870 24.771 5.246 1.00 27.63 C ATOM 515 O PRO A 66 29.613 25.584 4.660 1.00 27.23 O ATOM 516 CB PRO A 66 27.726 25.219 7.536 1.00 29.11 C ATOM 517 CG PRO A 66 28.234 26.675 7.674 1.00 33.16 C ATOM 518 CD PRO A 66 29.753 26.688 7.917 1.00 31.04 C ATOM 0 HA PRO A 66 28.925 23.631 6.895 1.00 31.15 H new ATOM 0 HB2 PRO A 66 26.901 25.161 7.029 1.00 29.11 H new ATOM 0 HB3 PRO A 66 27.561 24.801 8.396 1.00 29.11 H new ATOM 0 HG2 PRO A 66 28.024 27.175 6.870 1.00 33.16 H new ATOM 0 HG3 PRO A 66 27.779 27.115 8.409 1.00 33.16 H new ATOM 0 HD2 PRO A 66 30.212 27.379 7.414 1.00 31.04 H new ATOM 0 HD3 PRO A 66 29.988 26.813 8.850 1.00 31.04 H new ATOM 519 N LEU A 67 28.248 23.898 4.520 1.00 26.22 N ATOM 520 CA LEU A 67 28.159 23.961 3.019 1.00 23.85 C ATOM 521 C LEU A 67 27.472 25.345 2.735 1.00 23.91 C ATOM 522 O LEU A 67 26.381 25.547 3.262 1.00 24.39 O ATOM 523 CB LEU A 67 27.385 22.698 2.613 1.00 23.54 C ATOM 524 CG LEU A 67 28.164 21.374 2.750 1.00 21.80 C ATOM 525 CD1 LEU A 67 27.140 20.285 2.319 1.00 20.20 C ATOM 526 CD2 LEU A 67 29.462 21.411 2.011 1.00 21.62 C ATOM 0 H LEU A 67 27.842 23.219 4.856 1.00 26.22 H new ATOM 0 HA LEU A 67 28.981 23.945 2.504 1.00 23.85 H new ATOM 0 HB2 LEU A 67 26.582 22.641 3.154 1.00 23.54 H new ATOM 0 HB3 LEU A 67 27.100 22.794 1.691 1.00 23.54 H new ATOM 0 HG LEU A 67 28.472 21.182 3.650 1.00 21.80 H new ATOM 0 HD11 LEU A 67 27.554 19.410 2.377 1.00 20.20 H new ATOM 0 HD12 LEU A 67 26.368 20.316 2.906 1.00 20.20 H new ATOM 0 HD13 LEU A 67 26.858 20.449 1.405 1.00 20.20 H new ATOM 0 HD21 LEU A 67 29.921 20.564 2.121 1.00 21.62 H new ATOM 0 HD22 LEU A 67 29.294 21.568 1.069 1.00 21.62 H new ATOM 0 HD23 LEU A 67 30.015 22.126 2.363 1.00 21.62 H new ATOM 527 N LYS A 68 28.191 26.183 1.992 1.00 27.21 N ATOM 528 CA LYS A 68 27.576 27.546 1.781 1.00 30.13 C ATOM 529 C LYS A 68 26.315 27.622 0.965 1.00 29.47 C ATOM 530 O LYS A 68 26.040 26.942 -0.059 1.00 27.44 O ATOM 531 CB LYS A 68 28.638 28.521 1.269 1.00 34.98 C ATOM 532 CG LYS A 68 29.113 27.977 -0.054 1.00 36.21 C ATOM 533 CD LYS A 68 29.752 29.086 -0.940 1.00 41.03 C ATOM 534 CE LYS A 68 31.222 28.859 -1.253 1.00 42.11 C ATOM 535 NZ LYS A 68 31.962 28.841 0.096 1.00 42.44 N ATOM 0 H LYS A 68 28.955 26.031 1.627 1.00 27.21 H new ATOM 0 HA LYS A 68 27.262 27.803 2.662 1.00 30.13 H new ATOM 0 HB2 LYS A 68 28.268 29.411 1.164 1.00 34.98 H new ATOM 0 HB3 LYS A 68 29.373 28.592 1.897 1.00 34.98 H new ATOM 0 HG2 LYS A 68 29.762 27.273 0.100 1.00 36.21 H new ATOM 0 HG3 LYS A 68 28.366 27.576 -0.526 1.00 36.21 H new ATOM 0 HD2 LYS A 68 29.259 29.145 -1.773 1.00 41.03 H new ATOM 0 HD3 LYS A 68 29.655 29.941 -0.492 1.00 41.03 H new ATOM 0 HE2 LYS A 68 31.348 28.022 -1.727 1.00 42.11 H new ATOM 0 HE3 LYS A 68 31.565 29.563 -1.825 1.00 42.11 H new ATOM 0 HZ1 LYS A 68 32.827 29.001 -0.038 1.00 42.44 H new ATOM 0 HZ2 LYS A 68 31.623 29.468 0.629 1.00 42.44 H new ATOM 0 HZ3 LYS A 68 31.864 28.043 0.478 1.00 42.44 H new ATOM 536 N GLY A 69 25.382 28.489 1.440 1.00 27.44 N ATOM 537 CA GLY A 69 24.099 28.767 0.786 1.00 26.61 C ATOM 538 C GLY A 69 23.077 27.716 0.999 1.00 25.78 C ATOM 539 O GLY A 69 22.032 27.805 0.241 1.00 28.44 O ATOM 0 H GLY A 69 25.493 28.934 2.167 1.00 27.44 H new ATOM 0 HA2 GLY A 69 23.755 29.612 1.115 1.00 26.61 H new ATOM 0 HA3 GLY A 69 24.248 28.873 -0.167 1.00 26.61 H new ATOM 540 N ARG A 70 23.263 26.747 1.846 1.00 23.21 N ATOM 541 CA ARG A 70 22.477 25.629 2.206 1.00 21.88 C ATOM 542 C ARG A 70 22.099 25.642 3.713 1.00 22.85 C ATOM 543 O ARG A 70 22.990 26.238 4.343 1.00 24.93 O ATOM 544 CB ARG A 70 23.051 24.231 1.740 1.00 23.05 C ATOM 545 CG ARG A 70 23.013 24.312 0.186 1.00 24.80 C ATOM 546 CD ARG A 70 24.141 23.472 -0.334 1.00 23.19 C ATOM 547 NE ARG A 70 25.448 24.105 -0.440 1.00 23.74 N ATOM 548 CZ ARG A 70 26.575 23.528 -0.881 1.00 21.95 C ATOM 549 NH1 ARG A 70 26.645 22.270 -1.212 1.00 22.18 N ATOM 550 NH2 ARG A 70 27.682 24.331 -0.867 1.00 24.94 N ATOM 0 H ARG A 70 23.992 26.739 2.302 1.00 23.21 H new ATOM 0 HA ARG A 70 21.658 25.731 1.696 1.00 21.88 H new ATOM 0 HB2 ARG A 70 23.953 24.090 2.067 1.00 23.05 H new ATOM 0 HB3 ARG A 70 22.511 23.496 2.071 1.00 23.05 H new ATOM 0 HG2 ARG A 70 22.163 23.990 -0.152 1.00 24.80 H new ATOM 0 HG3 ARG A 70 23.106 25.231 -0.111 1.00 24.80 H new ATOM 0 HD2 ARG A 70 24.228 22.696 0.242 1.00 23.19 H new ATOM 0 HD3 ARG A 70 23.893 23.146 -1.213 1.00 23.19 H new ATOM 0 HE ARG A 70 25.502 24.928 -0.196 1.00 23.74 H new ATOM 0 HH11 ARG A 70 25.948 21.770 -1.152 1.00 22.18 H new ATOM 0 HH12 ARG A 70 27.388 21.939 -1.491 1.00 22.18 H new ATOM 0 HH21 ARG A 70 27.621 25.142 -0.588 1.00 24.94 H new ATOM 0 HH22 ARG A 70 28.439 24.025 -1.137 1.00 24.94 H new ATOM 551 N ILE A 71 20.999 25.208 4.146 1.00 22.71 N ATOM 552 CA ILE A 71 20.660 25.018 5.576 1.00 23.47 C ATOM 553 C ILE A 71 21.262 23.617 5.882 1.00 22.99 C ATOM 554 O ILE A 71 20.856 22.597 5.154 1.00 24.81 O ATOM 555 CB ILE A 71 19.160 25.173 5.972 1.00 20.81 C ATOM 556 CG1 ILE A 71 18.795 26.620 5.580 1.00 25.22 C ATOM 557 CG2 ILE A 71 18.939 24.748 7.447 1.00 20.57 C ATOM 558 CD1 ILE A 71 17.324 26.870 5.261 1.00 24.83 C ATOM 0 H ILE A 71 20.355 24.988 3.620 1.00 22.71 H new ATOM 0 HA ILE A 71 21.027 25.732 6.121 1.00 23.47 H new ATOM 0 HB ILE A 71 18.548 24.581 5.507 1.00 20.81 H new ATOM 0 HG12 ILE A 71 19.056 27.209 6.305 1.00 25.22 H new ATOM 0 HG13 ILE A 71 19.324 26.871 4.806 1.00 25.22 H new ATOM 0 HG21 ILE A 71 18.002 24.850 7.677 1.00 20.57 H new ATOM 0 HG22 ILE A 71 19.199 23.820 7.559 1.00 20.57 H new ATOM 0 HG23 ILE A 71 19.477 25.307 8.029 1.00 20.57 H new ATOM 0 HD11 ILE A 71 17.197 27.803 5.028 1.00 24.83 H new ATOM 0 HD12 ILE A 71 17.055 26.311 4.515 1.00 24.83 H new ATOM 0 HD13 ILE A 71 16.783 26.655 6.037 1.00 24.83 H new ATOM 559 N ASN A 72 22.209 23.517 6.860 1.00 22.43 N ATOM 560 CA ASN A 72 22.952 22.316 7.205 1.00 21.87 C ATOM 561 C ASN A 72 22.346 21.688 8.455 1.00 21.83 C ATOM 562 O ASN A 72 22.497 22.420 9.434 1.00 23.90 O ATOM 563 CB ASN A 72 24.516 22.505 7.378 1.00 20.04 C ATOM 564 CG ASN A 72 25.263 22.918 6.226 1.00 22.43 C ATOM 565 OD1 ASN A 72 26.379 22.340 5.914 1.00 21.87 O ATOM 566 ND2 ASN A 72 24.926 23.823 5.332 1.00 21.98 N ATOM 0 H ASN A 72 22.428 24.190 7.348 1.00 22.43 H new ATOM 0 HA ASN A 72 22.865 21.726 6.440 1.00 21.87 H new ATOM 0 HB2 ASN A 72 24.663 23.158 8.080 1.00 20.04 H new ATOM 0 HB3 ASN A 72 24.887 21.665 7.690 1.00 20.04 H new ATOM 0 HD21 ASN A 72 25.430 23.962 4.650 1.00 21.98 H new ATOM 0 HD22 ASN A 72 24.201 24.275 5.430 1.00 21.98 H new ATOM 567 N LEU A 73 21.790 20.493 8.374 1.00 22.82 N ATOM 568 CA LEU A 73 21.256 19.778 9.498 1.00 22.65 C ATOM 569 C LEU A 73 22.070 18.462 9.624 1.00 24.06 C ATOM 570 O LEU A 73 22.218 17.757 8.644 1.00 23.03 O ATOM 571 CB LEU A 73 19.713 19.562 9.448 1.00 22.09 C ATOM 572 CG LEU A 73 18.877 18.745 10.423 1.00 21.48 C ATOM 573 CD1 LEU A 73 17.452 19.271 10.168 1.00 25.24 C ATOM 574 CD2 LEU A 73 18.966 17.237 10.325 1.00 22.67 C ATOM 0 H LEU A 73 21.713 20.065 7.632 1.00 22.82 H new ATOM 0 HA LEU A 73 21.358 20.312 10.301 1.00 22.65 H new ATOM 0 HB2 LEU A 73 19.327 20.452 9.458 1.00 22.09 H new ATOM 0 HB3 LEU A 73 19.533 19.184 8.573 1.00 22.09 H new ATOM 0 HG LEU A 73 19.206 18.867 11.327 1.00 21.48 H new ATOM 0 HD11 LEU A 73 16.827 18.809 10.749 1.00 25.24 H new ATOM 0 HD12 LEU A 73 17.420 20.223 10.352 1.00 25.24 H new ATOM 0 HD13 LEU A 73 17.210 19.113 9.242 1.00 25.24 H new ATOM 0 HD21 LEU A 73 18.391 16.835 10.995 1.00 22.67 H new ATOM 0 HD22 LEU A 73 18.682 16.953 9.442 1.00 22.67 H new ATOM 0 HD23 LEU A 73 19.882 16.956 10.475 1.00 22.67 H new ATOM 575 N VAL A 74 22.423 18.210 10.877 1.00 22.80 N ATOM 576 CA VAL A 74 23.188 17.084 11.271 1.00 21.90 C ATOM 577 C VAL A 74 22.273 16.115 12.059 1.00 23.89 C ATOM 578 O VAL A 74 21.407 16.568 12.919 1.00 23.91 O ATOM 579 CB VAL A 74 24.573 17.359 11.870 1.00 21.88 C ATOM 580 CG1 VAL A 74 25.323 16.028 12.187 1.00 23.79 C ATOM 581 CG2 VAL A 74 25.652 18.181 11.081 1.00 21.69 C ATOM 0 H VAL A 74 22.206 18.721 11.534 1.00 22.80 H new ATOM 0 HA VAL A 74 23.484 16.633 10.465 1.00 21.90 H new ATOM 0 HB VAL A 74 24.286 17.909 12.616 1.00 21.88 H new ATOM 0 HG11 VAL A 74 26.194 16.229 12.564 1.00 23.79 H new ATOM 0 HG12 VAL A 74 24.807 15.510 12.824 1.00 23.79 H new ATOM 0 HG13 VAL A 74 25.435 15.517 11.370 1.00 23.79 H new ATOM 0 HG21 VAL A 74 26.459 18.252 11.615 1.00 21.69 H new ATOM 0 HG22 VAL A 74 25.855 17.731 10.246 1.00 21.69 H new ATOM 0 HG23 VAL A 74 25.310 19.069 10.894 1.00 21.69 H new ATOM 582 N LEU A 75 22.268 14.824 11.874 1.00 24.77 N ATOM 583 CA LEU A 75 21.565 13.745 12.530 1.00 24.32 C ATOM 584 C LEU A 75 22.520 13.016 13.498 1.00 24.67 C ATOM 585 O LEU A 75 23.620 12.493 13.206 1.00 22.96 O ATOM 586 CB LEU A 75 20.843 12.612 11.677 1.00 25.38 C ATOM 587 CG LEU A 75 19.750 12.912 10.727 1.00 24.92 C ATOM 588 CD1 LEU A 75 19.424 11.721 9.753 1.00 26.28 C ATOM 589 CD2 LEU A 75 18.455 13.545 11.301 1.00 27.34 C ATOM 0 H LEU A 75 22.764 14.500 11.251 1.00 24.77 H new ATOM 0 HA LEU A 75 20.834 14.236 12.937 1.00 24.32 H new ATOM 0 HB2 LEU A 75 21.536 12.161 11.170 1.00 25.38 H new ATOM 0 HB3 LEU A 75 20.491 11.968 12.311 1.00 25.38 H new ATOM 0 HG LEU A 75 20.146 13.633 10.213 1.00 24.92 H new ATOM 0 HD11 LEU A 75 18.703 11.978 9.158 1.00 26.28 H new ATOM 0 HD12 LEU A 75 20.212 11.505 9.231 1.00 26.28 H new ATOM 0 HD13 LEU A 75 19.156 10.945 10.269 1.00 26.28 H new ATOM 0 HD21 LEU A 75 17.820 13.692 10.582 1.00 27.34 H new ATOM 0 HD22 LEU A 75 18.066 12.947 11.958 1.00 27.34 H new ATOM 0 HD23 LEU A 75 18.668 14.393 11.722 1.00 27.34 H new ATOM 590 N SER A 76 21.934 12.870 14.757 1.00 24.31 N ATOM 591 CA SER A 76 22.808 12.148 15.698 1.00 24.76 C ATOM 592 C SER A 76 21.934 11.917 17.036 1.00 27.88 C ATOM 593 O SER A 76 21.200 12.792 17.423 1.00 28.92 O ATOM 594 CB SER A 76 23.868 13.097 16.216 1.00 24.08 C ATOM 595 OG SER A 76 24.615 12.446 17.267 1.00 25.45 O ATOM 0 H SER A 76 21.164 13.140 15.028 1.00 24.31 H new ATOM 0 HA SER A 76 23.162 11.355 15.265 1.00 24.76 H new ATOM 0 HB2 SER A 76 24.463 13.359 15.496 1.00 24.08 H new ATOM 0 HB3 SER A 76 23.455 13.908 16.552 1.00 24.08 H new ATOM 0 HG SER A 76 24.983 11.755 16.963 1.00 25.45 H new ATOM 596 N ARG A 77 22.183 10.759 17.621 1.00 32.61 N ATOM 597 CA ARG A 77 21.440 10.669 18.924 1.00 35.26 C ATOM 598 C ARG A 77 22.299 11.014 20.118 1.00 36.36 C ATOM 599 O ARG A 77 21.687 10.965 21.212 1.00 39.53 O ATOM 600 CB ARG A 77 20.953 9.213 19.021 1.00 36.91 C ATOM 601 CG ARG A 77 19.948 9.188 17.904 1.00 39.90 C ATOM 602 CD ARG A 77 19.340 7.837 17.702 1.00 41.68 C ATOM 603 NE ARG A 77 18.494 8.406 16.553 1.00 41.99 N ATOM 604 CZ ARG A 77 17.690 7.459 15.989 1.00 44.71 C ATOM 605 NH1 ARG A 77 17.718 6.344 16.816 1.00 48.42 N ATOM 606 NH2 ARG A 77 16.812 7.578 14.963 1.00 45.32 N ATOM 0 H ARG A 77 22.680 10.106 17.364 1.00 32.61 H new ATOM 0 HA ARG A 77 20.713 11.310 18.937 1.00 35.26 H new ATOM 0 HB2 ARG A 77 21.670 8.574 18.887 1.00 36.91 H new ATOM 0 HB3 ARG A 77 20.553 9.014 19.882 1.00 36.91 H new ATOM 0 HG2 ARG A 77 19.245 9.829 18.092 1.00 39.90 H new ATOM 0 HG3 ARG A 77 20.377 9.471 17.082 1.00 39.90 H new ATOM 0 HD2 ARG A 77 19.965 7.141 17.445 1.00 41.68 H new ATOM 0 HD3 ARG A 77 18.832 7.499 18.456 1.00 41.68 H new ATOM 0 HE ARG A 77 18.524 9.226 16.295 1.00 41.99 H new ATOM 0 HH11 ARG A 77 18.191 6.353 17.534 1.00 48.42 H new ATOM 0 HH12 ARG A 77 17.262 5.645 16.610 1.00 48.42 H new ATOM 0 HH21 ARG A 77 16.706 8.338 14.574 1.00 45.32 H new ATOM 0 HH22 ARG A 77 16.361 6.894 14.701 1.00 45.32 H new ATOM 607 N GLU A 78 23.603 11.142 19.954 1.00 34.83 N ATOM 608 CA GLU A 78 24.632 11.282 21.005 1.00 38.48 C ATOM 609 C GLU A 78 24.983 12.720 21.307 1.00 37.83 C ATOM 610 O GLU A 78 25.237 13.141 22.460 1.00 37.77 O ATOM 611 CB GLU A 78 25.820 10.472 20.443 1.00 38.18 C ATOM 612 CG GLU A 78 27.181 10.319 21.048 1.00 43.06 C ATOM 613 CD GLU A 78 28.248 9.555 20.371 1.00 42.85 C ATOM 614 OE1 GLU A 78 28.204 8.811 19.412 1.00 47.62 O ATOM 615 OE2 GLU A 78 29.472 9.317 20.768 1.00 44.33 O ATOM 0 H GLU A 78 23.950 11.152 19.167 1.00 34.83 H new ATOM 0 HA GLU A 78 24.331 10.955 21.867 1.00 38.48 H new ATOM 0 HB2 GLU A 78 25.485 9.568 20.334 1.00 38.18 H new ATOM 0 HB3 GLU A 78 25.974 10.827 19.553 1.00 38.18 H new ATOM 0 HG2 GLU A 78 27.526 11.214 21.195 1.00 43.06 H new ATOM 0 HG3 GLU A 78 27.057 9.916 21.921 1.00 43.06 H new ATOM 616 N LEU A 79 24.967 13.556 20.243 1.00 34.75 N ATOM 617 CA LEU A 79 25.363 14.970 20.312 1.00 32.93 C ATOM 618 C LEU A 79 24.306 15.783 21.109 1.00 32.06 C ATOM 619 O LEU A 79 23.095 15.504 20.973 1.00 32.21 O ATOM 620 CB LEU A 79 25.658 15.560 18.910 1.00 33.04 C ATOM 621 CG LEU A 79 26.846 14.957 18.106 1.00 33.90 C ATOM 622 CD1 LEU A 79 26.989 15.723 16.800 1.00 33.78 C ATOM 623 CD2 LEU A 79 28.219 15.132 18.830 1.00 32.92 C ATOM 0 H LEU A 79 24.722 13.307 19.457 1.00 34.75 H new ATOM 0 HA LEU A 79 26.201 15.034 20.796 1.00 32.93 H new ATOM 0 HB2 LEU A 79 24.856 15.467 18.372 1.00 33.04 H new ATOM 0 HB3 LEU A 79 25.820 16.511 19.015 1.00 33.04 H new ATOM 0 HG LEU A 79 26.649 14.014 17.992 1.00 33.90 H new ATOM 0 HD11 LEU A 79 27.727 15.356 16.289 1.00 33.78 H new ATOM 0 HD12 LEU A 79 26.170 15.644 16.287 1.00 33.78 H new ATOM 0 HD13 LEU A 79 27.161 16.658 16.990 1.00 33.78 H new ATOM 0 HD21 LEU A 79 28.923 14.741 18.289 1.00 32.92 H new ATOM 0 HD22 LEU A 79 28.399 16.076 18.960 1.00 32.92 H new ATOM 0 HD23 LEU A 79 28.190 14.688 19.692 1.00 32.92 H new ATOM 624 N LYS A 80 24.817 16.689 21.913 1.00 35.39 N ATOM 625 CA LYS A 80 23.869 17.585 22.696 1.00 36.58 C ATOM 626 C LYS A 80 23.400 18.790 21.943 1.00 35.88 C ATOM 627 O LYS A 80 22.298 19.453 22.174 1.00 37.05 O ATOM 628 CB LYS A 80 24.509 18.066 23.991 1.00 37.08 C ATOM 629 CG LYS A 80 24.965 16.933 24.944 1.00 39.76 C ATOM 630 CD LYS A 80 23.837 16.188 25.729 1.00 39.00 C ATOM 631 CE LYS A 80 24.371 15.064 26.665 1.00 41.76 C ATOM 632 NZ LYS A 80 23.187 14.358 27.421 1.00 43.31 N ATOM 0 H LYS A 80 25.656 16.827 22.042 1.00 35.39 H new ATOM 0 HA LYS A 80 23.098 17.023 22.873 1.00 36.58 H new ATOM 0 HB2 LYS A 80 25.276 18.618 23.773 1.00 37.08 H new ATOM 0 HB3 LYS A 80 23.876 18.632 24.460 1.00 37.08 H new ATOM 0 HG2 LYS A 80 25.457 16.278 24.424 1.00 39.76 H new ATOM 0 HG3 LYS A 80 25.586 17.309 25.588 1.00 39.76 H new ATOM 0 HD2 LYS A 80 23.342 16.832 26.259 1.00 39.00 H new ATOM 0 HD3 LYS A 80 23.212 15.802 25.095 1.00 39.00 H new ATOM 0 HE2 LYS A 80 24.863 14.410 26.144 1.00 41.76 H new ATOM 0 HE3 LYS A 80 24.992 15.441 27.308 1.00 41.76 H new ATOM 0 HZ1 LYS A 80 23.511 13.720 27.950 1.00 43.31 H new ATOM 0 HZ2 LYS A 80 22.749 14.957 27.913 1.00 43.31 H new ATOM 0 HZ3 LYS A 80 22.630 13.997 26.829 1.00 43.31 H new ATOM 633 N GLU A 81 24.295 19.219 21.058 1.00 32.05 N ATOM 634 CA GLU A 81 24.064 20.439 20.255 1.00 33.87 C ATOM 635 C GLU A 81 24.695 20.246 18.856 1.00 32.15 C ATOM 636 O GLU A 81 25.553 19.389 18.762 1.00 32.18 O ATOM 637 CB GLU A 81 24.747 21.589 21.016 1.00 35.08 C ATOM 638 CG GLU A 81 26.213 21.879 21.173 1.00 37.50 C ATOM 639 CD GLU A 81 26.567 23.186 21.854 1.00 40.43 C ATOM 640 OE1 GLU A 81 26.128 24.281 21.679 1.00 40.92 O ATOM 641 OE2 GLU A 81 27.510 23.083 22.669 1.00 43.33 O ATOM 0 H GLU A 81 25.043 18.825 20.901 1.00 32.05 H new ATOM 0 HA GLU A 81 23.121 20.628 20.130 1.00 33.87 H new ATOM 0 HB2 GLU A 81 24.373 22.398 20.632 1.00 35.08 H new ATOM 0 HB3 GLU A 81 24.408 21.523 21.923 1.00 35.08 H new ATOM 0 HG2 GLU A 81 26.615 21.154 21.677 1.00 37.50 H new ATOM 0 HG3 GLU A 81 26.621 21.873 20.293 1.00 37.50 H new ATOM 642 N PRO A 82 24.251 21.035 17.848 1.00 33.45 N ATOM 643 CA PRO A 82 24.820 20.864 16.488 1.00 31.29 C ATOM 644 C PRO A 82 26.364 21.085 16.542 1.00 30.05 C ATOM 645 O PRO A 82 26.816 22.006 17.355 1.00 32.79 O ATOM 646 CB PRO A 82 24.155 21.997 15.729 1.00 32.81 C ATOM 647 CG PRO A 82 23.002 22.618 16.565 1.00 30.74 C ATOM 648 CD PRO A 82 23.216 22.041 17.978 1.00 33.50 C ATOM 0 HA PRO A 82 24.674 19.989 16.095 1.00 31.29 H new ATOM 0 HB2 PRO A 82 24.811 22.680 15.518 1.00 32.81 H new ATOM 0 HB3 PRO A 82 23.807 21.667 14.886 1.00 32.81 H new ATOM 0 HG2 PRO A 82 23.046 23.587 16.566 1.00 30.74 H new ATOM 0 HG3 PRO A 82 22.133 22.374 16.209 1.00 30.74 H new ATOM 0 HD2 PRO A 82 23.484 22.736 18.600 1.00 33.50 H new ATOM 0 HD3 PRO A 82 22.396 21.653 18.322 1.00 33.50 H new ATOM 649 N PRO A 83 27.199 20.379 15.811 1.00 27.44 N ATOM 650 CA PRO A 83 28.689 20.550 15.846 1.00 29.65 C ATOM 651 C PRO A 83 28.941 21.973 15.477 1.00 31.12 C ATOM 652 O PRO A 83 28.023 22.636 14.833 1.00 31.71 O ATOM 653 CB PRO A 83 29.206 19.584 14.748 1.00 29.64 C ATOM 654 CG PRO A 83 27.980 18.877 14.338 1.00 27.92 C ATOM 655 CD PRO A 83 26.665 19.257 14.956 1.00 25.74 C ATOM 0 HA PRO A 83 29.116 20.361 16.696 1.00 29.65 H new ATOM 0 HB2 PRO A 83 29.611 20.063 14.008 1.00 29.64 H new ATOM 0 HB3 PRO A 83 29.877 18.973 15.092 1.00 29.64 H new ATOM 0 HG2 PRO A 83 27.891 18.982 13.378 1.00 27.92 H new ATOM 0 HG3 PRO A 83 28.119 17.932 14.508 1.00 27.92 H new ATOM 0 HD2 PRO A 83 26.005 19.548 14.307 1.00 25.74 H new ATOM 0 HD3 PRO A 83 26.260 18.541 15.470 1.00 25.74 H new ATOM 656 N GLN A 84 30.166 22.487 15.625 1.00 31.55 N ATOM 657 CA GLN A 84 30.538 23.884 15.320 1.00 32.36 C ATOM 658 C GLN A 84 30.337 24.103 13.787 1.00 30.75 C ATOM 659 O GLN A 84 30.899 23.343 13.043 1.00 25.61 O ATOM 660 CB GLN A 84 32.003 24.140 15.643 1.00 35.60 C ATOM 661 CG GLN A 84 32.570 25.466 15.151 1.00 40.91 C ATOM 662 CD GLN A 84 33.768 26.141 15.760 1.00 45.87 C ATOM 663 OE1 GLN A 84 34.774 25.428 16.150 1.00 48.03 O ATOM 664 NE2 GLN A 84 33.655 27.524 15.884 1.00 46.96 N ATOM 0 H GLN A 84 30.828 22.021 15.915 1.00 31.55 H new ATOM 0 HA GLN A 84 29.990 24.484 15.850 1.00 32.36 H new ATOM 0 HB2 GLN A 84 32.117 24.096 16.605 1.00 35.60 H new ATOM 0 HB3 GLN A 84 32.531 23.421 15.262 1.00 35.60 H new ATOM 0 HG2 GLN A 84 32.777 25.341 14.212 1.00 40.91 H new ATOM 0 HG3 GLN A 84 31.843 26.107 15.199 1.00 40.91 H new ATOM 0 HE21 GLN A 84 32.950 27.925 15.598 1.00 46.96 H new ATOM 0 HE22 GLN A 84 34.290 27.977 16.246 1.00 46.96 H new ATOM 665 N GLY A 85 29.653 25.167 13.437 1.00 28.36 N ATOM 666 CA GLY A 85 29.350 25.498 12.075 1.00 28.62 C ATOM 667 C GLY A 85 27.989 24.926 11.588 1.00 26.94 C ATOM 668 O GLY A 85 27.518 25.597 10.616 1.00 29.16 O ATOM 0 H GLY A 85 29.343 25.733 14.005 1.00 28.36 H new ATOM 0 HA2 GLY A 85 29.341 26.463 11.978 1.00 28.62 H new ATOM 0 HA3 GLY A 85 30.058 25.162 11.503 1.00 28.62 H new ATOM 669 N ALA A 86 27.373 23.914 12.077 1.00 25.37 N ATOM 670 CA ALA A 86 26.142 23.273 11.753 1.00 27.14 C ATOM 671 C ALA A 86 25.016 24.148 12.246 1.00 27.78 C ATOM 672 O ALA A 86 25.020 24.897 13.276 1.00 26.11 O ATOM 673 CB ALA A 86 25.880 21.815 12.284 1.00 26.98 C ATOM 0 H ALA A 86 27.736 23.502 12.739 1.00 25.37 H new ATOM 0 HA ALA A 86 26.195 23.162 10.791 1.00 27.14 H new ATOM 0 HB1 ALA A 86 25.008 21.513 11.985 1.00 26.98 H new ATOM 0 HB2 ALA A 86 26.563 21.218 11.941 1.00 26.98 H new ATOM 0 HB3 ALA A 86 25.907 21.814 13.254 1.00 26.98 H new ATOM 674 N HIS A 87 23.952 24.166 11.423 1.00 25.24 N ATOM 675 CA HIS A 87 22.756 24.998 11.702 1.00 25.17 C ATOM 676 C HIS A 87 21.738 24.291 12.582 1.00 24.83 C ATOM 677 O HIS A 87 21.188 24.991 13.535 1.00 25.31 O ATOM 678 CB HIS A 87 21.972 25.541 10.437 1.00 23.20 C ATOM 679 CG HIS A 87 22.877 26.304 9.584 1.00 21.18 C ATOM 680 ND1 HIS A 87 23.792 27.343 9.928 1.00 24.31 N ATOM 681 CD2 HIS A 87 23.113 26.034 8.266 1.00 20.77 C ATOM 682 CE1 HIS A 87 24.489 27.821 8.870 1.00 21.87 C ATOM 683 NE2 HIS A 87 24.090 26.931 7.964 1.00 22.17 N ATOM 0 H HIS A 87 23.900 23.705 10.699 1.00 25.24 H new ATOM 0 HA HIS A 87 23.154 25.758 12.155 1.00 25.17 H new ATOM 0 HB2 HIS A 87 21.592 24.800 9.939 1.00 23.20 H new ATOM 0 HB3 HIS A 87 21.232 26.101 10.720 1.00 23.20 H new ATOM 0 HD2 HIS A 87 22.710 25.401 7.717 1.00 20.77 H new ATOM 0 HE1 HIS A 87 25.067 28.546 8.799 1.00 21.87 H new ATOM 0 HE2 HIS A 87 24.452 26.923 7.184 1.00 22.17 H new ATOM 684 N PHE A 88 21.464 23.018 12.506 1.00 24.87 N ATOM 685 CA PHE A 88 20.465 22.332 13.290 1.00 27.23 C ATOM 686 C PHE A 88 20.960 20.949 13.615 1.00 27.92 C ATOM 687 O PHE A 88 21.757 20.474 12.789 1.00 22.77 O ATOM 688 CB PHE A 88 19.190 22.176 12.355 1.00 26.81 C ATOM 689 CG PHE A 88 18.501 23.521 12.129 1.00 28.27 C ATOM 690 CD1 PHE A 88 17.591 23.891 13.179 1.00 29.98 C ATOM 691 CD2 PHE A 88 18.576 24.342 11.073 1.00 29.45 C ATOM 692 CE1 PHE A 88 16.914 25.156 13.150 1.00 29.42 C ATOM 693 CE2 PHE A 88 17.874 25.599 10.972 1.00 29.16 C ATOM 694 CZ PHE A 88 17.022 25.941 12.038 1.00 30.98 C ATOM 0 H PHE A 88 21.878 22.494 11.964 1.00 24.87 H new ATOM 0 HA PHE A 88 20.270 22.816 14.108 1.00 27.23 H new ATOM 0 HB2 PHE A 88 19.456 21.799 11.502 1.00 26.81 H new ATOM 0 HB3 PHE A 88 18.565 21.553 12.758 1.00 26.81 H new ATOM 0 HD1 PHE A 88 17.440 23.304 13.884 1.00 29.98 H new ATOM 0 HD2 PHE A 88 19.115 24.086 10.360 1.00 29.45 H new ATOM 0 HE1 PHE A 88 16.409 25.437 13.878 1.00 29.42 H new ATOM 0 HE2 PHE A 88 17.980 26.157 10.236 1.00 29.16 H new ATOM 0 HZ PHE A 88 16.520 26.722 11.984 1.00 30.98 H new ATOM 695 N LEU A 89 20.453 20.308 14.636 1.00 27.73 N ATOM 696 CA LEU A 89 20.768 18.950 15.094 1.00 24.31 C ATOM 697 C LEU A 89 19.445 18.182 15.165 1.00 28.43 C ATOM 698 O LEU A 89 18.508 18.870 15.706 1.00 32.90 O ATOM 699 CB LEU A 89 21.711 18.902 16.333 1.00 24.06 C ATOM 700 CG LEU A 89 21.531 17.528 17.103 1.00 25.15 C ATOM 701 CD1 LEU A 89 22.281 16.399 16.390 1.00 24.17 C ATOM 702 CD2 LEU A 89 22.013 17.891 18.488 1.00 25.88 C ATOM 0 H LEU A 89 19.859 20.678 15.136 1.00 27.73 H new ATOM 0 HA LEU A 89 21.333 18.480 14.461 1.00 24.31 H new ATOM 0 HB2 LEU A 89 22.633 19.004 16.050 1.00 24.06 H new ATOM 0 HB3 LEU A 89 21.513 19.642 16.928 1.00 24.06 H new ATOM 0 HG LEU A 89 20.631 17.167 17.137 1.00 25.15 H new ATOM 0 HD11 LEU A 89 22.157 15.570 16.878 1.00 24.17 H new ATOM 0 HD12 LEU A 89 21.935 16.299 15.489 1.00 24.17 H new ATOM 0 HD13 LEU A 89 23.226 16.612 16.351 1.00 24.17 H new ATOM 0 HD21 LEU A 89 21.951 17.115 19.066 1.00 25.88 H new ATOM 0 HD22 LEU A 89 22.936 18.186 18.443 1.00 25.88 H new ATOM 0 HD23 LEU A 89 21.463 18.605 18.846 1.00 25.88 H new ATOM 703 N SER A 90 19.180 16.978 14.678 1.00 28.56 N ATOM 704 CA SER A 90 17.930 16.192 14.794 1.00 27.35 C ATOM 705 C SER A 90 18.367 14.827 15.229 1.00 28.16 C ATOM 706 O SER A 90 19.480 14.398 14.934 1.00 29.39 O ATOM 707 CB SER A 90 16.870 16.098 13.762 1.00 26.72 C ATOM 708 OG SER A 90 16.522 17.392 13.395 1.00 26.47 O ATOM 0 H SER A 90 19.775 16.550 14.227 1.00 28.56 H new ATOM 0 HA SER A 90 17.407 16.744 15.396 1.00 27.35 H new ATOM 0 HB2 SER A 90 17.187 15.600 12.993 1.00 26.72 H new ATOM 0 HB3 SER A 90 16.098 15.623 14.109 1.00 26.72 H new ATOM 0 HG SER A 90 15.826 17.373 12.925 1.00 26.47 H new ATOM 709 N ARG A 91 17.408 14.174 16.009 1.00 30.49 N ATOM 710 CA ARG A 91 17.598 12.821 16.493 1.00 34.58 C ATOM 711 C ARG A 91 17.145 11.758 15.552 1.00 32.22 C ATOM 712 O ARG A 91 17.373 10.606 15.949 1.00 34.34 O ATOM 713 CB ARG A 91 16.987 12.533 17.899 1.00 35.55 C ATOM 714 CG ARG A 91 17.565 13.706 18.742 1.00 38.61 C ATOM 715 CD ARG A 91 17.304 13.467 20.216 1.00 42.84 C ATOM 716 NE ARG A 91 17.750 12.058 20.313 1.00 48.03 N ATOM 717 CZ ARG A 91 18.010 11.255 21.431 1.00 46.93 C ATOM 718 NH1 ARG A 91 17.767 11.737 22.748 1.00 47.03 N ATOM 719 NH2 ARG A 91 18.469 9.929 21.248 1.00 49.02 N ATOM 0 H ARG A 91 16.661 14.530 16.244 1.00 30.49 H new ATOM 0 HA ARG A 91 18.564 12.780 16.568 1.00 34.58 H new ATOM 0 HB2 ARG A 91 16.017 12.540 17.883 1.00 35.55 H new ATOM 0 HB3 ARG A 91 17.259 11.668 18.244 1.00 35.55 H new ATOM 0 HG2 ARG A 91 18.519 13.788 18.584 1.00 38.61 H new ATOM 0 HG3 ARG A 91 17.159 14.543 18.466 1.00 38.61 H new ATOM 0 HD2 ARG A 91 17.816 14.061 20.787 1.00 42.84 H new ATOM 0 HD3 ARG A 91 16.370 13.580 20.453 1.00 42.84 H new ATOM 0 HE ARG A 91 17.869 11.667 19.556 1.00 48.03 H new ATOM 0 HH11 ARG A 91 17.457 12.530 22.865 1.00 47.03 H new ATOM 0 HH12 ARG A 91 17.930 11.235 23.427 1.00 47.03 H new ATOM 0 HH21 ARG A 91 18.587 9.620 20.454 1.00 49.02 H new ATOM 0 HH22 ARG A 91 18.630 9.432 21.931 1.00 49.02 H new ATOM 720 N SER A 92 16.407 12.149 14.511 1.00 33.61 N ATOM 721 CA SER A 92 15.952 11.059 13.541 1.00 30.69 C ATOM 722 C SER A 92 15.535 11.715 12.265 1.00 31.60 C ATOM 723 O SER A 92 15.297 12.919 12.237 1.00 30.32 O ATOM 724 CB SER A 92 14.811 10.196 14.096 1.00 32.33 C ATOM 725 OG SER A 92 13.612 10.937 14.295 1.00 31.18 O ATOM 0 H SER A 92 16.162 12.954 14.332 1.00 33.61 H new ATOM 0 HA SER A 92 16.696 10.454 13.395 1.00 30.69 H new ATOM 0 HB2 SER A 92 14.637 9.464 13.484 1.00 32.33 H new ATOM 0 HB3 SER A 92 15.088 9.803 14.938 1.00 32.33 H new ATOM 0 HG SER A 92 13.722 11.486 14.921 1.00 31.18 H new ATOM 726 N LEU A 93 15.358 10.858 11.228 1.00 32.03 N ATOM 727 CA LEU A 93 14.916 11.559 9.986 1.00 35.73 C ATOM 728 C LEU A 93 13.436 11.999 10.121 1.00 34.38 C ATOM 729 O LEU A 93 13.089 13.057 9.503 1.00 35.14 O ATOM 730 CB LEU A 93 15.244 10.581 8.794 1.00 35.70 C ATOM 731 CG LEU A 93 14.680 11.169 7.495 1.00 36.67 C ATOM 732 CD1 LEU A 93 15.729 12.161 6.910 1.00 36.34 C ATOM 733 CD2 LEU A 93 14.557 9.810 6.685 1.00 37.88 C ATOM 0 H LEU A 93 15.466 10.005 11.208 1.00 32.03 H new ATOM 0 HA LEU A 93 15.382 12.393 9.818 1.00 35.73 H new ATOM 0 HB2 LEU A 93 16.203 10.457 8.717 1.00 35.70 H new ATOM 0 HB3 LEU A 93 14.858 9.707 8.962 1.00 35.70 H new ATOM 0 HG LEU A 93 13.858 11.683 7.528 1.00 36.67 H new ATOM 0 HD11 LEU A 93 15.389 12.544 6.086 1.00 36.34 H new ATOM 0 HD12 LEU A 93 15.896 12.870 7.550 1.00 36.34 H new ATOM 0 HD13 LEU A 93 16.556 11.688 6.729 1.00 36.34 H new ATOM 0 HD21 LEU A 93 14.202 9.991 5.801 1.00 37.88 H new ATOM 0 HD22 LEU A 93 15.433 9.401 6.604 1.00 37.88 H new ATOM 0 HD23 LEU A 93 13.961 9.206 7.155 1.00 37.88 H new ATOM 734 N ASP A 94 12.529 11.344 10.838 1.00 36.31 N ATOM 735 CA ASP A 94 11.145 11.882 10.902 1.00 38.49 C ATOM 736 C ASP A 94 11.098 13.241 11.570 1.00 36.40 C ATOM 737 O ASP A 94 10.258 14.121 11.231 1.00 36.95 O ATOM 738 CB ASP A 94 10.093 10.987 11.546 1.00 41.50 C ATOM 739 CG ASP A 94 9.868 9.739 10.717 1.00 43.63 C ATOM 740 OD1 ASP A 94 9.918 9.948 9.450 1.00 45.44 O ATOM 741 OD2 ASP A 94 9.723 8.734 11.423 1.00 44.77 O ATOM 0 H ASP A 94 12.670 10.620 11.280 1.00 36.31 H new ATOM 0 HA ASP A 94 10.905 11.942 9.964 1.00 38.49 H new ATOM 0 HB2 ASP A 94 10.376 10.740 12.440 1.00 41.50 H new ATOM 0 HB3 ASP A 94 9.259 11.475 11.637 1.00 41.50 H new ATOM 742 N ASP A 95 11.960 13.471 12.505 1.00 37.64 N ATOM 743 CA ASP A 95 12.029 14.731 13.221 1.00 36.22 C ATOM 744 C ASP A 95 12.608 15.807 12.325 1.00 35.71 C ATOM 745 O ASP A 95 12.219 16.963 12.618 1.00 35.72 O ATOM 746 CB ASP A 95 12.880 14.594 14.502 1.00 36.13 C ATOM 747 CG ASP A 95 12.226 13.721 15.552 1.00 38.87 C ATOM 748 OD1 ASP A 95 11.002 13.462 15.644 1.00 39.27 O ATOM 749 OD2 ASP A 95 13.059 13.087 16.269 1.00 42.17 O ATOM 0 H ASP A 95 12.544 12.894 12.761 1.00 37.64 H new ATOM 0 HA ASP A 95 11.129 14.982 13.480 1.00 36.22 H new ATOM 0 HB2 ASP A 95 13.746 14.222 14.272 1.00 36.13 H new ATOM 0 HB3 ASP A 95 13.040 15.475 14.874 1.00 36.13 H new ATOM 750 N ALA A 96 13.622 15.363 11.501 1.00 33.02 N ATOM 751 CA ALA A 96 14.212 16.475 10.647 1.00 30.50 C ATOM 752 C ALA A 96 13.125 16.935 9.668 1.00 30.87 C ATOM 753 O ALA A 96 13.087 18.101 9.355 1.00 29.66 O ATOM 754 CB ALA A 96 15.520 15.919 10.062 1.00 29.25 C ATOM 0 H ALA A 96 13.940 14.568 11.422 1.00 33.02 H new ATOM 0 HA ALA A 96 14.463 17.286 11.115 1.00 30.50 H new ATOM 0 HB1 ALA A 96 15.939 16.594 9.505 1.00 29.25 H new ATOM 0 HB2 ALA A 96 16.121 15.678 10.784 1.00 29.25 H new ATOM 0 HB3 ALA A 96 15.327 15.133 9.527 1.00 29.25 H new ATOM 755 N LEU A 97 12.316 15.946 9.229 1.00 31.85 N ATOM 756 CA LEU A 97 11.190 16.367 8.240 1.00 33.50 C ATOM 757 C LEU A 97 10.102 17.000 9.075 1.00 33.87 C ATOM 758 O LEU A 97 9.535 17.950 8.591 1.00 38.10 O ATOM 759 CB LEU A 97 10.663 15.103 7.536 1.00 32.79 C ATOM 760 CG LEU A 97 11.809 14.434 6.850 1.00 34.74 C ATOM 761 CD1 LEU A 97 11.513 12.984 6.416 1.00 36.33 C ATOM 762 CD2 LEU A 97 12.302 15.428 5.777 1.00 35.62 C ATOM 0 H LEU A 97 12.360 15.113 9.439 1.00 31.85 H new ATOM 0 HA LEU A 97 11.504 16.988 7.564 1.00 33.50 H new ATOM 0 HB2 LEU A 97 10.258 14.502 8.180 1.00 32.79 H new ATOM 0 HB3 LEU A 97 9.975 15.336 6.894 1.00 32.79 H new ATOM 0 HG LEU A 97 12.551 14.258 7.450 1.00 34.74 H new ATOM 0 HD11 LEU A 97 12.295 12.611 5.979 1.00 36.33 H new ATOM 0 HD12 LEU A 97 11.293 12.451 7.196 1.00 36.33 H new ATOM 0 HD13 LEU A 97 10.764 12.977 5.799 1.00 36.33 H new ATOM 0 HD21 LEU A 97 13.051 15.041 5.298 1.00 35.62 H new ATOM 0 HD22 LEU A 97 11.582 15.616 5.154 1.00 35.62 H new ATOM 0 HD23 LEU A 97 12.583 16.253 6.204 1.00 35.62 H new ATOM 763 N LYS A 98 9.837 16.585 10.292 0.50 33.14 N ATOM 764 CA LYS A 98 8.764 17.304 11.083 0.50 33.25 C ATOM 765 C LYS A 98 9.215 18.745 11.219 0.50 31.99 C ATOM 766 O LYS A 98 8.342 19.648 11.267 0.50 33.98 O ATOM 767 CB LYS A 98 8.628 16.488 12.365 0.50 35.03 C ATOM 768 CG LYS A 98 7.266 15.927 12.790 0.50 37.60 C ATOM 769 CD LYS A 98 7.416 15.070 14.119 0.50 35.85 C ATOM 770 CE LYS A 98 8.636 14.159 13.939 0.50 37.70 C ATOM 771 NZ LYS A 98 8.640 12.982 14.934 0.50 38.34 N ATOM 0 H LYS A 98 10.223 15.929 10.692 0.50 33.14 H new ATOM 0 HA LYS A 98 7.879 17.361 10.690 0.50 33.25 H new ATOM 0 HB2 LYS A 98 9.237 15.736 12.292 0.50 35.03 H new ATOM 0 HB3 LYS A 98 8.949 17.043 13.093 0.50 35.03 H new ATOM 0 HG2 LYS A 98 6.640 16.654 12.935 0.50 37.60 H new ATOM 0 HG3 LYS A 98 6.900 15.375 12.081 0.50 37.60 H new ATOM 0 HD2 LYS A 98 7.532 15.649 14.888 0.50 35.85 H new ATOM 0 HD3 LYS A 98 6.617 14.544 14.279 0.50 35.85 H new ATOM 0 HE2 LYS A 98 8.648 13.813 13.033 0.50 37.70 H new ATOM 0 HE3 LYS A 98 9.446 14.680 14.055 0.50 37.70 H new ATOM 0 HZ1 LYS A 98 9.464 12.862 15.249 0.50 38.34 H new ATOM 0 HZ2 LYS A 98 8.088 13.161 15.609 0.50 38.34 H new ATOM 0 HZ3 LYS A 98 8.371 12.242 14.520 0.50 38.34 H new ATOM 772 N LEU A 99 10.488 19.122 11.177 0.50 31.98 N ATOM 773 CA LEU A 99 11.075 20.467 11.340 0.50 30.10 C ATOM 774 C LEU A 99 10.917 21.476 10.240 0.50 29.87 C ATOM 775 O LEU A 99 10.748 22.683 10.547 0.50 29.19 O ATOM 776 CB LEU A 99 12.491 20.263 11.977 0.50 30.27 C ATOM 777 CG LEU A 99 13.476 21.236 12.523 0.50 29.28 C ATOM 778 CD1 LEU A 99 14.956 20.880 12.362 0.50 29.32 C ATOM 779 CD2 LEU A 99 13.248 22.597 11.815 0.50 29.54 C ATOM 0 H LEU A 99 11.103 18.538 11.037 0.50 31.98 H new ATOM 0 HA LEU A 99 10.518 20.979 11.946 0.50 30.10 H new ATOM 0 HB2 LEU A 99 12.335 19.647 12.710 0.50 30.27 H new ATOM 0 HB3 LEU A 99 12.988 19.777 11.300 0.50 30.27 H new ATOM 0 HG LEU A 99 13.313 21.245 13.479 0.50 29.28 H new ATOM 0 HD11 LEU A 99 15.502 21.581 12.752 0.50 29.32 H new ATOM 0 HD12 LEU A 99 15.138 20.041 12.813 0.50 29.32 H new ATOM 0 HD13 LEU A 99 15.167 20.793 11.419 0.50 29.32 H new ATOM 0 HD21 LEU A 99 13.880 23.249 12.155 0.50 29.54 H new ATOM 0 HD22 LEU A 99 13.377 22.491 10.860 0.50 29.54 H new ATOM 0 HD23 LEU A 99 12.344 22.904 11.987 0.50 29.54 H new ATOM 780 N THR A 100 10.824 21.066 8.994 0.50 28.78 N ATOM 781 CA THR A 100 10.650 21.971 7.861 0.50 30.89 C ATOM 782 C THR A 100 9.223 22.552 7.846 0.50 32.84 C ATOM 783 O THR A 100 9.072 23.565 7.159 0.50 34.53 O ATOM 784 CB THR A 100 10.975 21.143 6.537 0.50 29.02 C ATOM 785 OG1 THR A 100 9.702 20.407 6.414 0.50 29.42 O ATOM 786 CG2 THR A 100 12.219 20.281 6.523 0.50 28.60 C ATOM 0 H THR A 100 10.860 20.237 8.769 0.50 28.78 H new ATOM 0 HA THR A 100 11.251 22.730 7.925 0.50 30.89 H new ATOM 0 HB THR A 100 11.224 21.703 5.785 0.50 29.02 H new ATOM 0 HG1 THR A 100 9.728 19.913 5.735 0.50 29.42 H new ATOM 0 HG21 THR A 100 12.295 19.836 5.664 0.50 28.60 H new ATOM 0 HG22 THR A 100 13.000 20.837 6.669 0.50 28.60 H new ATOM 0 HG23 THR A 100 12.160 19.616 7.227 0.50 28.60 H new ATOM 787 N GLU A 101 8.307 21.949 8.603 0.50 32.27 N ATOM 788 CA GLU A 101 6.878 22.345 8.761 0.50 36.07 C ATOM 789 C GLU A 101 6.553 23.292 9.942 0.50 36.27 C ATOM 790 O GLU A 101 5.403 23.509 10.390 0.50 36.33 O ATOM 791 CB GLU A 101 5.950 21.175 9.127 0.50 37.28 C ATOM 792 CG GLU A 101 5.724 19.842 8.444 0.50 37.79 C ATOM 793 CD GLU A 101 5.160 19.591 7.101 0.50 39.21 C ATOM 794 OE1 GLU A 101 4.277 20.194 6.463 0.50 40.81 O ATOM 795 OE2 GLU A 101 5.698 18.558 6.526 0.50 40.47 O ATOM 0 H GLU A 101 8.502 21.255 9.072 0.50 32.27 H new ATOM 0 HA GLU A 101 6.737 22.749 7.890 0.50 36.07 H new ATOM 0 HB2 GLU A 101 6.204 20.941 10.033 0.50 37.28 H new ATOM 0 HB3 GLU A 101 5.067 21.574 9.174 0.50 37.28 H new ATOM 0 HG2 GLU A 101 6.593 19.411 8.438 0.50 37.79 H new ATOM 0 HG3 GLU A 101 5.161 19.338 9.053 0.50 37.79 H new ATOM 796 N GLN A 102 7.564 23.824 10.561 0.50 36.38 N ATOM 797 CA GLN A 102 7.590 24.751 11.675 0.50 37.76 C ATOM 798 C GLN A 102 7.653 26.094 10.911 0.50 35.35 C ATOM 799 O GLN A 102 8.477 26.213 10.004 0.50 36.91 O ATOM 800 CB GLN A 102 8.824 24.661 12.544 0.50 35.61 C ATOM 801 CG GLN A 102 8.989 23.278 13.242 0.50 36.98 C ATOM 802 CD GLN A 102 7.882 22.924 14.201 0.50 38.47 C ATOM 803 OE1 GLN A 102 7.591 23.734 15.104 0.50 39.06 O ATOM 804 NE2 GLN A 102 7.283 21.712 14.073 0.50 39.38 N ATOM 0 H GLN A 102 8.364 23.631 10.312 0.50 36.38 H new ATOM 0 HA GLN A 102 6.849 24.601 12.283 0.50 37.76 H new ATOM 0 HB2 GLN A 102 9.608 24.837 12.000 0.50 35.61 H new ATOM 0 HB3 GLN A 102 8.786 25.355 13.221 0.50 35.61 H new ATOM 0 HG2 GLN A 102 9.043 22.590 12.561 0.50 36.98 H new ATOM 0 HG3 GLN A 102 9.832 23.270 13.722 0.50 36.98 H new ATOM 0 HE21 GLN A 102 7.514 21.183 13.435 0.50 39.38 H new ATOM 0 HE22 GLN A 102 6.673 21.473 14.630 0.50 39.38 H new ATOM 805 N PRO A 103 6.842 27.071 11.261 0.50 36.07 N ATOM 806 CA PRO A 103 6.855 28.406 10.632 0.50 35.91 C ATOM 807 C PRO A 103 8.312 28.923 10.616 0.50 37.03 C ATOM 808 O PRO A 103 8.671 29.813 9.784 0.50 37.84 O ATOM 809 CB PRO A 103 6.012 29.256 11.598 0.50 36.36 C ATOM 810 CG PRO A 103 5.919 28.392 12.835 0.50 36.21 C ATOM 811 CD PRO A 103 5.796 26.954 12.316 0.50 36.22 C ATOM 0 HA PRO A 103 6.519 28.421 9.722 0.50 35.91 H new ATOM 0 HB2 PRO A 103 6.436 30.108 11.788 0.50 36.36 H new ATOM 0 HB3 PRO A 103 5.135 29.451 11.231 0.50 36.36 H new ATOM 0 HG2 PRO A 103 6.704 28.496 13.395 0.50 36.21 H new ATOM 0 HG3 PRO A 103 5.151 28.636 13.375 0.50 36.21 H new ATOM 0 HD2 PRO A 103 5.999 26.284 12.987 0.50 36.22 H new ATOM 0 HD3 PRO A 103 4.916 26.746 11.964 0.50 36.22 H new ATOM 812 N GLU A 104 9.124 28.354 11.522 0.50 36.86 N ATOM 813 CA GLU A 104 10.536 28.878 11.544 0.50 38.21 C ATOM 814 C GLU A 104 10.994 28.747 10.090 0.50 37.57 C ATOM 815 O GLU A 104 11.053 29.777 9.378 0.50 40.04 O ATOM 816 CB GLU A 104 11.521 28.181 12.468 0.50 39.30 C ATOM 817 CG GLU A 104 11.003 27.389 13.658 0.50 40.97 C ATOM 818 CD GLU A 104 11.882 26.356 14.334 0.50 41.86 C ATOM 819 OE1 GLU A 104 13.145 26.596 14.175 0.50 43.02 O ATOM 820 OE2 GLU A 104 11.342 25.457 14.971 0.50 41.89 O ATOM 0 H GLU A 104 8.924 27.732 12.081 0.50 36.86 H new ATOM 0 HA GLU A 104 10.526 29.779 11.904 0.50 38.21 H new ATOM 0 HB2 GLU A 104 12.050 27.576 11.925 0.50 39.30 H new ATOM 0 HB3 GLU A 104 12.126 28.857 12.811 0.50 39.30 H new ATOM 0 HG2 GLU A 104 10.741 28.030 14.337 0.50 40.97 H new ATOM 0 HG3 GLU A 104 10.196 26.934 13.370 0.50 40.97 H new ATOM 821 N LEU A 105 11.212 27.511 9.611 0.50 38.07 N ATOM 822 CA LEU A 105 11.684 27.089 8.316 0.50 36.29 C ATOM 823 C LEU A 105 10.689 26.907 7.165 0.50 35.09 C ATOM 824 O LEU A 105 11.087 26.856 5.988 0.50 33.63 O ATOM 825 CB LEU A 105 12.396 25.718 8.549 0.50 35.07 C ATOM 826 CG LEU A 105 13.631 25.569 9.427 0.50 34.63 C ATOM 827 CD1 LEU A 105 14.208 24.093 9.399 0.50 33.45 C ATOM 828 CD2 LEU A 105 14.782 26.464 8.904 0.50 34.34 C ATOM 0 H LEU A 105 11.063 26.829 10.113 0.50 38.07 H new ATOM 0 HA LEU A 105 12.231 27.827 8.005 0.50 36.29 H new ATOM 0 HB2 LEU A 105 11.726 25.117 8.910 0.50 35.07 H new ATOM 0 HB3 LEU A 105 12.638 25.380 7.673 0.50 35.07 H new ATOM 0 HG LEU A 105 13.347 25.814 10.321 0.50 34.63 H new ATOM 0 HD11 LEU A 105 14.991 24.041 9.969 0.50 33.45 H new ATOM 0 HD12 LEU A 105 13.533 23.475 9.721 0.50 33.45 H new ATOM 0 HD13 LEU A 105 14.454 23.859 8.490 0.50 33.45 H new ATOM 0 HD21 LEU A 105 15.560 26.357 9.474 0.50 34.34 H new ATOM 0 HD22 LEU A 105 15.008 26.204 7.997 0.50 34.34 H new ATOM 0 HD23 LEU A 105 14.500 27.392 8.913 0.50 34.34 H new ATOM 829 N ALA A 106 9.425 26.718 7.491 0.50 36.14 N ATOM 830 CA ALA A 106 8.327 26.440 6.522 0.50 37.48 C ATOM 831 C ALA A 106 8.320 27.390 5.351 0.50 37.37 C ATOM 832 O ALA A 106 8.179 26.911 4.202 0.50 38.25 O ATOM 833 CB ALA A 106 7.008 26.293 7.311 0.50 36.40 C ATOM 0 H ALA A 106 9.152 26.745 8.306 0.50 36.14 H new ATOM 0 HA ALA A 106 8.471 25.593 6.071 0.50 37.48 H new ATOM 0 HB1 ALA A 106 6.281 26.111 6.695 0.50 36.40 H new ATOM 0 HB2 ALA A 106 7.088 25.560 7.942 0.50 36.40 H new ATOM 0 HB3 ALA A 106 6.826 27.115 7.793 0.50 36.40 H new ATOM 834 N ASN A 107 8.444 28.704 5.613 0.50 38.01 N ATOM 835 CA ASN A 107 8.462 29.647 4.449 0.50 38.75 C ATOM 836 C ASN A 107 9.811 29.780 3.766 0.50 36.96 C ATOM 837 O ASN A 107 9.872 30.441 2.707 0.50 37.06 O ATOM 838 CB ASN A 107 7.952 31.014 4.989 0.50 38.48 C ATOM 839 CG ASN A 107 8.889 31.486 6.116 0.50 40.81 C ATOM 840 OD1 ASN A 107 9.833 30.742 6.502 0.50 42.31 O ATOM 841 ND2 ASN A 107 8.678 32.719 6.648 0.50 42.97 N ATOM 0 H ASN A 107 8.515 29.060 6.393 0.50 38.01 H new ATOM 0 HA ASN A 107 7.891 29.297 3.748 0.50 38.75 H new ATOM 0 HB2 ASN A 107 7.930 31.670 4.275 0.50 38.48 H new ATOM 0 HB3 ASN A 107 7.045 30.926 5.322 0.50 38.48 H new ATOM 0 HD21 ASN A 107 9.196 33.014 7.268 0.50 42.97 H new ATOM 0 HD22 ASN A 107 8.026 33.204 6.365 0.50 42.97 H new ATOM 842 N LYS A 108 10.882 29.267 4.380 0.50 36.47 N ATOM 843 CA LYS A 108 12.260 29.287 3.984 0.50 37.45 C ATOM 844 C LYS A 108 12.903 28.242 3.061 0.50 35.75 C ATOM 845 O LYS A 108 13.879 28.527 2.374 0.50 34.92 O ATOM 846 CB LYS A 108 13.116 28.861 5.271 0.50 36.18 C ATOM 847 CG LYS A 108 13.367 30.176 6.052 0.50 37.28 C ATOM 848 CD LYS A 108 14.047 30.019 7.423 0.50 37.49 C ATOM 849 CE LYS A 108 13.855 31.288 8.253 0.50 38.37 C ATOM 850 NZ LYS A 108 14.357 31.154 9.686 0.50 38.47 N ATOM 0 H LYS A 108 10.788 28.852 5.128 0.50 36.47 H new ATOM 0 HA LYS A 108 12.268 30.155 3.552 0.50 37.45 H new ATOM 0 HB2 LYS A 108 12.634 28.218 5.814 0.50 36.18 H new ATOM 0 HB3 LYS A 108 13.952 28.443 5.012 0.50 36.18 H new ATOM 0 HG2 LYS A 108 13.914 30.759 5.503 0.50 37.28 H new ATOM 0 HG3 LYS A 108 12.516 30.624 6.181 0.50 37.28 H new ATOM 0 HD2 LYS A 108 13.672 29.257 7.892 0.50 37.49 H new ATOM 0 HD3 LYS A 108 14.993 29.842 7.304 0.50 37.49 H new ATOM 0 HE2 LYS A 108 14.320 32.022 7.822 0.50 38.37 H new ATOM 0 HE3 LYS A 108 12.913 31.518 8.267 0.50 38.37 H new ATOM 0 HZ1 LYS A 108 14.221 31.918 10.121 0.50 38.47 H new ATOM 0 HZ2 LYS A 108 13.916 30.498 10.095 0.50 38.47 H new ATOM 0 HZ3 LYS A 108 15.227 30.968 9.680 0.50 38.47 H new ATOM 851 N VAL A 109 12.399 27.032 3.154 1.00 35.51 N ATOM 852 CA VAL A 109 12.925 25.853 2.456 1.00 36.75 C ATOM 853 C VAL A 109 12.176 25.416 1.198 1.00 35.29 C ATOM 854 O VAL A 109 10.931 25.141 1.420 1.00 34.68 O ATOM 855 CB VAL A 109 13.049 24.595 3.419 1.00 36.57 C ATOM 856 CG1 VAL A 109 13.515 23.338 2.661 1.00 35.52 C ATOM 857 CG2 VAL A 109 13.823 24.719 4.702 1.00 36.45 C ATOM 0 H VAL A 109 11.713 26.855 3.642 1.00 35.51 H new ATOM 0 HA VAL A 109 13.796 26.163 2.164 1.00 36.75 H new ATOM 0 HB VAL A 109 12.131 24.523 3.723 1.00 36.57 H new ATOM 0 HG11 VAL A 109 13.579 22.593 3.279 1.00 35.52 H new ATOM 0 HG12 VAL A 109 12.876 23.125 1.963 1.00 35.52 H new ATOM 0 HG13 VAL A 109 14.384 23.503 2.263 1.00 35.52 H new ATOM 0 HG21 VAL A 109 13.806 23.872 5.174 1.00 36.45 H new ATOM 0 HG22 VAL A 109 14.742 24.960 4.504 1.00 36.45 H new ATOM 0 HG23 VAL A 109 13.422 25.406 5.257 1.00 36.45 H new ATOM 858 N ASP A 110 13.004 25.288 0.204 1.00 32.01 N ATOM 859 CA ASP A 110 12.530 24.657 -1.075 1.00 33.14 C ATOM 860 C ASP A 110 12.768 23.162 -1.049 1.00 30.80 C ATOM 861 O ASP A 110 11.925 22.309 -0.524 1.00 29.90 O ATOM 862 CB ASP A 110 13.114 25.525 -2.233 1.00 32.98 C ATOM 863 CG ASP A 110 12.694 24.879 -3.554 1.00 37.01 C ATOM 864 OD1 ASP A 110 11.660 24.156 -3.428 1.00 37.58 O ATOM 865 OD2 ASP A 110 13.230 24.902 -4.644 1.00 37.71 O ATOM 0 H ASP A 110 13.826 25.539 0.210 1.00 32.01 H new ATOM 0 HA ASP A 110 11.571 24.670 -1.218 1.00 33.14 H new ATOM 0 HB2 ASP A 110 12.781 26.435 -2.178 1.00 32.98 H new ATOM 0 HB3 ASP A 110 14.081 25.572 -2.169 1.00 32.98 H new ATOM 866 N MET A 111 13.828 22.537 -1.570 1.00 28.78 N ATOM 867 CA MET A 111 14.121 21.128 -1.579 1.00 28.69 C ATOM 868 C MET A 111 14.901 20.645 -0.312 1.00 26.09 C ATOM 869 O MET A 111 15.752 21.371 0.222 1.00 28.67 O ATOM 870 CB MET A 111 15.016 20.714 -2.795 1.00 29.92 C ATOM 871 CG MET A 111 14.280 21.366 -4.022 1.00 32.34 C ATOM 872 SD MET A 111 15.439 20.890 -5.408 1.00 34.32 S ATOM 873 CE MET A 111 16.252 22.415 -5.657 1.00 37.88 C ATOM 0 H MET A 111 14.448 22.985 -1.963 1.00 28.78 H new ATOM 0 HA MET A 111 13.243 20.717 -1.619 1.00 28.69 H new ATOM 0 HB2 MET A 111 15.922 21.047 -2.703 1.00 29.92 H new ATOM 0 HB3 MET A 111 15.076 19.750 -2.884 1.00 29.92 H new ATOM 0 HG2 MET A 111 13.387 21.009 -4.149 1.00 32.34 H new ATOM 0 HG3 MET A 111 14.190 22.327 -3.930 1.00 32.34 H new ATOM 0 HE1 MET A 111 17.203 22.260 -5.772 1.00 37.88 H new ATOM 0 HE2 MET A 111 15.897 22.846 -6.450 1.00 37.88 H new ATOM 0 HE3 MET A 111 16.109 22.988 -4.887 1.00 37.88 H new ATOM 874 N VAL A 112 14.739 19.393 -0.070 1.00 25.77 N ATOM 875 CA VAL A 112 15.365 18.575 0.967 1.00 25.30 C ATOM 876 C VAL A 112 16.272 17.554 0.276 1.00 24.38 C ATOM 877 O VAL A 112 15.767 16.711 -0.506 1.00 24.42 O ATOM 878 CB VAL A 112 14.336 17.999 1.905 1.00 26.09 C ATOM 879 CG1 VAL A 112 15.258 17.286 2.958 1.00 26.96 C ATOM 880 CG2 VAL A 112 13.334 19.069 2.433 1.00 25.52 C ATOM 0 H VAL A 112 14.202 18.924 -0.551 1.00 25.77 H new ATOM 0 HA VAL A 112 15.928 19.107 1.551 1.00 25.30 H new ATOM 0 HB VAL A 112 13.702 17.377 1.514 1.00 26.09 H new ATOM 0 HG11 VAL A 112 14.708 16.863 3.636 1.00 26.96 H new ATOM 0 HG12 VAL A 112 15.797 16.613 2.513 1.00 26.96 H new ATOM 0 HG13 VAL A 112 15.839 17.941 3.375 1.00 26.96 H new ATOM 0 HG21 VAL A 112 12.696 18.648 3.030 1.00 25.52 H new ATOM 0 HG22 VAL A 112 13.819 19.758 2.913 1.00 25.52 H new ATOM 0 HG23 VAL A 112 12.862 19.468 1.685 1.00 25.52 H new ATOM 881 N TRP A 113 17.589 17.644 0.536 1.00 23.25 N ATOM 882 CA TRP A 113 18.651 16.791 0.019 1.00 22.93 C ATOM 883 C TRP A 113 19.240 15.829 1.074 1.00 24.14 C ATOM 884 O TRP A 113 19.830 16.396 1.974 1.00 25.09 O ATOM 885 CB TRP A 113 19.675 17.700 -0.665 1.00 22.38 C ATOM 886 CG TRP A 113 19.213 18.232 -2.019 1.00 24.03 C ATOM 887 CD1 TRP A 113 18.729 19.525 -2.265 1.00 22.83 C ATOM 888 CD2 TRP A 113 19.260 17.516 -3.271 1.00 23.42 C ATOM 889 NE1 TRP A 113 18.400 19.626 -3.622 1.00 24.85 N ATOM 890 CE2 TRP A 113 18.865 18.452 -4.232 1.00 24.03 C ATOM 891 CE3 TRP A 113 19.826 16.283 -3.697 1.00 24.75 C ATOM 892 CZ2 TRP A 113 18.670 18.129 -5.611 1.00 23.48 C ATOM 893 CZ3 TRP A 113 19.704 15.894 -5.030 1.00 23.38 C ATOM 894 CH2 TRP A 113 18.978 16.834 -5.845 1.00 23.15 C ATOM 0 H TRP A 113 17.897 18.254 1.059 1.00 23.25 H new ATOM 0 HA TRP A 113 18.294 16.173 -0.638 1.00 22.93 H new ATOM 0 HB2 TRP A 113 19.871 18.450 -0.082 1.00 22.38 H new ATOM 0 HB3 TRP A 113 20.503 17.209 -0.784 1.00 22.38 H new ATOM 0 HD1 TRP A 113 18.641 20.202 -1.633 1.00 22.83 H new ATOM 0 HE1 TRP A 113 17.993 20.279 -4.006 1.00 24.85 H new ATOM 0 HE3 TRP A 113 20.275 15.740 -3.090 1.00 24.75 H new ATOM 0 HZ2 TRP A 113 18.372 18.727 -6.258 1.00 23.48 H new ATOM 0 HZ3 TRP A 113 20.058 15.101 -5.362 1.00 23.38 H new ATOM 0 HH2 TRP A 113 18.674 16.498 -6.657 1.00 23.15 H new ATOM 895 N ILE A 114 19.148 14.526 1.119 1.00 21.68 N ATOM 896 CA ILE A 114 19.819 13.590 1.978 1.00 22.07 C ATOM 897 C ILE A 114 21.208 13.385 1.441 1.00 23.37 C ATOM 898 O ILE A 114 21.366 12.802 0.259 1.00 24.66 O ATOM 899 CB ILE A 114 18.898 12.283 2.142 1.00 22.40 C ATOM 900 CG1 ILE A 114 17.658 12.673 3.034 1.00 25.75 C ATOM 901 CG2 ILE A 114 19.817 11.180 2.884 1.00 23.99 C ATOM 902 CD1 ILE A 114 16.354 11.839 2.714 1.00 27.56 C ATOM 0 H ILE A 114 18.622 14.115 0.576 1.00 21.68 H new ATOM 0 HA ILE A 114 19.943 13.907 2.886 1.00 22.07 H new ATOM 0 HB ILE A 114 18.573 11.937 1.296 1.00 22.40 H new ATOM 0 HG12 ILE A 114 17.890 12.549 3.968 1.00 25.75 H new ATOM 0 HG13 ILE A 114 17.467 13.616 2.912 1.00 25.75 H new ATOM 0 HG21 ILE A 114 19.307 10.365 3.009 1.00 23.99 H new ATOM 0 HG22 ILE A 114 20.599 10.992 2.341 1.00 23.99 H new ATOM 0 HG23 ILE A 114 20.098 11.521 3.748 1.00 23.99 H new ATOM 0 HD11 ILE A 114 15.634 12.128 3.296 1.00 27.56 H new ATOM 0 HD12 ILE A 114 16.098 11.980 1.789 1.00 27.56 H new ATOM 0 HD13 ILE A 114 16.529 10.896 2.861 1.00 27.56 H new ATOM 903 N VAL A 115 22.368 13.671 2.024 1.00 21.97 N ATOM 904 CA VAL A 115 23.700 13.520 1.492 1.00 22.31 C ATOM 905 C VAL A 115 24.543 12.394 2.142 1.00 21.74 C ATOM 906 O VAL A 115 25.680 12.423 1.848 1.00 25.42 O ATOM 907 CB VAL A 115 24.369 14.929 1.368 1.00 21.70 C ATOM 908 CG1 VAL A 115 23.264 15.930 0.931 1.00 23.13 C ATOM 909 CG2 VAL A 115 24.884 15.266 2.798 1.00 24.93 C ATOM 0 H VAL A 115 22.387 13.990 2.822 1.00 21.97 H new ATOM 0 HA VAL A 115 23.639 13.166 0.591 1.00 22.31 H new ATOM 0 HB VAL A 115 25.094 14.965 0.725 1.00 21.70 H new ATOM 0 HG11 VAL A 115 23.647 16.817 0.844 1.00 23.13 H new ATOM 0 HG12 VAL A 115 22.895 15.653 0.078 1.00 23.13 H new ATOM 0 HG13 VAL A 115 22.560 15.946 1.598 1.00 23.13 H new ATOM 0 HG21 VAL A 115 25.314 16.136 2.791 1.00 24.93 H new ATOM 0 HG22 VAL A 115 24.137 15.280 3.416 1.00 24.93 H new ATOM 0 HG23 VAL A 115 25.523 14.592 3.079 1.00 24.93 H new ATOM 910 N GLY A 116 23.900 11.572 2.911 1.00 22.99 N ATOM 911 CA GLY A 116 24.438 10.308 3.535 1.00 23.29 C ATOM 912 C GLY A 116 24.629 10.358 5.070 1.00 18.29 C ATOM 913 O GLY A 116 24.270 11.374 5.532 1.00 23.40 O ATOM 0 H GLY A 116 23.078 11.710 3.122 1.00 22.99 H new ATOM 0 HA2 GLY A 116 23.836 9.578 3.322 1.00 23.29 H new ATOM 0 HA3 GLY A 116 25.292 10.100 3.124 1.00 23.29 H new ATOM 914 N GLY A 117 25.172 9.323 5.688 1.00 22.16 N ATOM 915 CA GLY A 117 25.615 8.141 5.113 1.00 22.23 C ATOM 916 C GLY A 117 24.699 6.946 4.943 1.00 24.15 C ATOM 917 O GLY A 117 23.577 7.185 4.768 1.00 22.48 O ATOM 0 H GLY A 117 25.288 9.326 6.540 1.00 22.16 H new ATOM 0 HA2 GLY A 117 25.950 8.366 4.231 1.00 22.23 H new ATOM 0 HA3 GLY A 117 26.374 7.841 5.637 1.00 22.23 H new ATOM 918 N SER A 118 25.203 5.712 4.870 1.00 24.82 N ATOM 919 CA SER A 118 24.432 4.478 4.614 1.00 29.02 C ATOM 920 C SER A 118 23.085 4.256 5.302 1.00 28.00 C ATOM 921 O SER A 118 21.963 4.172 4.742 1.00 26.76 O ATOM 922 CB SER A 118 25.232 3.230 4.991 1.00 29.48 C ATOM 923 OG SER A 118 26.460 3.255 4.340 1.00 35.72 O ATOM 0 H SER A 118 26.043 5.559 4.973 1.00 24.82 H new ATOM 0 HA SER A 118 24.254 4.615 3.670 1.00 29.02 H new ATOM 0 HB2 SER A 118 25.364 3.196 5.951 1.00 29.48 H new ATOM 0 HB3 SER A 118 24.740 2.431 4.744 1.00 29.48 H new ATOM 0 HG SER A 118 26.436 2.740 3.677 1.00 35.72 H new ATOM 924 N SER A 119 23.191 4.453 6.664 1.00 29.92 N ATOM 925 CA SER A 119 22.069 4.417 7.605 1.00 30.80 C ATOM 926 C SER A 119 20.957 5.379 7.241 1.00 28.96 C ATOM 927 O SER A 119 19.705 5.141 7.255 1.00 30.37 O ATOM 928 CB SER A 119 22.850 4.838 8.928 1.00 34.01 C ATOM 929 OG SER A 119 24.347 5.269 8.505 1.00 35.26 O ATOM 0 H SER A 119 23.944 4.613 7.048 1.00 29.92 H new ATOM 0 HA SER A 119 21.592 3.574 7.653 1.00 30.80 H new ATOM 0 HB2 SER A 119 22.397 5.573 9.370 1.00 34.01 H new ATOM 0 HB3 SER A 119 22.874 4.100 9.557 1.00 34.01 H new ATOM 0 HG SER A 119 24.421 6.105 8.548 1.00 35.26 H new ATOM 930 N VAL A 120 21.267 6.607 6.759 1.00 28.08 N ATOM 931 CA VAL A 120 20.383 7.729 6.385 1.00 24.83 C ATOM 932 C VAL A 120 19.638 7.356 4.999 1.00 23.68 C ATOM 933 O VAL A 120 18.429 7.581 4.955 1.00 28.18 O ATOM 934 CB VAL A 120 21.104 9.083 6.431 1.00 25.27 C ATOM 935 CG1 VAL A 120 20.137 10.325 6.361 1.00 23.36 C ATOM 936 CG2 VAL A 120 21.930 9.193 7.758 1.00 25.20 C ATOM 0 H VAL A 120 22.091 6.819 6.632 1.00 28.08 H new ATOM 0 HA VAL A 120 19.684 7.854 7.045 1.00 24.83 H new ATOM 0 HB VAL A 120 21.671 9.107 5.644 1.00 25.27 H new ATOM 0 HG11 VAL A 120 20.657 11.143 6.395 1.00 23.36 H new ATOM 0 HG12 VAL A 120 19.633 10.297 5.533 1.00 23.36 H new ATOM 0 HG13 VAL A 120 19.524 10.301 7.113 1.00 23.36 H new ATOM 0 HG21 VAL A 120 22.385 10.049 7.786 1.00 25.20 H new ATOM 0 HG22 VAL A 120 21.332 9.120 8.518 1.00 25.20 H new ATOM 0 HG23 VAL A 120 22.585 8.478 7.792 1.00 25.20 H new ATOM 937 N TYR A 121 20.555 6.976 4.171 1.00 24.15 N ATOM 938 CA TYR A 121 20.001 6.582 2.793 1.00 25.81 C ATOM 939 C TYR A 121 18.958 5.467 3.017 1.00 25.56 C ATOM 940 O TYR A 121 17.860 5.483 2.446 1.00 28.05 O ATOM 941 CB TYR A 121 21.203 6.113 2.024 1.00 19.64 C ATOM 942 CG TYR A 121 22.095 7.218 1.413 1.00 19.10 C ATOM 943 CD1 TYR A 121 21.614 8.337 0.839 1.00 20.33 C ATOM 944 CD2 TYR A 121 23.448 6.943 1.529 1.00 20.01 C ATOM 945 CE1 TYR A 121 22.605 9.331 0.334 1.00 20.28 C ATOM 946 CE2 TYR A 121 24.481 7.814 0.957 1.00 17.95 C ATOM 947 CZ TYR A 121 23.864 8.998 0.426 1.00 18.67 C ATOM 948 OH TYR A 121 24.821 9.856 -0.042 1.00 16.02 O ATOM 0 H TYR A 121 21.403 6.922 4.302 1.00 24.15 H new ATOM 0 HA TYR A 121 19.557 7.295 2.308 1.00 25.81 H new ATOM 0 HB2 TYR A 121 21.750 5.571 2.614 1.00 19.64 H new ATOM 0 HB3 TYR A 121 20.900 5.535 1.307 1.00 19.64 H new ATOM 0 HD1 TYR A 121 20.699 8.484 0.760 1.00 20.33 H new ATOM 0 HD2 TYR A 121 23.711 6.177 1.987 1.00 20.01 H new ATOM 0 HE1 TYR A 121 22.340 10.146 -0.028 1.00 20.28 H new ATOM 0 HE2 TYR A 121 25.392 7.629 0.941 1.00 17.95 H new ATOM 0 HH TYR A 121 24.482 10.368 -0.615 1.00 16.02 H new ATOM 949 N LYS A 122 19.318 4.400 3.724 1.00 28.07 N ATOM 950 CA LYS A 122 18.468 3.203 3.932 1.00 33.99 C ATOM 951 C LYS A 122 17.029 3.536 4.361 1.00 35.63 C ATOM 952 O LYS A 122 16.018 3.043 3.870 1.00 34.08 O ATOM 953 CB LYS A 122 19.038 2.114 4.886 1.00 34.89 C ATOM 954 CG LYS A 122 18.268 0.809 4.583 1.00 39.34 C ATOM 955 CD LYS A 122 18.715 -0.419 5.349 1.00 42.41 C ATOM 956 CE LYS A 122 17.591 -1.507 5.426 1.00 45.07 C ATOM 957 NZ LYS A 122 17.155 -1.783 3.987 1.00 47.75 N ATOM 0 H LYS A 122 20.083 4.340 4.111 1.00 28.07 H new ATOM 0 HA LYS A 122 18.463 2.819 3.041 1.00 33.99 H new ATOM 0 HB2 LYS A 122 19.990 1.994 4.741 1.00 34.89 H new ATOM 0 HB3 LYS A 122 18.923 2.374 5.813 1.00 34.89 H new ATOM 0 HG2 LYS A 122 17.328 0.959 4.768 1.00 39.34 H new ATOM 0 HG3 LYS A 122 18.344 0.622 3.634 1.00 39.34 H new ATOM 0 HD2 LYS A 122 19.500 -0.797 4.923 1.00 42.41 H new ATOM 0 HD3 LYS A 122 18.976 -0.161 6.247 1.00 42.41 H new ATOM 0 HE2 LYS A 122 17.922 -2.316 5.848 1.00 45.07 H new ATOM 0 HE3 LYS A 122 16.844 -1.194 5.959 1.00 45.07 H new ATOM 0 HZ1 LYS A 122 16.707 -2.551 3.954 1.00 47.75 H new ATOM 0 HZ2 LYS A 122 16.631 -1.122 3.704 1.00 47.75 H new ATOM 0 HZ3 LYS A 122 17.873 -1.836 3.464 1.00 47.75 H new ATOM 958 N GLU A 123 16.877 4.388 5.376 1.00 36.28 N ATOM 959 CA GLU A 123 15.635 4.940 5.922 1.00 37.79 C ATOM 960 C GLU A 123 14.983 5.866 4.900 1.00 37.42 C ATOM 961 O GLU A 123 13.729 5.549 4.686 1.00 36.54 O ATOM 962 CB GLU A 123 16.209 5.755 7.078 1.00 37.92 C ATOM 963 CG GLU A 123 15.601 6.687 8.115 1.00 42.80 C ATOM 964 CD GLU A 123 14.449 6.033 8.883 1.00 45.28 C ATOM 965 OE1 GLU A 123 14.154 4.789 8.887 1.00 48.10 O ATOM 966 OE2 GLU A 123 13.783 6.929 9.452 1.00 43.66 O ATOM 0 H GLU A 123 17.563 4.685 5.802 1.00 36.28 H new ATOM 0 HA GLU A 123 14.957 4.290 6.165 1.00 37.79 H new ATOM 0 HB2 GLU A 123 16.672 5.092 7.614 1.00 37.92 H new ATOM 0 HB3 GLU A 123 16.889 6.302 6.654 1.00 37.92 H new ATOM 0 HG2 GLU A 123 16.289 6.963 8.741 1.00 42.80 H new ATOM 0 HG3 GLU A 123 15.279 7.490 7.676 1.00 42.80 H new ATOM 967 N ALA A 124 15.614 6.904 4.287 1.00 31.32 N ATOM 968 CA ALA A 124 14.920 7.711 3.212 1.00 30.44 C ATOM 969 C ALA A 124 14.321 6.796 2.153 1.00 29.88 C ATOM 970 O ALA A 124 13.209 7.015 1.752 1.00 32.54 O ATOM 971 CB ALA A 124 15.775 8.882 2.636 1.00 27.30 C ATOM 0 H ALA A 124 16.416 7.157 4.465 1.00 31.32 H new ATOM 0 HA ALA A 124 14.182 8.173 3.639 1.00 30.44 H new ATOM 0 HB1 ALA A 124 15.266 9.350 1.956 1.00 27.30 H new ATOM 0 HB2 ALA A 124 16.003 9.498 3.350 1.00 27.30 H new ATOM 0 HB3 ALA A 124 16.588 8.527 2.244 1.00 27.30 H new ATOM 972 N MET A 125 15.018 5.712 1.779 1.00 32.51 N ATOM 973 CA MET A 125 14.659 4.831 0.722 1.00 37.79 C ATOM 974 C MET A 125 13.345 4.047 0.977 1.00 39.00 C ATOM 975 O MET A 125 12.702 3.778 -0.049 1.00 41.95 O ATOM 976 CB MET A 125 15.846 3.963 0.194 1.00 37.42 C ATOM 977 CG MET A 125 16.769 5.015 -0.505 1.00 42.01 C ATOM 978 SD MET A 125 18.162 4.008 -1.111 1.00 45.39 S ATOM 979 CE MET A 125 18.633 5.047 -2.589 1.00 48.14 C ATOM 0 H MET A 125 15.747 5.480 2.171 1.00 32.51 H new ATOM 0 HA MET A 125 14.442 5.410 -0.025 1.00 37.79 H new ATOM 0 HB2 MET A 125 16.305 3.506 0.916 1.00 37.42 H new ATOM 0 HB3 MET A 125 15.544 3.282 -0.427 1.00 37.42 H new ATOM 0 HG2 MET A 125 16.311 5.467 -1.231 1.00 42.01 H new ATOM 0 HG3 MET A 125 17.065 5.700 0.115 1.00 42.01 H new ATOM 0 HE1 MET A 125 18.994 4.476 -3.285 1.00 48.14 H new ATOM 0 HE2 MET A 125 17.848 5.507 -2.925 1.00 48.14 H new ATOM 0 HE3 MET A 125 19.302 5.699 -2.327 1.00 48.14 H new ATOM 980 N ASN A 126 12.974 3.912 2.218 1.00 39.46 N ATOM 981 CA ASN A 126 11.788 3.117 2.687 1.00 40.44 C ATOM 982 C ASN A 126 10.682 4.067 3.047 1.00 40.75 C ATOM 983 O ASN A 126 9.504 3.659 3.211 1.00 43.54 O ATOM 984 CB ASN A 126 12.336 2.080 3.710 1.00 42.87 C ATOM 985 CG ASN A 126 11.394 1.037 4.355 1.00 44.91 C ATOM 986 OD1 ASN A 126 10.109 0.646 4.332 1.00 45.52 O ATOM 987 ND2 ASN A 126 12.121 0.238 5.232 1.00 45.55 N ATOM 0 H ASN A 126 13.401 4.283 2.865 1.00 39.46 H new ATOM 0 HA ASN A 126 11.335 2.563 2.032 1.00 40.44 H new ATOM 0 HB2 ASN A 126 13.046 1.589 3.267 1.00 42.87 H new ATOM 0 HB3 ASN A 126 12.746 2.581 4.433 1.00 42.87 H new ATOM 0 HD21 ASN A 126 11.729 -0.396 5.661 1.00 45.55 H new ATOM 0 HD22 ASN A 126 12.962 0.378 5.345 1.00 45.55 H new ATOM 988 N HIS A 127 10.799 5.348 3.210 1.00 40.46 N ATOM 989 CA HIS A 127 9.880 6.431 3.532 1.00 41.55 C ATOM 990 C HIS A 127 8.879 6.344 2.384 1.00 42.78 C ATOM 991 O HIS A 127 9.135 6.082 1.196 1.00 41.03 O ATOM 992 CB HIS A 127 10.776 7.685 3.534 1.00 39.37 C ATOM 993 CG HIS A 127 10.138 8.827 4.299 1.00 38.72 C ATOM 994 ND1 HIS A 127 9.210 9.763 3.784 1.00 38.64 N ATOM 995 CD2 HIS A 127 10.256 9.059 5.608 1.00 39.71 C ATOM 996 CE1 HIS A 127 8.805 10.596 4.659 1.00 39.15 C ATOM 997 NE2 HIS A 127 9.414 10.218 5.809 1.00 40.53 N ATOM 0 H HIS A 127 11.585 5.684 3.116 1.00 40.46 H new ATOM 0 HA HIS A 127 9.398 6.420 4.374 1.00 41.55 H new ATOM 0 HB2 HIS A 127 11.635 7.469 3.930 1.00 39.37 H new ATOM 0 HB3 HIS A 127 10.947 7.963 2.620 1.00 39.37 H new ATOM 0 HD2 HIS A 127 10.757 8.591 6.236 1.00 39.71 H new ATOM 0 HE1 HIS A 127 8.219 11.308 4.535 1.00 39.15 H new ATOM 0 HE2 HIS A 127 9.313 10.617 6.564 1.00 40.53 H new ATOM 998 N PRO A 128 7.601 6.532 2.768 1.00 41.83 N ATOM 999 CA PRO A 128 6.489 6.434 1.771 1.00 41.05 C ATOM 1000 C PRO A 128 6.329 7.778 1.162 1.00 39.68 C ATOM 1001 O PRO A 128 6.404 8.999 1.596 1.00 41.81 O ATOM 1002 CB PRO A 128 5.435 5.688 2.594 1.00 40.43 C ATOM 1003 CG PRO A 128 5.606 6.434 3.938 1.00 41.13 C ATOM 1004 CD PRO A 128 7.067 6.847 4.106 1.00 41.07 C ATOM 0 HA PRO A 128 6.544 5.930 0.944 1.00 41.05 H new ATOM 0 HB2 PRO A 128 4.541 5.777 2.227 1.00 40.43 H new ATOM 0 HB3 PRO A 128 5.619 4.738 2.666 1.00 40.43 H new ATOM 0 HG2 PRO A 128 5.034 7.217 3.960 1.00 41.13 H new ATOM 0 HG3 PRO A 128 5.334 5.863 4.673 1.00 41.13 H new ATOM 0 HD2 PRO A 128 7.160 7.787 4.327 1.00 41.07 H new ATOM 0 HD3 PRO A 128 7.512 6.346 4.807 1.00 41.07 H new ATOM 1005 N GLY A 129 6.149 7.552 -0.153 1.00 38.88 N ATOM 1006 CA GLY A 129 6.028 8.914 -0.852 1.00 42.92 C ATOM 1007 C GLY A 129 6.939 9.063 -2.064 1.00 37.32 C ATOM 1008 O GLY A 129 7.512 8.041 -2.414 1.00 41.25 O ATOM 0 H GLY A 129 6.099 6.819 -0.599 1.00 38.88 H new ATOM 0 HA2 GLY A 129 5.108 9.045 -1.131 1.00 42.92 H new ATOM 0 HA3 GLY A 129 6.234 9.615 -0.214 1.00 42.92 H new ATOM 1009 N HIS A 130 6.885 10.296 -2.532 1.00 37.55 N ATOM 1010 CA HIS A 130 7.594 10.564 -3.862 1.00 32.92 C ATOM 1011 C HIS A 130 9.091 10.765 -3.484 1.00 31.00 C ATOM 1012 O HIS A 130 9.214 11.594 -2.601 1.00 24.96 O ATOM 1013 CB HIS A 130 6.950 11.813 -4.589 1.00 34.90 C ATOM 1014 CG HIS A 130 7.542 11.834 -5.992 1.00 38.75 C ATOM 1015 ND1 HIS A 130 7.814 10.593 -6.624 1.00 37.79 N ATOM 1016 CD2 HIS A 130 8.030 12.882 -6.766 1.00 38.63 C ATOM 1017 CE1 HIS A 130 8.438 10.912 -7.732 1.00 40.75 C ATOM 1018 NE2 HIS A 130 8.560 12.242 -7.887 1.00 38.45 N ATOM 0 H HIS A 130 6.490 10.965 -2.163 1.00 37.55 H new ATOM 0 HA HIS A 130 7.505 9.838 -4.499 1.00 32.92 H new ATOM 0 HB2 HIS A 130 5.984 11.736 -4.621 1.00 34.90 H new ATOM 0 HB3 HIS A 130 7.153 12.634 -4.114 1.00 34.90 H new ATOM 0 HD1 HIS A 130 7.614 9.805 -6.342 1.00 37.79 H new ATOM 0 HD2 HIS A 130 8.008 13.793 -6.580 1.00 38.63 H new ATOM 0 HE1 HIS A 130 8.760 10.288 -8.342 1.00 40.75 H new ATOM 1019 N LEU A 131 10.064 10.119 -4.141 1.00 25.71 N ATOM 1020 CA LEU A 131 11.463 10.436 -3.747 1.00 26.25 C ATOM 1021 C LEU A 131 12.258 10.265 -5.010 1.00 22.23 C ATOM 1022 O LEU A 131 11.910 9.453 -5.867 1.00 25.59 O ATOM 1023 CB LEU A 131 11.807 9.522 -2.533 1.00 28.94 C ATOM 1024 CG LEU A 131 13.302 9.338 -2.186 1.00 31.16 C ATOM 1025 CD1 LEU A 131 13.643 10.373 -1.238 1.00 32.26 C ATOM 1026 CD2 LEU A 131 13.723 7.992 -1.517 1.00 32.08 C ATOM 0 H LEU A 131 9.960 9.539 -4.768 1.00 25.71 H new ATOM 0 HA LEU A 131 11.650 11.332 -3.427 1.00 26.25 H new ATOM 0 HB2 LEU A 131 11.359 9.881 -1.751 1.00 28.94 H new ATOM 0 HB3 LEU A 131 11.427 8.645 -2.700 1.00 28.94 H new ATOM 0 HG LEU A 131 13.760 9.365 -3.041 1.00 31.16 H new ATOM 0 HD11 LEU A 131 14.578 10.292 -0.993 1.00 32.26 H new ATOM 0 HD12 LEU A 131 13.488 11.243 -1.638 1.00 32.26 H new ATOM 0 HD13 LEU A 131 13.092 10.280 -0.445 1.00 32.26 H new ATOM 0 HD21 LEU A 131 14.678 7.998 -1.350 1.00 32.08 H new ATOM 0 HD22 LEU A 131 13.249 7.886 -0.677 1.00 32.08 H new ATOM 0 HD23 LEU A 131 13.503 7.254 -2.107 1.00 32.08 H new ATOM 1027 N LYS A 132 13.275 11.023 -5.174 1.00 20.02 N ATOM 1028 CA LYS A 132 14.227 10.837 -6.342 1.00 21.65 C ATOM 1029 C LYS A 132 15.590 10.506 -5.813 1.00 21.51 C ATOM 1030 O LYS A 132 16.004 11.100 -4.762 1.00 21.23 O ATOM 1031 CB LYS A 132 14.264 12.165 -7.177 1.00 21.93 C ATOM 1032 CG LYS A 132 12.986 12.114 -8.115 1.00 23.81 C ATOM 1033 CD LYS A 132 13.291 13.082 -9.310 1.00 27.19 C ATOM 1034 CE LYS A 132 13.238 14.485 -8.686 1.00 29.38 C ATOM 1035 NZ LYS A 132 11.743 14.843 -8.927 1.00 30.25 N ATOM 0 H LYS A 132 13.481 11.671 -4.647 1.00 20.02 H new ATOM 0 HA LYS A 132 13.931 10.112 -6.914 1.00 21.65 H new ATOM 0 HB2 LYS A 132 14.241 12.942 -6.597 1.00 21.93 H new ATOM 0 HB3 LYS A 132 15.079 12.226 -7.700 1.00 21.93 H new ATOM 0 HG2 LYS A 132 12.823 11.212 -8.432 1.00 23.81 H new ATOM 0 HG3 LYS A 132 12.191 12.394 -7.635 1.00 23.81 H new ATOM 0 HD2 LYS A 132 14.161 12.900 -9.699 1.00 27.19 H new ATOM 0 HD3 LYS A 132 12.637 12.985 -10.020 1.00 27.19 H new ATOM 0 HE2 LYS A 132 13.469 14.479 -7.744 1.00 29.38 H new ATOM 0 HE3 LYS A 132 13.842 15.106 -9.122 1.00 29.38 H new ATOM 0 HZ1 LYS A 132 11.565 15.636 -8.564 1.00 30.25 H new ATOM 0 HZ2 LYS A 132 11.582 14.874 -9.802 1.00 30.25 H new ATOM 0 HZ3 LYS A 132 11.225 14.223 -8.553 1.00 30.25 H new ATOM 1036 N LEU A 133 16.356 9.602 -6.403 1.00 18.10 N ATOM 1037 CA LEU A 133 17.748 9.235 -6.108 1.00 20.36 C ATOM 1038 C LEU A 133 18.648 9.874 -7.219 1.00 20.45 C ATOM 1039 O LEU A 133 18.410 9.344 -8.407 1.00 20.20 O ATOM 1040 CB LEU A 133 17.722 7.739 -6.013 1.00 20.79 C ATOM 1041 CG LEU A 133 17.335 6.815 -4.996 1.00 23.23 C ATOM 1042 CD1 LEU A 133 16.650 7.322 -3.709 1.00 21.36 C ATOM 1043 CD2 LEU A 133 17.273 5.270 -5.194 1.00 22.15 C ATOM 0 H LEU A 133 16.048 9.135 -7.056 1.00 18.10 H new ATOM 0 HA LEU A 133 18.129 9.567 -5.280 1.00 20.36 H new ATOM 0 HB2 LEU A 133 17.182 7.475 -6.774 1.00 20.79 H new ATOM 0 HB3 LEU A 133 18.637 7.485 -6.212 1.00 20.79 H new ATOM 0 HG LEU A 133 18.302 6.885 -4.970 1.00 23.23 H new ATOM 0 HD11 LEU A 133 16.455 6.570 -3.128 1.00 21.36 H new ATOM 0 HD12 LEU A 133 17.240 7.940 -3.250 1.00 21.36 H new ATOM 0 HD13 LEU A 133 15.824 7.775 -3.939 1.00 21.36 H new ATOM 0 HD21 LEU A 133 16.985 4.849 -4.369 1.00 22.15 H new ATOM 0 HD22 LEU A 133 16.643 5.059 -5.901 1.00 22.15 H new ATOM 0 HD23 LEU A 133 18.152 4.939 -5.436 1.00 22.15 H new ATOM 1044 N PHE A 134 19.621 10.546 -7.000 1.00 22.01 N ATOM 1045 CA PHE A 134 20.629 11.226 -7.884 1.00 18.96 C ATOM 1046 C PHE A 134 21.811 10.330 -7.687 1.00 19.18 C ATOM 1047 O PHE A 134 22.426 10.363 -6.625 1.00 19.85 O ATOM 1048 CB PHE A 134 20.903 12.755 -7.831 1.00 20.87 C ATOM 1049 CG PHE A 134 19.642 13.453 -8.309 1.00 20.17 C ATOM 1050 CD1 PHE A 134 18.503 13.528 -7.497 1.00 20.36 C ATOM 1051 CD2 PHE A 134 19.687 14.335 -9.501 1.00 19.23 C ATOM 1052 CE1 PHE A 134 17.336 14.228 -7.856 1.00 22.43 C ATOM 1053 CE2 PHE A 134 18.507 15.033 -9.918 1.00 16.98 C ATOM 1054 CZ PHE A 134 17.371 14.993 -9.011 1.00 21.35 C ATOM 0 HA PHE A 134 20.276 11.306 -8.784 1.00 18.96 H new ATOM 0 HB2 PHE A 134 21.127 13.032 -6.929 1.00 20.87 H new ATOM 0 HB3 PHE A 134 21.658 12.987 -8.394 1.00 20.87 H new ATOM 0 HD1 PHE A 134 18.519 13.091 -6.676 1.00 20.36 H new ATOM 0 HD2 PHE A 134 20.480 14.435 -9.977 1.00 19.23 H new ATOM 0 HE1 PHE A 134 16.567 14.179 -7.335 1.00 22.43 H new ATOM 0 HE2 PHE A 134 18.470 15.489 -10.728 1.00 16.98 H new ATOM 0 HZ PHE A 134 16.626 15.510 -9.218 1.00 21.35 H new ATOM 1055 N VAL A 135 22.150 9.359 -8.622 1.00 16.48 N ATOM 1056 CA VAL A 135 23.243 8.406 -8.306 1.00 18.47 C ATOM 1057 C VAL A 135 24.378 8.637 -9.246 1.00 20.67 C ATOM 1058 O VAL A 135 24.009 8.536 -10.506 1.00 22.60 O ATOM 1059 CB VAL A 135 22.705 6.897 -8.431 1.00 16.74 C ATOM 1060 CG1 VAL A 135 23.906 5.972 -8.237 1.00 19.46 C ATOM 1061 CG2 VAL A 135 21.463 6.620 -7.580 1.00 20.43 C ATOM 0 H VAL A 135 21.775 9.255 -9.389 1.00 16.48 H new ATOM 0 HA VAL A 135 23.550 8.546 -7.396 1.00 18.47 H new ATOM 0 HB VAL A 135 22.346 6.719 -9.314 1.00 16.74 H new ATOM 0 HG11 VAL A 135 23.618 5.048 -8.306 1.00 19.46 H new ATOM 0 HG12 VAL A 135 24.570 6.155 -8.920 1.00 19.46 H new ATOM 0 HG13 VAL A 135 24.294 6.124 -7.361 1.00 19.46 H new ATOM 0 HG21 VAL A 135 21.189 5.697 -7.698 1.00 20.43 H new ATOM 0 HG22 VAL A 135 21.669 6.778 -6.645 1.00 20.43 H new ATOM 0 HG23 VAL A 135 20.743 7.209 -7.856 1.00 20.43 H new ATOM 1062 N THR A 136 25.584 8.916 -8.813 1.00 20.31 N ATOM 1063 CA THR A 136 26.799 9.023 -9.720 1.00 22.32 C ATOM 1064 C THR A 136 27.383 7.605 -9.784 1.00 22.61 C ATOM 1065 O THR A 136 27.881 7.062 -8.657 1.00 24.00 O ATOM 1066 CB THR A 136 27.842 10.079 -9.246 1.00 20.89 C ATOM 1067 OG1 THR A 136 27.228 11.360 -9.193 1.00 23.84 O ATOM 1068 CG2 THR A 136 29.185 10.106 -10.147 1.00 20.95 C ATOM 0 H THR A 136 25.762 9.056 -7.983 1.00 20.31 H new ATOM 0 HA THR A 136 26.543 9.346 -10.598 1.00 22.32 H new ATOM 0 HB THR A 136 28.134 9.820 -8.358 1.00 20.89 H new ATOM 0 HG1 THR A 136 27.757 11.910 -8.841 1.00 23.84 H new ATOM 0 HG21 THR A 136 29.792 10.780 -9.803 1.00 20.95 H new ATOM 0 HG22 THR A 136 29.615 9.237 -10.113 1.00 20.95 H new ATOM 0 HG23 THR A 136 28.955 10.317 -11.065 1.00 20.95 H new ATOM 1069 N ARG A 137 27.429 6.842 -10.857 1.00 21.43 N ATOM 1070 CA ARG A 137 28.011 5.508 -10.960 1.00 23.15 C ATOM 1071 C ARG A 137 29.498 5.662 -11.215 1.00 25.99 C ATOM 1072 O ARG A 137 29.912 6.077 -12.290 1.00 26.10 O ATOM 1073 CB ARG A 137 27.365 4.425 -11.860 1.00 25.88 C ATOM 1074 CG ARG A 137 25.865 4.346 -11.726 1.00 26.24 C ATOM 1075 CD ARG A 137 25.623 3.339 -10.612 1.00 27.09 C ATOM 1076 NE ARG A 137 24.236 2.963 -10.539 1.00 27.21 N ATOM 1077 CZ ARG A 137 23.736 2.080 -9.717 1.00 27.62 C ATOM 1078 NH1 ARG A 137 24.583 1.412 -8.870 1.00 28.45 N ATOM 1079 NH2 ARG A 137 22.430 1.770 -9.655 1.00 26.82 N ATOM 0 H ARG A 137 27.097 7.105 -11.605 1.00 21.43 H new ATOM 0 HA ARG A 137 27.803 5.107 -10.102 1.00 23.15 H new ATOM 0 HB2 ARG A 137 27.590 4.608 -12.786 1.00 25.88 H new ATOM 0 HB3 ARG A 137 27.748 3.561 -11.640 1.00 25.88 H new ATOM 0 HG2 ARG A 137 25.486 5.211 -11.506 1.00 26.24 H new ATOM 0 HG3 ARG A 137 25.453 4.058 -12.556 1.00 26.24 H new ATOM 0 HD2 ARG A 137 26.167 2.550 -10.763 1.00 27.09 H new ATOM 0 HD3 ARG A 137 25.902 3.718 -9.764 1.00 27.09 H new ATOM 0 HE ARG A 137 23.692 3.351 -11.081 1.00 27.21 H new ATOM 0 HH11 ARG A 137 25.427 1.578 -8.887 1.00 28.45 H new ATOM 0 HH12 ARG A 137 24.270 0.827 -8.322 1.00 28.45 H new ATOM 0 HH21 ARG A 137 21.870 2.162 -10.177 1.00 26.82 H new ATOM 0 HH22 ARG A 137 22.154 1.180 -9.094 1.00 26.82 H new ATOM 1080 N ILE A 138 30.466 5.380 -10.282 1.00 25.05 N ATOM 1081 CA ILE A 138 31.960 5.520 -10.466 1.00 26.05 C ATOM 1082 C ILE A 138 32.225 4.078 -10.899 1.00 27.72 C ATOM 1083 O ILE A 138 31.958 2.988 -10.356 1.00 27.83 O ATOM 1084 CB ILE A 138 32.824 5.839 -9.203 1.00 25.52 C ATOM 1085 CG1 ILE A 138 32.843 7.181 -8.435 1.00 26.71 C ATOM 1086 CG2 ILE A 138 34.327 5.422 -9.501 1.00 26.23 C ATOM 1087 CD1 ILE A 138 32.821 8.598 -8.852 1.00 27.41 C ATOM 0 H ILE A 138 30.262 5.092 -9.498 1.00 25.05 H new ATOM 0 HA ILE A 138 32.194 6.263 -11.044 1.00 26.05 H new ATOM 0 HB ILE A 138 32.305 5.326 -8.565 1.00 25.52 H new ATOM 0 HG12 ILE A 138 32.084 7.110 -7.836 1.00 26.71 H new ATOM 0 HG13 ILE A 138 33.642 7.118 -7.889 1.00 26.71 H new ATOM 0 HG21 ILE A 138 34.876 5.614 -8.725 1.00 26.23 H new ATOM 0 HG22 ILE A 138 34.367 4.473 -9.698 1.00 26.23 H new ATOM 0 HG23 ILE A 138 34.657 5.924 -10.263 1.00 26.23 H new ATOM 0 HD11 ILE A 138 32.845 9.167 -8.067 1.00 27.41 H new ATOM 0 HD12 ILE A 138 33.593 8.784 -9.409 1.00 27.41 H new ATOM 0 HD13 ILE A 138 32.010 8.775 -9.355 1.00 27.41 H new ATOM 1088 N MET A 139 32.715 4.082 -12.237 1.00 30.59 N ATOM 1089 CA MET A 139 32.762 2.726 -12.875 1.00 31.26 C ATOM 1090 C MET A 139 34.034 1.936 -12.668 1.00 32.92 C ATOM 1091 O MET A 139 34.660 1.467 -13.690 1.00 33.93 O ATOM 1092 CB MET A 139 32.391 2.854 -14.445 1.00 33.34 C ATOM 1093 CG MET A 139 31.018 3.382 -14.762 1.00 36.76 C ATOM 1094 SD MET A 139 30.868 4.378 -16.370 1.00 39.91 S ATOM 1095 CE MET A 139 31.681 3.307 -17.459 1.00 41.97 C ATOM 0 H MET A 139 32.978 4.757 -12.701 1.00 30.59 H new ATOM 0 HA MET A 139 32.096 2.198 -12.408 1.00 31.26 H new ATOM 0 HB2 MET A 139 33.045 3.433 -14.867 1.00 33.34 H new ATOM 0 HB3 MET A 139 32.483 1.978 -14.852 1.00 33.34 H new ATOM 0 HG2 MET A 139 30.404 2.632 -14.807 1.00 36.76 H new ATOM 0 HG3 MET A 139 30.727 3.943 -14.026 1.00 36.76 H new ATOM 0 HE1 MET A 139 31.523 3.593 -18.372 1.00 41.97 H new ATOM 0 HE2 MET A 139 32.633 3.321 -17.276 1.00 41.97 H new ATOM 0 HE3 MET A 139 31.343 2.406 -17.340 1.00 41.97 H new ATOM 1096 N GLN A 140 34.436 1.546 -11.460 1.00 31.90 N ATOM 1097 CA GLN A 140 35.521 0.654 -11.109 1.00 31.54 C ATOM 1098 C GLN A 140 35.252 0.301 -9.619 1.00 34.84 C ATOM 1099 O GLN A 140 34.438 0.994 -8.973 1.00 31.13 O ATOM 1100 CB GLN A 140 36.954 0.996 -11.198 1.00 34.42 C ATOM 1101 CG GLN A 140 37.280 2.453 -11.157 1.00 36.36 C ATOM 1102 CD GLN A 140 38.737 2.521 -11.553 1.00 38.94 C ATOM 1103 OE1 GLN A 140 39.720 2.083 -10.921 1.00 40.94 O ATOM 1104 NE2 GLN A 140 38.963 3.185 -12.631 1.00 39.09 N ATOM 0 H GLN A 140 34.032 1.832 -10.756 1.00 31.90 H new ATOM 0 HA GLN A 140 35.469 -0.012 -11.812 1.00 31.54 H new ATOM 0 HB2 GLN A 140 37.419 0.557 -10.469 1.00 34.42 H new ATOM 0 HB3 GLN A 140 37.306 0.626 -12.023 1.00 34.42 H new ATOM 0 HG2 GLN A 140 36.723 2.958 -11.770 1.00 36.36 H new ATOM 0 HG3 GLN A 140 37.136 2.823 -10.272 1.00 36.36 H new ATOM 0 HE21 GLN A 140 38.306 3.499 -13.088 1.00 39.09 H new ATOM 0 HE22 GLN A 140 39.771 3.315 -12.895 1.00 39.09 H new ATOM 1105 N ASP A 141 35.980 -0.736 -9.312 1.00 33.16 N ATOM 1106 CA ASP A 141 35.934 -1.330 -7.934 1.00 35.43 C ATOM 1107 C ASP A 141 36.952 -0.553 -7.148 1.00 32.05 C ATOM 1108 O ASP A 141 38.064 -0.160 -7.580 1.00 33.02 O ATOM 1109 CB ASP A 141 36.101 -2.839 -7.866 1.00 38.40 C ATOM 1110 CG ASP A 141 34.771 -3.439 -8.233 1.00 42.25 C ATOM 1111 OD1 ASP A 141 34.006 -2.464 -8.523 1.00 45.87 O ATOM 1112 OD2 ASP A 141 34.400 -4.595 -8.345 1.00 44.71 O ATOM 0 H ASP A 141 36.514 -1.133 -9.857 1.00 33.16 H new ATOM 0 HA ASP A 141 35.046 -1.243 -7.554 1.00 35.43 H new ATOM 0 HB2 ASP A 141 36.793 -3.137 -8.477 1.00 38.40 H new ATOM 0 HB3 ASP A 141 36.370 -3.116 -6.976 1.00 38.40 H new ATOM 1113 N PHE A 142 36.463 -0.241 -5.868 1.00 31.68 N ATOM 1114 CA PHE A 142 37.430 0.538 -4.995 1.00 27.88 C ATOM 1115 C PHE A 142 37.309 -0.097 -3.589 1.00 31.24 C ATOM 1116 O PHE A 142 36.137 -0.424 -3.233 1.00 30.13 O ATOM 1117 CB PHE A 142 37.364 2.045 -4.902 1.00 29.30 C ATOM 1118 CG PHE A 142 37.822 2.968 -5.950 1.00 28.42 C ATOM 1119 CD1 PHE A 142 39.098 3.253 -6.096 1.00 28.95 C ATOM 1120 CD2 PHE A 142 36.921 3.324 -7.021 1.00 29.69 C ATOM 1121 CE1 PHE A 142 39.673 3.940 -7.173 1.00 31.18 C ATOM 1122 CE2 PHE A 142 37.463 4.012 -8.105 1.00 28.93 C ATOM 1123 CZ PHE A 142 38.799 4.433 -8.134 1.00 28.22 C ATOM 0 H PHE A 142 35.695 -0.440 -5.537 1.00 31.68 H new ATOM 0 HA PHE A 142 38.287 0.455 -5.441 1.00 27.88 H new ATOM 0 HB2 PHE A 142 36.433 2.263 -4.741 1.00 29.30 H new ATOM 0 HB3 PHE A 142 37.854 2.286 -4.100 1.00 29.30 H new ATOM 0 HD1 PHE A 142 39.672 2.972 -5.421 1.00 28.95 H new ATOM 0 HD2 PHE A 142 36.018 3.104 -6.989 1.00 29.69 H new ATOM 0 HE1 PHE A 142 40.593 4.060 -7.241 1.00 31.18 H new ATOM 0 HE2 PHE A 142 36.918 4.198 -8.835 1.00 28.93 H new ATOM 0 HZ PHE A 142 39.095 5.030 -8.783 1.00 28.22 H new ATOM 1124 N GLU A 143 38.352 -0.468 -2.892 1.00 30.44 N ATOM 1125 CA GLU A 143 38.251 -1.046 -1.505 1.00 30.94 C ATOM 1126 C GLU A 143 37.546 0.035 -0.640 1.00 27.46 C ATOM 1127 O GLU A 143 37.939 1.261 -0.648 1.00 29.42 O ATOM 1128 CB GLU A 143 39.727 -1.029 -1.060 1.00 34.11 C ATOM 1129 CG GLU A 143 39.997 -1.325 0.427 1.00 40.09 C ATOM 1130 CD GLU A 143 41.427 -1.666 0.858 1.00 42.59 C ATOM 1131 OE1 GLU A 143 42.196 -0.662 0.942 1.00 44.34 O ATOM 1132 OE2 GLU A 143 41.899 -2.820 1.028 1.00 44.55 O ATOM 0 H GLU A 143 39.159 -0.405 -3.182 1.00 30.44 H new ATOM 0 HA GLU A 143 37.802 -1.904 -1.446 1.00 30.94 H new ATOM 0 HB2 GLU A 143 40.213 -1.678 -1.592 1.00 34.11 H new ATOM 0 HB3 GLU A 143 40.098 -0.157 -1.269 1.00 34.11 H new ATOM 0 HG2 GLU A 143 39.712 -0.551 0.938 1.00 40.09 H new ATOM 0 HG3 GLU A 143 39.426 -2.064 0.689 1.00 40.09 H new ATOM 1133 N SER A 144 36.442 -0.413 0.034 1.00 28.43 N ATOM 1134 CA SER A 144 35.476 0.424 0.732 1.00 26.74 C ATOM 1135 C SER A 144 35.248 -0.228 2.086 1.00 27.02 C ATOM 1136 O SER A 144 35.484 -1.443 2.162 1.00 27.14 O ATOM 1137 CB SER A 144 34.103 0.547 0.009 1.00 24.74 C ATOM 1138 OG SER A 144 34.483 1.232 -1.240 1.00 26.81 O ATOM 0 H SER A 144 36.250 -1.250 0.085 1.00 28.43 H new ATOM 0 HA SER A 144 35.835 1.324 0.784 1.00 26.74 H new ATOM 0 HB2 SER A 144 33.701 -0.320 -0.159 1.00 24.74 H new ATOM 0 HB3 SER A 144 33.464 1.061 0.526 1.00 24.74 H new ATOM 0 HG SER A 144 34.919 0.705 -1.727 1.00 26.81 H new ATOM 1139 N ASP A 145 34.700 0.509 3.031 1.00 27.42 N ATOM 1140 CA ASP A 145 34.314 -0.063 4.322 1.00 23.56 C ATOM 1141 C ASP A 145 32.919 0.359 4.589 1.00 25.40 C ATOM 1142 O ASP A 145 32.267 -0.167 5.594 1.00 28.30 O ATOM 1143 CB ASP A 145 35.441 0.333 5.399 1.00 25.63 C ATOM 1144 CG ASP A 145 35.382 1.775 5.773 1.00 22.19 C ATOM 1145 OD1 ASP A 145 34.735 2.837 5.450 1.00 25.68 O ATOM 1146 OD2 ASP A 145 36.428 2.243 6.368 1.00 27.09 O ATOM 0 H ASP A 145 34.539 1.350 2.952 1.00 27.42 H new ATOM 0 HA ASP A 145 34.290 -1.032 4.356 1.00 23.56 H new ATOM 0 HB2 ASP A 145 35.330 -0.210 6.195 1.00 25.63 H new ATOM 0 HB3 ASP A 145 36.318 0.130 5.037 1.00 25.63 H new ATOM 1147 N THR A 146 32.250 1.149 3.784 1.00 22.32 N ATOM 1148 CA THR A 146 30.849 1.573 3.917 1.00 24.25 C ATOM 1149 C THR A 146 30.162 1.433 2.462 1.00 23.16 C ATOM 1150 O THR A 146 30.906 1.852 1.627 1.00 21.32 O ATOM 1151 CB THR A 146 30.931 3.114 4.255 1.00 23.22 C ATOM 1152 OG1 THR A 146 31.731 3.265 5.537 1.00 27.83 O ATOM 1153 CG2 THR A 146 29.537 3.643 4.598 1.00 25.57 C ATOM 0 H THR A 146 32.620 1.486 3.085 1.00 22.32 H new ATOM 0 HA THR A 146 30.356 1.062 4.578 1.00 24.25 H new ATOM 0 HB THR A 146 31.317 3.583 3.499 1.00 23.22 H new ATOM 0 HG1 THR A 146 32.547 3.148 5.374 1.00 27.83 H new ATOM 0 HG21 THR A 146 29.592 4.589 4.805 1.00 25.57 H new ATOM 0 HG22 THR A 146 28.945 3.512 3.841 1.00 25.57 H new ATOM 0 HG23 THR A 146 29.189 3.164 5.366 1.00 25.57 H new ATOM 1154 N PHE A 147 29.001 0.955 2.384 1.00 24.57 N ATOM 1155 CA PHE A 147 28.277 0.601 1.149 1.00 29.58 C ATOM 1156 C PHE A 147 26.924 1.188 1.043 1.00 27.57 C ATOM 1157 O PHE A 147 26.200 1.464 2.125 1.00 29.86 O ATOM 1158 CB PHE A 147 28.186 -0.998 1.151 1.00 29.54 C ATOM 1159 CG PHE A 147 29.653 -1.548 1.139 1.00 28.98 C ATOM 1160 CD1 PHE A 147 30.318 -1.738 -0.107 1.00 29.58 C ATOM 1161 CD2 PHE A 147 30.302 -1.854 2.303 1.00 29.70 C ATOM 1162 CE1 PHE A 147 31.572 -2.302 -0.144 1.00 31.86 C ATOM 1163 CE2 PHE A 147 31.633 -2.251 2.269 1.00 30.39 C ATOM 1164 CZ PHE A 147 32.339 -2.479 1.049 1.00 30.67 C ATOM 0 H PHE A 147 28.534 0.797 3.088 1.00 24.57 H new ATOM 0 HA PHE A 147 28.756 0.961 0.386 1.00 29.58 H new ATOM 0 HB2 PHE A 147 27.709 -1.312 1.935 1.00 29.54 H new ATOM 0 HB3 PHE A 147 27.696 -1.314 0.376 1.00 29.54 H new ATOM 0 HD1 PHE A 147 29.903 -1.480 -0.898 1.00 29.58 H new ATOM 0 HD2 PHE A 147 29.853 -1.797 3.116 1.00 29.70 H new ATOM 0 HE1 PHE A 147 31.927 -2.573 -0.960 1.00 31.86 H new ATOM 0 HE2 PHE A 147 32.083 -2.373 3.074 1.00 30.39 H new ATOM 0 HZ PHE A 147 33.236 -2.726 1.032 1.00 30.67 H new ATOM 1165 N PHE A 148 26.462 1.570 -0.102 1.00 26.88 N ATOM 1166 CA PHE A 148 25.159 2.090 -0.429 1.00 24.85 C ATOM 1167 C PHE A 148 24.136 0.977 -0.374 1.00 26.13 C ATOM 1168 O PHE A 148 24.517 -0.162 -0.786 1.00 28.54 O ATOM 1169 CB PHE A 148 25.305 2.841 -1.829 1.00 23.35 C ATOM 1170 CG PHE A 148 24.026 3.533 -2.015 1.00 24.39 C ATOM 1171 CD1 PHE A 148 23.644 4.665 -1.361 1.00 26.70 C ATOM 1172 CD2 PHE A 148 23.140 3.034 -2.992 1.00 28.29 C ATOM 1173 CE1 PHE A 148 22.428 5.388 -1.538 1.00 25.08 C ATOM 1174 CE2 PHE A 148 21.890 3.703 -3.250 1.00 25.30 C ATOM 1175 CZ PHE A 148 21.536 4.876 -2.506 1.00 28.54 C ATOM 0 H PHE A 148 26.960 1.530 -0.802 1.00 26.88 H new ATOM 0 HA PHE A 148 24.827 2.741 0.209 1.00 24.85 H new ATOM 0 HB2 PHE A 148 26.046 3.467 -1.818 1.00 23.35 H new ATOM 0 HB3 PHE A 148 25.474 2.214 -2.549 1.00 23.35 H new ATOM 0 HD1 PHE A 148 24.240 5.002 -0.732 1.00 26.70 H new ATOM 0 HD2 PHE A 148 23.363 2.270 -3.472 1.00 28.29 H new ATOM 0 HE1 PHE A 148 22.234 6.152 -1.045 1.00 25.08 H new ATOM 0 HE2 PHE A 148 21.312 3.373 -3.900 1.00 25.30 H new ATOM 0 HZ PHE A 148 20.722 5.298 -2.660 1.00 28.54 H new ATOM 1176 N PRO A 149 22.903 1.031 0.122 1.00 27.62 N ATOM 1177 CA PRO A 149 21.868 -0.010 0.174 1.00 28.60 C ATOM 1178 C PRO A 149 21.456 -0.391 -1.257 1.00 28.59 C ATOM 1179 O PRO A 149 21.523 0.443 -2.241 1.00 27.75 O ATOM 1180 CB PRO A 149 20.649 0.638 0.829 1.00 27.87 C ATOM 1181 CG PRO A 149 21.249 1.781 1.581 1.00 27.06 C ATOM 1182 CD PRO A 149 22.374 2.257 0.682 1.00 26.57 C ATOM 0 HA PRO A 149 22.187 -0.793 0.650 1.00 28.60 H new ATOM 0 HB2 PRO A 149 20.004 0.939 0.170 1.00 27.87 H new ATOM 0 HB3 PRO A 149 20.187 0.022 1.418 1.00 27.87 H new ATOM 0 HG2 PRO A 149 20.599 2.483 1.739 1.00 27.06 H new ATOM 0 HG3 PRO A 149 21.581 1.501 2.448 1.00 27.06 H new ATOM 0 HD2 PRO A 149 22.050 2.855 -0.010 1.00 26.57 H new ATOM 0 HD3 PRO A 149 23.049 2.742 1.182 1.00 26.57 H new ATOM 1183 N GLU A 150 20.985 -1.612 -1.399 1.00 30.55 N ATOM 1184 CA GLU A 150 20.476 -2.151 -2.690 1.00 33.14 C ATOM 1185 C GLU A 150 19.236 -1.310 -3.143 1.00 32.00 C ATOM 1186 O GLU A 150 18.295 -0.873 -2.407 1.00 31.65 O ATOM 1187 CB GLU A 150 19.955 -3.586 -2.435 1.00 37.93 C ATOM 1188 CG GLU A 150 21.096 -4.643 -2.120 1.00 43.57 C ATOM 1189 CD GLU A 150 20.601 -6.121 -1.925 1.00 47.05 C ATOM 1190 OE1 GLU A 150 19.342 -6.366 -1.805 1.00 48.73 O ATOM 1191 OE2 GLU A 150 21.532 -6.998 -1.866 1.00 48.82 O ATOM 0 H GLU A 150 20.942 -2.176 -0.751 1.00 30.55 H new ATOM 0 HA GLU A 150 21.181 -2.126 -3.355 1.00 33.14 H new ATOM 0 HB2 GLU A 150 19.332 -3.566 -1.692 1.00 37.93 H new ATOM 0 HB3 GLU A 150 19.459 -3.883 -3.214 1.00 37.93 H new ATOM 0 HG2 GLU A 150 21.742 -4.626 -2.843 1.00 43.57 H new ATOM 0 HG3 GLU A 150 21.563 -4.364 -1.317 1.00 43.57 H new ATOM 1192 N ILE A 151 19.230 -1.001 -4.465 1.00 26.75 N ATOM 1193 CA ILE A 151 18.132 -0.203 -5.118 1.00 27.32 C ATOM 1194 C ILE A 151 17.148 -1.275 -5.606 1.00 28.15 C ATOM 1195 O ILE A 151 17.632 -2.173 -6.411 1.00 26.81 O ATOM 1196 CB ILE A 151 18.542 0.758 -6.271 1.00 26.06 C ATOM 1197 CG1 ILE A 151 19.505 1.818 -5.737 1.00 26.46 C ATOM 1198 CG2 ILE A 151 17.365 1.445 -6.923 1.00 26.06 C ATOM 1199 CD1 ILE A 151 20.502 2.415 -6.757 1.00 26.27 C ATOM 0 H ILE A 151 19.852 -1.242 -5.008 1.00 26.75 H new ATOM 0 HA ILE A 151 17.770 0.426 -4.474 1.00 27.32 H new ATOM 0 HB ILE A 151 18.967 0.211 -6.950 1.00 26.06 H new ATOM 0 HG12 ILE A 151 18.982 2.544 -5.363 1.00 26.46 H new ATOM 0 HG13 ILE A 151 20.012 1.429 -5.008 1.00 26.46 H new ATOM 0 HG21 ILE A 151 17.682 2.028 -7.631 1.00 26.06 H new ATOM 0 HG22 ILE A 151 16.768 0.779 -7.297 1.00 26.06 H new ATOM 0 HG23 ILE A 151 16.889 1.970 -6.261 1.00 26.06 H new ATOM 0 HD11 ILE A 151 21.062 3.073 -6.316 1.00 26.27 H new ATOM 0 HD12 ILE A 151 21.059 1.707 -7.118 1.00 26.27 H new ATOM 0 HD13 ILE A 151 20.012 2.840 -7.478 1.00 26.27 H new ATOM 1200 N ASP A 152 15.955 -1.142 -5.105 1.00 26.31 N ATOM 1201 CA ASP A 152 14.922 -2.175 -5.500 1.00 30.08 C ATOM 1202 C ASP A 152 14.233 -1.615 -6.839 1.00 27.45 C ATOM 1203 O ASP A 152 13.440 -0.680 -6.772 1.00 26.56 O ATOM 1204 CB ASP A 152 13.839 -2.207 -4.468 1.00 31.01 C ATOM 1205 CG ASP A 152 12.709 -3.165 -4.807 1.00 32.80 C ATOM 1206 OD1 ASP A 152 12.788 -3.815 -5.867 1.00 31.98 O ATOM 1207 OD2 ASP A 152 11.838 -3.499 -3.999 1.00 33.46 O ATOM 0 H ASP A 152 15.694 -0.522 -4.569 1.00 26.31 H new ATOM 0 HA ASP A 152 15.329 -3.050 -5.602 1.00 30.08 H new ATOM 0 HB2 ASP A 152 14.223 -2.460 -3.614 1.00 31.01 H new ATOM 0 HB3 ASP A 152 13.476 -1.314 -4.362 1.00 31.01 H new ATOM 1208 N LEU A 153 14.573 -2.302 -7.937 1.00 29.52 N ATOM 1209 CA LEU A 153 14.119 -1.916 -9.259 1.00 28.29 C ATOM 1210 C LEU A 153 12.654 -2.263 -9.534 1.00 25.22 C ATOM 1211 O LEU A 153 12.104 -1.704 -10.537 1.00 26.46 O ATOM 1212 CB LEU A 153 15.000 -2.414 -10.457 1.00 29.50 C ATOM 1213 CG LEU A 153 16.496 -1.833 -10.330 1.00 27.24 C ATOM 1214 CD1 LEU A 153 17.162 -2.645 -11.455 1.00 28.85 C ATOM 1215 CD2 LEU A 153 16.478 -0.372 -10.442 1.00 26.50 C ATOM 0 H LEU A 153 15.073 -3.002 -7.926 1.00 29.52 H new ATOM 0 HA LEU A 153 14.217 -0.952 -9.221 1.00 28.29 H new ATOM 0 HB2 LEU A 153 15.023 -3.384 -10.469 1.00 29.50 H new ATOM 0 HB3 LEU A 153 14.606 -2.129 -11.296 1.00 29.50 H new ATOM 0 HG LEU A 153 16.976 -1.935 -9.493 1.00 27.24 H new ATOM 0 HD11 LEU A 153 18.100 -2.407 -11.514 1.00 28.85 H new ATOM 0 HD12 LEU A 153 17.081 -3.592 -11.262 1.00 28.85 H new ATOM 0 HD13 LEU A 153 16.725 -2.449 -12.298 1.00 28.85 H new ATOM 0 HD21 LEU A 153 17.382 -0.030 -10.364 1.00 26.50 H new ATOM 0 HD22 LEU A 153 16.109 -0.118 -11.302 1.00 26.50 H new ATOM 0 HD23 LEU A 153 15.930 0.000 -9.733 1.00 26.50 H new ATOM 1216 N GLU A 154 12.030 -2.971 -8.630 1.00 29.17 N ATOM 1217 CA GLU A 154 10.537 -3.162 -8.716 1.00 31.63 C ATOM 1218 C GLU A 154 9.843 -1.864 -8.205 1.00 32.01 C ATOM 1219 O GLU A 154 8.711 -1.565 -8.748 1.00 33.74 O ATOM 1220 CB GLU A 154 9.910 -4.274 -7.902 1.00 33.88 C ATOM 1221 CG GLU A 154 10.438 -5.644 -8.530 1.00 36.87 C ATOM 1222 CD GLU A 154 9.645 -6.895 -8.145 1.00 41.35 C ATOM 1223 OE1 GLU A 154 9.458 -7.293 -6.958 1.00 41.99 O ATOM 1224 OE2 GLU A 154 9.187 -7.386 -9.273 1.00 42.63 O ATOM 0 H GLU A 154 12.409 -3.355 -7.961 1.00 29.17 H new ATOM 0 HA GLU A 154 10.405 -3.390 -9.650 1.00 31.63 H new ATOM 0 HB2 GLU A 154 10.161 -4.202 -6.968 1.00 33.88 H new ATOM 0 HB3 GLU A 154 8.942 -4.227 -7.940 1.00 33.88 H new ATOM 0 HG2 GLU A 154 10.433 -5.562 -9.496 1.00 36.87 H new ATOM 0 HG3 GLU A 154 11.361 -5.770 -8.261 1.00 36.87 H new ATOM 1225 N LYS A 155 10.485 -1.069 -7.390 1.00 30.30 N ATOM 1226 CA LYS A 155 9.977 0.225 -6.868 1.00 32.27 C ATOM 1227 C LYS A 155 10.627 1.477 -7.517 1.00 29.12 C ATOM 1228 O LYS A 155 9.805 2.491 -7.694 1.00 29.99 O ATOM 1229 CB LYS A 155 10.406 0.368 -5.395 1.00 33.58 C ATOM 1230 CG LYS A 155 9.361 -0.106 -4.448 1.00 38.80 C ATOM 1231 CD LYS A 155 10.019 -0.031 -3.072 1.00 41.71 C ATOM 1232 CE LYS A 155 10.260 -1.395 -2.384 1.00 44.91 C ATOM 1233 NZ LYS A 155 8.910 -1.824 -1.788 1.00 46.59 N ATOM 0 H LYS A 155 11.271 -1.257 -7.097 1.00 30.30 H new ATOM 0 HA LYS A 155 9.023 0.200 -7.039 1.00 32.27 H new ATOM 0 HB2 LYS A 155 11.223 -0.135 -5.249 1.00 33.58 H new ATOM 0 HB3 LYS A 155 10.609 1.298 -5.209 1.00 33.58 H new ATOM 0 HG2 LYS A 155 8.569 0.452 -4.490 1.00 38.80 H new ATOM 0 HG3 LYS A 155 9.082 -1.011 -4.656 1.00 38.80 H new ATOM 0 HD2 LYS A 155 10.870 0.426 -3.161 1.00 41.71 H new ATOM 0 HD3 LYS A 155 9.464 0.514 -2.493 1.00 41.71 H new ATOM 0 HE2 LYS A 155 10.581 -2.052 -3.022 1.00 44.91 H new ATOM 0 HE3 LYS A 155 10.935 -1.319 -1.692 1.00 44.91 H new ATOM 0 HZ1 LYS A 155 9.002 -2.609 -1.379 1.00 46.59 H new ATOM 0 HZ2 LYS A 155 8.638 -1.214 -1.200 1.00 46.59 H new ATOM 0 HZ3 LYS A 155 8.308 -1.897 -2.439 1.00 46.59 H new ATOM 1234 N TYR A 156 11.871 1.586 -7.826 1.00 27.75 N ATOM 1235 CA TYR A 156 12.515 2.685 -8.455 1.00 25.57 C ATOM 1236 C TYR A 156 12.695 2.536 -10.018 1.00 26.19 C ATOM 1237 O TYR A 156 13.327 1.580 -10.443 1.00 29.85 O ATOM 1238 CB TYR A 156 13.935 2.909 -7.867 1.00 25.55 C ATOM 1239 CG TYR A 156 13.804 3.455 -6.428 1.00 26.90 C ATOM 1240 CD1 TYR A 156 13.424 4.804 -6.214 1.00 28.63 C ATOM 1241 CD2 TYR A 156 13.767 2.480 -5.419 1.00 27.71 C ATOM 1242 CE1 TYR A 156 13.539 5.282 -4.891 1.00 28.66 C ATOM 1243 CE2 TYR A 156 13.594 2.946 -4.075 1.00 29.69 C ATOM 1244 CZ TYR A 156 13.484 4.310 -3.848 1.00 29.77 C ATOM 1245 OH TYR A 156 13.293 4.810 -2.619 1.00 33.25 O ATOM 0 H TYR A 156 12.425 0.951 -7.656 1.00 27.75 H new ATOM 0 HA TYR A 156 11.921 3.432 -8.282 1.00 25.57 H new ATOM 0 HB2 TYR A 156 14.432 2.076 -7.865 1.00 25.55 H new ATOM 0 HB3 TYR A 156 14.431 3.534 -8.418 1.00 25.55 H new ATOM 0 HD1 TYR A 156 13.116 5.343 -6.906 1.00 28.63 H new ATOM 0 HD2 TYR A 156 13.851 1.574 -5.613 1.00 27.71 H new ATOM 0 HE1 TYR A 156 13.646 6.188 -4.708 1.00 28.66 H new ATOM 0 HE2 TYR A 156 13.556 2.344 -3.367 1.00 29.69 H new ATOM 0 HH TYR A 156 13.144 4.182 -2.081 1.00 33.25 H new ATOM 1246 N LYS A 157 12.330 3.570 -10.783 1.00 27.95 N ATOM 1247 CA LYS A 157 12.593 3.470 -12.264 1.00 26.21 C ATOM 1248 C LYS A 157 13.713 4.369 -12.576 1.00 25.32 C ATOM 1249 O LYS A 157 13.743 5.525 -12.048 1.00 23.88 O ATOM 1250 CB LYS A 157 11.269 3.861 -12.964 1.00 29.76 C ATOM 1251 CG LYS A 157 10.301 2.633 -12.539 1.00 35.54 C ATOM 1252 CD LYS A 157 9.493 2.119 -13.728 1.00 40.79 C ATOM 1253 CE LYS A 157 8.717 0.781 -13.788 1.00 43.21 C ATOM 1254 NZ LYS A 157 9.164 -0.235 -14.841 1.00 44.57 N ATOM 0 H LYS A 157 11.956 4.294 -10.510 1.00 27.95 H new ATOM 0 HA LYS A 157 12.848 2.584 -12.567 1.00 26.21 H new ATOM 0 HB2 LYS A 157 10.931 4.716 -12.654 1.00 29.76 H new ATOM 0 HB3 LYS A 157 11.371 3.929 -13.926 1.00 29.76 H new ATOM 0 HG2 LYS A 157 10.835 1.911 -12.173 1.00 35.54 H new ATOM 0 HG3 LYS A 157 9.697 2.923 -11.838 1.00 35.54 H new ATOM 0 HD2 LYS A 157 8.840 2.810 -13.920 1.00 40.79 H new ATOM 0 HD3 LYS A 157 10.111 2.098 -14.475 1.00 40.79 H new ATOM 0 HE2 LYS A 157 8.777 0.358 -12.917 1.00 43.21 H new ATOM 0 HE3 LYS A 157 7.781 0.982 -13.942 1.00 43.21 H new ATOM 0 HZ1 LYS A 157 8.654 -0.962 -14.788 1.00 44.57 H new ATOM 0 HZ2 LYS A 157 9.085 0.123 -15.652 1.00 44.57 H new ATOM 0 HZ3 LYS A 157 10.013 -0.458 -14.697 1.00 44.57 H new ATOM 1255 N LEU A 158 14.635 3.955 -13.388 1.00 23.90 N ATOM 1256 CA LEU A 158 15.799 4.699 -13.923 1.00 22.32 C ATOM 1257 C LEU A 158 15.168 5.737 -14.946 1.00 22.95 C ATOM 1258 O LEU A 158 14.605 5.122 -15.922 1.00 22.79 O ATOM 1259 CB LEU A 158 16.828 3.725 -14.499 1.00 22.59 C ATOM 1260 CG LEU A 158 18.148 4.296 -15.057 1.00 23.24 C ATOM 1261 CD1 LEU A 158 18.704 5.492 -14.293 1.00 23.55 C ATOM 1262 CD2 LEU A 158 19.242 3.291 -15.233 1.00 25.28 C ATOM 0 H LEU A 158 14.619 3.149 -13.688 1.00 23.90 H new ATOM 0 HA LEU A 158 16.312 5.187 -13.260 1.00 22.32 H new ATOM 0 HB2 LEU A 158 17.053 3.087 -13.803 1.00 22.59 H new ATOM 0 HB3 LEU A 158 16.397 3.227 -15.211 1.00 22.59 H new ATOM 0 HG LEU A 158 17.865 4.599 -15.934 1.00 23.24 H new ATOM 0 HD11 LEU A 158 19.530 5.786 -14.708 1.00 23.55 H new ATOM 0 HD12 LEU A 158 18.058 6.216 -14.310 1.00 23.55 H new ATOM 0 HD13 LEU A 158 18.878 5.236 -13.374 1.00 23.55 H new ATOM 0 HD21 LEU A 158 20.032 3.730 -15.586 1.00 25.28 H new ATOM 0 HD22 LEU A 158 19.452 2.888 -14.376 1.00 25.28 H new ATOM 0 HD23 LEU A 158 18.952 2.602 -15.851 1.00 25.28 H new ATOM 1263 N LEU A 159 15.394 6.973 -14.899 1.00 22.16 N ATOM 1264 CA LEU A 159 14.816 7.899 -15.854 1.00 23.98 C ATOM 1265 C LEU A 159 15.789 7.932 -17.067 1.00 26.11 C ATOM 1266 O LEU A 159 17.056 7.829 -16.994 1.00 23.97 O ATOM 1267 CB LEU A 159 14.592 9.301 -15.256 1.00 23.61 C ATOM 1268 CG LEU A 159 13.588 9.362 -14.060 1.00 26.01 C ATOM 1269 CD1 LEU A 159 13.534 10.841 -13.616 1.00 26.10 C ATOM 1270 CD2 LEU A 159 12.207 8.797 -14.212 1.00 28.79 C ATOM 0 H LEU A 159 15.897 7.344 -14.308 1.00 22.16 H new ATOM 0 HA LEU A 159 13.932 7.604 -16.122 1.00 23.98 H new ATOM 0 HB2 LEU A 159 15.447 9.651 -14.960 1.00 23.61 H new ATOM 0 HB3 LEU A 159 14.272 9.889 -15.958 1.00 23.61 H new ATOM 0 HG LEU A 159 13.944 8.746 -13.401 1.00 26.01 H new ATOM 0 HD11 LEU A 159 12.920 10.933 -12.871 1.00 26.10 H new ATOM 0 HD12 LEU A 159 14.419 11.130 -13.343 1.00 26.10 H new ATOM 0 HD13 LEU A 159 13.229 11.390 -14.355 1.00 26.10 H new ATOM 0 HD21 LEU A 159 11.716 8.915 -13.384 1.00 28.79 H new ATOM 0 HD22 LEU A 159 11.745 9.259 -14.929 1.00 28.79 H new ATOM 0 HD23 LEU A 159 12.265 7.852 -14.421 1.00 28.79 H new ATOM 1271 N PRO A 160 15.150 8.083 -18.237 1.00 28.63 N ATOM 1272 CA PRO A 160 16.000 8.116 -19.533 1.00 28.97 C ATOM 1273 C PRO A 160 16.776 9.426 -19.711 1.00 27.37 C ATOM 1274 O PRO A 160 17.831 9.412 -20.471 1.00 30.64 O ATOM 1275 CB PRO A 160 14.958 7.737 -20.617 1.00 31.71 C ATOM 1276 CG PRO A 160 13.657 7.931 -19.979 1.00 31.65 C ATOM 1277 CD PRO A 160 13.668 8.106 -18.439 1.00 29.51 C ATOM 0 HA PRO A 160 16.748 7.499 -19.555 1.00 28.97 H new ATOM 0 HB2 PRO A 160 15.050 8.297 -21.403 1.00 31.71 H new ATOM 0 HB3 PRO A 160 15.073 6.819 -20.908 1.00 31.71 H new ATOM 0 HG2 PRO A 160 13.239 8.713 -20.372 1.00 31.65 H new ATOM 0 HG3 PRO A 160 13.095 7.170 -20.195 1.00 31.65 H new ATOM 0 HD2 PRO A 160 13.259 8.937 -18.150 1.00 29.51 H new ATOM 0 HD3 PRO A 160 13.211 7.388 -17.973 1.00 29.51 H new ATOM 1278 N GLU A 161 16.335 10.506 -18.992 1.00 26.16 N ATOM 1279 CA GLU A 161 16.946 11.789 -19.059 1.00 30.12 C ATOM 1280 C GLU A 161 16.395 12.700 -17.961 1.00 25.74 C ATOM 1281 O GLU A 161 15.299 12.385 -17.403 1.00 28.93 O ATOM 1282 CB GLU A 161 16.649 12.550 -20.417 1.00 32.86 C ATOM 1283 CG GLU A 161 15.183 12.989 -20.713 1.00 34.62 C ATOM 1284 CD GLU A 161 14.614 13.245 -22.109 1.00 38.61 C ATOM 1285 OE1 GLU A 161 15.336 13.793 -23.026 1.00 38.83 O ATOM 1286 OE2 GLU A 161 13.407 12.802 -22.280 1.00 35.87 O ATOM 0 H GLU A 161 15.662 10.472 -18.457 1.00 26.16 H new ATOM 0 HA GLU A 161 17.897 11.620 -18.970 1.00 30.12 H new ATOM 0 HB2 GLU A 161 17.206 13.344 -20.439 1.00 32.86 H new ATOM 0 HB3 GLU A 161 16.940 11.979 -21.146 1.00 32.86 H new ATOM 0 HG2 GLU A 161 14.615 12.312 -20.313 1.00 34.62 H new ATOM 0 HG3 GLU A 161 15.043 13.808 -20.213 1.00 34.62 H new ATOM 1287 N TYR A 162 17.157 13.663 -17.629 1.00 25.93 N ATOM 1288 CA TYR A 162 16.694 14.631 -16.586 1.00 27.64 C ATOM 1289 C TYR A 162 17.334 15.970 -16.953 1.00 29.63 C ATOM 1290 O TYR A 162 18.512 16.139 -17.217 1.00 30.00 O ATOM 1291 CB TYR A 162 17.166 14.132 -15.109 1.00 28.78 C ATOM 1292 CG TYR A 162 16.270 14.856 -14.071 1.00 26.13 C ATOM 1293 CD1 TYR A 162 14.968 14.419 -13.823 1.00 25.82 C ATOM 1294 CD2 TYR A 162 16.805 16.003 -13.482 1.00 26.90 C ATOM 1295 CE1 TYR A 162 14.129 15.108 -12.989 1.00 26.67 C ATOM 1296 CE2 TYR A 162 15.943 16.708 -12.594 1.00 26.88 C ATOM 1297 CZ TYR A 162 14.687 16.319 -12.399 1.00 27.64 C ATOM 1298 OH TYR A 162 13.817 16.957 -11.481 1.00 29.37 O ATOM 0 H TYR A 162 17.937 13.815 -17.957 1.00 25.93 H new ATOM 0 HA TYR A 162 15.727 14.704 -16.557 1.00 27.64 H new ATOM 0 HB2 TYR A 162 17.075 13.170 -15.028 1.00 28.78 H new ATOM 0 HB3 TYR A 162 18.101 14.342 -14.959 1.00 28.78 H new ATOM 0 HD1 TYR A 162 14.663 13.642 -14.234 1.00 25.82 H new ATOM 0 HD2 TYR A 162 17.672 16.290 -13.659 1.00 26.90 H new ATOM 0 HE1 TYR A 162 13.262 14.823 -12.811 1.00 26.67 H new ATOM 0 HE2 TYR A 162 16.265 17.454 -12.142 1.00 26.88 H new ATOM 0 HH TYR A 162 14.189 17.644 -11.174 1.00 29.37 H new ATOM 1299 N PRO A 163 16.561 17.047 -16.868 1.00 30.00 N ATOM 1300 CA PRO A 163 16.933 18.455 -17.106 1.00 31.48 C ATOM 1301 C PRO A 163 18.074 18.905 -16.171 1.00 33.39 C ATOM 1302 O PRO A 163 18.050 18.745 -14.935 1.00 36.60 O ATOM 1303 CB PRO A 163 15.665 19.339 -16.899 1.00 30.22 C ATOM 1304 CG PRO A 163 14.612 18.362 -16.423 1.00 28.53 C ATOM 1305 CD PRO A 163 15.067 16.978 -16.611 1.00 31.24 C ATOM 0 HA PRO A 163 17.261 18.551 -18.014 1.00 31.48 H new ATOM 0 HB2 PRO A 163 15.822 20.038 -16.245 1.00 30.22 H new ATOM 0 HB3 PRO A 163 15.398 19.776 -17.723 1.00 30.22 H new ATOM 0 HG2 PRO A 163 14.418 18.519 -15.486 1.00 28.53 H new ATOM 0 HG3 PRO A 163 13.786 18.505 -16.912 1.00 28.53 H new ATOM 0 HD2 PRO A 163 14.876 16.442 -15.825 1.00 31.24 H new ATOM 0 HD3 PRO A 163 14.607 16.562 -17.357 1.00 31.24 H new ATOM 1306 N GLY A 164 19.181 19.331 -16.864 1.00 33.81 N ATOM 1307 CA GLY A 164 20.439 19.818 -16.215 1.00 33.72 C ATOM 1308 C GLY A 164 21.343 18.617 -15.817 1.00 30.98 C ATOM 1309 O GLY A 164 22.386 18.799 -15.097 1.00 35.48 O ATOM 0 H GLY A 164 19.215 19.343 -17.723 1.00 33.81 H new ATOM 0 HA2 GLY A 164 20.918 20.403 -16.822 1.00 33.72 H new ATOM 0 HA3 GLY A 164 20.222 20.342 -15.428 1.00 33.72 H new ATOM 1310 N VAL A 165 21.127 17.377 -16.112 1.00 28.84 N ATOM 1311 CA VAL A 165 22.048 16.293 -15.791 1.00 28.96 C ATOM 1312 C VAL A 165 22.606 15.749 -17.090 1.00 31.21 C ATOM 1313 O VAL A 165 21.867 15.100 -17.956 1.00 32.18 O ATOM 1314 CB VAL A 165 21.376 15.273 -14.798 1.00 28.53 C ATOM 1315 CG1 VAL A 165 22.193 13.972 -14.679 1.00 27.09 C ATOM 1316 CG2 VAL A 165 20.885 16.189 -13.634 1.00 28.20 C ATOM 0 H VAL A 165 20.418 17.112 -16.521 1.00 28.84 H new ATOM 0 HA VAL A 165 22.823 16.589 -15.289 1.00 28.96 H new ATOM 0 HB VAL A 165 20.573 14.785 -15.038 1.00 28.53 H new ATOM 0 HG11 VAL A 165 21.752 13.368 -14.061 1.00 27.09 H new ATOM 0 HG12 VAL A 165 22.260 13.551 -15.550 1.00 27.09 H new ATOM 0 HG13 VAL A 165 23.082 14.177 -14.350 1.00 27.09 H new ATOM 0 HG21 VAL A 165 20.449 15.647 -12.958 1.00 28.20 H new ATOM 0 HG22 VAL A 165 21.644 16.647 -13.241 1.00 28.20 H new ATOM 0 HG23 VAL A 165 20.257 16.842 -13.979 1.00 28.20 H new ATOM 1317 N LEU A 166 23.948 15.786 -17.292 1.00 33.21 N ATOM 1318 CA LEU A 166 24.567 15.129 -18.422 1.00 31.10 C ATOM 1319 C LEU A 166 24.362 13.652 -18.512 1.00 31.59 C ATOM 1320 O LEU A 166 24.604 12.780 -17.622 1.00 30.92 O ATOM 1321 CB LEU A 166 26.121 15.250 -18.140 1.00 33.36 C ATOM 1322 CG LEU A 166 26.671 16.522 -18.676 1.00 36.32 C ATOM 1323 CD1 LEU A 166 26.015 17.874 -18.489 1.00 37.94 C ATOM 1324 CD2 LEU A 166 27.940 16.656 -17.793 1.00 38.45 C ATOM 0 H LEU A 166 24.500 16.193 -16.773 1.00 33.21 H new ATOM 0 HA LEU A 166 24.197 15.536 -19.221 1.00 31.10 H new ATOM 0 HB2 LEU A 166 26.283 15.203 -17.185 1.00 33.36 H new ATOM 0 HB3 LEU A 166 26.584 14.500 -18.544 1.00 33.36 H new ATOM 0 HG LEU A 166 26.658 16.409 -19.639 1.00 36.32 H new ATOM 0 HD11 LEU A 166 26.550 18.556 -18.923 1.00 37.94 H new ATOM 0 HD12 LEU A 166 25.128 17.861 -18.882 1.00 37.94 H new ATOM 0 HD13 LEU A 166 25.946 18.072 -17.542 1.00 37.94 H new ATOM 0 HD21 LEU A 166 28.418 17.465 -18.034 1.00 38.45 H new ATOM 0 HD22 LEU A 166 27.681 16.700 -16.859 1.00 38.45 H new ATOM 0 HD23 LEU A 166 28.515 15.887 -17.933 1.00 38.45 H new ATOM 1325 N SER A 167 23.978 13.122 -19.713 1.00 29.66 N ATOM 1326 CA SER A 167 23.749 11.716 -20.055 1.00 33.72 C ATOM 1327 C SER A 167 24.985 10.914 -20.452 1.00 32.37 C ATOM 1328 O SER A 167 25.054 9.674 -20.332 1.00 34.63 O ATOM 1329 CB SER A 167 22.734 11.642 -21.269 1.00 36.37 C ATOM 1330 OG SER A 167 21.609 11.205 -20.502 1.00 39.50 O ATOM 0 H SER A 167 23.839 13.633 -20.390 1.00 29.66 H new ATOM 0 HA SER A 167 23.413 11.317 -19.237 1.00 33.72 H new ATOM 0 HB2 SER A 167 22.594 12.496 -21.707 1.00 36.37 H new ATOM 0 HB3 SER A 167 23.000 11.011 -21.956 1.00 36.37 H new ATOM 0 HG SER A 167 20.945 11.110 -21.008 1.00 39.50 H new ATOM 1331 N ASP A 168 26.018 11.752 -20.831 1.00 34.89 N ATOM 1332 CA ASP A 168 27.264 10.933 -21.232 1.00 37.33 C ATOM 1333 C ASP A 168 28.290 10.563 -20.118 1.00 34.89 C ATOM 1334 O ASP A 168 28.313 11.326 -19.107 1.00 36.47 O ATOM 1335 CB ASP A 168 27.996 11.721 -22.389 1.00 37.72 C ATOM 1336 CG ASP A 168 28.487 13.015 -21.864 1.00 41.88 C ATOM 1337 OD1 ASP A 168 28.301 13.408 -20.707 1.00 45.77 O ATOM 1338 OD2 ASP A 168 29.292 13.787 -22.512 1.00 42.26 O ATOM 0 H ASP A 168 26.043 12.611 -20.866 1.00 34.89 H new ATOM 0 HA ASP A 168 26.920 10.066 -21.497 1.00 37.33 H new ATOM 0 HB2 ASP A 168 28.737 11.197 -22.733 1.00 37.72 H new ATOM 0 HB3 ASP A 168 27.387 11.870 -23.129 1.00 37.72 H new ATOM 1339 N VAL A 169 29.113 9.545 -20.435 1.00 34.59 N ATOM 1340 CA VAL A 169 30.240 9.039 -19.523 1.00 30.70 C ATOM 1341 C VAL A 169 31.254 10.135 -19.404 1.00 32.33 C ATOM 1342 O VAL A 169 31.676 10.764 -20.451 1.00 31.66 O ATOM 1343 CB VAL A 169 30.722 7.667 -19.916 1.00 30.53 C ATOM 1344 CG1 VAL A 169 31.856 7.092 -19.085 1.00 32.01 C ATOM 1345 CG2 VAL A 169 29.685 6.544 -20.110 1.00 29.72 C ATOM 0 H VAL A 169 29.055 9.113 -21.176 1.00 34.59 H new ATOM 0 HA VAL A 169 29.934 8.864 -18.620 1.00 30.70 H new ATOM 0 HB VAL A 169 31.040 7.921 -20.797 1.00 30.53 H new ATOM 0 HG11 VAL A 169 32.088 6.212 -19.419 1.00 32.01 H new ATOM 0 HG12 VAL A 169 32.629 7.675 -19.145 1.00 32.01 H new ATOM 0 HG13 VAL A 169 31.576 7.022 -18.159 1.00 32.01 H new ATOM 0 HG21 VAL A 169 30.139 5.724 -20.360 1.00 29.72 H new ATOM 0 HG22 VAL A 169 29.199 6.405 -19.282 1.00 29.72 H new ATOM 0 HG23 VAL A 169 29.063 6.795 -20.811 1.00 29.72 H new ATOM 1346 N GLN A 170 31.628 10.435 -18.140 1.00 30.57 N ATOM 1347 CA GLN A 170 32.605 11.450 -17.773 1.00 32.65 C ATOM 1348 C GLN A 170 33.903 10.685 -17.506 1.00 32.64 C ATOM 1349 O GLN A 170 33.864 9.449 -17.399 1.00 31.35 O ATOM 1350 CB GLN A 170 32.102 12.249 -16.562 1.00 33.07 C ATOM 1351 CG GLN A 170 30.792 12.943 -16.741 1.00 36.20 C ATOM 1352 CD GLN A 170 30.540 13.797 -17.932 1.00 38.11 C ATOM 1353 OE1 GLN A 170 30.988 14.923 -18.044 1.00 40.31 O ATOM 1354 NE2 GLN A 170 29.693 13.389 -18.923 1.00 40.38 N ATOM 0 H GLN A 170 31.298 10.029 -17.457 1.00 30.57 H new ATOM 0 HA GLN A 170 32.752 12.111 -18.467 1.00 32.65 H new ATOM 0 HB2 GLN A 170 32.029 11.646 -15.806 1.00 33.07 H new ATOM 0 HB3 GLN A 170 32.772 12.912 -16.332 1.00 33.07 H new ATOM 0 HG2 GLN A 170 30.103 12.260 -16.729 1.00 36.20 H new ATOM 0 HG3 GLN A 170 30.654 13.498 -15.958 1.00 36.20 H new ATOM 0 HE21 GLN A 170 29.346 12.602 -18.896 1.00 40.38 H new ATOM 0 HE22 GLN A 170 29.506 13.919 -19.574 1.00 40.38 H new ATOM 1355 N GLU A 171 34.953 11.530 -17.477 1.00 31.35 N ATOM 1356 CA GLU A 171 36.276 10.940 -17.204 1.00 36.42 C ATOM 1357 C GLU A 171 37.127 11.992 -16.494 1.00 33.94 C ATOM 1358 O GLU A 171 37.184 13.181 -17.020 1.00 33.92 O ATOM 1359 CB GLU A 171 37.054 10.479 -18.378 1.00 36.98 C ATOM 1360 CG GLU A 171 38.146 9.483 -17.978 1.00 39.97 C ATOM 1361 CD GLU A 171 38.931 8.791 -19.095 1.00 42.57 C ATOM 1362 OE1 GLU A 171 38.798 9.475 -20.141 1.00 43.86 O ATOM 1363 OE2 GLU A 171 39.509 7.718 -18.749 1.00 44.38 O ATOM 0 H GLU A 171 34.928 12.380 -17.602 1.00 31.35 H new ATOM 0 HA GLU A 171 36.088 10.146 -16.680 1.00 36.42 H new ATOM 0 HB2 GLU A 171 36.457 10.064 -19.020 1.00 36.98 H new ATOM 0 HB3 GLU A 171 37.458 11.243 -18.819 1.00 36.98 H new ATOM 0 HG2 GLU A 171 38.782 9.950 -17.413 1.00 39.97 H new ATOM 0 HG3 GLU A 171 37.735 8.794 -17.433 1.00 39.97 H new ATOM 1364 N GLU A 172 37.619 11.416 -15.379 1.00 37.14 N ATOM 1365 CA GLU A 172 38.483 12.503 -14.646 1.00 37.99 C ATOM 1366 C GLU A 172 39.566 11.706 -13.964 1.00 37.94 C ATOM 1367 O GLU A 172 39.379 10.605 -13.414 1.00 37.11 O ATOM 1368 CB GLU A 172 37.543 13.526 -13.956 1.00 36.52 C ATOM 1369 CG GLU A 172 38.205 14.345 -12.864 1.00 38.74 C ATOM 1370 CD GLU A 172 37.528 15.487 -12.041 1.00 41.03 C ATOM 1371 OE1 GLU A 172 36.317 15.790 -12.243 1.00 41.85 O ATOM 1372 OE2 GLU A 172 38.408 15.802 -11.087 1.00 42.48 O ATOM 0 H GLU A 172 37.529 10.623 -15.059 1.00 37.14 H new ATOM 0 HA GLU A 172 38.994 13.158 -15.148 1.00 37.99 H new ATOM 0 HB2 GLU A 172 37.189 14.129 -14.628 1.00 36.52 H new ATOM 0 HB3 GLU A 172 36.788 13.050 -13.576 1.00 36.52 H new ATOM 0 HG2 GLU A 172 38.523 13.703 -12.210 1.00 38.74 H new ATOM 0 HG3 GLU A 172 38.988 14.745 -13.273 1.00 38.74 H new ATOM 1373 N LYS A 173 40.860 12.147 -14.004 1.00 38.41 N ATOM 1374 CA LYS A 173 41.984 11.371 -13.408 1.00 38.27 C ATOM 1375 C LYS A 173 41.962 9.877 -13.836 1.00 38.74 C ATOM 1376 O LYS A 173 42.341 8.989 -12.990 1.00 37.18 O ATOM 1377 CB LYS A 173 41.956 11.156 -11.884 1.00 41.22 C ATOM 1378 CG LYS A 173 41.690 12.502 -11.200 1.00 42.49 C ATOM 1379 CD LYS A 173 42.350 12.417 -9.838 1.00 43.72 C ATOM 1380 CE LYS A 173 42.410 13.944 -9.470 1.00 44.77 C ATOM 1381 NZ LYS A 173 42.667 13.759 -8.009 1.00 45.86 N ATOM 0 H LYS A 173 41.100 12.887 -14.370 1.00 38.41 H new ATOM 0 HA LYS A 173 42.727 11.919 -13.705 1.00 38.27 H new ATOM 0 HB2 LYS A 173 41.266 10.517 -11.648 1.00 41.22 H new ATOM 0 HB3 LYS A 173 42.800 10.786 -11.581 1.00 41.22 H new ATOM 0 HG2 LYS A 173 42.058 13.234 -11.719 1.00 42.49 H new ATOM 0 HG3 LYS A 173 40.738 12.666 -11.115 1.00 42.49 H new ATOM 0 HD2 LYS A 173 41.827 11.903 -9.204 1.00 43.72 H new ATOM 0 HD3 LYS A 173 43.230 12.010 -9.877 1.00 43.72 H new ATOM 0 HE2 LYS A 173 43.120 14.421 -9.927 1.00 44.77 H new ATOM 0 HE3 LYS A 173 41.584 14.417 -9.658 1.00 44.77 H new ATOM 0 HZ1 LYS A 173 43.132 14.452 -7.699 1.00 45.86 H new ATOM 0 HZ2 LYS A 173 41.892 13.705 -7.575 1.00 45.86 H new ATOM 0 HZ3 LYS A 173 43.130 13.010 -7.881 1.00 45.86 H new ATOM 1382 N GLY A 174 41.467 9.705 -15.123 1.00 38.43 N ATOM 1383 CA GLY A 174 41.418 8.369 -15.620 1.00 35.44 C ATOM 1384 C GLY A 174 40.293 7.468 -15.033 1.00 37.05 C ATOM 1385 O GLY A 174 40.433 6.209 -15.233 1.00 38.09 O ATOM 0 H GLY A 174 41.187 10.324 -15.650 1.00 38.43 H new ATOM 0 HA2 GLY A 174 41.311 8.404 -16.583 1.00 35.44 H new ATOM 0 HA3 GLY A 174 42.273 7.945 -15.445 1.00 35.44 H new ATOM 1386 N ILE A 175 39.328 8.174 -14.422 1.00 33.69 N ATOM 1387 CA ILE A 175 38.240 7.294 -13.826 1.00 32.00 C ATOM 1388 C ILE A 175 36.957 7.574 -14.652 1.00 28.12 C ATOM 1389 O ILE A 175 36.666 8.742 -14.693 1.00 31.89 O ATOM 1390 CB ILE A 175 38.008 7.537 -12.290 1.00 31.65 C ATOM 1391 CG1 ILE A 175 39.233 6.902 -11.568 1.00 30.60 C ATOM 1392 CG2 ILE A 175 36.682 6.815 -11.784 1.00 32.43 C ATOM 1393 CD1 ILE A 175 39.478 7.399 -10.050 1.00 32.43 C ATOM 0 H ILE A 175 39.262 9.027 -14.335 1.00 33.69 H new ATOM 0 HA ILE A 175 38.504 6.362 -13.880 1.00 32.00 H new ATOM 0 HB ILE A 175 37.913 8.485 -12.108 1.00 31.65 H new ATOM 0 HG12 ILE A 175 39.122 5.938 -11.563 1.00 30.60 H new ATOM 0 HG13 ILE A 175 40.030 7.093 -12.087 1.00 30.60 H new ATOM 0 HG21 ILE A 175 36.564 6.981 -10.836 1.00 32.43 H new ATOM 0 HG22 ILE A 175 35.918 7.163 -12.270 1.00 32.43 H new ATOM 0 HG23 ILE A 175 36.755 5.860 -11.938 1.00 32.43 H new ATOM 0 HD11 ILE A 175 40.258 6.952 -9.685 1.00 32.43 H new ATOM 0 HD12 ILE A 175 39.623 8.358 -10.043 1.00 32.43 H new ATOM 0 HD13 ILE A 175 38.701 7.186 -9.510 1.00 32.43 H new ATOM 1394 N LYS A 176 36.330 6.461 -14.913 1.00 29.19 N ATOM 1395 CA LYS A 176 35.038 6.847 -15.703 1.00 29.83 C ATOM 1396 C LYS A 176 33.841 6.824 -14.715 1.00 28.25 C ATOM 1397 O LYS A 176 33.758 5.805 -14.045 1.00 28.88 O ATOM 1398 CB LYS A 176 34.817 5.860 -16.783 1.00 32.27 C ATOM 1399 CG LYS A 176 35.736 6.385 -17.991 1.00 35.89 C ATOM 1400 CD LYS A 176 35.814 5.070 -18.859 1.00 38.88 C ATOM 1401 CE LYS A 176 36.765 5.637 -20.017 1.00 41.11 C ATOM 1402 NZ LYS A 176 36.118 6.949 -20.526 1.00 43.77 N ATOM 0 H LYS A 176 36.516 5.642 -14.727 1.00 29.19 H new ATOM 0 HA LYS A 176 35.127 7.730 -16.095 1.00 29.83 H new ATOM 0 HB2 LYS A 176 35.074 4.967 -16.505 1.00 32.27 H new ATOM 0 HB3 LYS A 176 33.883 5.819 -17.040 1.00 32.27 H new ATOM 0 HG2 LYS A 176 35.332 7.124 -18.472 1.00 35.89 H new ATOM 0 HG3 LYS A 176 36.608 6.685 -17.691 1.00 35.89 H new ATOM 0 HD2 LYS A 176 36.203 4.321 -18.380 1.00 38.88 H new ATOM 0 HD3 LYS A 176 34.949 4.779 -19.186 1.00 38.88 H new ATOM 0 HE2 LYS A 176 37.658 5.803 -19.678 1.00 41.11 H new ATOM 0 HE3 LYS A 176 36.850 4.993 -20.738 1.00 41.11 H new ATOM 0 HZ1 LYS A 176 36.295 7.051 -21.392 1.00 43.77 H new ATOM 0 HZ2 LYS A 176 35.237 6.912 -20.405 1.00 43.77 H new ATOM 0 HZ3 LYS A 176 36.450 7.639 -20.073 1.00 43.77 H new ATOM 1403 N TYR A 177 32.916 7.771 -14.980 1.00 25.73 N ATOM 1404 CA TYR A 177 31.699 7.679 -14.195 1.00 24.74 C ATOM 1405 C TYR A 177 30.587 8.259 -15.027 1.00 25.12 C ATOM 1406 O TYR A 177 30.826 8.941 -16.072 1.00 26.24 O ATOM 1407 CB TYR A 177 31.891 8.654 -12.891 1.00 22.09 C ATOM 1408 CG TYR A 177 32.280 10.083 -13.011 1.00 24.17 C ATOM 1409 CD1 TYR A 177 33.672 10.443 -12.989 1.00 25.52 C ATOM 1410 CD2 TYR A 177 31.310 11.138 -13.060 1.00 23.76 C ATOM 1411 CE1 TYR A 177 34.042 11.823 -13.034 1.00 28.58 C ATOM 1412 CE2 TYR A 177 31.704 12.503 -13.119 1.00 26.50 C ATOM 1413 CZ TYR A 177 33.073 12.790 -13.026 1.00 26.19 C ATOM 1414 OH TYR A 177 33.449 14.125 -13.074 1.00 29.61 O ATOM 0 H TYR A 177 32.972 8.409 -15.554 1.00 25.73 H new ATOM 0 HA TYR A 177 31.509 6.764 -13.933 1.00 24.74 H new ATOM 0 HB2 TYR A 177 31.052 8.635 -12.405 1.00 22.09 H new ATOM 0 HB3 TYR A 177 32.556 8.232 -12.325 1.00 22.09 H new ATOM 0 HD1 TYR A 177 34.326 9.783 -12.946 1.00 25.52 H new ATOM 0 HD2 TYR A 177 30.405 10.925 -13.053 1.00 23.76 H new ATOM 0 HE1 TYR A 177 34.940 12.064 -13.069 1.00 28.58 H new ATOM 0 HE2 TYR A 177 31.075 13.182 -13.216 1.00 26.50 H new ATOM 0 HH TYR A 177 32.763 14.610 -13.064 1.00 29.61 H new ATOM 1415 N LYS A 178 29.337 7.915 -14.562 1.00 23.76 N ATOM 1416 CA LYS A 178 28.143 8.551 -15.199 1.00 24.94 C ATOM 1417 C LYS A 178 27.063 8.945 -14.219 1.00 24.30 C ATOM 1418 O LYS A 178 26.930 8.246 -13.157 1.00 21.70 O ATOM 1419 CB LYS A 178 27.592 7.474 -16.217 1.00 26.80 C ATOM 1420 CG LYS A 178 27.507 6.052 -15.736 1.00 29.58 C ATOM 1421 CD LYS A 178 26.646 5.135 -16.724 1.00 33.03 C ATOM 1422 CE LYS A 178 26.735 3.633 -16.699 1.00 35.85 C ATOM 1423 NZ LYS A 178 26.183 3.008 -15.416 1.00 39.10 N ATOM 0 H LYS A 178 29.174 7.358 -13.927 1.00 23.76 H new ATOM 0 HA LYS A 178 28.404 9.383 -15.623 1.00 24.94 H new ATOM 0 HB2 LYS A 178 26.705 7.750 -16.496 1.00 26.80 H new ATOM 0 HB3 LYS A 178 28.155 7.491 -17.006 1.00 26.80 H new ATOM 0 HG2 LYS A 178 28.401 5.686 -15.653 1.00 29.58 H new ATOM 0 HG3 LYS A 178 27.110 6.034 -14.851 1.00 29.58 H new ATOM 0 HD2 LYS A 178 25.715 5.362 -16.576 1.00 33.03 H new ATOM 0 HD3 LYS A 178 26.866 5.413 -17.627 1.00 33.03 H new ATOM 0 HE2 LYS A 178 26.250 3.275 -17.459 1.00 35.85 H new ATOM 0 HE3 LYS A 178 27.663 3.370 -16.805 1.00 35.85 H new ATOM 0 HZ1 LYS A 178 26.262 2.123 -15.459 1.00 39.10 H new ATOM 0 HZ2 LYS A 178 26.641 3.313 -14.716 1.00 39.10 H new ATOM 0 HZ3 LYS A 178 25.325 3.225 -15.326 1.00 39.10 H new ATOM 1424 N PHE A 179 26.222 9.901 -14.509 1.00 24.34 N ATOM 1425 CA PHE A 179 25.100 10.417 -13.647 1.00 25.75 C ATOM 1426 C PHE A 179 23.752 9.754 -13.806 1.00 26.32 C ATOM 1427 O PHE A 179 23.374 9.676 -15.052 1.00 26.08 O ATOM 1428 CB PHE A 179 24.973 11.922 -13.748 1.00 23.77 C ATOM 1429 CG PHE A 179 26.181 12.717 -13.521 1.00 25.92 C ATOM 1430 CD1 PHE A 179 26.823 12.718 -12.250 1.00 22.84 C ATOM 1431 CD2 PHE A 179 26.823 13.405 -14.588 1.00 24.01 C ATOM 1432 CE1 PHE A 179 27.904 13.567 -11.986 1.00 23.92 C ATOM 1433 CE2 PHE A 179 27.936 14.175 -14.338 1.00 26.27 C ATOM 1434 CZ PHE A 179 28.517 14.302 -13.037 1.00 26.01 C ATOM 0 H PHE A 179 26.265 10.318 -15.260 1.00 24.34 H new ATOM 0 HA PHE A 179 25.378 10.162 -12.753 1.00 25.75 H new ATOM 0 HB2 PHE A 179 24.635 12.136 -14.632 1.00 23.77 H new ATOM 0 HB3 PHE A 179 24.301 12.209 -13.110 1.00 23.77 H new ATOM 0 HD1 PHE A 179 26.519 12.145 -11.584 1.00 22.84 H new ATOM 0 HD2 PHE A 179 26.491 13.334 -15.454 1.00 24.01 H new ATOM 0 HE1 PHE A 179 28.224 13.651 -11.117 1.00 23.92 H new ATOM 0 HE2 PHE A 179 28.328 14.633 -15.046 1.00 26.27 H new ATOM 0 HZ PHE A 179 29.260 14.840 -12.886 1.00 26.01 H new ATOM 1435 N GLU A 180 22.967 9.139 -12.937 1.00 21.16 N ATOM 1436 CA GLU A 180 21.640 8.527 -13.096 1.00 24.33 C ATOM 1437 C GLU A 180 20.637 9.210 -12.165 1.00 26.24 C ATOM 1438 O GLU A 180 21.012 9.778 -11.127 1.00 27.42 O ATOM 1439 CB GLU A 180 21.712 7.036 -12.765 1.00 23.81 C ATOM 1440 CG GLU A 180 22.733 6.306 -13.634 1.00 25.06 C ATOM 1441 CD GLU A 180 22.774 4.808 -13.383 1.00 26.53 C ATOM 1442 OE1 GLU A 180 22.479 4.349 -12.220 1.00 25.15 O ATOM 1443 OE2 GLU A 180 23.102 4.004 -14.334 1.00 27.65 O ATOM 0 H GLU A 180 23.231 9.055 -12.123 1.00 21.16 H new ATOM 0 HA GLU A 180 21.350 8.638 -14.015 1.00 24.33 H new ATOM 0 HB2 GLU A 180 21.945 6.924 -11.830 1.00 23.81 H new ATOM 0 HB3 GLU A 180 20.837 6.635 -12.889 1.00 23.81 H new ATOM 0 HG2 GLU A 180 22.526 6.466 -14.568 1.00 25.06 H new ATOM 0 HG3 GLU A 180 23.613 6.679 -13.471 1.00 25.06 H new ATOM 1444 N VAL A 181 19.357 9.152 -12.654 1.00 20.65 N ATOM 1445 CA VAL A 181 18.237 9.756 -11.843 1.00 22.16 C ATOM 1446 C VAL A 181 17.208 8.687 -11.740 1.00 22.08 C ATOM 1447 O VAL A 181 16.711 7.996 -12.657 1.00 24.98 O ATOM 1448 CB VAL A 181 17.700 11.135 -12.274 1.00 21.22 C ATOM 1449 CG1 VAL A 181 16.736 11.578 -11.149 1.00 21.90 C ATOM 1450 CG2 VAL A 181 18.801 12.288 -12.572 1.00 20.58 C ATOM 0 H VAL A 181 19.125 8.794 -13.401 1.00 20.65 H new ATOM 0 HA VAL A 181 18.583 10.016 -10.975 1.00 22.16 H new ATOM 0 HB VAL A 181 17.276 11.027 -13.139 1.00 21.22 H new ATOM 0 HG11 VAL A 181 16.363 12.447 -11.366 1.00 21.90 H new ATOM 0 HG12 VAL A 181 16.018 10.931 -11.064 1.00 21.90 H new ATOM 0 HG13 VAL A 181 17.221 11.635 -10.311 1.00 21.90 H new ATOM 0 HG21 VAL A 181 18.350 13.106 -12.833 1.00 20.58 H new ATOM 0 HG22 VAL A 181 19.326 12.449 -11.772 1.00 20.58 H new ATOM 0 HG23 VAL A 181 19.387 11.999 -13.289 1.00 20.58 H new ATOM 1451 N TYR A 182 16.818 8.259 -10.524 1.00 20.88 N ATOM 1452 CA TYR A 182 15.851 7.201 -10.211 1.00 22.09 C ATOM 1453 C TYR A 182 14.663 7.865 -9.538 1.00 23.14 C ATOM 1454 O TYR A 182 14.811 8.892 -8.786 1.00 22.33 O ATOM 1455 CB TYR A 182 16.268 6.066 -9.262 1.00 21.87 C ATOM 1456 CG TYR A 182 17.386 5.164 -9.806 1.00 17.88 C ATOM 1457 CD1 TYR A 182 18.656 5.731 -9.845 1.00 20.65 C ATOM 1458 CD2 TYR A 182 17.044 4.006 -10.419 1.00 20.94 C ATOM 1459 CE1 TYR A 182 19.729 4.949 -10.347 1.00 20.58 C ATOM 1460 CE2 TYR A 182 18.052 3.155 -10.949 1.00 20.22 C ATOM 1461 CZ TYR A 182 19.326 3.716 -10.935 1.00 21.39 C ATOM 1462 OH TYR A 182 20.300 2.885 -11.416 1.00 20.66 O ATOM 0 H TYR A 182 17.141 8.612 -9.809 1.00 20.88 H new ATOM 0 HA TYR A 182 15.701 6.775 -11.070 1.00 22.09 H new ATOM 0 HB2 TYR A 182 16.559 6.452 -8.421 1.00 21.87 H new ATOM 0 HB3 TYR A 182 15.491 5.519 -9.069 1.00 21.87 H new ATOM 0 HD1 TYR A 182 18.798 6.601 -9.549 1.00 20.65 H new ATOM 0 HD2 TYR A 182 16.148 3.767 -10.493 1.00 20.94 H new ATOM 0 HE1 TYR A 182 20.618 5.218 -10.296 1.00 20.58 H new ATOM 0 HE2 TYR A 182 17.876 2.302 -11.275 1.00 20.22 H new ATOM 0 HH TYR A 182 20.962 3.341 -11.660 1.00 20.66 H new ATOM 1463 N GLU A 183 13.481 7.407 -9.858 1.00 23.40 N ATOM 1464 CA GLU A 183 12.252 7.976 -9.305 1.00 24.32 C ATOM 1465 C GLU A 183 11.354 6.829 -8.764 1.00 24.41 C ATOM 1466 O GLU A 183 11.032 5.752 -9.331 1.00 23.42 O ATOM 1467 CB GLU A 183 11.504 8.948 -10.216 1.00 27.56 C ATOM 1468 CG GLU A 183 10.159 9.551 -9.763 1.00 28.29 C ATOM 1469 CD GLU A 183 9.596 10.711 -10.603 1.00 30.34 C ATOM 1470 OE1 GLU A 183 9.639 10.406 -11.783 1.00 31.85 O ATOM 1471 OE2 GLU A 183 9.186 11.750 -10.277 1.00 30.74 O ATOM 0 H GLU A 183 13.353 6.755 -10.404 1.00 23.40 H new ATOM 0 HA GLU A 183 12.519 8.551 -8.571 1.00 24.32 H new ATOM 0 HB2 GLU A 183 12.103 9.688 -10.402 1.00 27.56 H new ATOM 0 HB3 GLU A 183 11.347 8.492 -11.057 1.00 27.56 H new ATOM 0 HG2 GLU A 183 9.499 8.840 -9.750 1.00 28.29 H new ATOM 0 HG3 GLU A 183 10.260 9.861 -8.850 1.00 28.29 H new ATOM 1472 N LYS A 184 10.816 7.096 -7.508 1.00 26.92 N ATOM 1473 CA LYS A 184 9.789 6.252 -6.809 1.00 32.18 C ATOM 1474 C LYS A 184 8.497 7.072 -6.500 1.00 35.77 C ATOM 1475 O LYS A 184 8.481 8.328 -6.277 1.00 38.66 O ATOM 1476 CB LYS A 184 10.108 6.014 -5.316 1.00 32.74 C ATOM 1477 CG LYS A 184 9.213 5.248 -4.364 1.00 36.01 C ATOM 1478 CD LYS A 184 10.264 4.799 -3.252 1.00 38.28 C ATOM 1479 CE LYS A 184 10.080 5.791 -2.076 1.00 39.17 C ATOM 1480 NZ LYS A 184 8.605 5.597 -1.705 1.00 43.01 N ATOM 0 H LYS A 184 11.050 7.783 -7.047 1.00 26.92 H new ATOM 0 HA LYS A 184 9.737 5.477 -7.390 1.00 32.18 H new ATOM 0 HB2 LYS A 184 10.970 5.570 -5.292 1.00 32.74 H new ATOM 0 HB3 LYS A 184 10.230 6.892 -4.923 1.00 32.74 H new ATOM 0 HG2 LYS A 184 8.506 5.803 -3.998 1.00 36.01 H new ATOM 0 HG3 LYS A 184 8.785 4.490 -4.792 1.00 36.01 H new ATOM 0 HD2 LYS A 184 10.101 3.886 -2.967 1.00 38.28 H new ATOM 0 HD3 LYS A 184 11.170 4.831 -3.596 1.00 38.28 H new ATOM 0 HE2 LYS A 184 10.669 5.584 -1.334 1.00 39.17 H new ATOM 0 HE3 LYS A 184 10.268 6.705 -2.342 1.00 39.17 H new ATOM 0 HZ1 LYS A 184 8.525 5.553 -0.820 1.00 43.01 H new ATOM 0 HZ2 LYS A 184 8.129 6.283 -2.012 1.00 43.01 H new ATOM 0 HZ3 LYS A 184 8.304 4.842 -2.067 1.00 43.01 H new ATOM 1481 N ASN A 185 7.329 6.407 -6.304 1.00 38.81 N ATOM 1482 CA ASN A 185 6.015 7.048 -5.850 1.00 40.91 C ATOM 1483 C ASN A 185 5.125 5.884 -5.400 1.00 42.21 C ATOM 1484 O ASN A 185 4.493 5.125 -6.182 1.00 40.93 O ATOM 1485 CB ASN A 185 5.214 8.035 -6.659 1.00 41.71 C ATOM 1486 CG ASN A 185 4.353 9.109 -5.947 1.00 40.07 C ATOM 1487 OD1 ASN A 185 3.658 10.094 -6.594 1.00 41.79 O ATOM 1488 ND2 ASN A 185 4.261 9.169 -4.631 1.00 42.94 N ATOM 0 H ASN A 185 7.259 5.559 -6.428 1.00 38.81 H new ATOM 0 HA ASN A 185 6.325 7.687 -5.190 1.00 40.91 H new ATOM 0 HB2 ASN A 185 5.835 8.502 -7.239 1.00 41.71 H new ATOM 0 HB3 ASN A 185 4.621 7.524 -7.231 1.00 41.71 H new ATOM 0 HD21 ASN A 185 3.795 9.789 -4.260 1.00 42.94 H new ATOM 0 HD22 ASN A 185 4.667 8.588 -4.145 1.00 42.94 H new ATOM 1489 N ASP A 186 5.044 5.715 -4.109 1.00 39.53 N ATOM 1490 CA ASP A 186 4.227 4.628 -3.430 1.00 42.67 C ATOM 1491 C ASP A 186 3.895 5.188 -2.021 1.00 42.94 C ATOM 1492 O ASP A 186 3.852 4.424 -1.028 1.00 45.84 O ATOM 1493 CB ASP A 186 5.060 3.333 -3.380 1.00 41.96 C ATOM 1494 CG ASP A 186 6.105 3.395 -2.258 1.00 42.71 C ATOM 1495 OD1 ASP A 186 6.358 4.424 -1.476 1.00 42.01 O ATOM 1496 OD2 ASP A 186 6.839 2.350 -2.212 1.00 41.25 O ATOM 1497 OXT ASP A 186 3.740 6.455 -1.902 1.00 44.47 O ATOM 0 H ASP A 186 5.459 6.221 -3.551 1.00 39.53 H new ATOM 0 HA ASP A 186 3.407 4.405 -3.898 1.00 42.67 H new ATOM 0 HB2 ASP A 186 4.474 2.573 -3.239 1.00 41.96 H new ATOM 0 HB3 ASP A 186 5.503 3.196 -4.232 1.00 41.96 H new TER 1498 ASP A 186 HETATM 1499 PA NDP A 187 26.763 8.675 8.694 1.00 25.27 P HETATM 1500 O1A NDP A 187 27.324 9.903 8.170 1.00 22.15 O HETATM 1501 O2A NDP A 187 25.525 8.123 8.330 1.00 25.50 O HETATM 1502 O5B NDP A 187 27.077 8.735 10.343 1.00 24.23 O HETATM 1503 C5B NDP A 187 26.475 7.701 11.191 1.00 26.09 C HETATM 1504 C4B NDP A 187 26.095 8.573 12.448 1.00 27.79 C HETATM 1505 O4B NDP A 187 25.147 9.410 12.179 1.00 28.70 O HETATM 1506 C3B NDP A 187 25.355 7.487 13.422 1.00 26.36 C HETATM 1507 O3B NDP A 187 26.440 6.880 14.325 1.00 30.95 O HETATM 1508 C2B NDP A 187 24.473 8.489 14.265 1.00 29.41 C HETATM 1509 O2B NDP A 187 25.298 9.373 14.964 1.00 26.79 O HETATM 1510 C1B NDP A 187 23.995 9.436 13.048 1.00 28.98 C HETATM 1511 N9A NDP A 187 22.881 8.917 12.371 1.00 31.76 N HETATM 1512 C8A NDP A 187 22.947 8.185 11.213 1.00 34.15 C HETATM 1513 N7A NDP A 187 21.754 7.838 10.827 1.00 34.18 N HETATM 1514 C5A NDP A 187 20.851 8.393 11.818 1.00 35.30 C HETATM 1515 C6A NDP A 187 19.323 8.483 12.117 1.00 35.70 C HETATM 1516 N6A NDP A 187 18.309 7.943 11.385 1.00 39.10 N HETATM 1517 N1A NDP A 187 18.950 9.108 13.248 1.00 38.42 N HETATM 1518 C2A NDP A 187 19.841 9.710 14.011 1.00 36.27 C HETATM 1519 N3A NDP A 187 21.189 9.646 13.880 1.00 37.06 N HETATM 1520 C4A NDP A 187 21.615 8.971 12.706 1.00 33.63 C HETATM 1521 O3 NDP A 187 27.924 7.666 8.384 1.00 27.80 O HETATM 1522 PN NDP A 187 28.473 6.391 7.440 1.00 25.55 P HETATM 1523 O1N NDP A 187 27.510 5.564 6.794 1.00 25.88 O HETATM 1524 O2N NDP A 187 29.134 5.705 8.468 1.00 32.75 O HETATM 1525 O5D NDP A 187 29.603 7.055 6.597 1.00 27.38 O HETATM 1526 C5D NDP A 187 30.231 8.172 6.028 1.00 30.33 C HETATM 1527 C4D NDP A 187 31.262 7.490 5.040 1.00 26.80 C HETATM 1528 O4D NDP A 187 30.784 7.559 3.607 1.00 27.79 O HETATM 1529 C3D NDP A 187 32.580 8.421 5.064 1.00 27.42 C HETATM 1530 O3D NDP A 187 33.604 7.395 4.838 1.00 27.30 O HETATM 1531 C2D NDP A 187 32.184 9.544 4.118 1.00 26.49 C HETATM 1532 O2D NDP A 187 33.325 10.139 3.581 1.00 28.07 O HETATM 1533 C1D NDP A 187 31.448 8.766 3.011 1.00 26.47 C HETATM 1534 N1N NDP A 187 30.284 9.383 2.256 1.00 28.51 N HETATM 1535 C2N NDP A 187 30.376 9.152 0.802 1.00 26.55 C HETATM 1536 C3N NDP A 187 29.294 9.555 0.125 1.00 26.44 C HETATM 1537 C7N NDP A 187 29.418 9.374 -1.402 1.00 26.30 C HETATM 1538 O7N NDP A 187 28.404 9.815 -1.909 1.00 24.25 O HETATM 1539 N7N NDP A 187 30.370 8.653 -1.953 1.00 21.98 N HETATM 1540 C4N NDP A 187 28.064 10.258 0.706 1.00 26.11 C HETATM 1541 C5N NDP A 187 28.099 10.318 2.223 1.00 26.16 C HETATM 1542 C6N NDP A 187 29.198 9.974 2.993 1.00 25.09 C HETATM 1543 P2B NDP A 187 25.391 8.954 16.649 1.00 27.07 P HETATM 1544 O1X NDP A 187 23.983 8.827 17.070 1.00 24.88 O HETATM 1545 O2X NDP A 187 26.020 10.223 17.016 1.00 26.09 O HETATM 1546 O3X NDP A 187 26.410 7.897 16.643 1.00 26.58 O HETATM 0 HO3N NDP A 187 33.840 7.068 5.575 1.00 27.30 H new HETATM 0 HO3A NDP A 187 26.701 7.457 14.876 1.00 30.95 H new HETATM 0 HO2N NDP A 187 33.100 10.757 3.059 1.00 28.07 H new HETATM 0 H72N NDP A 187 30.409 8.574 -2.808 1.00 21.98 H new HETATM 0 H71N NDP A 187 30.954 8.261 -1.458 1.00 21.98 H new HETATM 0 H62A NDP A 187 17.493 8.050 11.636 1.00 39.10 H new HETATM 0 H61A NDP A 187 18.484 7.495 10.672 1.00 39.10 H new HETATM 0 H52N NDP A 187 29.603 8.745 5.561 1.00 30.33 H new HETATM 0 H52A NDP A 187 25.701 7.286 10.779 1.00 26.09 H new HETATM 0 H51N NDP A 187 30.673 8.720 6.695 1.00 30.33 H new HETATM 0 H51A NDP A 187 27.097 6.989 11.407 1.00 26.09 H new HETATM 0 H42N NDP A 187 28.010 11.159 0.350 1.00 26.11 H new HETATM 0 H41N NDP A 187 27.263 9.792 0.421 1.00 26.11 H new HETATM 0 H8A NDP A 187 23.767 7.958 10.748 1.00 34.15 H new HETATM 0 H6N NDP A 187 29.233 10.120 3.951 1.00 25.09 H new HETATM 0 H5N NDP A 187 27.299 10.617 2.683 1.00 26.16 H new HETATM 0 H4D NDP A 187 31.394 6.568 5.310 1.00 26.80 H new HETATM 0 H4B NDP A 187 26.874 9.043 12.786 1.00 27.79 H new HETATM 0 H3D NDP A 187 32.937 8.928 5.810 1.00 27.42 H new HETATM 0 H3B NDP A 187 24.872 6.760 12.999 1.00 26.36 H new HETATM 0 H2N NDP A 187 31.148 8.746 0.377 1.00 26.55 H new HETATM 0 H2D NDP A 187 31.665 10.250 4.534 1.00 26.49 H new HETATM 0 H2B NDP A 187 23.836 8.053 14.852 1.00 29.41 H new HETATM 0 H2A NDP A 187 19.498 10.253 14.738 1.00 36.27 H new HETATM 0 H1D NDP A 187 32.184 8.658 2.388 1.00 26.47 H new HETATM 0 H1B NDP A 187 23.723 10.318 13.347 1.00 28.98 H new HETATM 1547 N1 MOT A 188 29.113 13.186 -4.599 1.00 21.06 N HETATM 1548 C2 MOT A 188 27.812 12.815 -4.570 1.00 22.36 C HETATM 1549 NA2 MOT A 188 27.344 12.644 -5.927 1.00 18.12 N HETATM 1550 N3 MOT A 188 27.040 12.681 -3.605 1.00 17.14 N HETATM 1551 C4 MOT A 188 27.498 12.920 -2.362 1.00 20.92 C HETATM 1552 NA4 MOT A 188 26.650 12.737 -1.439 1.00 20.41 N HETATM 1553 C4A MOT A 188 28.810 13.127 -2.193 1.00 21.15 C HETATM 1554 C6 MOT A 188 29.837 13.408 -1.218 1.00 24.37 C HETATM 1555 C7 MOT A 188 30.960 13.640 -1.867 1.00 25.07 C HETATM 1556 O8 MOT A 188 30.812 13.482 -3.168 1.00 25.81 O HETATM 1557 C8A MOT A 188 29.596 13.264 -3.323 1.00 25.38 C HETATM 1558 C9 MOT A 188 29.581 13.418 0.321 1.00 24.29 C HETATM 1559 N10 MOT A 188 30.789 14.228 0.907 1.00 24.17 N HETATM 1560 CM MOT A 188 31.749 13.174 1.412 1.00 23.10 C HETATM 1561 C11 MOT A 188 32.054 18.266 0.374 1.00 27.87 C HETATM 1562 C12 MOT A 188 30.787 17.843 0.010 1.00 28.82 C HETATM 1563 C13 MOT A 188 30.370 16.522 0.211 1.00 27.24 C HETATM 1564 C14 MOT A 188 31.114 15.519 0.668 1.00 24.26 C HETATM 1565 C15 MOT A 188 32.390 15.994 1.042 1.00 25.32 C HETATM 1566 C16 MOT A 188 32.851 17.283 0.944 1.00 25.92 C HETATM 1567 C MOT A 188 32.380 19.523 0.100 1.00 28.35 C HETATM 1568 O MOT A 188 33.458 19.984 0.396 1.00 30.15 O HETATM 1569 N MOT A 188 31.495 20.232 -0.675 1.00 31.10 N HETATM 1570 CA MOT A 188 31.750 21.621 -1.154 1.00 29.30 C HETATM 1571 CT MOT A 188 30.385 22.242 -1.424 1.00 31.81 C HETATM 1572 O1 MOT A 188 29.453 21.476 -1.768 1.00 27.18 O HETATM 1573 O2 MOT A 188 30.145 23.477 -1.433 1.00 22.95 O HETATM 1574 CB MOT A 188 32.289 21.313 -2.601 1.00 34.89 C HETATM 1575 CG MOT A 188 32.687 22.521 -3.350 1.00 39.79 C HETATM 1576 CD MOT A 188 33.747 22.201 -4.383 1.00 42.33 C HETATM 1577 OE1 MOT A 188 34.054 21.062 -4.710 1.00 42.68 O HETATM 1578 OE2 MOT A 188 34.285 23.295 -4.701 1.00 45.25 O HETATM 0 HN42 MOT A 188 26.872 12.870 -0.619 1.00 20.41 H new HETATM 0 HN41 MOT A 188 25.853 12.479 -1.633 1.00 20.41 H new HETATM 0 HN22 MOT A 188 26.530 12.407 -6.075 1.00 18.12 H new HETATM 0 HN21 MOT A 188 27.879 12.779 -6.587 1.00 18.12 H new HETATM 0 HN MOT A 188 30.754 19.855 -0.896 1.00 31.10 H new HETATM 0 HM3 MOT A 188 31.312 12.637 2.091 1.00 23.10 H new HETATM 0 HM2 MOT A 188 32.021 12.604 0.676 1.00 23.10 H new HETATM 0 HM1 MOT A 188 32.531 13.604 1.793 1.00 23.10 H new HETATM 0 HG2 MOT A 188 31.910 22.904 -3.788 1.00 39.79 H new HETATM 0 HG1 MOT A 188 33.024 23.190 -2.734 1.00 39.79 H new HETATM 0 HB2 MOT A 188 33.051 20.717 -2.534 1.00 34.89 H new HETATM 0 HB1 MOT A 188 31.603 20.843 -3.101 1.00 34.89 H new HETATM 0 HA MOT A 188 32.298 22.165 -0.568 1.00 29.30 H new HETATM 0 H92 MOT A 188 28.734 13.839 0.537 1.00 24.29 H new HETATM 0 H91 MOT A 188 29.550 12.518 0.681 1.00 24.29 H new HETATM 0 H7 MOT A 188 31.793 13.896 -1.441 1.00 25.07 H new HETATM 0 H16 MOT A 188 33.735 17.507 1.274 1.00 25.92 H new HETATM 0 H15 MOT A 188 33.006 15.340 1.407 1.00 25.32 H new HETATM 0 H13 MOT A 188 29.447 16.318 -0.004 1.00 27.24 H new HETATM 0 H12 MOT A 188 30.174 18.477 -0.394 1.00 28.82 H new HETATM 1579 O HOH A 189 24.713 11.861 -8.038 1.00 20.71 O HETATM 1580 O HOH A 190 23.098 12.138 -10.535 1.00 24.41 O HETATM 1581 O HOH A 191 35.180 14.237 -5.022 1.00 43.07 O HETATM 1582 O HOH A 192 35.621 13.880 2.062 1.00 40.37 O HETATM 1583 O HOH A 193 35.648 18.777 -0.917 1.00 45.36 O HETATM 1584 O HOH A 194 18.646 21.452 -7.474 1.00 32.97 O HETATM 1585 O HOH A 195 34.321 5.373 6.171 1.00 22.31 O HETATM 1586 O HOH A 196 42.080 4.555 10.299 1.00 23.87 O HETATM 1587 O HOH A 197 40.239 10.199 7.125 1.00 36.70 O HETATM 1588 O HOH A 198 20.465 26.399 -1.422 1.00 32.52 O HETATM 1589 O HOH A 199 26.217 11.356 -17.107 1.00 31.82 O HETATM 1590 O HOH A 200 25.440 16.358 -15.002 1.00 34.56 O HETATM 1591 O HOH A 201 27.276 28.160 11.084 1.00 33.45 O HETATM 1592 O HOH A 202 26.636 29.853 8.478 1.00 30.15 O HETATM 1593 O HOH A 203 35.449 21.348 -7.136 1.00 43.90 O HETATM 1594 O HOH A 204 34.376 11.154 9.071 1.00 31.03 O HETATM 1595 O HOH A 205 24.847 4.331 11.256 1.00 43.31 O HETATM 1596 O HOH A 206 35.861 3.817 8.653 1.00 28.37 O HETATM 1597 O HOH A 207 40.084 2.612 -1.755 1.00 34.51 O HETATM 1598 O HOH A 208 12.951 -0.387 -12.675 1.00 34.27 O HETATM 1599 O HOH A 209 15.612 0.129 -2.453 1.00 36.16 O HETATM 1600 O HOH A 210 21.468 -2.441 -5.942 1.00 38.60 O HETATM 1601 O HOH A 211 38.577 0.591 7.609 1.00 37.73 O HETATM 1602 O HOH A 212 42.546 1.548 8.881 1.00 37.52 O HETATM 1603 O HOH A 213 20.901 14.658 20.105 1.00 36.78 O HETATM 1604 O HOH A 214 22.830 29.243 4.876 1.00 42.88 O HETATM 1605 O HOH A 215 31.080 25.405 1.545 1.00 36.51 O HETATM 1606 O HOH A 216 33.223 12.163 -5.807 1.00 31.82 O HETATM 1607 O HOH A 217 20.186 13.272 -18.116 1.00 37.29 O HETATM 1608 O HOH A 218 33.894 4.805 11.968 1.00 38.11 O HETATM 1609 O HOH A 219 31.397 3.993 8.014 1.00 34.83 O HETATM 1610 O HOH A 220 36.536 -3.901 2.383 1.00 32.36 O HETATM 1611 O HOH A 221 28.156 19.150 19.465 1.00 35.86 O HETATM 1612 O HOH A 222 31.726 14.366 17.679 1.00 32.42 O HETATM 1613 O HOH A 223 34.292 8.136 12.991 1.00 28.78 O HETATM 1614 O HOH A 224 41.008 11.108 -17.318 1.00 38.45 O HETATM 1615 O HOH A 225 35.099 10.080 11.512 1.00 33.97 O HETATM 1616 O HOH A 226 30.065 12.441 18.832 1.00 15.00 O HETATM 1617 O HOH A 227 10.067 31.102 -10.244 1.00 15.00 O HETATM 1618 O HOH A 228 10.001 22.779 -9.222 1.00 15.00 O HETATM 1619 O HOH A 229 39.485 10.655 -1.192 1.00 15.00 O HETATM 1620 O HOH A 230 40.278 0.996 -9.062 1.00 15.00 O HETATM 1621 O HOH A 231 28.682 1.415 -10.860 1.00 15.00 O HETATM 1622 O HOH A 232 27.001 0.842 -8.491 1.00 15.00 O HETATM 1623 O HOH A 233 19.601 -2.469 -8.306 1.00 15.00 O HETATM 1624 O HOH A 234 13.724 -6.460 -6.389 1.00 15.00 O HETATM 1625 O HOH A 235 8.239 -5.185 -10.901 1.00 15.00 O HETATM 1626 O HOH A 236 9.361 -7.483 -12.270 1.00 15.00 O HETATM 1627 O HOH A 237 9.038 -2.601 -12.261 1.00 15.00 O HETATM 1628 O HOH A 238 8.948 14.696 -10.082 1.00 15.00 O HETATM 1629 O HOH A 239 10.882 13.299 -12.057 1.00 15.00 O CONECT 1499 1500 1501 1502 1521 CONECT 1500 1499 CONECT 1501 1499 CONECT 1502 1499 1503 CONECT 1503 1502 1504 CONECT 1504 1503 1505 1506 CONECT 1505 1504 1510 CONECT 1506 1504 1507 1508 CONECT 1507 1506 CONECT 1508 1506 1509 1510 CONECT 1509 1508 1543 CONECT 1510 1505 1508 1511 CONECT 1511 1510 1512 1520 CONECT 1512 1511 1513 CONECT 1513 1512 1514 CONECT 1514 1513 1515 1520 CONECT 1515 1514 1516 1517 CONECT 1516 1515 CONECT 1517 1515 1518 CONECT 1518 1517 1519 CONECT 1519 1518 1520 CONECT 1520 1511 1514 1519 CONECT 1521 1499 1522 CONECT 1522 1521 1523 1524 1525 CONECT 1523 1522 CONECT 1524 1522 CONECT 1525 1522 1526 CONECT 1526 1525 1527 CONECT 1527 1526 1528 1529 CONECT 1528 1527 1533 CONECT 1529 1527 1530 1531 CONECT 1530 1529 CONECT 1531 1529 1532 1533 CONECT 1532 1531 CONECT 1533 1528 1531 1534 CONECT 1534 1533 1535 1542 CONECT 1535 1534 1536 CONECT 1536 1535 1537 1540 CONECT 1537 1536 1538 1539 CONECT 1538 1537 CONECT 1539 1537 CONECT 1540 1536 1541 CONECT 1541 1540 1542 CONECT 1542 1534 1541 CONECT 1543 1509 1544 1545 1546 CONECT 1544 1543 CONECT 1545 1543 CONECT 1546 1543 CONECT 1547 1548 1557 CONECT 1548 1547 1549 1550 CONECT 1549 1548 CONECT 1550 1548 1551 CONECT 1551 1550 1552 1553 CONECT 1552 1551 CONECT 1553 1551 1554 1557 CONECT 1554 1553 1555 1558 CONECT 1555 1554 1556 CONECT 1556 1555 1557 CONECT 1557 1547 1553 1556 CONECT 1558 1554 1559 CONECT 1559 1558 1560 1564 CONECT 1560 1559 CONECT 1561 1562 1566 1567 CONECT 1562 1561 1563 CONECT 1563 1562 1564 CONECT 1564 1559 1563 1565 CONECT 1565 1564 1566 CONECT 1566 1561 1565 CONECT 1567 1561 1568 1569 CONECT 1568 1567 CONECT 1569 1567 1570 CONECT 1570 1569 1571 1574 CONECT 1571 1570 1572 1573 CONECT 1572 1571 CONECT 1573 1571 CONECT 1574 1570 1575 CONECT 1575 1574 1576 CONECT 1576 1575 1577 1578 CONECT 1577 1576 CONECT 1578 1576 END