Browse entries in the PDBbind-CN Database
HEADER HYDROLASE/HYDROLASE INHIBITOR 30-NOV-04 1Y4D TITLE CRYSTAL STRUCTURE OF THE COMPLEX OF SUBTILISIN BPN' WITH CHYMOTRYPSIN TITLE 2 INHIBITOR 2 M59R/E60S MUTANT COMPND MOL_ID: 1; COMPND 2 MOLECULE: SUBTILISIN BPN'; COMPND 3 CHAIN: E; COMPND 4 SYNONYM: SUBTILISIN NOVO; SUBTILISIN DFE; ALKALINE PROTEASE; COMPND 5 EC: 3.4.21.62; COMPND 6 ENGINEERED: YES; COMPND 7 MUTATION: YES; COMPND 8 MOL_ID: 2; COMPND 9 MOLECULE: CHYMOTRYPSIN INHIBITOR 2; COMPND 10 CHAIN: I; COMPND 11 ENGINEERED: YES; COMPND 12 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS AMYLOLIQUEFACIENS; SOURCE 3 ORGANISM_TAXID: 1390; SOURCE 4 GENE: APR; SOURCE 5 EXPRESSION_SYSTEM: BACILLUS SUBTILIS; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 1423; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: BG2036; SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PSER25; SOURCE 10 MOL_ID: 2; SOURCE 11 ORGANISM_SCIENTIFIC: HORDEUM VULGARE; SOURCE 12 ORGANISM_TAXID: 4513; SOURCE 13 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21(DE3); SOURCE 14 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 15 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 16 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 17 EXPRESSION_SYSTEM_PLASMID: PCI2M59R-E60S KEYWDS SERINE PROTEASE; INHIBITOR, HYDROLASE-HYDROLASE INHIBITOR COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR E.S.RADISKY,C.J.LU,G.KWAN,D.E.KOSHLAND JR. REVDAT 3 11-OCT-17 1Y4D 1 REMARK REVDAT 2 24-FEB-09 1Y4D 1 VERSN REVDAT 1 17-MAY-05 1Y4D 0 JRNL AUTH E.S.RADISKY,C.J.LU,G.KWAN,D.E.KOSHLAND JR. JRNL TITL ROLE OF THE INTRAMOLECULAR HYDROGEN BOND NETWORK IN THE JRNL TITL 2 INHIBITORY POWER OF CHYMOTRYPSIN INHIBITOR 2 JRNL REF BIOCHEMISTRY V. 44 6823 2005 JRNL REFN ISSN 0006-2960 JRNL PMID 15865427 JRNL DOI 10.1021/BI047301W REMARK 2 REMARK 2 RESOLUTION. 2.00 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.1.24 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.00 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 32.55 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.2 REMARK 3 NUMBER OF REFLECTIONS : 21026 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : INHERITED FROM 1TM3 REMARK 3 R VALUE (WORKING + TEST SET) : 0.200 REMARK 3 R VALUE (WORKING SET) : 0.197 REMARK 3 FREE R VALUE : 0.252 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.100 REMARK 3 FREE R VALUE TEST SET COUNT : 1130 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.00 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.05 REMARK 3 REFLECTION IN BIN (WORKING SET) : 1565 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 BIN R VALUE (WORKING SET) : 0.2490 REMARK 3 BIN FREE R VALUE SET COUNT : 86 REMARK 3 BIN FREE R VALUE : 0.3220 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2433 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 2 REMARK 3 SOLVENT ATOMS : 114 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 26.58 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.52000 REMARK 3 B22 (A**2) : -0.52000 REMARK 3 B33 (A**2) : 0.78000 REMARK 3 B12 (A**2) : -0.26000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.197 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.180 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.129 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 4.621 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.940 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.906 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2506 ; 0.023 ; 0.021 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3413 ; 1.810 ; 1.946 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 337 ; 6.881 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): NULL ; NULL ; NULL REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 400 ; 0.131 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1876 ; 0.008 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 1059 ; 0.219 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 124 ; 0.166 ; 0.200 REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): 5 ; 0.083 ; 0.200 REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): 19 ; 0.206 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 4 ; 0.301 ; 0.200 REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 1676 ; 1.088 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2698 ; 1.826 ; 2.000 REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 830 ; 2.783 ; 3.000 REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 715 ; 4.393 ; 4.500 REMARK 3 SIDE-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : BABINET MODEL WITH MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.40 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1Y4D COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 08-DEC-04. REMARK 100 THE DEPOSITION ID IS D_1000031100. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 04-JUN-03 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 4.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ALS REMARK 200 BEAMLINE : 8.3.1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.000 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 4 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : MOSFLM, TRUNCATE REMARK 200 DATA SCALING SOFTWARE : SCALA, CCP4 (SCALA, TRUNCATE REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 22160 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.000 REMARK 200 RESOLUTION RANGE LOW (A) : 32.550 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -3.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.6 REMARK 200 DATA REDUNDANCY : 4.900 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 0.15700 REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 7.4000 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 <I/SIGMA(I)> FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: EPMR REMARK 200 STARTING MODEL: 1TM3 REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 45.70 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.30 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: POTASSIUM PHOSPHATE, PEG 8000, PH 4.5, REMARK 280 VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 277K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 61 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+1/3 REMARK 290 3555 -X+Y,-X,Z+2/3 REMARK 290 4555 -X,-Y,Z+1/2 REMARK 290 5555 Y,-X+Y,Z+5/6 REMARK 290 6555 X-Y,X,Z+1/6 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 14.30233 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 28.60467 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 21.45350 REMARK 290 SMTRY1 5 0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 5 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 35.75583 REMARK 290 SMTRY1 6 0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 7.15117 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: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 1890 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 12880 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -21.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: E, I REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 HIS E 277 REMARK 465 HIS E 278 REMARK 465 HIS E 279 REMARK 465 HIS E 280 REMARK 465 HIS E 281 REMARK 465 MET I 20 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 ASP E 259 CG OD1 OD2 REMARK 470 HIS E 276 CG ND1 CD2 CE1 NE2 REMARK 470 GLU I 23 CD OE1 OE2 REMARK 470 GLU I 33 CD OE1 OE2 REMARK 470 ASP I 74 CG OD1 OD2 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 OE1 GLU E 112 O HOH E 1051 2.14 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 LEU E 90 CA - CB - CG ANGL. DEV. = 14.1 DEGREES REMARK 500 ARG E 186 NE - CZ - NH1 ANGL. DEV. = 4.4 DEGREES REMARK 500 ARG E 186 NE - CZ - NH2 ANGL. DEV. = -4.1 DEGREES REMARK 500 ASP E 197 CB - CG - OD2 ANGL. DEV. = 8.5 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ASP E 32 -148.24 -170.44 REMARK 500 ASP E 36 90.86 -69.83 REMARK 500 SER E 63 -26.68 103.77 REMARK 500 ALA E 73 30.27 -153.01 REMARK 500 ASN E 77 -140.42 -149.46 REMARK 500 VAL E 81 -169.16 -114.67 REMARK 500 SER E 159 55.98 -150.51 REMARK 500 LEU E 257 -141.80 -123.55 REMARK 500 GLU I 26 -7.82 -54.96 REMARK 500 VAL I 28 -140.40 27.83 REMARK 500 GLN I 41 33.81 -68.90 REMARK 500 ASP I 42 -30.39 -161.26 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: NON-CIS, NON-TRANS REMARK 500 REMARK 500 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH REMARK 500 CIS AND TRANS CONFORMATION. CIS BONDS, IF ANY, ARE LISTED REMARK 500 ON CISPEP RECORDS. TRANS IS DEFINED AS 180 +/- 30 AND REMARK 500 CIS IS DEFINED AS 0 +/- 30 DEGREES. REMARK 500 MODEL OMEGA REMARK 500 LEU I 27 VAL I 28 149.10 REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CA E1001 CA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 LEU E 75 O REMARK 620 2 VAL E 81 O 90.0 REMARK 620 3 GLN E 2 NE2 79.8 78.7 REMARK 620 4 ASP E 41 OD1 113.1 77.7 153.0 REMARK 620 5 ASP E 41 OD2 85.7 124.6 152.7 54.3 REMARK 620 6 ASN E 77 OD1 87.7 156.0 77.3 124.9 79.0 REMARK 620 7 ILE E 79 O 159.5 102.2 86.4 85.9 100.3 74.4 REMARK 620 N 1 2 3 4 5 6 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 NA E1002 NA REMARK 620 N RES CSSEQI ATOM REMARK 620 1 GLY E 169 O REMARK 620 2 TYR E 171 O 79.1 REMARK 620 3 VAL E 174 O 99.5 73.2 REMARK 620 4 ASP E 197 OD2 120.8 140.2 69.8 REMARK 620 5 HOH E1069 O 167.8 97.6 90.7 69.0 REMARK 620 N 1 2 3 4 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CA E 1001 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NA E 1002 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1Y1K RELATED DB: PDB REMARK 900 RELATED ID: 1Y33 RELATED DB: PDB REMARK 900 RELATED ID: 1Y34 RELATED DB: PDB REMARK 900 RELATED ID: 1Y3B RELATED DB: PDB REMARK 900 RELATED ID: 1Y3C RELATED DB: PDB REMARK 900 RELATED ID: 1Y3D RELATED DB: PDB REMARK 900 RELATED ID: 1Y3F RELATED DB: PDB REMARK 900 RELATED ID: 1Y48 RELATED DB: PDB REMARK 900 RELATED ID: 1Y4A RELATED DB: PDB DBREF 1Y4D E 1 275 UNP P00782 SUBT_BACAM 108 382 DBREF 1Y4D I 21 83 UNP Q40059 Q40059_HORVU 22 84 SEQADV 1Y4D HIS E 276 UNP P00782 EXPRESSION TAG SEQADV 1Y4D HIS E 277 UNP P00782 EXPRESSION TAG SEQADV 1Y4D HIS E 278 UNP P00782 EXPRESSION TAG SEQADV 1Y4D HIS E 279 UNP P00782 EXPRESSION TAG SEQADV 1Y4D HIS E 280 UNP P00782 EXPRESSION TAG SEQADV 1Y4D HIS E 281 UNP P00782 EXPRESSION TAG SEQADV 1Y4D MET I 20 UNP Q40059 INITIATING METHIONINE SEQADV 1Y4D ARG I 59 UNP Q40059 MET 60 ENGINEERED SEQADV 1Y4D SER I 60 UNP Q40059 GLU 61 ENGINEERED SEQRES 1 E 281 ALA GLN SER VAL PRO TYR GLY VAL SER GLN ILE LYS ALA SEQRES 2 E 281 PRO ALA LEU HIS SER GLN GLY TYR THR GLY SER ASN VAL SEQRES 3 E 281 LYS VAL ALA VAL ILE ASP SER GLY ILE ASP SER SER HIS SEQRES 4 E 281 PRO ASP LEU LYS VAL ALA GLY GLY ALA SER MET VAL PRO SEQRES 5 E 281 SER GLU THR ASN PRO PHE GLN ASP ASN ASN SER HIS GLY SEQRES 6 E 281 THR HIS VAL ALA GLY THR VAL ALA ALA LEU ASN ASN SER SEQRES 7 E 281 ILE GLY VAL LEU GLY VAL ALA PRO SER ALA SER LEU TYR SEQRES 8 E 281 ALA VAL LYS VAL LEU GLY ALA ASP GLY SER GLY GLN TYR SEQRES 9 E 281 SER TRP ILE ILE ASN GLY ILE GLU TRP ALA ILE ALA ASN SEQRES 10 E 281 ASN MET ASP VAL ILE ASN MET SER LEU GLY GLY PRO SER SEQRES 11 E 281 GLY SER ALA ALA LEU LYS ALA ALA VAL ASP LYS ALA VAL SEQRES 12 E 281 ALA SER GLY VAL VAL VAL VAL ALA ALA ALA GLY ASN GLU SEQRES 13 E 281 GLY THR SER GLY SER SER SER THR VAL GLY TYR PRO GLY SEQRES 14 E 281 LYS TYR PRO SER VAL ILE ALA VAL GLY ALA VAL ASP SER SEQRES 15 E 281 SER ASN GLN ARG ALA SER PHE SER SER VAL GLY PRO GLU SEQRES 16 E 281 LEU ASP VAL MET ALA PRO GLY VAL SER ILE GLN SER THR SEQRES 17 E 281 LEU PRO GLY ASN LYS TYR GLY ALA TYR ASN GLY THR SER SEQRES 18 E 281 MET ALA SER PRO HIS VAL ALA GLY ALA ALA ALA LEU ILE SEQRES 19 E 281 LEU SER LYS HIS PRO ASN TRP THR ASN THR GLN VAL ARG SEQRES 20 E 281 SER SER LEU GLU ASN THR THR THR LYS LEU GLY ASP SER SEQRES 21 E 281 PHE TYR TYR GLY LYS GLY LEU ILE ASN VAL GLN ALA ALA SEQRES 22 E 281 ALA GLN HIS HIS HIS HIS HIS HIS SEQRES 1 I 64 MET LYS THR GLU TRP PRO GLU LEU VAL GLY LYS SER VAL SEQRES 2 I 64 GLU GLU ALA LYS LYS VAL ILE LEU GLN ASP LYS PRO ALA SEQRES 3 I 64 ALA GLN ILE ILE VAL LEU PRO VAL GLY THR ILE VAL THR SEQRES 4 I 64 ARG SER TYR ARG ILE ASP ARG VAL ARG LEU PHE VAL ASP SEQRES 5 I 64 ARG LEU ASP ASN ILE ALA GLN VAL PRO ARG VAL GLY HET CA E1001 1 HET NA E1002 1 HETNAM CA CALCIUM ION HETNAM NA SODIUM ION FORMUL 3 CA CA 2+ FORMUL 4 NA NA 1+ FORMUL 5 HOH *114(H2 O) HELIX 1 1 PRO E 5 ILE E 11 1 7 HELIX 2 2 LYS E 12 GLN E 19 1 8 HELIX 3 3 SER E 63 ALA E 74 1 12 HELIX 4 4 GLN E 103 ASN E 117 1 15 HELIX 5 5 SER E 132 SER E 145 1 14 HELIX 6 6 GLY E 219 HIS E 238 1 20 HELIX 7 7 THR E 242 THR E 253 1 12 HELIX 8 8 ASP E 259 GLY E 264 1 6 HELIX 9 9 ASN E 269 HIS E 276 1 8 HELIX 10 10 TRP I 24 VAL I 28 5 5 HELIX 11 11 SER I 31 GLN I 41 1 11 SHEET 1 A 7 VAL E 44 SER E 49 0 SHEET 2 A 7 SER E 89 LYS E 94 1 O LEU E 90 N ALA E 45 SHEET 3 A 7 LYS E 27 ASP E 32 1 N VAL E 28 O SER E 89 SHEET 4 A 7 VAL E 121 MET E 124 1 O VAL E 121 N ALA E 29 SHEET 5 A 7 VAL E 148 ALA E 152 1 O VAL E 150 N MET E 124 SHEET 6 A 7 ILE E 175 VAL E 180 1 O ILE E 175 N ALA E 151 SHEET 7 A 7 VAL E 198 PRO E 201 1 O VAL E 198 N GLY E 178 SHEET 1 B 3 SER E 101 GLY E 102 0 SHEET 2 B 3 ILE I 56 THR I 58 -1 O ILE I 56 N GLY E 102 SHEET 3 B 3 LEU E 126 GLY E 127 -1 N GLY E 127 O VAL I 57 SHEET 1 C 2 ILE E 205 LEU E 209 0 SHEET 2 C 2 LYS E 213 TYR E 217 -1 O TYR E 217 N ILE E 205 SHEET 1 D 3 GLN I 47 PRO I 52 0 SHEET 2 D 3 ARG I 65 VAL I 70 1 O LEU I 68 N ILE I 49 SHEET 3 D 3 ARG I 81 VAL I 82 -1 O ARG I 81 N ARG I 67 LINK CA CA E1001 O LEU E 75 1555 1555 2.33 LINK CA CA E1001 O VAL E 81 1555 1555 2.38 LINK CA CA E1001 NE2 GLN E 2 1555 1555 2.36 LINK CA CA E1001 OD1 ASP E 41 1555 1555 2.30 LINK CA CA E1001 OD2 ASP E 41 1555 1555 2.39 LINK CA CA E1001 OD1 ASN E 77 1555 1555 2.55 LINK CA CA E1001 O ILE E 79 1555 1555 2.48 LINK O GLY E 169 NA NA E1002 1555 1555 2.74 LINK O TYR E 171 NA NA E1002 1555 1555 2.88 LINK O VAL E 174 NA NA E1002 1555 1555 2.68 LINK OD2 ASP E 197 NA NA E1002 1555 1555 2.67 LINK NA NA E1002 O HOH E1069 1555 1555 2.64 CISPEP 1 TYR E 167 PRO E 168 0 3.91 SITE 1 AC1 6 GLN E 2 ASP E 41 LEU E 75 ASN E 77 SITE 2 AC1 6 ILE E 79 VAL E 81 SITE 1 AC2 6 GLY E 169 TYR E 171 VAL E 174 GLU E 195 SITE 2 AC2 6 ASP E 197 HOH E1069 CRYST1 115.381 115.381 42.907 90.00 90.00 120.00 P 61 6 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 0.008667 0.005004 0.000000 0.00000 SCALE2 0.000000 0.010008 0.000000 0.00000 SCALE3 0.000000 0.000000 0.023306 0.00000 ATOM 1 N ALA E 1 10.364 19.207 29.593 1.00 36.17 N ATOM 2 CA ALA E 1 10.758 18.741 28.206 1.00 34.96 C ATOM 3 C ALA E 1 10.937 19.945 27.253 1.00 34.64 C ATOM 4 O ALA E 1 10.340 21.012 27.482 1.00 35.24 O ATOM 5 CB ALA E 1 9.700 17.797 27.670 1.00 35.29 C ATOM 6 N GLN E 2 11.741 19.777 26.203 1.00 33.68 N ATOM 7 CA GLN E 2 11.881 20.796 25.124 1.00 32.76 C ATOM 8 C GLN E 2 10.804 20.597 24.042 1.00 31.98 C ATOM 9 O GLN E 2 10.611 19.483 23.599 1.00 32.22 O ATOM 10 CB GLN E 2 13.267 20.715 24.458 1.00 31.80 C ATOM 11 CG GLN E 2 13.494 21.734 23.269 1.00 30.09 C ATOM 12 CD GLN E 2 14.938 21.824 22.884 1.00 27.13 C ATOM 13 OE1 GLN E 2 15.406 21.076 22.002 1.00 28.50 O ATOM 14 NE2 GLN E 2 15.684 22.703 23.580 1.00 21.64 N ATOM 15 N SER E 3 10.139 21.692 23.636 1.00 30.30 N ATOM 16 CA SER E 3 9.139 21.748 22.549 1.00 29.21 C ATOM 17 C SER E 3 9.767 22.465 21.325 1.00 28.04 C ATOM 18 O SER E 3 10.526 23.424 21.531 1.00 26.96 O ATOM 19 CB SER E 3 7.973 22.625 23.034 1.00 28.59 C ATOM 20 OG ASER E 3 7.490 22.179 24.298 0.33 30.31 O ATOM 21 OG BSER E 3 6.710 22.246 22.483 0.67 31.51 O ATOM 22 N VAL E 4 9.488 22.011 20.088 1.00 25.55 N ATOM 23 CA VAL E 4 9.919 22.756 18.882 1.00 24.10 C ATOM 24 C VAL E 4 8.693 23.600 18.429 1.00 23.74 C ATOM 25 O VAL E 4 7.660 23.068 18.044 1.00 23.70 O ATOM 26 CB VAL E 4 10.426 21.823 17.757 1.00 24.62 C ATOM 27 CG1 VAL E 4 10.915 22.638 16.525 1.00 23.69 C ATOM 28 CG2 VAL E 4 11.597 20.866 18.239 1.00 25.84 C ATOM 29 N PRO E 5 8.772 24.916 18.521 1.00 21.62 N ATOM 30 CA PRO E 5 7.648 25.757 18.093 1.00 20.88 C ATOM 31 C PRO E 5 7.382 25.519 16.591 1.00 20.21 C ATOM 32 O PRO E 5 8.348 25.171 15.908 1.00 18.13 O ATOM 33 CB PRO E 5 8.162 27.191 18.364 1.00 21.73 C ATOM 34 CG PRO E 5 9.266 27.015 19.420 1.00 21.71 C ATOM 35 CD PRO E 5 9.924 25.697 19.029 1.00 22.12 C ATOM 36 N TYR E 6 6.122 25.619 16.132 1.00 18.54 N ATOM 37 CA TYR E 6 5.731 25.135 14.810 1.00 19.74 C ATOM 38 C TYR E 6 6.423 25.920 13.696 1.00 19.39 C ATOM 39 O TYR E 6 6.627 25.391 12.589 1.00 20.62 O ATOM 40 CB TYR E 6 4.182 25.229 14.627 1.00 20.89 C ATOM 41 CG TYR E 6 3.684 26.616 14.253 1.00 22.05 C ATOM 42 CD1 TYR E 6 3.713 27.066 12.910 1.00 22.85 C ATOM 43 CD2 TYR E 6 3.175 27.489 15.223 1.00 23.58 C ATOM 44 CE1 TYR E 6 3.260 28.361 12.561 1.00 22.19 C ATOM 45 CE2 TYR E 6 2.724 28.790 14.877 1.00 19.58 C ATOM 46 CZ TYR E 6 2.770 29.209 13.537 1.00 22.60 C ATOM 47 OH TYR E 6 2.312 30.489 13.169 1.00 26.07 O ATOM 48 N GLY E 7 6.683 27.208 13.953 1.00 19.43 N ATOM 49 CA GLY E 7 7.346 28.072 12.985 1.00 19.70 C ATOM 50 C GLY E 7 8.748 27.622 12.596 1.00 19.86 C ATOM 51 O GLY E 7 9.113 27.691 11.410 1.00 18.61 O ATOM 52 N VAL E 8 9.501 27.127 13.575 1.00 18.31 N ATOM 53 CA VAL E 8 10.850 26.580 13.333 1.00 18.79 C ATOM 54 C VAL E 8 10.804 25.366 12.362 1.00 19.54 C ATOM 55 O VAL E 8 11.590 25.317 11.407 1.00 18.80 O ATOM 56 CB VAL E 8 11.576 26.201 14.663 1.00 17.43 C ATOM 57 CG1 VAL E 8 12.958 25.529 14.395 1.00 17.48 C ATOM 58 CG2 VAL E 8 11.695 27.399 15.613 1.00 18.77 C ATOM 59 N SER E 9 9.854 24.430 12.543 1.00 21.17 N ATOM 60 CA SER E 9 9.674 23.344 11.551 1.00 22.68 C ATOM 61 C SER E 9 9.033 23.734 10.170 1.00 22.82 C ATOM 62 O SER E 9 9.369 23.152 9.091 1.00 23.18 O ATOM 63 CB SER E 9 8.982 22.120 12.196 1.00 24.74 C ATOM 64 OG SER E 9 7.746 22.439 12.804 1.00 28.37 O ATOM 65 N GLN E 10 8.157 24.739 10.186 1.00 22.24 N ATOM 66 CA GLN E 10 7.499 25.231 8.967 1.00 22.01 C ATOM 67 C GLN E 10 8.514 25.772 7.975 1.00 21.18 C ATOM 68 O GLN E 10 8.308 25.668 6.752 1.00 20.16 O ATOM 69 CB GLN E 10 6.455 26.317 9.325 1.00 22.88 C ATOM 70 CG GLN E 10 5.482 26.748 8.202 1.00 22.82 C ATOM 71 CD GLN E 10 4.343 27.627 8.738 1.00 28.45 C ATOM 72 OE1 GLN E 10 3.988 27.520 9.917 1.00 32.07 O ATOM 73 NE2 GLN E 10 3.772 28.498 7.887 1.00 25.16 N ATOM 74 N ILE E 11 9.582 26.411 8.493 1.00 20.30 N ATOM 75 CA ILE E 11 10.637 26.923 7.613 1.00 19.83 C ATOM 76 C ILE E 11 11.657 25.865 7.265 1.00 20.82 C ATOM 77 O ILE E 11 12.535 26.115 6.456 1.00 21.63 O ATOM 78 CB ILE E 11 11.315 28.234 8.143 1.00 19.89 C ATOM 79 CG1 ILE E 11 12.108 27.992 9.466 1.00 18.43 C ATOM 80 CG2 ILE E 11 10.222 29.381 8.199 1.00 19.31 C ATOM 81 CD1 ILE E 11 12.983 29.273 9.952 1.00 16.65 C ATOM 82 N LYS E 12 11.494 24.666 7.828 1.00 21.27 N ATOM 83 CA LYS E 12 12.447 23.551 7.649 1.00 22.06 C ATOM 84 C LYS E 12 13.825 23.702 8.265 1.00 21.29 C ATOM 85 O LYS E 12 14.735 23.073 7.799 1.00 22.63 O ATOM 86 CB LYS E 12 12.634 23.186 6.135 1.00 22.75 C ATOM 87 CG LYS E 12 11.411 23.389 5.333 1.00 25.13 C ATOM 88 CD LYS E 12 10.531 22.210 5.410 1.00 29.59 C ATOM 89 CE LYS E 12 10.046 21.911 4.014 1.00 34.44 C ATOM 90 NZ LYS E 12 8.558 21.775 4.007 1.00 34.70 N ATOM 91 N ALA E 13 13.991 24.475 9.329 1.00 21.44 N ATOM 92 CA ALA E 13 15.269 24.482 10.056 1.00 22.25 C ATOM 93 C ALA E 13 15.750 23.085 10.568 1.00 22.92 C ATOM 94 O ALA E 13 16.917 22.825 10.518 1.00 22.02 O ATOM 95 CB ALA E 13 15.266 25.501 11.195 1.00 21.92 C ATOM 96 N PRO E 14 14.882 22.169 11.004 1.00 24.42 N ATOM 97 CA PRO E 14 15.379 20.849 11.491 1.00 24.43 C ATOM 98 C PRO E 14 16.199 19.994 10.503 1.00 23.90 C ATOM 99 O PRO E 14 17.147 19.322 10.922 1.00 22.26 O ATOM 100 CB PRO E 14 14.108 20.130 11.895 1.00 26.18 C ATOM 101 CG PRO E 14 13.171 21.344 12.275 1.00 26.28 C ATOM 102 CD PRO E 14 13.416 22.270 11.107 1.00 23.22 C ATOM 103 N ALA E 15 15.880 20.055 9.223 1.00 24.04 N ATOM 104 CA ALA E 15 16.700 19.385 8.226 1.00 23.54 C ATOM 105 C ALA E 15 18.172 19.863 8.257 1.00 23.44 C ATOM 106 O ALA E 15 19.100 19.069 8.047 1.00 23.88 O ATOM 107 CB ALA E 15 16.091 19.566 6.829 1.00 24.88 C ATOM 108 N LEU E 16 18.404 21.137 8.563 1.00 22.49 N ATOM 109 CA LEU E 16 19.780 21.644 8.680 1.00 22.97 C ATOM 110 C LEU E 16 20.442 21.253 9.988 1.00 23.63 C ATOM 111 O LEU E 16 21.667 20.990 10.025 1.00 25.18 O ATOM 112 CB LEU E 16 19.828 23.184 8.519 1.00 23.03 C ATOM 113 CG ALEU E 16 19.671 23.356 6.990 0.50 22.77 C ATOM 114 CG BLEU E 16 19.939 23.917 7.177 0.50 21.68 C ATOM 115 CD1ALEU E 16 19.505 24.804 6.588 0.50 17.77 C ATOM 116 CD1BLEU E 16 21.394 23.881 6.650 0.50 16.92 C ATOM 117 CD2ALEU E 16 20.882 22.741 6.314 0.50 22.42 C ATOM 118 CD2BLEU E 16 18.918 23.311 6.229 0.50 13.74 C ATOM 119 N HIS E 17 19.654 21.204 11.063 1.00 23.40 N ATOM 120 CA HIS E 17 20.213 20.817 12.355 1.00 23.85 C ATOM 121 C HIS E 17 20.685 19.348 12.248 1.00 26.58 C ATOM 122 O HIS E 17 21.678 18.965 12.897 1.00 26.68 O ATOM 123 CB HIS E 17 19.165 20.937 13.446 1.00 23.25 C ATOM 124 CG HIS E 17 18.660 22.333 13.662 1.00 22.33 C ATOM 125 ND1 HIS E 17 17.497 22.590 14.337 1.00 21.64 N ATOM 126 CD2 HIS E 17 19.134 23.542 13.263 1.00 21.97 C ATOM 127 CE1 HIS E 17 17.273 23.893 14.360 1.00 22.15 C ATOM 128 NE2 HIS E 17 18.246 24.494 13.713 1.00 20.46 N ATOM 129 N SER E 18 19.990 18.564 11.397 1.00 27.41 N ATOM 130 CA SER E 18 20.284 17.125 11.251 1.00 29.06 C ATOM 131 C SER E 18 21.590 16.847 10.535 1.00 30.61 C ATOM 132 O SER E 18 22.178 15.773 10.744 1.00 31.84 O ATOM 133 CB SER E 18 19.085 16.322 10.705 1.00 27.40 C ATOM 134 OG ASER E 18 18.920 16.536 9.338 0.67 31.70 O ATOM 135 OG BSER E 18 17.977 16.383 11.583 0.33 25.48 O ATOM 136 N GLN E 19 22.095 17.815 9.743 1.00 32.03 N ATOM 137 CA GLN E 19 23.498 17.731 9.240 1.00 32.03 C ATOM 138 C GLN E 19 24.545 18.471 10.031 1.00 31.35 C ATOM 139 O GLN E 19 25.682 18.633 9.575 1.00 32.58 O ATOM 140 CB GLN E 19 23.660 18.105 7.763 1.00 32.20 C ATOM 141 CG GLN E 19 22.380 18.250 6.967 1.00 35.44 C ATOM 142 CD GLN E 19 22.690 18.677 5.541 1.00 40.18 C ATOM 143 OE1 GLN E 19 23.523 18.041 4.874 1.00 45.88 O ATOM 144 NE2 GLN E 19 22.055 19.747 5.071 1.00 41.60 N ATOM 145 N GLY E 20 24.219 18.889 11.237 1.00 31.09 N ATOM 146 CA GLY E 20 25.224 19.554 12.038 1.00 31.43 C ATOM 147 C GLY E 20 25.300 21.057 11.781 1.00 30.83 C ATOM 148 O GLY E 20 26.222 21.713 12.266 1.00 31.54 O ATOM 149 N TYR E 21 24.321 21.629 11.069 1.00 30.43 N ATOM 150 CA TYR E 21 24.341 23.098 10.832 1.00 27.70 C ATOM 151 C TYR E 21 23.334 23.817 11.700 1.00 27.52 C ATOM 152 O TYR E 21 22.121 23.660 11.517 1.00 27.23 O ATOM 153 CB TYR E 21 24.131 23.402 9.369 1.00 27.61 C ATOM 154 CG TYR E 21 25.172 22.781 8.454 1.00 28.75 C ATOM 155 CD1 TYR E 21 26.532 23.107 8.572 1.00 30.61 C ATOM 156 CD2 TYR E 21 24.791 21.870 7.465 1.00 30.35 C ATOM 157 CE1 TYR E 21 27.512 22.503 7.704 1.00 33.98 C ATOM 158 CE2 TYR E 21 25.733 21.285 6.590 1.00 31.85 C ATOM 159 CZ TYR E 21 27.079 21.606 6.712 1.00 34.00 C ATOM 160 OH TYR E 21 27.976 21.015 5.836 1.00 38.25 O ATOM 161 N THR E 22 23.846 24.593 12.663 1.00 27.05 N ATOM 162 CA THR E 22 23.030 25.230 13.716 1.00 26.47 C ATOM 163 C THR E 22 23.352 26.726 14.004 1.00 25.28 C ATOM 164 O THR E 22 22.858 27.278 14.968 1.00 23.59 O ATOM 165 CB THR E 22 23.171 24.413 15.011 1.00 27.35 C ATOM 166 OG1 THR E 22 24.568 24.302 15.334 1.00 27.94 O ATOM 167 CG2 THR E 22 22.737 22.939 14.787 1.00 29.25 C ATOM 168 N GLY E 23 24.178 27.365 13.169 1.00 25.26 N ATOM 169 CA GLY E 23 24.583 28.769 13.381 1.00 25.17 C ATOM 170 C GLY E 23 25.940 28.988 14.050 1.00 24.67 C ATOM 171 O GLY E 23 26.295 30.154 14.345 1.00 24.19 O ATOM 172 N SER E 24 26.716 27.913 14.277 1.00 23.21 N ATOM 173 CA SER E 24 27.930 28.035 15.143 1.00 24.20 C ATOM 174 C SER E 24 28.814 29.159 14.625 1.00 22.55 C ATOM 175 O SER E 24 29.069 29.231 13.440 1.00 23.23 O ATOM 176 CB SER E 24 28.757 26.711 15.241 1.00 24.97 C ATOM 177 OG ASER E 24 28.946 26.259 16.589 0.50 25.77 O ATOM 178 OG BSER E 24 29.957 26.972 15.996 0.50 25.89 O ATOM 179 N ASN E 25 29.212 30.059 15.502 1.00 23.99 N ATOM 180 CA ASN E 25 30.163 31.152 15.215 1.00 24.94 C ATOM 181 C ASN E 25 29.583 32.306 14.352 1.00 24.20 C ATOM 182 O ASN E 25 30.296 33.279 14.058 1.00 25.27 O ATOM 183 CB ASN E 25 31.502 30.641 14.629 1.00 26.80 C ATOM 184 CG ASN E 25 32.428 29.992 15.683 1.00 30.66 C ATOM 185 OD1 ASN E 25 32.035 29.099 16.465 1.00 36.73 O ATOM 186 ND2 ASN E 25 33.667 30.455 15.711 1.00 35.70 N ATOM 187 N VAL E 26 28.301 32.232 13.988 1.00 22.43 N ATOM 188 CA VAL E 26 27.671 33.324 13.227 1.00 21.16 C ATOM 189 C VAL E 26 27.110 34.307 14.216 1.00 19.49 C ATOM 190 O VAL E 26 26.397 33.906 15.114 1.00 20.31 O ATOM 191 CB VAL E 26 26.592 32.842 12.202 1.00 20.99 C ATOM 192 CG1 VAL E 26 25.890 34.052 11.500 1.00 21.25 C ATOM 193 CG2 VAL E 26 27.221 31.872 11.222 1.00 19.96 C ATOM 194 N LYS E 27 27.457 35.582 14.036 1.00 17.71 N ATOM 195 CA LYS E 27 27.148 36.663 14.968 1.00 17.40 C ATOM 196 C LYS E 27 25.885 37.396 14.531 1.00 17.06 C ATOM 197 O LYS E 27 25.783 37.896 13.382 1.00 17.48 O ATOM 198 CB LYS E 27 28.323 37.641 15.055 1.00 18.02 C ATOM 199 CG LYS E 27 29.670 36.976 15.463 1.00 20.61 C ATOM 200 CD LYS E 27 30.674 38.053 16.096 1.00 26.00 C ATOM 201 CE LYS E 27 31.591 38.734 15.067 1.00 26.79 C ATOM 202 NZ LYS E 27 31.608 38.053 13.677 1.00 30.66 N ATOM 203 N VAL E 28 24.888 37.368 15.404 1.00 16.52 N ATOM 204 CA VAL E 28 23.559 37.932 15.131 1.00 16.95 C ATOM 205 C VAL E 28 23.260 39.041 16.126 1.00 17.63 C ATOM 206 O VAL E 28 23.215 38.815 17.354 1.00 18.46 O ATOM 207 CB VAL E 28 22.445 36.848 15.171 1.00 16.79 C ATOM 208 CG1 VAL E 28 21.083 37.438 14.750 1.00 17.28 C ATOM 209 CG2 VAL E 28 22.770 35.700 14.218 1.00 16.75 C ATOM 210 N ALA E 29 23.121 40.253 15.617 1.00 18.29 N ATOM 211 CA ALA E 29 22.728 41.360 16.505 1.00 17.68 C ATOM 212 C ALA E 29 21.184 41.467 16.471 1.00 17.64 C ATOM 213 O ALA E 29 20.571 41.656 15.423 1.00 14.55 O ATOM 214 CB ALA E 29 23.396 42.698 16.107 1.00 17.43 C ATOM 215 N VAL E 30 20.580 41.380 17.655 1.00 16.25 N ATOM 216 CA VAL E 30 19.150 41.642 17.792 1.00 16.86 C ATOM 217 C VAL E 30 19.032 43.091 18.289 1.00 16.94 C ATOM 218 O VAL E 30 19.319 43.383 19.473 1.00 17.71 O ATOM 219 CB VAL E 30 18.526 40.691 18.842 1.00 17.88 C ATOM 220 CG1 VAL E 30 17.001 41.012 19.022 1.00 17.33 C ATOM 221 CG2 VAL E 30 18.755 39.147 18.426 1.00 16.52 C ATOM 222 N ILE E 31 18.669 43.988 17.388 1.00 16.48 N ATOM 223 CA ILE E 31 18.582 45.402 17.682 1.00 17.19 C ATOM 224 C ILE E 31 17.145 45.655 18.131 1.00 18.37 C ATOM 225 O ILE E 31 16.218 45.588 17.284 1.00 17.22 O ATOM 226 CB ILE E 31 18.892 46.219 16.402 1.00 17.68 C ATOM 227 CG1 ILE E 31 20.360 45.937 15.973 1.00 19.41 C ATOM 228 CG2 ILE E 31 18.726 47.783 16.683 1.00 16.19 C ATOM 229 CD1 ILE E 31 20.793 46.807 14.783 1.00 18.66 C ATOM 230 N ASP E 32 16.977 45.908 19.443 1.00 17.32 N ATOM 231 CA ASP E 32 15.669 45.779 20.088 1.00 18.67 C ATOM 232 C ASP E 32 15.708 46.358 21.537 1.00 18.31 C ATOM 233 O ASP E 32 16.479 47.301 21.835 1.00 17.86 O ATOM 234 CB ASP E 32 15.317 44.267 20.115 1.00 18.55 C ATOM 235 CG ASP E 32 13.845 44.000 19.892 1.00 24.77 C ATOM 236 OD1 ASP E 32 13.015 44.427 20.743 1.00 22.56 O ATOM 237 OD2 ASP E 32 13.410 43.443 18.851 1.00 25.57 O ATOM 238 N SER E 33 14.910 45.779 22.435 1.00 18.78 N ATOM 239 CA SER E 33 14.718 46.269 23.851 1.00 20.86 C ATOM 240 C SER E 33 15.654 45.650 24.851 1.00 20.42 C ATOM 241 O SER E 33 15.505 45.818 26.100 1.00 22.21 O ATOM 242 CB SER E 33 13.238 46.032 24.340 1.00 21.53 C ATOM 243 OG SER E 33 13.041 44.666 24.778 1.00 23.51 O ATOM 244 N GLY E 34 16.615 44.900 24.328 1.00 20.91 N ATOM 245 CA GLY E 34 17.574 44.175 25.111 1.00 20.87 C ATOM 246 C GLY E 34 17.247 42.711 25.140 1.00 21.58 C ATOM 247 O GLY E 34 16.208 42.313 24.604 1.00 21.97 O ATOM 248 N ILE E 35 18.097 41.914 25.796 1.00 20.24 N ATOM 249 CA ILE E 35 17.843 40.471 25.957 1.00 19.65 C ATOM 250 C ILE E 35 18.137 40.071 27.403 1.00 20.80 C ATOM 251 O ILE E 35 19.202 40.388 27.920 1.00 21.45 O ATOM 252 CB ILE E 35 18.767 39.573 25.018 1.00 19.22 C ATOM 253 CG1 ILE E 35 18.663 39.921 23.535 1.00 15.95 C ATOM 254 CG2 ILE E 35 18.442 38.048 25.222 1.00 18.98 C ATOM 255 CD1 ILE E 35 19.869 39.310 22.619 1.00 21.42 C ATOM 256 N ASP E 36 17.232 39.321 28.031 1.00 21.88 N ATOM 257 CA ASP E 36 17.486 38.740 29.361 1.00 21.56 C ATOM 258 C ASP E 36 18.533 37.618 29.362 1.00 22.07 C ATOM 259 O ASP E 36 18.242 36.417 29.181 1.00 21.02 O ATOM 260 CB ASP E 36 16.171 38.307 29.993 1.00 23.32 C ATOM 261 CG ASP E 36 16.350 37.739 31.404 1.00 24.66 C ATOM 262 OD1 ASP E 36 17.419 37.953 32.019 1.00 22.85 O ATOM 263 OD2 ASP E 36 15.505 36.981 31.888 1.00 28.57 O ATOM 264 N SER E 37 19.784 38.010 29.568 1.00 22.49 N ATOM 265 CA SER E 37 20.879 37.067 29.443 1.00 24.03 C ATOM 266 C SER E 37 20.890 35.942 30.504 1.00 24.59 C ATOM 267 O SER E 37 21.542 34.894 30.316 1.00 25.24 O ATOM 268 CB SER E 37 22.197 37.838 29.408 1.00 24.36 C ATOM 269 OG SER E 37 22.478 38.341 30.683 1.00 27.41 O ATOM 270 N SER E 38 20.155 36.135 31.598 1.00 23.63 N ATOM 271 CA SER E 38 20.099 35.092 32.630 1.00 24.96 C ATOM 272 C SER E 38 19.006 34.080 32.334 1.00 25.05 C ATOM 273 O SER E 38 18.844 33.130 33.103 1.00 24.53 O ATOM 274 CB SER E 38 19.898 35.650 34.062 1.00 24.48 C ATOM 275 OG SER E 38 18.654 36.303 34.134 1.00 25.09 O ATOM 276 N HIS E 39 18.280 34.249 31.214 1.00 23.64 N ATOM 277 CA HIS E 39 17.398 33.146 30.771 1.00 22.57 C ATOM 278 C HIS E 39 18.102 31.798 30.627 1.00 23.07 C ATOM 279 O HIS E 39 19.083 31.668 29.878 1.00 23.41 O ATOM 280 CB HIS E 39 16.628 33.485 29.485 1.00 21.51 C ATOM 281 CG HIS E 39 15.309 32.784 29.383 1.00 16.58 C ATOM 282 ND1 HIS E 39 15.214 31.429 29.168 1.00 16.13 N ATOM 283 CD2 HIS E 39 14.042 33.239 29.479 1.00 15.97 C ATOM 284 CE1 HIS E 39 13.942 31.078 29.127 1.00 16.17 C ATOM 285 NE2 HIS E 39 13.212 32.151 29.343 1.00 15.67 N ATOM 286 N PRO E 40 17.613 30.759 31.322 1.00 24.40 N ATOM 287 CA PRO E 40 18.194 29.402 31.163 1.00 25.39 C ATOM 288 C PRO E 40 18.224 28.843 29.714 1.00 23.55 C ATOM 289 O PRO E 40 19.124 28.051 29.420 1.00 23.43 O ATOM 290 CB PRO E 40 17.328 28.510 32.081 1.00 25.54 C ATOM 291 CG PRO E 40 16.739 29.444 33.074 1.00 27.43 C ATOM 292 CD PRO E 40 16.528 30.775 32.330 1.00 25.75 C ATOM 293 N ASP E 41 17.285 29.245 28.857 1.00 22.77 N ATOM 294 CA ASP E 41 17.276 28.779 27.454 1.00 22.05 C ATOM 295 C ASP E 41 17.934 29.742 26.439 1.00 22.67 C ATOM 296 O ASP E 41 17.735 29.577 25.209 1.00 22.11 O ATOM 297 CB ASP E 41 15.832 28.343 27.017 1.00 22.21 C ATOM 298 CG ASP E 41 15.860 27.134 26.091 1.00 24.67 C ATOM 299 OD1 ASP E 41 14.888 26.813 25.323 1.00 23.85 O ATOM 300 OD2 ASP E 41 16.865 26.424 26.055 1.00 24.15 O ATOM 301 N LEU E 42 18.736 30.716 26.934 1.00 22.83 N ATOM 302 CA LEU E 42 19.519 31.642 26.066 1.00 22.94 C ATOM 303 C LEU E 42 20.996 31.733 26.437 1.00 22.73 C ATOM 304 O LEU E 42 21.313 31.776 27.639 1.00 23.45 O ATOM 305 CB LEU E 42 18.950 33.075 26.134 1.00 22.10 C ATOM 306 CG LEU E 42 17.510 33.310 25.739 1.00 21.84 C ATOM 307 CD1 LEU E 42 17.172 34.812 25.881 1.00 22.77 C ATOM 308 CD2 LEU E 42 17.216 32.771 24.315 1.00 24.67 C ATOM 309 N LYS E 43 21.885 31.840 25.430 1.00 22.15 N ATOM 310 CA LYS E 43 23.289 32.300 25.675 1.00 21.64 C ATOM 311 C LYS E 43 23.631 33.615 24.894 1.00 21.18 C ATOM 312 O LYS E 43 23.656 33.630 23.665 1.00 22.39 O ATOM 313 CB LYS E 43 24.290 31.165 25.343 1.00 22.90 C ATOM 314 CG LYS E 43 25.743 31.401 25.833 1.00 24.54 C ATOM 315 CD LYS E 43 26.759 30.620 24.976 1.00 32.67 C ATOM 316 CE LYS E 43 28.234 30.884 25.448 1.00 38.58 C ATOM 317 NZ LYS E 43 29.208 29.806 25.033 1.00 40.29 N ATOM 318 N VAL E 44 23.881 34.707 25.598 1.00 20.14 N ATOM 319 CA VAL E 44 24.161 36.035 24.995 1.00 18.98 C ATOM 320 C VAL E 44 25.696 36.217 25.031 1.00 19.85 C ATOM 321 O VAL E 44 26.313 36.063 26.096 1.00 18.99 O ATOM 322 CB VAL E 44 23.394 37.174 25.782 1.00 18.25 C ATOM 323 CG1 VAL E 44 23.738 38.590 25.294 1.00 20.14 C ATOM 324 CG2 VAL E 44 21.874 36.930 25.661 1.00 18.76 C ATOM 325 N ALA E 45 26.305 36.524 23.889 1.00 18.37 N ATOM 326 CA ALA E 45 27.761 36.621 23.746 1.00 18.55 C ATOM 327 C ALA E 45 28.298 38.044 23.963 1.00 19.50 C ATOM 328 O ALA E 45 29.490 38.207 24.136 1.00 20.33 O ATOM 329 CB ALA E 45 28.214 36.141 22.271 1.00 21.18 C ATOM 330 N GLY E 46 27.470 39.085 23.910 1.00 18.69 N ATOM 331 CA GLY E 46 28.005 40.433 24.141 1.00 18.99 C ATOM 332 C GLY E 46 26.899 41.425 23.874 1.00 19.35 C ATOM 333 O GLY E 46 25.744 41.009 23.705 1.00 16.86 O ATOM 334 N GLY E 47 27.227 42.725 23.834 1.00 18.94 N ATOM 335 CA GLY E 47 26.161 43.687 23.597 1.00 20.87 C ATOM 336 C GLY E 47 26.517 45.069 24.016 1.00 20.32 C ATOM 337 O GLY E 47 27.578 45.250 24.524 1.00 21.38 O ATOM 338 N ALA E 48 25.652 46.036 23.736 1.00 20.00 N ATOM 339 CA ALA E 48 25.818 47.406 24.213 1.00 20.02 C ATOM 340 C ALA E 48 24.448 48.051 24.210 1.00 20.84 C ATOM 341 O ALA E 48 23.650 47.767 23.346 1.00 18.90 O ATOM 342 CB ALA E 48 26.786 48.238 23.306 1.00 18.61 C ATOM 343 N SER E 49 24.206 48.938 25.180 1.00 22.15 N ATOM 344 CA SER E 49 23.013 49.780 25.175 1.00 23.16 C ATOM 345 C SER E 49 23.243 51.226 24.657 1.00 24.50 C ATOM 346 O SER E 49 24.137 51.973 25.149 1.00 24.34 O ATOM 347 CB SER E 49 22.375 49.801 26.559 1.00 22.56 C ATOM 348 OG SER E 49 21.295 50.718 26.574 1.00 23.78 O ATOM 349 N MET E 50 22.415 51.597 23.676 1.00 24.16 N ATOM 350 CA MET E 50 22.309 52.958 23.124 1.00 25.93 C ATOM 351 C MET E 50 21.225 53.834 23.818 1.00 26.41 C ATOM 352 O MET E 50 20.978 54.977 23.425 1.00 26.81 O ATOM 353 CB MET E 50 22.051 52.872 21.585 1.00 24.64 C ATOM 354 CG MET E 50 22.887 51.772 20.895 1.00 28.55 C ATOM 355 SD MET E 50 24.626 52.417 20.873 1.00 34.24 S ATOM 356 CE MET E 50 25.526 51.000 21.425 1.00 30.75 C ATOM 357 N VAL E 51 20.566 53.300 24.834 1.00 27.58 N ATOM 358 CA VAL E 51 19.397 53.985 25.415 1.00 27.99 C ATOM 359 C VAL E 51 19.999 54.710 26.620 1.00 29.30 C ATOM 360 O VAL E 51 20.428 54.046 27.533 1.00 30.23 O ATOM 361 CB VAL E 51 18.293 52.967 25.907 1.00 27.62 C ATOM 362 CG1 VAL E 51 17.153 53.711 26.639 1.00 27.12 C ATOM 363 CG2 VAL E 51 17.723 52.133 24.770 1.00 22.28 C ATOM 364 N PRO E 52 20.091 56.045 26.599 1.00 31.10 N ATOM 365 CA PRO E 52 20.773 56.798 27.682 1.00 32.39 C ATOM 366 C PRO E 52 20.369 56.507 29.131 1.00 33.72 C ATOM 367 O PRO E 52 21.247 56.534 30.010 1.00 33.74 O ATOM 368 CB PRO E 52 20.491 58.256 27.331 1.00 32.77 C ATOM 369 CG PRO E 52 20.425 58.239 25.806 1.00 33.66 C ATOM 370 CD PRO E 52 19.618 56.931 25.515 1.00 30.41 C ATOM 371 N SER E 53 19.091 56.247 29.419 1.00 34.46 N ATOM 372 CA SER E 53 18.749 55.957 30.844 1.00 35.43 C ATOM 373 C SER E 53 18.670 54.462 31.275 1.00 35.75 C ATOM 374 O SER E 53 18.538 54.149 32.496 1.00 36.72 O ATOM 375 CB SER E 53 17.518 56.752 31.291 1.00 34.94 C ATOM 376 OG SER E 53 16.313 56.267 30.707 1.00 38.05 O ATOM 377 N GLU E 54 18.802 53.548 30.297 1.00 33.86 N ATOM 378 CA GLU E 54 18.839 52.107 30.573 1.00 32.21 C ATOM 379 C GLU E 54 20.142 51.522 29.988 1.00 29.61 C ATOM 380 O GLU E 54 20.182 51.034 28.845 1.00 28.01 O ATOM 381 CB GLU E 54 17.574 51.408 30.011 1.00 33.07 C ATOM 382 CG GLU E 54 16.246 52.009 30.487 1.00 34.52 C ATOM 383 CD GLU E 54 14.993 51.221 30.043 1.00 38.48 C ATOM 384 OE1 GLU E 54 15.063 49.977 29.836 1.00 36.37 O ATOM 385 OE2 GLU E 54 13.913 51.861 29.897 1.00 39.23 O ATOM 386 N THR E 55 21.218 51.614 30.758 1.00 27.10 N ATOM 387 CA THR E 55 22.551 51.335 30.219 1.00 25.35 C ATOM 388 C THR E 55 22.962 49.841 30.179 1.00 24.34 C ATOM 389 O THR E 55 24.036 49.514 29.637 1.00 23.65 O ATOM 390 CB THR E 55 23.642 52.186 30.934 1.00 26.81 C ATOM 391 OG1 THR E 55 23.901 51.629 32.206 1.00 25.07 O ATOM 392 CG2 THR E 55 23.116 53.640 31.305 1.00 28.40 C ATOM 393 N ASN E 56 22.153 48.960 30.779 1.00 23.33 N ATOM 394 CA ASN E 56 22.352 47.482 30.726 1.00 22.10 C ATOM 395 C ASN E 56 21.587 46.790 29.572 1.00 21.70 C ATOM 396 O ASN E 56 20.347 46.607 29.699 1.00 22.80 O ATOM 397 CB ASN E 56 21.881 46.844 32.059 1.00 21.19 C ATOM 398 CG ASN E 56 22.308 45.395 32.208 1.00 25.23 C ATOM 399 OD1 ASN E 56 22.964 44.847 31.316 1.00 24.52 O ATOM 400 ND2 ASN E 56 21.999 44.767 33.383 1.00 26.38 N ATOM 401 N PRO E 57 22.262 46.343 28.502 1.00 21.26 N ATOM 402 CA PRO E 57 21.550 45.724 27.367 1.00 21.62 C ATOM 403 C PRO E 57 21.096 44.295 27.725 1.00 23.44 C ATOM 404 O PRO E 57 20.342 43.693 26.943 1.00 21.38 O ATOM 405 CB PRO E 57 22.627 45.642 26.269 1.00 20.56 C ATOM 406 CG PRO E 57 23.941 45.413 27.032 1.00 18.91 C ATOM 407 CD PRO E 57 23.726 46.387 28.247 1.00 21.18 C ATOM 408 N PHE E 58 21.552 43.797 28.888 1.00 24.09 N ATOM 409 CA PHE E 58 21.311 42.409 29.322 1.00 26.51 C ATOM 410 C PHE E 58 20.159 42.351 30.279 1.00 28.23 C ATOM 411 O PHE E 58 19.889 41.332 30.896 1.00 29.38 O ATOM 412 CB PHE E 58 22.556 41.725 29.928 1.00 25.68 C ATOM 413 CG PHE E 58 23.787 41.801 29.056 1.00 25.89 C ATOM 414 CD1 PHE E 58 23.746 41.379 27.712 1.00 26.85 C ATOM 415 CD2 PHE E 58 24.969 42.349 29.550 1.00 26.68 C ATOM 416 CE1 PHE E 58 24.884 41.444 26.903 1.00 25.98 C ATOM 417 CE2 PHE E 58 26.124 42.428 28.757 1.00 28.87 C ATOM 418 CZ PHE E 58 26.074 41.988 27.401 1.00 26.80 C ATOM 419 N GLN E 59 19.443 43.452 30.349 1.00 29.89 N ATOM 420 CA GLN E 59 18.243 43.519 31.137 1.00 31.65 C ATOM 421 C GLN E 59 17.145 44.008 30.208 1.00 30.87 C ATOM 422 O GLN E 59 17.283 45.063 29.615 1.00 32.12 O ATOM 423 CB GLN E 59 18.463 44.473 32.318 1.00 32.05 C ATOM 424 CG GLN E 59 17.204 45.133 32.863 1.00 38.80 C ATOM 425 CD GLN E 59 17.385 45.524 34.307 1.00 45.95 C ATOM 426 OE1 GLN E 59 18.533 45.656 34.780 1.00 49.16 O ATOM 427 NE2 GLN E 59 16.273 45.705 35.022 1.00 48.34 N ATOM 428 N ASP E 60 16.068 43.236 30.063 1.00 29.60 N ATOM 429 CA ASP E 60 15.046 43.591 29.095 1.00 30.14 C ATOM 430 C ASP E 60 13.722 43.972 29.797 1.00 30.99 C ATOM 431 O ASP E 60 12.941 43.122 30.130 1.00 31.65 O ATOM 432 CB ASP E 60 14.867 42.416 28.102 1.00 28.60 C ATOM 433 CG ASP E 60 13.604 42.510 27.267 1.00 26.04 C ATOM 434 OD1 ASP E 60 13.037 43.604 27.022 1.00 20.19 O ATOM 435 OD2 ASP E 60 13.122 41.482 26.779 1.00 24.71 O ATOM 436 N ASN E 61 13.485 45.252 29.999 1.00 32.05 N ATOM 437 CA ASN E 61 12.363 45.674 30.851 1.00 33.98 C ATOM 438 C ASN E 61 11.017 45.660 30.114 1.00 33.19 C ATOM 439 O ASN E 61 9.961 45.800 30.723 1.00 34.26 O ATOM 440 CB ASN E 61 12.663 47.041 31.486 1.00 34.18 C ATOM 441 CG ASN E 61 13.771 46.950 32.544 1.00 37.14 C ATOM 442 OD1 ASN E 61 13.725 46.078 33.427 1.00 41.95 O ATOM 443 ND2 ASN E 61 14.793 47.809 32.426 1.00 36.01 N ATOM 444 N ASN E 62 11.088 45.457 28.809 1.00 31.04 N ATOM 445 CA ASN E 62 9.920 45.311 27.972 1.00 30.33 C ATOM 446 C ASN E 62 9.385 43.863 27.767 1.00 28.69 C ATOM 447 O ASN E 62 8.151 43.626 27.811 1.00 29.96 O ATOM 448 CB ASN E 62 10.185 45.973 26.619 1.00 30.13 C ATOM 449 CG ASN E 62 8.947 46.000 25.766 1.00 32.53 C ATOM 450 OD1 ASN E 62 8.667 45.034 25.062 1.00 32.39 O ATOM 451 ND2 ASN E 62 8.126 47.057 25.923 1.00 34.08 N ATOM 452 N SER E 63 10.299 42.925 27.497 1.00 26.02 N ATOM 453 CA SER E 63 10.002 41.530 27.159 1.00 24.62 C ATOM 454 C SER E 63 10.169 41.252 25.631 1.00 24.13 C ATOM 455 O SER E 63 10.532 40.143 25.246 1.00 24.40 O ATOM 456 CB SER E 63 8.614 41.081 27.661 1.00 25.75 C ATOM 457 OG SER E 63 7.667 41.069 26.589 1.00 32.45 O ATOM 458 N HIS E 64 10.005 42.263 24.799 1.00 20.57 N ATOM 459 CA HIS E 64 10.039 42.032 23.312 1.00 19.72 C ATOM 460 C HIS E 64 11.381 41.387 22.814 1.00 17.74 C ATOM 461 O HIS E 64 11.390 40.321 22.242 1.00 19.18 O ATOM 462 CB HIS E 64 9.793 43.350 22.610 1.00 18.44 C ATOM 463 CG HIS E 64 9.595 43.250 21.105 1.00 20.23 C ATOM 464 ND1 HIS E 64 10.604 43.536 20.200 1.00 17.32 N ATOM 465 CD2 HIS E 64 8.486 42.964 20.361 1.00 19.49 C ATOM 466 CE1 HIS E 64 10.122 43.443 18.964 1.00 18.62 C ATOM 467 NE2 HIS E 64 8.846 43.068 19.030 1.00 16.44 N ATOM 468 N GLY E 65 12.493 42.074 23.020 1.00 17.44 N ATOM 469 CA GLY E 65 13.838 41.605 22.658 1.00 17.16 C ATOM 470 C GLY E 65 14.177 40.167 22.985 1.00 17.44 C ATOM 471 O GLY E 65 14.729 39.451 22.166 1.00 18.30 O ATOM 472 N THR E 66 13.904 39.760 24.223 1.00 16.89 N ATOM 473 CA THR E 66 14.128 38.385 24.683 1.00 16.77 C ATOM 474 C THR E 66 13.322 37.349 23.866 1.00 16.39 C ATOM 475 O THR E 66 13.796 36.246 23.595 1.00 16.91 O ATOM 476 CB THR E 66 13.716 38.324 26.206 1.00 16.97 C ATOM 477 OG1 THR E 66 14.475 39.310 26.937 1.00 17.92 O ATOM 478 CG2 THR E 66 14.108 36.995 26.848 1.00 17.34 C ATOM 479 N HIS E 67 12.099 37.708 23.484 1.00 16.28 N ATOM 480 CA HIS E 67 11.201 36.796 22.746 1.00 15.77 C ATOM 481 C HIS E 67 11.736 36.653 21.292 1.00 15.34 C ATOM 482 O HIS E 67 11.883 35.543 20.799 1.00 14.77 O ATOM 483 CB HIS E 67 9.739 37.346 22.729 1.00 15.76 C ATOM 484 CG HIS E 67 8.731 36.363 22.201 1.00 15.55 C ATOM 485 ND1 HIS E 67 8.578 36.089 20.841 1.00 17.68 N ATOM 486 CD2 HIS E 67 7.861 35.548 22.856 1.00 14.84 C ATOM 487 CE1 HIS E 67 7.638 35.156 20.694 1.00 20.59 C ATOM 488 NE2 HIS E 67 7.196 34.805 21.903 1.00 16.14 N ATOM 489 N VAL E 68 12.180 37.767 20.718 1.00 14.94 N ATOM 490 CA VAL E 68 12.763 37.796 19.374 1.00 14.31 C ATOM 491 C VAL E 68 14.054 36.955 19.403 1.00 15.04 C ATOM 492 O VAL E 68 14.282 36.101 18.513 1.00 14.80 O ATOM 493 CB VAL E 68 13.026 39.298 18.892 1.00 16.28 C ATOM 494 CG1 VAL E 68 13.986 39.411 17.659 1.00 12.41 C ATOM 495 CG2 VAL E 68 11.689 40.094 18.607 1.00 14.41 C ATOM 496 N ALA E 69 14.851 37.119 20.469 1.00 15.96 N ATOM 497 CA ALA E 69 16.096 36.418 20.520 1.00 15.91 C ATOM 498 C ALA E 69 15.922 34.893 20.669 1.00 16.04 C ATOM 499 O ALA E 69 16.801 34.115 20.278 1.00 17.23 O ATOM 500 CB ALA E 69 16.983 36.972 21.589 1.00 14.46 C ATOM 501 N GLY E 70 14.855 34.470 21.290 1.00 16.70 N ATOM 502 CA GLY E 70 14.597 33.036 21.419 1.00 15.76 C ATOM 503 C GLY E 70 14.168 32.405 20.111 1.00 15.63 C ATOM 504 O GLY E 70 14.513 31.240 19.827 1.00 14.76 O ATOM 505 N THR E 71 13.484 33.175 19.263 1.00 15.19 N ATOM 506 CA THR E 71 13.181 32.658 17.903 1.00 15.04 C ATOM 507 C THR E 71 14.452 32.423 17.099 1.00 15.04 C ATOM 508 O THR E 71 14.645 31.351 16.475 1.00 16.93 O ATOM 509 CB THR E 71 12.190 33.542 17.222 1.00 14.19 C ATOM 510 OG1 THR E 71 10.954 33.461 17.944 1.00 20.29 O ATOM 511 CG2 THR E 71 11.826 33.057 15.760 1.00 12.63 C ATOM 512 N VAL E 72 15.390 33.369 17.193 1.00 15.11 N ATOM 513 CA VAL E 72 16.659 33.207 16.498 1.00 15.29 C ATOM 514 C VAL E 72 17.445 32.033 17.066 1.00 15.69 C ATOM 515 O VAL E 72 17.988 31.291 16.315 1.00 16.37 O ATOM 516 CB VAL E 72 17.563 34.441 16.654 1.00 15.56 C ATOM 517 CG1 VAL E 72 18.917 34.195 15.984 1.00 16.66 C ATOM 518 CG2 VAL E 72 16.878 35.767 16.146 1.00 12.13 C ATOM 519 N ALA E 73 17.564 31.917 18.390 1.00 13.30 N ATOM 520 CA ALA E 73 18.646 31.132 18.951 1.00 14.49 C ATOM 521 C ALA E 73 18.383 30.495 20.375 1.00 16.21 C ATOM 522 O ALA E 73 19.347 30.203 21.099 1.00 15.79 O ATOM 523 CB ALA E 73 20.003 31.964 18.960 1.00 12.95 C ATOM 524 N ALA E 74 17.135 30.160 20.713 1.00 16.52 N ATOM 525 CA ALA E 74 16.919 29.417 21.991 1.00 18.97 C ATOM 526 C ALA E 74 17.742 28.088 21.923 1.00 19.40 C ATOM 527 O ALA E 74 17.846 27.462 20.865 1.00 16.62 O ATOM 528 CB ALA E 74 15.437 29.164 22.257 1.00 18.86 C ATOM 529 N LEU E 75 18.419 27.745 23.017 1.00 20.02 N ATOM 530 CA LEU E 75 19.378 26.629 23.033 1.00 22.62 C ATOM 531 C LEU E 75 18.745 25.243 22.822 1.00 23.46 C ATOM 532 O LEU E 75 17.611 24.996 23.277 1.00 24.76 O ATOM 533 CB LEU E 75 20.187 26.646 24.351 1.00 22.35 C ATOM 534 CG LEU E 75 21.026 27.883 24.738 1.00 24.35 C ATOM 535 CD1 LEU E 75 21.470 27.782 26.269 1.00 26.79 C ATOM 536 CD2 LEU E 75 22.273 28.009 23.820 1.00 24.64 C ATOM 537 N ASN E 76 19.460 24.377 22.112 1.00 25.04 N ATOM 538 CA ASN E 76 19.081 22.962 21.980 1.00 27.51 C ATOM 539 C ASN E 76 19.522 22.174 23.232 1.00 28.89 C ATOM 540 O ASN E 76 20.723 21.901 23.411 1.00 28.85 O ATOM 541 CB ASN E 76 19.638 22.338 20.695 1.00 26.52 C ATOM 542 CG ASN E 76 19.069 20.910 20.400 1.00 28.73 C ATOM 543 OD1 ASN E 76 19.696 20.119 19.658 0.50 26.80 O ATOM 544 ND2 ASN E 76 17.923 20.591 20.968 0.50 22.37 N ATOM 545 N ASN E 77 18.548 21.898 24.104 1.00 30.01 N ATOM 546 CA ASN E 77 18.761 21.139 25.349 1.00 31.20 C ATOM 547 C ASN E 77 17.509 20.347 25.745 1.00 31.60 C ATOM 548 O ASN E 77 16.804 19.842 24.883 1.00 31.58 O ATOM 549 CB ASN E 77 19.220 22.088 26.467 1.00 30.78 C ATOM 550 CG ASN E 77 18.387 23.346 26.523 1.00 31.10 C ATOM 551 OD1 ASN E 77 17.217 23.299 26.176 1.00 30.28 O ATOM 552 ND2 ASN E 77 18.976 24.485 26.984 1.00 26.84 N ATOM 553 N SER E 78 17.192 20.297 27.045 1.00 33.45 N ATOM 554 CA SER E 78 16.081 19.492 27.535 1.00 33.10 C ATOM 555 C SER E 78 15.025 20.328 28.185 1.00 32.74 C ATOM 556 O SER E 78 14.152 19.766 28.879 1.00 32.28 O ATOM 557 CB SER E 78 16.580 18.419 28.516 1.00 34.07 C ATOM 558 OG ASER E 78 17.065 19.000 29.724 0.50 35.09 O ATOM 559 OG BSER E 78 17.183 17.332 27.823 0.50 34.26 O ATOM 560 N ILE E 79 15.107 21.658 27.986 1.00 30.49 N ATOM 561 CA ILE E 79 14.099 22.608 28.481 1.00 28.84 C ATOM 562 C ILE E 79 13.591 23.618 27.404 1.00 27.55 C ATOM 563 O ILE E 79 14.220 23.792 26.354 1.00 27.47 O ATOM 564 CB ILE E 79 14.608 23.419 29.752 1.00 29.73 C ATOM 565 CG1 ILE E 79 15.386 24.694 29.340 1.00 29.73 C ATOM 566 CG2 ILE E 79 15.343 22.529 30.762 1.00 31.94 C ATOM 567 CD1 ILE E 79 16.828 24.668 29.580 1.00 29.35 C ATOM 568 N GLY E 80 12.463 24.257 27.703 1.00 24.99 N ATOM 569 CA GLY E 80 11.875 25.332 26.917 1.00 24.33 C ATOM 570 C GLY E 80 11.646 25.099 25.426 1.00 23.28 C ATOM 571 O GLY E 80 10.930 24.150 25.049 1.00 22.66 O ATOM 572 N VAL E 81 12.193 25.995 24.597 1.00 21.37 N ATOM 573 CA VAL E 81 12.008 25.962 23.116 1.00 21.42 C ATOM 574 C VAL E 81 13.303 25.689 22.322 1.00 20.35 C ATOM 575 O VAL E 81 14.319 25.291 22.879 1.00 19.56 O ATOM 576 CB VAL E 81 11.251 27.244 22.612 1.00 22.58 C ATOM 577 CG1 VAL E 81 9.816 27.329 23.200 1.00 23.29 C ATOM 578 CG2 VAL E 81 12.030 28.510 22.962 1.00 21.62 C ATOM 579 N LEU E 82 13.264 25.862 21.007 1.00 19.79 N ATOM 580 CA LEU E 82 14.434 25.708 20.184 1.00 20.01 C ATOM 581 C LEU E 82 14.414 26.768 19.043 1.00 19.65 C ATOM 582 O LEU E 82 13.398 26.978 18.404 1.00 18.28 O ATOM 583 CB LEU E 82 14.457 24.270 19.586 1.00 21.64 C ATOM 584 CG LEU E 82 15.505 23.975 18.528 1.00 21.36 C ATOM 585 CD1 LEU E 82 16.858 23.736 19.198 1.00 22.51 C ATOM 586 CD2 LEU E 82 15.169 22.780 17.624 1.00 21.30 C ATOM 587 N GLY E 83 15.548 27.434 18.835 1.00 18.03 N ATOM 588 CA GLY E 83 15.656 28.535 17.934 1.00 16.27 C ATOM 589 C GLY E 83 15.865 27.937 16.545 1.00 15.89 C ATOM 590 O GLY E 83 16.157 26.717 16.334 1.00 15.76 O ATOM 591 N VAL E 84 15.714 28.800 15.584 1.00 14.70 N ATOM 592 CA VAL E 84 16.084 28.471 14.219 1.00 15.17 C ATOM 593 C VAL E 84 17.599 28.162 14.110 1.00 16.54 C ATOM 594 O VAL E 84 17.969 27.218 13.448 1.00 17.92 O ATOM 595 CB VAL E 84 15.698 29.648 13.293 1.00 15.92 C ATOM 596 CG1 VAL E 84 16.323 29.489 11.862 1.00 14.86 C ATOM 597 CG2 VAL E 84 14.171 29.734 13.178 1.00 13.99 C ATOM 598 N ALA E 85 18.455 28.954 14.766 1.00 15.95 N ATOM 599 CA ALA E 85 19.924 28.855 14.698 1.00 14.84 C ATOM 600 C ALA E 85 20.500 28.705 16.137 1.00 17.19 C ATOM 601 O ALA E 85 21.110 29.653 16.663 1.00 17.69 O ATOM 602 CB ALA E 85 20.485 30.130 14.081 1.00 13.22 C ATOM 603 N PRO E 86 20.310 27.555 16.796 1.00 18.08 N ATOM 604 CA PRO E 86 20.516 27.508 18.249 1.00 19.83 C ATOM 605 C PRO E 86 21.974 27.554 18.717 1.00 20.83 C ATOM 606 O PRO E 86 22.119 27.731 19.919 1.00 20.94 O ATOM 607 CB PRO E 86 19.828 26.195 18.680 1.00 19.86 C ATOM 608 CG PRO E 86 19.810 25.372 17.460 1.00 22.12 C ATOM 609 CD PRO E 86 19.763 26.299 16.276 1.00 17.03 C ATOM 610 N SER E 87 22.971 27.377 17.836 1.00 20.83 N ATOM 611 CA SER E 87 24.385 27.699 18.180 1.00 21.73 C ATOM 612 C SER E 87 24.889 29.108 17.789 1.00 21.69 C ATOM 613 O SER E 87 26.094 29.399 17.903 1.00 20.56 O ATOM 614 CB SER E 87 25.328 26.624 17.624 1.00 22.69 C ATOM 615 OG SER E 87 24.818 25.305 17.924 1.00 23.33 O ATOM 616 N ALA E 88 23.984 29.982 17.298 1.00 21.58 N ATOM 617 CA ALA E 88 24.380 31.355 16.955 1.00 21.38 C ATOM 618 C ALA E 88 24.944 32.125 18.139 1.00 21.88 C ATOM 619 O ALA E 88 24.574 31.854 19.307 1.00 22.35 O ATOM 620 CB ALA E 88 23.181 32.129 16.317 1.00 21.21 C ATOM 621 N SER E 89 25.837 33.085 17.871 1.00 21.83 N ATOM 622 CA SER E 89 26.264 34.043 18.915 1.00 22.14 C ATOM 623 C SER E 89 25.400 35.283 18.827 1.00 22.06 C ATOM 624 O SER E 89 25.412 36.021 17.802 1.00 21.39 O ATOM 625 CB SER E 89 27.730 34.483 18.758 1.00 22.10 C ATOM 626 OG SER E 89 28.573 33.446 18.324 1.00 27.17 O ATOM 627 N LEU E 90 24.622 35.451 19.884 1.00 21.32 N ATOM 628 CA LEU E 90 23.575 36.428 20.015 1.00 19.70 C ATOM 629 C LEU E 90 24.187 37.657 20.652 1.00 18.94 C ATOM 630 O LEU E 90 24.825 37.570 21.752 1.00 16.65 O ATOM 631 CB LEU E 90 22.544 35.866 21.032 1.00 21.23 C ATOM 632 CG LEU E 90 21.021 35.877 20.972 1.00 24.34 C ATOM 633 CD1 LEU E 90 20.494 36.114 19.507 1.00 24.84 C ATOM 634 CD2 LEU E 90 20.398 34.630 21.643 1.00 19.19 C ATOM 635 N TYR E 91 23.960 38.800 20.012 1.00 18.14 N ATOM 636 CA TYR E 91 24.355 40.079 20.624 1.00 18.40 C ATOM 637 C TYR E 91 23.160 40.948 20.930 1.00 17.05 C ATOM 638 O TYR E 91 22.338 41.134 20.079 1.00 16.08 O ATOM 639 CB TYR E 91 25.347 40.804 19.712 1.00 17.94 C ATOM 640 CG TYR E 91 26.696 40.113 19.704 1.00 20.48 C ATOM 641 CD1 TYR E 91 26.918 38.965 18.909 1.00 24.08 C ATOM 642 CD2 TYR E 91 27.765 40.605 20.491 1.00 21.72 C ATOM 643 CE1 TYR E 91 28.168 38.310 18.875 1.00 21.47 C ATOM 644 CE2 TYR E 91 29.010 39.976 20.476 1.00 19.34 C ATOM 645 CZ TYR E 91 29.205 38.832 19.669 1.00 23.69 C ATOM 646 OH TYR E 91 30.403 38.174 19.664 1.00 21.60 O ATOM 647 N ALA E 92 23.080 41.486 22.166 1.00 15.95 N ATOM 648 CA ALA E 92 21.961 42.338 22.572 1.00 16.29 C ATOM 649 C ALA E 92 22.324 43.787 22.276 1.00 16.81 C ATOM 650 O ALA E 92 23.251 44.279 22.880 1.00 18.94 O ATOM 651 CB ALA E 92 21.763 42.186 24.123 1.00 13.22 C ATOM 652 N VAL E 93 21.659 44.438 21.340 1.00 17.77 N ATOM 653 CA VAL E 93 21.941 45.841 20.957 1.00 17.41 C ATOM 654 C VAL E 93 20.685 46.618 21.310 1.00 18.00 C ATOM 655 O VAL E 93 19.749 46.710 20.504 1.00 15.79 O ATOM 656 CB VAL E 93 22.304 45.994 19.416 1.00 15.97 C ATOM 657 CG1 VAL E 93 22.706 47.426 19.113 1.00 17.47 C ATOM 658 CG2 VAL E 93 23.507 45.097 19.100 1.00 15.32 C ATOM 659 N LYS E 94 20.654 47.120 22.559 1.00 17.43 N ATOM 660 CA LYS E 94 19.482 47.747 23.098 1.00 16.91 C ATOM 661 C LYS E 94 19.348 49.189 22.633 1.00 16.95 C ATOM 662 O LYS E 94 20.248 50.056 22.863 1.00 16.88 O ATOM 663 CB LYS E 94 19.494 47.677 24.668 1.00 17.76 C ATOM 664 CG LYS E 94 18.359 48.462 25.244 1.00 19.16 C ATOM 665 CD LYS E 94 18.430 48.635 26.764 1.00 27.58 C ATOM 666 CE LYS E 94 17.887 47.426 27.491 1.00 31.98 C ATOM 667 NZ LYS E 94 17.377 47.790 28.905 1.00 37.56 N ATOM 668 N VAL E 95 18.234 49.445 21.951 1.00 16.30 N ATOM 669 CA VAL E 95 17.969 50.731 21.315 1.00 16.48 C ATOM 670 C VAL E 95 16.570 51.167 21.717 1.00 16.45 C ATOM 671 O VAL E 95 16.188 52.258 21.420 1.00 17.58 O ATOM 672 CB VAL E 95 18.128 50.708 19.760 1.00 14.84 C ATOM 673 CG1 VAL E 95 19.614 50.284 19.336 1.00 17.05 C ATOM 674 CG2 VAL E 95 17.090 49.785 19.114 1.00 18.67 C ATOM 675 N LEU E 96 15.830 50.327 22.436 1.00 18.32 N ATOM 676 CA LEU E 96 14.454 50.674 22.867 1.00 21.07 C ATOM 677 C LEU E 96 14.326 50.628 24.385 1.00 23.10 C ATOM 678 O LEU E 96 14.964 49.807 25.025 1.00 24.51 O ATOM 679 CB LEU E 96 13.408 49.734 22.204 1.00 20.87 C ATOM 680 CG LEU E 96 13.450 49.493 20.665 1.00 18.41 C ATOM 681 CD1 LEU E 96 12.334 48.482 20.245 1.00 15.84 C ATOM 682 CD2 LEU E 96 13.189 50.847 20.035 1.00 18.68 C ATOM 683 N GLY E 97 13.536 51.546 24.939 1.00 25.85 N ATOM 684 CA GLY E 97 13.284 51.624 26.366 1.00 27.98 C ATOM 685 C GLY E 97 12.194 50.647 26.784 1.00 29.61 C ATOM 686 O GLY E 97 11.638 49.906 25.929 1.00 29.92 O ATOM 687 N ALA E 98 11.904 50.660 28.088 1.00 30.19 N ATOM 688 CA ALA E 98 10.967 49.746 28.767 1.00 31.38 C ATOM 689 C ALA E 98 9.580 49.821 28.187 1.00 31.96 C ATOM 690 O ALA E 98 8.891 48.808 28.159 1.00 32.75 O ATOM 691 CB ALA E 98 10.927 50.026 30.278 1.00 31.16 C ATOM 692 N ASP E 99 9.183 51.006 27.720 1.00 32.49 N ATOM 693 CA ASP E 99 7.927 51.152 26.973 1.00 34.40 C ATOM 694 C ASP E 99 7.964 50.754 25.484 1.00 34.28 C ATOM 695 O ASP E 99 6.986 51.010 24.773 1.00 36.06 O ATOM 696 CB ASP E 99 7.355 52.571 27.102 1.00 34.86 C ATOM 697 CG ASP E 99 8.125 53.628 26.289 1.00 38.74 C ATOM 698 OD1 ASP E 99 9.202 53.343 25.645 1.00 37.72 O ATOM 699 OD2 ASP E 99 7.695 54.820 26.281 1.00 38.78 O ATOM 700 N GLY E 100 9.059 50.135 25.016 1.00 33.06 N ATOM 701 CA GLY E 100 9.163 49.694 23.618 1.00 31.17 C ATOM 702 C GLY E 100 9.317 50.759 22.549 1.00 29.76 C ATOM 703 O GLY E 100 8.998 50.519 21.371 1.00 30.52 O ATOM 704 N SER E 101 9.811 51.935 22.924 1.00 28.24 N ATOM 705 CA SER E 101 10.048 53.002 21.973 1.00 27.53 C ATOM 706 C SER E 101 11.489 53.498 22.100 1.00 26.37 C ATOM 707 O SER E 101 12.097 53.372 23.162 1.00 26.19 O ATOM 708 CB SER E 101 9.104 54.181 22.225 1.00 27.73 C ATOM 709 OG SER E 101 9.287 54.684 23.560 1.00 33.01 O ATOM 710 N GLY E 102 12.009 54.046 21.013 1.00 25.67 N ATOM 711 CA GLY E 102 13.305 54.681 21.012 1.00 25.83 C ATOM 712 C GLY E 102 13.361 55.804 20.006 1.00 26.81 C ATOM 713 O GLY E 102 12.518 55.900 19.105 1.00 26.07 O ATOM 714 N GLN E 103 14.360 56.676 20.162 1.00 27.36 N ATOM 715 CA GLN E 103 14.660 57.753 19.222 1.00 27.36 C ATOM 716 C GLN E 103 15.406 57.206 17.968 1.00 28.87 C ATOM 717 O GLN E 103 16.117 56.207 18.064 1.00 29.66 O ATOM 718 CB GLN E 103 15.541 58.815 19.916 1.00 27.27 C ATOM 719 CG GLN E 103 14.849 59.570 21.080 1.00 26.65 C ATOM 720 CD AGLN E 103 13.469 60.111 20.697 0.67 27.68 C ATOM 721 CD BGLN E 103 14.347 60.925 20.639 0.33 25.31 C ATOM 722 OE1AGLN E 103 13.320 60.853 19.709 0.67 26.59 O ATOM 723 OE1BGLN E 103 15.098 61.720 20.064 0.33 23.76 O ATOM 724 NE2AGLN E 103 12.463 59.706 21.442 0.67 24.17 N ATOM 725 NE2BGLN E 103 13.066 61.182 20.879 0.33 24.10 N ATOM 726 N TYR E 104 15.288 57.876 16.827 1.00 28.46 N ATOM 727 CA TYR E 104 15.938 57.446 15.577 1.00 29.26 C ATOM 728 C TYR E 104 17.486 57.379 15.691 1.00 29.88 C ATOM 729 O TYR E 104 18.184 56.514 15.087 1.00 28.14 O ATOM 730 CB TYR E 104 15.534 58.373 14.413 1.00 28.82 C ATOM 731 CG TYR E 104 14.253 57.998 13.675 1.00 31.88 C ATOM 732 CD1 TYR E 104 13.024 57.931 14.351 1.00 34.62 C ATOM 733 CD2 TYR E 104 14.251 57.748 12.315 1.00 31.35 C ATOM 734 CE1 TYR E 104 11.847 57.622 13.689 1.00 33.47 C ATOM 735 CE2 TYR E 104 13.060 57.433 11.633 1.00 32.45 C ATOM 736 CZ TYR E 104 11.863 57.379 12.339 1.00 34.58 C ATOM 737 OH TYR E 104 10.671 57.054 11.736 1.00 32.65 O ATOM 738 N SER E 105 18.043 58.281 16.495 1.00 30.23 N ATOM 739 CA SER E 105 19.500 58.332 16.628 1.00 28.82 C ATOM 740 C SER E 105 19.977 57.137 17.477 1.00 27.87 C ATOM 741 O SER E 105 21.098 56.693 17.316 1.00 25.66 O ATOM 742 CB SER E 105 19.929 59.657 17.244 1.00 29.04 C ATOM 743 OG SER E 105 19.398 59.753 18.561 1.00 31.54 O ATOM 744 N TRP E 106 19.133 56.625 18.383 1.00 26.90 N ATOM 745 CA TRP E 106 19.523 55.425 19.123 1.00 26.17 C ATOM 746 C TRP E 106 19.570 54.172 18.218 1.00 25.61 C ATOM 747 O TRP E 106 20.489 53.330 18.368 1.00 24.84 O ATOM 748 CB TRP E 106 18.663 55.161 20.372 1.00 26.90 C ATOM 749 CG TRP E 106 18.288 56.373 21.257 1.00 26.64 C ATOM 750 CD1 TRP E 106 18.889 57.606 21.290 1.00 31.19 C ATOM 751 CD2 TRP E 106 17.257 56.408 22.256 1.00 27.89 C ATOM 752 NE1 TRP E 106 18.266 58.409 22.215 1.00 30.92 N ATOM 753 CE2 TRP E 106 17.274 57.692 22.839 1.00 29.17 C ATOM 754 CE3 TRP E 106 16.311 55.479 22.718 1.00 25.73 C ATOM 755 CZ2 TRP E 106 16.364 58.079 23.835 1.00 29.46 C ATOM 756 CZ3 TRP E 106 15.423 55.860 23.731 1.00 30.64 C ATOM 757 CH2 TRP E 106 15.447 57.142 24.271 1.00 28.77 C ATOM 758 N ILE E 107 18.576 54.046 17.325 1.00 23.73 N ATOM 759 CA ILE E 107 18.541 52.977 16.305 1.00 23.98 C ATOM 760 C ILE E 107 19.782 53.023 15.393 1.00 23.35 C ATOM 761 O ILE E 107 20.462 51.976 15.145 1.00 21.24 O ATOM 762 CB ILE E 107 17.177 52.965 15.507 1.00 23.57 C ATOM 763 CG1 ILE E 107 16.097 52.267 16.343 1.00 24.66 C ATOM 764 CG2 ILE E 107 17.262 52.163 14.223 1.00 23.69 C ATOM 765 CD1 ILE E 107 15.556 53.073 17.520 1.00 24.30 C ATOM 766 N ILE E 108 20.125 54.247 14.953 1.00 22.88 N ATOM 767 CA ILE E 108 21.260 54.453 14.045 1.00 22.11 C ATOM 768 C ILE E 108 22.548 54.098 14.719 1.00 22.13 C ATOM 769 O ILE E 108 23.403 53.439 14.117 1.00 22.62 O ATOM 770 CB ILE E 108 21.293 55.912 13.557 1.00 23.75 C ATOM 771 CG1 ILE E 108 20.172 56.102 12.500 1.00 24.12 C ATOM 772 CG2 ILE E 108 22.695 56.260 13.053 1.00 22.76 C ATOM 773 CD1 ILE E 108 19.656 57.611 12.371 1.00 26.52 C ATOM 774 N ASN E 109 22.687 54.505 15.989 1.00 21.38 N ATOM 775 CA ASN E 109 23.854 54.193 16.741 1.00 21.35 C ATOM 776 C ASN E 109 23.979 52.660 16.939 1.00 20.67 C ATOM 777 O ASN E 109 25.094 52.116 17.094 1.00 19.67 O ATOM 778 CB ASN E 109 23.786 54.911 18.102 1.00 22.69 C ATOM 779 CG ASN E 109 24.214 56.429 18.000 1.00 28.74 C ATOM 780 OD1 ASN E 109 24.745 56.846 16.976 1.00 31.96 O ATOM 781 ND2 ASN E 109 23.938 57.233 19.059 1.00 26.44 N ATOM 782 N GLY E 110 22.836 51.963 16.999 1.00 19.76 N ATOM 783 CA GLY E 110 22.860 50.523 17.170 1.00 17.32 C ATOM 784 C GLY E 110 23.385 49.861 15.933 1.00 18.25 C ATOM 785 O GLY E 110 24.170 48.906 16.028 1.00 18.40 O ATOM 786 N ILE E 111 22.954 50.354 14.756 1.00 18.24 N ATOM 787 CA ILE E 111 23.380 49.757 13.512 1.00 18.12 C ATOM 788 C ILE E 111 24.882 50.010 13.390 1.00 18.61 C ATOM 789 O ILE E 111 25.648 49.121 13.026 1.00 17.96 O ATOM 790 CB ILE E 111 22.565 50.292 12.300 1.00 17.21 C ATOM 791 CG1 ILE E 111 21.119 49.784 12.336 1.00 19.11 C ATOM 792 CG2 ILE E 111 23.238 49.896 10.983 1.00 16.62 C ATOM 793 CD1 ILE E 111 20.021 50.847 11.763 1.00 16.38 C ATOM 794 N GLU E 112 25.323 51.218 13.751 1.00 19.59 N ATOM 795 CA GLU E 112 26.760 51.524 13.663 1.00 18.74 C ATOM 796 C GLU E 112 27.624 50.617 14.535 1.00 18.44 C ATOM 797 O GLU E 112 28.742 50.227 14.126 1.00 18.78 O ATOM 798 CB GLU E 112 27.024 53.018 14.016 1.00 20.09 C ATOM 799 CG AGLU E 112 26.078 53.998 13.317 0.50 17.96 C ATOM 800 CG BGLU E 112 27.152 53.968 12.822 0.50 22.44 C ATOM 801 CD AGLU E 112 26.602 54.544 12.003 0.50 20.46 C ATOM 802 CD BGLU E 112 28.561 53.970 12.242 0.50 25.83 C ATOM 803 OE1AGLU E 112 27.539 53.953 11.445 0.50 15.82 O ATOM 804 OE1BGLU E 112 28.922 52.976 11.535 0.50 24.22 O ATOM 805 OE2AGLU E 112 26.049 55.568 11.507 0.50 24.80 O ATOM 806 OE2BGLU E 112 29.314 54.956 12.502 0.50 29.09 O ATOM 807 N TRP E 113 27.149 50.314 15.758 1.00 16.68 N ATOM 808 CA TRP E 113 27.845 49.400 16.629 1.00 16.10 C ATOM 809 C TRP E 113 27.971 47.983 16.036 1.00 15.82 C ATOM 810 O TRP E 113 29.024 47.356 16.083 1.00 13.62 O ATOM 811 CB TRP E 113 27.204 49.400 18.072 1.00 16.47 C ATOM 812 CG TRP E 113 27.871 48.476 19.031 1.00 17.03 C ATOM 813 CD1 TRP E 113 28.726 48.847 20.061 1.00 20.42 C ATOM 814 CD2 TRP E 113 27.763 47.031 19.114 1.00 18.26 C ATOM 815 NE1 TRP E 113 29.150 47.728 20.751 1.00 18.87 N ATOM 816 CE2 TRP E 113 28.563 46.609 20.220 1.00 18.34 C ATOM 817 CE3 TRP E 113 27.033 46.045 18.409 1.00 18.61 C ATOM 818 CZ2 TRP E 113 28.719 45.242 20.582 1.00 18.79 C ATOM 819 CZ3 TRP E 113 27.199 44.685 18.766 1.00 18.28 C ATOM 820 CH2 TRP E 113 28.008 44.301 19.861 1.00 18.78 C ATOM 821 N ALA E 114 26.882 47.497 15.477 1.00 17.17 N ATOM 822 CA ALA E 114 26.844 46.248 14.688 1.00 19.51 C ATOM 823 C ALA E 114 27.860 46.181 13.520 1.00 18.97 C ATOM 824 O ALA E 114 28.535 45.171 13.321 1.00 18.00 O ATOM 825 CB ALA E 114 25.388 45.993 14.134 1.00 17.73 C ATOM 826 N ILE E 115 28.001 47.260 12.782 1.00 19.11 N ATOM 827 CA ILE E 115 29.053 47.260 11.748 1.00 19.87 C ATOM 828 C ILE E 115 30.466 47.179 12.384 1.00 20.84 C ATOM 829 O ILE E 115 31.269 46.303 12.033 1.00 21.62 O ATOM 830 CB ILE E 115 28.900 48.501 10.824 1.00 19.88 C ATOM 831 CG1 ILE E 115 27.590 48.428 10.026 1.00 20.44 C ATOM 832 CG2 ILE E 115 30.037 48.611 9.832 1.00 21.49 C ATOM 833 CD1 ILE E 115 26.966 49.911 9.765 1.00 20.30 C ATOM 834 N ALA E 116 30.741 48.034 13.368 1.00 20.68 N ATOM 835 CA ALA E 116 32.049 48.129 14.022 1.00 20.40 C ATOM 836 C ALA E 116 32.514 46.807 14.686 1.00 21.28 C ATOM 837 O ALA E 116 33.719 46.548 14.820 1.00 19.35 O ATOM 838 CB ALA E 116 32.028 49.259 15.067 1.00 21.14 C ATOM 839 N ASN E 117 31.548 45.982 15.082 1.00 20.23 N ATOM 840 CA ASN E 117 31.815 44.743 15.784 1.00 18.95 C ATOM 841 C ASN E 117 31.648 43.520 14.887 1.00 17.88 C ATOM 842 O ASN E 117 31.585 42.374 15.358 1.00 17.84 O ATOM 843 CB ASN E 117 30.920 44.696 17.044 1.00 20.39 C ATOM 844 CG ASN E 117 31.475 45.580 18.185 1.00 21.76 C ATOM 845 OD1 ASN E 117 32.291 45.109 18.953 1.00 23.90 O ATOM 846 ND2 ASN E 117 31.074 46.856 18.256 1.00 19.54 N ATOM 847 N ASN E 118 31.566 43.764 13.579 1.00 17.03 N ATOM 848 CA ASN E 118 31.608 42.714 12.549 1.00 17.05 C ATOM 849 C ASN E 118 30.466 41.708 12.643 1.00 16.66 C ATOM 850 O ASN E 118 30.688 40.487 12.495 1.00 15.49 O ATOM 851 CB ASN E 118 32.961 41.964 12.504 1.00 17.37 C ATOM 852 CG ASN E 118 34.156 42.915 12.393 1.00 22.91 C ATOM 853 OD1 ASN E 118 34.494 43.406 11.308 1.00 27.74 O ATOM 854 ND2 ASN E 118 34.787 43.184 13.511 1.00 25.26 N ATOM 855 N MET E 119 29.252 42.202 12.843 1.00 15.81 N ATOM 856 CA MET E 119 28.091 41.285 12.873 1.00 16.41 C ATOM 857 C MET E 119 27.844 40.747 11.458 1.00 17.03 C ATOM 858 O MET E 119 28.082 41.447 10.462 1.00 17.92 O ATOM 859 CB MET E 119 26.834 41.996 13.441 1.00 15.81 C ATOM 860 CG MET E 119 26.961 42.527 14.836 1.00 17.10 C ATOM 861 SD MET E 119 26.986 41.290 16.220 1.00 19.38 S ATOM 862 CE MET E 119 28.621 41.503 16.735 1.00 14.96 C ATOM 863 N ASP E 120 27.375 39.505 11.368 1.00 15.62 N ATOM 864 CA ASP E 120 27.095 38.847 10.124 1.00 15.82 C ATOM 865 C ASP E 120 25.625 39.060 9.713 1.00 15.88 C ATOM 866 O ASP E 120 25.284 39.077 8.530 1.00 16.38 O ATOM 867 CB ASP E 120 27.360 37.346 10.318 1.00 16.42 C ATOM 868 CG ASP E 120 28.844 37.058 10.637 1.00 20.27 C ATOM 869 OD1 ASP E 120 29.729 37.487 9.843 1.00 23.74 O ATOM 870 OD2 ASP E 120 29.197 36.422 11.660 1.00 20.56 O ATOM 871 N VAL E 121 24.756 39.180 10.696 1.00 14.63 N ATOM 872 CA VAL E 121 23.311 39.360 10.450 1.00 13.92 C ATOM 873 C VAL E 121 22.774 40.374 11.463 1.00 14.54 C ATOM 874 O VAL E 121 23.135 40.326 12.688 1.00 15.48 O ATOM 875 CB VAL E 121 22.528 38.028 10.643 1.00 12.91 C ATOM 876 CG1 VAL E 121 20.997 38.195 10.229 1.00 11.81 C ATOM 877 CG2 VAL E 121 23.161 36.882 9.848 1.00 12.41 C ATOM 878 N ILE E 122 21.932 41.274 10.978 1.00 14.73 N ATOM 879 CA ILE E 122 21.202 42.173 11.850 1.00 14.49 C ATOM 880 C ILE E 122 19.683 41.900 11.752 1.00 15.10 C ATOM 881 O ILE E 122 19.125 41.741 10.642 1.00 12.13 O ATOM 882 CB ILE E 122 21.476 43.660 11.498 1.00 14.96 C ATOM 883 CG1 ILE E 122 22.828 44.135 12.017 1.00 14.15 C ATOM 884 CG2 ILE E 122 20.357 44.572 12.021 1.00 11.24 C ATOM 885 CD1 ILE E 122 23.180 45.527 11.419 1.00 20.36 C ATOM 886 N ASN E 123 19.022 41.836 12.918 1.00 14.18 N ATOM 887 CA ASN E 123 17.556 41.696 12.922 1.00 13.61 C ATOM 888 C ASN E 123 16.980 42.926 13.535 1.00 15.59 C ATOM 889 O ASN E 123 17.310 43.289 14.716 1.00 13.90 O ATOM 890 CB ASN E 123 17.088 40.491 13.746 1.00 15.22 C ATOM 891 CG ASN E 123 15.548 40.344 13.718 1.00 16.86 C ATOM 892 OD1 ASN E 123 14.981 39.867 12.744 1.00 16.52 O ATOM 893 ND2 ASN E 123 14.892 40.850 14.746 1.00 13.07 N ATOM 894 N MET E 124 16.031 43.512 12.815 1.00 15.87 N ATOM 895 CA MET E 124 15.337 44.684 13.375 1.00 17.20 C ATOM 896 C MET E 124 13.812 44.486 13.493 1.00 18.03 C ATOM 897 O MET E 124 13.097 44.691 12.497 1.00 15.23 O ATOM 898 CB MET E 124 15.654 45.925 12.533 1.00 17.46 C ATOM 899 CG MET E 124 17.095 46.483 12.819 1.00 17.81 C ATOM 900 SD MET E 124 17.451 48.075 12.036 1.00 23.81 S ATOM 901 CE MET E 124 17.637 47.476 10.333 1.00 17.52 C ATOM 902 N SER E 125 13.326 44.123 14.702 1.00 17.40 N ATOM 903 CA SER E 125 11.869 43.831 14.845 1.00 18.26 C ATOM 904 C SER E 125 11.155 45.140 15.310 1.00 17.95 C ATOM 905 O SER E 125 10.585 45.248 16.380 1.00 18.03 O ATOM 906 CB SER E 125 11.605 42.638 15.765 1.00 16.98 C ATOM 907 OG SER E 125 11.856 41.405 15.060 1.00 19.11 O ATOM 908 N LEU E 126 11.235 46.145 14.472 1.00 20.03 N ATOM 909 CA LEU E 126 10.936 47.526 14.872 1.00 19.46 C ATOM 910 C LEU E 126 10.739 48.416 13.659 1.00 19.59 C ATOM 911 O LEU E 126 11.000 48.013 12.514 1.00 18.52 O ATOM 912 CB LEU E 126 11.997 48.108 15.834 1.00 20.80 C ATOM 913 CG LEU E 126 13.516 48.143 15.486 1.00 22.03 C ATOM 914 CD1 LEU E 126 13.876 48.932 14.203 1.00 20.97 C ATOM 915 CD2 LEU E 126 14.344 48.654 16.663 1.00 18.67 C ATOM 916 N GLY E 127 10.183 49.615 13.897 1.00 20.37 N ATOM 917 CA GLY E 127 9.896 50.497 12.779 1.00 21.57 C ATOM 918 C GLY E 127 9.165 51.800 13.142 1.00 22.18 C ATOM 919 O GLY E 127 8.768 52.028 14.300 1.00 20.55 O ATOM 920 N GLY E 128 9.002 52.621 12.123 1.00 22.15 N ATOM 921 CA GLY E 128 8.231 53.857 12.175 1.00 24.12 C ATOM 922 C GLY E 128 7.715 54.217 10.789 1.00 25.93 C ATOM 923 O GLY E 128 8.146 53.654 9.817 1.00 23.98 O ATOM 924 N PRO E 129 6.834 55.222 10.686 1.00 28.41 N ATOM 925 CA PRO E 129 6.072 55.442 9.462 1.00 29.11 C ATOM 926 C PRO E 129 6.854 56.336 8.511 1.00 30.32 C ATOM 927 O PRO E 129 6.510 56.444 7.312 1.00 32.00 O ATOM 928 CB PRO E 129 4.815 56.148 9.996 1.00 30.04 C ATOM 929 CG PRO E 129 5.390 57.064 11.079 1.00 29.46 C ATOM 930 CD PRO E 129 6.537 56.234 11.715 1.00 29.05 C ATOM 931 N SER E 130 7.905 56.969 9.040 1.00 31.07 N ATOM 932 CA SER E 130 8.741 57.882 8.254 1.00 32.72 C ATOM 933 C SER E 130 10.226 57.470 8.283 1.00 31.69 C ATOM 934 O SER E 130 10.696 56.870 9.260 1.00 29.72 O ATOM 935 CB SER E 130 8.539 59.357 8.693 1.00 33.84 C ATOM 936 OG SER E 130 9.173 59.628 9.945 1.00 36.40 O ATOM 937 N GLY E 131 10.920 57.720 7.169 1.00 31.19 N ATOM 938 CA GLY E 131 12.335 57.403 7.072 1.00 30.64 C ATOM 939 C GLY E 131 13.145 58.647 7.391 1.00 30.53 C ATOM 940 O GLY E 131 12.576 59.643 7.811 1.00 30.94 O ATOM 941 N SER E 132 14.461 58.580 7.198 1.00 30.18 N ATOM 942 CA SER E 132 15.349 59.738 7.330 1.00 29.90 C ATOM 943 C SER E 132 16.668 59.417 6.655 1.00 29.43 C ATOM 944 O SER E 132 17.062 58.235 6.474 1.00 27.47 O ATOM 945 CB SER E 132 15.582 60.137 8.810 1.00 30.11 C ATOM 946 OG SER E 132 16.770 59.525 9.295 1.00 29.24 O ATOM 947 N ALA E 133 17.357 60.492 6.278 1.00 29.78 N ATOM 948 CA ALA E 133 18.570 60.374 5.492 1.00 28.54 C ATOM 949 C ALA E 133 19.581 59.601 6.304 1.00 26.78 C ATOM 950 O ALA E 133 20.292 58.815 5.765 1.00 25.20 O ATOM 951 CB ALA E 133 19.134 61.759 5.140 1.00 29.11 C ATOM 952 N ALA E 134 19.691 59.911 7.591 1.00 26.88 N ATOM 953 CA ALA E 134 20.665 59.241 8.444 1.00 25.73 C ATOM 954 C ALA E 134 20.339 57.702 8.585 1.00 25.51 C ATOM 955 O ALA E 134 21.230 56.842 8.528 1.00 25.57 O ATOM 956 CB ALA E 134 20.722 59.939 9.792 1.00 24.75 C ATOM 957 N LEU E 135 19.069 57.366 8.781 1.00 25.24 N ATOM 958 CA LEU E 135 18.632 55.938 8.837 1.00 24.34 C ATOM 959 C LEU E 135 18.894 55.201 7.515 1.00 25.07 C ATOM 960 O LEU E 135 19.487 54.066 7.480 1.00 24.07 O ATOM 961 CB LEU E 135 17.158 55.844 9.286 1.00 24.78 C ATOM 962 CG LEU E 135 16.601 54.417 9.449 1.00 24.47 C ATOM 963 CD1 LEU E 135 17.297 53.759 10.679 1.00 25.11 C ATOM 964 CD2 LEU E 135 14.999 54.382 9.551 1.00 18.23 C ATOM 965 N LYS E 136 18.543 55.842 6.401 1.00 24.76 N ATOM 966 CA LYS E 136 18.827 55.218 5.081 1.00 26.11 C ATOM 967 C LYS E 136 20.299 54.980 4.880 1.00 25.76 C ATOM 968 O LYS E 136 20.675 53.887 4.463 1.00 26.43 O ATOM 969 CB LYS E 136 18.267 56.015 3.881 1.00 26.85 C ATOM 970 CG LYS E 136 18.412 55.285 2.561 1.00 27.58 C ATOM 971 CD LYS E 136 17.916 56.136 1.441 1.00 33.81 C ATOM 972 CE LYS E 136 17.819 55.309 0.163 1.00 35.11 C ATOM 973 NZ LYS E 136 19.191 54.946 -0.237 1.00 35.59 N ATOM 974 N ALA E 137 21.128 55.988 5.203 1.00 25.83 N ATOM 975 CA ALA E 137 22.583 55.855 5.122 1.00 25.13 C ATOM 976 C ALA E 137 23.089 54.692 5.936 1.00 24.23 C ATOM 977 O ALA E 137 23.934 53.954 5.472 1.00 23.42 O ATOM 978 CB ALA E 137 23.317 57.168 5.565 1.00 25.09 C ATOM 979 N ALA E 138 22.598 54.553 7.175 1.00 23.83 N ATOM 980 CA ALA E 138 23.176 53.571 8.074 1.00 22.76 C ATOM 981 C ALA E 138 22.873 52.118 7.656 1.00 22.21 C ATOM 982 O ALA E 138 23.792 51.291 7.668 1.00 20.25 O ATOM 983 CB ALA E 138 22.785 53.841 9.557 1.00 23.63 C ATOM 984 N VAL E 139 21.632 51.790 7.291 1.00 21.90 N ATOM 985 CA VAL E 139 21.356 50.434 6.751 1.00 23.67 C ATOM 986 C VAL E 139 22.075 50.104 5.365 1.00 23.58 C ATOM 987 O VAL E 139 22.543 48.961 5.091 1.00 23.46 O ATOM 988 CB VAL E 139 19.785 50.071 6.687 1.00 24.38 C ATOM 989 CG1 VAL E 139 19.021 50.390 7.987 1.00 23.81 C ATOM 990 CG2 VAL E 139 19.078 50.735 5.526 1.00 25.82 C ATOM 991 N ASP E 140 22.162 51.081 4.496 1.00 23.33 N ATOM 992 CA ASP E 140 22.876 50.900 3.205 1.00 24.93 C ATOM 993 C ASP E 140 24.395 50.678 3.463 1.00 23.33 C ATOM 994 O ASP E 140 25.052 49.965 2.708 1.00 23.71 O ATOM 995 CB ASP E 140 22.698 52.144 2.293 1.00 26.07 C ATOM 996 CG ASP E 140 21.244 52.330 1.777 1.00 33.66 C ATOM 997 OD1 ASP E 140 20.404 51.349 1.811 1.00 35.10 O ATOM 998 OD2 ASP E 140 20.859 53.449 1.306 1.00 35.50 O ATOM 999 N LYS E 141 24.936 51.252 4.542 1.00 21.83 N ATOM 1000 CA LYS E 141 26.350 51.003 4.849 1.00 21.88 C ATOM 1001 C LYS E 141 26.567 49.598 5.474 1.00 20.83 C ATOM 1002 O LYS E 141 27.530 48.895 5.149 1.00 20.65 O ATOM 1003 CB LYS E 141 26.904 52.145 5.671 1.00 22.09 C ATOM 1004 CG LYS E 141 28.383 52.111 5.917 1.00 25.09 C ATOM 1005 CD LYS E 141 28.582 52.485 7.424 1.00 30.84 C ATOM 1006 CE LYS E 141 29.266 53.818 7.548 1.00 35.59 C ATOM 1007 NZ LYS E 141 29.272 54.363 8.978 1.00 38.43 N ATOM 1008 N ALA E 142 25.670 49.173 6.364 1.00 19.94 N ATOM 1009 CA ALA E 142 25.722 47.798 6.873 1.00 19.53 C ATOM 1010 C ALA E 142 25.772 46.761 5.722 1.00 19.38 C ATOM 1011 O ALA E 142 26.671 45.891 5.672 1.00 20.07 O ATOM 1012 CB ALA E 142 24.565 47.547 7.897 1.00 19.12 C ATOM 1013 N VAL E 143 24.873 46.922 4.753 1.00 19.63 N ATOM 1014 CA VAL E 143 24.825 46.068 3.580 1.00 20.50 C ATOM 1015 C VAL E 143 26.102 46.142 2.693 1.00 21.25 C ATOM 1016 O VAL E 143 26.617 45.073 2.242 1.00 21.25 O ATOM 1017 CB VAL E 143 23.583 46.329 2.728 1.00 20.43 C ATOM 1018 CG1 VAL E 143 23.732 45.597 1.402 1.00 22.85 C ATOM 1019 CG2 VAL E 143 22.341 45.852 3.443 1.00 19.31 C ATOM 1020 N ALA E 144 26.568 47.375 2.428 1.00 20.19 N ATOM 1021 CA ALA E 144 27.855 47.586 1.745 1.00 20.93 C ATOM 1022 C ALA E 144 29.043 46.876 2.439 1.00 20.80 C ATOM 1023 O ALA E 144 29.944 46.350 1.784 1.00 20.48 O ATOM 1024 CB ALA E 144 28.125 49.110 1.611 1.00 21.85 C ATOM 1025 N SER E 145 29.036 46.883 3.785 1.00 20.74 N ATOM 1026 CA SER E 145 30.065 46.275 4.602 1.00 21.17 C ATOM 1027 C SER E 145 29.912 44.764 4.689 1.00 21.01 C ATOM 1028 O SER E 145 30.745 44.148 5.264 1.00 22.13 O ATOM 1029 CB SER E 145 30.109 46.895 6.055 1.00 22.34 C ATOM 1030 OG ASER E 145 30.262 48.312 6.056 0.33 21.32 O ATOM 1031 OG BSER E 145 29.869 45.943 7.068 0.33 22.86 O ATOM 1032 OG CSER E 145 30.265 48.312 6.058 0.34 21.30 O ATOM 1033 N GLY E 146 28.825 44.168 4.171 1.00 19.91 N ATOM 1034 CA GLY E 146 28.705 42.715 4.158 1.00 19.50 C ATOM 1035 C GLY E 146 27.655 42.081 5.051 1.00 18.27 C ATOM 1036 O GLY E 146 27.546 40.847 5.085 1.00 19.74 O ATOM 1037 N VAL E 147 26.898 42.900 5.769 1.00 17.60 N ATOM 1038 CA VAL E 147 25.946 42.410 6.792 1.00 17.46 C ATOM 1039 C VAL E 147 24.603 41.999 6.109 1.00 15.95 C ATOM 1040 O VAL E 147 24.135 42.719 5.272 1.00 15.72 O ATOM 1041 CB VAL E 147 25.689 43.469 7.945 1.00 18.32 C ATOM 1042 CG1 VAL E 147 24.814 42.906 9.073 1.00 15.90 C ATOM 1043 CG2 VAL E 147 27.001 44.056 8.528 1.00 14.78 C ATOM 1044 N VAL E 148 24.020 40.843 6.419 1.00 15.58 N ATOM 1045 CA VAL E 148 22.597 40.579 6.036 1.00 14.59 C ATOM 1046 C VAL E 148 21.623 41.313 7.008 1.00 14.56 C ATOM 1047 O VAL E 148 21.652 41.075 8.219 1.00 14.78 O ATOM 1048 CB VAL E 148 22.244 39.004 6.099 1.00 15.79 C ATOM 1049 CG1 VAL E 148 20.800 38.720 5.649 1.00 14.99 C ATOM 1050 CG2 VAL E 148 23.232 38.133 5.335 1.00 13.98 C ATOM 1051 N VAL E 149 20.752 42.175 6.487 1.00 15.32 N ATOM 1052 CA VAL E 149 19.929 43.052 7.284 1.00 13.75 C ATOM 1053 C VAL E 149 18.437 42.668 7.032 1.00 14.94 C ATOM 1054 O VAL E 149 17.962 42.584 5.884 1.00 12.45 O ATOM 1055 CB VAL E 149 20.203 44.574 6.930 1.00 15.04 C ATOM 1056 CG1 VAL E 149 19.197 45.476 7.639 1.00 12.85 C ATOM 1057 CG2 VAL E 149 21.637 45.003 7.372 1.00 13.50 C ATOM 1058 N VAL E 150 17.744 42.382 8.113 1.00 10.62 N ATOM 1059 CA VAL E 150 16.388 41.858 8.078 1.00 12.08 C ATOM 1060 C VAL E 150 15.527 42.726 8.988 1.00 12.70 C ATOM 1061 O VAL E 150 15.901 43.044 10.183 1.00 12.63 O ATOM 1062 CB VAL E 150 16.318 40.297 8.584 1.00 10.07 C ATOM 1063 CG1 VAL E 150 14.865 39.663 8.428 1.00 11.00 C ATOM 1064 CG2 VAL E 150 17.395 39.447 7.920 1.00 11.15 C ATOM 1065 N ALA E 151 14.301 42.982 8.572 1.00 15.19 N ATOM 1066 CA ALA E 151 13.437 43.777 9.462 1.00 14.93 C ATOM 1067 C ALA E 151 11.958 43.377 9.345 1.00 16.39 C ATOM 1068 O ALA E 151 11.583 42.857 8.332 1.00 15.19 O ATOM 1069 CB ALA E 151 13.609 45.274 9.152 1.00 15.27 C ATOM 1070 N ALA E 152 11.162 43.589 10.405 1.00 16.84 N ATOM 1071 CA ALA E 152 9.670 43.457 10.356 1.00 19.17 C ATOM 1072 C ALA E 152 9.091 44.395 9.286 1.00 21.33 C ATOM 1073 O ALA E 152 9.566 45.552 9.161 1.00 22.90 O ATOM 1074 CB ALA E 152 9.095 43.777 11.741 1.00 19.12 C ATOM 1075 N ALA E 153 8.180 43.902 8.439 1.00 21.60 N ATOM 1076 CA ALA E 153 7.471 44.762 7.476 1.00 21.48 C ATOM 1077 C ALA E 153 6.567 45.818 8.122 1.00 21.71 C ATOM 1078 O ALA E 153 6.398 46.905 7.572 1.00 22.48 O ATOM 1079 CB ALA E 153 6.632 43.928 6.529 1.00 21.72 C ATOM 1080 N GLY E 154 5.972 45.500 9.268 1.00 20.19 N ATOM 1081 CA GLY E 154 4.964 46.337 9.857 1.00 20.12 C ATOM 1082 C GLY E 154 3.624 45.618 9.986 1.00 19.73 C ATOM 1083 O GLY E 154 3.359 44.624 9.314 1.00 19.18 O ATOM 1084 N ASN E 155 2.820 46.107 10.925 1.00 20.99 N ATOM 1085 CA ASN E 155 1.515 45.530 11.309 1.00 21.55 C ATOM 1086 C ASN E 155 0.328 46.413 10.905 1.00 24.31 C ATOM 1087 O ASN E 155 -0.666 46.464 11.624 1.00 24.39 O ATOM 1088 CB ASN E 155 1.442 45.260 12.812 1.00 20.80 C ATOM 1089 CG ASN E 155 2.576 44.340 13.335 1.00 20.03 C ATOM 1090 OD1 ASN E 155 3.099 43.548 12.585 1.00 18.17 O ATOM 1091 ND2 ASN E 155 2.895 44.422 14.661 1.00 20.53 N ATOM 1092 N GLU E 156 0.388 47.036 9.726 1.00 26.83 N ATOM 1093 CA GLU E 156 -0.667 48.010 9.394 1.00 30.35 C ATOM 1094 C GLU E 156 -1.757 47.517 8.478 1.00 31.04 C ATOM 1095 O GLU E 156 -2.608 48.315 8.103 1.00 32.80 O ATOM 1096 CB GLU E 156 -0.152 49.359 8.846 1.00 31.09 C ATOM 1097 CG GLU E 156 1.128 49.899 9.429 1.00 36.06 C ATOM 1098 CD GLU E 156 0.894 50.905 10.506 1.00 46.63 C ATOM 1099 OE1 GLU E 156 0.752 52.125 10.173 1.00 53.71 O ATOM 1100 OE2 GLU E 156 0.878 50.484 11.693 1.00 50.91 O ATOM 1101 N GLY E 157 -1.757 46.232 8.133 1.00 31.84 N ATOM 1102 CA GLY E 157 -2.765 45.657 7.250 1.00 32.18 C ATOM 1103 C GLY E 157 -2.811 46.281 5.856 1.00 32.76 C ATOM 1104 O GLY E 157 -1.786 46.670 5.333 1.00 32.40 O ATOM 1105 N THR E 158 -4.007 46.377 5.262 1.00 33.25 N ATOM 1106 CA THR E 158 -4.169 46.872 3.890 1.00 34.56 C ATOM 1107 C THR E 158 -4.841 48.267 3.915 1.00 36.45 C ATOM 1108 O THR E 158 -5.536 48.642 4.876 1.00 37.30 O ATOM 1109 CB THR E 158 -5.018 45.912 3.019 1.00 34.45 C ATOM 1110 OG1 THR E 158 -6.302 45.735 3.637 1.00 32.53 O ATOM 1111 CG2 THR E 158 -4.442 44.472 2.957 1.00 33.25 C ATOM 1112 N SER E 159 -4.603 49.033 2.865 1.00 37.80 N ATOM 1113 CA SER E 159 -5.147 50.378 2.735 1.00 39.52 C ATOM 1114 C SER E 159 -5.312 50.625 1.229 1.00 40.61 C ATOM 1115 O SER E 159 -4.749 51.573 0.675 1.00 41.12 O ATOM 1116 CB SER E 159 -4.174 51.383 3.345 1.00 40.00 C ATOM 1117 OG SER E 159 -4.798 52.613 3.659 1.00 42.03 O ATOM 1118 N GLY E 160 -6.060 49.729 0.578 1.00 41.09 N ATOM 1119 CA GLY E 160 -6.279 49.777 -0.856 1.00 40.84 C ATOM 1120 C GLY E 160 -5.120 49.315 -1.710 1.00 40.42 C ATOM 1121 O GLY E 160 -4.697 48.140 -1.693 1.00 40.07 O ATOM 1122 N SER E 161 -4.607 50.253 -2.495 1.00 39.60 N ATOM 1123 CA SER E 161 -3.488 49.987 -3.398 1.00 37.60 C ATOM 1124 C SER E 161 -2.234 50.601 -2.826 1.00 36.52 C ATOM 1125 O SER E 161 -1.155 50.509 -3.414 1.00 36.32 O ATOM 1126 CB SER E 161 -3.781 50.593 -4.794 1.00 38.40 C ATOM 1127 OG ASER E 161 -4.039 49.560 -5.726 0.67 37.47 O ATOM 1128 OG BSER E 161 -4.017 51.994 -4.700 0.33 36.56 O ATOM 1129 N SER E 162 -2.391 51.272 -1.698 1.00 35.23 N ATOM 1130 CA SER E 162 -1.278 51.929 -1.067 1.00 34.47 C ATOM 1131 C SER E 162 -0.429 50.885 -0.304 1.00 32.60 C ATOM 1132 O SER E 162 -0.954 49.873 0.200 1.00 31.94 O ATOM 1133 CB SER E 162 -1.775 53.122 -0.217 1.00 35.84 C ATOM 1134 OG SER E 162 -1.745 52.876 1.197 1.00 38.34 O ATOM 1135 N SER E 163 0.878 51.120 -0.279 1.00 30.43 N ATOM 1136 CA SER E 163 1.829 50.339 0.487 1.00 28.40 C ATOM 1137 C SER E 163 1.750 50.726 1.977 1.00 27.23 C ATOM 1138 O SER E 163 1.679 51.939 2.307 1.00 26.13 O ATOM 1139 CB SER E 163 3.261 50.590 -0.066 1.00 29.09 C ATOM 1140 OG SER E 163 4.245 50.241 0.931 1.00 30.30 O ATOM 1141 N THR E 164 1.764 49.722 2.876 1.00 25.18 N ATOM 1142 CA THR E 164 1.813 49.984 4.340 1.00 24.26 C ATOM 1143 C THR E 164 3.092 49.527 5.080 1.00 23.82 C ATOM 1144 O THR E 164 3.156 49.552 6.361 1.00 24.00 O ATOM 1145 CB THR E 164 0.580 49.383 5.116 1.00 24.03 C ATOM 1146 OG1 THR E 164 0.465 47.994 4.827 1.00 23.72 O ATOM 1147 CG2 THR E 164 -0.783 49.965 4.652 1.00 24.59 C ATOM 1148 N VAL E 165 4.086 49.124 4.315 1.00 22.36 N ATOM 1149 CA VAL E 165 5.420 48.758 4.847 1.00 22.59 C ATOM 1150 C VAL E 165 6.067 49.979 5.508 1.00 23.50 C ATOM 1151 O VAL E 165 6.146 51.050 4.893 1.00 24.21 O ATOM 1152 CB VAL E 165 6.390 48.214 3.711 1.00 22.73 C ATOM 1153 CG1 VAL E 165 7.790 47.746 4.302 1.00 21.61 C ATOM 1154 CG2 VAL E 165 5.750 47.106 2.862 1.00 19.23 C ATOM 1155 N GLY E 166 6.512 49.846 6.761 1.00 23.75 N ATOM 1156 CA GLY E 166 7.202 50.944 7.444 1.00 23.97 C ATOM 1157 C GLY E 166 8.721 50.867 7.278 1.00 24.29 C ATOM 1158 O GLY E 166 9.215 49.957 6.632 1.00 25.11 O ATOM 1159 N TYR E 167 9.451 51.834 7.828 1.00 24.14 N ATOM 1160 CA TYR E 167 10.920 51.909 7.740 1.00 24.01 C ATOM 1161 C TYR E 167 11.537 51.317 9.016 1.00 23.15 C ATOM 1162 O TYR E 167 10.969 51.497 10.050 1.00 21.56 O ATOM 1163 CB TYR E 167 11.331 53.400 7.684 1.00 24.54 C ATOM 1164 CG TYR E 167 10.832 54.101 6.445 1.00 26.30 C ATOM 1165 CD1 TYR E 167 11.631 54.188 5.313 1.00 29.85 C ATOM 1166 CD2 TYR E 167 9.554 54.660 6.401 1.00 29.13 C ATOM 1167 CE1 TYR E 167 11.180 54.836 4.153 1.00 31.41 C ATOM 1168 CE2 TYR E 167 9.090 55.304 5.254 1.00 30.28 C ATOM 1169 CZ TYR E 167 9.907 55.402 4.135 1.00 33.04 C ATOM 1170 OH TYR E 167 9.435 56.042 2.960 1.00 35.03 O ATOM 1171 N PRO E 168 12.709 50.669 8.968 1.00 23.00 N ATOM 1172 CA PRO E 168 13.538 50.535 7.753 1.00 21.72 C ATOM 1173 C PRO E 168 13.184 49.428 6.762 1.00 22.14 C ATOM 1174 O PRO E 168 13.801 49.368 5.696 1.00 20.57 O ATOM 1175 CB PRO E 168 14.964 50.346 8.310 1.00 22.62 C ATOM 1176 CG PRO E 168 14.751 49.806 9.774 1.00 22.97 C ATOM 1177 CD PRO E 168 13.319 50.052 10.166 1.00 21.83 C ATOM 1178 N GLY E 169 12.194 48.586 7.052 1.00 21.80 N ATOM 1179 CA GLY E 169 11.774 47.605 6.060 1.00 21.78 C ATOM 1180 C GLY E 169 11.543 48.095 4.622 1.00 22.15 C ATOM 1181 O GLY E 169 11.822 47.383 3.678 1.00 21.64 O ATOM 1182 N LYS E 170 11.023 49.317 4.458 1.00 22.84 N ATOM 1183 CA LYS E 170 10.769 49.885 3.136 1.00 23.46 C ATOM 1184 C LYS E 170 12.049 50.105 2.274 1.00 23.64 C ATOM 1185 O LYS E 170 11.962 50.138 1.036 1.00 24.09 O ATOM 1186 CB LYS E 170 10.011 51.218 3.278 1.00 25.20 C ATOM 1187 CG LYS E 170 8.844 51.387 2.278 1.00 28.63 C ATOM 1188 CD LYS E 170 7.999 52.628 2.624 1.00 30.78 C ATOM 1189 CE LYS E 170 7.185 53.060 1.454 1.00 33.80 C ATOM 1190 NZ LYS E 170 6.114 54.025 1.876 1.00 35.75 N ATOM 1191 N TYR E 171 13.229 50.209 2.888 1.00 22.45 N ATOM 1192 CA TYR E 171 14.467 50.343 2.067 1.00 23.29 C ATOM 1193 C TYR E 171 14.825 49.107 1.208 1.00 24.34 C ATOM 1194 O TYR E 171 14.741 47.962 1.690 1.00 22.96 O ATOM 1195 CB TYR E 171 15.649 50.761 2.956 1.00 22.62 C ATOM 1196 CG TYR E 171 15.429 52.109 3.592 1.00 22.65 C ATOM 1197 CD1 TYR E 171 15.111 53.236 2.810 1.00 24.64 C ATOM 1198 CD2 TYR E 171 15.555 52.269 4.981 1.00 20.11 C ATOM 1199 CE1 TYR E 171 14.898 54.528 3.410 1.00 25.94 C ATOM 1200 CE2 TYR E 171 15.355 53.514 5.584 1.00 25.38 C ATOM 1201 CZ TYR E 171 15.019 54.634 4.801 1.00 25.52 C ATOM 1202 OH TYR E 171 14.841 55.814 5.481 1.00 28.49 O ATOM 1203 N PRO E 172 15.189 49.305 -0.067 1.00 24.70 N ATOM 1204 CA PRO E 172 15.551 48.165 -0.927 1.00 24.96 C ATOM 1205 C PRO E 172 16.719 47.330 -0.350 1.00 24.72 C ATOM 1206 O PRO E 172 16.867 46.113 -0.656 1.00 23.91 O ATOM 1207 CB PRO E 172 15.986 48.834 -2.267 1.00 24.71 C ATOM 1208 CG PRO E 172 15.255 50.107 -2.290 1.00 25.68 C ATOM 1209 CD PRO E 172 15.210 50.588 -0.798 1.00 25.73 C ATOM 1210 N SER E 173 17.561 47.988 0.446 1.00 23.42 N ATOM 1211 CA SER E 173 18.695 47.276 1.049 1.00 23.17 C ATOM 1212 C SER E 173 18.272 46.263 2.164 1.00 21.56 C ATOM 1213 O SER E 173 19.067 45.390 2.532 1.00 20.71 O ATOM 1214 CB SER E 173 19.790 48.226 1.536 1.00 20.81 C ATOM 1215 OG SER E 173 19.241 49.099 2.461 1.00 25.88 O ATOM 1216 N VAL E 174 17.019 46.362 2.641 1.00 21.61 N ATOM 1217 CA VAL E 174 16.561 45.586 3.789 1.00 19.60 C ATOM 1218 C VAL E 174 15.594 44.489 3.346 1.00 19.91 C ATOM 1219 O VAL E 174 14.756 44.737 2.461 1.00 21.49 O ATOM 1220 CB VAL E 174 15.904 46.478 4.868 1.00 20.62 C ATOM 1221 CG1 VAL E 174 15.578 45.644 6.158 1.00 18.13 C ATOM 1222 CG2 VAL E 174 16.784 47.670 5.246 1.00 17.44 C ATOM 1223 N ILE E 175 15.771 43.253 3.846 1.00 18.20 N ATOM 1224 CA ILE E 175 14.746 42.202 3.651 1.00 17.71 C ATOM 1225 C ILE E 175 13.606 42.487 4.596 1.00 18.22 C ATOM 1226 O ILE E 175 13.770 42.390 5.865 1.00 16.36 O ATOM 1227 CB ILE E 175 15.293 40.791 3.879 1.00 16.81 C ATOM 1228 CG1 ILE E 175 16.611 40.650 3.143 1.00 17.10 C ATOM 1229 CG2 ILE E 175 14.200 39.724 3.472 1.00 19.70 C ATOM 1230 CD1 ILE E 175 17.627 39.562 3.620 1.00 17.15 C ATOM 1231 N ALA E 176 12.481 42.889 3.995 1.00 17.42 N ATOM 1232 CA ALA E 176 11.247 43.160 4.751 1.00 17.92 C ATOM 1233 C ALA E 176 10.330 41.908 4.871 1.00 17.20 C ATOM 1234 O ALA E 176 9.981 41.241 3.889 1.00 17.33 O ATOM 1235 CB ALA E 176 10.516 44.394 4.171 1.00 16.96 C ATOM 1236 N VAL E 177 9.996 41.538 6.106 1.00 17.25 N ATOM 1237 CA VAL E 177 9.381 40.221 6.346 1.00 15.47 C ATOM 1238 C VAL E 177 7.933 40.381 6.843 1.00 15.68 C ATOM 1239 O VAL E 177 7.683 41.019 7.848 1.00 16.68 O ATOM 1240 CB VAL E 177 10.189 39.355 7.349 1.00 16.16 C ATOM 1241 CG1 VAL E 177 9.551 37.906 7.483 1.00 12.07 C ATOM 1242 CG2 VAL E 177 11.680 39.259 6.900 1.00 12.92 C ATOM 1243 N GLY E 178 7.009 39.758 6.152 1.00 16.82 N ATOM 1244 CA GLY E 178 5.603 39.716 6.595 1.00 16.35 C ATOM 1245 C GLY E 178 5.268 38.404 7.276 1.00 16.77 C ATOM 1246 O GLY E 178 6.092 37.432 7.322 1.00 16.38 O ATOM 1247 N ALA E 179 4.045 38.347 7.803 1.00 15.42 N ATOM 1248 CA ALA E 179 3.649 37.266 8.699 1.00 16.87 C ATOM 1249 C ALA E 179 2.586 36.359 8.137 1.00 16.90 C ATOM 1250 O ALA E 179 1.499 36.857 7.740 1.00 18.03 O ATOM 1251 CB ALA E 179 3.126 37.875 10.030 1.00 12.79 C ATOM 1252 N VAL E 180 2.835 35.049 8.194 1.00 18.50 N ATOM 1253 CA VAL E 180 1.786 34.057 7.913 1.00 21.14 C ATOM 1254 C VAL E 180 1.470 33.286 9.213 1.00 23.05 C ATOM 1255 O VAL E 180 2.161 33.450 10.210 1.00 23.53 O ATOM 1256 CB VAL E 180 2.131 33.057 6.751 1.00 20.06 C ATOM 1257 CG1 VAL E 180 2.222 33.766 5.400 1.00 20.27 C ATOM 1258 CG2 VAL E 180 3.426 32.294 7.031 1.00 22.42 C ATOM 1259 N ASP E 181 0.413 32.455 9.154 1.00 24.25 N ATOM 1260 CA ASP E 181 0.021 31.533 10.203 1.00 26.44 C ATOM 1261 C ASP E 181 0.438 30.123 9.792 1.00 25.52 C ATOM 1262 O ASP E 181 1.004 29.947 8.716 1.00 27.39 O ATOM 1263 CB ASP E 181 -1.498 31.621 10.438 1.00 26.87 C ATOM 1264 CG ASP E 181 -2.318 31.033 9.273 1.00 29.87 C ATOM 1265 OD1 ASP E 181 -1.768 30.234 8.461 1.00 29.40 O ATOM 1266 OD2 ASP E 181 -3.529 31.351 9.089 1.00 35.14 O ATOM 1267 N SER E 182 0.149 29.128 10.630 1.00 25.81 N ATOM 1268 CA SER E 182 0.489 27.716 10.383 1.00 26.89 C ATOM 1269 C SER E 182 -0.154 27.084 9.154 1.00 27.64 C ATOM 1270 O SER E 182 0.208 25.940 8.741 1.00 27.49 O ATOM 1271 CB SER E 182 0.151 26.847 11.608 1.00 28.34 C ATOM 1272 OG SER E 182 -1.261 26.669 11.739 1.00 31.80 O ATOM 1273 N SER E 183 -1.079 27.817 8.547 1.00 28.12 N ATOM 1274 CA SER E 183 -1.656 27.387 7.277 1.00 28.09 C ATOM 1275 C SER E 183 -1.134 28.087 6.031 1.00 28.19 C ATOM 1276 O SER E 183 -1.651 27.840 4.922 1.00 28.23 O ATOM 1277 CB SER E 183 -3.184 27.467 7.344 1.00 29.80 C ATOM 1278 OG SER E 183 -3.663 26.123 7.534 1.00 32.91 O ATOM 1279 N ASN E 184 -0.074 28.903 6.198 1.00 26.08 N ATOM 1280 CA ASN E 184 0.490 29.744 5.145 1.00 25.56 C ATOM 1281 C ASN E 184 -0.435 30.835 4.671 1.00 24.77 C ATOM 1282 O ASN E 184 -0.281 31.283 3.565 1.00 24.50 O ATOM 1283 CB ASN E 184 1.052 28.968 3.929 1.00 26.55 C ATOM 1284 CG ASN E 184 2.135 27.972 4.307 1.00 27.33 C ATOM 1285 OD1 ASN E 184 2.674 27.998 5.439 1.00 26.95 O ATOM 1286 ND2 ASN E 184 2.459 27.086 3.380 1.00 23.30 N ATOM 1287 N GLN E 185 -1.420 31.209 5.493 1.00 24.63 N ATOM 1288 CA GLN E 185 -2.303 32.349 5.219 1.00 24.16 C ATOM 1289 C GLN E 185 -1.750 33.631 5.809 1.00 22.74 C ATOM 1290 O GLN E 185 -1.327 33.660 6.967 1.00 21.94 O ATOM 1291 CB GLN E 185 -3.745 32.102 5.737 1.00 24.58 C ATOM 1292 CG AGLN E 185 -4.520 31.070 4.902 0.50 23.79 C ATOM 1293 CG BGLN E 185 -4.611 33.380 5.839 0.50 26.85 C ATOM 1294 CD AGLN E 185 -6.037 31.123 5.096 0.50 24.51 C ATOM 1295 CD BGLN E 185 -4.811 34.134 4.515 0.50 30.46 C ATOM 1296 OE1AGLN E 185 -6.547 31.433 6.195 0.50 22.57 O ATOM 1297 OE1BGLN E 185 -4.648 33.562 3.429 0.50 33.55 O ATOM 1298 NE2AGLN E 185 -6.758 30.818 4.033 0.50 18.52 N ATOM 1299 NE2BGLN E 185 -5.180 35.431 4.608 0.50 30.35 N ATOM 1300 N ARG E 186 -1.784 34.709 5.032 1.00 21.36 N ATOM 1301 CA ARG E 186 -1.316 35.989 5.552 1.00 20.56 C ATOM 1302 C ARG E 186 -2.104 36.411 6.813 1.00 20.55 C ATOM 1303 O ARG E 186 -3.365 36.342 6.839 1.00 19.95 O ATOM 1304 CB ARG E 186 -1.423 37.003 4.420 1.00 21.16 C ATOM 1305 CG ARG E 186 -1.122 38.420 4.764 1.00 21.37 C ATOM 1306 CD ARG E 186 -1.509 39.383 3.648 1.00 25.45 C ATOM 1307 NE ARG E 186 -1.692 40.696 4.224 1.00 24.93 N ATOM 1308 CZ ARG E 186 -2.855 41.211 4.638 1.00 22.02 C ATOM 1309 NH1 ARG E 186 -4.054 40.593 4.529 1.00 19.58 N ATOM 1310 NH2 ARG E 186 -2.805 42.381 5.146 1.00 21.99 N ATOM 1311 N ALA E 187 -1.421 36.883 7.853 1.00 20.46 N ATOM 1312 CA ALA E 187 -2.145 37.370 9.047 1.00 21.69 C ATOM 1313 C ALA E 187 -2.801 38.721 8.709 1.00 22.93 C ATOM 1314 O ALA E 187 -2.253 39.478 7.878 1.00 22.84 O ATOM 1315 CB ALA E 187 -1.195 37.549 10.213 1.00 21.57 C ATOM 1316 N SER E 188 -3.955 39.030 9.319 1.00 23.23 N ATOM 1317 CA SER E 188 -4.745 40.228 8.925 1.00 24.29 C ATOM 1318 C SER E 188 -3.928 41.504 9.120 1.00 24.24 C ATOM 1319 O SER E 188 -4.062 42.454 8.370 1.00 25.69 O ATOM 1320 CB SER E 188 -6.026 40.345 9.771 1.00 24.82 C ATOM 1321 OG SER E 188 -5.668 40.562 11.180 1.00 27.13 O ATOM 1322 N PHE E 189 -3.143 41.564 10.197 1.00 25.06 N ATOM 1323 CA PHE E 189 -2.372 42.787 10.516 1.00 23.65 C ATOM 1324 C PHE E 189 -1.161 43.018 9.561 1.00 23.73 C ATOM 1325 O PHE E 189 -0.600 44.114 9.515 1.00 23.55 O ATOM 1326 CB PHE E 189 -1.904 42.740 11.990 1.00 23.39 C ATOM 1327 CG PHE E 189 -1.117 41.526 12.313 1.00 21.41 C ATOM 1328 CD1 PHE E 189 0.235 41.421 11.922 1.00 20.93 C ATOM 1329 CD2 PHE E 189 -1.697 40.471 12.990 1.00 24.00 C ATOM 1330 CE1 PHE E 189 0.991 40.297 12.184 1.00 19.60 C ATOM 1331 CE2 PHE E 189 -0.947 39.326 13.292 1.00 26.86 C ATOM 1332 CZ PHE E 189 0.414 39.222 12.853 1.00 22.17 C ATOM 1333 N SER E 190 -0.757 42.001 8.810 1.00 24.16 N ATOM 1334 CA SER E 190 0.576 42.024 8.130 1.00 25.02 C ATOM 1335 C SER E 190 0.588 43.107 7.043 1.00 24.85 C ATOM 1336 O SER E 190 -0.379 43.210 6.270 1.00 25.60 O ATOM 1337 CB SER E 190 0.910 40.615 7.556 1.00 24.43 C ATOM 1338 OG SER E 190 2.162 40.583 6.870 1.00 23.80 O ATOM 1339 N SER E 191 1.628 43.955 7.023 1.00 22.88 N ATOM 1340 CA SER E 191 1.725 45.066 6.071 1.00 21.67 C ATOM 1341 C SER E 191 1.956 44.532 4.652 1.00 21.84 C ATOM 1342 O SER E 191 2.465 43.432 4.479 1.00 19.33 O ATOM 1343 CB SER E 191 2.880 46.020 6.476 1.00 21.79 C ATOM 1344 OG SER E 191 2.555 46.988 7.494 1.00 21.48 O ATOM 1345 N VAL E 192 1.579 45.331 3.632 1.00 21.40 N ATOM 1346 CA VAL E 192 1.640 44.955 2.220 1.00 20.68 C ATOM 1347 C VAL E 192 2.278 46.078 1.374 1.00 22.79 C ATOM 1348 O VAL E 192 2.364 47.231 1.829 1.00 22.64 O ATOM 1349 CB VAL E 192 0.202 44.741 1.618 1.00 20.92 C ATOM 1350 CG1 VAL E 192 -0.446 43.526 2.219 1.00 16.75 C ATOM 1351 CG2 VAL E 192 -0.698 46.024 1.825 1.00 21.87 C ATOM 1352 N GLY E 193 2.701 45.744 0.145 1.00 23.85 N ATOM 1353 CA GLY E 193 3.285 46.727 -0.741 1.00 25.88 C ATOM 1354 C GLY E 193 4.435 46.146 -1.539 1.00 26.58 C ATOM 1355 O GLY E 193 4.873 45.009 -1.282 1.00 27.85 O ATOM 1356 N PRO E 194 4.882 46.876 -2.561 1.00 27.40 N ATOM 1357 CA PRO E 194 6.006 46.415 -3.413 1.00 27.17 C ATOM 1358 C PRO E 194 7.346 46.124 -2.666 1.00 26.29 C ATOM 1359 O PRO E 194 8.104 45.257 -3.078 1.00 26.48 O ATOM 1360 CB PRO E 194 6.170 47.553 -4.442 1.00 27.62 C ATOM 1361 CG PRO E 194 5.303 48.704 -3.915 1.00 30.30 C ATOM 1362 CD PRO E 194 4.261 48.131 -3.032 1.00 26.11 C ATOM 1363 N GLU E 195 7.569 46.813 -1.551 1.00 26.72 N ATOM 1364 CA GLU E 195 8.743 46.662 -0.682 1.00 27.52 C ATOM 1365 C GLU E 195 8.747 45.384 0.180 1.00 26.73 C ATOM 1366 O GLU E 195 9.759 45.108 0.848 1.00 25.48 O ATOM 1367 CB GLU E 195 8.853 47.881 0.249 1.00 27.71 C ATOM 1368 CG GLU E 195 8.785 49.217 -0.508 1.00 31.64 C ATOM 1369 CD GLU E 195 7.356 49.697 -0.746 1.00 34.42 C ATOM 1370 OE1 GLU E 195 6.396 49.030 -0.267 1.00 35.13 O ATOM 1371 OE2 GLU E 195 7.198 50.737 -1.421 1.00 36.77 O ATOM 1372 N LEU E 196 7.631 44.627 0.179 1.00 24.80 N ATOM 1373 CA LEU E 196 7.535 43.410 0.990 1.00 24.84 C ATOM 1374 C LEU E 196 8.347 42.287 0.327 1.00 24.97 C ATOM 1375 O LEU E 196 8.131 42.030 -0.862 1.00 25.70 O ATOM 1376 CB LEU E 196 6.035 43.059 1.254 1.00 23.93 C ATOM 1377 CG LEU E 196 5.688 41.723 1.872 1.00 23.95 C ATOM 1378 CD1 LEU E 196 6.114 41.746 3.407 1.00 26.06 C ATOM 1379 CD2 LEU E 196 4.182 41.473 1.735 1.00 18.03 C ATOM 1380 N ASP E 197 9.303 41.636 1.025 1.00 23.37 N ATOM 1381 CA ASP E 197 10.198 40.684 0.310 1.00 22.77 C ATOM 1382 C ASP E 197 9.825 39.182 0.447 1.00 21.63 C ATOM 1383 O ASP E 197 9.737 38.430 -0.565 1.00 19.97 O ATOM 1384 CB ASP E 197 11.681 40.948 0.690 1.00 22.79 C ATOM 1385 CG ASP E 197 12.121 42.436 0.393 1.00 27.27 C ATOM 1386 OD1 ASP E 197 12.240 42.766 -0.827 1.00 27.62 O ATOM 1387 OD2 ASP E 197 12.294 43.377 1.258 1.00 24.58 O ATOM 1388 N VAL E 198 9.634 38.756 1.703 1.00 20.70 N ATOM 1389 CA VAL E 198 9.309 37.363 2.075 1.00 20.25 C ATOM 1390 C VAL E 198 8.319 37.247 3.257 1.00 19.97 C ATOM 1391 O VAL E 198 8.044 38.224 3.943 1.00 21.34 O ATOM 1392 CB VAL E 198 10.602 36.556 2.435 1.00 19.74 C ATOM 1393 CG1 VAL E 198 11.582 36.431 1.213 1.00 18.65 C ATOM 1394 CG2 VAL E 198 11.305 37.105 3.687 1.00 17.15 C ATOM 1395 N MET E 199 7.829 36.035 3.513 1.00 20.38 N ATOM 1396 CA MET E 199 6.913 35.773 4.616 1.00 19.23 C ATOM 1397 C MET E 199 7.532 34.757 5.563 1.00 18.50 C ATOM 1398 O MET E 199 8.286 33.872 5.143 1.00 20.11 O ATOM 1399 CB MET E 199 5.593 35.188 4.075 1.00 19.81 C ATOM 1400 CG MET E 199 4.854 36.100 3.068 1.00 21.02 C ATOM 1401 SD MET E 199 4.490 37.724 3.700 1.00 22.27 S ATOM 1402 CE MET E 199 2.794 37.621 4.187 1.00 16.77 C ATOM 1403 N ALA E 200 7.209 34.851 6.859 1.00 18.34 N ATOM 1404 CA ALA E 200 7.594 33.818 7.752 1.00 16.77 C ATOM 1405 C ALA E 200 6.527 33.717 8.883 1.00 18.31 C ATOM 1406 O ALA E 200 5.676 34.573 9.006 1.00 16.77 O ATOM 1407 CB ALA E 200 8.986 34.102 8.271 1.00 17.13 C ATOM 1408 N PRO E 201 6.546 32.651 9.694 1.00 17.02 N ATOM 1409 CA PRO E 201 5.486 32.483 10.715 1.00 16.84 C ATOM 1410 C PRO E 201 5.482 33.649 11.673 1.00 15.36 C ATOM 1411 O PRO E 201 6.545 33.986 12.150 1.00 15.87 O ATOM 1412 CB PRO E 201 5.876 31.168 11.423 1.00 16.14 C ATOM 1413 CG PRO E 201 6.651 30.429 10.268 1.00 14.54 C ATOM 1414 CD PRO E 201 7.516 31.536 9.707 1.00 16.42 C ATOM 1415 N GLY E 202 4.314 34.239 11.924 1.00 14.26 N ATOM 1416 CA GLY E 202 4.123 35.413 12.756 1.00 15.71 C ATOM 1417 C GLY E 202 2.918 35.362 13.745 1.00 17.13 C ATOM 1418 O GLY E 202 2.562 36.343 14.391 1.00 15.83 O ATOM 1419 N VAL E 203 2.278 34.206 13.838 1.00 18.39 N ATOM 1420 CA VAL E 203 1.012 34.114 14.561 1.00 19.38 C ATOM 1421 C VAL E 203 1.188 33.070 15.682 1.00 18.04 C ATOM 1422 O VAL E 203 1.603 31.949 15.418 1.00 19.36 O ATOM 1423 CB VAL E 203 -0.150 33.746 13.603 1.00 19.60 C ATOM 1424 CG1 VAL E 203 -1.435 33.269 14.422 1.00 20.59 C ATOM 1425 CG2 VAL E 203 -0.491 34.873 12.651 1.00 17.76 C ATOM 1426 N SER E 204 0.973 33.477 16.924 1.00 17.91 N ATOM 1427 CA SER E 204 1.069 32.538 18.064 1.00 17.81 C ATOM 1428 C SER E 204 2.418 31.846 18.112 1.00 15.76 C ATOM 1429 O SER E 204 2.553 30.622 18.090 1.00 13.07 O ATOM 1430 CB SER E 204 -0.110 31.527 18.001 1.00 20.04 C ATOM 1431 OG SER E 204 -0.284 30.809 19.209 1.00 26.93 O ATOM 1432 N ILE E 205 3.478 32.655 18.133 1.00 15.14 N ATOM 1433 CA ILE E 205 4.810 32.069 18.141 1.00 13.38 C ATOM 1434 C ILE E 205 5.291 31.971 19.629 1.00 14.97 C ATOM 1435 O ILE E 205 5.483 33.028 20.320 1.00 15.10 O ATOM 1436 CB ILE E 205 5.737 33.041 17.392 1.00 14.98 C ATOM 1437 CG1 ILE E 205 5.278 33.210 15.893 1.00 15.61 C ATOM 1438 CG2 ILE E 205 7.278 32.737 17.656 1.00 13.07 C ATOM 1439 CD1 ILE E 205 5.184 31.912 15.054 1.00 15.74 C ATOM 1440 N GLN E 206 5.570 30.756 20.075 1.00 15.21 N ATOM 1441 CA GLN E 206 6.157 30.543 21.435 1.00 18.48 C ATOM 1442 C GLN E 206 7.666 30.862 21.436 1.00 17.50 C ATOM 1443 O GLN E 206 8.445 30.381 20.565 1.00 16.18 O ATOM 1444 CB GLN E 206 5.966 29.083 21.925 1.00 18.38 C ATOM 1445 CG GLN E 206 4.497 28.723 22.222 1.00 27.57 C ATOM 1446 CD GLN E 206 4.029 29.155 23.606 1.00 32.79 C ATOM 1447 OE1 GLN E 206 4.846 29.307 24.520 1.00 33.83 O ATOM 1448 NE2 GLN E 206 2.694 29.307 23.773 1.00 37.34 N ATOM 1449 N SER E 207 8.092 31.632 22.435 1.00 17.56 N ATOM 1450 CA SER E 207 9.505 31.889 22.626 1.00 17.54 C ATOM 1451 C SER E 207 9.773 32.229 24.078 1.00 18.62 C ATOM 1452 O SER E 207 8.871 32.138 24.907 1.00 17.23 O ATOM 1453 CB SER E 207 10.004 32.989 21.636 1.00 19.80 C ATOM 1454 OG SER E 207 11.422 33.063 21.651 1.00 17.86 O ATOM 1455 N THR E 208 11.018 32.603 24.373 1.00 18.60 N ATOM 1456 CA THR E 208 11.505 32.866 25.718 1.00 18.03 C ATOM 1457 C THR E 208 11.028 34.222 26.152 1.00 19.26 C ATOM 1458 O THR E 208 10.964 35.142 25.338 1.00 18.45 O ATOM 1459 CB THR E 208 13.077 32.944 25.692 1.00 18.75 C ATOM 1460 OG1 THR E 208 13.494 33.606 24.468 1.00 17.95 O ATOM 1461 CG2 THR E 208 13.687 31.539 25.636 1.00 16.69 C ATOM 1462 N LEU E 209 10.789 34.384 27.460 1.00 18.67 N ATOM 1463 CA LEU E 209 10.326 35.649 28.014 1.00 20.10 C ATOM 1464 C LEU E 209 11.066 35.876 29.365 1.00 20.92 C ATOM 1465 O LEU E 209 11.438 34.900 30.002 1.00 19.35 O ATOM 1466 CB LEU E 209 8.808 35.595 28.257 1.00 21.03 C ATOM 1467 CG LEU E 209 7.791 35.780 27.117 1.00 21.28 C ATOM 1468 CD1 LEU E 209 6.365 35.650 27.630 1.00 24.18 C ATOM 1469 CD2 LEU E 209 7.999 37.159 26.479 1.00 21.77 C ATOM 1470 N PRO E 210 11.337 37.124 29.740 1.00 21.94 N ATOM 1471 CA PRO E 210 12.222 37.388 30.869 1.00 24.92 C ATOM 1472 C PRO E 210 11.699 36.710 32.158 1.00 25.79 C ATOM 1473 O PRO E 210 10.471 36.542 32.362 1.00 26.50 O ATOM 1474 CB PRO E 210 12.189 38.917 30.995 1.00 24.42 C ATOM 1475 CG PRO E 210 11.858 39.387 29.629 1.00 25.05 C ATOM 1476 CD PRO E 210 10.772 38.383 29.207 1.00 22.49 C ATOM 1477 N GLY E 211 12.653 36.258 32.970 1.00 27.48 N ATOM 1478 CA GLY E 211 12.366 35.622 34.236 1.00 28.64 C ATOM 1479 C GLY E 211 12.054 34.151 34.087 1.00 29.68 C ATOM 1480 O GLY E 211 11.131 33.671 34.746 1.00 30.93 O ATOM 1481 N ASN E 212 12.779 33.439 33.221 1.00 29.40 N ATOM 1482 CA ASN E 212 12.519 32.011 32.986 1.00 29.96 C ATOM 1483 C ASN E 212 11.079 31.679 32.563 1.00 29.77 C ATOM 1484 O ASN E 212 10.551 30.629 32.920 1.00 29.90 O ATOM 1485 CB ASN E 212 12.925 31.188 34.218 1.00 30.77 C ATOM 1486 CG ASN E 212 13.036 29.720 33.925 1.00 34.82 C ATOM 1487 OD1 ASN E 212 13.290 29.308 32.768 1.00 36.56 O ATOM 1488 ND2 ASN E 212 12.818 28.896 34.960 1.00 29.64 N ATOM 1489 N LYS E 213 10.439 32.574 31.806 1.00 27.99 N ATOM 1490 CA LYS E 213 9.103 32.302 31.298 1.00 27.28 C ATOM 1491 C LYS E 213 9.126 31.863 29.787 1.00 25.71 C ATOM 1492 O LYS E 213 10.149 31.961 29.122 1.00 23.28 O ATOM 1493 CB LYS E 213 8.194 33.516 31.540 1.00 27.19 C ATOM 1494 CG LYS E 213 8.042 33.983 33.026 1.00 31.70 C ATOM 1495 CD LYS E 213 6.961 35.078 33.188 1.00 34.00 C ATOM 1496 CE LYS E 213 7.473 36.353 33.931 1.00 43.15 C ATOM 1497 NZ LYS E 213 8.713 36.265 34.847 1.00 43.20 N ATOM 1498 N TYR E 214 8.006 31.321 29.288 1.00 25.75 N ATOM 1499 CA TYR E 214 7.755 31.156 27.831 1.00 24.30 C ATOM 1500 C TYR E 214 6.336 31.648 27.516 1.00 24.83 C ATOM 1501 O TYR E 214 5.477 31.730 28.420 1.00 23.61 O ATOM 1502 CB TYR E 214 7.962 29.705 27.421 1.00 24.45 C ATOM 1503 CG TYR E 214 9.304 29.161 27.838 1.00 25.97 C ATOM 1504 CD1 TYR E 214 10.387 29.171 26.957 1.00 22.26 C ATOM 1505 CD2 TYR E 214 9.510 28.643 29.160 1.00 27.24 C ATOM 1506 CE1 TYR E 214 11.636 28.671 27.341 1.00 23.09 C ATOM 1507 CE2 TYR E 214 10.764 28.148 29.559 1.00 25.23 C ATOM 1508 CZ TYR E 214 11.826 28.196 28.667 1.00 25.39 C ATOM 1509 OH TYR E 214 13.063 27.701 29.053 1.00 24.63 O ATOM 1510 N GLY E 215 6.058 31.983 26.253 1.00 24.11 N ATOM 1511 CA GLY E 215 4.867 32.772 25.909 1.00 23.67 C ATOM 1512 C GLY E 215 4.767 32.900 24.406 1.00 24.40 C ATOM 1513 O GLY E 215 5.795 32.880 23.725 1.00 23.57 O ATOM 1514 N ALA E 216 3.529 32.968 23.901 1.00 24.05 N ATOM 1515 CA ALA E 216 3.238 33.077 22.471 1.00 24.16 C ATOM 1516 C ALA E 216 2.950 34.557 22.171 1.00 24.23 C ATOM 1517 O ALA E 216 2.328 35.222 22.986 1.00 25.31 O ATOM 1518 CB ALA E 216 2.053 32.187 22.095 1.00 25.20 C ATOM 1519 N TYR E 217 3.464 35.097 21.047 1.00 22.32 N ATOM 1520 CA TYR E 217 3.215 36.491 20.656 1.00 20.69 C ATOM 1521 C TYR E 217 2.863 36.455 19.162 1.00 18.94 C ATOM 1522 O TYR E 217 3.207 35.477 18.525 1.00 17.66 O ATOM 1523 CB TYR E 217 4.475 37.345 20.872 1.00 20.90 C ATOM 1524 CG TYR E 217 4.774 37.974 22.257 1.00 26.23 C ATOM 1525 CD1 TYR E 217 4.001 37.690 23.406 1.00 31.35 C ATOM 1526 CD2 TYR E 217 5.838 38.880 22.394 1.00 26.53 C ATOM 1527 CE1 TYR E 217 4.286 38.296 24.670 1.00 31.88 C ATOM 1528 CE2 TYR E 217 6.132 39.477 23.605 1.00 33.73 C ATOM 1529 CZ TYR E 217 5.358 39.185 24.756 1.00 35.87 C ATOM 1530 OH TYR E 217 5.682 39.800 25.955 1.00 36.17 O ATOM 1531 N ASN E 218 2.172 37.498 18.648 1.00 17.43 N ATOM 1532 CA ASN E 218 1.906 37.750 17.202 1.00 19.38 C ATOM 1533 C ASN E 218 2.590 39.035 16.717 1.00 18.29 C ATOM 1534 O ASN E 218 2.792 39.978 17.489 1.00 17.83 O ATOM 1535 CB ASN E 218 0.387 37.913 16.930 1.00 18.60 C ATOM 1536 CG ASN E 218 -0.422 36.911 17.708 1.00 24.43 C ATOM 1537 OD1 ASN E 218 -0.398 35.726 17.399 1.00 26.52 O ATOM 1538 ND2 ASN E 218 -1.042 37.366 18.814 1.00 28.36 N ATOM 1539 N GLY E 219 2.905 39.066 15.430 1.00 18.60 N ATOM 1540 CA GLY E 219 3.408 40.296 14.841 1.00 18.10 C ATOM 1541 C GLY E 219 4.456 40.003 13.801 1.00 17.47 C ATOM 1542 O GLY E 219 5.051 38.905 13.805 1.00 16.57 O ATOM 1543 N THR E 220 4.631 40.927 12.857 1.00 17.28 N ATOM 1544 CA THR E 220 5.813 40.841 11.977 1.00 16.96 C ATOM 1545 C THR E 220 7.161 40.906 12.742 1.00 16.52 C ATOM 1546 O THR E 220 8.207 40.490 12.190 1.00 17.45 O ATOM 1547 CB THR E 220 5.761 41.863 10.804 1.00 16.64 C ATOM 1548 OG1 THR E 220 5.665 43.216 11.305 1.00 14.47 O ATOM 1549 CG2 THR E 220 4.512 41.608 9.948 1.00 17.68 C ATOM 1550 N SER E 221 7.151 41.384 13.996 1.00 15.06 N ATOM 1551 CA SER E 221 8.335 41.211 14.906 1.00 15.62 C ATOM 1552 C SER E 221 8.793 39.756 15.131 1.00 15.69 C ATOM 1553 O SER E 221 9.965 39.527 15.420 1.00 12.99 O ATOM 1554 CB SER E 221 8.007 41.710 16.336 1.00 15.22 C ATOM 1555 OG SER E 221 8.317 43.094 16.508 1.00 16.55 O ATOM 1556 N MET E 222 7.824 38.811 15.105 1.00 14.10 N ATOM 1557 CA MET E 222 8.055 37.382 15.346 1.00 14.92 C ATOM 1558 C MET E 222 8.408 36.686 14.021 1.00 15.12 C ATOM 1559 O MET E 222 9.054 35.623 14.032 1.00 16.70 O ATOM 1560 CB MET E 222 6.764 36.738 15.934 1.00 15.20 C ATOM 1561 CG MET E 222 6.491 37.023 17.493 1.00 18.38 C ATOM 1562 SD MET E 222 6.183 38.819 17.903 1.00 24.14 S ATOM 1563 CE MET E 222 7.796 39.175 18.650 1.00 18.12 C ATOM 1564 N ALA E 223 7.964 37.255 12.881 1.00 13.40 N ATOM 1565 CA ALA E 223 8.293 36.663 11.582 1.00 12.92 C ATOM 1566 C ALA E 223 9.764 36.987 11.241 1.00 12.79 C ATOM 1567 O ALA E 223 10.535 36.109 10.861 1.00 12.22 O ATOM 1568 CB ALA E 223 7.310 37.133 10.448 1.00 12.26 C ATOM 1569 N SER E 224 10.162 38.251 11.371 1.00 13.02 N ATOM 1570 CA SER E 224 11.570 38.643 11.076 1.00 13.17 C ATOM 1571 C SER E 224 12.718 37.719 11.632 1.00 12.87 C ATOM 1572 O SER E 224 13.612 37.349 10.864 1.00 12.76 O ATOM 1573 CB SER E 224 11.757 40.115 11.420 1.00 13.86 C ATOM 1574 OG SER E 224 13.041 40.616 11.147 1.00 18.56 O ATOM 1575 N PRO E 225 12.763 37.375 12.957 1.00 12.50 N ATOM 1576 CA PRO E 225 13.844 36.505 13.471 1.00 10.90 C ATOM 1577 C PRO E 225 13.902 35.106 12.865 1.00 12.67 C ATOM 1578 O PRO E 225 14.986 34.441 12.952 1.00 13.07 O ATOM 1579 CB PRO E 225 13.561 36.448 15.042 1.00 10.69 C ATOM 1580 CG PRO E 225 12.067 36.927 15.233 1.00 11.72 C ATOM 1581 CD PRO E 225 11.915 37.881 14.047 1.00 11.26 C ATOM 1582 N HIS E 226 12.763 34.570 12.379 1.00 13.12 N ATOM 1583 CA HIS E 226 12.834 33.332 11.560 1.00 15.01 C ATOM 1584 C HIS E 226 13.796 33.435 10.368 1.00 14.34 C ATOM 1585 O HIS E 226 14.535 32.497 10.092 1.00 12.99 O ATOM 1586 CB HIS E 226 11.445 32.860 11.035 1.00 14.63 C ATOM 1587 CG HIS E 226 10.548 32.329 12.117 1.00 15.72 C ATOM 1588 ND1 HIS E 226 9.684 33.133 12.838 1.00 17.58 N ATOM 1589 CD2 HIS E 226 10.363 31.060 12.583 1.00 18.86 C ATOM 1590 CE1 HIS E 226 8.986 32.387 13.682 1.00 13.37 C ATOM 1591 NE2 HIS E 226 9.401 31.125 13.575 1.00 15.62 N ATOM 1592 N VAL E 227 13.766 34.577 9.687 1.00 15.24 N ATOM 1593 CA VAL E 227 14.590 34.849 8.503 1.00 14.31 C ATOM 1594 C VAL E 227 16.017 35.218 8.914 1.00 15.57 C ATOM 1595 O VAL E 227 16.943 34.764 8.261 1.00 16.25 O ATOM 1596 CB VAL E 227 13.984 35.994 7.665 1.00 15.94 C ATOM 1597 CG1 VAL E 227 14.797 36.240 6.416 1.00 13.09 C ATOM 1598 CG2 VAL E 227 12.481 35.659 7.224 1.00 13.04 C ATOM 1599 N ALA E 228 16.197 35.931 10.053 1.00 14.57 N ATOM 1600 CA ALA E 228 17.540 36.303 10.511 1.00 14.10 C ATOM 1601 C ALA E 228 18.216 35.013 10.904 1.00 13.41 C ATOM 1602 O ALA E 228 19.408 34.840 10.677 1.00 13.46 O ATOM 1603 CB ALA E 228 17.477 37.258 11.684 1.00 10.90 C ATOM 1604 N GLY E 229 17.453 34.116 11.511 1.00 14.91 N ATOM 1605 CA GLY E 229 18.001 32.805 11.948 1.00 14.09 C ATOM 1606 C GLY E 229 18.319 31.965 10.729 1.00 15.65 C ATOM 1607 O GLY E 229 19.324 31.242 10.717 1.00 17.36 O ATOM 1608 N ALA E 230 17.447 32.007 9.713 1.00 16.04 N ATOM 1609 CA ALA E 230 17.673 31.230 8.479 1.00 16.43 C ATOM 1610 C ALA E 230 19.004 31.642 7.805 1.00 16.32 C ATOM 1611 O ALA E 230 19.785 30.805 7.373 1.00 16.44 O ATOM 1612 CB ALA E 230 16.541 31.388 7.520 1.00 15.38 C ATOM 1613 N ALA E 231 19.224 32.942 7.693 1.00 16.39 N ATOM 1614 CA ALA E 231 20.514 33.492 7.216 1.00 15.85 C ATOM 1615 C ALA E 231 21.729 32.903 7.959 1.00 16.03 C ATOM 1616 O ALA E 231 22.725 32.600 7.346 1.00 18.19 O ATOM 1617 CB ALA E 231 20.500 35.059 7.294 1.00 13.00 C ATOM 1618 N ALA E 232 21.656 32.815 9.293 1.00 14.20 N ATOM 1619 CA ALA E 232 22.721 32.253 10.093 1.00 12.88 C ATOM 1620 C ALA E 232 22.939 30.775 9.800 1.00 12.47 C ATOM 1621 O ALA E 232 24.102 30.328 9.763 1.00 11.96 O ATOM 1622 CB ALA E 232 22.445 32.478 11.692 1.00 10.97 C ATOM 1623 N LEU E 233 21.865 30.010 9.621 1.00 11.17 N ATOM 1624 CA LEU E 233 22.029 28.625 9.142 1.00 15.09 C ATOM 1625 C LEU E 233 22.750 28.489 7.780 1.00 15.80 C ATOM 1626 O LEU E 233 23.676 27.672 7.615 1.00 16.60 O ATOM 1627 CB LEU E 233 20.673 27.879 9.074 1.00 14.99 C ATOM 1628 CG LEU E 233 19.918 27.660 10.397 1.00 15.49 C ATOM 1629 CD1 LEU E 233 18.551 26.957 10.133 1.00 11.92 C ATOM 1630 CD2 LEU E 233 20.647 26.832 11.455 1.00 21.09 C ATOM 1631 N ILE E 234 22.338 29.297 6.817 1.00 16.58 N ATOM 1632 CA ILE E 234 22.967 29.293 5.492 1.00 16.68 C ATOM 1633 C ILE E 234 24.476 29.637 5.620 1.00 18.13 C ATOM 1634 O ILE E 234 25.357 28.926 5.023 1.00 16.35 O ATOM 1635 CB ILE E 234 22.182 30.263 4.568 1.00 17.49 C ATOM 1636 CG1 ILE E 234 20.795 29.670 4.252 1.00 18.36 C ATOM 1637 CG2 ILE E 234 22.911 30.543 3.212 1.00 16.34 C ATOM 1638 CD1 ILE E 234 19.829 30.678 3.546 1.00 21.80 C ATOM 1639 N LEU E 235 24.812 30.599 6.498 1.00 18.44 N ATOM 1640 CA LEU E 235 26.236 31.007 6.651 1.00 19.14 C ATOM 1641 C LEU E 235 27.037 29.948 7.410 1.00 20.43 C ATOM 1642 O LEU E 235 28.244 29.845 7.277 1.00 20.01 O ATOM 1643 CB LEU E 235 26.381 32.351 7.328 1.00 18.11 C ATOM 1644 CG LEU E 235 26.026 33.613 6.508 1.00 19.27 C ATOM 1645 CD1 LEU E 235 25.705 34.933 7.351 1.00 18.89 C ATOM 1646 CD2 LEU E 235 27.043 33.836 5.364 1.00 19.56 C ATOM 1647 N SER E 236 26.365 29.130 8.199 1.00 22.05 N ATOM 1648 CA SER E 236 27.136 28.121 8.918 1.00 23.58 C ATOM 1649 C SER E 236 27.511 26.940 7.995 1.00 23.43 C ATOM 1650 O SER E 236 28.529 26.280 8.191 1.00 23.72 O ATOM 1651 CB SER E 236 26.469 27.741 10.271 1.00 23.10 C ATOM 1652 OG SER E 236 25.494 26.747 10.104 1.00 26.36 O ATOM 1653 N LYS E 237 26.697 26.719 6.973 1.00 22.81 N ATOM 1654 CA LYS E 237 26.962 25.748 5.940 1.00 22.82 C ATOM 1655 C LYS E 237 27.784 26.314 4.815 1.00 23.15 C ATOM 1656 O LYS E 237 28.611 25.565 4.235 1.00 23.70 O ATOM 1657 CB LYS E 237 25.636 25.167 5.401 1.00 23.85 C ATOM 1658 CG LYS E 237 25.736 24.071 4.321 1.00 22.25 C ATOM 1659 CD LYS E 237 24.342 23.675 3.889 1.00 17.98 C ATOM 1660 CE LYS E 237 24.274 22.273 3.394 1.00 27.19 C ATOM 1661 NZ LYS E 237 24.221 22.257 1.906 1.00 33.72 N ATOM 1662 N HIS E 238 27.572 27.592 4.472 1.00 21.59 N ATOM 1663 CA HIS E 238 28.374 28.276 3.454 1.00 22.44 C ATOM 1664 C HIS E 238 29.063 29.589 3.904 1.00 23.54 C ATOM 1665 O HIS E 238 28.665 30.695 3.458 1.00 22.27 O ATOM 1666 CB HIS E 238 27.567 28.550 2.171 1.00 23.46 C ATOM 1667 CG HIS E 238 26.862 27.345 1.611 1.00 24.59 C ATOM 1668 ND1 HIS E 238 27.510 26.379 0.864 1.00 28.48 N ATOM 1669 CD2 HIS E 238 25.562 26.968 1.666 1.00 24.36 C ATOM 1670 CE1 HIS E 238 26.639 25.455 0.490 1.00 27.80 C ATOM 1671 NE2 HIS E 238 25.445 25.798 0.953 1.00 26.40 N ATOM 1672 N PRO E 239 30.084 29.463 4.751 1.00 24.00 N ATOM 1673 CA PRO E 239 30.685 30.641 5.447 1.00 25.28 C ATOM 1674 C PRO E 239 31.370 31.581 4.474 1.00 25.82 C ATOM 1675 O PRO E 239 31.630 32.751 4.799 1.00 27.04 O ATOM 1676 CB PRO E 239 31.696 30.015 6.433 1.00 24.48 C ATOM 1677 CG PRO E 239 32.000 28.594 5.849 1.00 25.91 C ATOM 1678 CD PRO E 239 30.738 28.179 5.125 1.00 24.00 C ATOM 1679 N ASN E 240 31.622 31.059 3.278 1.00 26.17 N ATOM 1680 CA ASN E 240 32.197 31.786 2.163 1.00 26.97 C ATOM 1681 C ASN E 240 31.222 32.644 1.383 1.00 26.10 C ATOM 1682 O ASN E 240 31.669 33.526 0.684 1.00 26.08 O ATOM 1683 CB ASN E 240 32.953 30.821 1.191 1.00 28.70 C ATOM 1684 CG ASN E 240 32.031 29.716 0.585 1.00 29.05 C ATOM 1685 OD1 ASN E 240 31.251 29.032 1.311 1.00 24.40 O ATOM 1686 ND2 ASN E 240 32.120 29.546 -0.749 1.00 29.21 N ATOM 1687 N TRP E 241 29.906 32.399 1.480 1.00 23.96 N ATOM 1688 CA TRP E 241 28.911 33.256 0.794 1.00 22.28 C ATOM 1689 C TRP E 241 28.787 34.688 1.340 1.00 21.10 C ATOM 1690 O TRP E 241 28.889 34.928 2.579 1.00 20.04 O ATOM 1691 CB TRP E 241 27.510 32.625 0.796 1.00 21.85 C ATOM 1692 CG TRP E 241 27.352 31.338 0.005 1.00 21.74 C ATOM 1693 CD1 TRP E 241 28.328 30.620 -0.675 1.00 21.98 C ATOM 1694 CD2 TRP E 241 26.119 30.631 -0.213 1.00 24.35 C ATOM 1695 NE1 TRP E 241 27.767 29.523 -1.283 1.00 24.46 N ATOM 1696 CE2 TRP E 241 26.413 29.506 -1.022 1.00 23.41 C ATOM 1697 CE3 TRP E 241 24.780 30.847 0.194 1.00 25.35 C ATOM 1698 CZ2 TRP E 241 25.440 28.581 -1.401 1.00 26.50 C ATOM 1699 CZ3 TRP E 241 23.807 29.922 -0.183 1.00 26.70 C ATOM 1700 CH2 TRP E 241 24.147 28.805 -0.995 1.00 25.38 C ATOM 1701 N THR E 242 28.535 35.612 0.423 1.00 20.04 N ATOM 1702 CA THR E 242 28.329 37.030 0.733 1.00 21.34 C ATOM 1703 C THR E 242 26.864 37.210 1.179 1.00 20.59 C ATOM 1704 O THR E 242 26.027 36.277 0.996 1.00 19.91 O ATOM 1705 CB THR E 242 28.615 37.960 -0.548 1.00 22.15 C ATOM 1706 OG1 THR E 242 27.708 37.612 -1.570 1.00 23.04 O ATOM 1707 CG2 THR E 242 30.035 37.729 -1.233 1.00 22.42 C ATOM 1708 N ASN E 243 26.551 38.388 1.754 1.00 20.46 N ATOM 1709 CA ASN E 243 25.152 38.826 1.994 1.00 18.08 C ATOM 1710 C ASN E 243 24.294 38.778 0.684 1.00 18.81 C ATOM 1711 O ASN E 243 23.158 38.249 0.653 1.00 19.46 O ATOM 1712 CB ASN E 243 25.061 40.157 2.818 1.00 16.74 C ATOM 1713 CG ASN E 243 25.767 41.362 2.167 1.00 18.31 C ATOM 1714 OD1 ASN E 243 26.626 41.205 1.292 1.00 22.00 O ATOM 1715 ND2 ASN E 243 25.392 42.570 2.590 1.00 17.97 N ATOM 1716 N THR E 244 24.881 39.170 -0.432 1.00 19.58 N ATOM 1717 CA THR E 244 24.159 39.104 -1.707 1.00 19.72 C ATOM 1718 C THR E 244 23.665 37.704 -1.969 1.00 19.20 C ATOM 1719 O THR E 244 22.470 37.507 -2.257 1.00 20.62 O ATOM 1720 CB THR E 244 25.024 39.608 -2.853 1.00 21.69 C ATOM 1721 OG1 THR E 244 25.718 40.789 -2.421 1.00 22.88 O ATOM 1722 CG2 THR E 244 24.072 40.116 -4.045 1.00 23.18 C ATOM 1723 N GLN E 245 24.541 36.728 -1.765 1.00 17.46 N ATOM 1724 CA GLN E 245 24.225 35.330 -2.049 1.00 19.00 C ATOM 1725 C GLN E 245 23.248 34.701 -1.088 1.00 18.64 C ATOM 1726 O GLN E 245 22.430 33.835 -1.465 1.00 19.33 O ATOM 1727 CB GLN E 245 25.519 34.473 -2.107 1.00 19.61 C ATOM 1728 CG GLN E 245 26.362 34.730 -3.375 1.00 24.55 C ATOM 1729 CD GLN E 245 27.811 34.222 -3.227 1.00 30.23 C ATOM 1730 OE1 GLN E 245 28.470 34.408 -2.181 1.00 27.55 O ATOM 1731 NE2 GLN E 245 28.269 33.522 -4.242 1.00 30.57 N ATOM 1732 N VAL E 246 23.408 35.035 0.190 1.00 16.78 N ATOM 1733 CA VAL E 246 22.468 34.574 1.146 1.00 15.82 C ATOM 1734 C VAL E 246 21.088 35.102 0.831 1.00 15.39 C ATOM 1735 O VAL E 246 20.141 34.331 0.744 1.00 16.14 O ATOM 1736 CB VAL E 246 22.879 35.041 2.596 1.00 14.69 C ATOM 1737 CG1 VAL E 246 21.792 34.558 3.616 1.00 15.69 C ATOM 1738 CG2 VAL E 246 24.235 34.452 2.949 1.00 13.28 C ATOM 1739 N ARG E 247 20.958 36.423 0.690 1.00 16.30 N ATOM 1740 CA ARG E 247 19.642 37.008 0.358 1.00 17.23 C ATOM 1741 C ARG E 247 19.001 36.380 -0.877 1.00 19.27 C ATOM 1742 O ARG E 247 17.795 35.991 -0.852 1.00 18.45 O ATOM 1743 CB ARG E 247 19.715 38.523 0.152 1.00 17.37 C ATOM 1744 CG ARG E 247 18.393 39.140 -0.085 1.00 16.46 C ATOM 1745 CD ARG E 247 18.439 40.665 -0.333 1.00 20.59 C ATOM 1746 NE ARG E 247 17.069 41.069 -0.599 1.00 18.59 N ATOM 1747 CZ ARG E 247 16.597 42.290 -0.514 1.00 19.46 C ATOM 1748 NH1 ARG E 247 17.405 43.285 -0.195 1.00 19.67 N ATOM 1749 NH2 ARG E 247 15.301 42.500 -0.735 1.00 22.28 N ATOM 1750 N SER E 248 19.785 36.240 -1.950 1.00 19.07 N ATOM 1751 CA SER E 248 19.214 35.683 -3.190 1.00 20.30 C ATOM 1752 C SER E 248 18.856 34.175 -3.057 1.00 21.89 C ATOM 1753 O SER E 248 17.809 33.717 -3.600 1.00 22.70 O ATOM 1754 CB SER E 248 20.082 36.034 -4.439 1.00 20.45 C ATOM 1755 OG ASER E 248 19.839 35.169 -5.513 0.50 18.95 O ATOM 1756 OG BSER E 248 21.196 35.202 -4.616 0.50 19.46 O ATOM 1757 N SER E 249 19.609 33.435 -2.253 1.00 21.22 N ATOM 1758 CA SER E 249 19.231 32.032 -2.063 1.00 21.77 C ATOM 1759 C SER E 249 17.861 31.893 -1.304 1.00 22.41 C ATOM 1760 O SER E 249 17.051 30.997 -1.603 1.00 21.32 O ATOM 1761 CB SER E 249 20.346 31.216 -1.432 1.00 21.02 C ATOM 1762 OG SER E 249 20.428 31.442 -0.002 1.00 24.72 O ATOM 1763 N LEU E 250 17.613 32.770 -0.335 1.00 23.49 N ATOM 1764 CA LEU E 250 16.321 32.798 0.362 1.00 23.71 C ATOM 1765 C LEU E 250 15.182 33.247 -0.584 1.00 24.05 C ATOM 1766 O LEU E 250 14.109 32.631 -0.618 1.00 22.42 O ATOM 1767 CB LEU E 250 16.369 33.745 1.569 1.00 22.76 C ATOM 1768 CG LEU E 250 17.140 33.212 2.779 1.00 22.17 C ATOM 1769 CD1 LEU E 250 17.577 34.361 3.686 1.00 20.65 C ATOM 1770 CD2 LEU E 250 16.361 32.135 3.500 1.00 18.68 C ATOM 1771 N GLU E 251 15.427 34.312 -1.347 1.00 24.70 N ATOM 1772 CA GLU E 251 14.369 34.854 -2.198 1.00 26.53 C ATOM 1773 C GLU E 251 14.007 33.904 -3.359 1.00 26.69 C ATOM 1774 O GLU E 251 12.841 33.870 -3.784 1.00 27.45 O ATOM 1775 CB GLU E 251 14.681 36.278 -2.671 1.00 27.91 C ATOM 1776 CG GLU E 251 14.621 37.286 -1.515 1.00 31.19 C ATOM 1777 CD GLU E 251 14.690 38.765 -1.934 1.00 37.51 C ATOM 1778 OE1 GLU E 251 14.583 39.102 -3.136 1.00 43.80 O ATOM 1779 OE2 GLU E 251 14.845 39.623 -1.053 1.00 39.07 O ATOM 1780 N ASN E 252 14.948 33.067 -3.788 1.00 25.30 N ATOM 1781 CA ASN E 252 14.745 32.229 -4.987 1.00 26.32 C ATOM 1782 C ASN E 252 14.215 30.837 -4.664 1.00 26.55 C ATOM 1783 O ASN E 252 13.914 30.086 -5.598 1.00 26.77 O ATOM 1784 CB ASN E 252 16.028 32.072 -5.834 1.00 26.16 C ATOM 1785 CG ASN E 252 16.356 33.313 -6.665 1.00 27.89 C ATOM 1786 OD1 ASN E 252 15.463 34.011 -7.186 1.00 27.94 O ATOM 1787 ND2 ASN E 252 17.656 33.618 -6.771 1.00 29.84 N ATOM 1788 N THR E 253 14.124 30.463 -3.374 1.00 23.84 N ATOM 1789 CA THR E 253 13.705 29.106 -3.037 1.00 23.13 C ATOM 1790 C THR E 253 12.418 29.067 -2.166 1.00 23.32 C ATOM 1791 O THR E 253 12.099 28.042 -1.540 1.00 22.36 O ATOM 1792 CB THR E 253 14.842 28.332 -2.320 1.00 24.28 C ATOM 1793 OG1 THR E 253 15.272 29.071 -1.152 1.00 22.30 O ATOM 1794 CG2 THR E 253 16.159 28.151 -3.248 1.00 23.99 C ATOM 1795 N THR E 254 11.689 30.176 -2.118 1.00 22.08 N ATOM 1796 CA THR E 254 10.528 30.264 -1.246 1.00 21.94 C ATOM 1797 C THR E 254 9.468 29.275 -1.786 1.00 23.06 C ATOM 1798 O THR E 254 9.530 28.860 -2.988 1.00 22.15 O ATOM 1799 CB THR E 254 9.907 31.636 -1.344 1.00 21.10 C ATOM 1800 OG1 THR E 254 9.753 31.937 -2.761 1.00 20.39 O ATOM 1801 CG2 THR E 254 10.789 32.754 -0.752 1.00 16.26 C ATOM 1802 N THR E 255 8.478 28.952 -0.936 1.00 24.13 N ATOM 1803 CA THR E 255 7.208 28.330 -1.388 1.00 24.29 C ATOM 1804 C THR E 255 6.314 29.464 -1.786 1.00 25.67 C ATOM 1805 O THR E 255 5.923 30.302 -0.948 1.00 23.86 O ATOM 1806 CB THR E 255 6.512 27.504 -0.266 1.00 24.88 C ATOM 1807 OG1 THR E 255 7.331 26.381 0.062 1.00 26.16 O ATOM 1808 CG2 THR E 255 5.241 26.810 -0.776 1.00 25.50 C ATOM 1809 N LYS E 256 5.992 29.519 -3.072 1.00 26.42 N ATOM 1810 CA LYS E 256 5.196 30.626 -3.580 1.00 29.49 C ATOM 1811 C LYS E 256 3.796 30.560 -3.025 1.00 30.28 C ATOM 1812 O LYS E 256 3.188 29.488 -2.947 1.00 30.50 O ATOM 1813 CB LYS E 256 5.141 30.618 -5.123 1.00 29.76 C ATOM 1814 CG LYS E 256 6.448 31.140 -5.723 1.00 33.68 C ATOM 1815 CD LYS E 256 6.721 30.614 -7.120 1.00 36.55 C ATOM 1816 CE LYS E 256 8.198 30.854 -7.445 1.00 36.72 C ATOM 1817 NZ LYS E 256 8.997 29.587 -7.411 1.00 35.90 N ATOM 1818 N LEU E 257 3.277 31.727 -2.669 1.00 31.29 N ATOM 1819 CA LEU E 257 1.931 31.829 -2.132 1.00 32.28 C ATOM 1820 C LEU E 257 1.148 32.820 -3.027 1.00 33.23 C ATOM 1821 O LEU E 257 1.349 32.830 -4.261 1.00 34.48 O ATOM 1822 CB LEU E 257 2.004 32.238 -0.635 1.00 30.93 C ATOM 1823 CG LEU E 257 2.859 31.347 0.286 1.00 30.57 C ATOM 1824 CD1 LEU E 257 3.004 31.975 1.703 1.00 26.92 C ATOM 1825 CD2 LEU E 257 2.355 29.905 0.405 1.00 28.92 C ATOM 1826 N GLY E 258 0.289 33.661 -2.462 1.00 33.35 N ATOM 1827 CA GLY E 258 -0.443 34.622 -3.299 1.00 33.85 C ATOM 1828 C GLY E 258 0.321 35.681 -4.141 1.00 33.64 C ATOM 1829 O GLY E 258 1.541 35.573 -4.478 1.00 33.25 O ATOM 1830 N ASP E 259 -0.456 36.703 -4.509 1.00 32.34 N ATOM 1831 CA ASP E 259 0.029 37.958 -5.080 1.00 31.43 C ATOM 1832 C ASP E 259 1.204 38.546 -4.277 1.00 29.31 C ATOM 1833 O ASP E 259 1.114 38.675 -3.038 1.00 29.09 O ATOM 1834 CB ASP E 259 -1.147 38.944 -5.115 1.00 30.99 C ATOM 1835 N SER E 260 2.288 38.879 -4.968 1.00 28.17 N ATOM 1836 CA SER E 260 3.517 39.472 -4.372 1.00 29.15 C ATOM 1837 C SER E 260 3.278 40.757 -3.550 1.00 28.23 C ATOM 1838 O SER E 260 4.017 41.089 -2.592 1.00 28.64 O ATOM 1839 CB SER E 260 4.550 39.784 -5.471 1.00 30.23 C ATOM 1840 OG SER E 260 4.195 40.998 -6.124 1.00 34.74 O ATOM 1841 N PHE E 261 2.246 41.497 -3.912 1.00 26.73 N ATOM 1842 CA PHE E 261 1.899 42.695 -3.155 1.00 25.22 C ATOM 1843 C PHE E 261 1.500 42.303 -1.697 1.00 24.41 C ATOM 1844 O PHE E 261 1.777 43.058 -0.768 1.00 23.86 O ATOM 1845 CB PHE E 261 0.853 43.465 -3.942 1.00 25.38 C ATOM 1846 CG PHE E 261 0.405 44.764 -3.330 1.00 26.00 C ATOM 1847 CD1 PHE E 261 0.975 45.976 -3.734 1.00 26.49 C ATOM 1848 CD2 PHE E 261 -0.638 44.790 -2.419 1.00 22.94 C ATOM 1849 CE1 PHE E 261 0.554 47.196 -3.183 1.00 25.85 C ATOM 1850 CE2 PHE E 261 -1.049 46.003 -1.850 1.00 27.11 C ATOM 1851 CZ PHE E 261 -0.452 47.221 -2.263 1.00 27.21 C ATOM 1852 N TYR E 262 0.882 41.119 -1.513 1.00 24.30 N ATOM 1853 CA TYR E 262 0.428 40.628 -0.203 1.00 23.43 C ATOM 1854 C TYR E 262 1.383 39.613 0.481 1.00 23.42 C ATOM 1855 O TYR E 262 1.427 39.527 1.744 1.00 22.56 O ATOM 1856 CB TYR E 262 -0.982 39.990 -0.304 1.00 24.76 C ATOM 1857 CG TYR E 262 -2.039 40.982 -0.752 1.00 27.34 C ATOM 1858 CD1 TYR E 262 -2.673 41.826 0.169 1.00 29.98 C ATOM 1859 CD2 TYR E 262 -2.390 41.110 -2.122 1.00 31.16 C ATOM 1860 CE1 TYR E 262 -3.621 42.748 -0.248 1.00 32.27 C ATOM 1861 CE2 TYR E 262 -3.327 42.037 -2.534 1.00 31.81 C ATOM 1862 CZ TYR E 262 -3.940 42.845 -1.590 1.00 35.97 C ATOM 1863 OH TYR E 262 -4.878 43.785 -1.968 1.00 41.78 O ATOM 1864 N TYR E 263 2.133 38.863 -0.334 1.00 22.12 N ATOM 1865 CA TYR E 263 2.991 37.774 0.122 1.00 22.89 C ATOM 1866 C TYR E 263 4.488 37.890 -0.253 1.00 22.05 C ATOM 1867 O TYR E 263 5.255 37.000 0.049 1.00 22.81 O ATOM 1868 CB TYR E 263 2.434 36.437 -0.389 1.00 23.11 C ATOM 1869 CG TYR E 263 1.118 35.960 0.240 1.00 26.40 C ATOM 1870 CD1 TYR E 263 -0.128 36.344 -0.264 1.00 28.34 C ATOM 1871 CD2 TYR E 263 1.136 35.126 1.371 1.00 28.74 C ATOM 1872 CE1 TYR E 263 -1.341 35.864 0.326 1.00 31.37 C ATOM 1873 CE2 TYR E 263 -0.026 34.679 1.967 1.00 29.91 C ATOM 1874 CZ TYR E 263 -1.271 35.034 1.444 1.00 32.50 C ATOM 1875 OH TYR E 263 -2.402 34.544 2.082 1.00 30.94 O ATOM 1876 N GLY E 264 4.940 38.993 -0.865 1.00 22.50 N ATOM 1877 CA GLY E 264 6.319 39.032 -1.403 1.00 21.70 C ATOM 1878 C GLY E 264 6.587 37.791 -2.267 1.00 21.15 C ATOM 1879 O GLY E 264 5.686 37.252 -2.889 1.00 21.15 O ATOM 1880 N LYS E 265 7.801 37.275 -2.254 1.00 21.44 N ATOM 1881 CA LYS E 265 8.080 36.043 -2.983 1.00 21.09 C ATOM 1882 C LYS E 265 7.507 34.759 -2.368 1.00 20.13 C ATOM 1883 O LYS E 265 7.654 33.691 -2.964 1.00 22.55 O ATOM 1884 CB LYS E 265 9.602 35.901 -3.248 1.00 21.26 C ATOM 1885 CG LYS E 265 10.286 37.245 -3.562 1.00 25.06 C ATOM 1886 CD LYS E 265 11.116 37.191 -4.836 1.00 29.54 C ATOM 1887 CE LYS E 265 11.458 38.598 -5.318 1.00 34.03 C ATOM 1888 NZ LYS E 265 10.232 39.346 -5.758 1.00 36.42 N ATOM 1889 N GLY E 266 7.005 34.795 -1.131 1.00 20.23 N ATOM 1890 CA GLY E 266 6.399 33.623 -0.487 1.00 19.26 C ATOM 1891 C GLY E 266 7.069 33.240 0.837 1.00 18.74 C ATOM 1892 O GLY E 266 7.817 34.050 1.388 1.00 18.14 O ATOM 1893 N LEU E 267 6.861 32.002 1.308 1.00 18.04 N ATOM 1894 CA LEU E 267 7.367 31.591 2.645 1.00 18.59 C ATOM 1895 C LEU E 267 8.775 31.049 2.424 1.00 18.01 C ATOM 1896 O LEU E 267 9.011 30.284 1.451 1.00 16.36 O ATOM 1897 CB LEU E 267 6.498 30.516 3.264 1.00 18.54 C ATOM 1898 CG LEU E 267 7.045 29.688 4.410 1.00 21.00 C ATOM 1899 CD1 LEU E 267 6.924 30.516 5.660 1.00 12.07 C ATOM 1900 CD2 LEU E 267 6.276 28.303 4.487 1.00 23.65 C ATOM 1901 N ILE E 268 9.695 31.445 3.316 1.00 16.96 N ATOM 1902 CA ILE E 268 11.069 30.974 3.215 1.00 16.98 C ATOM 1903 C ILE E 268 11.148 29.481 3.501 1.00 17.84 C ATOM 1904 O ILE E 268 10.301 28.912 4.248 1.00 19.30 O ATOM 1905 CB ILE E 268 12.062 31.810 4.059 1.00 16.90 C ATOM 1906 CG1 ILE E 268 11.728 31.735 5.579 1.00 15.71 C ATOM 1907 CG2 ILE E 268 12.166 33.278 3.567 1.00 15.45 C ATOM 1908 CD1 ILE E 268 13.013 31.627 6.407 1.00 15.54 C ATOM 1909 N ASN E 269 12.162 28.857 2.902 1.00 18.54 N ATOM 1910 CA ASN E 269 12.466 27.423 3.032 1.00 18.86 C ATOM 1911 C ASN E 269 14.003 27.317 3.127 1.00 18.43 C ATOM 1912 O ASN E 269 14.727 27.347 2.103 1.00 18.08 O ATOM 1913 CB ASN E 269 11.988 26.634 1.783 1.00 20.22 C ATOM 1914 CG ASN E 269 12.324 25.121 1.856 1.00 19.91 C ATOM 1915 OD1 ASN E 269 13.146 24.651 2.652 1.00 21.89 O ATOM 1916 ND2 ASN E 269 11.675 24.373 1.017 1.00 19.98 N ATOM 1917 N VAL E 270 14.504 27.166 4.332 1.00 16.67 N ATOM 1918 CA VAL E 270 15.961 27.297 4.526 1.00 17.58 C ATOM 1919 C VAL E 270 16.707 26.053 4.066 1.00 17.70 C ATOM 1920 O VAL E 270 17.913 26.150 3.744 1.00 17.28 O ATOM 1921 CB VAL E 270 16.323 27.713 5.979 1.00 17.28 C ATOM 1922 CG1 VAL E 270 15.887 26.657 6.937 1.00 18.61 C ATOM 1923 CG2 VAL E 270 17.858 28.031 6.174 1.00 16.40 C ATOM 1924 N GLN E 271 16.004 24.905 4.058 1.00 17.82 N ATOM 1925 CA GLN E 271 16.559 23.651 3.579 1.00 19.99 C ATOM 1926 C GLN E 271 16.845 23.811 2.077 1.00 20.78 C ATOM 1927 O GLN E 271 17.977 23.545 1.595 1.00 21.46 O ATOM 1928 CB GLN E 271 15.552 22.483 3.810 1.00 21.45 C ATOM 1929 CG GLN E 271 16.100 21.085 3.365 1.00 24.99 C ATOM 1930 CD GLN E 271 15.057 19.986 3.405 1.00 28.72 C ATOM 1931 OE1 GLN E 271 13.850 20.262 3.478 1.00 31.32 O ATOM 1932 NE2 GLN E 271 15.516 18.718 3.349 1.00 31.11 N ATOM 1933 N ALA E 272 15.863 24.293 1.340 1.00 20.82 N ATOM 1934 CA ALA E 272 16.070 24.583 -0.101 1.00 20.76 C ATOM 1935 C ALA E 272 17.099 25.715 -0.317 1.00 20.92 C ATOM 1936 O ALA E 272 18.012 25.571 -1.135 1.00 21.39 O ATOM 1937 CB ALA E 272 14.749 24.854 -0.826 1.00 20.64 C ATOM 1938 N ALA E 273 17.023 26.797 0.455 1.00 20.75 N ATOM 1939 CA ALA E 273 17.978 27.921 0.254 1.00 21.54 C ATOM 1940 C ALA E 273 19.453 27.475 0.414 1.00 22.97 C ATOM 1941 O ALA E 273 20.303 27.899 -0.350 1.00 22.45 O ATOM 1942 CB ALA E 273 17.689 29.072 1.199 1.00 20.35 C ATOM 1943 N ALA E 274 19.707 26.639 1.420 1.00 24.08 N ATOM 1944 CA ALA E 274 21.031 26.077 1.730 1.00 26.79 C ATOM 1945 C ALA E 274 21.578 25.019 0.749 1.00 28.62 C ATOM 1946 O ALA E 274 22.798 24.755 0.776 1.00 28.57 O ATOM 1947 CB ALA E 274 21.092 25.547 3.237 1.00 25.03 C ATOM 1948 N GLN E 275 20.714 24.432 -0.095 1.00 30.90 N ATOM 1949 CA GLN E 275 21.144 23.528 -1.192 1.00 34.00 C ATOM 1950 C GLN E 275 21.563 24.243 -2.482 1.00 34.74 C ATOM 1951 O GLN E 275 22.118 23.596 -3.367 1.00 35.14 O ATOM 1952 CB GLN E 275 20.032 22.545 -1.648 1.00 35.08 C ATOM 1953 CG GLN E 275 18.991 22.150 -0.650 1.00 38.98 C ATOM 1954 CD GLN E 275 19.299 20.799 0.000 1.00 43.43 C ATOM 1955 OE1 GLN E 275 20.467 20.524 0.372 1.00 44.91 O ATOM 1956 NE2 GLN E 275 18.257 19.957 0.150 1.00 41.22 N ATOM 1957 N HIS E 276 21.250 25.537 -2.631 1.00 35.54 N ATOM 1958 CA HIS E 276 21.586 26.292 -3.856 1.00 36.87 C ATOM 1959 C HIS E 276 23.065 26.172 -4.188 1.00 37.35 C ATOM 1960 O HIS E 276 23.894 26.099 -3.274 1.00 37.49 O ATOM 1961 CB HIS E 276 21.227 27.781 -3.715 1.00 37.36 C TER 1962 HIS E 276 ATOM 1963 N LYS I 21 -13.787 46.982 13.661 1.00 47.43 N ATOM 1964 CA LYS I 21 -13.181 48.336 13.906 1.00 47.98 C ATOM 1965 C LYS I 21 -11.696 48.340 14.417 1.00 47.86 C ATOM 1966 O LYS I 21 -11.410 47.935 15.557 1.00 47.45 O ATOM 1967 CB LYS I 21 -14.081 49.140 14.819 1.00 47.83 C ATOM 1968 CG LYS I 21 -14.415 50.502 14.260 1.00 48.96 C ATOM 1969 CD LYS I 21 -13.844 51.608 15.152 1.00 47.93 C ATOM 1970 CE LYS I 21 -13.472 52.857 14.350 1.00 48.68 C ATOM 1971 NZ LYS I 21 -14.001 54.105 15.011 1.00 49.62 N ATOM 1972 N THR I 22 -10.768 48.783 13.554 1.00 47.03 N ATOM 1973 CA THR I 22 -9.321 48.648 13.810 1.00 46.23 C ATOM 1974 C THR I 22 -8.437 49.913 13.675 1.00 45.63 C ATOM 1975 O THR I 22 -7.214 49.845 13.834 1.00 46.15 O ATOM 1976 CB THR I 22 -8.693 47.471 12.981 1.00 46.73 C ATOM 1977 OG1 THR I 22 -8.903 47.650 11.564 1.00 47.94 O ATOM 1978 CG2 THR I 22 -9.367 46.133 13.294 1.00 47.13 C ATOM 1979 N GLU I 23 -9.038 51.055 13.379 1.00 44.82 N ATOM 1980 CA GLU I 23 -8.309 52.306 13.162 1.00 43.93 C ATOM 1981 C GLU I 23 -9.322 53.429 13.229 1.00 43.87 C ATOM 1982 O GLU I 23 -10.469 53.215 12.822 1.00 43.71 O ATOM 1983 CB GLU I 23 -7.594 52.332 11.787 1.00 43.97 C ATOM 1984 CG GLU I 23 -8.393 51.863 10.577 1.00 43.78 C ATOM 1985 N TRP I 24 -8.887 54.613 13.693 1.00 43.31 N ATOM 1986 CA TRP I 24 -9.735 55.788 13.897 1.00 42.89 C ATOM 1987 C TRP I 24 -9.268 56.996 13.089 1.00 43.54 C ATOM 1988 O TRP I 24 -8.865 58.006 13.704 1.00 42.12 O ATOM 1989 CB TRP I 24 -9.747 56.202 15.372 1.00 43.71 C ATOM 1990 CG TRP I 24 -10.460 55.236 16.239 1.00 44.21 C ATOM 1991 CD1 TRP I 24 -11.774 55.285 16.612 1.00 46.80 C ATOM 1992 CD2 TRP I 24 -9.931 54.040 16.795 1.00 42.10 C ATOM 1993 NE1 TRP I 24 -12.096 54.193 17.375 1.00 42.75 N ATOM 1994 CE2 TRP I 24 -10.980 53.409 17.510 1.00 42.17 C ATOM 1995 CE3 TRP I 24 -8.669 53.427 16.771 1.00 40.84 C ATOM 1996 CZ2 TRP I 24 -10.803 52.199 18.210 1.00 39.50 C ATOM 1997 CZ3 TRP I 24 -8.493 52.232 17.454 1.00 41.89 C ATOM 1998 CH2 TRP I 24 -9.561 51.626 18.168 1.00 41.01 C ATOM 1999 N PRO I 25 -9.319 56.912 11.739 1.00 43.81 N ATOM 2000 CA PRO I 25 -9.009 58.068 10.867 1.00 44.67 C ATOM 2001 C PRO I 25 -9.661 59.338 11.393 1.00 44.97 C ATOM 2002 O PRO I 25 -9.052 60.418 11.459 1.00 45.24 O ATOM 2003 CB PRO I 25 -9.652 57.694 9.516 1.00 44.31 C ATOM 2004 CG PRO I 25 -9.690 56.150 9.494 1.00 45.69 C ATOM 2005 CD PRO I 25 -9.639 55.702 10.946 1.00 44.32 C ATOM 2006 N GLU I 26 -10.910 59.161 11.807 1.00 45.62 N ATOM 2007 CA GLU I 26 -11.761 60.211 12.358 1.00 46.16 C ATOM 2008 C GLU I 26 -11.163 60.966 13.558 1.00 45.42 C ATOM 2009 O GLU I 26 -11.748 61.961 13.978 1.00 44.89 O ATOM 2010 CB GLU I 26 -13.145 59.610 12.712 1.00 46.50 C ATOM 2011 CG GLU I 26 -13.080 58.386 13.632 1.00 48.35 C ATOM 2012 CD GLU I 26 -13.383 57.061 12.926 1.00 50.24 C ATOM 2013 OE1 GLU I 26 -12.479 56.474 12.288 1.00 51.07 O ATOM 2014 OE2 GLU I 26 -14.528 56.574 13.034 1.00 51.72 O ATOM 2015 N LEU I 27 -10.018 60.509 14.091 1.00 45.84 N ATOM 2016 CA LEU I 27 -9.375 61.161 15.264 1.00 46.67 C ATOM 2017 C LEU I 27 -8.154 62.104 14.999 1.00 46.74 C ATOM 2018 O LEU I 27 -7.503 62.575 15.943 1.00 45.44 O ATOM 2019 CB LEU I 27 -9.074 60.151 16.382 1.00 46.79 C ATOM 2020 CG LEU I 27 -10.254 59.740 17.281 1.00 48.64 C ATOM 2021 CD1 LEU I 27 -9.956 58.439 18.077 1.00 48.63 C ATOM 2022 CD2 LEU I 27 -10.689 60.884 18.216 1.00 48.25 C ATOM 2023 N VAL I 28 -7.876 62.355 13.715 1.00 48.39 N ATOM 2024 CA VAL I 28 -7.272 63.626 13.189 1.00 49.51 C ATOM 2025 C VAL I 28 -6.359 64.435 14.149 1.00 49.84 C ATOM 2026 O VAL I 28 -5.560 63.866 14.867 1.00 50.22 O ATOM 2027 CB VAL I 28 -8.369 64.564 12.493 1.00 49.26 C ATOM 2028 CG1 VAL I 28 -9.418 63.753 11.690 1.00 50.75 C ATOM 2029 CG2 VAL I 28 -9.084 65.464 13.465 1.00 50.09 C ATOM 2030 N GLY I 29 -6.454 65.763 14.130 1.00 50.34 N ATOM 2031 CA GLY I 29 -5.842 66.568 15.166 1.00 49.58 C ATOM 2032 C GLY I 29 -6.891 66.832 16.224 1.00 49.23 C ATOM 2033 O GLY I 29 -7.226 67.983 16.478 1.00 49.69 O ATOM 2034 N LYS I 30 -7.430 65.759 16.814 1.00 48.28 N ATOM 2035 CA LYS I 30 -8.279 65.877 17.994 1.00 47.09 C ATOM 2036 C LYS I 30 -7.357 65.800 19.196 1.00 46.41 C ATOM 2037 O LYS I 30 -6.248 65.267 19.082 1.00 45.90 O ATOM 2038 CB LYS I 30 -9.354 64.766 18.045 1.00 46.63 C ATOM 2039 CG LYS I 30 -10.260 64.681 16.817 1.00 46.26 C ATOM 2040 CD LYS I 30 -11.134 65.950 16.602 1.00 45.21 C ATOM 2041 CE LYS I 30 -12.154 65.758 15.455 1.00 47.36 C ATOM 2042 NZ LYS I 30 -13.459 65.138 15.881 1.00 46.91 N ATOM 2043 N SER I 31 -7.804 66.338 20.335 1.00 46.07 N ATOM 2044 CA SER I 31 -7.019 66.344 21.583 1.00 45.87 C ATOM 2045 C SER I 31 -6.833 64.932 22.162 1.00 45.85 C ATOM 2046 O SER I 31 -7.469 63.964 21.732 1.00 44.65 O ATOM 2047 CB SER I 31 -7.678 67.275 22.639 1.00 46.56 C ATOM 2048 OG SER I 31 -7.271 67.010 24.004 1.00 47.34 O ATOM 2049 N VAL I 32 -5.987 64.854 23.178 1.00 46.18 N ATOM 2050 CA VAL I 32 -5.814 63.643 23.971 1.00 47.24 C ATOM 2051 C VAL I 32 -7.154 63.047 24.470 1.00 46.72 C ATOM 2052 O VAL I 32 -7.415 61.835 24.328 1.00 46.26 O ATOM 2053 CB VAL I 32 -4.892 63.929 25.174 1.00 47.08 C ATOM 2054 CG1 VAL I 32 -5.660 64.677 26.314 1.00 47.85 C ATOM 2055 CG2 VAL I 32 -4.240 62.634 25.671 1.00 47.97 C ATOM 2056 N GLU I 33 -8.001 63.902 25.043 1.00 46.79 N ATOM 2057 CA GLU I 33 -9.161 63.401 25.769 1.00 46.38 C ATOM 2058 C GLU I 33 -10.213 62.910 24.772 1.00 46.26 C ATOM 2059 O GLU I 33 -10.753 61.806 24.950 1.00 46.57 O ATOM 2060 CB GLU I 33 -9.663 64.418 26.793 1.00 47.17 C ATOM 2061 CG GLU I 33 -8.586 64.845 27.792 1.00 47.10 C ATOM 2062 N GLU I 34 -10.430 63.669 23.697 1.00 44.82 N ATOM 2063 CA GLU I 34 -11.347 63.248 22.624 1.00 44.90 C ATOM 2064 C GLU I 34 -10.974 61.870 22.022 1.00 42.96 C ATOM 2065 O GLU I 34 -11.848 61.046 21.688 1.00 42.44 O ATOM 2066 CB GLU I 34 -11.485 64.315 21.502 1.00 45.62 C ATOM 2067 CG GLU I 34 -10.914 65.702 21.823 1.00 49.80 C ATOM 2068 CD AGLU I 34 -11.411 66.810 20.881 1.00 53.68 C ATOM 2069 OE1AGLU I 34 -12.603 67.217 20.988 1.00 54.99 O ATOM 2070 OE2AGLU I 34 -10.603 67.295 20.040 1.00 53.24 O ATOM 2071 N ALA I 35 -9.679 61.628 21.862 1.00 41.51 N ATOM 2072 CA ALA I 35 -9.232 60.317 21.393 1.00 39.90 C ATOM 2073 C ALA I 35 -9.454 59.227 22.464 1.00 38.23 C ATOM 2074 O ALA I 35 -10.038 58.183 22.183 1.00 36.85 O ATOM 2075 CB ALA I 35 -7.807 60.383 20.946 1.00 40.13 C ATOM 2076 N LYS I 36 -9.033 59.489 23.694 1.00 38.31 N ATOM 2077 CA LYS I 36 -9.318 58.548 24.779 1.00 39.04 C ATOM 2078 C LYS I 36 -10.837 58.207 24.946 1.00 39.03 C ATOM 2079 O LYS I 36 -11.187 57.032 25.077 1.00 39.05 O ATOM 2080 CB LYS I 36 -8.719 59.066 26.073 1.00 40.14 C ATOM 2081 CG LYS I 36 -7.211 58.973 26.125 1.00 39.93 C ATOM 2082 CD LYS I 36 -6.706 59.035 27.539 1.00 41.04 C ATOM 2083 CE LYS I 36 -5.312 59.667 27.603 1.00 44.32 C ATOM 2084 NZ LYS I 36 -4.366 58.847 28.435 1.00 42.94 N ATOM 2085 N LYS I 37 -11.731 59.201 24.848 1.00 38.70 N ATOM 2086 CA LYS I 37 -13.184 58.973 25.000 1.00 38.69 C ATOM 2087 C LYS I 37 -13.740 58.130 23.874 1.00 38.66 C ATOM 2088 O LYS I 37 -14.393 57.096 24.130 1.00 38.42 O ATOM 2089 CB LYS I 37 -13.960 60.297 25.049 1.00 40.17 C ATOM 2090 CG LYS I 37 -14.447 60.791 26.426 1.00 41.73 C ATOM 2091 CD LYS I 37 -15.401 62.020 26.269 1.00 44.98 C ATOM 2092 CE LYS I 37 -14.872 63.324 26.930 1.00 48.07 C ATOM 2093 NZ LYS I 37 -15.959 64.259 27.467 1.00 47.58 N ATOM 2094 N VAL I 38 -13.454 58.552 22.625 1.00 37.67 N ATOM 2095 CA VAL I 38 -13.955 57.892 21.434 1.00 37.41 C ATOM 2096 C VAL I 38 -13.505 56.458 21.499 1.00 37.59 C ATOM 2097 O VAL I 38 -14.327 55.541 21.322 1.00 37.17 O ATOM 2098 CB VAL I 38 -13.478 58.556 20.067 1.00 37.12 C ATOM 2099 CG1 VAL I 38 -13.861 57.694 18.853 1.00 37.42 C ATOM 2100 CG2 VAL I 38 -14.095 59.933 19.859 1.00 39.33 C ATOM 2101 N ILE I 39 -12.205 56.253 21.764 1.00 38.43 N ATOM 2102 CA ILE I 39 -11.636 54.902 21.659 1.00 38.08 C ATOM 2103 C ILE I 39 -12.206 54.019 22.741 1.00 39.26 C ATOM 2104 O ILE I 39 -12.659 52.912 22.427 1.00 40.00 O ATOM 2105 CB ILE I 39 -10.072 54.890 21.661 1.00 38.68 C ATOM 2106 CG1 ILE I 39 -9.517 55.348 20.289 1.00 36.09 C ATOM 2107 CG2 ILE I 39 -9.540 53.484 21.962 1.00 37.05 C ATOM 2108 CD1 ILE I 39 -8.154 55.864 20.354 1.00 36.59 C ATOM 2109 N LEU I 40 -12.175 54.481 24.002 1.00 40.64 N ATOM 2110 CA LEU I 40 -12.788 53.731 25.121 1.00 42.18 C ATOM 2111 C LEU I 40 -14.306 53.583 24.918 1.00 43.60 C ATOM 2112 O LEU I 40 -14.835 52.475 25.050 1.00 43.97 O ATOM 2113 CB LEU I 40 -12.457 54.343 26.499 1.00 41.01 C ATOM 2114 CG LEU I 40 -10.992 54.280 26.967 1.00 40.85 C ATOM 2115 CD1 LEU I 40 -10.720 55.143 28.235 1.00 40.35 C ATOM 2116 CD2 LEU I 40 -10.529 52.820 27.177 1.00 38.36 C ATOM 2117 N GLN I 41 -14.983 54.686 24.571 1.00 46.18 N ATOM 2118 CA GLN I 41 -16.424 54.675 24.213 1.00 48.43 C ATOM 2119 C GLN I 41 -16.617 53.954 22.885 1.00 49.25 C ATOM 2120 O GLN I 41 -17.492 54.332 22.107 1.00 50.19 O ATOM 2121 CB GLN I 41 -17.002 56.121 24.104 1.00 48.62 C ATOM 2122 CG AGLN I 41 -18.115 56.470 25.114 0.33 48.52 C ATOM 2123 CG BGLN I 41 -18.507 56.336 24.506 0.67 49.07 C ATOM 2124 CD AGLN I 41 -18.455 57.960 25.135 0.33 48.86 C ATOM 2125 CD BGLN I 41 -19.465 55.279 23.948 0.67 50.07 C ATOM 2126 OE1AGLN I 41 -19.153 58.457 24.249 0.33 47.77 O ATOM 2127 OE1BGLN I 41 -19.818 55.294 22.757 0.67 50.03 O ATOM 2128 NE2AGLN I 41 -17.965 58.671 26.152 0.33 48.52 N ATOM 2129 NE2BGLN I 41 -19.885 54.365 24.807 0.67 49.70 N ATOM 2130 N ASP I 42 -15.794 52.933 22.624 1.00 49.97 N ATOM 2131 CA ASP I 42 -15.864 52.093 21.400 1.00 49.77 C ATOM 2132 C ASP I 42 -15.122 50.760 21.604 1.00 48.70 C ATOM 2133 O ASP I 42 -15.497 49.729 21.011 1.00 49.03 O ATOM 2134 CB ASP I 42 -15.274 52.827 20.172 1.00 51.00 C ATOM 2135 CG ASP I 42 -16.220 53.897 19.573 1.00 53.24 C ATOM 2136 OD1 ASP I 42 -17.429 53.625 19.358 1.00 56.23 O ATOM 2137 OD2 ASP I 42 -15.826 55.049 19.266 1.00 56.61 O ATOM 2138 N LYS I 43 -14.078 50.789 22.448 1.00 47.19 N ATOM 2139 CA LYS I 43 -13.233 49.617 22.776 1.00 45.98 C ATOM 2140 C LYS I 43 -12.830 49.624 24.282 1.00 45.20 C ATOM 2141 O LYS I 43 -11.699 50.019 24.660 1.00 44.93 O ATOM 2142 CB LYS I 43 -12.008 49.563 21.828 1.00 46.33 C ATOM 2143 CG LYS I 43 -10.868 48.593 22.186 1.00 45.61 C ATOM 2144 CD LYS I 43 -9.650 48.849 21.272 1.00 46.21 C ATOM 2145 CE LYS I 43 -8.638 47.706 21.315 1.00 42.93 C ATOM 2146 NZ LYS I 43 -9.243 46.407 20.868 1.00 42.02 N ATOM 2147 N PRO I 44 -13.768 49.207 25.135 1.00 44.06 N ATOM 2148 CA PRO I 44 -13.617 49.331 26.602 1.00 43.31 C ATOM 2149 C PRO I 44 -12.270 48.959 27.261 1.00 42.38 C ATOM 2150 O PRO I 44 -11.828 49.656 28.192 1.00 41.96 O ATOM 2151 CB PRO I 44 -14.764 48.452 27.176 1.00 43.34 C ATOM 2152 CG PRO I 44 -15.549 47.892 25.971 1.00 44.10 C ATOM 2153 CD PRO I 44 -15.076 48.632 24.741 1.00 43.82 C ATOM 2154 N ALA I 45 -11.642 47.868 26.845 1.00 41.76 N ATOM 2155 CA ALA I 45 -10.438 47.404 27.553 1.00 42.18 C ATOM 2156 C ALA I 45 -9.106 47.932 26.987 1.00 41.67 C ATOM 2157 O ALA I 45 -8.011 47.493 27.403 1.00 42.67 O ATOM 2158 CB ALA I 45 -10.427 45.861 27.658 1.00 42.51 C ATOM 2159 N ALA I 46 -9.203 48.879 26.059 1.00 40.61 N ATOM 2160 CA ALA I 46 -8.034 49.500 25.434 1.00 38.91 C ATOM 2161 C ALA I 46 -6.931 49.835 26.419 1.00 38.44 C ATOM 2162 O ALA I 46 -7.158 50.538 27.405 1.00 37.28 O ATOM 2163 CB ALA I 46 -8.432 50.733 24.669 1.00 38.68 C ATOM 2164 N GLN I 47 -5.739 49.301 26.157 1.00 37.98 N ATOM 2165 CA GLN I 47 -4.543 49.805 26.804 1.00 38.32 C ATOM 2166 C GLN I 47 -3.926 50.918 25.952 1.00 37.64 C ATOM 2167 O GLN I 47 -3.296 50.674 24.921 1.00 37.25 O ATOM 2168 CB GLN I 47 -3.577 48.662 27.102 1.00 38.97 C ATOM 2169 CG GLN I 47 -3.882 48.005 28.459 1.00 43.17 C ATOM 2170 CD GLN I 47 -2.907 46.880 28.785 1.00 50.18 C ATOM 2171 OE1 GLN I 47 -2.115 46.968 29.756 1.00 53.10 O ATOM 2172 NE2 GLN I 47 -2.955 45.816 27.982 1.00 50.36 N ATOM 2173 N ILE I 48 -4.147 52.150 26.392 1.00 37.36 N ATOM 2174 CA ILE I 48 -3.774 53.340 25.632 1.00 36.84 C ATOM 2175 C ILE I 48 -2.428 53.868 26.060 1.00 37.29 C ATOM 2176 O ILE I 48 -2.172 54.079 27.252 1.00 37.61 O ATOM 2177 CB ILE I 48 -4.829 54.439 25.802 1.00 36.73 C ATOM 2178 CG1 ILE I 48 -6.240 53.889 25.546 1.00 37.13 C ATOM 2179 CG2 ILE I 48 -4.522 55.628 24.888 1.00 36.32 C ATOM 2180 CD1 ILE I 48 -7.325 54.940 25.492 1.00 35.70 C ATOM 2181 N ILE I 49 -1.565 54.107 25.084 1.00 36.98 N ATOM 2182 CA ILE I 49 -0.269 54.684 25.375 1.00 36.75 C ATOM 2183 C ILE I 49 0.024 55.900 24.481 1.00 36.35 C ATOM 2184 O ILE I 49 -0.144 55.844 23.281 1.00 35.79 O ATOM 2185 CB ILE I 49 0.842 53.578 25.354 1.00 37.22 C ATOM 2186 CG1 ILE I 49 2.152 54.089 25.975 1.00 38.65 C ATOM 2187 CG2 ILE I 49 1.034 52.994 23.976 1.00 38.36 C ATOM 2188 CD1 ILE I 49 3.104 52.937 26.473 1.00 41.08 C ATOM 2189 N VAL I 50 0.414 57.008 25.114 1.00 36.69 N ATOM 2190 CA VAL I 50 0.796 58.247 24.425 1.00 38.07 C ATOM 2191 C VAL I 50 2.333 58.275 24.261 1.00 37.74 C ATOM 2192 O VAL I 50 3.082 58.034 25.196 1.00 38.43 O ATOM 2193 CB VAL I 50 0.244 59.543 25.165 1.00 37.89 C ATOM 2194 CG1 VAL I 50 0.352 60.785 24.283 1.00 39.71 C ATOM 2195 CG2 VAL I 50 -1.221 59.372 25.533 1.00 39.05 C ATOM 2196 N LEU I 51 2.771 58.496 23.032 1.00 38.30 N ATOM 2197 CA LEU I 51 4.174 58.525 22.676 1.00 37.54 C ATOM 2198 C LEU I 51 4.338 59.681 21.704 1.00 37.73 C ATOM 2199 O LEU I 51 3.395 59.990 20.966 1.00 37.49 O ATOM 2200 CB LEU I 51 4.561 57.209 21.977 1.00 37.30 C ATOM 2201 CG LEU I 51 4.549 55.856 22.718 1.00 37.37 C ATOM 2202 CD1 LEU I 51 4.745 54.737 21.705 1.00 38.76 C ATOM 2203 CD2 LEU I 51 5.594 55.755 23.840 1.00 34.83 C ATOM 2204 N PRO I 52 5.514 60.328 21.709 1.00 38.70 N ATOM 2205 CA PRO I 52 5.864 61.348 20.711 1.00 38.94 C ATOM 2206 C PRO I 52 5.776 60.836 19.273 1.00 39.22 C ATOM 2207 O PRO I 52 5.964 59.634 18.985 1.00 39.20 O ATOM 2208 CB PRO I 52 7.345 61.644 21.013 1.00 39.33 C ATOM 2209 CG PRO I 52 7.616 61.148 22.381 1.00 38.76 C ATOM 2210 CD PRO I 52 6.586 60.149 22.712 1.00 38.86 C ATOM 2211 N VAL I 53 5.481 61.750 18.371 1.00 38.38 N ATOM 2212 CA VAL I 53 5.583 61.471 16.962 1.00 39.12 C ATOM 2213 C VAL I 53 7.090 61.431 16.633 1.00 38.95 C ATOM 2214 O VAL I 53 7.902 62.037 17.340 1.00 38.07 O ATOM 2215 CB VAL I 53 4.739 62.495 16.124 1.00 38.98 C ATOM 2216 CG1 VAL I 53 5.394 63.876 16.086 1.00 40.27 C ATOM 2217 CG2 VAL I 53 4.459 61.967 14.733 1.00 41.10 C ATOM 2218 N GLY I 54 7.478 60.662 15.617 1.00 39.28 N ATOM 2219 CA GLY I 54 8.904 60.539 15.281 1.00 39.24 C ATOM 2220 C GLY I 54 9.761 59.661 16.201 1.00 38.84 C ATOM 2221 O GLY I 54 10.934 60.001 16.495 1.00 39.65 O ATOM 2222 N THR I 55 9.162 58.578 16.709 1.00 36.96 N ATOM 2223 CA THR I 55 9.881 57.520 17.421 1.00 34.19 C ATOM 2224 C THR I 55 9.696 56.195 16.673 1.00 31.83 C ATOM 2225 O THR I 55 8.722 56.000 15.929 1.00 30.43 O ATOM 2226 CB THR I 55 9.422 57.347 18.939 1.00 34.57 C ATOM 2227 OG1 THR I 55 8.014 57.057 19.012 1.00 35.87 O ATOM 2228 CG2 THR I 55 9.506 58.660 19.693 1.00 36.99 C ATOM 2229 N ILE I 56 10.625 55.275 16.925 1.00 28.95 N ATOM 2230 CA ILE I 56 10.560 53.907 16.409 1.00 26.83 C ATOM 2231 C ILE I 56 9.930 53.026 17.467 1.00 25.24 C ATOM 2232 O ILE I 56 10.188 53.224 18.680 1.00 24.60 O ATOM 2233 CB ILE I 56 12.044 53.424 16.102 1.00 27.61 C ATOM 2234 CG1 ILE I 56 12.626 54.216 14.922 1.00 27.82 C ATOM 2235 CG2 ILE I 56 12.113 51.916 15.935 1.00 24.68 C ATOM 2236 CD1 ILE I 56 12.440 53.575 13.543 1.00 27.54 C ATOM 2237 N VAL I 57 9.128 52.038 17.056 1.00 22.51 N ATOM 2238 CA VAL I 57 8.496 51.147 18.055 1.00 22.08 C ATOM 2239 C VAL I 57 8.597 49.670 17.629 1.00 20.82 C ATOM 2240 O VAL I 57 8.759 49.386 16.453 1.00 19.49 O ATOM 2241 CB VAL I 57 6.980 51.535 18.310 1.00 22.08 C ATOM 2242 CG1 VAL I 57 6.922 52.990 18.864 1.00 22.43 C ATOM 2243 CG2 VAL I 57 6.129 51.351 16.997 1.00 21.51 C ATOM 2244 N THR I 58 8.501 48.764 18.590 1.00 20.47 N ATOM 2245 CA THR I 58 8.388 47.322 18.284 1.00 21.31 C ATOM 2246 C THR I 58 7.261 47.020 17.347 1.00 21.44 C ATOM 2247 O THR I 58 6.247 47.760 17.315 1.00 22.68 O ATOM 2248 CB THR I 58 8.082 46.490 19.537 1.00 21.93 C ATOM 2249 OG1 THR I 58 6.823 46.906 20.076 1.00 22.19 O ATOM 2250 CG2 THR I 58 9.064 46.711 20.671 1.00 17.26 C ATOM 2251 N ARG I 59 7.385 45.891 16.644 1.00 21.15 N ATOM 2252 CA ARG I 59 6.352 45.415 15.745 1.00 20.49 C ATOM 2253 C ARG I 59 5.645 44.173 16.243 1.00 20.10 C ATOM 2254 O ARG I 59 5.309 43.313 15.436 1.00 18.33 O ATOM 2255 CB ARG I 59 6.901 45.177 14.315 1.00 20.67 C ATOM 2256 CG ARG I 59 7.366 46.449 13.604 1.00 22.91 C ATOM 2257 CD ARG I 59 6.274 47.439 13.418 1.00 27.35 C ATOM 2258 NE ARG I 59 6.607 48.491 12.451 1.00 27.24 N ATOM 2259 CZ ARG I 59 6.163 49.739 12.577 1.00 29.45 C ATOM 2260 NH1 ARG I 59 5.414 50.074 13.626 1.00 32.02 N ATOM 2261 NH2 ARG I 59 6.466 50.651 11.679 1.00 29.65 N ATOM 2262 N SER I 60 5.448 44.030 17.560 1.00 20.39 N ATOM 2263 CA SER I 60 4.523 43.040 18.046 1.00 21.69 C ATOM 2264 C SER I 60 3.110 43.578 17.718 1.00 22.09 C ATOM 2265 O SER I 60 2.928 44.776 17.541 1.00 22.34 O ATOM 2266 CB SER I 60 4.670 42.864 19.569 1.00 22.85 C ATOM 2267 OG SER I 60 4.617 44.141 20.193 1.00 25.53 O ATOM 2268 N TYR I 61 2.119 42.701 17.635 1.00 23.63 N ATOM 2269 CA TYR I 61 0.733 43.113 17.363 1.00 24.95 C ATOM 2270 C TYR I 61 -0.086 42.667 18.564 1.00 26.41 C ATOM 2271 O TYR I 61 -0.223 41.458 18.780 1.00 25.90 O ATOM 2272 CB TYR I 61 0.230 42.386 16.095 1.00 24.90 C ATOM 2273 CG TYR I 61 -1.255 42.600 15.834 1.00 26.66 C ATOM 2274 CD1 TYR I 61 -1.744 43.825 15.392 1.00 25.35 C ATOM 2275 CD2 TYR I 61 -2.158 41.589 16.121 1.00 29.84 C ATOM 2276 CE1 TYR I 61 -3.146 44.011 15.179 1.00 32.36 C ATOM 2277 CE2 TYR I 61 -3.531 41.757 15.918 1.00 33.63 C ATOM 2278 CZ TYR I 61 -4.008 42.956 15.444 1.00 32.42 C ATOM 2279 OH TYR I 61 -5.365 43.053 15.290 1.00 38.83 O ATOM 2280 N ARG I 62 -0.546 43.598 19.400 1.00 28.79 N ATOM 2281 CA ARG I 62 -1.334 43.227 20.598 1.00 31.24 C ATOM 2282 C ARG I 62 -2.752 43.816 20.460 1.00 32.39 C ATOM 2283 O ARG I 62 -2.945 45.033 20.448 1.00 31.55 O ATOM 2284 CB ARG I 62 -0.707 43.746 21.929 1.00 32.56 C ATOM 2285 CG ARG I 62 0.724 43.252 22.313 1.00 33.89 C ATOM 2286 CD ARG I 62 1.050 43.375 23.864 1.00 41.12 C ATOM 2287 NE ARG I 62 1.492 44.720 24.279 1.00 48.23 N ATOM 2288 CZ ARG I 62 2.600 45.013 25.009 1.00 52.19 C ATOM 2289 NH1 ARG I 62 3.421 44.040 25.444 1.00 52.11 N ATOM 2290 NH2 ARG I 62 2.891 46.298 25.310 1.00 50.85 N ATOM 2291 N ILE I 63 -3.736 42.936 20.405 1.00 34.01 N ATOM 2292 CA ILE I 63 -5.140 43.309 20.163 1.00 36.40 C ATOM 2293 C ILE I 63 -5.673 44.376 21.173 1.00 36.68 C ATOM 2294 O ILE I 63 -6.506 45.184 20.823 1.00 37.88 O ATOM 2295 CB ILE I 63 -5.985 41.989 20.192 1.00 35.91 C ATOM 2296 CG1 ILE I 63 -7.364 42.157 19.544 1.00 37.09 C ATOM 2297 CG2 ILE I 63 -6.018 41.422 21.639 1.00 36.80 C ATOM 2298 CD1 ILE I 63 -7.348 42.434 17.998 1.00 39.01 C ATOM 2299 N ASP I 64 -5.161 44.361 22.403 1.00 37.61 N ATOM 2300 CA ASP I 64 -5.541 45.288 23.490 1.00 37.99 C ATOM 2301 C ASP I 64 -5.051 46.748 23.320 1.00 36.60 C ATOM 2302 O ASP I 64 -5.662 47.692 23.858 1.00 36.89 O ATOM 2303 CB ASP I 64 -5.045 44.739 24.859 1.00 38.96 C ATOM 2304 CG ASP I 64 -5.901 43.579 25.385 1.00 44.07 C ATOM 2305 OD1 ASP I 64 -5.379 42.441 25.575 1.00 47.64 O ATOM 2306 OD2 ASP I 64 -7.134 43.705 25.630 1.00 50.57 O ATOM 2307 N ARG I 65 -3.972 46.941 22.559 1.00 34.68 N ATOM 2308 CA ARG I 65 -3.193 48.173 22.597 1.00 31.54 C ATOM 2309 C ARG I 65 -3.609 49.171 21.524 1.00 30.77 C ATOM 2310 O ARG I 65 -3.821 48.804 20.361 1.00 29.31 O ATOM 2311 CB ARG I 65 -1.691 47.825 22.472 1.00 31.23 C ATOM 2312 CG ARG I 65 -0.667 48.992 22.679 1.00 32.19 C ATOM 2313 CD ARG I 65 0.835 48.576 22.655 1.00 29.30 C ATOM 2314 NE ARG I 65 1.188 47.790 21.459 1.00 26.26 N ATOM 2315 CZ ARG I 65 2.239 46.941 21.356 1.00 29.42 C ATOM 2316 NH1 ARG I 65 3.122 46.785 22.363 1.00 29.16 N ATOM 2317 NH2 ARG I 65 2.420 46.236 20.239 1.00 23.69 N ATOM 2318 N VAL I 66 -3.670 50.450 21.896 1.00 28.18 N ATOM 2319 CA VAL I 66 -3.816 51.493 20.898 1.00 28.84 C ATOM 2320 C VAL I 66 -2.779 52.523 21.226 1.00 28.60 C ATOM 2321 O VAL I 66 -2.852 53.138 22.288 1.00 27.05 O ATOM 2322 CB VAL I 66 -5.258 52.128 20.893 1.00 28.34 C ATOM 2323 CG1 VAL I 66 -5.327 53.310 19.959 1.00 28.93 C ATOM 2324 CG2 VAL I 66 -6.277 51.099 20.450 1.00 27.87 C ATOM 2325 N ARG I 67 -1.765 52.654 20.354 1.00 28.46 N ATOM 2326 CA ARG I 67 -0.698 53.627 20.574 1.00 28.42 C ATOM 2327 C ARG I 67 -1.139 54.939 19.976 1.00 28.93 C ATOM 2328 O ARG I 67 -1.710 54.947 18.873 1.00 26.79 O ATOM 2329 CB ARG I 67 0.638 53.187 19.920 1.00 28.55 C ATOM 2330 CG ARG I 67 1.388 52.107 20.712 1.00 27.84 C ATOM 2331 CD ARG I 67 2.443 51.407 19.892 1.00 30.81 C ATOM 2332 NE ARG I 67 3.403 50.627 20.672 1.00 26.14 N ATOM 2333 CZ ARG I 67 4.154 49.661 20.145 1.00 28.28 C ATOM 2334 NH1 ARG I 67 4.021 49.361 18.842 1.00 25.68 N ATOM 2335 NH2 ARG I 67 5.061 49.019 20.899 1.00 25.52 N ATOM 2336 N LEU I 68 -0.853 56.033 20.691 1.00 29.51 N ATOM 2337 CA LEU I 68 -1.269 57.379 20.258 1.00 31.02 C ATOM 2338 C LEU I 68 -0.062 58.259 20.063 1.00 30.48 C ATOM 2339 O LEU I 68 0.659 58.528 20.984 1.00 31.07 O ATOM 2340 CB LEU I 68 -2.254 58.031 21.257 1.00 31.14 C ATOM 2341 CG LEU I 68 -3.621 57.356 21.504 1.00 32.26 C ATOM 2342 CD1 LEU I 68 -4.469 58.222 22.452 1.00 37.18 C ATOM 2343 CD2 LEU I 68 -4.393 57.066 20.188 1.00 32.84 C ATOM 2344 N PHE I 69 0.153 58.670 18.828 1.00 32.16 N ATOM 2345 CA PHE I 69 1.305 59.484 18.433 1.00 34.01 C ATOM 2346 C PHE I 69 0.870 60.955 18.334 1.00 35.32 C ATOM 2347 O PHE I 69 0.070 61.329 17.459 1.00 35.30 O ATOM 2348 CB PHE I 69 1.901 58.983 17.083 1.00 33.82 C ATOM 2349 CG PHE I 69 2.465 57.565 17.147 1.00 34.11 C ATOM 2350 CD1 PHE I 69 3.690 57.320 17.758 1.00 34.85 C ATOM 2351 CD2 PHE I 69 1.743 56.485 16.634 1.00 31.88 C ATOM 2352 CE1 PHE I 69 4.211 55.989 17.854 1.00 35.28 C ATOM 2353 CE2 PHE I 69 2.245 55.161 16.680 1.00 30.93 C ATOM 2354 CZ PHE I 69 3.484 54.914 17.300 1.00 34.34 C ATOM 2355 N VAL I 70 1.422 61.772 19.221 1.00 37.07 N ATOM 2356 CA VAL I 70 1.034 63.191 19.346 1.00 39.01 C ATOM 2357 C VAL I 70 2.153 64.174 18.917 1.00 39.82 C ATOM 2358 O VAL I 70 3.329 63.825 18.963 1.00 38.70 O ATOM 2359 CB VAL I 70 0.545 63.537 20.792 1.00 38.69 C ATOM 2360 CG1 VAL I 70 -0.600 62.652 21.188 1.00 39.13 C ATOM 2361 CG2 VAL I 70 1.671 63.439 21.804 1.00 38.86 C ATOM 2362 N ASP I 71 1.763 65.375 18.473 1.00 41.47 N ATOM 2363 CA ASP I 71 2.713 66.489 18.369 1.00 44.00 C ATOM 2364 C ASP I 71 2.959 67.112 19.740 1.00 45.80 C ATOM 2365 O ASP I 71 2.329 66.729 20.732 1.00 45.95 O ATOM 2366 CB ASP I 71 2.263 67.562 17.347 1.00 44.10 C ATOM 2367 CG ASP I 71 0.859 68.112 17.624 1.00 44.61 C ATOM 2368 OD1 ASP I 71 0.411 68.064 18.784 1.00 44.88 O ATOM 2369 OD2 ASP I 71 0.125 68.610 16.741 1.00 44.65 O ATOM 2370 N ARG I 72 3.866 68.085 19.773 1.00 47.58 N ATOM 2371 CA ARG I 72 4.173 68.865 20.963 1.00 49.41 C ATOM 2372 C ARG I 72 2.984 69.681 21.484 1.00 50.01 C ATOM 2373 O ARG I 72 3.085 70.280 22.560 1.00 50.63 O ATOM 2374 CB ARG I 72 5.356 69.796 20.678 1.00 49.98 C ATOM 2375 CG ARG I 72 6.338 69.250 19.635 1.00 51.79 C ATOM 2376 CD ARG I 72 5.897 69.489 18.174 1.00 56.11 C ATOM 2377 NE ARG I 72 6.834 68.909 17.216 1.00 58.56 N ATOM 2378 CZ ARG I 72 8.024 69.424 16.899 1.00 59.89 C ATOM 2379 NH1 ARG I 72 8.459 70.557 17.452 1.00 59.41 N ATOM 2380 NH2 ARG I 72 8.787 68.793 16.015 1.00 60.87 N ATOM 2381 N LEU I 73 1.881 69.711 20.722 1.00 50.48 N ATOM 2382 CA LEU I 73 0.601 70.326 21.179 1.00 51.07 C ATOM 2383 C LEU I 73 -0.437 69.338 21.790 1.00 50.49 C ATOM 2384 O LEU I 73 -1.614 69.709 22.011 1.00 50.86 O ATOM 2385 CB LEU I 73 -0.066 71.141 20.045 1.00 51.32 C ATOM 2386 CG LEU I 73 0.518 72.503 19.622 1.00 53.18 C ATOM 2387 CD1 LEU I 73 -0.307 73.132 18.466 1.00 54.90 C ATOM 2388 CD2 LEU I 73 0.668 73.493 20.810 1.00 52.72 C ATOM 2389 N ASP I 74 -0.004 68.100 22.043 1.00 49.59 N ATOM 2390 CA ASP I 74 -0.848 67.033 22.603 1.00 48.52 C ATOM 2391 C ASP I 74 -2.074 66.754 21.714 1.00 48.60 C ATOM 2392 O ASP I 74 -3.180 66.427 22.190 1.00 48.03 O ATOM 2393 CB ASP I 74 -1.240 67.303 24.058 1.00 48.57 C ATOM 2394 N ASN I 75 -1.857 66.883 20.410 1.00 47.92 N ATOM 2395 CA ASN I 75 -2.841 66.465 19.435 1.00 48.07 C ATOM 2396 C ASN I 75 -2.329 65.284 18.603 1.00 46.58 C ATOM 2397 O ASN I 75 -1.158 65.242 18.235 1.00 46.55 O ATOM 2398 CB ASN I 75 -3.274 67.644 18.541 1.00 48.60 C ATOM 2399 CG ASN I 75 -4.135 68.684 19.307 1.00 51.61 C ATOM 2400 OD1 ASN I 75 -3.650 69.757 19.683 1.00 53.24 O ATOM 2401 ND2 ASN I 75 -5.413 68.351 19.536 1.00 52.60 N ATOM 2402 N ILE I 76 -3.238 64.348 18.330 1.00 44.88 N ATOM 2403 CA ILE I 76 -3.040 63.192 17.459 1.00 43.19 C ATOM 2404 C ILE I 76 -2.547 63.585 16.049 1.00 42.10 C ATOM 2405 O ILE I 76 -3.246 64.260 15.307 1.00 41.03 O ATOM 2406 CB ILE I 76 -4.395 62.375 17.378 1.00 43.42 C ATOM 2407 CG1 ILE I 76 -5.011 62.117 18.782 1.00 44.90 C ATOM 2408 CG2 ILE I 76 -4.240 61.093 16.564 1.00 43.31 C ATOM 2409 CD1 ILE I 76 -4.020 62.102 19.968 1.00 44.33 C ATOM 2410 N ALA I 77 -1.345 63.130 15.689 1.00 41.12 N ATOM 2411 CA ALA I 77 -0.724 63.451 14.410 1.00 39.96 C ATOM 2412 C ALA I 77 -0.907 62.376 13.330 1.00 39.96 C ATOM 2413 O ALA I 77 -0.821 62.702 12.133 1.00 40.04 O ATOM 2414 CB ALA I 77 0.750 63.753 14.604 1.00 39.61 C ATOM 2415 N GLN I 78 -1.176 61.126 13.742 1.00 38.39 N ATOM 2416 CA GLN I 78 -1.216 59.983 12.813 1.00 38.50 C ATOM 2417 C GLN I 78 -2.431 59.086 13.093 1.00 37.49 C ATOM 2418 O GLN I 78 -2.838 58.970 14.249 1.00 35.63 O ATOM 2419 CB GLN I 78 0.096 59.138 12.940 1.00 37.98 C ATOM 2420 CG GLN I 78 1.282 59.645 12.077 1.00 40.57 C ATOM 2421 CD GLN I 78 2.692 59.235 12.611 1.00 43.11 C ATOM 2422 OE1 GLN I 78 2.848 58.216 13.295 1.00 43.87 O ATOM 2423 NE2 GLN I 78 3.703 60.036 12.287 1.00 44.47 N ATOM 2424 N VAL I 79 -2.980 58.417 12.071 1.00 37.56 N ATOM 2425 CA VAL I 79 -4.135 57.495 12.318 1.00 38.04 C ATOM 2426 C VAL I 79 -3.854 56.474 13.483 1.00 37.65 C ATOM 2427 O VAL I 79 -2.970 55.603 13.359 1.00 37.41 O ATOM 2428 CB VAL I 79 -4.608 56.733 11.036 1.00 38.61 C ATOM 2429 CG1 VAL I 79 -5.841 55.868 11.340 1.00 39.51 C ATOM 2430 CG2 VAL I 79 -4.949 57.703 9.898 1.00 39.40 C ATOM 2431 N PRO I 80 -4.564 56.604 14.618 1.00 36.47 N ATOM 2432 CA PRO I 80 -4.465 55.612 15.707 1.00 35.30 C ATOM 2433 C PRO I 80 -5.031 54.281 15.250 1.00 35.95 C ATOM 2434 O PRO I 80 -5.981 54.247 14.429 1.00 35.08 O ATOM 2435 CB PRO I 80 -5.338 56.202 16.818 1.00 34.78 C ATOM 2436 CG PRO I 80 -5.444 57.657 16.503 1.00 34.32 C ATOM 2437 CD PRO I 80 -5.470 57.714 14.974 1.00 36.14 C ATOM 2438 N ARG I 81 -4.466 53.188 15.781 1.00 35.77 N ATOM 2439 CA ARG I 81 -4.658 51.888 15.150 1.00 35.56 C ATOM 2440 C ARG I 81 -4.573 50.824 16.233 1.00 33.81 C ATOM 2441 O ARG I 81 -3.766 50.939 17.155 1.00 34.37 O ATOM 2442 CB ARG I 81 -3.624 51.757 13.992 1.00 36.04 C ATOM 2443 CG ARG I 81 -3.366 50.386 13.401 1.00 38.73 C ATOM 2444 CD ARG I 81 -2.808 50.436 11.950 1.00 42.81 C ATOM 2445 NE ARG I 81 -3.946 50.450 11.039 1.00 45.28 N ATOM 2446 CZ ARG I 81 -4.220 51.397 10.151 1.00 44.58 C ATOM 2447 NH1 ARG I 81 -3.409 52.431 9.967 1.00 42.39 N ATOM 2448 NH2 ARG I 81 -5.338 51.295 9.443 1.00 45.12 N ATOM 2449 N VAL I 82 -5.435 49.816 16.186 1.00 33.08 N ATOM 2450 CA VAL I 82 -5.295 48.722 17.165 1.00 32.47 C ATOM 2451 C VAL I 82 -3.963 47.992 16.900 1.00 31.26 C ATOM 2452 O VAL I 82 -3.576 47.777 15.744 1.00 30.66 O ATOM 2453 CB VAL I 82 -6.497 47.695 17.194 1.00 32.73 C ATOM 2454 CG1AVAL I 82 -7.862 48.423 17.253 0.50 32.11 C ATOM 2455 CG1BVAL I 82 -6.832 47.251 15.811 0.50 32.40 C ATOM 2456 CG2AVAL I 82 -6.438 46.721 16.037 0.50 33.00 C ATOM 2457 CG2BVAL I 82 -6.145 46.479 18.029 0.50 31.39 C ATOM 2458 N GLY I 83 -3.276 47.683 17.984 1.00 30.01 N ATOM 2459 CA GLY I 83 -2.199 46.736 17.986 1.00 31.24 C ATOM 2460 C GLY I 83 -0.871 47.204 18.536 1.00 31.41 C ATOM 2461 O GLY I 83 -0.668 48.360 18.931 1.00 31.61 O ATOM 2462 OXT GLY I 83 0.023 46.351 18.586 1.00 32.08 O TER 2463 GLY I 83 HETATM 2464 CA CA E1001 15.775 24.787 24.692 1.00 23.56 CA HETATM 2465 NA NA E1002 12.635 46.017 1.446 1.00 12.99 NA HETATM 2466 O HOH E1003 17.055 60.109 11.651 1.00 33.66 O HETATM 2467 O HOH E1004 13.724 30.343 1.026 1.00 13.04 O HETATM 2468 O HOH E1005 9.882 36.255 18.068 1.00 15.75 O HETATM 2469 O HOH E1006 16.328 57.022 28.103 1.00 25.97 O HETATM 2470 O HOH E1007 14.863 43.131 16.702 1.00 18.07 O HETATM 2471 O HOH E1008 18.150 43.763 21.932 1.00 17.92 O HETATM 2472 O HOH E1009 22.287 25.203 21.322 1.00 18.80 O HETATM 2473 O HOH E1010 23.417 30.053 20.907 1.00 21.78 O HETATM 2474 O HOH E1011 1.639 41.008 4.358 1.00 17.83 O HETATM 2475 O HOH E1012 10.054 30.678 18.346 1.00 12.43 O HETATM 2476 O HOH E1013 8.841 29.746 16.002 1.00 13.20 O HETATM 2477 O HOH E1014 9.227 26.332 4.091 1.00 20.56 O HETATM 2478 O HOH E1015 19.858 42.807 3.581 1.00 19.35 O HETATM 2479 O HOH E1016 10.634 47.996 9.874 1.00 25.56 O HETATM 2480 O HOH E1017 4.704 28.527 18.206 1.00 21.58 O HETATM 2481 O HOH E1018 6.225 29.020 16.074 1.00 21.64 O HETATM 2482 O HOH E1019 28.361 30.743 18.111 1.00 24.39 O HETATM 2483 O HOH E1020 4.195 34.604 -3.217 1.00 25.44 O HETATM 2484 O HOH E1021 21.223 31.435 22.666 1.00 23.09 O HETATM 2485 O HOH E1022 23.706 57.412 9.142 1.00 26.33 O HETATM 2486 O HOH E1023 30.763 44.812 9.519 1.00 24.17 O HETATM 2487 O HOH E1024 3.034 48.680 12.038 1.00 38.89 O HETATM 2488 O HOH E1025 16.228 63.156 6.423 1.00 39.16 O HETATM 2489 O HOH E1026 -0.596 29.623 13.446 1.00 33.59 O HETATM 2490 O HOH E1027 30.155 26.809 0.113 1.00 32.28 O HETATM 2491 O HOH E1028 21.561 41.100 2.667 1.00 26.40 O HETATM 2492 O HOH E1029 7.343 21.726 15.657 1.00 28.76 O HETATM 2493 O HOH E1030 30.190 27.258 -2.533 1.00 37.56 O HETATM 2494 O HOH E1031 20.777 39.347 -3.306 1.00 27.81 O HETATM 2495 O HOH E1032 4.044 25.713 18.426 1.00 29.68 O HETATM 2496 O HOH E1033 24.637 49.034 33.301 1.00 32.67 O HETATM 2497 O HOH E1034 28.953 39.325 3.150 1.00 26.68 O HETATM 2498 O HOH E1035 -3.558 46.282 11.291 1.00 26.76 O HETATM 2499 O HOH E1036 1.222 32.678 25.747 1.00 32.16 O HETATM 2500 O HOH E1037 12.240 29.532 19.647 1.00 26.45 O HETATM 2501 O HOH E1038 25.743 55.634 8.964 1.00 34.14 O HETATM 2502 O HOH E1039 26.914 38.419 6.255 1.00 20.87 O HETATM 2503 O HOH E1040 15.234 34.586 -9.615 1.00 31.01 O HETATM 2504 O HOH E1041 31.682 50.397 6.021 1.00 26.24 O HETATM 2505 O HOH E1042 23.306 53.436 27.463 1.00 28.53 O HETATM 2506 O HOH E1043 10.232 25.738 -1.152 1.00 25.33 O HETATM 2507 O HOH E1044 11.769 52.036 -0.608 1.00 24.07 O HETATM 2508 O HOH E1045 4.149 49.820 8.782 1.00 37.54 O HETATM 2509 O HOH E1046 18.419 51.232 0.628 1.00 38.67 O HETATM 2510 O HOH E1047 29.193 22.981 3.634 1.00 27.55 O HETATM 2511 O HOH E1048 7.397 25.234 2.375 1.00 33.53 O HETATM 2512 O HOH E1049 -2.935 48.502 0.849 1.00 32.40 O HETATM 2513 O HOH E1050 31.513 30.614 11.742 1.00 53.66 O HETATM 2514 O HOH E1051 30.345 51.571 12.283 1.00 23.22 O HETATM 2515 O HOH E1052 23.730 34.315 28.463 1.00 26.24 O HETATM 2516 O HOH E1053 17.844 38.544 -4.201 1.00 38.13 O HETATM 2517 O HOH E1054 7.997 34.264 -5.781 1.00 34.73 O HETATM 2518 O HOH E1055 9.107 57.484 23.889 1.00 33.92 O HETATM 2519 O HOH E1056 13.138 26.993 31.672 1.00 24.27 O HETATM 2520 O HOH E1057 22.596 49.718 34.568 1.00 53.91 O HETATM 2521 O HOH E1058 22.365 56.737 21.879 1.00 35.46 O HETATM 2522 O HOH E1059 12.783 19.989 8.192 1.00 29.46 O HETATM 2523 O HOH E1060 6.055 42.719 -2.996 1.00 22.92 O HETATM 2524 O HOH E1061 22.249 41.938 0.248 1.00 25.31 O HETATM 2525 O HOH E1062 -3.429 36.169 -3.839 1.00 43.32 O HETATM 2526 O HOH E1063 27.519 53.344 18.117 1.00 25.89 O HETATM 2527 O HOH E1064 24.538 42.791 -1.283 1.00 27.81 O HETATM 2528 O HOH E1065 23.092 23.416 18.660 1.00 37.78 O HETATM 2529 O HOH E1066 21.572 24.328 28.030 1.00 32.70 O HETATM 2530 O HOH E1067 12.451 40.006 -8.206 1.00 29.48 O HETATM 2531 O HOH E1068 26.608 25.113 13.174 1.00 28.32 O HETATM 2532 O HOH E1069 13.233 45.155 -0.972 1.00 32.43 O HETATM 2533 O HOH E1070 31.269 35.774 24.558 1.00 38.17 O HETATM 2534 O HOH E1071 25.472 28.835 21.838 1.00 33.87 O HETATM 2535 O HOH E1072 31.722 54.509 9.947 1.00 35.73 O HETATM 2536 O HOH E1073 8.005 19.648 20.012 1.00 31.80 O HETATM 2537 O HOH E1074 30.052 42.741 23.205 1.00 28.22 O HETATM 2538 O HOH E1075 26.091 52.347 1.191 1.00 34.54 O HETATM 2539 O HOH E1076 6.757 27.116 -4.661 1.00 31.62 O HETATM 2540 O HOH E1077 28.082 56.804 7.724 1.00 37.01 O HETATM 2541 O HOH E1078 21.665 32.240 30.263 1.00 12.43 O HETATM 2542 O HOH E1079 15.539 41.117 32.063 1.00 27.07 O HETATM 2543 O HOH E1080 -5.525 35.443 1.883 1.00 45.94 O HETATM 2544 O HOH E1081 20.547 51.970 33.705 1.00 33.82 O HETATM 2545 O HOH E1082 9.027 22.800 26.800 1.00 41.58 O HETATM 2546 O HOH E1083 27.840 32.622 22.291 1.00 39.20 O HETATM 2547 O HOH E1084 4.815 25.117 3.461 1.00 32.50 O HETATM 2548 O HOH E1085 25.010 33.159 21.996 1.00 22.75 O HETATM 2549 O HOH E1086 18.083 42.970 -3.460 1.00 32.37 O HETATM 2550 O HOH E1087 22.957 32.531 -4.112 1.00 30.13 O HETATM 2551 O HOH E1088 23.228 33.954 -6.518 1.00 43.21 O HETATM 2552 O HOH E1089 24.612 59.611 7.777 1.00 29.20 O HETATM 2553 O HOH E1090 26.448 33.877 -6.969 1.00 31.37 O HETATM 2554 O HOH E1091 -1.623 30.768 1.321 1.00 33.65 O HETATM 2555 O HOH E1092 10.827 61.847 20.076 1.00 38.73 O HETATM 2556 O HOH E1093 17.003 45.235 -3.086 1.00 36.54 O HETATM 2557 O HOH E1094 7.535 17.768 25.020 1.00 42.46 O HETATM 2558 O HOH I 84 7.865 48.814 9.858 1.00 21.05 O HETATM 2559 O HOH I 85 -1.633 53.665 16.512 1.00 25.69 O HETATM 2560 O HOH I 86 -1.639 58.099 16.678 1.00 32.19 O HETATM 2561 O HOH I 87 -5.461 52.701 28.632 1.00 42.01 O HETATM 2562 O HOH I 88 -1.302 50.645 18.230 1.00 30.59 O HETATM 2563 O HOH I 89 6.901 72.032 19.732 1.00 43.32 O HETATM 2564 O HOH I 90 3.259 41.140 22.252 1.00 39.80 O HETATM 2565 O HOH I 91 3.461 48.267 15.413 1.00 28.29 O HETATM 2566 O HOH I 92 1.077 46.572 15.840 1.00 34.20 O HETATM 2567 O HOH I 93 -5.068 47.029 13.331 1.00 35.98 O HETATM 2568 O HOH I 94 13.420 60.427 17.082 1.00 33.79 O HETATM 2569 O HOH I 95 -0.977 47.622 14.343 1.00 30.72 O HETATM 2570 O HOH I 96 -9.145 50.084 29.341 1.00 26.29 O HETATM 2571 O HOH I 97 -0.734 55.687 14.653 1.00 29.67 O HETATM 2572 O HOH I 98 -13.615 42.818 16.375 1.00 28.81 O HETATM 2573 O HOH I 99 -15.161 44.942 14.414 1.00 38.87 O HETATM 2574 O HOH I 100 4.237 51.074 23.351 1.00 33.19 O HETATM 2575 O HOH I 101 -15.475 50.530 18.346 1.00 45.90 O HETATM 2576 O HOH I 102 -17.063 51.948 17.224 1.00 44.61 O HETATM 2577 O HOH I 103 5.699 45.423 22.723 1.00 32.32 O HETATM 2578 O HOH I 104 -11.894 47.133 10.800 1.00 39.06 O HETATM 2579 O HOH I 105 0.100 51.478 15.787 1.00 31.03 O CONECT 14 2464 CONECT 299 2464 CONECT 300 2464 CONECT 532 2464 CONECT 551 2464 CONECT 563 2464 CONECT 575 2464 CONECT 1181 2465 CONECT 1194 2465 CONECT 1219 2465 CONECT 1387 2465 CONECT 2464 14 299 300 532 CONECT 2464 551 563 575 CONECT 2465 1181 1194 1219 1387 CONECT 2465 2532 CONECT 2532 2465 MASTER 388 0 2 11 15 0 4 6 2549 2 16 27 END
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Complexes with the same small molecule ligand
PDB Code
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Ligand Name
2k79
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63-mer
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Entry Information
PDB ID
1y4d
Complex Type
Protein-Protein
PDBbind Subset
general set
Protein Name
subtilisin bpn
Ligand Name
63-mer
EC.Number
E.C.3.4.21.62
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Ki=1.2nM
Release Year
2005
Protein/NA Sequence
Check fasta file
Primary Reference
Biochemistry v44 pp. 6823-30, 2005
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P00782
Q40059
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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