USER MOD reduce.3.24.130724 H: found=0, std=0, add=2361, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER CARBOXYSOME 18-JUN-05 2A18 TITLE CARBOXYSOME SHELL PROTEIN CCMK4, CRYSTAL FORM 2 COMPND MOL_ID: 1; COMPND 2 MOLECULE: CARBON DIOXIDE CONCENTRATING MECHANISM PROTEIN CCMK HOMOLO COMPND 3 4; COMPND 4 CHAIN: A, B, C; COMPND 5 SYNONYM: CCMK4; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP.; SOURCE 3 ORGANISM_TAXID: 1148; SOURCE 4 STRAIN: PCC 6803; SOURCE 5 GENE: CCMK4; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21-GOLD DE3; SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 0 EXPRESSION_SYSTEM_PLASMID: PET22B KEYWDS CYCLIC HEXAMER; C6 POINT SYMMETRY, CARBOXYSOME EXPDTA X-RAY DIFFRACTION AUTHOR C.A.KERFELD,M.R.SAWAYA,S.TANAKA,C.V.NGUYEN,M.PHILLIPS,M.BEEBY, AUTHOR 2 T.O.YEATES REVDAT 3 13-JUL-11 2A18 1 VERSN REVDAT 2 24-FEB-09 2A18 1 VERSN REVDAT 1 09-AUG-05 2A18 0 JRNL AUTH C.A.KERFELD,M.R.SAWAYA,S.TANAKA,C.V.NGUYEN,M.PHILLIPS, JRNL AUTH 2 M.BEEBY,T.O.YEATES JRNL TITL PROTEIN STRUCTURES FORMING THE SHELL OF PRIMITIVE BACTERIAL JRNL TITL 2 ORGANELLES JRNL REF SCIENCE V. 309 936 2005 JRNL REFN ISSN 0036-8075 JRNL PMID 16081736 JRNL DOI 10.1126/SCIENCE.1113397 REMARK 2 REMARK 2 RESOLUTION. 2.28 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.2 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) : 2.28 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 62.50 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.8 REMARK 3 NUMBER OF REFLECTIONS : 13071 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.204 REMARK 3 R VALUE (WORKING SET) : 0.203 REMARK 3 FREE R VALUE : 0.222 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 686 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) : 2.28 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.34 REMARK 3 REFLECTION IN BIN (WORKING SET) : 935 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 100.00 REMARK 3 BIN R VALUE (WORKING SET) : 0.2340 REMARK 3 BIN FREE R VALUE SET COUNT : 57 REMARK 3 BIN FREE R VALUE : 0.2650 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2325 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 3 REMARK 3 SOLVENT ATOMS : 80 REMARK 3 REMARK 3 B VALUES. REMARK 3 B VALUE TYPE : LIKELY RESIDUAL REMARK 3 FROM WILSON PLOT (A**2) : 42.50 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 35.61 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -1.78000 REMARK 3 B22 (A**2) : 1.30000 REMARK 3 B33 (A**2) : 0.48000 REMARK 3 B12 (A**2) : 0.00000 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): 0.395 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.222 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.163 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 13.331 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.942 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.936 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2367 ; 0.008 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 3222 ; 1.006 ; 1.958 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 309 ; 4.292 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 96 ;36.437 ;23.438 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 375 ;13.374 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 21 ;18.779 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 381 ; 0.064 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1797 ; 0.003 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 1109 ; 0.190 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 1689 ; 0.291 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 132 ; 0.103 ; 0.200 REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): 69 ; 0.158 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 8 ; 0.120 ; 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): 1597 ; 0.635 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2505 ; 1.129 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 858 ; 1.161 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 717 ; 2.019 ; 4.500 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 : 5 REMARK 3 REMARK 3 NCS GROUP NUMBER : 1 REMARK 3 CHAIN NAMES : A B C REMARK 3 NUMBER OF COMPONENTS NCS GROUP : 1 REMARK 3 COMPONENT C SSSEQI TO C SSSEQI CODE REMARK 3 1 A 4 A 29 1 REMARK 3 1 B 4 B 29 1 REMARK 3 1 C 4 C 29 1 REMARK 3 GROUP CHAIN COUNT RMS WEIGHT REMARK 3 TIGHT POSITIONAL 1 A (A): 172 ; 0.01 ; 0.05 REMARK 3 TIGHT POSITIONAL 1 B (A): 172 ; 0.02 ; 0.05 REMARK 3 TIGHT POSITIONAL 1 C (A): 172 ; 0.01 ; 0.05 REMARK 3 TIGHT THERMAL 1 A (A**2): 172 ; 0.03 ; 0.50 REMARK 3 TIGHT THERMAL 1 B (A**2): 172 ; 0.03 ; 0.50 REMARK 3 TIGHT THERMAL 1 C (A**2): 172 ; 0.03 ; 0.50 REMARK 3 REMARK 3 NCS GROUP NUMBER : 2 REMARK 3 CHAIN NAMES : A B C REMARK 3 NUMBER OF COMPONENTS NCS GROUP : 1 REMARK 3 COMPONENT C SSSEQI TO C SSSEQI CODE REMARK 3 1 A 39 A 72 1 REMARK 3 1 B 39 B 72 1 REMARK 3 1 C 39 C 72 1 REMARK 3 GROUP CHAIN COUNT RMS WEIGHT REMARK 3 TIGHT POSITIONAL 2 A (A): 244 ; 0.01 ; 0.05 REMARK 3 TIGHT POSITIONAL 2 B (A): 244 ; 0.01 ; 0.05 REMARK 3 TIGHT POSITIONAL 2 C (A): 244 ; 0.01 ; 0.05 REMARK 3 TIGHT THERMAL 2 A (A**2): 244 ; 0.03 ; 0.50 REMARK 3 TIGHT THERMAL 2 B (A**2): 244 ; 0.03 ; 0.50 REMARK 3 TIGHT THERMAL 2 C (A**2): 244 ; 0.03 ; 0.50 REMARK 3 REMARK 3 NCS GROUP NUMBER : 3 REMARK 3 CHAIN NAMES : A B C REMARK 3 NUMBER OF COMPONENTS NCS GROUP : 1 REMARK 3 COMPONENT C SSSEQI TO C SSSEQI CODE REMARK 3 1 A 74 A 81 1 REMARK 3 1 B 74 B 81 1 REMARK 3 1 C 74 C 81 1 REMARK 3 GROUP CHAIN COUNT RMS WEIGHT REMARK 3 TIGHT POSITIONAL 3 A (A): 67 ; 0.01 ; 0.05 REMARK 3 TIGHT POSITIONAL 3 B (A): 67 ; 0.01 ; 0.05 REMARK 3 TIGHT POSITIONAL 3 C (A): 67 ; 0.01 ; 0.05 REMARK 3 TIGHT THERMAL 3 A (A**2): 67 ; 0.02 ; 0.50 REMARK 3 TIGHT THERMAL 3 B (A**2): 67 ; 0.02 ; 0.50 REMARK 3 TIGHT THERMAL 3 C (A**2): 67 ; 0.02 ; 0.50 REMARK 3 REMARK 3 NCS GROUP NUMBER : 4 REMARK 3 CHAIN NAMES : A B C REMARK 3 NUMBER OF COMPONENTS NCS GROUP : 1 REMARK 3 COMPONENT C SSSEQI TO C SSSEQI CODE REMARK 3 1 A 83 A 107 1 REMARK 3 1 B 83 B 107 1 REMARK 3 1 C 83 C 107 1 REMARK 3 GROUP CHAIN COUNT RMS WEIGHT REMARK 3 TIGHT POSITIONAL 4 A (A): 198 ; 0.01 ; 0.05 REMARK 3 TIGHT POSITIONAL 4 B (A): 198 ; 0.01 ; 0.05 REMARK 3 TIGHT POSITIONAL 4 C (A): 198 ; 0.01 ; 0.05 REMARK 3 TIGHT THERMAL 4 A (A**2): 198 ; 0.02 ; 0.50 REMARK 3 TIGHT THERMAL 4 B (A**2): 198 ; 0.02 ; 0.50 REMARK 3 TIGHT THERMAL 4 C (A**2): 198 ; 0.02 ; 0.50 REMARK 3 REMARK 3 NCS GROUP NUMBER : 5 REMARK 3 CHAIN NAMES : A B C REMARK 3 NUMBER OF COMPONENTS NCS GROUP : 1 REMARK 3 COMPONENT C SSSEQI TO C SSSEQI CODE REMARK 3 1 A 31 A 37 1 REMARK 3 1 B 31 B 37 1 REMARK 3 1 C 31 C 37 1 REMARK 3 GROUP CHAIN COUNT RMS WEIGHT REMARK 3 TIGHT POSITIONAL 5 A (A): 54 ; 0.01 ; 0.05 REMARK 3 TIGHT POSITIONAL 5 B (A): 54 ; 0.01 ; 0.05 REMARK 3 TIGHT POSITIONAL 5 C (A): 54 ; 0.01 ; 0.05 REMARK 3 TIGHT THERMAL 5 A (A**2): 54 ; 0.03 ; 0.50 REMARK 3 TIGHT THERMAL 5 B (A**2): 54 ; 0.03 ; 0.50 REMARK 3 TIGHT THERMAL 5 C (A**2): 54 ; 0.03 ; 0.50 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : 3 REMARK 3 REMARK 3 TLS GROUP : 1 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 4 A 107 REMARK 3 ORIGIN FOR THE GROUP (A): 16.4848 12.5386 15.5039 REMARK 3 T TENSOR REMARK 3 T11: -0.0826 T22: -0.0507 REMARK 3 T33: -0.0869 T12: 0.0401 REMARK 3 T13: -0.0268 T23: -0.0778 REMARK 3 L TENSOR REMARK 3 L11: 2.9337 L22: 2.8500 REMARK 3 L33: 1.8271 L12: 1.4596 REMARK 3 L13: -0.7592 L23: -0.9892 REMARK 3 S TENSOR REMARK 3 S11: 0.0031 S12: -0.0624 S13: 0.0959 REMARK 3 S21: 0.1783 S22: -0.0980 S23: 0.0250 REMARK 3 S31: -0.2089 S32: -0.0771 S33: 0.0949 REMARK 3 REMARK 3 TLS GROUP : 2 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 4 B 107 REMARK 3 ORIGIN FOR THE GROUP (A): 14.9823 -9.9831 15.5258 REMARK 3 T TENSOR REMARK 3 T11: -0.1024 T22: -0.0170 REMARK 3 T33: -0.0603 T12: -0.0726 REMARK 3 T13: 0.0523 T23: -0.0837 REMARK 3 L TENSOR REMARK 3 L11: 1.9296 L22: 4.0670 REMARK 3 L33: 2.2511 L12: -1.3908 REMARK 3 L13: 0.4411 L23: -0.7960 REMARK 3 S TENSOR REMARK 3 S11: -0.0972 S12: -0.0900 S13: -0.0638 REMARK 3 S21: 0.1536 S22: -0.0673 S23: 0.1436 REMARK 3 S31: 0.1044 S32: -0.2310 S33: 0.1644 REMARK 3 REMARK 3 TLS GROUP : 3 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : C 4 C 107 REMARK 3 ORIGIN FOR THE GROUP (A): 36.7655 22.4717 15.5400 REMARK 3 T TENSOR REMARK 3 T11: -0.0091 T22: -0.0944 REMARK 3 T33: -0.0758 T12: -0.0373 REMARK 3 T13: -0.0910 T23: -0.0152 REMARK 3 L TENSOR REMARK 3 L11: 4.3042 L22: 1.8517 REMARK 3 L33: 1.7798 L12: -0.4545 REMARK 3 L13: -0.9752 L23: -0.0329 REMARK 3 S TENSOR REMARK 3 S11: -0.0186 S12: -0.1783 S13: 0.1393 REMARK 3 S21: 0.0892 S22: -0.0890 S23: -0.0650 REMARK 3 S31: -0.1683 S32: 0.1124 S33: 0.1075 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING REMARK 3 POSITIONS REMARK 4 REMARK 4 2A18 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 11-JUL-05. REMARK 100 THE RCSB ID CODE IS RCSB033364. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 11-JUN-05 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 4.6 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ALS REMARK 200 BEAMLINE : 8.2.1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.95373 REMARK 200 MONOCHROMATOR : DOUBLE CRYSTAL SI 111 REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 210 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DCS REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 13846 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.280 REMARK 200 RESOLUTION RANGE LOW (A) : 90.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.9 REMARK 200 DATA REDUNDANCY : 13.600 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 0.11300 REMARK 200 FOR THE DATA SET : 23.2000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.28 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.36 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 13.90 REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : 0.37300 REMARK 200 FOR SHELL : 8.700 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: 2A10 REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 43.60 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.20 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 0.1M SODIUM CITRATE, PH 4.6, 30% PEG REMARK 280 4000, 0.2M AMMONIUM ACETATE, VAPOR DIFFUSION, HANGING DROP, REMARK 280 TEMPERATURE 293K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z REMARK 290 3555 -X+1/2,Y+1/2,-Z REMARK 290 4555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 35.27450 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 62.52000 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 35.27450 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 62.52000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 300 REMARK: THE BIOLOGICAL ASSEMBLY IS GENERATED BY THE TWO-FOLD AXIS: REMARK 300 1-X,-Y,Z 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: HEXAMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: HEXAMERIC REMARK 350 SOFTWARE USED: PISA,PQS REMARK 350 TOTAL BURIED SURFACE AREA: 13640 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 23660 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -97.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, C 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 350 BIOMT1 2 -1.000000 0.000000 0.000000 70.54900 REMARK 350 BIOMT2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 350 BIOMT3 2 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 MET A 1 REMARK 465 SER A 2 REMARK 465 ALA A 3 REMARK 465 GLY A 108 REMARK 465 LEU A 109 REMARK 465 ASN A 110 REMARK 465 ARG A 111 REMARK 465 ARG A 112 REMARK 465 GLY A 113 REMARK 465 VAL A 114 REMARK 465 PRO A 115 REMARK 465 ARG A 116 REMARK 465 GLY A 117 REMARK 465 LEU A 118 REMARK 465 GLU A 119 REMARK 465 HIS A 120 REMARK 465 HIS A 121 REMARK 465 HIS A 122 REMARK 465 HIS A 123 REMARK 465 HIS A 124 REMARK 465 HIS A 125 REMARK 465 MET B 1 REMARK 465 SER B 2 REMARK 465 ALA B 3 REMARK 465 GLY B 108 REMARK 465 LEU B 109 REMARK 465 ASN B 110 REMARK 465 ARG B 111 REMARK 465 ARG B 112 REMARK 465 GLY B 113 REMARK 465 VAL B 114 REMARK 465 PRO B 115 REMARK 465 ARG B 116 REMARK 465 GLY B 117 REMARK 465 LEU B 118 REMARK 465 GLU B 119 REMARK 465 HIS B 120 REMARK 465 HIS B 121 REMARK 465 HIS B 122 REMARK 465 HIS B 123 REMARK 465 HIS B 124 REMARK 465 HIS B 125 REMARK 465 MET C 1 REMARK 465 SER C 2 REMARK 465 ALA C 3 REMARK 465 GLY C 108 REMARK 465 LEU C 109 REMARK 465 ASN C 110 REMARK 465 ARG C 111 REMARK 465 ARG C 112 REMARK 465 GLY C 113 REMARK 465 VAL C 114 REMARK 465 PRO C 115 REMARK 465 ARG C 116 REMARK 465 GLY C 117 REMARK 465 LEU C 118 REMARK 465 GLU C 119 REMARK 465 HIS C 120 REMARK 465 HIS C 121 REMARK 465 HIS C 122 REMARK 465 HIS C 123 REMARK 465 HIS C 124 REMARK 465 HIS C 125 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NH4 A 126 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NH4 B 126 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NH4 C 126 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 2A10 RELATED DB: PDB REMARK 900 THE SAME PROTEIN IN A DIFFERENT CRYSTAL PACKING REMARK 900 RELATED ID: 2A1B RELATED DB: PDB REMARK 900 CCMK2, AN ORTHOLOG AND ALSO A COMPONENT OF THE CARBOXYSOME REMARK 900 SHELL DBREF 2A18 A 2 112 UNP P73407 CCMK4_SYNY3 1 111 DBREF 2A18 B 2 112 UNP P73407 CCMK4_SYNY3 1 111 DBREF 2A18 C 2 112 UNP P73407 CCMK4_SYNY3 1 111 SEQADV 2A18 MET A 1 UNP P73407 INITIATING METHIONINE SEQADV 2A18 GLY A 113 UNP P73407 EXPRESSION TAG SEQADV 2A18 VAL A 114 UNP P73407 EXPRESSION TAG SEQADV 2A18 PRO A 115 UNP P73407 EXPRESSION TAG SEQADV 2A18 ARG A 116 UNP P73407 EXPRESSION TAG SEQADV 2A18 GLY A 117 UNP P73407 EXPRESSION TAG SEQADV 2A18 LEU A 118 UNP P73407 EXPRESSION TAG SEQADV 2A18 GLU A 119 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS A 120 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS A 121 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS A 122 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS A 123 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS A 124 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS A 125 UNP P73407 EXPRESSION TAG SEQADV 2A18 MET B 1 UNP P73407 INITIATING METHIONINE SEQADV 2A18 GLY B 113 UNP P73407 EXPRESSION TAG SEQADV 2A18 VAL B 114 UNP P73407 EXPRESSION TAG SEQADV 2A18 PRO B 115 UNP P73407 EXPRESSION TAG SEQADV 2A18 ARG B 116 UNP P73407 EXPRESSION TAG SEQADV 2A18 GLY B 117 UNP P73407 EXPRESSION TAG SEQADV 2A18 LEU B 118 UNP P73407 EXPRESSION TAG SEQADV 2A18 GLU B 119 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS B 120 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS B 121 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS B 122 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS B 123 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS B 124 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS B 125 UNP P73407 EXPRESSION TAG SEQADV 2A18 MET C 1 UNP P73407 INITIATING METHIONINE SEQADV 2A18 GLY C 113 UNP P73407 EXPRESSION TAG SEQADV 2A18 VAL C 114 UNP P73407 EXPRESSION TAG SEQADV 2A18 PRO C 115 UNP P73407 EXPRESSION TAG SEQADV 2A18 ARG C 116 UNP P73407 EXPRESSION TAG SEQADV 2A18 GLY C 117 UNP P73407 EXPRESSION TAG SEQADV 2A18 LEU C 118 UNP P73407 EXPRESSION TAG SEQADV 2A18 GLU C 119 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS C 120 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS C 121 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS C 122 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS C 123 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS C 124 UNP P73407 EXPRESSION TAG SEQADV 2A18 HIS C 125 UNP P73407 EXPRESSION TAG SEQRES 1 A 125 MET SER ALA GLN SER ALA VAL GLY SER ILE GLU THR ILE SEQRES 2 A 125 GLY PHE PRO GLY ILE LEU ALA ALA ALA ASP ALA MET VAL SEQRES 3 A 125 LYS ALA GLY ARG ILE THR ILE VAL GLY TYR ILE ARG ALA SEQRES 4 A 125 GLY SER ALA ARG PHE THR LEU ASN ILE ARG GLY ASP VAL SEQRES 5 A 125 GLN GLU VAL LYS THR ALA MET ALA ALA GLY ILE ASP ALA SEQRES 6 A 125 ILE ASN ARG THR GLU GLY ALA ASP VAL LYS THR TRP VAL SEQRES 7 A 125 ILE ILE PRO ARG PRO HIS GLU ASN VAL VAL ALA VAL LEU SEQRES 8 A 125 PRO ILE ASP PHE SER PRO GLU VAL GLU PRO PHE ARG GLU SEQRES 9 A 125 ALA ALA GLU GLY LEU ASN ARG ARG GLY VAL PRO ARG GLY SEQRES 10 A 125 LEU GLU HIS HIS HIS HIS HIS HIS SEQRES 1 B 125 MET SER ALA GLN SER ALA VAL GLY SER ILE GLU THR ILE SEQRES 2 B 125 GLY PHE PRO GLY ILE LEU ALA ALA ALA ASP ALA MET VAL SEQRES 3 B 125 LYS ALA GLY ARG ILE THR ILE VAL GLY TYR ILE ARG ALA SEQRES 4 B 125 GLY SER ALA ARG PHE THR LEU ASN ILE ARG GLY ASP VAL SEQRES 5 B 125 GLN GLU VAL LYS THR ALA MET ALA ALA GLY ILE ASP ALA SEQRES 6 B 125 ILE ASN ARG THR GLU GLY ALA ASP VAL LYS THR TRP VAL SEQRES 7 B 125 ILE ILE PRO ARG PRO HIS GLU ASN VAL VAL ALA VAL LEU SEQRES 8 B 125 PRO ILE ASP PHE SER PRO GLU VAL GLU PRO PHE ARG GLU SEQRES 9 B 125 ALA ALA GLU GLY LEU ASN ARG ARG GLY VAL PRO ARG GLY SEQRES 10 B 125 LEU GLU HIS HIS HIS HIS HIS HIS SEQRES 1 C 125 MET SER ALA GLN SER ALA VAL GLY SER ILE GLU THR ILE SEQRES 2 C 125 GLY PHE PRO GLY ILE LEU ALA ALA ALA ASP ALA MET VAL SEQRES 3 C 125 LYS ALA GLY ARG ILE THR ILE VAL GLY TYR ILE ARG ALA SEQRES 4 C 125 GLY SER ALA ARG PHE THR LEU ASN ILE ARG GLY ASP VAL SEQRES 5 C 125 GLN GLU VAL LYS THR ALA MET ALA ALA GLY ILE ASP ALA SEQRES 6 C 125 ILE ASN ARG THR GLU GLY ALA ASP VAL LYS THR TRP VAL SEQRES 7 C 125 ILE ILE PRO ARG PRO HIS GLU ASN VAL VAL ALA VAL LEU SEQRES 8 C 125 PRO ILE ASP PHE SER PRO GLU VAL GLU PRO PHE ARG GLU SEQRES 9 C 125 ALA ALA GLU GLY LEU ASN ARG ARG GLY VAL PRO ARG GLY SEQRES 10 C 125 LEU GLU HIS HIS HIS HIS HIS HIS HET NH4 A 126 1 HET NH4 B 126 1 HET NH4 C 126 1 HETNAM NH4 AMMONIUM ION FORMUL 4 NH4 3(H4 N 1+) FORMUL 7 HOH *80(H2 O) HELIX 1 1 GLY A 14 GLY A 29 1 16 HELIX 2 2 ASP A 51 THR A 69 1 19 HELIX 3 3 HIS A 84 LEU A 91 1 8 HELIX 4 4 SER A 96 GLU A 98 5 3 HELIX 5 5 VAL A 99 GLU A 107 1 9 HELIX 6 6 GLY B 14 GLY B 29 1 16 HELIX 7 7 ASP B 51 THR B 69 1 19 HELIX 8 8 HIS B 84 LEU B 91 1 8 HELIX 9 9 SER B 96 GLU B 98 5 3 HELIX 10 10 VAL B 99 GLU B 107 1 9 HELIX 11 11 GLY C 14 GLY C 29 1 16 HELIX 12 12 ASP C 51 THR C 69 1 19 HELIX 13 13 HIS C 84 LEU C 91 1 8 HELIX 14 14 SER C 96 GLU C 98 5 3 HELIX 15 15 VAL C 99 GLU C 107 1 9 SHEET 1 A 4 ILE A 31 GLY A 40 0 SHEET 2 A 4 ARG A 43 GLY A 50 -1 O ARG A 49 N THR A 32 SHEET 3 A 4 ALA A 6 ILE A 13 -1 N GLY A 8 O ILE A 48 SHEET 4 A 4 VAL A 74 ILE A 80 -1 O ILE A 80 N VAL A 7 SHEET 1 B 4 THR B 32 GLY B 40 0 SHEET 2 B 4 ARG B 43 GLY B 50 -1 O ARG B 49 N THR B 32 SHEET 3 B 4 ALA B 6 ILE B 13 -1 N GLY B 8 O ILE B 48 SHEET 4 B 4 VAL B 74 ILE B 80 -1 O ILE B 80 N VAL B 7 SHEET 1 C 4 ILE C 31 GLY C 40 0 SHEET 2 C 4 ARG C 43 GLY C 50 -1 O ARG C 49 N THR C 32 SHEET 3 C 4 ALA C 6 ILE C 13 -1 N GLY C 8 O ILE C 48 SHEET 4 C 4 VAL C 74 ILE C 80 -1 O ILE C 80 N VAL C 7 SITE *** AC1 5 ILE A 66 ASN A 67 THR A 69 ALA A 72 SITE *** AC1 5 HOH A 132 SITE *** AC2 5 ILE B 66 ASN B 67 THR B 69 ALA B 72 SITE *** AC2 5 HOH B 128 SITE *** AC3 6 ILE C 66 ASN C 67 THR C 69 ALA C 72 SITE *** AC3 6 HOH C 134 HOH C 137 CRYST1 70.549 125.040 32.521 90.00 90.00 90.00 P 21 21 2 12 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 0.014175 0.000000 0.000000 0.00000 SCALE2 0.000000 0.007997 0.000000 0.00000 SCALE3 0.000000 0.000000 0.030749 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: C 25 MET CE :methyl -160:sc= 0 (180deg=-0.493) USER MOD Set 1.2: C 59 MET CE :methyl 165:sc= -0.0513 (180deg=-0.326) USER MOD Set 2.1: C 9 SER OG : rot 85:sc= 0.979 USER MOD Set 2.2: C 47 ASN :FLIP amide:sc= 1.59 F(o=0.26,f=2.6) USER MOD Set 3.1: B 9 SER OG : rot 85:sc= 0.83 USER MOD Set 3.2: B 47 ASN :FLIP amide:sc= 1.47 F(o=0.46,f=2.3) USER MOD Set 4.1: A 25 MET CE :methyl -162:sc= 0 (180deg=-0.456) USER MOD Set 4.2: A 59 MET CE :methyl 164:sc= -0.0616 (180deg=-0.365) USER MOD Set 5.1: A 9 SER OG : rot 86:sc= 0.952 USER MOD Set 5.2: A 47 ASN :FLIP amide:sc= 1.54 F(o=0.29,f=2.5) USER MOD Single : A 4 GLN : amide:sc= 1.14 K(o=1.1,f=-1.3) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 45:sc= 1.09 USER MOD Single : A 27 LYS NZ :NH3+ -165:sc= 2.35 (180deg=2.12) USER MOD Single : A 32 THR OG1 : rot 130:sc=-0.00778 USER MOD Single : A 36 TYR OH : rot -14:sc= 2.47 USER MOD Single : A 41 SER OG : rot -178:sc= -1.47! USER MOD Single : A 45 THR OG1 : rot -85:sc= 0.742 USER MOD Single : A 53 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 74:sc= 0.288 USER MOD Single : A 67 ASN : amide:sc= 1.02 K(o=1,f=-1.6) USER MOD Single : A 69 THR OG1 : rot 69:sc= 1 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 50:sc= 1.95 USER MOD Single : A 84 HIS : no HD1:sc= 0.567 K(o=0.57,f=-3.9!) USER MOD Single : A 86 ASN : amide:sc= -0.577 K(o=-0.58,f=-3!) USER MOD Single : A 96 SER OG : rot -91:sc= 0.0762 USER MOD Single : B 4 GLN : amide:sc= 0.0866 K(o=0.087,f=-2) USER MOD Single : B 5 SER OG : rot 180:sc= 0 USER MOD Single : B 12 THR OG1 : rot 44:sc= 1.21 USER MOD Single : B 25 MET CE :methyl -161:sc= 0 (180deg=-0.514) USER MOD Single : B 27 LYS NZ :NH3+ -165:sc= 2.53 (180deg=2.45) USER MOD Single : B 32 THR OG1 : rot 110:sc= -0.0904 USER MOD Single : B 36 TYR OH : rot -175:sc= 2.33 USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 45 THR OG1 : rot -85:sc= 0.786 USER MOD Single : B 53 GLN : amide:sc=-0.00626 X(o=-0.0063,f=-0.37) USER MOD Single : B 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 THR OG1 : rot 73:sc= 0.272 USER MOD Single : B 59 MET CE :methyl 166:sc= -0.0433 (180deg=-0.238) USER MOD Single : B 67 ASN : amide:sc= 1.04 K(o=1,f=-2.3!) USER MOD Single : B 69 THR OG1 : rot 70:sc= 1.04 USER MOD Single : B 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 76 THR OG1 : rot 180:sc= 0 USER MOD Single : B 84 HIS : no HD1:sc= 0.558 K(o=0.56,f=-4.1!) USER MOD Single : B 86 ASN :FLIP amide:sc= -0.0527 F(o=-1,f=-0.053) USER MOD Single : B 96 SER OG : rot -84:sc= 0.333 USER MOD Single : C 4 GLN : amide:sc= 0.0571 K(o=0.057,f=-2.2) USER MOD Single : C 5 SER OG : rot 180:sc= 0 USER MOD Single : C 12 THR OG1 : rot 38:sc= 1.13 USER MOD Single : C 27 LYS NZ :NH3+ -161:sc= 1.26 (180deg=1.01) USER MOD Single : C 32 THR OG1 : rot 110:sc= -0.185 USER MOD Single : C 36 TYR OH : rot -3:sc= 2.69 USER MOD Single : C 41 SER OG : rot -170:sc= -1.5! USER MOD Single : C 45 THR OG1 : rot -84:sc= 0.673 USER MOD Single : C 53 GLN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : C 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 57 THR OG1 : rot 72:sc= 0.247 USER MOD Single : C 67 ASN : amide:sc= -0.0175 K(o=-0.018,f=-0.88) USER MOD Single : C 69 THR OG1 : rot 69:sc= 1.03 USER MOD Single : C 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 76 THR OG1 : rot 50:sc= 1.93 USER MOD Single : C 84 HIS : no HD1:sc= 0.561 K(o=0.56,f=-4.1!) USER MOD Single : C 86 ASN : amide:sc= -0.626 K(o=-0.63,f=-2.5!) USER MOD Single : C 96 SER OG : rot -86:sc= 0.223 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 4 3.288 6.588 23.543 1.00 42.01 N ATOM 2 CA GLN A 4 4.663 6.773 22.993 1.00 41.93 C ATOM 3 C GLN A 4 4.656 7.791 21.857 1.00 41.14 C ATOM 4 O GLN A 4 3.977 7.596 20.840 1.00 41.34 O ATOM 5 CB GLN A 4 5.242 5.439 22.490 1.00 42.37 C ATOM 6 CG GLN A 4 5.491 4.375 23.570 1.00 44.20 C ATOM 7 CD GLN A 4 6.683 4.686 24.474 1.00 46.67 C ATOM 8 OE1 GLN A 4 7.565 5.476 24.125 1.00 47.37 O ATOM 9 NE2 GLN A 4 6.712 4.056 25.646 1.00 47.46 N ATOM 0 HA GLN A 4 5.225 7.104 23.711 1.00 41.93 H new ATOM 0 HB2 GLN A 4 4.635 5.070 21.829 1.00 42.37 H new ATOM 0 HB3 GLN A 4 6.080 5.619 22.037 1.00 42.37 H new ATOM 0 HG2 GLN A 4 4.695 4.288 24.117 1.00 44.20 H new ATOM 0 HG3 GLN A 4 5.636 3.517 23.141 1.00 44.20 H new ATOM 0 HE21 GLN A 4 6.081 3.512 25.857 1.00 47.46 H new ATOM 0 HE22 GLN A 4 7.362 4.193 26.192 1.00 47.46 H new ATOM 10 N SER A 5 5.409 8.874 22.036 1.00 39.78 N ATOM 11 CA SER A 5 5.585 9.869 20.986 1.00 38.51 C ATOM 12 C SER A 5 6.446 9.313 19.852 1.00 37.27 C ATOM 13 O SER A 5 7.208 8.355 20.044 1.00 37.16 O ATOM 14 CB SER A 5 6.202 11.148 21.551 1.00 38.84 C ATOM 15 OG SER A 5 7.515 10.909 22.018 1.00 39.54 O ATOM 0 H SER A 5 5.829 9.050 22.765 1.00 39.78 H new ATOM 0 HA SER A 5 4.711 10.086 20.626 1.00 38.51 H new ATOM 0 HB2 SER A 5 6.218 11.834 20.866 1.00 38.84 H new ATOM 0 HB3 SER A 5 5.653 11.484 22.276 1.00 38.84 H new ATOM 0 HG SER A 5 7.838 11.622 22.323 1.00 39.54 H new ATOM 16 N ALA A 6 6.317 9.917 18.675 1.00 35.71 N ATOM 17 CA ALA A 6 7.014 9.464 17.470 1.00 34.31 C ATOM 18 C ALA A 6 8.533 9.486 17.609 1.00 33.16 C ATOM 19 O ALA A 6 9.080 10.211 18.436 1.00 32.88 O ATOM 20 CB ALA A 6 6.578 10.296 16.260 1.00 34.22 C ATOM 0 H ALA A 6 5.819 10.607 18.550 1.00 35.71 H new ATOM 0 HA ALA A 6 6.763 8.537 17.337 1.00 34.31 H new ATOM 0 HB1 ALA A 6 7.046 9.987 15.469 1.00 34.22 H new ATOM 0 HB2 ALA A 6 5.622 10.199 16.128 1.00 34.22 H new ATOM 0 HB3 ALA A 6 6.789 11.230 16.416 1.00 34.22 H new ATOM 21 N VAL A 7 9.202 8.676 16.798 1.00 31.90 N ATOM 22 CA VAL A 7 10.658 8.697 16.711 1.00 30.78 C ATOM 23 C VAL A 7 11.112 8.986 15.276 1.00 30.39 C ATOM 24 O VAL A 7 10.585 8.417 14.314 1.00 30.38 O ATOM 25 CB VAL A 7 11.309 7.396 17.283 1.00 30.80 C ATOM 26 CG1 VAL A 7 10.690 6.135 16.679 1.00 30.20 C ATOM 27 CG2 VAL A 7 12.834 7.406 17.112 1.00 30.13 C ATOM 0 H VAL A 7 8.826 8.099 16.283 1.00 31.90 H new ATOM 0 HA VAL A 7 10.972 9.422 17.274 1.00 30.78 H new ATOM 0 HB VAL A 7 11.121 7.381 18.234 1.00 30.80 H new ATOM 0 HG11 VAL A 7 11.118 5.351 17.057 1.00 30.20 H new ATOM 0 HG12 VAL A 7 9.741 6.112 16.879 1.00 30.20 H new ATOM 0 HG13 VAL A 7 10.817 6.140 15.717 1.00 30.20 H new ATOM 0 HG21 VAL A 7 13.206 6.587 17.476 1.00 30.13 H new ATOM 0 HG22 VAL A 7 13.054 7.469 16.169 1.00 30.13 H new ATOM 0 HG23 VAL A 7 13.208 8.168 17.582 1.00 30.13 H new ATOM 28 N GLY A 8 12.069 9.900 15.149 1.00 29.66 N ATOM 29 CA GLY A 8 12.694 10.201 13.868 1.00 28.77 C ATOM 30 C GLY A 8 14.155 9.806 13.931 1.00 28.47 C ATOM 31 O GLY A 8 14.821 10.006 14.951 1.00 28.14 O ATOM 0 H GLY A 8 12.374 10.364 15.806 1.00 29.66 H new ATOM 0 HA2 GLY A 8 12.247 9.719 13.155 1.00 28.77 H new ATOM 0 HA3 GLY A 8 12.610 11.146 13.668 1.00 28.77 H new ATOM 32 N SER A 9 14.644 9.229 12.838 1.00 27.97 N ATOM 33 CA SER A 9 16.020 8.780 12.752 1.00 27.74 C ATOM 34 C SER A 9 16.598 9.170 11.404 1.00 27.38 C ATOM 35 O SER A 9 15.990 8.926 10.363 1.00 27.66 O ATOM 36 CB SER A 9 16.104 7.265 12.948 1.00 27.66 C ATOM 37 OG SER A 9 17.450 6.858 13.092 1.00 27.76 O ATOM 0 H SER A 9 14.183 9.088 12.126 1.00 27.97 H new ATOM 0 HA SER A 9 16.535 9.205 13.455 1.00 27.74 H new ATOM 0 HB2 SER A 9 15.597 7.006 13.733 1.00 27.66 H new ATOM 0 HB3 SER A 9 15.703 6.813 12.189 1.00 27.66 H new ATOM 0 HG SER A 9 17.678 6.925 13.898 1.00 27.76 H new ATOM 38 N ILE A 10 17.774 9.783 11.434 1.00 27.05 N ATOM 39 CA ILE A 10 18.438 10.240 10.223 1.00 26.63 C ATOM 40 C ILE A 10 19.910 9.870 10.304 1.00 26.68 C ATOM 41 O ILE A 10 20.518 9.928 11.375 1.00 26.45 O ATOM 42 CB ILE A 10 18.223 11.768 9.988 1.00 26.64 C ATOM 43 CG1 ILE A 10 18.569 12.162 8.543 1.00 26.78 C ATOM 44 CG2 ILE A 10 18.968 12.619 11.041 1.00 26.39 C ATOM 45 CD1 ILE A 10 17.985 13.506 8.121 1.00 26.47 C ATOM 0 H ILE A 10 18.209 9.946 12.158 1.00 27.05 H new ATOM 0 HA ILE A 10 18.046 9.799 9.453 1.00 26.63 H new ATOM 0 HB ILE A 10 17.280 11.960 10.109 1.00 26.64 H new ATOM 0 HG12 ILE A 10 19.534 12.192 8.446 1.00 26.78 H new ATOM 0 HG13 ILE A 10 18.245 11.474 7.941 1.00 26.78 H new ATOM 0 HG21 ILE A 10 18.813 13.560 10.865 1.00 26.39 H new ATOM 0 HG22 ILE A 10 18.640 12.398 11.927 1.00 26.39 H new ATOM 0 HG23 ILE A 10 19.919 12.434 10.993 1.00 26.39 H new ATOM 0 HD11 ILE A 10 18.238 13.696 7.204 1.00 26.47 H new ATOM 0 HD12 ILE A 10 17.018 13.474 8.189 1.00 26.47 H new ATOM 0 HD13 ILE A 10 18.327 14.204 8.701 1.00 26.47 H new ATOM 46 N GLU A 11 20.466 9.455 9.172 1.00 26.78 N ATOM 47 CA GLU A 11 21.851 9.032 9.109 1.00 27.07 C ATOM 48 C GLU A 11 22.551 9.703 7.937 1.00 27.07 C ATOM 49 O GLU A 11 22.004 9.807 6.834 1.00 26.93 O ATOM 50 CB GLU A 11 21.940 7.505 9.004 1.00 26.83 C ATOM 51 CG GLU A 11 23.323 6.932 9.264 1.00 27.58 C ATOM 52 CD GLU A 11 23.314 5.424 9.480 1.00 28.06 C ATOM 53 OE1 GLU A 11 22.689 4.954 10.456 1.00 29.66 O ATOM 54 OE2 GLU A 11 23.954 4.708 8.683 1.00 29.37 O ATOM 0 H GLU A 11 20.049 9.412 8.421 1.00 26.78 H new ATOM 0 HA GLU A 11 22.300 9.302 9.925 1.00 27.07 H new ATOM 0 HB2 GLU A 11 21.316 7.112 9.635 1.00 26.83 H new ATOM 0 HB3 GLU A 11 21.653 7.236 8.117 1.00 26.83 H new ATOM 0 HG2 GLU A 11 23.901 7.142 8.514 1.00 27.58 H new ATOM 0 HG3 GLU A 11 23.704 7.363 10.045 1.00 27.58 H new ATOM 55 N THR A 12 23.767 10.166 8.189 1.00 27.11 N ATOM 56 CA THR A 12 24.550 10.822 7.161 1.00 27.28 C ATOM 57 C THR A 12 25.994 10.346 7.199 1.00 26.98 C ATOM 58 O THR A 12 26.416 9.682 8.145 1.00 26.81 O ATOM 59 CB THR A 12 24.482 12.366 7.291 1.00 27.49 C ATOM 60 OG1 THR A 12 25.115 12.963 6.150 1.00 28.96 O ATOM 61 CG2 THR A 12 25.170 12.847 8.566 1.00 27.25 C ATOM 0 H THR A 12 24.156 10.109 8.954 1.00 27.11 H new ATOM 0 HA THR A 12 24.167 10.581 6.303 1.00 27.28 H new ATOM 0 HB THR A 12 23.549 12.629 7.335 1.00 27.49 H new ATOM 0 HG1 THR A 12 24.864 12.569 5.452 1.00 28.96 H new ATOM 0 HG21 THR A 12 25.112 13.814 8.620 1.00 27.25 H new ATOM 0 HG22 THR A 12 24.734 12.453 9.338 1.00 27.25 H new ATOM 0 HG23 THR A 12 26.102 12.580 8.551 1.00 27.25 H new ATOM 62 N ILE A 13 26.744 10.680 6.158 1.00 26.92 N ATOM 63 CA ILE A 13 28.180 10.462 6.175 1.00 26.77 C ATOM 64 C ILE A 13 28.869 11.714 6.745 1.00 26.26 C ATOM 65 O ILE A 13 28.638 12.834 6.283 1.00 26.09 O ATOM 66 CB ILE A 13 28.713 10.038 4.780 1.00 27.19 C ATOM 67 CG1 ILE A 13 30.141 9.487 4.894 1.00 27.81 C ATOM 68 CG2 ILE A 13 28.584 11.183 3.749 1.00 27.77 C ATOM 69 CD1 ILE A 13 30.523 8.533 3.771 1.00 30.12 C ATOM 0 H ILE A 13 26.441 11.033 5.435 1.00 26.92 H new ATOM 0 HA ILE A 13 28.393 9.716 6.758 1.00 26.77 H new ATOM 0 HB ILE A 13 28.158 9.317 4.443 1.00 27.19 H new ATOM 0 HG12 ILE A 13 30.765 10.229 4.903 1.00 27.81 H new ATOM 0 HG13 ILE A 13 30.235 9.028 5.743 1.00 27.81 H new ATOM 0 HG21 ILE A 13 28.925 10.886 2.891 1.00 27.77 H new ATOM 0 HG22 ILE A 13 27.651 11.432 3.657 1.00 27.77 H new ATOM 0 HG23 ILE A 13 29.095 11.950 4.051 1.00 27.77 H new ATOM 0 HD11 ILE A 13 31.433 8.224 3.904 1.00 30.12 H new ATOM 0 HD12 ILE A 13 29.920 7.773 3.773 1.00 30.12 H new ATOM 0 HD13 ILE A 13 30.459 8.993 2.920 1.00 30.12 H new ATOM 70 N GLY A 14 29.677 11.513 7.781 1.00 25.79 N ATOM 71 CA GLY A 14 30.401 12.607 8.425 1.00 25.09 C ATOM 72 C GLY A 14 29.669 13.214 9.610 1.00 24.56 C ATOM 73 O GLY A 14 28.439 13.307 9.619 1.00 24.35 O ATOM 0 H GLY A 14 29.822 10.741 8.131 1.00 25.79 H new ATOM 0 HA2 GLY A 14 31.265 12.281 8.722 1.00 25.09 H new ATOM 0 HA3 GLY A 14 30.570 13.302 7.770 1.00 25.09 H new ATOM 74 N PHE A 15 30.438 13.635 10.610 1.00 24.14 N ATOM 75 CA PHE A 15 29.879 14.276 11.798 1.00 23.72 C ATOM 76 C PHE A 15 29.321 15.687 11.551 1.00 23.49 C ATOM 77 O PHE A 15 28.263 16.016 12.088 1.00 23.79 O ATOM 78 CB PHE A 15 30.891 14.278 12.954 1.00 23.71 C ATOM 79 CG PHE A 15 30.352 14.855 14.240 1.00 23.58 C ATOM 80 CD1 PHE A 15 29.634 14.059 15.128 1.00 23.20 C ATOM 81 CD2 PHE A 15 30.562 16.195 14.561 1.00 23.36 C ATOM 82 CE1 PHE A 15 29.139 14.584 16.321 1.00 23.46 C ATOM 83 CE2 PHE A 15 30.068 16.734 15.753 1.00 23.46 C ATOM 84 CZ PHE A 15 29.353 15.923 16.633 1.00 23.62 C ATOM 0 H PHE A 15 31.294 13.558 10.620 1.00 24.14 H new ATOM 0 HA PHE A 15 29.114 13.734 12.048 1.00 23.72 H new ATOM 0 HB2 PHE A 15 31.184 13.368 13.117 1.00 23.71 H new ATOM 0 HB3 PHE A 15 31.674 14.785 12.686 1.00 23.71 H new ATOM 0 HD1 PHE A 15 29.482 13.165 14.923 1.00 23.20 H new ATOM 0 HD2 PHE A 15 31.037 16.738 13.974 1.00 23.36 H new ATOM 0 HE1 PHE A 15 28.666 14.039 16.908 1.00 23.46 H new ATOM 0 HE2 PHE A 15 30.216 17.629 15.958 1.00 23.46 H new ATOM 0 HZ PHE A 15 29.020 16.276 17.426 1.00 23.62 H new ATOM 85 N PRO A 16 30.028 16.537 10.772 1.00 23.30 N ATOM 86 CA PRO A 16 29.465 17.876 10.538 1.00 23.30 C ATOM 87 C PRO A 16 28.017 17.862 10.036 1.00 23.48 C ATOM 88 O PRO A 16 27.206 18.670 10.487 1.00 23.32 O ATOM 89 CB PRO A 16 30.419 18.475 9.499 1.00 23.22 C ATOM 90 CG PRO A 16 31.731 17.814 9.806 1.00 22.94 C ATOM 91 CD PRO A 16 31.350 16.395 10.126 1.00 23.20 C ATOM 0 HA PRO A 16 29.406 18.389 11.359 1.00 23.30 H new ATOM 0 HB2 PRO A 16 30.126 18.285 8.594 1.00 23.22 H new ATOM 0 HB3 PRO A 16 30.477 19.440 9.582 1.00 23.22 H new ATOM 0 HG2 PRO A 16 32.338 17.858 9.050 1.00 22.94 H new ATOM 0 HG3 PRO A 16 32.178 18.240 10.554 1.00 22.94 H new ATOM 0 HD2 PRO A 16 31.301 15.848 9.326 1.00 23.20 H new ATOM 0 HD3 PRO A 16 31.995 15.976 10.717 1.00 23.20 H new ATOM 92 N GLY A 17 27.696 16.934 9.134 1.00 23.77 N ATOM 93 CA GLY A 17 26.331 16.768 8.637 1.00 23.65 C ATOM 94 C GLY A 17 25.317 16.424 9.715 1.00 23.83 C ATOM 95 O GLY A 17 24.183 16.903 9.675 1.00 23.91 O ATOM 0 H GLY A 17 28.263 16.384 8.794 1.00 23.77 H new ATOM 0 HA2 GLY A 17 26.055 17.587 8.197 1.00 23.65 H new ATOM 0 HA3 GLY A 17 26.324 16.069 7.965 1.00 23.65 H new ATOM 96 N ILE A 18 25.711 15.603 10.691 1.00 23.96 N ATOM 97 CA ILE A 18 24.780 15.231 11.759 1.00 24.12 C ATOM 98 C ILE A 18 24.612 16.366 12.766 1.00 24.16 C ATOM 99 O ILE A 18 23.544 16.528 13.355 1.00 24.41 O ATOM 100 CB ILE A 18 25.142 13.873 12.446 1.00 24.25 C ATOM 101 CG1 ILE A 18 23.872 13.136 12.878 1.00 24.29 C ATOM 102 CG2 ILE A 18 26.123 14.047 13.623 1.00 23.75 C ATOM 103 CD1 ILE A 18 23.052 12.579 11.715 1.00 24.27 C ATOM 0 H ILE A 18 26.496 15.257 10.753 1.00 23.96 H new ATOM 0 HA ILE A 18 23.919 15.084 11.338 1.00 24.12 H new ATOM 0 HB ILE A 18 25.604 13.331 11.787 1.00 24.25 H new ATOM 0 HG12 ILE A 18 24.117 12.406 13.468 1.00 24.29 H new ATOM 0 HG13 ILE A 18 23.316 13.742 13.393 1.00 24.29 H new ATOM 0 HG21 ILE A 18 26.316 13.181 14.014 1.00 23.75 H new ATOM 0 HG22 ILE A 18 26.946 14.447 13.302 1.00 23.75 H new ATOM 0 HG23 ILE A 18 25.725 14.623 14.294 1.00 23.75 H new ATOM 0 HD11 ILE A 18 22.266 12.127 12.060 1.00 24.27 H new ATOM 0 HD12 ILE A 18 22.778 13.306 11.135 1.00 24.27 H new ATOM 0 HD13 ILE A 18 23.591 11.949 11.211 1.00 24.27 H new ATOM 104 N LEU A 19 25.672 17.153 12.942 1.00 24.21 N ATOM 105 CA LEU A 19 25.613 18.375 13.740 1.00 24.15 C ATOM 106 C LEU A 19 24.639 19.383 13.114 1.00 24.29 C ATOM 107 O LEU A 19 23.794 19.960 13.807 1.00 24.47 O ATOM 108 CB LEU A 19 27.015 18.982 13.900 1.00 24.06 C ATOM 109 CG LEU A 19 27.161 20.378 14.532 1.00 24.30 C ATOM 110 CD1 LEU A 19 26.609 20.415 15.955 1.00 23.44 C ATOM 111 CD2 LEU A 19 28.617 20.852 14.506 1.00 23.61 C ATOM 0 H LEU A 19 26.445 16.993 12.602 1.00 24.21 H new ATOM 0 HA LEU A 19 25.282 18.151 14.624 1.00 24.15 H new ATOM 0 HB2 LEU A 19 27.542 18.364 14.431 1.00 24.06 H new ATOM 0 HB3 LEU A 19 27.421 19.016 13.020 1.00 24.06 H new ATOM 0 HG LEU A 19 26.634 20.989 13.994 1.00 24.30 H new ATOM 0 HD11 LEU A 19 26.717 21.307 16.321 1.00 23.44 H new ATOM 0 HD12 LEU A 19 25.667 20.183 15.943 1.00 23.44 H new ATOM 0 HD13 LEU A 19 27.091 19.779 16.506 1.00 23.44 H new ATOM 0 HD21 LEU A 19 28.678 21.732 14.910 1.00 23.61 H new ATOM 0 HD22 LEU A 19 29.169 20.229 15.004 1.00 23.61 H new ATOM 0 HD23 LEU A 19 28.927 20.896 13.588 1.00 23.61 H new ATOM 112 N ALA A 20 24.749 19.567 11.801 1.00 24.34 N ATOM 113 CA ALA A 20 23.872 20.476 11.064 1.00 24.47 C ATOM 114 C ALA A 20 22.410 20.032 11.138 1.00 24.63 C ATOM 115 O ALA A 20 21.519 20.860 11.344 1.00 24.82 O ATOM 116 CB ALA A 20 24.325 20.589 9.615 1.00 24.47 C ATOM 0 H ALA A 20 25.334 19.169 11.312 1.00 24.34 H new ATOM 0 HA ALA A 20 23.933 21.350 11.481 1.00 24.47 H new ATOM 0 HB1 ALA A 20 23.736 21.194 9.138 1.00 24.47 H new ATOM 0 HB2 ALA A 20 25.232 20.931 9.585 1.00 24.47 H new ATOM 0 HB3 ALA A 20 24.296 19.714 9.198 1.00 24.47 H new ATOM 117 N ALA A 21 22.174 18.731 10.964 1.00 24.67 N ATOM 118 CA ALA A 21 20.834 18.166 11.091 1.00 24.84 C ATOM 119 C ALA A 21 20.287 18.372 12.506 1.00 25.12 C ATOM 120 O ALA A 21 19.158 18.828 12.671 1.00 25.14 O ATOM 121 CB ALA A 21 20.830 16.686 10.725 1.00 24.59 C ATOM 0 H ALA A 21 22.783 18.156 10.770 1.00 24.67 H new ATOM 0 HA ALA A 21 20.254 18.633 10.470 1.00 24.84 H new ATOM 0 HB1 ALA A 21 19.931 16.332 10.816 1.00 24.59 H new ATOM 0 HB2 ALA A 21 21.128 16.578 9.808 1.00 24.59 H new ATOM 0 HB3 ALA A 21 21.428 16.204 11.317 1.00 24.59 H new ATOM 122 N ALA A 22 21.098 18.059 13.516 1.00 25.37 N ATOM 123 CA ALA A 22 20.693 18.214 14.915 1.00 25.66 C ATOM 124 C ALA A 22 20.156 19.610 15.215 1.00 26.03 C ATOM 125 O ALA A 22 19.056 19.758 15.756 1.00 25.91 O ATOM 126 CB ALA A 22 21.848 17.878 15.853 1.00 25.40 C ATOM 0 H ALA A 22 21.895 17.752 13.411 1.00 25.37 H new ATOM 0 HA ALA A 22 19.968 17.588 15.068 1.00 25.66 H new ATOM 0 HB1 ALA A 22 21.560 17.987 16.773 1.00 25.40 H new ATOM 0 HB2 ALA A 22 22.126 16.960 15.708 1.00 25.40 H new ATOM 0 HB3 ALA A 22 22.593 18.473 15.675 1.00 25.40 H new ATOM 127 N ASP A 23 20.937 20.628 14.860 1.00 26.53 N ATOM 128 CA ASP A 23 20.573 22.008 15.153 1.00 27.05 C ATOM 129 C ASP A 23 19.335 22.490 14.394 1.00 27.27 C ATOM 130 O ASP A 23 18.521 23.230 14.946 1.00 27.42 O ATOM 131 CB ASP A 23 21.744 22.952 14.892 1.00 27.15 C ATOM 132 CG ASP A 23 21.512 24.328 15.485 1.00 27.77 C ATOM 133 OD1 ASP A 23 21.414 24.429 16.725 1.00 28.78 O ATOM 134 OD2 ASP A 23 21.422 25.305 14.717 1.00 28.78 O ATOM 0 H ASP A 23 21.686 20.538 14.446 1.00 26.53 H new ATOM 0 HA ASP A 23 20.347 22.023 16.096 1.00 27.05 H new ATOM 0 HB2 ASP A 23 22.554 22.572 15.267 1.00 27.15 H new ATOM 0 HB3 ASP A 23 21.885 23.033 13.936 1.00 27.15 H new ATOM 135 N ALA A 24 19.206 22.078 13.135 1.00 27.58 N ATOM 136 CA ALA A 24 18.055 22.452 12.319 1.00 27.86 C ATOM 137 C ALA A 24 16.774 21.790 12.827 1.00 28.16 C ATOM 138 O ALA A 24 15.733 22.436 12.901 1.00 27.94 O ATOM 139 CB ALA A 24 18.296 22.095 10.856 1.00 27.61 C ATOM 0 H ALA A 24 19.779 21.578 12.733 1.00 27.58 H new ATOM 0 HA ALA A 24 17.942 23.413 12.390 1.00 27.86 H new ATOM 0 HB1 ALA A 24 17.523 22.350 10.329 1.00 27.61 H new ATOM 0 HB2 ALA A 24 19.078 22.568 10.532 1.00 27.61 H new ATOM 0 HB3 ALA A 24 18.441 21.139 10.776 1.00 27.61 H new ATOM 140 N MET A 25 16.868 20.507 13.177 1.00 28.68 N ATOM 141 CA MET A 25 15.716 19.730 13.632 1.00 29.53 C ATOM 142 C MET A 25 15.085 20.286 14.905 1.00 29.58 C ATOM 143 O MET A 25 13.876 20.499 14.951 1.00 29.76 O ATOM 144 CB MET A 25 16.089 18.253 13.824 1.00 29.29 C ATOM 145 CG MET A 25 16.424 17.526 12.534 1.00 29.65 C ATOM 146 SD MET A 25 17.111 15.883 12.820 1.00 30.90 S ATOM 147 CE MET A 25 15.819 14.863 12.130 1.00 31.44 C ATOM 0 H MET A 25 17.604 20.062 13.157 1.00 28.68 H new ATOM 0 HA MET A 25 15.049 19.801 12.931 1.00 29.53 H new ATOM 0 HB2 MET A 25 16.850 18.197 14.423 1.00 29.29 H new ATOM 0 HB3 MET A 25 15.352 17.797 14.259 1.00 29.29 H new ATOM 0 HG2 MET A 25 15.622 17.448 11.994 1.00 29.65 H new ATOM 0 HG3 MET A 25 17.059 18.054 12.025 1.00 29.65 H new ATOM 0 HE1 MET A 25 15.912 13.956 12.460 1.00 31.44 H new ATOM 0 HE2 MET A 25 14.954 15.215 12.392 1.00 31.44 H new ATOM 0 HE3 MET A 25 15.888 14.863 11.162 1.00 31.44 H new ATOM 148 N VAL A 26 15.904 20.527 15.927 1.00 29.90 N ATOM 149 CA VAL A 26 15.409 21.016 17.221 1.00 30.33 C ATOM 150 C VAL A 26 14.889 22.459 17.157 1.00 30.72 C ATOM 151 O VAL A 26 14.047 22.864 17.969 1.00 30.92 O ATOM 152 CB VAL A 26 16.463 20.812 18.356 1.00 30.27 C ATOM 153 CG1 VAL A 26 17.662 21.731 18.173 1.00 29.96 C ATOM 154 CG2 VAL A 26 15.829 20.982 19.732 1.00 30.15 C ATOM 0 H VAL A 26 16.756 20.414 15.894 1.00 29.90 H new ATOM 0 HA VAL A 26 14.639 20.471 17.445 1.00 30.33 H new ATOM 0 HB VAL A 26 16.789 19.900 18.296 1.00 30.27 H new ATOM 0 HG11 VAL A 26 18.297 21.582 18.891 1.00 29.96 H new ATOM 0 HG12 VAL A 26 18.087 21.543 17.322 1.00 29.96 H new ATOM 0 HG13 VAL A 26 17.367 22.655 18.190 1.00 29.96 H new ATOM 0 HG21 VAL A 26 16.503 20.851 20.417 1.00 30.15 H new ATOM 0 HG22 VAL A 26 15.459 21.875 19.810 1.00 30.15 H new ATOM 0 HG23 VAL A 26 15.121 20.328 19.845 1.00 30.15 H new ATOM 155 N LYS A 27 15.377 23.222 16.181 1.00 31.04 N ATOM 156 CA LYS A 27 14.923 24.599 15.987 1.00 31.43 C ATOM 157 C LYS A 27 13.640 24.678 15.160 1.00 31.73 C ATOM 158 O LYS A 27 12.817 25.568 15.377 1.00 31.64 O ATOM 159 CB LYS A 27 16.028 25.454 15.356 1.00 31.34 C ATOM 160 CG LYS A 27 17.082 25.919 16.348 1.00 31.31 C ATOM 161 CD LYS A 27 18.269 26.554 15.645 1.00 31.28 C ATOM 162 CE LYS A 27 19.266 27.115 16.654 1.00 31.16 C ATOM 163 NZ LYS A 27 20.551 27.469 15.989 1.00 30.70 N ATOM 0 H LYS A 27 15.973 22.961 15.619 1.00 31.04 H new ATOM 0 HA LYS A 27 14.718 24.955 16.866 1.00 31.43 H new ATOM 0 HB2 LYS A 27 16.460 24.943 14.653 1.00 31.34 H new ATOM 0 HB3 LYS A 27 15.625 26.230 14.936 1.00 31.34 H new ATOM 0 HG2 LYS A 27 16.689 26.558 16.963 1.00 31.31 H new ATOM 0 HG3 LYS A 27 17.384 25.165 16.878 1.00 31.31 H new ATOM 0 HD2 LYS A 27 18.707 25.895 15.084 1.00 31.28 H new ATOM 0 HD3 LYS A 27 17.961 27.264 15.060 1.00 31.28 H new ATOM 0 HE2 LYS A 27 18.892 27.901 17.082 1.00 31.16 H new ATOM 0 HE3 LYS A 27 19.428 26.462 17.352 1.00 31.16 H new ATOM 0 HZ1 LYS A 27 21.182 27.585 16.605 1.00 30.70 H new ATOM 0 HZ2 LYS A 27 20.791 26.812 15.438 1.00 30.70 H new ATOM 0 HZ3 LYS A 27 20.448 28.222 15.525 1.00 30.70 H new ATOM 164 N ALA A 28 13.471 23.744 14.223 1.00 32.04 N ATOM 165 CA ALA A 28 12.318 23.757 13.313 1.00 32.42 C ATOM 166 C ALA A 28 11.063 23.111 13.901 1.00 32.60 C ATOM 167 O ALA A 28 9.951 23.529 13.595 1.00 32.95 O ATOM 168 CB ALA A 28 12.672 23.110 11.984 1.00 32.35 C ATOM 0 H ALA A 28 14.015 23.090 14.096 1.00 32.04 H new ATOM 0 HA ALA A 28 12.103 24.692 13.171 1.00 32.42 H new ATOM 0 HB1 ALA A 28 11.899 23.129 11.399 1.00 32.35 H new ATOM 0 HB2 ALA A 28 13.402 23.597 11.571 1.00 32.35 H new ATOM 0 HB3 ALA A 28 12.942 22.190 12.133 1.00 32.35 H new ATOM 169 N GLY A 29 11.244 22.089 14.734 1.00 32.72 N ATOM 170 CA GLY A 29 10.118 21.399 15.359 1.00 32.74 C ATOM 171 C GLY A 29 10.243 21.296 16.865 1.00 32.64 C ATOM 172 O GLY A 29 11.331 21.443 17.415 1.00 32.81 O ATOM 0 H GLY A 29 12.016 21.778 14.951 1.00 32.72 H new ATOM 0 HA2 GLY A 29 9.297 21.867 15.140 1.00 32.74 H new ATOM 0 HA3 GLY A 29 10.045 20.507 14.985 1.00 32.74 H new ATOM 173 N ARG A 30 9.121 21.039 17.531 1.00 32.41 N ATOM 174 CA ARG A 30 9.109 20.817 18.974 1.00 32.07 C ATOM 175 C ARG A 30 9.441 19.353 19.270 1.00 32.17 C ATOM 176 O ARG A 30 8.572 18.534 19.605 1.00 32.31 O ATOM 177 CB ARG A 30 7.774 21.250 19.573 1.00 31.86 C ATOM 178 CG ARG A 30 7.550 22.744 19.420 1.00 31.94 C ATOM 179 CD ARG A 30 6.230 23.225 19.982 1.00 31.50 C ATOM 180 NE ARG A 30 6.067 24.652 19.715 1.00 31.23 N ATOM 181 CZ ARG A 30 5.462 25.158 18.642 1.00 31.01 C ATOM 182 NH1 ARG A 30 4.938 24.357 17.721 1.00 30.71 N ATOM 183 NH2 ARG A 30 5.380 26.473 18.492 1.00 31.28 N ATOM 0 H ARG A 30 8.347 20.988 17.160 1.00 32.41 H new ATOM 0 HA ARG A 30 9.790 21.363 19.396 1.00 32.07 H new ATOM 0 HB2 ARG A 30 7.053 20.768 19.139 1.00 31.86 H new ATOM 0 HB3 ARG A 30 7.748 21.013 20.513 1.00 31.86 H new ATOM 0 HG2 ARG A 30 8.272 23.218 19.862 1.00 31.94 H new ATOM 0 HG3 ARG A 30 7.594 22.974 18.479 1.00 31.94 H new ATOM 0 HD2 ARG A 30 5.499 22.728 19.583 1.00 31.50 H new ATOM 0 HD3 ARG A 30 6.197 23.061 20.937 1.00 31.50 H new ATOM 0 HE ARG A 30 6.385 25.205 20.292 1.00 31.23 H new ATOM 0 HH11 ARG A 30 4.988 23.504 17.815 1.00 30.71 H new ATOM 0 HH12 ARG A 30 4.549 24.692 17.031 1.00 30.71 H new ATOM 0 HH21 ARG A 30 5.717 26.995 19.086 1.00 31.28 H new ATOM 0 HH22 ARG A 30 4.990 26.803 17.800 1.00 31.28 H new ATOM 184 N ILE A 31 10.723 19.038 19.115 1.00 31.86 N ATOM 185 CA ILE A 31 11.233 17.686 19.280 1.00 31.44 C ATOM 186 C ILE A 31 12.360 17.655 20.312 1.00 31.09 C ATOM 187 O ILE A 31 12.908 18.697 20.686 1.00 31.07 O ATOM 188 CB ILE A 31 11.731 17.086 17.925 1.00 31.47 C ATOM 189 CG1 ILE A 31 12.869 17.925 17.322 1.00 31.26 C ATOM 190 CG2 ILE A 31 10.577 16.948 16.931 1.00 31.65 C ATOM 191 CD1 ILE A 31 14.269 17.495 17.749 1.00 31.32 C ATOM 0 H ILE A 31 11.328 19.613 18.908 1.00 31.86 H new ATOM 0 HA ILE A 31 10.498 17.138 19.598 1.00 31.44 H new ATOM 0 HB ILE A 31 12.082 16.201 18.110 1.00 31.47 H new ATOM 0 HG12 ILE A 31 12.811 17.880 16.355 1.00 31.26 H new ATOM 0 HG13 ILE A 31 12.738 18.853 17.572 1.00 31.26 H new ATOM 0 HG21 ILE A 31 10.909 16.575 16.099 1.00 31.65 H new ATOM 0 HG22 ILE A 31 9.899 16.361 17.301 1.00 31.65 H new ATOM 0 HG23 ILE A 31 10.190 17.821 16.761 1.00 31.65 H new ATOM 0 HD11 ILE A 31 14.927 18.070 17.328 1.00 31.32 H new ATOM 0 HD12 ILE A 31 14.349 17.564 18.713 1.00 31.32 H new ATOM 0 HD13 ILE A 31 14.423 16.577 17.477 1.00 31.32 H new ATOM 192 N THR A 32 12.703 16.449 20.756 1.00 30.50 N ATOM 193 CA THR A 32 13.815 16.238 21.664 1.00 29.88 C ATOM 194 C THR A 32 14.840 15.321 21.008 1.00 29.22 C ATOM 195 O THR A 32 14.491 14.244 20.513 1.00 29.12 O ATOM 196 CB THR A 32 13.336 15.635 22.996 1.00 29.99 C ATOM 197 OG1 THR A 32 12.357 16.504 23.580 1.00 30.97 O ATOM 198 CG2 THR A 32 14.500 15.470 23.972 1.00 30.13 C ATOM 0 H THR A 32 12.291 15.727 20.535 1.00 30.50 H new ATOM 0 HA THR A 32 14.225 17.096 21.857 1.00 29.88 H new ATOM 0 HB THR A 32 12.953 14.762 22.819 1.00 29.99 H new ATOM 0 HG1 THR A 32 11.678 16.058 23.794 1.00 30.97 H new ATOM 0 HG21 THR A 32 14.175 15.089 24.803 1.00 30.13 H new ATOM 0 HG22 THR A 32 15.166 14.880 23.585 1.00 30.13 H new ATOM 0 HG23 THR A 32 14.900 16.336 24.149 1.00 30.13 H new ATOM 199 N ILE A 33 16.094 15.767 20.979 1.00 28.26 N ATOM 200 CA ILE A 33 17.205 14.928 20.532 1.00 27.46 C ATOM 201 C ILE A 33 17.536 13.972 21.671 1.00 26.95 C ATOM 202 O ILE A 33 17.903 14.409 22.759 1.00 26.62 O ATOM 203 CB ILE A 33 18.456 15.761 20.153 1.00 27.37 C ATOM 204 CG1 ILE A 33 18.120 16.773 19.054 1.00 27.32 C ATOM 205 CG2 ILE A 33 19.613 14.845 19.724 1.00 27.11 C ATOM 206 CD1 ILE A 33 19.136 17.904 18.913 1.00 27.23 C ATOM 0 H ILE A 33 16.324 16.561 21.217 1.00 28.26 H new ATOM 0 HA ILE A 33 16.943 14.449 19.730 1.00 27.46 H new ATOM 0 HB ILE A 33 18.742 16.254 20.938 1.00 27.37 H new ATOM 0 HG12 ILE A 33 18.052 16.305 18.207 1.00 27.32 H new ATOM 0 HG13 ILE A 33 17.248 17.156 19.237 1.00 27.32 H new ATOM 0 HG21 ILE A 33 20.384 15.385 19.491 1.00 27.11 H new ATOM 0 HG22 ILE A 33 19.843 14.251 20.455 1.00 27.11 H new ATOM 0 HG23 ILE A 33 19.342 14.320 18.954 1.00 27.11 H new ATOM 0 HD11 ILE A 33 18.858 18.502 18.202 1.00 27.23 H new ATOM 0 HD12 ILE A 33 19.190 18.397 19.747 1.00 27.23 H new ATOM 0 HD13 ILE A 33 20.007 17.533 18.701 1.00 27.23 H new ATOM 207 N VAL A 34 17.399 12.673 21.424 1.00 26.32 N ATOM 208 CA VAL A 34 17.586 11.682 22.493 1.00 25.95 C ATOM 209 C VAL A 34 18.953 10.994 22.483 1.00 25.70 C ATOM 210 O VAL A 34 19.395 10.472 23.507 1.00 25.70 O ATOM 211 CB VAL A 34 16.450 10.630 22.527 1.00 25.95 C ATOM 212 CG1 VAL A 34 15.150 11.290 22.948 1.00 26.04 C ATOM 213 CG2 VAL A 34 16.300 9.914 21.170 1.00 25.66 C ATOM 0 H VAL A 34 17.200 12.342 20.655 1.00 26.32 H new ATOM 0 HA VAL A 34 17.549 12.204 23.310 1.00 25.95 H new ATOM 0 HB VAL A 34 16.680 9.951 23.180 1.00 25.95 H new ATOM 0 HG11 VAL A 34 14.442 10.627 22.968 1.00 26.04 H new ATOM 0 HG12 VAL A 34 15.255 11.677 23.831 1.00 26.04 H new ATOM 0 HG13 VAL A 34 14.921 11.988 22.315 1.00 26.04 H new ATOM 0 HG21 VAL A 34 15.582 9.264 21.225 1.00 25.66 H new ATOM 0 HG22 VAL A 34 16.094 10.565 20.481 1.00 25.66 H new ATOM 0 HG23 VAL A 34 17.129 9.462 20.949 1.00 25.66 H new ATOM 214 N GLY A 35 19.620 10.993 21.333 1.00 25.29 N ATOM 215 CA GLY A 35 20.968 10.453 21.256 1.00 24.61 C ATOM 216 C GLY A 35 21.512 10.478 19.850 1.00 24.35 C ATOM 217 O GLY A 35 20.810 10.854 18.913 1.00 24.18 O ATOM 0 H GLY A 35 19.310 11.299 20.591 1.00 25.29 H new ATOM 0 HA2 GLY A 35 21.553 10.964 21.837 1.00 24.61 H new ATOM 0 HA3 GLY A 35 20.968 9.541 21.585 1.00 24.61 H new ATOM 218 N TYR A 36 22.777 10.089 19.714 1.00 23.92 N ATOM 219 CA TYR A 36 23.395 9.915 18.411 1.00 23.58 C ATOM 220 C TYR A 36 24.191 8.620 18.416 1.00 23.63 C ATOM 221 O TYR A 36 24.531 8.103 19.479 1.00 23.46 O ATOM 222 CB TYR A 36 24.280 11.115 18.048 1.00 23.43 C ATOM 223 CG TYR A 36 25.675 11.089 18.642 1.00 22.88 C ATOM 224 CD1 TYR A 36 26.783 10.843 17.836 1.00 22.94 C ATOM 225 CD2 TYR A 36 25.885 11.317 20.001 1.00 22.77 C ATOM 226 CE1 TYR A 36 28.065 10.812 18.364 1.00 22.68 C ATOM 227 CE2 TYR A 36 27.172 11.289 20.547 1.00 22.53 C ATOM 228 CZ TYR A 36 28.250 11.035 19.718 1.00 22.70 C ATOM 229 OH TYR A 36 29.518 11.008 20.226 1.00 23.58 O ATOM 0 H TYR A 36 23.298 9.919 20.377 1.00 23.92 H new ATOM 0 HA TYR A 36 22.704 9.864 17.732 1.00 23.58 H new ATOM 0 HB2 TYR A 36 24.356 11.163 17.082 1.00 23.43 H new ATOM 0 HB3 TYR A 36 23.835 11.927 18.338 1.00 23.43 H new ATOM 0 HD1 TYR A 36 26.661 10.697 16.926 1.00 22.94 H new ATOM 0 HD2 TYR A 36 25.157 11.491 20.554 1.00 22.77 H new ATOM 0 HE1 TYR A 36 28.795 10.643 17.813 1.00 22.68 H new ATOM 0 HE2 TYR A 36 27.302 11.439 21.456 1.00 22.53 H new ATOM 0 HH TYR A 36 30.038 10.665 19.663 1.00 23.58 H new ATOM 230 N ILE A 37 24.457 8.085 17.229 1.00 23.73 N ATOM 231 CA ILE A 37 25.220 6.848 17.100 1.00 24.00 C ATOM 232 C ILE A 37 26.394 7.057 16.161 1.00 24.33 C ATOM 233 O ILE A 37 26.249 7.655 15.098 1.00 24.51 O ATOM 234 CB ILE A 37 24.344 5.672 16.591 1.00 23.80 C ATOM 235 CG1 ILE A 37 23.125 5.476 17.499 1.00 23.57 C ATOM 236 CG2 ILE A 37 25.164 4.381 16.504 1.00 23.64 C ATOM 237 CD1 ILE A 37 22.104 4.478 16.963 1.00 24.13 C ATOM 0 H ILE A 37 24.203 8.425 16.481 1.00 23.73 H new ATOM 0 HA ILE A 37 25.543 6.613 17.984 1.00 24.00 H new ATOM 0 HB ILE A 37 24.030 5.892 15.700 1.00 23.80 H new ATOM 0 HG12 ILE A 37 23.428 5.178 18.371 1.00 23.57 H new ATOM 0 HG13 ILE A 37 22.689 6.333 17.628 1.00 23.57 H new ATOM 0 HG21 ILE A 37 24.599 3.660 16.185 1.00 23.64 H new ATOM 0 HG22 ILE A 37 25.904 4.508 15.890 1.00 23.64 H new ATOM 0 HG23 ILE A 37 25.509 4.156 17.382 1.00 23.64 H new ATOM 0 HD11 ILE A 37 21.364 4.405 17.586 1.00 24.13 H new ATOM 0 HD12 ILE A 37 21.774 4.783 16.104 1.00 24.13 H new ATOM 0 HD13 ILE A 37 22.524 3.610 16.858 1.00 24.13 H new ATOM 238 N ARG A 38 27.565 6.586 16.574 1.00 24.91 N ATOM 239 CA ARG A 38 28.698 6.469 15.680 1.00 25.31 C ATOM 240 C ARG A 38 28.558 5.096 15.020 1.00 25.75 C ATOM 241 O ARG A 38 28.885 4.065 15.615 1.00 25.71 O ATOM 242 CB ARG A 38 30.004 6.609 16.459 1.00 25.45 C ATOM 243 CG ARG A 38 31.253 6.596 15.596 0.75 25.90 C ATOM 244 CD ARG A 38 32.491 6.892 16.413 0.75 26.51 C ATOM 245 NE ARG A 38 32.535 6.110 17.645 0.75 27.45 N ATOM 246 CZ ARG A 38 33.562 6.086 18.488 0.75 27.70 C ATOM 247 NH1 ARG A 38 34.655 6.796 18.239 0.75 28.07 N ATOM 248 NH2 ARG A 38 33.497 5.343 19.584 0.75 27.70 N ATOM 0 H ARG A 38 27.721 6.327 17.379 1.00 24.91 H new ATOM 0 HA ARG A 38 28.716 7.169 15.008 1.00 25.31 H new ATOM 0 HB2 ARG A 38 29.980 7.438 16.962 1.00 25.45 H new ATOM 0 HB3 ARG A 38 30.062 5.887 17.104 1.00 25.45 H new ATOM 0 HG2 ARG A 38 31.344 5.730 15.169 0.75 25.90 H new ATOM 0 HG3 ARG A 38 31.166 7.253 14.888 0.75 25.90 H new ATOM 0 HD2 ARG A 38 33.280 6.702 15.882 0.75 26.51 H new ATOM 0 HD3 ARG A 38 32.516 7.837 16.630 0.75 26.51 H new ATOM 0 HE ARG A 38 31.848 5.631 17.839 0.75 27.45 H new ATOM 0 HH11 ARG A 38 34.703 7.277 17.527 0.75 28.07 H new ATOM 0 HH12 ARG A 38 35.316 6.776 18.789 0.75 28.07 H new ATOM 0 HH21 ARG A 38 32.792 4.879 19.747 0.75 27.70 H new ATOM 0 HH22 ARG A 38 34.160 5.325 20.131 0.75 27.70 H new ATOM 249 N ALA A 39 28.041 5.101 13.795 1.00 26.25 N ATOM 250 CA ALA A 39 27.582 3.883 13.127 1.00 26.66 C ATOM 251 C ALA A 39 28.696 3.067 12.473 1.00 26.90 C ATOM 252 O ALA A 39 28.480 1.912 12.109 1.00 27.25 O ATOM 253 CB ALA A 39 26.496 4.223 12.102 1.00 26.66 C ATOM 0 H ALA A 39 27.945 5.814 13.324 1.00 26.25 H new ATOM 0 HA ALA A 39 27.218 3.316 13.825 1.00 26.66 H new ATOM 0 HB1 ALA A 39 26.198 3.410 11.664 1.00 26.66 H new ATOM 0 HB2 ALA A 39 25.745 4.641 12.552 1.00 26.66 H new ATOM 0 HB3 ALA A 39 26.856 4.833 11.439 1.00 26.66 H new ATOM 254 N GLY A 40 29.878 3.665 12.334 1.00 26.79 N ATOM 255 CA GLY A 40 30.982 3.047 11.602 1.00 26.75 C ATOM 256 C GLY A 40 31.023 3.567 10.179 1.00 26.74 C ATOM 257 O GLY A 40 30.016 4.051 9.662 1.00 26.94 O ATOM 0 H GLY A 40 30.062 4.439 12.661 1.00 26.79 H new ATOM 0 HA2 GLY A 40 31.822 3.239 12.048 1.00 26.75 H new ATOM 0 HA3 GLY A 40 30.877 2.083 11.598 1.00 26.75 H new ATOM 258 N SER A 41 32.191 3.472 9.548 1.00 26.77 N ATOM 259 CA SER A 41 32.415 4.001 8.193 1.00 26.86 C ATOM 260 C SER A 41 32.133 5.501 8.069 1.00 26.57 C ATOM 261 O SER A 41 31.666 5.975 7.027 1.00 26.60 O ATOM 262 CB SER A 41 31.614 3.209 7.157 1.00 26.79 C ATOM 263 OG SER A 41 32.104 1.884 7.089 1.00 28.32 O ATOM 0 H SER A 41 32.884 3.097 9.893 1.00 26.77 H new ATOM 0 HA SER A 41 33.362 3.888 8.014 1.00 26.86 H new ATOM 0 HB2 SER A 41 30.674 3.204 7.397 1.00 26.79 H new ATOM 0 HB3 SER A 41 31.683 3.634 6.288 1.00 26.79 H new ATOM 0 HG SER A 41 31.681 1.458 6.502 1.00 28.32 H new ATOM 264 N ALA A 42 32.420 6.234 9.145 1.00 26.23 N ATOM 265 CA ALA A 42 32.221 7.688 9.211 1.00 25.64 C ATOM 266 C ALA A 42 30.762 8.100 9.106 1.00 25.31 C ATOM 267 O ALA A 42 30.458 9.268 8.875 1.00 25.36 O ATOM 268 CB ALA A 42 33.066 8.404 8.159 1.00 25.76 C ATOM 0 H ALA A 42 32.741 5.898 9.869 1.00 26.23 H new ATOM 0 HA ALA A 42 32.519 7.962 10.092 1.00 25.64 H new ATOM 0 HB1 ALA A 42 32.918 9.361 8.221 1.00 25.76 H new ATOM 0 HB2 ALA A 42 34.004 8.211 8.311 1.00 25.76 H new ATOM 0 HB3 ALA A 42 32.812 8.095 7.275 1.00 25.76 H new ATOM 269 N ARG A 43 29.858 7.142 9.285 1.00 25.03 N ATOM 270 CA ARG A 43 28.431 7.447 9.305 1.00 24.57 C ATOM 271 C ARG A 43 27.923 7.686 10.726 1.00 24.22 C ATOM 272 O ARG A 43 28.344 7.014 11.676 1.00 23.89 O ATOM 273 CB ARG A 43 27.621 6.362 8.585 1.00 24.74 C ATOM 274 CG ARG A 43 27.716 6.479 7.063 1.00 24.93 C ATOM 275 CD ARG A 43 27.183 5.265 6.331 1.00 24.71 C ATOM 276 NE ARG A 43 25.752 5.057 6.548 1.00 24.74 N ATOM 277 CZ ARG A 43 24.914 4.563 5.635 1.00 24.58 C ATOM 278 NH1 ARG A 43 25.346 4.240 4.418 1.00 24.01 N ATOM 279 NH2 ARG A 43 23.636 4.401 5.934 1.00 23.99 N ATOM 0 H ARG A 43 30.049 6.311 9.396 1.00 25.03 H new ATOM 0 HA ARG A 43 28.303 8.276 8.818 1.00 24.57 H new ATOM 0 HB2 ARG A 43 27.939 5.488 8.860 1.00 24.74 H new ATOM 0 HB3 ARG A 43 26.691 6.423 8.854 1.00 24.74 H new ATOM 0 HG2 ARG A 43 27.224 7.264 6.775 1.00 24.93 H new ATOM 0 HG3 ARG A 43 28.643 6.617 6.813 1.00 24.93 H new ATOM 0 HD2 ARG A 43 27.351 5.366 5.381 1.00 24.71 H new ATOM 0 HD3 ARG A 43 27.668 4.477 6.623 1.00 24.71 H new ATOM 0 HE ARG A 43 25.429 5.267 7.317 1.00 24.74 H new ATOM 0 HH11 ARG A 43 26.174 4.349 4.213 1.00 24.01 H new ATOM 0 HH12 ARG A 43 24.797 3.922 3.837 1.00 24.01 H new ATOM 0 HH21 ARG A 43 23.347 4.614 6.715 1.00 23.99 H new ATOM 0 HH22 ARG A 43 23.094 4.083 5.347 1.00 23.99 H new ATOM 280 N PHE A 44 27.031 8.665 10.853 1.00 23.86 N ATOM 281 CA PHE A 44 26.481 9.065 12.144 1.00 23.79 C ATOM 282 C PHE A 44 24.960 9.097 12.086 1.00 24.05 C ATOM 283 O PHE A 44 24.380 9.584 11.115 1.00 24.05 O ATOM 284 CB PHE A 44 27.039 10.433 12.571 1.00 23.27 C ATOM 285 CG PHE A 44 28.487 10.397 12.984 1.00 22.57 C ATOM 286 CD1 PHE A 44 28.844 10.170 14.315 1.00 22.17 C ATOM 287 CD2 PHE A 44 29.495 10.577 12.046 1.00 21.38 C ATOM 288 CE1 PHE A 44 30.188 10.133 14.701 1.00 21.59 C ATOM 289 CE2 PHE A 44 30.838 10.533 12.420 1.00 21.53 C ATOM 290 CZ PHE A 44 31.184 10.317 13.748 1.00 21.72 C ATOM 0 H PHE A 44 26.727 9.118 10.188 1.00 23.86 H new ATOM 0 HA PHE A 44 26.748 8.410 12.808 1.00 23.79 H new ATOM 0 HB2 PHE A 44 26.936 11.058 11.837 1.00 23.27 H new ATOM 0 HB3 PHE A 44 26.509 10.773 13.309 1.00 23.27 H new ATOM 0 HD1 PHE A 44 28.180 10.042 14.953 1.00 22.17 H new ATOM 0 HD2 PHE A 44 29.272 10.729 11.156 1.00 21.38 H new ATOM 0 HE1 PHE A 44 30.414 9.986 15.591 1.00 21.59 H new ATOM 0 HE2 PHE A 44 31.503 10.648 11.780 1.00 21.53 H new ATOM 0 HZ PHE A 44 32.079 10.296 13.999 1.00 21.72 H new ATOM 291 N THR A 45 24.326 8.558 13.124 1.00 24.32 N ATOM 292 CA THR A 45 22.872 8.531 13.226 1.00 24.47 C ATOM 293 C THR A 45 22.423 9.525 14.287 1.00 24.73 C ATOM 294 O THR A 45 23.058 9.641 15.337 1.00 24.75 O ATOM 295 CB THR A 45 22.364 7.127 13.644 1.00 24.48 C ATOM 296 OG1 THR A 45 23.020 6.115 12.868 1.00 25.24 O ATOM 297 CG2 THR A 45 20.856 7.017 13.457 1.00 24.10 C ATOM 0 H THR A 45 24.730 8.196 13.791 1.00 24.32 H new ATOM 0 HA THR A 45 22.508 8.758 12.356 1.00 24.47 H new ATOM 0 HB THR A 45 22.570 6.999 14.583 1.00 24.48 H new ATOM 0 HG1 THR A 45 22.609 6.006 12.144 1.00 25.24 H new ATOM 0 HG21 THR A 45 20.560 6.133 13.724 1.00 24.10 H new ATOM 0 HG22 THR A 45 20.412 7.684 14.004 1.00 24.10 H new ATOM 0 HG23 THR A 45 20.634 7.164 12.524 1.00 24.10 H new ATOM 298 N LEU A 46 21.331 10.236 14.015 1.00 24.86 N ATOM 299 CA LEU A 46 20.695 11.067 15.027 1.00 25.32 C ATOM 300 C LEU A 46 19.282 10.580 15.260 1.00 25.67 C ATOM 301 O LEU A 46 18.540 10.343 14.305 1.00 25.72 O ATOM 302 CB LEU A 46 20.664 12.545 14.614 1.00 25.17 C ATOM 303 CG LEU A 46 20.345 13.518 15.754 1.00 25.01 C ATOM 304 CD1 LEU A 46 21.595 13.817 16.610 1.00 22.85 C ATOM 305 CD2 LEU A 46 19.733 14.805 15.217 1.00 24.72 C ATOM 0 H LEU A 46 20.944 10.249 13.247 1.00 24.86 H new ATOM 0 HA LEU A 46 21.216 10.996 15.842 1.00 25.32 H new ATOM 0 HB2 LEU A 46 21.525 12.781 14.234 1.00 25.17 H new ATOM 0 HB3 LEU A 46 20.004 12.659 13.913 1.00 25.17 H new ATOM 0 HG LEU A 46 19.692 13.090 16.329 1.00 25.01 H new ATOM 0 HD11 LEU A 46 21.361 14.434 17.321 1.00 22.85 H new ATOM 0 HD12 LEU A 46 21.928 12.992 16.996 1.00 22.85 H new ATOM 0 HD13 LEU A 46 22.282 14.213 16.052 1.00 22.85 H new ATOM 0 HD21 LEU A 46 19.540 15.404 15.955 1.00 24.72 H new ATOM 0 HD22 LEU A 46 20.357 15.232 14.610 1.00 24.72 H new ATOM 0 HD23 LEU A 46 18.911 14.600 14.744 1.00 24.72 H new ATOM 306 N ASN A 47 18.912 10.447 16.532 1.00 26.20 N ATOM 307 CA ASN A 47 17.566 10.015 16.907 1.00 26.69 C ATOM 308 C ASN A 47 16.812 11.096 17.662 1.00 27.05 C ATOM 309 O ASN A 47 17.352 11.711 18.584 1.00 26.82 O ATOM 310 CB ASN A 47 17.626 8.720 17.721 1.00 26.47 C ATOM 311 CG ASN A 47 18.303 7.592 16.959 1.00 26.99 C ATOM 312 OD1 ASN A 47 17.769 7.271 15.795 1.00 28.41 O flip ATOM 313 ND2 ASN A 47 19.306 7.028 17.407 1.00 26.31 N flip ATOM 0 H ASN A 47 19.431 10.604 17.199 1.00 26.20 H new ATOM 0 HA ASN A 47 17.075 9.844 16.088 1.00 26.69 H new ATOM 0 HB2 ASN A 47 18.105 8.882 18.548 1.00 26.47 H new ATOM 0 HB3 ASN A 47 16.726 8.450 17.963 1.00 26.47 H new ATOM 0 HD21 ASN A 47 19.627 7.263 18.169 1.00 26.31 H new ATOM 0 HD22 ASN A 47 19.684 6.400 16.957 1.00 26.31 H new ATOM 314 N ILE A 48 15.565 11.334 17.251 1.00 27.60 N ATOM 315 CA ILE A 48 14.728 12.367 17.859 1.00 28.07 C ATOM 316 C ILE A 48 13.352 11.833 18.270 1.00 28.64 C ATOM 317 O ILE A 48 12.880 10.822 17.742 1.00 28.78 O ATOM 318 CB ILE A 48 14.577 13.629 16.941 1.00 28.09 C ATOM 319 CG1 ILE A 48 13.760 13.310 15.681 1.00 27.88 C ATOM 320 CG2 ILE A 48 15.954 14.215 16.592 1.00 28.03 C ATOM 321 CD1 ILE A 48 13.261 14.540 14.926 1.00 28.15 C ATOM 0 H ILE A 48 15.183 10.902 16.613 1.00 27.60 H new ATOM 0 HA ILE A 48 15.192 12.642 18.665 1.00 28.07 H new ATOM 0 HB ILE A 48 14.085 14.304 17.435 1.00 28.09 H new ATOM 0 HG12 ILE A 48 14.304 12.775 15.082 1.00 27.88 H new ATOM 0 HG13 ILE A 48 12.997 12.766 15.932 1.00 27.88 H new ATOM 0 HG21 ILE A 48 15.840 14.993 16.025 1.00 28.03 H new ATOM 0 HG22 ILE A 48 16.412 14.474 17.407 1.00 28.03 H new ATOM 0 HG23 ILE A 48 16.480 13.548 16.124 1.00 28.03 H new ATOM 0 HD11 ILE A 48 12.756 14.259 14.147 1.00 28.15 H new ATOM 0 HD12 ILE A 48 12.691 15.067 15.507 1.00 28.15 H new ATOM 0 HD13 ILE A 48 14.019 15.076 14.644 1.00 28.15 H new ATOM 322 N ARG A 49 12.725 12.510 19.228 1.00 29.24 N ATOM 323 CA ARG A 49 11.383 12.148 19.680 1.00 29.87 C ATOM 324 C ARG A 49 10.466 13.373 19.738 1.00 30.67 C ATOM 325 O ARG A 49 10.927 14.500 19.929 1.00 30.49 O ATOM 326 CB ARG A 49 11.423 11.455 21.049 1.00 29.42 C ATOM 327 CG ARG A 49 12.249 10.162 21.122 1.00 28.71 C ATOM 328 CD ARG A 49 11.627 8.976 20.381 1.00 27.87 C ATOM 329 NE ARG A 49 10.309 8.603 20.894 1.00 27.43 N ATOM 330 CZ ARG A 49 10.093 7.882 21.992 1.00 26.88 C ATOM 331 NH1 ARG A 49 11.108 7.430 22.715 1.00 26.34 N ATOM 332 NH2 ARG A 49 8.850 7.614 22.371 1.00 26.67 N ATOM 0 H ARG A 49 13.063 13.189 19.633 1.00 29.24 H new ATOM 0 HA ARG A 49 11.022 11.524 19.031 1.00 29.87 H new ATOM 0 HB2 ARG A 49 11.777 12.082 21.699 1.00 29.42 H new ATOM 0 HB3 ARG A 49 10.513 11.253 21.316 1.00 29.42 H new ATOM 0 HG2 ARG A 49 13.131 10.333 20.756 1.00 28.71 H new ATOM 0 HG3 ARG A 49 12.371 9.920 22.053 1.00 28.71 H new ATOM 0 HD2 ARG A 49 11.551 9.195 19.439 1.00 27.87 H new ATOM 0 HD3 ARG A 49 12.222 8.213 20.448 1.00 27.87 H new ATOM 0 HE ARG A 49 9.621 8.870 20.452 1.00 27.43 H new ATOM 0 HH11 ARG A 49 11.916 7.602 22.476 1.00 26.34 H new ATOM 0 HH12 ARG A 49 10.958 6.965 23.423 1.00 26.34 H new ATOM 0 HH21 ARG A 49 8.187 7.906 21.908 1.00 26.67 H new ATOM 0 HH22 ARG A 49 8.708 7.148 23.080 1.00 26.67 H new ATOM 333 N GLY A 50 9.170 13.138 19.569 1.00 31.66 N ATOM 334 CA GLY A 50 8.171 14.203 19.638 1.00 33.21 C ATOM 335 C GLY A 50 6.881 13.802 18.955 1.00 34.31 C ATOM 336 O GLY A 50 6.740 12.665 18.508 1.00 34.20 O ATOM 0 H GLY A 50 8.843 12.358 19.411 1.00 31.66 H new ATOM 0 HA2 GLY A 50 7.992 14.420 20.566 1.00 33.21 H new ATOM 0 HA3 GLY A 50 8.523 15.005 19.221 1.00 33.21 H new ATOM 337 N ASP A 51 5.935 14.735 18.884 1.00 35.47 N ATOM 338 CA ASP A 51 4.679 14.514 18.161 1.00 36.81 C ATOM 339 C ASP A 51 4.990 14.225 16.698 1.00 36.94 C ATOM 340 O ASP A 51 5.915 14.811 16.134 1.00 36.97 O ATOM 341 CB ASP A 51 3.764 15.740 18.281 1.00 37.30 C ATOM 342 CG ASP A 51 2.517 15.628 17.420 1.00 39.33 C ATOM 343 OD1 ASP A 51 1.516 15.041 17.886 1.00 41.97 O ATOM 344 OD2 ASP A 51 2.534 16.133 16.275 1.00 41.48 O ATOM 0 H ASP A 51 6.000 15.510 19.250 1.00 35.47 H new ATOM 0 HA ASP A 51 4.215 13.756 18.549 1.00 36.81 H new ATOM 0 HB2 ASP A 51 3.503 15.855 19.208 1.00 37.30 H new ATOM 0 HB3 ASP A 51 4.259 16.534 18.025 1.00 37.30 H new ATOM 345 N VAL A 52 4.216 13.325 16.094 1.00 37.35 N ATOM 346 CA VAL A 52 4.452 12.876 14.716 1.00 37.68 C ATOM 347 C VAL A 52 4.620 14.021 13.701 1.00 37.60 C ATOM 348 O VAL A 52 5.500 13.963 12.842 1.00 37.45 O ATOM 349 CB VAL A 52 3.392 11.823 14.251 1.00 37.81 C ATOM 350 CG1 VAL A 52 1.999 12.437 14.116 1.00 38.32 C ATOM 351 CG2 VAL A 52 3.823 11.158 12.943 1.00 38.32 C ATOM 0 H VAL A 52 3.537 12.955 16.470 1.00 37.35 H new ATOM 0 HA VAL A 52 5.314 12.431 14.737 1.00 37.68 H new ATOM 0 HB VAL A 52 3.341 11.142 14.939 1.00 37.81 H new ATOM 0 HG11 VAL A 52 1.372 11.756 13.827 1.00 38.32 H new ATOM 0 HG12 VAL A 52 1.717 12.793 14.973 1.00 38.32 H new ATOM 0 HG13 VAL A 52 2.023 13.153 13.462 1.00 38.32 H new ATOM 0 HG21 VAL A 52 3.153 10.510 12.673 1.00 38.32 H new ATOM 0 HG22 VAL A 52 3.917 11.833 12.252 1.00 38.32 H new ATOM 0 HG23 VAL A 52 4.673 10.709 13.073 1.00 38.32 H new ATOM 352 N GLN A 53 3.802 15.063 13.829 1.00 37.59 N ATOM 353 CA GLN A 53 3.854 16.214 12.920 1.00 37.75 C ATOM 354 C GLN A 53 5.089 17.080 13.158 1.00 36.93 C ATOM 355 O GLN A 53 5.649 17.647 12.215 1.00 36.73 O ATOM 356 CB GLN A 53 2.580 17.064 13.030 1.00 38.24 C ATOM 357 CG GLN A 53 1.275 16.313 12.743 1.00 40.96 C ATOM 358 CD GLN A 53 0.979 16.153 11.256 1.00 44.28 C ATOM 359 OE1 GLN A 53 1.686 15.447 10.533 1.00 45.38 O ATOM 360 NE2 GLN A 53 -0.091 16.799 10.798 1.00 45.77 N ATOM 0 H GLN A 53 3.202 15.126 14.442 1.00 37.59 H new ATOM 0 HA GLN A 53 3.914 15.857 12.020 1.00 37.75 H new ATOM 0 HB2 GLN A 53 2.533 17.438 13.924 1.00 38.24 H new ATOM 0 HB3 GLN A 53 2.651 17.810 12.414 1.00 38.24 H new ATOM 0 HG2 GLN A 53 1.319 15.435 13.153 1.00 40.96 H new ATOM 0 HG3 GLN A 53 0.539 16.786 13.163 1.00 40.96 H new ATOM 0 HE21 GLN A 53 -0.562 17.283 11.331 1.00 45.77 H new ATOM 0 HE22 GLN A 53 -0.312 16.732 9.969 1.00 45.77 H new ATOM 361 N GLU A 54 5.504 17.179 14.419 1.00 36.15 N ATOM 362 CA GLU A 54 6.698 17.937 14.788 1.00 35.40 C ATOM 363 C GLU A 54 7.965 17.234 14.311 1.00 34.78 C ATOM 364 O GLU A 54 8.909 17.885 13.857 1.00 34.57 O ATOM 365 CB GLU A 54 6.755 18.171 16.300 1.00 35.48 C ATOM 366 CG GLU A 54 5.645 19.066 16.852 1.00 36.22 C ATOM 367 CD GLU A 54 5.668 20.485 16.290 1.00 36.85 C ATOM 368 OE1 GLU A 54 6.761 21.010 15.981 1.00 36.43 O ATOM 369 OE2 GLU A 54 4.577 21.081 16.167 1.00 38.17 O ATOM 0 H GLU A 54 5.102 16.809 15.084 1.00 36.15 H new ATOM 0 HA GLU A 54 6.645 18.799 14.347 1.00 35.40 H new ATOM 0 HB2 GLU A 54 6.714 17.312 16.749 1.00 35.48 H new ATOM 0 HB3 GLU A 54 7.613 18.567 16.521 1.00 35.48 H new ATOM 0 HG2 GLU A 54 4.786 18.662 16.654 1.00 36.22 H new ATOM 0 HG3 GLU A 54 5.724 19.107 17.818 1.00 36.22 H new ATOM 370 N VAL A 55 7.973 15.905 14.422 1.00 33.95 N ATOM 371 CA VAL A 55 9.060 15.070 13.902 1.00 33.21 C ATOM 372 C VAL A 55 9.148 15.191 12.373 1.00 32.92 C ATOM 373 O VAL A 55 10.244 15.245 11.815 1.00 32.83 O ATOM 374 CB VAL A 55 8.901 13.585 14.351 1.00 33.14 C ATOM 375 CG1 VAL A 55 9.939 12.685 13.695 1.00 32.64 C ATOM 376 CG2 VAL A 55 8.990 13.474 15.872 1.00 32.92 C ATOM 0 H VAL A 55 7.344 15.459 14.803 1.00 33.95 H new ATOM 0 HA VAL A 55 9.895 15.393 14.276 1.00 33.21 H new ATOM 0 HB VAL A 55 8.025 13.285 14.063 1.00 33.14 H new ATOM 0 HG11 VAL A 55 9.812 11.772 13.995 1.00 32.64 H new ATOM 0 HG12 VAL A 55 9.839 12.725 12.731 1.00 32.64 H new ATOM 0 HG13 VAL A 55 10.828 12.984 13.940 1.00 32.64 H new ATOM 0 HG21 VAL A 55 8.889 12.546 16.135 1.00 32.92 H new ATOM 0 HG22 VAL A 55 9.852 13.803 16.171 1.00 32.92 H new ATOM 0 HG23 VAL A 55 8.285 14.003 16.277 1.00 32.92 H new ATOM 377 N LYS A 56 7.995 15.252 11.708 1.00 32.56 N ATOM 378 CA LYS A 56 7.944 15.419 10.254 1.00 32.46 C ATOM 379 C LYS A 56 8.560 16.746 9.815 1.00 31.98 C ATOM 380 O LYS A 56 9.334 16.785 8.852 1.00 31.87 O ATOM 381 CB LYS A 56 6.509 15.312 9.734 1.00 32.57 C ATOM 382 CG LYS A 56 5.996 13.895 9.582 1.00 33.93 C ATOM 383 CD LYS A 56 4.605 13.888 8.971 1.00 36.77 C ATOM 384 CE LYS A 56 4.081 12.471 8.789 1.00 38.78 C ATOM 385 NZ LYS A 56 2.692 12.468 8.227 1.00 40.52 N ATOM 0 H LYS A 56 7.223 15.198 12.084 1.00 32.56 H new ATOM 0 HA LYS A 56 8.469 14.700 9.870 1.00 32.46 H new ATOM 0 HB2 LYS A 56 5.922 15.793 10.339 1.00 32.57 H new ATOM 0 HB3 LYS A 56 6.456 15.757 8.874 1.00 32.57 H new ATOM 0 HG2 LYS A 56 6.602 13.385 9.022 1.00 33.93 H new ATOM 0 HG3 LYS A 56 5.976 13.459 10.448 1.00 33.93 H new ATOM 0 HD2 LYS A 56 3.998 14.388 9.540 1.00 36.77 H new ATOM 0 HD3 LYS A 56 4.625 14.339 8.113 1.00 36.77 H new ATOM 0 HE2 LYS A 56 4.672 11.980 8.197 1.00 38.78 H new ATOM 0 HE3 LYS A 56 4.087 12.010 9.643 1.00 38.78 H new ATOM 0 HZ1 LYS A 56 2.412 11.629 8.131 1.00 40.52 H new ATOM 0 HZ2 LYS A 56 2.146 12.901 8.781 1.00 40.52 H new ATOM 0 HZ3 LYS A 56 2.691 12.872 7.434 1.00 40.52 H new ATOM 386 N THR A 57 8.213 17.819 10.530 1.00 31.29 N ATOM 387 CA THR A 57 8.727 19.162 10.259 1.00 30.90 C ATOM 388 C THR A 57 10.236 19.224 10.498 1.00 30.49 C ATOM 389 O THR A 57 10.978 19.777 9.680 1.00 30.48 O ATOM 390 CB THR A 57 8.017 20.217 11.137 1.00 30.86 C ATOM 391 OG1 THR A 57 6.607 20.166 10.892 1.00 31.27 O ATOM 392 CG2 THR A 57 8.524 21.624 10.829 1.00 31.14 C ATOM 0 H THR A 57 7.666 17.786 11.193 1.00 31.29 H new ATOM 0 HA THR A 57 8.547 19.361 9.327 1.00 30.90 H new ATOM 0 HB THR A 57 8.208 20.016 12.067 1.00 30.86 H new ATOM 0 HG1 THR A 57 6.284 19.480 11.254 1.00 31.27 H new ATOM 0 HG21 THR A 57 8.063 22.265 11.393 1.00 31.14 H new ATOM 0 HG22 THR A 57 9.477 21.670 11.001 1.00 31.14 H new ATOM 0 HG23 THR A 57 8.354 21.833 9.897 1.00 31.14 H new ATOM 393 N ALA A 58 10.669 18.644 11.619 1.00 29.85 N ATOM 394 CA ALA A 58 12.079 18.551 11.977 1.00 29.39 C ATOM 395 C ALA A 58 12.866 17.756 10.945 1.00 29.08 C ATOM 396 O ALA A 58 13.953 18.173 10.551 1.00 29.02 O ATOM 397 CB ALA A 58 12.242 17.936 13.360 1.00 29.21 C ATOM 0 H ALA A 58 10.142 18.290 12.199 1.00 29.85 H new ATOM 0 HA ALA A 58 12.437 19.452 11.993 1.00 29.39 H new ATOM 0 HB1 ALA A 58 13.185 17.882 13.581 1.00 29.21 H new ATOM 0 HB2 ALA A 58 11.788 18.488 14.015 1.00 29.21 H new ATOM 0 HB3 ALA A 58 11.857 17.045 13.366 1.00 29.21 H new ATOM 398 N MET A 59 12.312 16.626 10.505 1.00 28.82 N ATOM 399 CA MET A 59 12.987 15.758 9.536 1.00 28.77 C ATOM 400 C MET A 59 13.257 16.485 8.217 1.00 28.57 C ATOM 401 O MET A 59 14.349 16.362 7.661 1.00 28.76 O ATOM 402 CB MET A 59 12.192 14.468 9.292 1.00 28.82 C ATOM 403 CG MET A 59 12.907 13.418 8.427 1.00 29.52 C ATOM 404 SD MET A 59 14.434 12.745 9.140 1.00 31.89 S ATOM 405 CE MET A 59 13.836 12.062 10.698 1.00 29.77 C ATOM 0 H MET A 59 11.540 16.342 10.757 1.00 28.82 H new ATOM 0 HA MET A 59 13.844 15.516 9.920 1.00 28.77 H new ATOM 0 HB2 MET A 59 11.978 14.069 10.150 1.00 28.82 H new ATOM 0 HB3 MET A 59 11.350 14.698 8.868 1.00 28.82 H new ATOM 0 HG2 MET A 59 12.294 12.685 8.260 1.00 29.52 H new ATOM 0 HG3 MET A 59 13.116 13.815 7.567 1.00 29.52 H new ATOM 0 HE1 MET A 59 14.499 11.454 11.061 1.00 29.77 H new ATOM 0 HE2 MET A 59 13.679 12.782 11.328 1.00 29.77 H new ATOM 0 HE3 MET A 59 13.008 11.581 10.544 1.00 29.77 H new ATOM 406 N ALA A 60 12.268 17.239 7.735 1.00 28.17 N ATOM 407 CA ALA A 60 12.410 18.046 6.518 1.00 28.05 C ATOM 408 C ALA A 60 13.522 19.094 6.637 1.00 27.94 C ATOM 409 O ALA A 60 14.308 19.283 5.707 1.00 27.91 O ATOM 410 CB ALA A 60 11.082 18.711 6.157 1.00 27.96 C ATOM 0 H ALA A 60 11.494 17.298 8.104 1.00 28.17 H new ATOM 0 HA ALA A 60 12.665 17.441 5.804 1.00 28.05 H new ATOM 0 HB1 ALA A 60 11.193 19.240 5.351 1.00 27.96 H new ATOM 0 HB2 ALA A 60 10.409 18.029 6.005 1.00 27.96 H new ATOM 0 HB3 ALA A 60 10.800 19.287 6.885 1.00 27.96 H new ATOM 411 N ALA A 61 13.582 19.762 7.786 1.00 27.91 N ATOM 412 CA ALA A 61 14.630 20.741 8.072 1.00 27.96 C ATOM 413 C ALA A 61 16.010 20.088 8.225 1.00 28.08 C ATOM 414 O ALA A 61 17.024 20.656 7.805 1.00 27.99 O ATOM 415 CB ALA A 61 14.280 21.529 9.309 1.00 27.90 C ATOM 0 H ALA A 61 13.015 19.660 8.424 1.00 27.91 H new ATOM 0 HA ALA A 61 14.682 21.341 7.312 1.00 27.96 H new ATOM 0 HB1 ALA A 61 14.980 22.175 9.490 1.00 27.90 H new ATOM 0 HB2 ALA A 61 13.440 21.994 9.170 1.00 27.90 H new ATOM 0 HB3 ALA A 61 14.194 20.926 10.064 1.00 27.90 H new ATOM 416 N GLY A 62 16.039 18.902 8.832 1.00 28.21 N ATOM 417 CA GLY A 62 17.269 18.113 8.956 1.00 28.58 C ATOM 418 C GLY A 62 17.853 17.712 7.611 1.00 28.74 C ATOM 419 O GLY A 62 19.037 17.935 7.353 1.00 28.89 O ATOM 0 H GLY A 62 15.348 18.531 9.184 1.00 28.21 H new ATOM 0 HA2 GLY A 62 17.928 18.626 9.450 1.00 28.58 H new ATOM 0 HA3 GLY A 62 17.084 17.314 9.474 1.00 28.58 H new ATOM 420 N ILE A 63 17.019 17.126 6.755 1.00 29.04 N ATOM 421 CA ILE A 63 17.411 16.763 5.391 1.00 29.66 C ATOM 422 C ILE A 63 17.961 17.986 4.646 1.00 30.22 C ATOM 423 O ILE A 63 19.003 17.908 3.989 1.00 30.19 O ATOM 424 CB ILE A 63 16.226 16.117 4.610 1.00 29.60 C ATOM 425 CG1 ILE A 63 15.914 14.723 5.175 1.00 29.47 C ATOM 426 CG2 ILE A 63 16.529 16.035 3.109 1.00 29.31 C ATOM 427 CD1 ILE A 63 14.566 14.144 4.748 1.00 29.62 C ATOM 0 H ILE A 63 16.205 16.926 6.949 1.00 29.04 H new ATOM 0 HA ILE A 63 18.115 16.099 5.449 1.00 29.66 H new ATOM 0 HB ILE A 63 15.446 16.682 4.724 1.00 29.60 H new ATOM 0 HG12 ILE A 63 16.616 14.112 4.900 1.00 29.47 H new ATOM 0 HG13 ILE A 63 15.940 14.767 6.144 1.00 29.47 H new ATOM 0 HG21 ILE A 63 15.777 15.630 2.649 1.00 29.31 H new ATOM 0 HG22 ILE A 63 16.679 16.927 2.760 1.00 29.31 H new ATOM 0 HG23 ILE A 63 17.323 15.495 2.968 1.00 29.31 H new ATOM 0 HD11 ILE A 63 14.449 13.267 5.146 1.00 29.62 H new ATOM 0 HD12 ILE A 63 13.853 14.731 5.044 1.00 29.62 H new ATOM 0 HD13 ILE A 63 14.539 14.066 3.782 1.00 29.62 H new ATOM 428 N ASP A 64 17.256 19.109 4.778 1.00 30.80 N ATOM 429 CA ASP A 64 17.644 20.377 4.167 1.00 31.59 C ATOM 430 C ASP A 64 19.004 20.890 4.663 1.00 31.38 C ATOM 431 O ASP A 64 19.833 21.329 3.867 1.00 31.07 O ATOM 432 CB ASP A 64 16.559 21.417 4.427 1.00 32.17 C ATOM 433 CG ASP A 64 16.505 22.478 3.358 1.00 34.97 C ATOM 434 OD1 ASP A 64 17.480 23.257 3.237 1.00 37.95 O ATOM 435 OD2 ASP A 64 15.475 22.547 2.644 1.00 38.55 O ATOM 0 H ASP A 64 16.527 19.155 5.233 1.00 30.80 H new ATOM 0 HA ASP A 64 17.740 20.223 3.214 1.00 31.59 H new ATOM 0 HB2 ASP A 64 15.698 20.974 4.482 1.00 32.17 H new ATOM 0 HB3 ASP A 64 16.718 21.837 5.287 1.00 32.17 H new ATOM 436 N ALA A 65 19.225 20.827 5.976 1.00 31.34 N ATOM 437 CA ALA A 65 20.506 21.212 6.567 1.00 31.35 C ATOM 438 C ALA A 65 21.658 20.336 6.062 1.00 31.36 C ATOM 439 O ALA A 65 22.739 20.845 5.754 1.00 30.87 O ATOM 440 CB ALA A 65 20.426 21.172 8.088 1.00 31.27 C ATOM 0 H ALA A 65 18.639 20.561 6.547 1.00 31.34 H new ATOM 0 HA ALA A 65 20.693 22.122 6.287 1.00 31.35 H new ATOM 0 HB1 ALA A 65 21.282 21.430 8.464 1.00 31.27 H new ATOM 0 HB2 ALA A 65 19.741 21.788 8.393 1.00 31.27 H new ATOM 0 HB3 ALA A 65 20.204 20.273 8.377 1.00 31.27 H new ATOM 441 N ILE A 66 21.419 19.027 5.973 1.00 31.62 N ATOM 442 CA ILE A 66 22.425 18.091 5.467 1.00 32.15 C ATOM 443 C ILE A 66 22.769 18.365 3.995 1.00 32.84 C ATOM 444 O ILE A 66 23.947 18.357 3.625 1.00 32.79 O ATOM 445 CB ILE A 66 22.023 16.607 5.685 1.00 32.05 C ATOM 446 CG1 ILE A 66 22.040 16.265 7.181 1.00 31.91 C ATOM 447 CG2 ILE A 66 22.974 15.673 4.926 1.00 31.87 C ATOM 448 CD1 ILE A 66 21.385 14.937 7.537 1.00 31.81 C ATOM 0 H ILE A 66 20.676 18.659 6.202 1.00 31.62 H new ATOM 0 HA ILE A 66 23.227 18.244 5.991 1.00 32.15 H new ATOM 0 HB ILE A 66 21.124 16.482 5.342 1.00 32.05 H new ATOM 0 HG12 ILE A 66 22.961 16.250 7.487 1.00 31.91 H new ATOM 0 HG13 ILE A 66 21.591 16.974 7.668 1.00 31.91 H new ATOM 0 HG21 ILE A 66 22.709 14.752 5.073 1.00 31.87 H new ATOM 0 HG22 ILE A 66 22.935 15.873 3.978 1.00 31.87 H new ATOM 0 HG23 ILE A 66 23.880 15.803 5.247 1.00 31.87 H new ATOM 0 HD11 ILE A 66 21.438 14.797 8.495 1.00 31.81 H new ATOM 0 HD12 ILE A 66 20.455 14.951 7.263 1.00 31.81 H new ATOM 0 HD13 ILE A 66 21.845 14.216 7.079 1.00 31.81 H new ATOM 449 N ASN A 67 21.748 18.626 3.177 1.00 33.62 N ATOM 450 CA ASN A 67 21.952 18.992 1.772 1.00 34.81 C ATOM 451 C ASN A 67 22.806 20.254 1.607 1.00 35.31 C ATOM 452 O ASN A 67 23.642 20.324 0.710 1.00 35.25 O ATOM 453 CB ASN A 67 20.610 19.138 1.032 1.00 34.83 C ATOM 454 CG ASN A 67 19.907 17.792 0.796 1.00 35.73 C ATOM 455 OD1 ASN A 67 20.530 16.731 0.815 1.00 36.44 O ATOM 456 ND2 ASN A 67 18.600 17.844 0.566 1.00 36.61 N ATOM 0 H ASN A 67 20.923 18.596 3.418 1.00 33.62 H new ATOM 0 HA ASN A 67 22.447 18.262 1.368 1.00 34.81 H new ATOM 0 HB2 ASN A 67 20.025 19.718 1.544 1.00 34.83 H new ATOM 0 HB3 ASN A 67 20.762 19.572 0.178 1.00 34.83 H new ATOM 0 HD21 ASN A 67 18.159 17.119 0.424 1.00 36.61 H new ATOM 0 HD22 ASN A 67 18.194 18.602 0.560 1.00 36.61 H new ATOM 457 N ARG A 68 22.600 21.234 2.488 1.00 35.95 N ATOM 458 CA ARG A 68 23.354 22.490 2.471 1.00 37.06 C ATOM 459 C ARG A 68 24.779 22.364 3.043 1.00 36.29 C ATOM 460 O ARG A 68 25.628 23.225 2.799 1.00 36.43 O ATOM 461 CB ARG A 68 22.586 23.585 3.221 1.00 37.09 C ATOM 462 CG ARG A 68 21.278 24.018 2.557 1.00 39.15 C ATOM 463 CD ARG A 68 20.542 25.082 3.378 1.00 40.19 C ATOM 464 NE ARG A 68 20.226 24.620 4.731 1.00 47.53 N ATOM 465 CZ ARG A 68 19.546 25.323 5.636 1.00 50.35 C ATOM 466 NH1 ARG A 68 19.090 26.540 5.347 1.00 52.08 N ATOM 467 NH2 ARG A 68 19.320 24.803 6.838 1.00 51.72 N ATOM 0 H ARG A 68 22.015 21.189 3.117 1.00 35.95 H new ATOM 0 HA ARG A 68 23.451 22.731 1.536 1.00 37.06 H new ATOM 0 HB2 ARG A 68 22.391 23.270 4.117 1.00 37.09 H new ATOM 0 HB3 ARG A 68 23.161 24.361 3.312 1.00 37.09 H new ATOM 0 HG2 ARG A 68 21.466 24.367 1.671 1.00 39.15 H new ATOM 0 HG3 ARG A 68 20.703 23.245 2.442 1.00 39.15 H new ATOM 0 HD2 ARG A 68 21.088 25.882 3.431 1.00 40.19 H new ATOM 0 HD3 ARG A 68 19.722 25.328 2.923 1.00 40.19 H new ATOM 0 HE ARG A 68 20.499 23.837 4.958 1.00 47.53 H new ATOM 0 HH11 ARG A 68 19.233 26.880 4.570 1.00 52.08 H new ATOM 0 HH12 ARG A 68 18.652 26.986 5.937 1.00 52.08 H new ATOM 0 HH21 ARG A 68 19.612 24.017 7.028 1.00 51.72 H new ATOM 0 HH22 ARG A 68 18.882 25.253 7.426 1.00 51.72 H new ATOM 468 N THR A 69 25.035 21.296 3.797 1.00 35.53 N ATOM 469 CA THR A 69 26.338 21.078 4.429 1.00 34.78 C ATOM 470 C THR A 69 27.348 20.488 3.448 1.00 34.49 C ATOM 471 O THR A 69 27.090 19.462 2.828 1.00 34.14 O ATOM 472 CB THR A 69 26.212 20.170 5.681 1.00 34.62 C ATOM 473 OG1 THR A 69 25.345 20.793 6.629 1.00 33.85 O ATOM 474 CG2 THR A 69 27.571 19.926 6.337 1.00 34.54 C ATOM 0 H THR A 69 24.459 20.677 3.957 1.00 35.53 H new ATOM 0 HA THR A 69 26.665 21.947 4.711 1.00 34.78 H new ATOM 0 HB THR A 69 25.852 19.315 5.397 1.00 34.62 H new ATOM 0 HG1 THR A 69 24.559 20.794 6.332 1.00 33.85 H new ATOM 0 HG21 THR A 69 27.458 19.357 7.114 1.00 34.54 H new ATOM 0 HG22 THR A 69 28.164 19.493 5.703 1.00 34.54 H new ATOM 0 HG23 THR A 69 27.955 20.774 6.611 1.00 34.54 H new ATOM 475 N GLU A 70 28.501 21.142 3.328 1.00 34.41 N ATOM 476 CA GLU A 70 29.569 20.698 2.431 1.00 34.53 C ATOM 477 C GLU A 70 30.043 19.283 2.758 1.00 33.92 C ATOM 478 O GLU A 70 30.397 18.991 3.901 1.00 33.59 O ATOM 479 CB GLU A 70 30.753 21.663 2.499 1.00 34.90 C ATOM 480 CG GLU A 70 31.714 21.550 1.323 1.00 37.03 C ATOM 481 CD GLU A 70 31.146 22.141 0.035 1.00 39.70 C ATOM 482 OE1 GLU A 70 31.447 21.590 -1.045 1.00 41.07 O ATOM 483 OE2 GLU A 70 30.403 23.151 0.099 1.00 40.22 O ATOM 0 H GLU A 70 28.688 21.858 3.766 1.00 34.41 H new ATOM 0 HA GLU A 70 29.203 20.689 1.533 1.00 34.53 H new ATOM 0 HB2 GLU A 70 30.416 22.571 2.543 1.00 34.90 H new ATOM 0 HB3 GLU A 70 31.242 21.502 3.321 1.00 34.90 H new ATOM 0 HG2 GLU A 70 32.543 22.003 1.544 1.00 37.03 H new ATOM 0 HG3 GLU A 70 31.931 20.616 1.177 1.00 37.03 H new ATOM 484 N GLY A 71 30.031 18.418 1.745 1.00 33.44 N ATOM 485 CA GLY A 71 30.521 17.044 1.866 1.00 33.09 C ATOM 486 C GLY A 71 29.593 16.071 2.571 1.00 32.95 C ATOM 487 O GLY A 71 29.954 14.911 2.778 1.00 32.85 O ATOM 0 H GLY A 71 29.736 18.613 0.961 1.00 33.44 H new ATOM 0 HA2 GLY A 71 30.703 16.704 0.976 1.00 33.09 H new ATOM 0 HA3 GLY A 71 31.366 17.061 2.342 1.00 33.09 H new ATOM 488 N ALA A 72 28.398 16.536 2.935 1.00 32.75 N ATOM 489 CA ALA A 72 27.425 15.715 3.656 1.00 32.75 C ATOM 490 C ALA A 72 26.258 15.289 2.772 1.00 32.70 C ATOM 491 O ALA A 72 25.776 16.062 1.949 1.00 32.66 O ATOM 492 CB ALA A 72 26.914 16.452 4.888 1.00 32.61 C ATOM 0 H ALA A 72 28.129 17.336 2.771 1.00 32.75 H new ATOM 0 HA ALA A 72 27.885 14.908 3.935 1.00 32.75 H new ATOM 0 HB1 ALA A 72 26.271 15.896 5.355 1.00 32.61 H new ATOM 0 HB2 ALA A 72 27.658 16.650 5.478 1.00 32.61 H new ATOM 0 HB3 ALA A 72 26.488 17.280 4.616 1.00 32.61 H new ATOM 493 N ASP A 73 25.811 14.050 2.951 1.00 32.89 N ATOM 494 CA ASP A 73 24.665 13.523 2.217 1.00 33.04 C ATOM 495 C ASP A 73 23.798 12.704 3.157 1.00 32.48 C ATOM 496 O ASP A 73 24.324 11.984 4.003 1.00 32.50 O ATOM 497 CB ASP A 73 25.131 12.657 1.041 1.00 33.42 C ATOM 498 CG ASP A 73 25.827 13.465 -0.048 1.00 35.83 C ATOM 499 OD1 ASP A 73 25.149 14.282 -0.718 1.00 38.18 O ATOM 500 OD2 ASP A 73 27.052 13.280 -0.241 1.00 37.87 O ATOM 0 H ASP A 73 26.163 13.491 3.501 1.00 32.89 H new ATOM 0 HA ASP A 73 24.148 14.264 1.863 1.00 33.04 H new ATOM 0 HB2 ASP A 73 25.737 11.974 1.368 1.00 33.42 H new ATOM 0 HB3 ASP A 73 24.366 12.199 0.659 1.00 33.42 H new ATOM 501 N VAL A 74 22.476 12.829 3.023 1.00 32.00 N ATOM 502 CA VAL A 74 21.541 11.986 3.768 1.00 31.63 C ATOM 503 C VAL A 74 21.583 10.601 3.145 1.00 31.40 C ATOM 504 O VAL A 74 21.319 10.439 1.949 1.00 31.47 O ATOM 505 CB VAL A 74 20.072 12.497 3.724 1.00 31.80 C ATOM 506 CG1 VAL A 74 19.174 11.632 4.616 1.00 31.64 C ATOM 507 CG2 VAL A 74 19.967 13.960 4.127 1.00 31.48 C ATOM 0 H VAL A 74 22.099 13.400 2.502 1.00 32.00 H new ATOM 0 HA VAL A 74 21.813 11.993 4.699 1.00 31.63 H new ATOM 0 HB VAL A 74 19.768 12.424 2.806 1.00 31.80 H new ATOM 0 HG11 VAL A 74 18.263 11.964 4.577 1.00 31.64 H new ATOM 0 HG12 VAL A 74 19.197 10.714 4.305 1.00 31.64 H new ATOM 0 HG13 VAL A 74 19.493 11.671 5.531 1.00 31.64 H new ATOM 0 HG21 VAL A 74 19.039 14.241 4.087 1.00 31.48 H new ATOM 0 HG22 VAL A 74 20.300 14.071 5.031 1.00 31.48 H new ATOM 0 HG23 VAL A 74 20.495 14.502 3.520 1.00 31.48 H new ATOM 508 N LYS A 75 21.922 9.607 3.954 1.00 31.01 N ATOM 509 CA LYS A 75 22.036 8.239 3.467 1.00 30.87 C ATOM 510 C LYS A 75 20.728 7.475 3.641 1.00 30.36 C ATOM 511 O LYS A 75 20.329 6.698 2.771 1.00 30.28 O ATOM 512 CB LYS A 75 23.196 7.523 4.170 1.00 31.09 C ATOM 513 CG LYS A 75 24.579 7.984 3.706 1.00 32.27 C ATOM 514 CD LYS A 75 24.886 7.429 2.322 1.00 35.21 C ATOM 515 CE LYS A 75 25.977 8.206 1.631 1.00 36.91 C ATOM 516 NZ LYS A 75 26.237 7.628 0.288 1.00 38.83 N ATOM 0 H LYS A 75 22.091 9.703 4.792 1.00 31.01 H new ATOM 0 HA LYS A 75 22.225 8.269 2.516 1.00 30.87 H new ATOM 0 HB2 LYS A 75 23.121 7.666 5.126 1.00 31.09 H new ATOM 0 HB3 LYS A 75 23.115 6.568 4.019 1.00 31.09 H new ATOM 0 HG2 LYS A 75 24.614 8.953 3.687 1.00 32.27 H new ATOM 0 HG3 LYS A 75 25.254 7.688 4.337 1.00 32.27 H new ATOM 0 HD2 LYS A 75 25.151 6.499 2.399 1.00 35.21 H new ATOM 0 HD3 LYS A 75 24.082 7.451 1.780 1.00 35.21 H new ATOM 0 HE2 LYS A 75 25.718 9.137 1.546 1.00 36.91 H new ATOM 0 HE3 LYS A 75 26.787 8.184 2.164 1.00 36.91 H new ATOM 0 HZ1 LYS A 75 26.882 8.091 -0.115 1.00 38.83 H new ATOM 0 HZ2 LYS A 75 26.491 6.779 0.374 1.00 38.83 H new ATOM 0 HZ3 LYS A 75 25.494 7.667 -0.201 1.00 38.83 H new ATOM 517 N THR A 76 20.057 7.724 4.761 1.00 29.74 N ATOM 518 CA THR A 76 18.866 6.976 5.150 1.00 29.24 C ATOM 519 C THR A 76 18.141 7.710 6.281 1.00 28.84 C ATOM 520 O THR A 76 18.769 8.391 7.095 1.00 28.83 O ATOM 521 CB THR A 76 19.220 5.481 5.520 1.00 29.39 C ATOM 522 OG1 THR A 76 18.044 4.761 5.917 1.00 29.72 O ATOM 523 CG2 THR A 76 20.271 5.402 6.621 1.00 28.94 C ATOM 0 H THR A 76 20.282 8.337 5.321 1.00 29.74 H new ATOM 0 HA THR A 76 18.260 6.927 4.394 1.00 29.24 H new ATOM 0 HB THR A 76 19.589 5.072 4.722 1.00 29.39 H new ATOM 0 HG1 THR A 76 17.439 4.875 5.345 1.00 29.72 H new ATOM 0 HG21 THR A 76 20.462 4.472 6.820 1.00 28.94 H new ATOM 0 HG22 THR A 76 21.083 5.842 6.325 1.00 28.94 H new ATOM 0 HG23 THR A 76 19.938 5.841 7.419 1.00 28.94 H new ATOM 524 N TRP A 77 16.816 7.605 6.296 1.00 28.40 N ATOM 525 CA TRP A 77 15.990 8.219 7.340 1.00 28.01 C ATOM 526 C TRP A 77 14.654 7.500 7.459 1.00 27.77 C ATOM 527 O TRP A 77 14.206 6.850 6.521 1.00 27.64 O ATOM 528 CB TRP A 77 15.758 9.718 7.080 1.00 28.00 C ATOM 529 CG TRP A 77 14.929 10.018 5.855 1.00 28.00 C ATOM 530 CD1 TRP A 77 15.384 10.179 4.577 1.00 27.86 C ATOM 531 CD2 TRP A 77 13.505 10.195 5.799 1.00 27.54 C ATOM 532 NE1 TRP A 77 14.332 10.440 3.727 1.00 27.78 N ATOM 533 CE2 TRP A 77 13.168 10.453 4.450 1.00 27.80 C ATOM 534 CE3 TRP A 77 12.482 10.153 6.757 1.00 27.67 C ATOM 535 CZ2 TRP A 77 11.846 10.676 4.032 1.00 28.20 C ATOM 536 CZ3 TRP A 77 11.168 10.370 6.344 1.00 28.21 C ATOM 537 CH2 TRP A 77 10.863 10.628 4.989 1.00 28.40 C ATOM 0 H TRP A 77 16.367 7.176 5.701 1.00 28.40 H new ATOM 0 HA TRP A 77 16.474 8.133 8.176 1.00 28.01 H new ATOM 0 HB2 TRP A 77 15.322 10.106 7.855 1.00 28.00 H new ATOM 0 HB3 TRP A 77 16.619 10.156 6.990 1.00 28.00 H new ATOM 0 HD1 TRP A 77 16.275 10.121 4.318 1.00 27.86 H new ATOM 0 HE1 TRP A 77 14.395 10.573 2.880 1.00 27.78 H new ATOM 0 HE3 TRP A 77 12.676 9.984 7.651 1.00 27.67 H new ATOM 0 HZ2 TRP A 77 11.644 10.850 3.141 1.00 28.20 H new ATOM 0 HZ3 TRP A 77 10.481 10.344 6.971 1.00 28.21 H new ATOM 0 HH2 TRP A 77 9.978 10.768 4.740 1.00 28.40 H new ATOM 538 N VAL A 78 14.026 7.628 8.623 1.00 27.65 N ATOM 539 CA VAL A 78 12.699 7.071 8.854 1.00 27.58 C ATOM 540 C VAL A 78 11.991 7.859 9.960 1.00 27.84 C ATOM 541 O VAL A 78 12.637 8.505 10.793 1.00 27.45 O ATOM 542 CB VAL A 78 12.763 5.542 9.187 1.00 27.65 C ATOM 543 CG1 VAL A 78 13.150 5.298 10.645 1.00 26.69 C ATOM 544 CG2 VAL A 78 11.447 4.839 8.833 1.00 26.95 C ATOM 0 H VAL A 78 14.358 8.040 9.301 1.00 27.65 H new ATOM 0 HA VAL A 78 12.184 7.155 8.036 1.00 27.58 H new ATOM 0 HB VAL A 78 13.461 5.155 8.635 1.00 27.65 H new ATOM 0 HG11 VAL A 78 13.180 4.344 10.817 1.00 26.69 H new ATOM 0 HG12 VAL A 78 14.023 5.685 10.817 1.00 26.69 H new ATOM 0 HG13 VAL A 78 12.493 5.710 11.228 1.00 26.69 H new ATOM 0 HG21 VAL A 78 11.515 3.896 9.049 1.00 26.95 H new ATOM 0 HG22 VAL A 78 10.722 5.235 9.341 1.00 26.95 H new ATOM 0 HG23 VAL A 78 11.270 4.941 7.885 1.00 26.95 H new ATOM 545 N ILE A 79 10.663 7.831 9.926 1.00 28.25 N ATOM 546 CA ILE A 79 9.832 8.317 11.018 1.00 28.79 C ATOM 547 C ILE A 79 8.894 7.182 11.434 1.00 29.36 C ATOM 548 O ILE A 79 8.175 6.626 10.597 1.00 29.21 O ATOM 549 CB ILE A 79 9.012 9.574 10.610 1.00 28.84 C ATOM 550 CG1 ILE A 79 9.947 10.749 10.297 1.00 28.58 C ATOM 551 CG2 ILE A 79 8.016 9.956 11.719 1.00 28.11 C ATOM 552 CD1 ILE A 79 9.269 11.924 9.598 1.00 28.63 C ATOM 0 H ILE A 79 10.215 7.525 9.259 1.00 28.25 H new ATOM 0 HA ILE A 79 10.400 8.584 11.757 1.00 28.79 H new ATOM 0 HB ILE A 79 8.508 9.362 9.809 1.00 28.84 H new ATOM 0 HG12 ILE A 79 10.342 11.064 11.125 1.00 28.58 H new ATOM 0 HG13 ILE A 79 10.674 10.430 9.739 1.00 28.58 H new ATOM 0 HG21 ILE A 79 7.514 10.741 11.448 1.00 28.11 H new ATOM 0 HG22 ILE A 79 7.404 9.219 11.873 1.00 28.11 H new ATOM 0 HG23 ILE A 79 8.501 10.150 12.537 1.00 28.11 H new ATOM 0 HD11 ILE A 79 9.921 12.623 9.435 1.00 28.63 H new ATOM 0 HD12 ILE A 79 8.896 11.627 8.754 1.00 28.63 H new ATOM 0 HD13 ILE A 79 8.559 12.270 10.161 1.00 28.63 H new ATOM 553 N ILE A 80 8.924 6.832 12.719 1.00 30.21 N ATOM 554 CA ILE A 80 8.005 5.835 13.279 1.00 31.16 C ATOM 555 C ILE A 80 7.021 6.537 14.220 1.00 31.95 C ATOM 556 O ILE A 80 7.421 6.995 15.288 1.00 32.14 O ATOM 557 CB ILE A 80 8.752 4.714 14.060 1.00 31.14 C ATOM 558 CG1 ILE A 80 9.919 4.128 13.250 1.00 30.69 C ATOM 559 CG2 ILE A 80 7.773 3.641 14.546 1.00 31.10 C ATOM 560 CD1 ILE A 80 9.524 3.330 12.014 1.00 30.35 C ATOM 0 H ILE A 80 9.475 7.163 13.291 1.00 30.21 H new ATOM 0 HA ILE A 80 7.538 5.414 12.540 1.00 31.16 H new ATOM 0 HB ILE A 80 9.150 5.115 14.848 1.00 31.14 H new ATOM 0 HG12 ILE A 80 10.498 4.855 12.975 1.00 30.69 H new ATOM 0 HG13 ILE A 80 10.441 3.555 13.833 1.00 30.69 H new ATOM 0 HG21 ILE A 80 8.259 2.954 15.029 1.00 31.10 H new ATOM 0 HG22 ILE A 80 7.115 4.045 15.134 1.00 31.10 H new ATOM 0 HG23 ILE A 80 7.324 3.243 13.784 1.00 31.10 H new ATOM 0 HD11 ILE A 80 10.322 3.003 11.571 1.00 30.35 H new ATOM 0 HD12 ILE A 80 8.970 2.579 12.277 1.00 30.35 H new ATOM 0 HD13 ILE A 80 9.028 3.900 11.406 1.00 30.35 H new ATOM 561 N PRO A 81 5.734 6.621 13.823 1.00 32.75 N ATOM 562 CA PRO A 81 4.699 7.365 14.562 1.00 33.28 C ATOM 563 C PRO A 81 4.463 6.935 16.011 1.00 33.92 C ATOM 564 O PRO A 81 4.334 7.798 16.888 1.00 34.23 O ATOM 565 CB PRO A 81 3.429 7.126 13.734 1.00 33.23 C ATOM 566 CG PRO A 81 3.916 6.780 12.376 1.00 33.26 C ATOM 567 CD PRO A 81 5.191 6.018 12.592 1.00 32.83 C ATOM 0 HA PRO A 81 4.974 8.291 14.654 1.00 33.28 H new ATOM 0 HB2 PRO A 81 2.895 6.408 14.109 1.00 33.23 H new ATOM 0 HB3 PRO A 81 2.868 7.917 13.715 1.00 33.23 H new ATOM 0 HG2 PRO A 81 3.265 6.244 11.897 1.00 33.26 H new ATOM 0 HG3 PRO A 81 4.071 7.578 11.846 1.00 33.26 H new ATOM 0 HD2 PRO A 81 5.028 5.068 12.699 1.00 32.83 H new ATOM 0 HD3 PRO A 81 5.800 6.118 11.844 1.00 32.83 H new ATOM 568 N ARG A 82 4.377 5.629 16.261 1.00 34.32 N ATOM 569 CA ARG A 82 4.039 5.134 17.601 1.00 34.89 C ATOM 570 C ARG A 82 4.869 3.911 17.980 1.00 34.93 C ATOM 571 O ARG A 82 4.366 2.785 17.959 1.00 34.87 O ATOM 572 CB ARG A 82 2.536 4.825 17.712 1.00 35.25 C ATOM 573 CG ARG A 82 1.640 6.037 17.507 1.00 36.58 C ATOM 574 CD ARG A 82 0.358 5.948 18.303 1.00 39.02 C ATOM 575 NE ARG A 82 -0.411 7.188 18.206 1.00 40.04 N ATOM 576 CZ ARG A 82 -1.674 7.324 18.596 1.00 41.00 C ATOM 577 NH1 ARG A 82 -2.329 6.295 19.120 1.00 41.31 N ATOM 578 NH2 ARG A 82 -2.285 8.494 18.458 1.00 41.96 N ATOM 0 H ARG A 82 4.509 5.014 15.674 1.00 34.32 H new ATOM 0 HA ARG A 82 4.254 5.840 18.230 1.00 34.89 H new ATOM 0 HB2 ARG A 82 2.305 4.148 17.056 1.00 35.25 H new ATOM 0 HB3 ARG A 82 2.357 4.446 18.587 1.00 35.25 H new ATOM 0 HG2 ARG A 82 2.122 6.839 17.763 1.00 36.58 H new ATOM 0 HG3 ARG A 82 1.427 6.123 16.565 1.00 36.58 H new ATOM 0 HD2 ARG A 82 -0.177 5.207 17.978 1.00 39.02 H new ATOM 0 HD3 ARG A 82 0.564 5.764 19.233 1.00 39.02 H new ATOM 0 HE ARG A 82 -0.019 7.877 17.873 1.00 40.04 H new ATOM 0 HH11 ARG A 82 -1.936 5.535 19.209 1.00 41.31 H new ATOM 0 HH12 ARG A 82 -3.146 6.388 19.371 1.00 41.31 H new ATOM 0 HH21 ARG A 82 -1.864 9.162 18.117 1.00 41.96 H new ATOM 0 HH22 ARG A 82 -3.102 8.585 18.710 1.00 41.96 H new ATOM 579 N PRO A 83 6.145 4.130 18.349 1.00 35.26 N ATOM 580 CA PRO A 83 7.056 3.004 18.570 1.00 35.33 C ATOM 581 C PRO A 83 6.642 2.133 19.758 1.00 35.29 C ATOM 582 O PRO A 83 6.328 2.650 20.833 1.00 35.31 O ATOM 583 CB PRO A 83 8.405 3.687 18.840 1.00 35.34 C ATOM 584 CG PRO A 83 8.043 5.049 19.351 1.00 35.36 C ATOM 585 CD PRO A 83 6.805 5.428 18.594 1.00 35.16 C ATOM 0 HA PRO A 83 7.069 2.396 17.814 1.00 35.33 H new ATOM 0 HB2 PRO A 83 8.927 3.193 19.492 1.00 35.34 H new ATOM 0 HB3 PRO A 83 8.940 3.744 18.033 1.00 35.34 H new ATOM 0 HG2 PRO A 83 7.880 5.034 20.307 1.00 35.36 H new ATOM 0 HG3 PRO A 83 8.759 5.685 19.195 1.00 35.36 H new ATOM 0 HD2 PRO A 83 6.240 6.025 19.108 1.00 35.16 H new ATOM 0 HD3 PRO A 83 7.018 5.883 17.764 1.00 35.16 H new ATOM 586 N HIS A 84 6.636 0.823 19.538 1.00 35.16 N ATOM 587 CA HIS A 84 6.350 -0.165 20.572 1.00 35.10 C ATOM 588 C HIS A 84 7.355 -0.035 21.719 1.00 35.09 C ATOM 589 O HIS A 84 8.506 0.351 21.503 1.00 35.03 O ATOM 590 CB HIS A 84 6.436 -1.559 19.946 1.00 35.13 C ATOM 591 CG HIS A 84 5.852 -2.651 20.783 1.00 34.88 C ATOM 592 ND1 HIS A 84 6.549 -3.260 21.804 1.00 34.87 N ATOM 593 CD2 HIS A 84 4.648 -3.268 20.730 1.00 35.08 C ATOM 594 CE1 HIS A 84 5.795 -4.196 22.353 1.00 35.02 C ATOM 595 NE2 HIS A 84 4.636 -4.221 21.719 1.00 34.87 N ATOM 0 H HIS A 84 6.801 0.477 18.768 1.00 35.16 H new ATOM 0 HA HIS A 84 5.461 -0.020 20.932 1.00 35.10 H new ATOM 0 HB2 HIS A 84 5.981 -1.545 19.089 1.00 35.13 H new ATOM 0 HB3 HIS A 84 7.367 -1.765 19.769 1.00 35.13 H new ATOM 0 HD2 HIS A 84 3.958 -3.081 20.135 1.00 35.08 H new ATOM 0 HE1 HIS A 84 6.038 -4.744 23.064 1.00 35.02 H new ATOM 0 HE2 HIS A 84 3.980 -4.748 21.897 1.00 34.87 H new ATOM 596 N GLU A 85 6.917 -0.370 22.930 1.00 34.98 N ATOM 597 CA GLU A 85 7.762 -0.288 24.130 1.00 35.21 C ATOM 598 C GLU A 85 9.022 -1.164 24.071 1.00 33.75 C ATOM 599 O GLU A 85 10.072 -0.778 24.589 1.00 33.72 O ATOM 600 CB GLU A 85 6.953 -0.631 25.385 1.00 35.28 C ATOM 601 CG GLU A 85 5.817 0.325 25.697 1.00 37.30 C ATOM 602 CD GLU A 85 5.135 -0.003 27.018 1.00 37.99 C ATOM 603 OE1 GLU A 85 5.779 0.175 28.080 1.00 41.71 O ATOM 604 OE2 GLU A 85 3.956 -0.432 26.998 1.00 41.85 O ATOM 0 H GLU A 85 6.119 -0.653 23.084 1.00 34.98 H new ATOM 0 HA GLU A 85 8.068 0.632 24.169 1.00 35.21 H new ATOM 0 HB2 GLU A 85 6.588 -1.524 25.284 1.00 35.28 H new ATOM 0 HB3 GLU A 85 7.555 -0.655 26.145 1.00 35.28 H new ATOM 0 HG2 GLU A 85 6.159 1.232 25.728 1.00 37.30 H new ATOM 0 HG3 GLU A 85 5.164 0.293 24.981 1.00 37.30 H new ATOM 605 N ASN A 86 8.906 -2.337 23.449 1.00 32.42 N ATOM 606 CA ASN A 86 10.038 -3.252 23.261 1.00 31.04 C ATOM 607 C ASN A 86 11.130 -2.605 22.402 1.00 30.22 C ATOM 608 O ASN A 86 12.318 -2.835 22.621 1.00 30.01 O ATOM 609 CB ASN A 86 9.553 -4.570 22.634 1.00 30.89 C ATOM 610 CG ASN A 86 10.542 -5.732 22.803 1.00 30.31 C ATOM 611 OD1 ASN A 86 10.224 -6.867 22.449 1.00 29.05 O ATOM 612 ND2 ASN A 86 11.731 -5.458 23.333 1.00 29.37 N ATOM 0 H ASN A 86 8.166 -2.628 23.122 1.00 32.42 H new ATOM 0 HA ASN A 86 10.425 -3.447 24.129 1.00 31.04 H new ATOM 0 HB2 ASN A 86 8.705 -4.817 23.034 1.00 30.89 H new ATOM 0 HB3 ASN A 86 9.390 -4.429 21.688 1.00 30.89 H new ATOM 0 HD21 ASN A 86 12.310 -6.085 23.439 1.00 29.37 H new ATOM 0 HD22 ASN A 86 11.921 -4.653 23.570 1.00 29.37 H new ATOM 613 N VAL A 87 10.713 -1.792 21.434 1.00 29.37 N ATOM 614 CA VAL A 87 11.642 -1.085 20.551 1.00 28.67 C ATOM 615 C VAL A 87 12.339 0.031 21.324 1.00 28.20 C ATOM 616 O VAL A 87 13.562 0.174 21.256 1.00 28.19 O ATOM 617 CB VAL A 87 10.920 -0.480 19.317 1.00 28.59 C ATOM 618 CG1 VAL A 87 11.908 0.234 18.407 1.00 28.34 C ATOM 619 CG2 VAL A 87 10.168 -1.549 18.546 1.00 28.26 C ATOM 0 H VAL A 87 9.884 -1.634 21.270 1.00 29.37 H new ATOM 0 HA VAL A 87 12.292 -1.730 20.232 1.00 28.67 H new ATOM 0 HB VAL A 87 10.276 0.170 19.641 1.00 28.59 H new ATOM 0 HG11 VAL A 87 11.437 0.604 17.644 1.00 28.34 H new ATOM 0 HG12 VAL A 87 12.341 0.950 18.897 1.00 28.34 H new ATOM 0 HG13 VAL A 87 12.578 -0.396 18.098 1.00 28.34 H new ATOM 0 HG21 VAL A 87 9.726 -1.147 17.782 1.00 28.26 H new ATOM 0 HG22 VAL A 87 10.791 -2.226 18.239 1.00 28.26 H new ATOM 0 HG23 VAL A 87 9.505 -1.958 19.123 1.00 28.26 H new ATOM 620 N VAL A 88 11.541 0.804 22.059 1.00 27.54 N ATOM 621 CA VAL A 88 12.015 1.894 22.907 1.00 27.17 C ATOM 622 C VAL A 88 13.027 1.409 23.958 1.00 26.92 C ATOM 623 O VAL A 88 13.989 2.112 24.265 1.00 26.76 O ATOM 624 CB VAL A 88 10.813 2.636 23.586 1.00 27.23 C ATOM 625 CG1 VAL A 88 11.286 3.669 24.579 1.00 26.86 C ATOM 626 CG2 VAL A 88 9.925 3.295 22.534 1.00 26.98 C ATOM 0 H VAL A 88 10.687 0.705 22.078 1.00 27.54 H new ATOM 0 HA VAL A 88 12.479 2.524 22.333 1.00 27.17 H new ATOM 0 HB VAL A 88 10.297 1.970 24.067 1.00 27.23 H new ATOM 0 HG11 VAL A 88 10.519 4.108 24.979 1.00 26.86 H new ATOM 0 HG12 VAL A 88 11.809 3.236 25.272 1.00 26.86 H new ATOM 0 HG13 VAL A 88 11.834 4.328 24.125 1.00 26.86 H new ATOM 0 HG21 VAL A 88 9.187 3.749 22.971 1.00 26.98 H new ATOM 0 HG22 VAL A 88 10.446 3.938 22.028 1.00 26.98 H new ATOM 0 HG23 VAL A 88 9.577 2.617 21.934 1.00 26.98 H new ATOM 627 N ALA A 89 12.812 0.204 24.486 1.00 26.77 N ATOM 628 CA ALA A 89 13.702 -0.368 25.502 1.00 26.77 C ATOM 629 C ALA A 89 15.033 -0.851 24.927 1.00 26.81 C ATOM 630 O ALA A 89 16.090 -0.591 25.506 1.00 27.08 O ATOM 631 CB ALA A 89 13.006 -1.494 26.259 1.00 26.53 C ATOM 0 H ALA A 89 12.152 -0.303 24.269 1.00 26.77 H new ATOM 0 HA ALA A 89 13.910 0.350 26.120 1.00 26.77 H new ATOM 0 HB1 ALA A 89 13.610 -1.858 26.925 1.00 26.53 H new ATOM 0 HB2 ALA A 89 12.213 -1.148 26.697 1.00 26.53 H new ATOM 0 HB3 ALA A 89 12.752 -2.193 25.637 1.00 26.53 H new ATOM 632 N VAL A 90 14.983 -1.544 23.791 1.00 26.72 N ATOM 633 CA VAL A 90 16.183 -2.175 23.216 1.00 26.63 C ATOM 634 C VAL A 90 17.062 -1.192 22.431 1.00 26.77 C ATOM 635 O VAL A 90 18.286 -1.199 22.582 1.00 26.73 O ATOM 636 CB VAL A 90 15.828 -3.436 22.370 1.00 26.50 C ATOM 637 CG1 VAL A 90 17.007 -3.895 21.531 1.00 26.19 C ATOM 638 CG2 VAL A 90 15.370 -4.566 23.278 1.00 26.14 C ATOM 0 H VAL A 90 14.265 -1.664 23.333 1.00 26.72 H new ATOM 0 HA VAL A 90 16.717 -2.471 23.970 1.00 26.63 H new ATOM 0 HB VAL A 90 15.107 -3.193 21.768 1.00 26.50 H new ATOM 0 HG11 VAL A 90 16.754 -4.679 21.018 1.00 26.19 H new ATOM 0 HG12 VAL A 90 17.270 -3.184 20.926 1.00 26.19 H new ATOM 0 HG13 VAL A 90 17.752 -4.116 22.112 1.00 26.19 H new ATOM 0 HG21 VAL A 90 15.152 -5.344 22.742 1.00 26.14 H new ATOM 0 HG22 VAL A 90 16.080 -4.790 23.899 1.00 26.14 H new ATOM 0 HG23 VAL A 90 14.585 -4.285 23.773 1.00 26.14 H new ATOM 639 N LEU A 91 16.435 -0.351 21.612 1.00 27.01 N ATOM 640 CA LEU A 91 17.162 0.611 20.783 1.00 27.42 C ATOM 641 C LEU A 91 17.350 1.937 21.519 1.00 27.91 C ATOM 642 O LEU A 91 16.519 2.304 22.351 1.00 27.60 O ATOM 643 CB LEU A 91 16.443 0.833 19.439 1.00 27.17 C ATOM 644 CG LEU A 91 16.223 -0.382 18.517 1.00 27.54 C ATOM 645 CD1 LEU A 91 15.571 0.050 17.216 1.00 26.63 C ATOM 646 CD2 LEU A 91 17.511 -1.153 18.230 1.00 26.79 C ATOM 0 H LEU A 91 15.580 -0.321 21.521 1.00 27.01 H new ATOM 0 HA LEU A 91 18.040 0.241 20.600 1.00 27.42 H new ATOM 0 HB2 LEU A 91 15.575 1.221 19.629 1.00 27.17 H new ATOM 0 HB3 LEU A 91 16.947 1.495 18.940 1.00 27.17 H new ATOM 0 HG LEU A 91 15.632 -0.987 18.992 1.00 27.54 H new ATOM 0 HD11 LEU A 91 15.439 -0.725 16.647 1.00 26.63 H new ATOM 0 HD12 LEU A 91 14.713 0.462 17.405 1.00 26.63 H new ATOM 0 HD13 LEU A 91 16.143 0.689 16.764 1.00 26.63 H new ATOM 0 HD21 LEU A 91 17.316 -1.904 17.648 1.00 26.79 H new ATOM 0 HD22 LEU A 91 18.150 -0.566 17.797 1.00 26.79 H new ATOM 0 HD23 LEU A 91 17.886 -1.479 19.063 1.00 26.79 H new ATOM 647 N PRO A 92 18.442 2.668 21.213 1.00 28.63 N ATOM 648 CA PRO A 92 18.739 3.889 21.968 1.00 29.19 C ATOM 649 C PRO A 92 17.888 5.083 21.523 1.00 29.76 C ATOM 650 O PRO A 92 18.422 6.100 21.072 1.00 29.94 O ATOM 651 CB PRO A 92 20.226 4.122 21.668 1.00 29.18 C ATOM 652 CG PRO A 92 20.406 3.569 20.282 1.00 28.66 C ATOM 653 CD PRO A 92 19.461 2.400 20.176 1.00 28.53 C ATOM 0 HA PRO A 92 18.540 3.796 22.913 1.00 29.19 H new ATOM 0 HB2 PRO A 92 20.453 5.064 21.707 1.00 29.18 H new ATOM 0 HB3 PRO A 92 20.794 3.666 22.309 1.00 29.18 H new ATOM 0 HG2 PRO A 92 20.205 4.240 19.611 1.00 28.66 H new ATOM 0 HG3 PRO A 92 21.323 3.289 20.136 1.00 28.66 H new ATOM 0 HD2 PRO A 92 19.063 2.344 19.293 1.00 28.53 H new ATOM 0 HD3 PRO A 92 19.917 1.559 20.335 1.00 28.53 H new ATOM 654 N ILE A 93 16.571 4.950 21.664 1.00 30.46 N ATOM 655 CA ILE A 93 15.625 5.987 21.244 1.00 31.03 C ATOM 656 C ILE A 93 14.766 6.526 22.401 1.00 31.84 C ATOM 657 O ILE A 93 13.887 7.363 22.189 1.00 31.78 O ATOM 658 CB ILE A 93 14.704 5.497 20.084 1.00 30.99 C ATOM 659 CG1 ILE A 93 13.865 4.286 20.522 1.00 30.84 C ATOM 660 CG2 ILE A 93 15.526 5.182 18.829 1.00 30.44 C ATOM 661 CD1 ILE A 93 12.623 4.041 19.665 1.00 31.07 C ATOM 0 H ILE A 93 16.198 4.255 22.007 1.00 30.46 H new ATOM 0 HA ILE A 93 16.174 6.719 20.922 1.00 31.03 H new ATOM 0 HB ILE A 93 14.090 6.215 19.862 1.00 30.99 H new ATOM 0 HG12 ILE A 93 14.423 3.493 20.499 1.00 30.84 H new ATOM 0 HG13 ILE A 93 13.590 4.412 21.444 1.00 30.84 H new ATOM 0 HG21 ILE A 93 14.935 4.880 18.122 1.00 30.44 H new ATOM 0 HG22 ILE A 93 15.994 5.981 18.539 1.00 30.44 H new ATOM 0 HG23 ILE A 93 16.171 4.486 19.030 1.00 30.44 H new ATOM 0 HD11 ILE A 93 12.147 3.265 20.000 1.00 31.07 H new ATOM 0 HD12 ILE A 93 12.043 4.818 19.705 1.00 31.07 H new ATOM 0 HD13 ILE A 93 12.890 3.884 18.746 1.00 31.07 H new ATOM 662 N ASP A 94 15.018 6.054 23.619 1.00 32.79 N ATOM 663 CA ASP A 94 14.234 6.495 24.775 1.00 33.95 C ATOM 664 C ASP A 94 14.766 7.814 25.332 1.00 34.61 C ATOM 665 O ASP A 94 15.920 8.186 25.081 1.00 34.37 O ATOM 666 CB ASP A 94 14.201 5.415 25.867 1.00 34.13 C ATOM 667 CG ASP A 94 13.053 5.611 26.873 1.00 35.72 C ATOM 668 OD1 ASP A 94 12.110 6.397 26.603 1.00 36.56 O ATOM 669 OD2 ASP A 94 13.092 4.966 27.946 1.00 37.36 O ATOM 0 H ASP A 94 15.634 5.481 23.799 1.00 32.79 H new ATOM 0 HA ASP A 94 13.324 6.643 24.473 1.00 33.95 H new ATOM 0 HB2 ASP A 94 14.114 4.543 25.450 1.00 34.13 H new ATOM 0 HB3 ASP A 94 15.046 5.418 26.344 1.00 34.13 H new ATOM 670 N PHE A 95 13.902 8.519 26.065 1.00 35.59 N ATOM 671 CA PHE A 95 14.272 9.732 26.780 1.00 36.76 C ATOM 672 C PHE A 95 15.186 9.387 27.950 1.00 38.36 C ATOM 673 O PHE A 95 15.077 8.311 28.538 1.00 38.31 O ATOM 674 CB PHE A 95 13.028 10.444 27.318 1.00 35.87 C ATOM 675 CG PHE A 95 12.108 10.971 26.251 1.00 34.74 C ATOM 676 CD1 PHE A 95 12.334 12.213 25.666 1.00 33.33 C ATOM 677 CD2 PHE A 95 10.996 10.237 25.851 1.00 33.31 C ATOM 678 CE1 PHE A 95 11.474 12.705 24.682 1.00 32.49 C ATOM 679 CE2 PHE A 95 10.131 10.726 24.872 1.00 32.69 C ATOM 680 CZ PHE A 95 10.370 11.961 24.291 1.00 32.81 C ATOM 0 H PHE A 95 13.076 8.300 26.159 1.00 35.59 H new ATOM 0 HA PHE A 95 14.733 10.319 26.160 1.00 36.76 H new ATOM 0 HB2 PHE A 95 12.534 9.828 27.881 1.00 35.87 H new ATOM 0 HB3 PHE A 95 13.309 11.182 27.882 1.00 35.87 H new ATOM 0 HD1 PHE A 95 13.066 12.721 25.933 1.00 33.33 H new ATOM 0 HD2 PHE A 95 10.827 9.410 26.241 1.00 33.31 H new ATOM 0 HE1 PHE A 95 11.641 13.531 24.289 1.00 32.49 H new ATOM 0 HE2 PHE A 95 9.394 10.223 24.609 1.00 32.69 H new ATOM 0 HZ PHE A 95 9.792 12.290 23.641 1.00 32.81 H new ATOM 681 N SER A 96 16.083 10.312 28.273 1.00 40.71 N ATOM 682 CA SER A 96 16.936 10.208 29.453 1.00 43.02 C ATOM 683 C SER A 96 16.820 11.505 30.264 1.00 44.94 C ATOM 684 O SER A 96 16.333 12.513 29.746 1.00 44.83 O ATOM 685 CB SER A 96 18.387 9.949 29.036 1.00 42.86 C ATOM 686 OG SER A 96 18.948 11.090 28.412 1.00 42.96 O ATOM 0 H SER A 96 16.215 11.024 27.810 1.00 40.71 H new ATOM 0 HA SER A 96 16.650 9.462 30.003 1.00 43.02 H new ATOM 0 HB2 SER A 96 18.913 9.711 29.815 1.00 42.86 H new ATOM 0 HB3 SER A 96 18.422 9.194 28.428 1.00 42.86 H new ATOM 0 HG SER A 96 18.826 11.044 27.582 1.00 42.96 H new ATOM 687 N PRO A 97 17.257 11.490 31.541 1.00 47.14 N ATOM 688 CA PRO A 97 17.169 12.707 32.359 1.00 48.99 C ATOM 689 C PRO A 97 17.941 13.912 31.801 1.00 51.07 C ATOM 690 O PRO A 97 17.562 15.055 32.067 1.00 50.98 O ATOM 691 CB PRO A 97 17.752 12.265 33.701 1.00 48.93 C ATOM 692 CG PRO A 97 17.590 10.775 33.717 1.00 48.00 C ATOM 693 CD PRO A 97 17.823 10.363 32.308 1.00 47.12 C ATOM 0 HA PRO A 97 16.255 13.030 32.400 1.00 48.99 H new ATOM 0 HB2 PRO A 97 18.685 12.518 33.780 1.00 48.93 H new ATOM 0 HB3 PRO A 97 17.282 12.678 34.442 1.00 48.93 H new ATOM 0 HG2 PRO A 97 18.226 10.357 34.318 1.00 48.00 H new ATOM 0 HG3 PRO A 97 16.704 10.519 34.019 1.00 48.00 H new ATOM 0 HD2 PRO A 97 18.766 10.238 32.121 1.00 47.12 H new ATOM 0 HD3 PRO A 97 17.379 9.526 32.099 1.00 47.12 H new ATOM 694 N GLU A 98 18.999 13.650 31.032 1.00 53.74 N ATOM 695 CA GLU A 98 19.790 14.698 30.369 1.00 56.65 C ATOM 696 C GLU A 98 18.967 15.570 29.423 1.00 57.94 C ATOM 697 O GLU A 98 19.209 16.775 29.309 1.00 58.14 O ATOM 698 CB GLU A 98 20.934 14.079 29.571 1.00 56.53 C ATOM 699 CG GLU A 98 22.131 13.647 30.392 1.00 57.99 C ATOM 700 CD GLU A 98 23.233 13.029 29.541 1.00 58.22 C ATOM 701 OE1 GLU A 98 23.939 12.133 30.056 1.00 60.56 O ATOM 702 OE2 GLU A 98 23.393 13.433 28.363 1.00 60.09 O ATOM 0 H GLU A 98 19.283 12.853 30.877 1.00 53.74 H new ATOM 0 HA GLU A 98 20.127 15.262 31.082 1.00 56.65 H new ATOM 0 HB2 GLU A 98 20.594 13.308 29.090 1.00 56.53 H new ATOM 0 HB3 GLU A 98 21.230 14.720 28.906 1.00 56.53 H new ATOM 0 HG2 GLU A 98 22.486 14.414 30.868 1.00 57.99 H new ATOM 0 HG3 GLU A 98 21.845 13.005 31.061 1.00 57.99 H new ATOM 703 N VAL A 99 18.010 14.950 28.737 1.00 59.86 N ATOM 704 CA VAL A 99 17.195 15.642 27.739 1.00 61.78 C ATOM 705 C VAL A 99 15.788 15.958 28.262 1.00 63.31 C ATOM 706 O VAL A 99 14.905 16.369 27.504 1.00 63.33 O ATOM 707 CB VAL A 99 17.148 14.859 26.398 1.00 61.64 C ATOM 708 CG1 VAL A 99 18.554 14.687 25.844 1.00 61.53 C ATOM 709 CG2 VAL A 99 16.467 13.500 26.567 1.00 61.47 C ATOM 0 H VAL A 99 17.815 14.118 28.836 1.00 59.86 H new ATOM 0 HA VAL A 99 17.626 16.493 27.562 1.00 61.78 H new ATOM 0 HB VAL A 99 16.621 15.374 25.767 1.00 61.64 H new ATOM 0 HG11 VAL A 99 18.515 14.197 25.007 1.00 61.53 H new ATOM 0 HG12 VAL A 99 18.950 15.559 25.690 1.00 61.53 H new ATOM 0 HG13 VAL A 99 19.095 14.195 26.481 1.00 61.53 H new ATOM 0 HG21 VAL A 99 16.453 13.037 25.715 1.00 61.47 H new ATOM 0 HG22 VAL A 99 16.958 12.970 27.215 1.00 61.47 H new ATOM 0 HG23 VAL A 99 15.558 13.630 26.879 1.00 61.47 H new ATOM 710 N GLU A 100 15.608 15.779 29.570 1.00 65.43 N ATOM 711 CA GLU A 100 14.334 16.026 30.249 1.00 67.49 C ATOM 712 C GLU A 100 13.848 17.487 30.198 1.00 68.72 C ATOM 713 O GLU A 100 12.659 17.717 29.968 1.00 68.75 O ATOM 714 CB GLU A 100 14.383 15.507 31.694 1.00 67.61 C ATOM 715 CG GLU A 100 13.028 15.404 32.397 1.00 68.89 C ATOM 716 CD GLU A 100 12.125 14.299 31.847 1.00 70.46 C ATOM 717 OE1 GLU A 100 12.548 13.535 30.947 1.00 70.86 O ATOM 718 OE2 GLU A 100 10.976 14.195 32.329 1.00 71.23 O ATOM 0 H GLU A 100 16.231 15.507 30.096 1.00 65.43 H new ATOM 0 HA GLU A 100 13.671 15.526 29.747 1.00 67.49 H new ATOM 0 HB2 GLU A 100 14.798 14.630 31.693 1.00 67.61 H new ATOM 0 HB3 GLU A 100 14.957 16.092 32.213 1.00 67.61 H new ATOM 0 HG2 GLU A 100 13.176 15.248 33.343 1.00 68.89 H new ATOM 0 HG3 GLU A 100 12.568 16.254 32.319 1.00 68.89 H new ATOM 719 N PRO A 101 14.751 18.475 30.409 1.00 70.11 N ATOM 720 CA PRO A 101 14.321 19.873 30.268 1.00 71.30 C ATOM 721 C PRO A 101 13.840 20.222 28.856 1.00 72.60 C ATOM 722 O PRO A 101 13.020 21.127 28.689 1.00 72.71 O ATOM 723 CB PRO A 101 15.591 20.668 30.598 1.00 71.23 C ATOM 724 CG PRO A 101 16.710 19.716 30.366 1.00 70.71 C ATOM 725 CD PRO A 101 16.172 18.392 30.793 1.00 70.17 C ATOM 0 HA PRO A 101 13.563 20.066 30.842 1.00 71.30 H new ATOM 0 HB2 PRO A 101 15.673 21.451 30.032 1.00 71.23 H new ATOM 0 HB3 PRO A 101 15.581 20.982 31.516 1.00 71.23 H new ATOM 0 HG2 PRO A 101 16.976 19.705 29.433 1.00 70.71 H new ATOM 0 HG3 PRO A 101 17.494 19.961 30.881 1.00 70.71 H new ATOM 0 HD2 PRO A 101 16.623 17.659 30.345 1.00 70.17 H new ATOM 0 HD3 PRO A 101 16.279 18.251 31.747 1.00 70.17 H new ATOM 726 N PHE A 102 14.348 19.503 27.857 1.00 74.09 N ATOM 727 CA PHE A 102 13.985 19.738 26.463 1.00 75.63 C ATOM 728 C PHE A 102 12.691 19.017 26.095 1.00 76.92 C ATOM 729 O PHE A 102 11.976 19.442 25.186 1.00 77.04 O ATOM 730 CB PHE A 102 15.135 19.336 25.532 1.00 75.37 C ATOM 731 CG PHE A 102 16.475 19.877 25.961 1.00 75.12 C ATOM 732 CD1 PHE A 102 16.785 21.225 25.790 1.00 74.73 C ATOM 733 CD2 PHE A 102 17.421 19.043 26.552 1.00 74.73 C ATOM 734 CE1 PHE A 102 18.017 21.730 26.196 1.00 74.50 C ATOM 735 CE2 PHE A 102 18.658 19.540 26.960 1.00 74.51 C ATOM 736 CZ PHE A 102 18.956 20.886 26.782 1.00 74.59 C ATOM 0 H PHE A 102 14.913 18.865 27.970 1.00 74.09 H new ATOM 0 HA PHE A 102 13.825 20.688 26.350 1.00 75.63 H new ATOM 0 HB2 PHE A 102 15.184 18.368 25.490 1.00 75.37 H new ATOM 0 HB3 PHE A 102 14.940 19.650 24.635 1.00 75.37 H new ATOM 0 HD1 PHE A 102 16.161 21.794 25.400 1.00 74.73 H new ATOM 0 HD2 PHE A 102 17.225 18.142 26.676 1.00 74.73 H new ATOM 0 HE1 PHE A 102 18.213 22.631 26.076 1.00 74.50 H new ATOM 0 HE2 PHE A 102 19.283 18.972 27.350 1.00 74.51 H new ATOM 0 HZ PHE A 102 19.780 21.221 27.053 1.00 74.59 H new ATOM 737 N ARG A 103 12.400 17.932 26.813 1.00 78.66 N ATOM 738 CA ARG A 103 11.144 17.193 26.668 1.00 80.39 C ATOM 739 C ARG A 103 9.970 18.007 27.212 1.00 81.77 C ATOM 740 O ARG A 103 8.914 18.088 26.579 1.00 81.86 O ATOM 741 CB ARG A 103 11.228 15.853 27.404 1.00 80.23 C ATOM 742 CG ARG A 103 10.042 14.932 27.170 1.00 80.11 C ATOM 743 CD ARG A 103 9.910 13.913 28.286 1.00 79.85 C ATOM 744 NE ARG A 103 9.272 12.683 27.822 1.00 79.78 N ATOM 745 CZ ARG A 103 8.894 11.679 28.610 1.00 79.73 C ATOM 746 NH1 ARG A 103 9.074 11.747 29.924 1.00 79.78 N ATOM 747 NH2 ARG A 103 8.327 10.603 28.083 1.00 79.59 N ATOM 0 H ARG A 103 12.931 17.601 27.403 1.00 78.66 H new ATOM 0 HA ARG A 103 10.998 17.029 25.723 1.00 80.39 H new ATOM 0 HB2 ARG A 103 12.038 15.396 27.129 1.00 80.23 H new ATOM 0 HB3 ARG A 103 11.308 16.024 28.356 1.00 80.23 H new ATOM 0 HG2 ARG A 103 9.229 15.457 27.110 1.00 80.11 H new ATOM 0 HG3 ARG A 103 10.147 14.474 26.321 1.00 80.11 H new ATOM 0 HD2 ARG A 103 10.788 13.708 28.643 1.00 79.85 H new ATOM 0 HD3 ARG A 103 9.391 14.293 29.012 1.00 79.85 H new ATOM 0 HE ARG A 103 9.130 12.602 26.978 1.00 79.78 H new ATOM 0 HH11 ARG A 103 9.438 12.444 30.273 1.00 79.78 H new ATOM 0 HH12 ARG A 103 8.827 11.094 30.426 1.00 79.78 H new ATOM 0 HH21 ARG A 103 8.204 10.554 27.233 1.00 79.59 H new ATOM 0 HH22 ARG A 103 8.082 9.954 28.591 1.00 79.59 H new ATOM 748 N GLU A 104 10.172 18.597 28.390 1.00 83.55 N ATOM 749 CA GLU A 104 9.170 19.432 29.052 1.00 85.35 C ATOM 750 C GLU A 104 8.864 20.691 28.239 1.00 86.31 C ATOM 751 O GLU A 104 7.713 21.124 28.168 1.00 86.45 O ATOM 752 CB GLU A 104 9.637 19.813 30.461 1.00 85.29 C ATOM 753 CG GLU A 104 9.802 18.631 31.421 1.00 85.84 C ATOM 754 CD GLU A 104 10.498 19.005 32.726 1.00 85.97 C ATOM 755 OE1 GLU A 104 11.117 20.091 32.802 1.00 86.80 O ATOM 756 OE2 GLU A 104 10.430 18.202 33.682 1.00 86.81 O ATOM 0 H GLU A 104 10.905 18.522 28.833 1.00 83.55 H new ATOM 0 HA GLU A 104 8.353 18.914 29.119 1.00 85.35 H new ATOM 0 HB2 GLU A 104 10.485 20.279 30.393 1.00 85.29 H new ATOM 0 HB3 GLU A 104 9.000 20.437 30.842 1.00 85.29 H new ATOM 0 HG2 GLU A 104 8.928 18.262 31.622 1.00 85.84 H new ATOM 0 HG3 GLU A 104 10.310 17.933 30.980 1.00 85.84 H new ATOM 757 N ALA A 105 9.899 21.261 27.625 1.00 87.66 N ATOM 758 CA ALA A 105 9.762 22.449 26.780 1.00 88.95 C ATOM 759 C ALA A 105 9.057 22.147 25.456 1.00 89.87 C ATOM 760 O ALA A 105 8.362 23.007 24.909 1.00 90.02 O ATOM 761 CB ALA A 105 11.126 23.080 26.526 1.00 88.90 C ATOM 0 H ALA A 105 10.705 20.969 27.687 1.00 87.66 H new ATOM 0 HA ALA A 105 9.203 23.079 27.262 1.00 88.95 H new ATOM 0 HB1 ALA A 105 11.020 23.865 25.966 1.00 88.90 H new ATOM 0 HB2 ALA A 105 11.526 23.338 27.371 1.00 88.90 H new ATOM 0 HB3 ALA A 105 11.701 22.439 26.079 1.00 88.90 H new ATOM 762 N ALA A 106 9.240 20.927 24.951 1.00 91.00 N ATOM 763 CA ALA A 106 8.635 20.497 23.689 1.00 92.02 C ATOM 764 C ALA A 106 7.134 20.240 23.816 1.00 92.73 C ATOM 765 O ALA A 106 6.386 20.423 22.855 1.00 92.88 O ATOM 766 CB ALA A 106 9.341 19.259 23.154 1.00 92.02 C ATOM 0 H ALA A 106 9.720 20.323 25.332 1.00 91.00 H new ATOM 0 HA ALA A 106 8.747 21.226 23.059 1.00 92.02 H new ATOM 0 HB1 ALA A 106 8.929 18.987 22.319 1.00 92.02 H new ATOM 0 HB2 ALA A 106 10.277 19.461 23.002 1.00 92.02 H new ATOM 0 HB3 ALA A 106 9.267 18.539 23.800 1.00 92.02 H new ATOM 767 N GLU A 107 6.703 19.819 25.003 1.00 93.55 N ATOM 768 CA GLU A 107 5.305 19.458 25.240 1.00 94.29 C ATOM 769 C GLU A 107 4.590 20.477 26.129 1.00 94.42 C ATOM 770 O GLU A 107 3.789 21.277 25.646 1.00 94.55 O ATOM 771 CB GLU A 107 5.202 18.048 25.834 1.00 94.47 C ATOM 772 CG GLU A 107 5.960 16.987 25.041 1.00 95.47 C ATOM 773 CD GLU A 107 5.482 15.576 25.325 1.00 96.61 C ATOM 774 OE1 GLU A 107 5.156 14.860 24.354 1.00 97.08 O ATOM 775 OE2 GLU A 107 5.428 15.181 26.510 1.00 97.11 O ATOM 0 H GLU A 107 7.210 19.734 25.692 1.00 93.55 H new ATOM 0 HA GLU A 107 4.856 19.465 24.380 1.00 94.29 H new ATOM 0 HB2 GLU A 107 5.541 18.064 26.743 1.00 94.47 H new ATOM 0 HB3 GLU A 107 4.267 17.795 25.884 1.00 94.47 H new ATOM 0 HG2 GLU A 107 5.865 17.170 24.093 1.00 95.47 H new ATOM 0 HG3 GLU A 107 6.905 17.050 25.248 1.00 95.47 H new TER 776 GLU A 107 ATOM 777 N GLN B 4 13.562 -24.370 23.609 1.00 42.01 N ATOM 778 CA GLN B 4 14.081 -23.085 23.048 1.00 41.97 C ATOM 779 C GLN B 4 13.194 -22.583 21.909 1.00 41.15 C ATOM 780 O GLN B 4 13.021 -23.272 20.897 1.00 41.36 O ATOM 781 CB GLN B 4 15.524 -23.247 22.548 1.00 42.35 C ATOM 782 CG GLN B 4 16.566 -23.556 23.628 1.00 44.19 C ATOM 783 CD GLN B 4 16.895 -22.366 24.526 1.00 46.63 C ATOM 784 OE1 GLN B 4 16.655 -21.207 24.174 1.00 47.40 O ATOM 785 NE2 GLN B 4 17.455 -22.655 25.696 1.00 47.49 N ATOM 0 HA GLN B 4 14.069 -22.430 23.764 1.00 41.97 H new ATOM 0 HB2 GLN B 4 15.543 -23.959 21.889 1.00 42.35 H new ATOM 0 HB3 GLN B 4 15.785 -22.431 22.093 1.00 42.35 H new ATOM 0 HG2 GLN B 4 16.242 -24.286 24.179 1.00 44.19 H new ATOM 0 HG3 GLN B 4 17.381 -23.863 23.201 1.00 44.19 H new ATOM 0 HE21 GLN B 4 17.608 -23.474 25.909 1.00 47.49 H new ATOM 0 HE22 GLN B 4 17.664 -22.023 26.240 1.00 47.49 H new ATOM 786 N SER B 5 12.632 -21.388 22.083 1.00 39.84 N ATOM 787 CA SER B 5 11.846 -20.749 21.030 1.00 38.57 C ATOM 788 C SER B 5 12.759 -20.283 19.893 1.00 37.28 C ATOM 789 O SER B 5 13.964 -20.110 20.087 1.00 37.12 O ATOM 790 CB SER B 5 11.036 -19.578 21.589 1.00 38.84 C ATOM 791 OG SER B 5 11.885 -18.554 22.068 1.00 39.49 O ATOM 0 H SER B 5 12.695 -20.929 22.808 1.00 39.84 H new ATOM 0 HA SER B 5 11.222 -21.402 20.676 1.00 38.57 H new ATOM 0 HB2 SER B 5 10.455 -19.224 20.898 1.00 38.84 H new ATOM 0 HB3 SER B 5 10.464 -19.890 22.307 1.00 38.84 H new ATOM 0 HG SER B 5 11.420 -17.922 22.368 1.00 39.49 H new ATOM 792 N ALA B 6 12.176 -20.087 18.713 1.00 35.75 N ATOM 793 CA ALA B 6 12.922 -19.715 17.511 1.00 34.24 C ATOM 794 C ALA B 6 13.655 -18.386 17.651 1.00 33.17 C ATOM 795 O ALA B 6 13.302 -17.550 18.483 1.00 32.90 O ATOM 796 CB ALA B 6 11.994 -19.679 16.301 1.00 34.19 C ATOM 0 H ALA B 6 11.329 -20.167 18.586 1.00 35.75 H new ATOM 0 HA ALA B 6 13.600 -20.397 17.383 1.00 34.24 H new ATOM 0 HB1 ALA B 6 12.501 -19.431 15.512 1.00 34.19 H new ATOM 0 HB2 ALA B 6 11.599 -20.555 16.170 1.00 34.19 H new ATOM 0 HB3 ALA B 6 11.291 -19.027 16.451 1.00 34.19 H new ATOM 797 N VAL B 7 14.688 -18.207 16.836 1.00 31.90 N ATOM 798 CA VAL B 7 15.384 -16.931 16.748 1.00 30.76 C ATOM 799 C VAL B 7 15.357 -16.403 15.311 1.00 30.35 C ATOM 800 O VAL B 7 15.590 -17.151 14.356 1.00 30.27 O ATOM 801 CB VAL B 7 16.838 -17.005 17.321 1.00 30.82 C ATOM 802 CG1 VAL B 7 17.631 -18.170 16.721 1.00 30.17 C ATOM 803 CG2 VAL B 7 17.577 -15.673 17.154 1.00 30.07 C ATOM 0 H VAL B 7 15.004 -18.819 16.321 1.00 31.90 H new ATOM 0 HA VAL B 7 14.909 -16.297 17.308 1.00 30.76 H new ATOM 0 HB VAL B 7 16.760 -17.176 18.273 1.00 30.82 H new ATOM 0 HG11 VAL B 7 18.524 -18.183 17.099 1.00 30.17 H new ATOM 0 HG12 VAL B 7 17.182 -19.006 16.924 1.00 30.17 H new ATOM 0 HG13 VAL B 7 17.690 -18.060 15.759 1.00 30.17 H new ATOM 0 HG21 VAL B 7 18.473 -15.752 17.518 1.00 30.07 H new ATOM 0 HG22 VAL B 7 17.630 -15.448 16.212 1.00 30.07 H new ATOM 0 HG23 VAL B 7 17.097 -14.975 17.626 1.00 30.07 H new ATOM 804 N GLY B 8 15.041 -15.118 15.177 1.00 29.63 N ATOM 805 CA GLY B 8 15.079 -14.427 13.895 1.00 28.79 C ATOM 806 C GLY B 8 16.144 -13.347 13.957 1.00 28.45 C ATOM 807 O GLY B 8 16.285 -12.673 14.974 1.00 28.20 O ATOM 0 H GLY B 8 14.797 -14.620 15.834 1.00 29.63 H new ATOM 0 HA2 GLY B 8 15.276 -15.053 13.181 1.00 28.79 H new ATOM 0 HA3 GLY B 8 14.214 -14.035 13.698 1.00 28.79 H new ATOM 808 N SER B 9 16.900 -13.207 12.875 1.00 27.86 N ATOM 809 CA SER B 9 17.984 -12.240 12.794 1.00 27.69 C ATOM 810 C SER B 9 17.936 -11.544 11.442 1.00 27.32 C ATOM 811 O SER B 9 17.847 -12.193 10.399 1.00 27.50 O ATOM 812 CB SER B 9 19.338 -12.925 12.991 1.00 27.63 C ATOM 813 OG SER B 9 20.381 -11.967 13.119 1.00 27.80 O ATOM 0 H SER B 9 16.797 -13.675 12.161 1.00 27.86 H new ATOM 0 HA SER B 9 17.875 -11.584 13.500 1.00 27.69 H new ATOM 0 HB2 SER B 9 19.309 -13.484 13.783 1.00 27.63 H new ATOM 0 HB3 SER B 9 19.521 -13.509 12.238 1.00 27.63 H new ATOM 0 HG SER B 9 20.434 -11.715 13.919 1.00 27.80 H new ATOM 814 N ILE B 10 17.975 -10.220 11.469 1.00 26.90 N ATOM 815 CA ILE B 10 17.911 -9.424 10.251 1.00 26.64 C ATOM 816 C ILE B 10 18.959 -8.323 10.321 1.00 26.69 C ATOM 817 O ILE B 10 19.195 -7.739 11.384 1.00 26.48 O ATOM 818 CB ILE B 10 16.473 -8.860 10.003 1.00 26.70 C ATOM 819 CG1 ILE B 10 16.324 -8.340 8.566 1.00 26.80 C ATOM 820 CG2 ILE B 10 16.079 -7.810 11.061 1.00 26.46 C ATOM 821 CD1 ILE B 10 14.870 -8.169 8.123 1.00 26.50 C ATOM 0 H ILE B 10 18.039 -9.757 12.191 1.00 26.90 H new ATOM 0 HA ILE B 10 18.108 -9.990 9.488 1.00 26.64 H new ATOM 0 HB ILE B 10 15.844 -9.592 10.104 1.00 26.70 H new ATOM 0 HG12 ILE B 10 16.780 -7.487 8.490 1.00 26.80 H new ATOM 0 HG13 ILE B 10 16.768 -8.954 7.960 1.00 26.80 H new ATOM 0 HG21 ILE B 10 15.184 -7.484 10.876 1.00 26.46 H new ATOM 0 HG22 ILE B 10 16.099 -8.215 11.942 1.00 26.46 H new ATOM 0 HG23 ILE B 10 16.705 -7.070 11.031 1.00 26.46 H new ATOM 0 HD11 ILE B 10 14.846 -7.839 7.211 1.00 26.50 H new ATOM 0 HD12 ILE B 10 14.415 -9.024 8.169 1.00 26.50 H new ATOM 0 HD13 ILE B 10 14.426 -7.535 8.707 1.00 26.50 H new ATOM 822 N GLU B 11 19.611 -8.073 9.192 1.00 26.78 N ATOM 823 CA GLU B 11 20.668 -7.081 9.128 1.00 27.08 C ATOM 824 C GLU B 11 20.441 -6.140 7.953 1.00 27.12 C ATOM 825 O GLU B 11 20.119 -6.573 6.839 1.00 27.01 O ATOM 826 CB GLU B 11 22.043 -7.759 9.038 1.00 26.82 C ATOM 827 CG GLU B 11 23.224 -6.829 9.275 1.00 27.54 C ATOM 828 CD GLU B 11 24.531 -7.572 9.518 1.00 28.12 C ATOM 829 OE1 GLU B 11 24.615 -8.351 10.499 1.00 29.74 O ATOM 830 OE2 GLU B 11 25.486 -7.364 8.733 1.00 29.47 O ATOM 0 H GLU B 11 19.453 -8.472 8.447 1.00 26.78 H new ATOM 0 HA GLU B 11 20.650 -6.555 9.943 1.00 27.08 H new ATOM 0 HB2 GLU B 11 22.078 -8.479 9.687 1.00 26.82 H new ATOM 0 HB3 GLU B 11 22.135 -8.162 8.161 1.00 26.82 H new ATOM 0 HG2 GLU B 11 23.328 -6.245 8.507 1.00 27.54 H new ATOM 0 HG3 GLU B 11 23.034 -6.262 10.039 1.00 27.54 H new ATOM 831 N THR B 12 20.611 -4.849 8.214 1.00 27.12 N ATOM 832 CA THR B 12 20.446 -3.836 7.184 1.00 27.28 C ATOM 833 C THR B 12 21.579 -2.819 7.218 1.00 27.00 C ATOM 834 O THR B 12 22.356 -2.760 8.173 1.00 26.73 O ATOM 835 CB THR B 12 19.074 -3.115 7.305 1.00 27.55 C ATOM 836 OG1 THR B 12 18.883 -2.261 6.165 1.00 28.96 O ATOM 837 CG2 THR B 12 18.995 -2.283 8.579 1.00 27.25 C ATOM 0 H THR B 12 20.824 -4.539 8.987 1.00 27.12 H new ATOM 0 HA THR B 12 20.472 -4.295 6.330 1.00 27.28 H new ATOM 0 HB THR B 12 18.378 -3.790 7.340 1.00 27.55 H new ATOM 0 HG1 THR B 12 19.111 -2.670 5.467 1.00 28.96 H new ATOM 0 HG21 THR B 12 18.130 -1.846 8.627 1.00 27.25 H new ATOM 0 HG22 THR B 12 19.109 -2.860 9.350 1.00 27.25 H new ATOM 0 HG23 THR B 12 19.696 -1.612 8.572 1.00 27.25 H new ATOM 838 N ILE B 13 21.674 -2.024 6.161 1.00 26.95 N ATOM 839 CA ILE B 13 22.572 -0.881 6.170 1.00 26.81 C ATOM 840 C ILE B 13 21.837 0.351 6.730 1.00 26.19 C ATOM 841 O ILE B 13 20.776 0.729 6.244 1.00 26.02 O ATOM 842 CB ILE B 13 23.214 -0.643 4.771 1.00 27.23 C ATOM 843 CG1 ILE B 13 24.386 0.337 4.880 1.00 27.77 C ATOM 844 CG2 ILE B 13 22.155 -0.204 3.724 1.00 27.75 C ATOM 845 CD1 ILE B 13 25.405 0.202 3.765 1.00 30.11 C ATOM 0 H ILE B 13 21.229 -2.129 5.432 1.00 26.95 H new ATOM 0 HA ILE B 13 23.319 -1.063 6.761 1.00 26.81 H new ATOM 0 HB ILE B 13 23.574 -1.484 4.449 1.00 27.23 H new ATOM 0 HG12 ILE B 13 24.040 1.243 4.882 1.00 27.77 H new ATOM 0 HG13 ILE B 13 24.831 0.202 5.731 1.00 27.77 H new ATOM 0 HG21 ILE B 13 22.586 -0.064 2.866 1.00 27.75 H new ATOM 0 HG22 ILE B 13 21.480 -0.895 3.637 1.00 27.75 H new ATOM 0 HG23 ILE B 13 21.737 0.622 4.013 1.00 27.75 H new ATOM 0 HD11 ILE B 13 26.116 0.849 3.896 1.00 30.11 H new ATOM 0 HD12 ILE B 13 25.778 -0.693 3.774 1.00 30.11 H new ATOM 0 HD13 ILE B 13 24.974 0.364 2.911 1.00 30.11 H new ATOM 846 N GLY B 14 22.396 0.942 7.781 1.00 25.80 N ATOM 847 CA GLY B 14 21.804 2.118 8.421 1.00 25.09 C ATOM 848 C GLY B 14 20.916 1.785 9.608 1.00 24.54 C ATOM 849 O GLY B 14 20.229 0.760 9.624 1.00 24.37 O ATOM 0 H GLY B 14 23.128 0.675 8.145 1.00 25.80 H new ATOM 0 HA2 GLY B 14 22.515 2.709 8.715 1.00 25.09 H new ATOM 0 HA3 GLY B 14 21.283 2.606 7.764 1.00 25.09 H new ATOM 850 N PHE B 15 20.931 2.662 10.608 1.00 24.13 N ATOM 851 CA PHE B 15 20.094 2.492 11.796 1.00 23.71 C ATOM 852 C PHE B 15 18.589 2.710 11.552 1.00 23.49 C ATOM 853 O PHE B 15 17.781 1.961 12.102 1.00 23.61 O ATOM 854 CB PHE B 15 20.587 3.376 12.949 1.00 23.68 C ATOM 855 CG PHE B 15 19.815 3.196 14.231 1.00 23.54 C ATOM 856 CD1 PHE B 15 20.156 2.184 15.128 1.00 23.17 C ATOM 857 CD2 PHE B 15 18.745 4.038 14.539 1.00 23.36 C ATOM 858 CE1 PHE B 15 19.452 2.018 16.321 1.00 23.47 C ATOM 859 CE2 PHE B 15 18.027 3.881 15.732 1.00 23.42 C ATOM 860 CZ PHE B 15 18.384 2.871 16.624 1.00 23.61 C ATOM 0 H PHE B 15 21.422 3.368 10.619 1.00 24.13 H new ATOM 0 HA PHE B 15 20.188 1.558 12.041 1.00 23.71 H new ATOM 0 HB2 PHE B 15 21.523 3.183 13.116 1.00 23.68 H new ATOM 0 HB3 PHE B 15 20.533 4.306 12.678 1.00 23.68 H new ATOM 0 HD1 PHE B 15 20.862 1.612 14.928 1.00 23.17 H new ATOM 0 HD2 PHE B 15 18.506 4.712 13.945 1.00 23.36 H new ATOM 0 HE1 PHE B 15 19.692 1.342 16.914 1.00 23.47 H new ATOM 0 HE2 PHE B 15 17.316 4.448 15.928 1.00 23.42 H new ATOM 0 HZ PHE B 15 17.914 2.764 17.419 1.00 23.61 H new ATOM 861 N PRO B 16 18.203 3.745 10.768 1.00 23.27 N ATOM 862 CA PRO B 16 16.766 3.925 10.525 1.00 23.29 C ATOM 863 C PRO B 16 16.067 2.654 10.024 1.00 23.51 C ATOM 864 O PRO B 16 14.963 2.347 10.474 1.00 23.47 O ATOM 865 CB PRO B 16 16.729 5.035 9.475 1.00 23.22 C ATOM 866 CG PRO B 16 17.949 5.844 9.776 1.00 23.00 C ATOM 867 CD PRO B 16 18.990 4.811 10.116 1.00 23.16 C ATOM 0 HA PRO B 16 16.286 4.141 11.340 1.00 23.29 H new ATOM 0 HB2 PRO B 16 16.753 4.675 8.574 1.00 23.22 H new ATOM 0 HB3 PRO B 16 15.921 5.567 9.547 1.00 23.22 H new ATOM 0 HG2 PRO B 16 18.217 6.382 9.014 1.00 23.00 H new ATOM 0 HG3 PRO B 16 17.798 6.454 10.515 1.00 23.00 H new ATOM 0 HD2 PRO B 16 19.446 4.487 9.324 1.00 23.16 H new ATOM 0 HD3 PRO B 16 19.670 5.168 10.708 1.00 23.16 H new ATOM 868 N GLY B 17 16.721 1.910 9.132 1.00 23.72 N ATOM 869 CA GLY B 17 16.181 0.644 8.634 1.00 23.63 C ATOM 870 C GLY B 17 15.981 -0.412 9.709 1.00 23.76 C ATOM 871 O GLY B 17 15.016 -1.177 9.667 1.00 23.92 O ATOM 0 H GLY B 17 17.485 2.123 8.800 1.00 23.72 H new ATOM 0 HA2 GLY B 17 15.330 0.815 8.200 1.00 23.63 H new ATOM 0 HA3 GLY B 17 16.780 0.292 7.956 1.00 23.63 H new ATOM 872 N ILE B 18 16.884 -0.466 10.680 1.00 23.93 N ATOM 873 CA ILE B 18 16.742 -1.443 11.759 1.00 24.19 C ATOM 874 C ILE B 18 15.660 -1.028 12.759 1.00 24.21 C ATOM 875 O ILE B 18 14.978 -1.877 13.331 1.00 24.54 O ATOM 876 CB ILE B 18 18.099 -1.800 12.444 1.00 24.30 C ATOM 877 CG1 ILE B 18 18.095 -3.267 12.881 1.00 24.36 C ATOM 878 CG2 ILE B 18 18.417 -0.876 13.621 1.00 23.78 C ATOM 879 CD1 ILE B 18 18.173 -4.257 11.721 1.00 24.36 C ATOM 0 H ILE B 18 17.575 0.043 10.736 1.00 23.93 H new ATOM 0 HA ILE B 18 16.441 -2.268 11.348 1.00 24.19 H new ATOM 0 HB ILE B 18 18.803 -1.667 11.790 1.00 24.30 H new ATOM 0 HG12 ILE B 18 18.845 -3.420 13.477 1.00 24.36 H new ATOM 0 HG13 ILE B 18 17.288 -3.442 13.390 1.00 24.36 H new ATOM 0 HG21 ILE B 18 19.265 -1.133 14.015 1.00 23.78 H new ATOM 0 HG22 ILE B 18 18.471 0.040 13.308 1.00 23.78 H new ATOM 0 HG23 ILE B 18 17.716 -0.948 14.288 1.00 23.78 H new ATOM 0 HD11 ILE B 18 18.166 -5.163 12.068 1.00 24.36 H new ATOM 0 HD12 ILE B 18 17.411 -4.130 11.135 1.00 24.36 H new ATOM 0 HD13 ILE B 18 18.992 -4.108 11.223 1.00 24.36 H new ATOM 880 N LEU B 19 15.499 0.283 12.937 1.00 24.26 N ATOM 881 CA LEU B 19 14.411 0.845 13.732 1.00 24.13 C ATOM 882 C LEU B 19 13.055 0.513 13.104 1.00 24.22 C ATOM 883 O LEU B 19 12.132 0.075 13.796 1.00 24.47 O ATOM 884 CB LEU B 19 14.595 2.366 13.898 1.00 24.10 C ATOM 885 CG LEU B 19 13.452 3.190 14.513 1.00 24.23 C ATOM 886 CD1 LEU B 19 13.124 2.715 15.924 1.00 23.42 C ATOM 887 CD2 LEU B 19 13.775 4.686 14.503 1.00 23.61 C ATOM 0 H LEU B 19 16.023 0.874 12.597 1.00 24.26 H new ATOM 0 HA LEU B 19 14.433 0.444 14.615 1.00 24.13 H new ATOM 0 HB2 LEU B 19 15.385 2.508 14.443 1.00 24.10 H new ATOM 0 HB3 LEU B 19 14.785 2.736 13.022 1.00 24.10 H new ATOM 0 HG LEU B 19 12.666 3.052 13.961 1.00 24.23 H new ATOM 0 HD11 LEU B 19 12.401 3.251 16.286 1.00 23.42 H new ATOM 0 HD12 LEU B 19 12.853 1.784 15.897 1.00 23.42 H new ATOM 0 HD13 LEU B 19 13.908 2.807 16.487 1.00 23.42 H new ATOM 0 HD21 LEU B 19 13.038 5.179 14.896 1.00 23.61 H new ATOM 0 HD22 LEU B 19 14.582 4.847 15.017 1.00 23.61 H new ATOM 0 HD23 LEU B 19 13.911 4.982 13.589 1.00 23.61 H new ATOM 888 N ALA B 20 12.948 0.697 11.790 1.00 24.31 N ATOM 889 CA ALA B 20 11.724 0.369 11.056 1.00 24.38 C ATOM 890 C ALA B 20 11.388 -1.121 11.140 1.00 24.66 C ATOM 891 O ALA B 20 10.228 -1.492 11.340 1.00 24.98 O ATOM 892 CB ALA B 20 11.848 0.799 9.608 1.00 24.43 C ATOM 0 H ALA B 20 13.579 1.014 11.299 1.00 24.31 H new ATOM 0 HA ALA B 20 10.996 0.856 11.473 1.00 24.38 H new ATOM 0 HB1 ALA B 20 11.032 0.577 9.133 1.00 24.43 H new ATOM 0 HB2 ALA B 20 11.995 1.757 9.566 1.00 24.43 H new ATOM 0 HB3 ALA B 20 12.596 0.339 9.197 1.00 24.43 H new ATOM 893 N ALA B 21 12.402 -1.968 10.976 1.00 24.75 N ATOM 894 CA ALA B 21 12.227 -3.415 11.090 1.00 24.86 C ATOM 895 C ALA B 21 11.774 -3.789 12.504 1.00 25.12 C ATOM 896 O ALA B 21 10.822 -4.547 12.670 1.00 25.09 O ATOM 897 CB ALA B 21 13.518 -4.146 10.726 1.00 24.50 C ATOM 0 H ALA B 21 13.206 -1.722 10.797 1.00 24.75 H new ATOM 0 HA ALA B 21 11.538 -3.690 10.465 1.00 24.86 H new ATOM 0 HB1 ALA B 21 13.382 -5.103 10.808 1.00 24.50 H new ATOM 0 HB2 ALA B 21 13.765 -3.932 9.813 1.00 24.50 H new ATOM 0 HB3 ALA B 21 14.228 -3.868 11.326 1.00 24.50 H new ATOM 898 N ALA B 22 12.443 -3.230 13.516 1.00 25.46 N ATOM 899 CA ALA B 22 12.100 -3.498 14.916 1.00 25.70 C ATOM 900 C ALA B 22 10.615 -3.282 15.199 1.00 26.05 C ATOM 901 O ALA B 22 9.944 -4.167 15.730 1.00 26.02 O ATOM 902 CB ALA B 22 12.951 -2.647 15.857 1.00 25.38 C ATOM 0 H ALA B 22 13.103 -2.689 13.412 1.00 25.46 H new ATOM 0 HA ALA B 22 12.293 -4.435 15.079 1.00 25.70 H new ATOM 0 HB1 ALA B 22 12.708 -2.840 16.776 1.00 25.38 H new ATOM 0 HB2 ALA B 22 13.889 -2.853 15.721 1.00 25.38 H new ATOM 0 HB3 ALA B 22 12.797 -1.707 15.672 1.00 25.38 H new ATOM 903 N ASP B 23 10.112 -2.106 14.832 1.00 26.51 N ATOM 904 CA ASP B 23 8.739 -1.731 15.140 1.00 27.10 C ATOM 905 C ASP B 23 7.714 -2.570 14.387 1.00 27.28 C ATOM 906 O ASP B 23 6.669 -2.916 14.938 1.00 27.48 O ATOM 907 CB ASP B 23 8.502 -0.245 14.873 1.00 27.14 C ATOM 908 CG ASP B 23 7.199 0.246 15.465 1.00 27.77 C ATOM 909 OD1 ASP B 23 7.055 0.210 16.706 1.00 28.80 O ATOM 910 OD2 ASP B 23 6.312 0.669 14.693 1.00 28.83 O ATOM 0 H ASP B 23 10.555 -1.508 14.401 1.00 26.51 H new ATOM 0 HA ASP B 23 8.615 -1.907 16.086 1.00 27.10 H new ATOM 0 HB2 ASP B 23 9.237 0.269 15.243 1.00 27.14 H new ATOM 0 HB3 ASP B 23 8.499 -0.087 13.916 1.00 27.14 H new ATOM 911 N ALA B 24 8.011 -2.885 13.129 1.00 27.63 N ATOM 912 CA ALA B 24 7.120 -3.706 12.314 1.00 27.84 C ATOM 913 C ALA B 24 7.067 -5.144 12.827 1.00 28.12 C ATOM 914 O ALA B 24 5.995 -5.734 12.913 1.00 28.04 O ATOM 915 CB ALA B 24 7.547 -3.672 10.859 1.00 27.64 C ATOM 0 H ALA B 24 8.728 -2.632 12.727 1.00 27.63 H new ATOM 0 HA ALA B 24 6.227 -3.334 12.382 1.00 27.84 H new ATOM 0 HB1 ALA B 24 6.946 -4.221 10.332 1.00 27.64 H new ATOM 0 HB2 ALA B 24 7.518 -2.758 10.534 1.00 27.64 H new ATOM 0 HB3 ALA B 24 8.451 -4.014 10.779 1.00 27.64 H new ATOM 916 N MET B 25 8.225 -5.693 13.182 1.00 28.72 N ATOM 917 CA MET B 25 8.324 -7.079 13.641 1.00 29.56 C ATOM 918 C MET B 25 7.528 -7.349 14.919 1.00 29.61 C ATOM 919 O MET B 25 6.750 -8.304 14.973 1.00 29.76 O ATOM 920 CB MET B 25 9.787 -7.493 13.828 1.00 29.34 C ATOM 921 CG MET B 25 10.588 -7.534 12.538 1.00 29.63 C ATOM 922 SD MET B 25 12.350 -7.741 12.826 1.00 31.03 S ATOM 923 CE MET B 25 12.600 -9.384 12.153 1.00 31.44 C ATOM 0 H MET B 25 8.976 -5.274 13.164 1.00 28.72 H new ATOM 0 HA MET B 25 7.926 -7.622 12.943 1.00 29.56 H new ATOM 0 HB2 MET B 25 10.212 -6.874 14.442 1.00 29.34 H new ATOM 0 HB3 MET B 25 9.815 -8.369 14.243 1.00 29.34 H new ATOM 0 HG2 MET B 25 10.266 -8.263 11.984 1.00 29.63 H new ATOM 0 HG3 MET B 25 10.439 -6.714 12.042 1.00 29.63 H new ATOM 0 HE1 MET B 25 13.427 -9.753 12.500 1.00 31.44 H new ATOM 0 HE2 MET B 25 11.859 -9.955 12.409 1.00 31.44 H new ATOM 0 HE3 MET B 25 12.649 -9.334 11.186 1.00 31.44 H new ATOM 924 N VAL B 26 7.718 -6.510 15.935 1.00 29.86 N ATOM 925 CA VAL B 26 7.049 -6.695 17.230 1.00 30.32 C ATOM 926 C VAL B 26 5.532 -6.431 17.156 1.00 30.67 C ATOM 927 O VAL B 26 4.762 -6.976 17.949 1.00 30.90 O ATOM 928 CB VAL B 26 7.744 -5.876 18.367 1.00 30.30 C ATOM 929 CG1 VAL B 26 7.548 -4.375 18.173 1.00 30.01 C ATOM 930 CG2 VAL B 26 7.263 -6.321 19.746 1.00 30.12 C ATOM 0 H VAL B 26 8.233 -5.822 15.898 1.00 29.86 H new ATOM 0 HA VAL B 26 7.145 -7.632 17.461 1.00 30.32 H new ATOM 0 HB VAL B 26 8.696 -6.057 18.314 1.00 30.30 H new ATOM 0 HG11 VAL B 26 7.989 -3.895 18.892 1.00 30.01 H new ATOM 0 HG12 VAL B 26 7.930 -4.106 17.323 1.00 30.01 H new ATOM 0 HG13 VAL B 26 6.600 -4.169 18.181 1.00 30.01 H new ATOM 0 HG21 VAL B 26 7.710 -5.797 20.429 1.00 30.12 H new ATOM 0 HG22 VAL B 26 6.304 -6.189 19.813 1.00 30.12 H new ATOM 0 HG23 VAL B 26 7.469 -7.260 19.873 1.00 30.12 H new ATOM 931 N LYS B 27 5.111 -5.620 16.187 1.00 30.98 N ATOM 932 CA LYS B 27 3.688 -5.340 15.986 1.00 31.40 C ATOM 933 C LYS B 27 2.985 -6.415 15.159 1.00 31.71 C ATOM 934 O LYS B 27 1.804 -6.680 15.371 1.00 31.64 O ATOM 935 CB LYS B 27 3.484 -3.959 15.358 1.00 31.33 C ATOM 936 CG LYS B 27 3.607 -2.808 16.349 1.00 31.23 C ATOM 937 CD LYS B 27 3.664 -1.469 15.640 1.00 31.19 C ATOM 938 CE LYS B 27 3.662 -0.317 16.638 1.00 31.22 C ATOM 939 NZ LYS B 27 3.997 0.979 15.978 1.00 30.74 N ATOM 0 H LYS B 27 5.634 -5.221 15.633 1.00 30.98 H new ATOM 0 HA LYS B 27 3.279 -5.348 16.866 1.00 31.40 H new ATOM 0 HB2 LYS B 27 4.135 -3.836 14.650 1.00 31.33 H new ATOM 0 HB3 LYS B 27 2.607 -3.927 14.945 1.00 31.33 H new ATOM 0 HG2 LYS B 27 2.852 -2.821 16.958 1.00 31.23 H new ATOM 0 HG3 LYS B 27 4.406 -2.926 16.886 1.00 31.23 H new ATOM 0 HD2 LYS B 27 4.463 -1.424 15.092 1.00 31.19 H new ATOM 0 HD3 LYS B 27 2.905 -1.384 15.042 1.00 31.19 H new ATOM 0 HE2 LYS B 27 2.790 -0.252 17.057 1.00 31.22 H new ATOM 0 HE3 LYS B 27 4.303 -0.497 17.343 1.00 31.22 H new ATOM 0 HZ1 LYS B 27 4.202 1.584 16.598 1.00 30.74 H new ATOM 0 HZ2 LYS B 27 4.693 0.865 15.435 1.00 30.74 H new ATOM 0 HZ3 LYS B 27 3.297 1.262 15.507 1.00 30.74 H new ATOM 940 N ALA B 28 3.714 -7.034 14.231 1.00 32.09 N ATOM 941 CA ALA B 28 3.135 -8.028 13.318 1.00 32.43 C ATOM 942 C ALA B 28 3.042 -9.432 13.912 1.00 32.60 C ATOM 943 O ALA B 28 2.109 -10.171 13.609 1.00 32.86 O ATOM 944 CB ALA B 28 3.901 -8.059 12.005 1.00 32.36 C ATOM 0 H ALA B 28 4.554 -6.893 14.111 1.00 32.09 H new ATOM 0 HA ALA B 28 2.222 -7.741 13.158 1.00 32.43 H new ATOM 0 HB1 ALA B 28 3.506 -8.720 11.415 1.00 32.36 H new ATOM 0 HB2 ALA B 28 3.860 -7.185 11.585 1.00 32.36 H new ATOM 0 HB3 ALA B 28 4.827 -8.292 12.176 1.00 32.36 H new ATOM 945 N GLY B 29 4.015 -9.806 14.737 1.00 32.72 N ATOM 946 CA GLY B 29 4.003 -11.116 15.390 1.00 32.82 C ATOM 947 C GLY B 29 4.144 -11.002 16.898 1.00 32.85 C ATOM 948 O GLY B 29 4.665 -10.001 17.403 1.00 32.90 O ATOM 0 H GLY B 29 4.694 -9.316 14.934 1.00 32.72 H new ATOM 0 HA2 GLY B 29 3.175 -11.575 15.177 1.00 32.82 H new ATOM 0 HA3 GLY B 29 4.726 -11.658 15.038 1.00 32.82 H new ATOM 949 N ARG B 30 3.662 -11.999 17.639 1.00 32.74 N ATOM 950 CA ARG B 30 3.964 -12.024 19.071 1.00 32.88 C ATOM 951 C ARG B 30 5.383 -12.555 19.297 1.00 32.46 C ATOM 952 O ARG B 30 5.600 -13.735 19.598 1.00 32.49 O ATOM 953 CB ARG B 30 2.885 -12.715 19.931 1.00 32.86 C ATOM 954 CG ARG B 30 2.291 -14.011 19.412 1.00 33.85 C ATOM 955 CD ARG B 30 1.047 -14.388 20.234 1.00 33.78 C ATOM 956 NE ARG B 30 0.517 -15.714 19.907 1.00 35.88 N ATOM 957 CZ ARG B 30 -0.466 -16.321 20.579 1.00 37.54 C ATOM 958 NH1 ARG B 30 -1.036 -15.732 21.628 1.00 37.80 N ATOM 959 NH2 ARG B 30 -0.885 -17.525 20.205 1.00 37.31 N ATOM 0 H ARG B 30 3.177 -12.647 17.348 1.00 32.74 H new ATOM 0 HA ARG B 30 3.940 -11.109 19.393 1.00 32.88 H new ATOM 0 HB2 ARG B 30 3.268 -12.891 20.805 1.00 32.86 H new ATOM 0 HB3 ARG B 30 2.159 -12.085 20.061 1.00 32.86 H new ATOM 0 HG2 ARG B 30 2.052 -13.914 18.477 1.00 33.85 H new ATOM 0 HG3 ARG B 30 2.950 -14.721 19.465 1.00 33.85 H new ATOM 0 HD2 ARG B 30 1.270 -14.359 21.178 1.00 33.78 H new ATOM 0 HD3 ARG B 30 0.355 -13.724 20.085 1.00 33.78 H new ATOM 0 HE ARG B 30 0.862 -16.130 19.238 1.00 35.88 H new ATOM 0 HH11 ARG B 30 -0.772 -14.953 21.880 1.00 37.80 H new ATOM 0 HH12 ARG B 30 -1.668 -16.130 22.054 1.00 37.80 H new ATOM 0 HH21 ARG B 30 -0.524 -17.915 19.529 1.00 37.31 H new ATOM 0 HH22 ARG B 30 -1.518 -17.914 20.639 1.00 37.31 H new ATOM 960 N ILE B 31 6.341 -11.650 19.098 1.00 31.93 N ATOM 961 CA ILE B 31 7.766 -11.921 19.260 1.00 31.47 C ATOM 962 C ILE B 31 8.364 -10.963 20.289 1.00 31.07 C ATOM 963 O ILE B 31 7.739 -9.974 20.661 1.00 31.07 O ATOM 964 CB ILE B 31 8.545 -11.814 17.899 1.00 31.50 C ATOM 965 CG1 ILE B 31 8.416 -10.416 17.273 1.00 31.25 C ATOM 966 CG2 ILE B 31 8.068 -12.883 16.910 1.00 31.65 C ATOM 967 CD1 ILE B 31 9.478 -9.430 17.709 1.00 31.28 C ATOM 0 H ILE B 31 6.174 -10.841 18.859 1.00 31.93 H new ATOM 0 HA ILE B 31 7.859 -12.834 19.574 1.00 31.47 H new ATOM 0 HB ILE B 31 9.483 -11.965 18.096 1.00 31.50 H new ATOM 0 HG12 ILE B 31 8.449 -10.503 16.307 1.00 31.25 H new ATOM 0 HG13 ILE B 31 7.544 -10.054 17.496 1.00 31.25 H new ATOM 0 HG21 ILE B 31 8.561 -12.798 16.079 1.00 31.65 H new ATOM 0 HG22 ILE B 31 8.220 -13.764 17.287 1.00 31.65 H new ATOM 0 HG23 ILE B 31 7.121 -12.764 16.737 1.00 31.65 H new ATOM 0 HD11 ILE B 31 9.327 -8.577 17.272 1.00 31.28 H new ATOM 0 HD12 ILE B 31 9.435 -9.312 18.671 1.00 31.28 H new ATOM 0 HD13 ILE B 31 10.354 -9.768 17.464 1.00 31.28 H new ATOM 968 N THR B 32 9.581 -11.261 20.730 1.00 30.55 N ATOM 969 CA THR B 32 10.321 -10.398 21.637 1.00 29.87 C ATOM 970 C THR B 32 11.631 -9.976 20.980 1.00 29.18 C ATOM 971 O THR B 32 12.396 -10.821 20.508 1.00 28.98 O ATOM 972 CB THR B 32 10.595 -11.108 22.978 1.00 29.97 C ATOM 973 OG1 THR B 32 9.347 -11.500 23.563 1.00 31.01 O ATOM 974 CG2 THR B 32 11.320 -10.189 23.950 1.00 30.16 C ATOM 0 H THR B 32 10.003 -11.977 20.508 1.00 30.55 H new ATOM 0 HA THR B 32 9.786 -9.611 21.824 1.00 29.87 H new ATOM 0 HB THR B 32 11.154 -11.881 22.805 1.00 29.97 H new ATOM 0 HG1 THR B 32 9.274 -12.336 23.533 1.00 31.01 H new ATOM 0 HG21 THR B 32 11.479 -10.660 24.783 1.00 30.16 H new ATOM 0 HG22 THR B 32 12.168 -9.916 23.566 1.00 30.16 H new ATOM 0 HG23 THR B 32 10.776 -9.405 24.121 1.00 30.16 H new ATOM 975 N ILE B 33 11.867 -8.667 20.927 1.00 28.22 N ATOM 976 CA ILE B 33 13.154 -8.133 20.495 1.00 27.40 C ATOM 977 C ILE B 33 14.135 -8.325 21.648 1.00 26.90 C ATOM 978 O ILE B 33 13.916 -7.817 22.746 1.00 26.60 O ATOM 979 CB ILE B 33 13.060 -6.631 20.106 1.00 27.43 C ATOM 980 CG1 ILE B 33 12.032 -6.423 18.985 1.00 27.28 C ATOM 981 CG2 ILE B 33 14.433 -6.088 19.697 1.00 27.08 C ATOM 982 CD1 ILE B 33 11.561 -4.977 18.831 1.00 27.26 C ATOM 0 H ILE B 33 11.288 -8.067 21.139 1.00 28.22 H new ATOM 0 HA ILE B 33 13.451 -8.603 19.700 1.00 27.40 H new ATOM 0 HB ILE B 33 12.761 -6.135 20.884 1.00 27.43 H new ATOM 0 HG12 ILE B 33 12.419 -6.718 18.146 1.00 27.28 H new ATOM 0 HG13 ILE B 33 11.262 -6.987 19.157 1.00 27.28 H new ATOM 0 HG21 ILE B 33 14.353 -5.151 19.458 1.00 27.08 H new ATOM 0 HG22 ILE B 33 15.052 -6.181 20.438 1.00 27.08 H new ATOM 0 HG23 ILE B 33 14.765 -6.588 18.935 1.00 27.08 H new ATOM 0 HD11 ILE B 33 10.917 -4.922 18.108 1.00 27.26 H new ATOM 0 HD12 ILE B 33 11.146 -4.682 19.657 1.00 27.26 H new ATOM 0 HD13 ILE B 33 12.321 -4.409 18.630 1.00 27.26 H new ATOM 983 N VAL B 34 15.207 -9.074 21.407 1.00 26.28 N ATOM 984 CA VAL B 34 16.148 -9.396 22.490 1.00 25.94 C ATOM 985 C VAL B 34 17.415 -8.544 22.492 1.00 25.71 C ATOM 986 O VAL B 34 18.078 -8.412 23.523 1.00 25.77 O ATOM 987 CB VAL B 34 16.503 -10.904 22.542 1.00 25.88 C ATOM 988 CG1 VAL B 34 15.284 -11.712 22.961 1.00 26.00 C ATOM 989 CG2 VAL B 34 17.064 -11.403 21.203 1.00 25.76 C ATOM 0 H VAL B 34 15.410 -9.403 20.639 1.00 26.28 H new ATOM 0 HA VAL B 34 15.664 -9.170 23.300 1.00 25.94 H new ATOM 0 HB VAL B 34 17.201 -11.027 23.204 1.00 25.88 H new ATOM 0 HG11 VAL B 34 15.514 -12.654 22.991 1.00 26.00 H new ATOM 0 HG12 VAL B 34 14.990 -11.423 23.839 1.00 26.00 H new ATOM 0 HG13 VAL B 34 14.569 -11.575 22.320 1.00 26.00 H new ATOM 0 HG21 VAL B 34 17.274 -12.347 21.272 1.00 25.76 H new ATOM 0 HG22 VAL B 34 16.404 -11.269 20.505 1.00 25.76 H new ATOM 0 HG23 VAL B 34 17.869 -10.908 20.985 1.00 25.76 H new ATOM 990 N GLY B 35 17.740 -7.955 21.345 1.00 25.33 N ATOM 991 CA GLY B 35 18.902 -7.081 21.250 1.00 24.61 C ATOM 992 C GLY B 35 19.163 -6.616 19.835 1.00 24.31 C ATOM 993 O GLY B 35 18.483 -7.031 18.895 1.00 24.14 O ATOM 0 H GLY B 35 17.301 -8.049 20.612 1.00 25.33 H new ATOM 0 HA2 GLY B 35 18.770 -6.309 21.822 1.00 24.61 H new ATOM 0 HA3 GLY B 35 19.683 -7.550 21.583 1.00 24.61 H new ATOM 994 N TYR B 36 20.147 -5.735 19.693 1.00 23.87 N ATOM 995 CA TYR B 36 20.605 -5.293 18.392 1.00 23.53 C ATOM 996 C TYR B 36 22.118 -5.238 18.411 1.00 23.69 C ATOM 997 O TYR B 36 22.729 -5.150 19.482 1.00 23.57 O ATOM 998 CB TYR B 36 20.006 -3.926 18.023 1.00 23.42 C ATOM 999 CG TYR B 36 20.723 -2.725 18.608 1.00 22.96 C ATOM 1000 CD1 TYR B 36 21.492 -1.893 17.799 1.00 23.06 C ATOM 1001 CD2 TYR B 36 20.626 -2.417 19.968 1.00 22.75 C ATOM 1002 CE1 TYR B 36 22.159 -0.782 18.330 1.00 22.67 C ATOM 1003 CE2 TYR B 36 21.284 -1.314 20.505 1.00 22.43 C ATOM 1004 CZ TYR B 36 22.046 -0.504 19.680 1.00 22.65 C ATOM 1005 OH TYR B 36 22.693 0.593 20.202 1.00 23.46 O ATOM 0 H TYR B 36 20.566 -5.378 20.354 1.00 23.87 H new ATOM 0 HA TYR B 36 20.308 -5.920 17.714 1.00 23.53 H new ATOM 0 HB2 TYR B 36 20.001 -3.842 17.057 1.00 23.42 H new ATOM 0 HB3 TYR B 36 19.081 -3.905 18.314 1.00 23.42 H new ATOM 0 HD1 TYR B 36 21.564 -2.078 16.890 1.00 23.06 H new ATOM 0 HD2 TYR B 36 20.113 -2.958 20.524 1.00 22.75 H new ATOM 0 HE1 TYR B 36 22.673 -0.236 17.780 1.00 22.67 H new ATOM 0 HE2 TYR B 36 21.212 -1.122 21.412 1.00 22.43 H new ATOM 0 HH TYR B 36 22.596 0.605 21.036 1.00 23.46 H new ATOM 1006 N ILE B 37 22.723 -5.303 17.227 1.00 23.79 N ATOM 1007 CA ILE B 37 24.177 -5.253 17.111 1.00 23.99 C ATOM 1008 C ILE B 37 24.612 -4.124 16.191 1.00 24.42 C ATOM 1009 O ILE B 37 24.043 -3.925 15.120 1.00 24.55 O ATOM 1010 CB ILE B 37 24.760 -6.603 16.602 1.00 23.75 C ATOM 1011 CG1 ILE B 37 24.313 -7.750 17.510 1.00 23.45 C ATOM 1012 CG2 ILE B 37 26.288 -6.550 16.531 1.00 23.63 C ATOM 1013 CD1 ILE B 37 24.695 -9.119 17.005 1.00 24.15 C ATOM 0 H ILE B 37 22.308 -5.376 16.477 1.00 23.79 H new ATOM 0 HA ILE B 37 24.527 -5.087 18.000 1.00 23.99 H new ATOM 0 HB ILE B 37 24.421 -6.759 15.707 1.00 23.75 H new ATOM 0 HG12 ILE B 37 24.698 -7.622 18.391 1.00 23.45 H new ATOM 0 HG13 ILE B 37 23.349 -7.711 17.614 1.00 23.45 H new ATOM 0 HG21 ILE B 37 26.627 -7.401 16.212 1.00 23.63 H new ATOM 0 HG22 ILE B 37 26.560 -5.845 15.922 1.00 23.63 H new ATOM 0 HG23 ILE B 37 26.647 -6.370 17.414 1.00 23.63 H new ATOM 0 HD11 ILE B 37 24.381 -9.793 17.628 1.00 24.15 H new ATOM 0 HD12 ILE B 37 24.290 -9.268 16.136 1.00 24.15 H new ATOM 0 HD13 ILE B 37 25.660 -9.177 16.926 1.00 24.15 H new ATOM 1014 N ARG B 38 25.616 -3.379 16.637 1.00 25.23 N ATOM 1015 CA ARG B 38 26.332 -2.432 15.799 1.00 25.95 C ATOM 1016 C ARG B 38 27.429 -3.251 15.118 1.00 26.13 C ATOM 1017 O ARG B 38 28.459 -3.553 15.720 1.00 26.28 O ATOM 1018 CB ARG B 38 26.900 -1.304 16.669 1.00 26.02 C ATOM 1019 CG ARG B 38 27.729 -0.247 15.951 0.75 27.16 C ATOM 1020 CD ARG B 38 28.578 0.527 16.959 0.75 28.45 C ATOM 1021 NE ARG B 38 29.584 1.375 16.316 0.75 30.44 N ATOM 1022 CZ ARG B 38 30.821 0.991 15.999 0.75 30.43 C ATOM 1023 NH1 ARG B 38 31.236 -0.244 16.254 0.75 30.52 N ATOM 1024 NH2 ARG B 38 31.651 1.848 15.420 0.75 30.01 N ATOM 0 H ARG B 38 25.903 -3.411 17.447 1.00 25.23 H new ATOM 0 HA ARG B 38 25.768 -2.004 15.137 1.00 25.95 H new ATOM 0 HB2 ARG B 38 26.160 -0.860 17.113 1.00 26.02 H new ATOM 0 HB3 ARG B 38 27.449 -1.702 17.362 1.00 26.02 H new ATOM 0 HG2 ARG B 38 28.301 -0.668 15.291 0.75 27.16 H new ATOM 0 HG3 ARG B 38 27.145 0.363 15.473 0.75 27.16 H new ATOM 0 HD2 ARG B 38 27.999 1.078 17.508 0.75 28.45 H new ATOM 0 HD3 ARG B 38 29.020 -0.100 17.553 0.75 28.45 H new ATOM 0 HE ARG B 38 29.359 2.184 16.128 0.75 30.44 H new ATOM 0 HH11 ARG B 38 30.705 -0.807 16.628 0.75 30.52 H new ATOM 0 HH12 ARG B 38 32.036 -0.481 16.045 0.75 30.52 H new ATOM 0 HH21 ARG B 38 31.391 2.650 15.250 0.75 30.01 H new ATOM 0 HH22 ARG B 38 32.449 1.602 15.215 0.75 30.01 H new ATOM 1025 N ALA B 39 27.178 -3.639 13.870 1.00 26.38 N ATOM 1026 CA ALA B 39 27.998 -4.640 13.180 1.00 26.66 C ATOM 1027 C ALA B 39 29.247 -4.060 12.510 1.00 26.89 C ATOM 1028 O ALA B 39 30.158 -4.802 12.122 1.00 27.29 O ATOM 1029 CB ALA B 39 27.149 -5.403 12.164 1.00 26.64 C ATOM 0 H ALA B 39 26.529 -3.331 13.398 1.00 26.38 H new ATOM 0 HA ALA B 39 28.322 -5.248 13.863 1.00 26.66 H new ATOM 0 HB1 ALA B 39 27.699 -6.062 11.713 1.00 26.64 H new ATOM 0 HB2 ALA B 39 26.420 -5.850 12.622 1.00 26.64 H new ATOM 0 HB3 ALA B 39 26.789 -4.782 11.512 1.00 26.64 H new ATOM 1030 N GLY B 40 29.300 -2.739 12.392 1.00 26.78 N ATOM 1031 CA GLY B 40 30.387 -2.080 11.674 1.00 26.72 C ATOM 1032 C GLY B 40 29.966 -1.816 10.245 1.00 26.74 C ATOM 1033 O GLY B 40 29.061 -2.476 9.728 1.00 26.91 O ATOM 0 H GLY B 40 28.714 -2.203 12.722 1.00 26.78 H new ATOM 0 HA2 GLY B 40 30.617 -1.246 12.112 1.00 26.72 H new ATOM 0 HA3 GLY B 40 31.181 -2.637 11.689 1.00 26.72 H new ATOM 1034 N SER B 41 30.618 -0.848 9.609 1.00 26.78 N ATOM 1035 CA SER B 41 30.267 -0.407 8.249 1.00 26.87 C ATOM 1036 C SER B 41 28.823 0.093 8.119 1.00 26.60 C ATOM 1037 O SER B 41 28.185 -0.077 7.075 1.00 26.67 O ATOM 1038 CB SER B 41 30.569 -1.501 7.220 1.00 26.84 C ATOM 1039 OG SER B 41 31.967 -1.713 7.136 1.00 28.28 O ATOM 0 H SER B 41 31.282 -0.422 9.952 1.00 26.78 H new ATOM 0 HA SER B 41 30.831 0.360 8.062 1.00 26.87 H new ATOM 0 HB2 SER B 41 30.124 -2.325 7.472 1.00 26.84 H new ATOM 0 HB3 SER B 41 30.220 -1.244 6.352 1.00 26.84 H new ATOM 0 HG SER B 41 32.126 -2.315 6.572 1.00 28.28 H new ATOM 1040 N ALA B 42 28.327 0.712 9.192 1.00 26.23 N ATOM 1041 CA ALA B 42 26.971 1.268 9.257 1.00 25.62 C ATOM 1042 C ALA B 42 25.885 0.206 9.144 1.00 25.36 C ATOM 1043 O ALA B 42 24.719 0.517 8.904 1.00 25.35 O ATOM 1044 CB ALA B 42 26.776 2.368 8.215 1.00 25.74 C ATOM 0 H ALA B 42 28.777 0.823 9.916 1.00 26.23 H new ATOM 0 HA ALA B 42 26.879 1.661 10.139 1.00 25.62 H new ATOM 0 HB1 ALA B 42 25.874 2.718 8.279 1.00 25.74 H new ATOM 0 HB2 ALA B 42 27.412 3.083 8.376 1.00 25.74 H new ATOM 0 HB3 ALA B 42 26.919 2.003 7.328 1.00 25.74 H new ATOM 1045 N ARG B 43 26.270 -1.051 9.331 1.00 25.04 N ATOM 1046 CA ARG B 43 25.310 -2.140 9.348 1.00 24.57 C ATOM 1047 C ARG B 43 24.850 -2.449 10.772 1.00 24.23 C ATOM 1048 O ARG B 43 25.637 -2.390 11.722 1.00 23.83 O ATOM 1049 CB ARG B 43 25.870 -3.377 8.639 1.00 24.65 C ATOM 1050 CG ARG B 43 25.827 -3.234 7.115 1.00 24.88 C ATOM 1051 CD ARG B 43 26.624 -4.303 6.384 1.00 24.72 C ATOM 1052 NE ARG B 43 26.093 -5.650 6.604 1.00 24.81 N ATOM 1053 CZ ARG B 43 26.092 -6.620 5.689 1.00 24.60 C ATOM 1054 NH1 ARG B 43 26.576 -6.406 4.469 1.00 23.89 N ATOM 1055 NH2 ARG B 43 25.587 -7.804 5.991 1.00 24.15 N ATOM 0 H ARG B 43 27.087 -1.293 9.450 1.00 25.04 H new ATOM 0 HA ARG B 43 24.525 -1.859 8.853 1.00 24.57 H new ATOM 0 HB2 ARG B 43 26.786 -3.525 8.923 1.00 24.65 H new ATOM 0 HB3 ARG B 43 25.361 -4.159 8.904 1.00 24.65 H new ATOM 0 HG2 ARG B 43 24.904 -3.270 6.820 1.00 24.88 H new ATOM 0 HG3 ARG B 43 26.169 -2.360 6.869 1.00 24.88 H new ATOM 0 HD2 ARG B 43 26.622 -4.110 5.433 1.00 24.72 H new ATOM 0 HD3 ARG B 43 27.548 -4.271 6.678 1.00 24.72 H new ATOM 0 HE ARG B 43 25.759 -5.828 7.376 1.00 24.81 H new ATOM 0 HH11 ARG B 43 26.895 -5.635 4.262 1.00 23.89 H new ATOM 0 HH12 ARG B 43 26.570 -7.039 3.887 1.00 23.89 H new ATOM 0 HH21 ARG B 43 25.261 -7.945 6.774 1.00 24.15 H new ATOM 0 HH22 ARG B 43 25.584 -8.433 5.404 1.00 24.15 H new ATOM 1056 N PHE B 44 23.559 -2.747 10.901 1.00 23.90 N ATOM 1057 CA PHE B 44 22.940 -3.030 12.192 1.00 23.77 C ATOM 1058 C PHE B 44 22.152 -4.334 12.122 1.00 24.07 C ATOM 1059 O PHE B 44 21.454 -4.598 11.134 1.00 23.99 O ATOM 1060 CB PHE B 44 22.037 -1.868 12.628 1.00 23.21 C ATOM 1061 CG PHE B 44 22.793 -0.626 13.027 1.00 22.62 C ATOM 1062 CD1 PHE B 44 23.166 -0.418 14.356 1.00 22.05 C ATOM 1063 CD2 PHE B 44 23.140 0.335 12.074 1.00 21.38 C ATOM 1064 CE1 PHE B 44 23.864 0.724 14.734 1.00 21.53 C ATOM 1065 CE2 PHE B 44 23.848 1.484 12.437 1.00 21.47 C ATOM 1066 CZ PHE B 44 24.209 1.682 13.772 1.00 21.82 C ATOM 0 H PHE B 44 23.015 -2.791 10.237 1.00 23.90 H new ATOM 0 HA PHE B 44 23.640 -3.129 12.856 1.00 23.77 H new ATOM 0 HB2 PHE B 44 21.433 -1.649 11.902 1.00 23.21 H new ATOM 0 HB3 PHE B 44 21.490 -2.157 13.375 1.00 23.21 H new ATOM 0 HD1 PHE B 44 22.944 -1.053 14.998 1.00 22.05 H new ATOM 0 HD2 PHE B 44 22.896 0.208 11.185 1.00 21.38 H new ATOM 0 HE1 PHE B 44 24.101 0.851 15.624 1.00 21.53 H new ATOM 0 HE2 PHE B 44 24.078 2.114 11.793 1.00 21.47 H new ATOM 0 HZ PHE B 44 24.676 2.447 14.021 1.00 21.82 H new ATOM 1067 N THR B 45 22.285 -5.147 13.167 1.00 24.28 N ATOM 1068 CA THR B 45 21.586 -6.430 13.266 1.00 24.46 C ATOM 1069 C THR B 45 20.507 -6.329 14.331 1.00 24.73 C ATOM 1070 O THR B 45 20.725 -5.729 15.385 1.00 24.91 O ATOM 1071 CB THR B 45 22.554 -7.572 13.670 1.00 24.46 C ATOM 1072 OG1 THR B 45 23.747 -7.505 12.877 1.00 25.31 O ATOM 1073 CG2 THR B 45 21.910 -8.936 13.496 1.00 24.02 C ATOM 0 H THR B 45 22.786 -4.970 13.843 1.00 24.28 H new ATOM 0 HA THR B 45 21.205 -6.630 12.397 1.00 24.46 H new ATOM 0 HB THR B 45 22.773 -7.456 14.608 1.00 24.46 H new ATOM 0 HG1 THR B 45 23.626 -7.913 12.153 1.00 25.31 H new ATOM 0 HG21 THR B 45 22.539 -9.627 13.756 1.00 24.02 H new ATOM 0 HG22 THR B 45 21.118 -8.994 14.053 1.00 24.02 H new ATOM 0 HG23 THR B 45 21.660 -9.060 12.567 1.00 24.02 H new ATOM 1074 N LEU B 46 19.344 -6.906 14.051 1.00 24.81 N ATOM 1075 CA LEU B 46 18.305 -7.049 15.056 1.00 25.33 C ATOM 1076 C LEU B 46 18.024 -8.524 15.285 1.00 25.60 C ATOM 1077 O LEU B 46 17.873 -9.286 14.331 1.00 25.67 O ATOM 1078 CB LEU B 46 17.013 -6.336 14.635 1.00 25.13 C ATOM 1079 CG LEU B 46 16.016 -6.141 15.776 1.00 24.93 C ATOM 1080 CD1 LEU B 46 16.379 -4.917 16.642 1.00 22.97 C ATOM 1081 CD2 LEU B 46 14.610 -6.027 15.238 1.00 24.84 C ATOM 0 H LEU B 46 19.138 -7.223 13.278 1.00 24.81 H new ATOM 0 HA LEU B 46 18.619 -6.638 15.877 1.00 25.33 H new ATOM 0 HB2 LEU B 46 17.239 -5.469 14.262 1.00 25.13 H new ATOM 0 HB3 LEU B 46 16.587 -6.847 13.929 1.00 25.13 H new ATOM 0 HG LEU B 46 16.062 -6.923 16.348 1.00 24.93 H new ATOM 0 HD11 LEU B 46 15.729 -4.821 17.355 1.00 22.97 H new ATOM 0 HD12 LEU B 46 17.262 -5.041 17.024 1.00 22.97 H new ATOM 0 HD13 LEU B 46 16.375 -4.118 16.092 1.00 22.97 H new ATOM 0 HD21 LEU B 46 13.991 -5.904 15.974 1.00 24.84 H new ATOM 0 HD22 LEU B 46 14.554 -5.267 14.638 1.00 24.84 H new ATOM 0 HD23 LEU B 46 14.381 -6.837 14.756 1.00 24.84 H new ATOM 1082 N ASN B 47 17.944 -8.912 16.553 1.00 26.13 N ATOM 1083 CA ASN B 47 17.666 -10.294 16.933 1.00 26.60 C ATOM 1084 C ASN B 47 16.355 -10.409 17.698 1.00 26.95 C ATOM 1085 O ASN B 47 16.110 -9.652 18.635 1.00 26.64 O ATOM 1086 CB ASN B 47 18.818 -10.862 17.764 1.00 26.41 C ATOM 1087 CG ASN B 47 20.137 -10.841 17.019 1.00 26.96 C ATOM 1088 OD1 ASN B 47 20.166 -11.463 15.850 1.00 28.52 O flip ATOM 1089 ND2 ASN B 47 21.120 -10.258 17.486 1.00 26.36 N flip ATOM 0 H ASN B 47 18.050 -8.380 17.220 1.00 26.13 H new ATOM 0 HA ASN B 47 17.581 -10.813 16.118 1.00 26.60 H new ATOM 0 HB2 ASN B 47 18.905 -10.350 18.583 1.00 26.41 H new ATOM 0 HB3 ASN B 47 18.609 -11.774 18.020 1.00 26.41 H new ATOM 0 HD21 ASN B 47 21.064 -9.865 18.249 1.00 26.36 H new ATOM 0 HD22 ASN B 47 21.860 -10.245 17.049 1.00 26.36 H new ATOM 1090 N ILE B 48 15.516 -11.354 17.278 1.00 27.54 N ATOM 1091 CA ILE B 48 14.203 -11.569 17.887 1.00 28.02 C ATOM 1092 C ILE B 48 13.976 -13.029 18.289 1.00 28.61 C ATOM 1093 O ILE B 48 14.599 -13.942 17.744 1.00 28.81 O ATOM 1094 CB ILE B 48 13.037 -11.078 16.966 1.00 28.04 C ATOM 1095 CG1 ILE B 48 12.924 -11.935 15.701 1.00 27.85 C ATOM 1096 CG2 ILE B 48 13.196 -9.579 16.626 1.00 28.07 C ATOM 1097 CD1 ILE B 48 11.620 -11.750 14.937 1.00 28.11 C ATOM 0 H ILE B 48 15.692 -11.891 16.630 1.00 27.54 H new ATOM 0 HA ILE B 48 14.199 -11.032 18.695 1.00 28.02 H new ATOM 0 HB ILE B 48 12.207 -11.182 17.456 1.00 28.04 H new ATOM 0 HG12 ILE B 48 13.665 -11.724 15.112 1.00 27.85 H new ATOM 0 HG13 ILE B 48 13.014 -12.869 15.946 1.00 27.85 H new ATOM 0 HG21 ILE B 48 12.464 -9.297 16.056 1.00 28.07 H new ATOM 0 HG22 ILE B 48 13.187 -9.059 17.445 1.00 28.07 H new ATOM 0 HG23 ILE B 48 14.037 -9.439 16.164 1.00 28.07 H new ATOM 0 HD11 ILE B 48 11.620 -12.321 14.153 1.00 28.11 H new ATOM 0 HD12 ILE B 48 10.873 -11.987 15.509 1.00 28.11 H new ATOM 0 HD13 ILE B 48 11.535 -10.824 14.662 1.00 28.11 H new ATOM 1098 N ARG B 49 13.090 -13.239 19.255 1.00 29.19 N ATOM 1099 CA ARG B 49 12.734 -14.582 19.699 1.00 29.86 C ATOM 1100 C ARG B 49 11.216 -14.763 19.747 1.00 30.69 C ATOM 1101 O ARG B 49 10.469 -13.793 19.899 1.00 30.52 O ATOM 1102 CB ARG B 49 13.353 -14.891 21.068 1.00 29.47 C ATOM 1103 CG ARG B 49 14.885 -14.809 21.143 1.00 28.75 C ATOM 1104 CD ARG B 49 15.602 -15.946 20.410 1.00 27.90 C ATOM 1105 NE ARG B 49 15.266 -17.278 20.922 1.00 27.45 N ATOM 1106 CZ ARG B 49 15.790 -17.824 22.017 1.00 26.85 C ATOM 1107 NH1 ARG B 49 16.676 -17.155 22.741 1.00 26.39 N ATOM 1108 NH2 ARG B 49 15.416 -19.040 22.397 1.00 26.63 N ATOM 0 H ARG B 49 12.679 -12.609 19.671 1.00 29.19 H new ATOM 0 HA ARG B 49 13.094 -15.209 19.052 1.00 29.86 H new ATOM 0 HB2 ARG B 49 12.981 -14.275 21.719 1.00 29.47 H new ATOM 0 HB3 ARG B 49 13.080 -15.783 21.333 1.00 29.47 H new ATOM 0 HG2 ARG B 49 15.174 -13.962 20.769 1.00 28.75 H new ATOM 0 HG3 ARG B 49 15.155 -14.815 22.075 1.00 28.75 H new ATOM 0 HD2 ARG B 49 15.379 -15.904 19.467 1.00 27.90 H new ATOM 0 HD3 ARG B 49 16.560 -15.813 20.481 1.00 27.90 H new ATOM 0 HE ARG B 49 14.689 -17.740 20.483 1.00 27.45 H new ATOM 0 HH11 ARG B 49 16.915 -16.364 22.504 1.00 26.39 H new ATOM 0 HH12 ARG B 49 17.012 -17.512 23.448 1.00 26.39 H new ATOM 0 HH21 ARG B 49 14.835 -19.475 21.936 1.00 26.63 H new ATOM 0 HH22 ARG B 49 15.755 -19.393 23.105 1.00 26.63 H new ATOM 1109 N GLY B 50 10.771 -16.010 19.614 1.00 31.70 N ATOM 1110 CA GLY B 50 9.350 -16.346 19.664 1.00 33.17 C ATOM 1111 C GLY B 50 9.072 -17.670 18.982 1.00 34.38 C ATOM 1112 O GLY B 50 10.003 -18.345 18.531 1.00 34.23 O ATOM 0 H GLY B 50 11.286 -16.687 19.492 1.00 31.70 H new ATOM 0 HA2 GLY B 50 9.058 -16.388 20.588 1.00 33.17 H new ATOM 0 HA3 GLY B 50 8.835 -15.645 19.236 1.00 33.17 H new ATOM 1113 N ASP B 51 7.793 -18.049 18.919 1.00 35.49 N ATOM 1114 CA ASP B 51 7.366 -19.239 18.178 1.00 36.83 C ATOM 1115 C ASP B 51 7.786 -19.108 16.713 1.00 36.99 C ATOM 1116 O ASP B 51 7.756 -18.011 16.150 1.00 36.93 O ATOM 1117 CB ASP B 51 5.848 -19.423 18.288 1.00 37.31 C ATOM 1118 CG ASP B 51 5.329 -20.565 17.431 1.00 39.38 C ATOM 1119 OD1 ASP B 51 5.312 -21.725 17.908 1.00 41.92 O ATOM 1120 OD2 ASP B 51 4.924 -20.300 16.277 1.00 41.55 O ATOM 0 H ASP B 51 7.151 -17.625 19.303 1.00 35.49 H new ATOM 0 HA ASP B 51 7.793 -20.021 18.561 1.00 36.83 H new ATOM 0 HB2 ASP B 51 5.613 -19.587 19.215 1.00 37.31 H new ATOM 0 HB3 ASP B 51 5.407 -18.600 18.025 1.00 37.31 H new ATOM 1121 N VAL B 52 8.170 -20.230 16.106 1.00 37.39 N ATOM 1122 CA VAL B 52 8.680 -20.248 14.730 1.00 37.68 C ATOM 1123 C VAL B 52 7.768 -19.529 13.719 1.00 37.60 C ATOM 1124 O VAL B 52 8.251 -18.794 12.861 1.00 37.52 O ATOM 1125 CB VAL B 52 9.068 -21.686 14.268 1.00 37.81 C ATOM 1126 CG1 VAL B 52 7.841 -22.589 14.132 1.00 38.32 C ATOM 1127 CG2 VAL B 52 9.866 -21.642 12.968 1.00 38.33 C ATOM 0 H VAL B 52 8.143 -21.004 16.479 1.00 37.39 H new ATOM 0 HA VAL B 52 9.497 -19.725 14.748 1.00 37.68 H new ATOM 0 HB VAL B 52 9.632 -22.071 14.957 1.00 37.81 H new ATOM 0 HG11 VAL B 52 8.119 -23.472 13.844 1.00 38.32 H new ATOM 0 HG12 VAL B 52 7.391 -22.656 14.989 1.00 38.32 H new ATOM 0 HG13 VAL B 52 7.233 -22.212 13.477 1.00 38.32 H new ATOM 0 HG21 VAL B 52 10.097 -22.545 12.699 1.00 38.33 H new ATOM 0 HG22 VAL B 52 9.332 -21.225 12.274 1.00 38.33 H new ATOM 0 HG23 VAL B 52 10.678 -21.128 13.103 1.00 38.33 H new ATOM 1128 N GLN B 53 6.458 -19.727 13.846 1.00 37.63 N ATOM 1129 CA GLN B 53 5.486 -19.117 12.937 1.00 37.78 C ATOM 1130 C GLN B 53 5.341 -17.616 13.176 1.00 36.91 C ATOM 1131 O GLN B 53 5.123 -16.851 12.235 1.00 36.71 O ATOM 1132 CB GLN B 53 4.120 -19.809 13.046 1.00 38.25 C ATOM 1133 CG GLN B 53 4.137 -21.313 12.753 1.00 40.98 C ATOM 1134 CD GLN B 53 4.131 -21.645 11.263 1.00 44.27 C ATOM 1135 OE1 GLN B 53 5.091 -21.370 10.544 1.00 45.39 O ATOM 1136 NE2 GLN B 53 3.045 -22.259 10.802 1.00 45.73 N ATOM 0 H GLN B 53 6.107 -20.217 14.459 1.00 37.63 H new ATOM 0 HA GLN B 53 5.826 -19.240 12.037 1.00 37.78 H new ATOM 0 HB2 GLN B 53 3.772 -19.670 13.941 1.00 38.25 H new ATOM 0 HB3 GLN B 53 3.504 -19.380 12.432 1.00 38.25 H new ATOM 0 HG2 GLN B 53 4.925 -21.706 13.161 1.00 40.98 H new ATOM 0 HG3 GLN B 53 3.365 -21.725 13.172 1.00 40.98 H new ATOM 0 HE21 GLN B 53 2.393 -22.436 11.334 1.00 45.73 H new ATOM 0 HE22 GLN B 53 2.995 -22.479 9.972 1.00 45.73 H new ATOM 1137 N GLU B 54 5.457 -17.206 14.437 1.00 36.09 N ATOM 1138 CA GLU B 54 5.404 -15.790 14.802 1.00 35.43 C ATOM 1139 C GLU B 54 6.646 -15.045 14.321 1.00 34.74 C ATOM 1140 O GLU B 54 6.552 -13.912 13.849 1.00 34.59 O ATOM 1141 CB GLU B 54 5.225 -15.616 16.316 1.00 35.49 C ATOM 1142 CG GLU B 54 3.895 -16.140 16.863 1.00 36.30 C ATOM 1143 CD GLU B 54 2.672 -15.435 16.279 1.00 36.88 C ATOM 1144 OE1 GLU B 54 2.743 -14.224 15.976 1.00 36.64 O ATOM 1145 OE2 GLU B 54 1.627 -16.099 16.134 1.00 38.16 O ATOM 0 H GLU B 54 5.568 -17.738 15.104 1.00 36.09 H new ATOM 0 HA GLU B 54 4.632 -15.405 14.358 1.00 35.43 H new ATOM 0 HB2 GLU B 54 5.951 -16.072 16.770 1.00 35.49 H new ATOM 0 HB3 GLU B 54 5.302 -14.674 16.533 1.00 35.49 H new ATOM 0 HG2 GLU B 54 3.830 -17.090 16.678 1.00 36.30 H new ATOM 0 HG3 GLU B 54 3.888 -16.037 17.828 1.00 36.30 H new ATOM 1146 N VAL B 55 7.801 -15.696 14.438 1.00 33.96 N ATOM 1147 CA VAL B 55 9.068 -15.166 13.922 1.00 33.24 C ATOM 1148 C VAL B 55 9.020 -15.025 12.394 1.00 32.94 C ATOM 1149 O VAL B 55 9.530 -14.049 11.844 1.00 32.79 O ATOM 1150 CB VAL B 55 10.273 -16.038 14.378 1.00 33.17 C ATOM 1151 CG1 VAL B 55 11.583 -15.576 13.735 1.00 32.67 C ATOM 1152 CG2 VAL B 55 10.393 -16.027 15.902 1.00 32.90 C ATOM 0 H VAL B 55 7.875 -16.463 14.821 1.00 33.96 H new ATOM 0 HA VAL B 55 9.196 -14.280 14.296 1.00 33.24 H new ATOM 0 HB VAL B 55 10.106 -16.946 14.082 1.00 33.17 H new ATOM 0 HG11 VAL B 55 12.310 -16.140 14.041 1.00 32.67 H new ATOM 0 HG12 VAL B 55 11.510 -15.639 12.770 1.00 32.67 H new ATOM 0 HG13 VAL B 55 11.760 -14.656 13.986 1.00 32.67 H new ATOM 0 HG21 VAL B 55 11.147 -16.574 16.171 1.00 32.90 H new ATOM 0 HG22 VAL B 55 10.528 -15.117 16.210 1.00 32.90 H new ATOM 0 HG23 VAL B 55 9.580 -16.383 16.293 1.00 32.90 H new ATOM 1153 N LYS B 56 8.387 -15.989 11.724 1.00 32.63 N ATOM 1154 CA LYS B 56 8.218 -15.949 10.266 1.00 32.50 C ATOM 1155 C LYS B 56 7.362 -14.761 9.825 1.00 31.98 C ATOM 1156 O LYS B 56 7.713 -14.058 8.874 1.00 31.86 O ATOM 1157 CB LYS B 56 7.611 -17.254 9.744 1.00 32.59 C ATOM 1158 CG LYS B 56 8.594 -18.397 9.589 1.00 33.91 C ATOM 1159 CD LYS B 56 7.897 -19.625 9.008 1.00 36.78 C ATOM 1160 CE LYS B 56 8.867 -20.781 8.819 1.00 38.73 C ATOM 1161 NZ LYS B 56 8.190 -21.984 8.248 1.00 40.46 N ATOM 0 H LYS B 56 8.044 -16.683 12.099 1.00 32.63 H new ATOM 0 HA LYS B 56 9.103 -15.841 9.883 1.00 32.50 H new ATOM 0 HB2 LYS B 56 6.905 -17.532 10.348 1.00 32.59 H new ATOM 0 HB3 LYS B 56 7.197 -17.082 8.884 1.00 32.59 H new ATOM 0 HG2 LYS B 56 9.323 -18.127 9.009 1.00 33.91 H new ATOM 0 HG3 LYS B 56 8.983 -18.616 10.450 1.00 33.91 H new ATOM 0 HD2 LYS B 56 7.177 -19.899 9.598 1.00 36.78 H new ATOM 0 HD3 LYS B 56 7.494 -19.397 8.156 1.00 36.78 H new ATOM 0 HE2 LYS B 56 9.588 -20.506 8.231 1.00 38.73 H new ATOM 0 HE3 LYS B 56 9.268 -21.010 9.672 1.00 38.73 H new ATOM 0 HZ1 LYS B 56 8.783 -22.640 8.150 1.00 40.46 H new ATOM 0 HZ2 LYS B 56 7.542 -22.249 8.798 1.00 40.46 H new ATOM 0 HZ3 LYS B 56 7.840 -21.780 7.455 1.00 40.46 H new ATOM 1162 N THR B 57 6.245 -14.551 10.522 1.00 31.33 N ATOM 1163 CA THR B 57 5.344 -13.426 10.260 1.00 30.90 C ATOM 1164 C THR B 57 6.059 -12.093 10.495 1.00 30.49 C ATOM 1165 O THR B 57 5.960 -11.171 9.677 1.00 30.52 O ATOM 1166 CB THR B 57 4.077 -13.508 11.145 1.00 30.88 C ATOM 1167 OG1 THR B 57 3.411 -14.756 10.916 1.00 31.30 O ATOM 1168 CG2 THR B 57 3.113 -12.368 10.835 1.00 31.15 C ATOM 0 H THR B 57 5.987 -15.061 11.165 1.00 31.33 H new ATOM 0 HA THR B 57 5.073 -13.477 9.330 1.00 30.90 H new ATOM 0 HB THR B 57 4.353 -13.438 12.072 1.00 30.88 H new ATOM 0 HG1 THR B 57 3.853 -15.378 11.266 1.00 31.30 H new ATOM 0 HG21 THR B 57 2.330 -12.443 11.402 1.00 31.15 H new ATOM 0 HG22 THR B 57 3.552 -11.519 11.001 1.00 31.15 H new ATOM 0 HG23 THR B 57 2.844 -12.416 9.904 1.00 31.15 H new ATOM 1169 N ALA B 58 6.777 -12.010 11.615 1.00 29.89 N ATOM 1170 CA ALA B 58 7.544 -10.825 11.974 1.00 29.38 C ATOM 1171 C ALA B 58 8.631 -10.528 10.950 1.00 29.05 C ATOM 1172 O ALA B 58 8.820 -9.372 10.570 1.00 28.94 O ATOM 1173 CB ALA B 58 8.150 -10.983 13.367 1.00 29.29 C ATOM 0 H ALA B 58 6.831 -12.647 12.190 1.00 29.89 H new ATOM 0 HA ALA B 58 6.934 -10.071 11.981 1.00 29.38 H new ATOM 0 HB1 ALA B 58 8.657 -10.187 13.592 1.00 29.29 H new ATOM 0 HB2 ALA B 58 7.440 -11.108 14.017 1.00 29.29 H new ATOM 0 HB3 ALA B 58 8.738 -11.754 13.379 1.00 29.29 H new ATOM 1174 N MET B 59 9.335 -11.571 10.505 1.00 28.78 N ATOM 1175 CA MET B 59 10.425 -11.419 9.539 1.00 28.73 C ATOM 1176 C MET B 59 9.945 -10.820 8.216 1.00 28.58 C ATOM 1177 O MET B 59 10.610 -9.945 7.652 1.00 28.73 O ATOM 1178 CB MET B 59 11.149 -12.751 9.298 1.00 28.82 C ATOM 1179 CG MET B 59 12.431 -12.642 8.460 1.00 29.46 C ATOM 1180 SD MET B 59 13.745 -11.620 9.204 1.00 31.62 S ATOM 1181 CE MET B 59 14.078 -12.517 10.725 1.00 29.69 C ATOM 0 H MET B 59 9.195 -12.382 10.753 1.00 28.78 H new ATOM 0 HA MET B 59 11.057 -10.795 9.929 1.00 28.73 H new ATOM 0 HB2 MET B 59 11.371 -13.144 10.156 1.00 28.82 H new ATOM 0 HB3 MET B 59 10.539 -13.361 8.855 1.00 28.82 H new ATOM 0 HG2 MET B 59 12.780 -13.534 8.308 1.00 29.46 H new ATOM 0 HG3 MET B 59 12.205 -12.274 7.592 1.00 29.46 H new ATOM 0 HE1 MET B 59 14.910 -12.202 11.111 1.00 29.69 H new ATOM 0 HE2 MET B 59 13.354 -12.369 11.353 1.00 29.69 H new ATOM 0 HE3 MET B 59 14.150 -13.465 10.533 1.00 29.69 H new ATOM 1182 N ALA B 60 8.795 -11.292 7.733 1.00 28.24 N ATOM 1183 CA ALA B 60 8.174 -10.771 6.511 1.00 28.02 C ATOM 1184 C ALA B 60 7.819 -9.287 6.644 1.00 27.96 C ATOM 1185 O ALA B 60 8.044 -8.503 5.719 1.00 27.81 O ATOM 1186 CB ALA B 60 6.937 -11.585 6.152 1.00 27.95 C ATOM 0 H ALA B 60 8.350 -11.927 8.106 1.00 28.24 H new ATOM 0 HA ALA B 60 8.823 -10.854 5.795 1.00 28.02 H new ATOM 0 HB1 ALA B 60 6.538 -11.228 5.343 1.00 27.95 H new ATOM 0 HB2 ALA B 60 7.189 -12.510 6.007 1.00 27.95 H new ATOM 0 HB3 ALA B 60 6.295 -11.535 6.877 1.00 27.95 H new ATOM 1187 N ALA B 61 7.267 -8.914 7.796 1.00 27.88 N ATOM 1188 CA ALA B 61 6.917 -7.524 8.077 1.00 27.93 C ATOM 1189 C ALA B 61 8.157 -6.646 8.236 1.00 28.09 C ATOM 1190 O ALA B 61 8.154 -5.482 7.821 1.00 28.04 O ATOM 1191 CB ALA B 61 6.047 -7.440 9.311 1.00 27.92 C ATOM 0 H ALA B 61 7.085 -9.459 8.436 1.00 27.88 H new ATOM 0 HA ALA B 61 6.419 -7.188 7.316 1.00 27.93 H new ATOM 0 HB1 ALA B 61 5.822 -6.513 9.486 1.00 27.92 H new ATOM 0 HB2 ALA B 61 5.233 -7.948 9.169 1.00 27.92 H new ATOM 0 HB3 ALA B 61 6.527 -7.805 10.071 1.00 27.92 H new ATOM 1192 N GLY B 62 9.206 -7.206 8.843 1.00 28.24 N ATOM 1193 CA GLY B 62 10.497 -6.526 8.966 1.00 28.59 C ATOM 1194 C GLY B 62 11.128 -6.214 7.621 1.00 28.76 C ATOM 1195 O GLY B 62 11.500 -5.069 7.358 1.00 28.92 O ATOM 0 H GLY B 62 9.188 -7.991 9.195 1.00 28.24 H new ATOM 0 HA2 GLY B 62 10.377 -5.701 9.462 1.00 28.59 H new ATOM 0 HA3 GLY B 62 11.103 -7.081 9.482 1.00 28.59 H new ATOM 1196 N ILE B 63 11.246 -7.233 6.771 1.00 29.07 N ATOM 1197 CA ILE B 63 11.760 -7.069 5.406 1.00 29.65 C ATOM 1198 C ILE B 63 10.967 -5.988 4.659 1.00 30.24 C ATOM 1199 O ILE B 63 11.550 -5.121 3.997 1.00 30.27 O ATOM 1200 CB ILE B 63 11.736 -8.413 4.621 1.00 29.63 C ATOM 1201 CG1 ILE B 63 12.783 -9.384 5.187 1.00 29.45 C ATOM 1202 CG2 ILE B 63 11.961 -8.184 3.119 1.00 29.28 C ATOM 1203 CD1 ILE B 63 12.589 -10.834 4.752 1.00 29.57 C ATOM 0 H ILE B 63 11.030 -8.042 6.968 1.00 29.07 H new ATOM 0 HA ILE B 63 12.685 -6.785 5.470 1.00 29.65 H new ATOM 0 HB ILE B 63 10.857 -8.809 4.731 1.00 29.63 H new ATOM 0 HG12 ILE B 63 13.665 -9.089 4.912 1.00 29.45 H new ATOM 0 HG13 ILE B 63 12.759 -9.341 6.156 1.00 29.45 H new ATOM 0 HG21 ILE B 63 11.941 -9.036 2.655 1.00 29.28 H new ATOM 0 HG22 ILE B 63 11.261 -7.610 2.771 1.00 29.28 H new ATOM 0 HG23 ILE B 63 12.823 -7.761 2.981 1.00 29.28 H new ATOM 0 HD11 ILE B 63 13.283 -11.386 5.146 1.00 29.57 H new ATOM 0 HD12 ILE B 63 11.720 -11.147 5.048 1.00 29.57 H new ATOM 0 HD13 ILE B 63 12.640 -10.892 3.785 1.00 29.57 H new ATOM 1204 N ASP B 64 9.643 -6.040 4.797 1.00 30.76 N ATOM 1205 CA ASP B 64 8.734 -5.083 4.181 1.00 31.59 C ATOM 1206 C ASP B 64 8.965 -3.645 4.670 1.00 31.41 C ATOM 1207 O ASP B 64 8.996 -2.705 3.866 1.00 31.08 O ATOM 1208 CB ASP B 64 7.291 -5.507 4.447 1.00 32.19 C ATOM 1209 CG ASP B 64 6.336 -5.031 3.374 1.00 34.94 C ATOM 1210 OD1 ASP B 64 6.120 -3.803 3.258 1.00 37.82 O ATOM 1211 OD2 ASP B 64 5.781 -5.897 2.656 1.00 38.54 O ATOM 0 H ASP B 64 9.243 -6.644 5.260 1.00 30.76 H new ATOM 0 HA ASP B 64 8.911 -5.084 3.227 1.00 31.59 H new ATOM 0 HB2 ASP B 64 7.248 -6.474 4.507 1.00 32.19 H new ATOM 0 HB3 ASP B 64 7.008 -5.156 5.306 1.00 32.19 H new ATOM 1212 N ALA B 65 9.124 -3.486 5.984 1.00 31.32 N ATOM 1213 CA ALA B 65 9.431 -2.187 6.586 1.00 31.34 C ATOM 1214 C ALA B 65 10.765 -1.615 6.089 1.00 31.34 C ATOM 1215 O ALA B 65 10.862 -0.419 5.805 1.00 30.86 O ATOM 1216 CB ALA B 65 9.424 -2.286 8.102 1.00 31.22 C ATOM 0 H ALA B 65 9.057 -4.128 6.552 1.00 31.32 H new ATOM 0 HA ALA B 65 8.735 -1.572 6.307 1.00 31.34 H new ATOM 0 HB1 ALA B 65 9.629 -1.418 8.484 1.00 31.22 H new ATOM 0 HB2 ALA B 65 8.548 -2.573 8.404 1.00 31.22 H new ATOM 0 HB3 ALA B 65 10.091 -2.930 8.387 1.00 31.22 H new ATOM 1217 N ILE B 66 11.779 -2.473 5.981 1.00 31.60 N ATOM 1218 CA ILE B 66 13.091 -2.061 5.474 1.00 32.15 C ATOM 1219 C ILE B 66 13.023 -1.625 4.002 1.00 32.81 C ATOM 1220 O ILE B 66 13.596 -0.601 3.631 1.00 32.72 O ATOM 1221 CB ILE B 66 14.179 -3.148 5.692 1.00 32.06 C ATOM 1222 CG1 ILE B 66 14.483 -3.306 7.187 1.00 31.98 C ATOM 1223 CG2 ILE B 66 15.458 -2.792 4.934 1.00 31.87 C ATOM 1224 CD1 ILE B 66 15.286 -4.549 7.541 1.00 31.77 C ATOM 0 H ILE B 66 11.728 -3.304 6.197 1.00 31.60 H new ATOM 0 HA ILE B 66 13.356 -1.288 5.997 1.00 32.15 H new ATOM 0 HB ILE B 66 13.840 -3.989 5.349 1.00 32.06 H new ATOM 0 HG12 ILE B 66 14.969 -2.524 7.491 1.00 31.98 H new ATOM 0 HG13 ILE B 66 13.645 -3.326 7.675 1.00 31.98 H new ATOM 0 HG21 ILE B 66 16.124 -3.481 5.082 1.00 31.87 H new ATOM 0 HG22 ILE B 66 15.265 -2.728 3.986 1.00 31.87 H new ATOM 0 HG23 ILE B 66 15.797 -1.941 5.253 1.00 31.87 H new ATOM 0 HD11 ILE B 66 15.436 -4.576 8.499 1.00 31.77 H new ATOM 0 HD12 ILE B 66 14.795 -5.340 7.269 1.00 31.77 H new ATOM 0 HD13 ILE B 66 16.140 -4.525 7.081 1.00 31.77 H new ATOM 1225 N ASN B 67 12.303 -2.391 3.181 1.00 33.63 N ATOM 1226 CA ASN B 67 12.079 -2.030 1.778 1.00 34.79 C ATOM 1227 C ASN B 67 11.394 -0.666 1.609 1.00 35.32 C ATOM 1228 O ASN B 67 11.739 0.096 0.706 1.00 35.27 O ATOM 1229 CB ASN B 67 11.292 -3.125 1.043 1.00 34.82 C ATOM 1230 CG ASN B 67 12.113 -4.399 0.812 1.00 35.73 C ATOM 1231 OD1 ASN B 67 13.345 -4.377 0.814 1.00 36.47 O ATOM 1232 ND2 ASN B 67 11.422 -5.513 0.598 1.00 36.56 N ATOM 0 H ASN B 67 11.933 -3.130 3.419 1.00 33.63 H new ATOM 0 HA ASN B 67 12.958 -1.952 1.376 1.00 34.79 H new ATOM 0 HB2 ASN B 67 10.499 -3.346 1.556 1.00 34.82 H new ATOM 0 HB3 ASN B 67 10.990 -2.781 0.188 1.00 34.82 H new ATOM 0 HD21 ASN B 67 11.834 -6.254 0.454 1.00 36.56 H new ATOM 0 HD22 ASN B 67 10.562 -5.493 0.603 1.00 36.56 H new ATOM 1233 N ARG B 68 10.443 -0.362 2.490 1.00 35.92 N ATOM 1234 CA ARG B 68 9.735 0.924 2.477 1.00 37.08 C ATOM 1235 C ARG B 68 10.553 2.100 3.051 1.00 36.30 C ATOM 1236 O ARG B 68 10.230 3.263 2.800 1.00 36.42 O ATOM 1237 CB ARG B 68 8.402 0.804 3.222 1.00 37.09 C ATOM 1238 CG ARG B 68 7.385 -0.133 2.557 1.00 39.18 C ATOM 1239 CD ARG B 68 6.096 -0.246 3.372 1.00 40.18 C ATOM 1240 NE ARG B 68 6.343 -0.742 4.729 1.00 47.54 N ATOM 1241 CZ ARG B 68 5.396 -0.983 5.633 1.00 50.31 C ATOM 1242 NH1 ARG B 68 4.113 -0.782 5.343 1.00 52.11 N ATOM 1243 NH2 ARG B 68 5.737 -1.431 6.835 1.00 51.72 N ATOM 0 H ARG B 68 10.187 -0.895 3.115 1.00 35.92 H new ATOM 0 HA ARG B 68 9.582 1.131 1.542 1.00 37.08 H new ATOM 0 HB2 ARG B 68 8.575 0.488 4.123 1.00 37.09 H new ATOM 0 HB3 ARG B 68 8.008 1.687 3.301 1.00 37.09 H new ATOM 0 HG2 ARG B 68 7.177 0.194 1.668 1.00 39.18 H new ATOM 0 HG3 ARG B 68 7.778 -1.013 2.451 1.00 39.18 H new ATOM 0 HD2 ARG B 68 5.668 0.623 3.420 1.00 40.18 H new ATOM 0 HD3 ARG B 68 5.479 -0.842 2.919 1.00 40.18 H new ATOM 0 HE ARG B 68 7.159 -0.888 4.958 1.00 47.54 H new ATOM 0 HH11 ARG B 68 3.888 -0.493 4.565 1.00 52.11 H new ATOM 0 HH12 ARG B 68 3.509 -0.941 5.934 1.00 52.11 H new ATOM 0 HH21 ARG B 68 6.565 -1.564 7.025 1.00 51.72 H new ATOM 0 HH22 ARG B 68 5.130 -1.589 7.423 1.00 51.72 H new ATOM 1244 N THR B 69 11.601 1.795 3.815 1.00 35.57 N ATOM 1245 CA THR B 69 12.445 2.821 4.441 1.00 34.79 C ATOM 1246 C THR B 69 13.467 3.398 3.463 1.00 34.49 C ATOM 1247 O THR B 69 14.239 2.661 2.857 1.00 34.04 O ATOM 1248 CB THR B 69 13.166 2.260 5.691 1.00 34.65 C ATOM 1249 OG1 THR B 69 12.187 1.828 6.635 1.00 33.88 O ATOM 1250 CG2 THR B 69 14.068 3.312 6.348 1.00 34.55 C ATOM 0 H THR B 69 11.845 0.988 3.987 1.00 35.57 H new ATOM 0 HA THR B 69 11.855 3.541 4.714 1.00 34.79 H new ATOM 0 HB THR B 69 13.726 1.519 5.410 1.00 34.65 H new ATOM 0 HG1 THR B 69 11.802 1.140 6.345 1.00 33.88 H new ATOM 0 HG21 THR B 69 14.502 2.927 7.125 1.00 34.55 H new ATOM 0 HG22 THR B 69 14.741 3.603 5.713 1.00 34.55 H new ATOM 0 HG23 THR B 69 13.532 4.073 6.622 1.00 34.55 H new ATOM 1251 N GLU B 70 13.466 4.723 3.330 1.00 34.37 N ATOM 1252 CA GLU B 70 14.391 5.428 2.439 1.00 34.54 C ATOM 1253 C GLU B 70 15.856 5.136 2.765 1.00 33.90 C ATOM 1254 O GLU B 70 16.288 5.305 3.903 1.00 33.62 O ATOM 1255 CB GLU B 70 14.144 6.936 2.508 1.00 34.92 C ATOM 1256 CG GLU B 70 14.718 7.715 1.332 1.00 37.02 C ATOM 1257 CD GLU B 70 13.921 7.525 0.046 1.00 39.69 C ATOM 1258 OE1 GLU B 70 14.546 7.524 -1.036 1.00 41.09 O ATOM 1259 OE2 GLU B 70 12.678 7.376 0.110 1.00 40.21 O ATOM 0 H GLU B 70 12.927 5.242 3.755 1.00 34.37 H new ATOM 0 HA GLU B 70 14.220 5.103 1.541 1.00 34.54 H new ATOM 0 HB2 GLU B 70 13.188 7.096 2.554 1.00 34.92 H new ATOM 0 HB3 GLU B 70 14.528 7.280 3.330 1.00 34.92 H new ATOM 0 HG2 GLU B 70 14.741 8.659 1.556 1.00 37.02 H new ATOM 0 HG3 GLU B 70 15.635 7.436 1.183 1.00 37.02 H new ATOM 1260 N GLY B 71 16.601 4.688 1.759 1.00 33.46 N ATOM 1261 CA GLY B 71 18.036 4.435 1.884 1.00 33.10 C ATOM 1262 C GLY B 71 18.419 3.151 2.596 1.00 32.95 C ATOM 1263 O GLY B 71 19.601 2.893 2.816 1.00 32.85 O ATOM 0 H GLY B 71 16.286 4.520 0.977 1.00 33.46 H new ATOM 0 HA2 GLY B 71 18.424 4.420 0.995 1.00 33.10 H new ATOM 0 HA3 GLY B 71 18.439 5.180 2.357 1.00 33.10 H new ATOM 1264 N ALA B 72 17.423 2.341 2.952 1.00 32.75 N ATOM 1265 CA ALA B 72 17.654 1.095 3.684 1.00 32.75 C ATOM 1266 C ALA B 72 17.439 -0.134 2.814 1.00 32.67 C ATOM 1267 O ALA B 72 16.534 -0.170 1.989 1.00 32.70 O ATOM 1268 CB ALA B 72 16.757 1.028 4.915 1.00 32.59 C ATOM 0 H ALA B 72 16.596 2.497 2.777 1.00 32.75 H new ATOM 0 HA ALA B 72 18.584 1.096 3.961 1.00 32.75 H new ATOM 0 HB1 ALA B 72 16.920 0.198 5.390 1.00 32.59 H new ATOM 0 HB2 ALA B 72 16.952 1.778 5.499 1.00 32.59 H new ATOM 0 HB3 ALA B 72 15.827 1.065 4.641 1.00 32.59 H new ATOM 1269 N ASP B 73 18.270 -1.146 3.015 1.00 32.73 N ATOM 1270 CA ASP B 73 18.143 -2.397 2.286 1.00 33.02 C ATOM 1271 C ASP B 73 18.466 -3.569 3.194 1.00 32.57 C ATOM 1272 O ASP B 73 19.393 -3.490 4.000 1.00 32.68 O ATOM 1273 CB ASP B 73 19.055 -2.399 1.052 1.00 33.52 C ATOM 1274 CG ASP B 73 18.467 -1.606 -0.119 1.00 35.60 C ATOM 1275 OD1 ASP B 73 17.234 -1.670 -0.343 1.00 37.40 O ATOM 1276 OD2 ASP B 73 19.243 -0.923 -0.828 1.00 38.17 O ATOM 0 H ASP B 73 18.921 -1.127 3.576 1.00 32.73 H new ATOM 0 HA ASP B 73 17.226 -2.486 1.983 1.00 33.02 H new ATOM 0 HB2 ASP B 73 19.917 -2.024 1.291 1.00 33.52 H new ATOM 0 HB3 ASP B 73 19.212 -3.314 0.772 1.00 33.52 H new ATOM 1277 N VAL B 74 17.687 -4.645 3.075 1.00 31.98 N ATOM 1278 CA VAL B 74 17.955 -5.873 3.815 1.00 31.67 C ATOM 1279 C VAL B 74 19.182 -6.518 3.198 1.00 31.41 C ATOM 1280 O VAL B 74 19.200 -6.832 2.004 1.00 31.42 O ATOM 1281 CB VAL B 74 16.778 -6.894 3.764 1.00 31.85 C ATOM 1282 CG1 VAL B 74 17.077 -8.108 4.645 1.00 31.68 C ATOM 1283 CG2 VAL B 74 15.461 -6.258 4.175 1.00 31.53 C ATOM 0 H VAL B 74 16.994 -4.681 2.567 1.00 31.98 H new ATOM 0 HA VAL B 74 18.083 -5.638 4.747 1.00 31.67 H new ATOM 0 HB VAL B 74 16.691 -7.187 2.843 1.00 31.85 H new ATOM 0 HG11 VAL B 74 16.335 -8.731 4.601 1.00 31.68 H new ATOM 0 HG12 VAL B 74 17.884 -8.545 4.331 1.00 31.68 H new ATOM 0 HG13 VAL B 74 17.202 -7.819 5.563 1.00 31.68 H new ATOM 0 HG21 VAL B 74 14.754 -6.921 4.131 1.00 31.53 H new ATOM 0 HG22 VAL B 74 15.533 -5.922 5.082 1.00 31.53 H new ATOM 0 HG23 VAL B 74 15.254 -5.525 3.574 1.00 31.53 H new ATOM 1284 N LYS B 75 20.209 -6.707 4.013 1.00 31.04 N ATOM 1285 CA LYS B 75 21.454 -7.287 3.525 1.00 30.90 C ATOM 1286 C LYS B 75 21.462 -8.799 3.701 1.00 30.34 C ATOM 1287 O LYS B 75 21.945 -9.529 2.837 1.00 30.32 O ATOM 1288 CB LYS B 75 22.659 -6.638 4.224 1.00 31.07 C ATOM 1289 CG LYS B 75 22.942 -5.207 3.764 1.00 32.33 C ATOM 1290 CD LYS B 75 23.575 -5.214 2.386 1.00 35.22 C ATOM 1291 CE LYS B 75 23.435 -3.882 1.690 1.00 36.93 C ATOM 1292 NZ LYS B 75 24.092 -3.940 0.356 1.00 38.79 N ATOM 0 H LYS B 75 20.208 -6.508 4.850 1.00 31.04 H new ATOM 0 HA LYS B 75 21.522 -7.105 2.575 1.00 30.90 H new ATOM 0 HB2 LYS B 75 22.505 -6.636 5.182 1.00 31.07 H new ATOM 0 HB3 LYS B 75 23.446 -7.182 4.065 1.00 31.07 H new ATOM 0 HG2 LYS B 75 22.117 -4.697 3.745 1.00 32.33 H new ATOM 0 HG3 LYS B 75 23.533 -4.768 4.396 1.00 32.33 H new ATOM 0 HD2 LYS B 75 24.515 -5.439 2.464 1.00 35.22 H new ATOM 0 HD3 LYS B 75 23.162 -5.905 1.845 1.00 35.22 H new ATOM 0 HE2 LYS B 75 22.497 -3.658 1.588 1.00 36.93 H new ATOM 0 HE3 LYS B 75 23.837 -3.182 2.228 1.00 36.93 H new ATOM 0 HZ1 LYS B 75 24.007 -3.153 -0.051 1.00 38.79 H new ATOM 0 HZ2 LYS B 75 24.956 -4.129 0.458 1.00 38.79 H new ATOM 0 HZ3 LYS B 75 23.706 -4.572 -0.138 1.00 38.79 H new ATOM 1293 N THR B 76 20.912 -9.258 4.822 1.00 29.72 N ATOM 1294 CA THR B 76 20.978 -10.663 5.211 1.00 29.25 C ATOM 1295 C THR B 76 19.982 -10.942 6.337 1.00 28.87 C ATOM 1296 O THR B 76 19.692 -10.064 7.158 1.00 28.82 O ATOM 1297 CB THR B 76 22.449 -11.092 5.581 1.00 29.37 C ATOM 1298 OG1 THR B 76 22.494 -12.474 5.954 1.00 29.78 O ATOM 1299 CG2 THR B 76 23.023 -10.238 6.704 1.00 29.00 C ATOM 0 H THR B 76 20.488 -8.760 5.381 1.00 29.72 H new ATOM 0 HA THR B 76 20.723 -11.210 4.452 1.00 29.25 H new ATOM 0 HB THR B 76 22.993 -10.955 4.790 1.00 29.37 H new ATOM 0 HG1 THR B 76 23.283 -12.687 6.146 1.00 29.78 H new ATOM 0 HG21 THR B 76 23.926 -10.530 6.904 1.00 29.00 H new ATOM 0 HG22 THR B 76 23.038 -9.308 6.428 1.00 29.00 H new ATOM 0 HG23 THR B 76 22.471 -10.331 7.496 1.00 29.00 H new ATOM 1300 N TRP B 77 19.432 -12.151 6.345 1.00 28.34 N ATOM 1301 CA TRP B 77 18.488 -12.569 7.381 1.00 27.98 C ATOM 1302 C TRP B 77 18.456 -14.085 7.505 1.00 27.75 C ATOM 1303 O TRP B 77 18.812 -14.801 6.573 1.00 27.57 O ATOM 1304 CB TRP B 77 17.072 -12.025 7.114 1.00 27.92 C ATOM 1305 CG TRP B 77 16.397 -12.599 5.893 1.00 28.02 C ATOM 1306 CD1 TRP B 77 16.476 -12.124 4.616 1.00 27.89 C ATOM 1307 CD2 TRP B 77 15.535 -13.748 5.839 1.00 27.60 C ATOM 1308 NE1 TRP B 77 15.725 -12.905 3.772 1.00 27.72 N ATOM 1309 CE2 TRP B 77 15.136 -13.907 4.494 1.00 27.75 C ATOM 1310 CE3 TRP B 77 15.067 -14.660 6.797 1.00 27.67 C ATOM 1311 CZ2 TRP B 77 14.289 -14.947 4.075 1.00 28.22 C ATOM 1312 CZ3 TRP B 77 14.219 -15.694 6.384 1.00 28.13 C ATOM 1313 CH2 TRP B 77 13.842 -15.827 5.031 1.00 28.36 C ATOM 0 H TRP B 77 19.594 -12.753 5.752 1.00 28.34 H new ATOM 0 HA TRP B 77 18.797 -12.194 8.220 1.00 27.98 H new ATOM 0 HB2 TRP B 77 16.518 -12.205 7.890 1.00 27.92 H new ATOM 0 HB3 TRP B 77 17.122 -11.061 7.018 1.00 27.92 H new ATOM 0 HD1 TRP B 77 16.968 -11.379 4.355 1.00 27.89 H new ATOM 0 HE1 TRP B 77 15.639 -12.784 2.925 1.00 27.72 H new ATOM 0 HE3 TRP B 77 15.316 -14.579 7.689 1.00 27.67 H new ATOM 0 HZ2 TRP B 77 14.040 -15.036 3.183 1.00 28.22 H new ATOM 0 HZ3 TRP B 77 13.899 -16.302 7.011 1.00 28.13 H new ATOM 0 HH2 TRP B 77 13.280 -16.524 4.781 1.00 28.36 H new ATOM 1314 N VAL B 78 18.030 -14.563 8.667 1.00 27.61 N ATOM 1315 CA VAL B 78 17.852 -15.990 8.893 1.00 27.61 C ATOM 1316 C VAL B 78 16.815 -16.216 9.998 1.00 27.82 C ATOM 1317 O VAL B 78 16.567 -15.334 10.825 1.00 27.50 O ATOM 1318 CB VAL B 78 19.212 -16.695 9.235 1.00 27.68 C ATOM 1319 CG1 VAL B 78 19.601 -16.491 10.714 1.00 26.67 C ATOM 1320 CG2 VAL B 78 19.169 -18.184 8.865 1.00 26.92 C ATOM 0 H VAL B 78 17.836 -14.071 9.345 1.00 27.61 H new ATOM 0 HA VAL B 78 17.526 -16.392 8.073 1.00 27.61 H new ATOM 0 HB VAL B 78 19.903 -16.277 8.698 1.00 27.68 H new ATOM 0 HG11 VAL B 78 20.443 -16.938 10.892 1.00 26.67 H new ATOM 0 HG12 VAL B 78 19.693 -15.543 10.897 1.00 26.67 H new ATOM 0 HG13 VAL B 78 18.911 -16.864 11.285 1.00 26.67 H new ATOM 0 HG21 VAL B 78 20.019 -18.597 9.085 1.00 26.92 H new ATOM 0 HG22 VAL B 78 18.459 -18.621 9.362 1.00 26.92 H new ATOM 0 HG23 VAL B 78 19.002 -18.277 7.914 1.00 26.92 H new ATOM 1321 N ILE B 79 16.204 -17.395 9.978 1.00 28.23 N ATOM 1322 CA ILE B 79 15.349 -17.866 11.059 1.00 28.81 C ATOM 1323 C ILE B 79 15.859 -19.246 11.476 1.00 29.37 C ATOM 1324 O ILE B 79 15.991 -20.139 10.641 1.00 29.23 O ATOM 1325 CB ILE B 79 13.853 -17.953 10.626 1.00 28.87 C ATOM 1326 CG1 ILE B 79 13.307 -16.552 10.307 1.00 28.64 C ATOM 1327 CG2 ILE B 79 13.008 -18.663 11.712 1.00 28.09 C ATOM 1328 CD1 ILE B 79 11.947 -16.546 9.612 1.00 28.68 C ATOM 0 H ILE B 79 16.276 -17.952 9.326 1.00 28.23 H new ATOM 0 HA ILE B 79 15.387 -17.238 11.798 1.00 28.81 H new ATOM 0 HB ILE B 79 13.792 -18.486 9.818 1.00 28.87 H new ATOM 0 HG12 ILE B 79 13.238 -16.048 11.133 1.00 28.64 H new ATOM 0 HG13 ILE B 79 13.947 -16.088 9.745 1.00 28.64 H new ATOM 0 HG21 ILE B 79 12.083 -18.707 11.425 1.00 28.09 H new ATOM 0 HG22 ILE B 79 13.347 -19.561 11.850 1.00 28.09 H new ATOM 0 HG23 ILE B 79 13.065 -18.166 12.543 1.00 28.09 H new ATOM 0 HD11 ILE B 79 11.672 -15.631 9.446 1.00 28.68 H new ATOM 0 HD12 ILE B 79 12.012 -17.022 8.769 1.00 28.68 H new ATOM 0 HD13 ILE B 79 11.292 -16.982 10.179 1.00 28.68 H new ATOM 1329 N ILE B 80 16.161 -19.401 12.763 1.00 30.22 N ATOM 1330 CA ILE B 80 16.569 -20.689 13.323 1.00 31.10 C ATOM 1331 C ILE B 80 15.466 -21.183 14.264 1.00 31.97 C ATOM 1332 O ILE B 80 15.260 -20.597 15.328 1.00 32.11 O ATOM 1333 CB ILE B 80 17.907 -20.591 14.113 1.00 31.15 C ATOM 1334 CG1 ILE B 80 19.000 -19.840 13.317 1.00 30.76 C ATOM 1335 CG2 ILE B 80 18.355 -21.972 14.590 1.00 31.06 C ATOM 1336 CD1 ILE B 80 19.513 -20.549 12.071 1.00 30.40 C ATOM 0 H ILE B 80 16.135 -18.762 13.338 1.00 30.22 H new ATOM 0 HA ILE B 80 16.708 -21.307 12.588 1.00 31.10 H new ATOM 0 HB ILE B 80 17.750 -20.054 14.905 1.00 31.15 H new ATOM 0 HG12 ILE B 80 18.649 -18.974 13.055 1.00 30.76 H new ATOM 0 HG13 ILE B 80 19.751 -19.675 13.908 1.00 30.76 H new ATOM 0 HG21 ILE B 80 19.189 -21.891 15.079 1.00 31.06 H new ATOM 0 HG22 ILE B 80 17.676 -22.350 15.170 1.00 31.06 H new ATOM 0 HG23 ILE B 80 18.485 -22.553 13.824 1.00 31.06 H new ATOM 0 HD11 ILE B 80 20.191 -20.003 11.644 1.00 30.40 H new ATOM 0 HD12 ILE B 80 19.897 -21.404 12.320 1.00 30.40 H new ATOM 0 HD13 ILE B 80 18.778 -20.693 11.454 1.00 30.40 H new ATOM 1337 N PRO B 81 14.753 -22.258 13.869 1.00 32.71 N ATOM 1338 CA PRO B 81 13.595 -22.795 14.600 1.00 33.32 C ATOM 1339 C PRO B 81 13.851 -23.204 16.056 1.00 34.01 C ATOM 1340 O PRO B 81 13.049 -22.862 16.930 1.00 34.23 O ATOM 1341 CB PRO B 81 13.190 -24.024 13.772 1.00 33.27 C ATOM 1342 CG PRO B 81 13.731 -23.763 12.413 1.00 33.31 C ATOM 1343 CD PRO B 81 15.017 -23.022 12.635 1.00 32.86 C ATOM 0 HA PRO B 81 12.917 -22.106 14.685 1.00 33.32 H new ATOM 0 HB2 PRO B 81 13.560 -24.838 14.147 1.00 33.27 H new ATOM 0 HB3 PRO B 81 12.226 -24.133 13.752 1.00 33.27 H new ATOM 0 HG2 PRO B 81 13.883 -24.591 11.932 1.00 33.31 H new ATOM 0 HG3 PRO B 81 13.111 -23.237 11.884 1.00 33.31 H new ATOM 0 HD2 PRO B 81 15.767 -23.628 12.742 1.00 32.86 H new ATOM 0 HD3 PRO B 81 15.228 -22.438 11.890 1.00 32.86 H new ATOM 1344 N ARG B 82 14.934 -23.939 16.313 1.00 34.62 N ATOM 1345 CA ARG B 82 15.219 -24.431 17.670 1.00 35.15 C ATOM 1346 C ARG B 82 16.706 -24.300 18.017 1.00 35.14 C ATOM 1347 O ARG B 82 17.447 -25.286 17.967 1.00 34.97 O ATOM 1348 CB ARG B 82 14.749 -25.886 17.841 1.00 35.25 C ATOM 1349 CG ARG B 82 13.235 -26.074 17.896 1.00 36.50 C ATOM 1350 CD ARG B 82 12.851 -27.508 17.542 1.00 38.65 C ATOM 1351 NE ARG B 82 12.918 -28.404 18.696 1.00 40.04 N ATOM 1352 CZ ARG B 82 13.290 -29.683 18.642 1.00 41.00 C ATOM 1353 NH1 ARG B 82 13.657 -30.230 17.487 1.00 41.04 N ATOM 1354 NH2 ARG B 82 13.310 -30.415 19.751 1.00 40.86 N ATOM 0 H ARG B 82 15.516 -24.165 15.721 1.00 34.62 H new ATOM 0 HA ARG B 82 14.721 -23.875 18.289 1.00 35.15 H new ATOM 0 HB2 ARG B 82 15.100 -26.413 17.106 1.00 35.25 H new ATOM 0 HB3 ARG B 82 15.135 -26.243 18.656 1.00 35.25 H new ATOM 0 HG2 ARG B 82 12.911 -25.858 18.784 1.00 36.50 H new ATOM 0 HG3 ARG B 82 12.806 -25.459 17.280 1.00 36.50 H new ATOM 0 HD2 ARG B 82 11.952 -27.519 17.179 1.00 38.65 H new ATOM 0 HD3 ARG B 82 13.442 -27.836 16.846 1.00 38.65 H new ATOM 0 HE ARG B 82 12.702 -28.083 19.464 1.00 40.04 H new ATOM 0 HH11 ARG B 82 13.655 -29.758 16.768 1.00 41.04 H new ATOM 0 HH12 ARG B 82 13.896 -31.056 17.459 1.00 41.04 H new ATOM 0 HH21 ARG B 82 13.083 -30.063 20.502 1.00 40.86 H new ATOM 0 HH22 ARG B 82 13.550 -31.240 19.717 1.00 40.86 H new ATOM 1355 N PRO B 83 17.144 -23.083 18.389 1.00 35.25 N ATOM 1356 CA PRO B 83 18.573 -22.845 18.598 1.00 35.31 C ATOM 1357 C PRO B 83 19.132 -23.629 19.786 1.00 35.29 C ATOM 1358 O PRO B 83 18.533 -23.640 20.865 1.00 35.27 O ATOM 1359 CB PRO B 83 18.650 -21.333 18.855 1.00 35.31 C ATOM 1360 CG PRO B 83 17.287 -20.960 19.357 1.00 35.42 C ATOM 1361 CD PRO B 83 16.337 -21.873 18.637 1.00 35.22 C ATOM 0 HA PRO B 83 19.103 -23.138 17.840 1.00 35.31 H new ATOM 0 HB2 PRO B 83 19.336 -21.121 19.508 1.00 35.31 H new ATOM 0 HB3 PRO B 83 18.871 -20.849 18.044 1.00 35.31 H new ATOM 0 HG2 PRO B 83 17.224 -21.076 20.318 1.00 35.42 H new ATOM 0 HG3 PRO B 83 17.088 -20.029 19.170 1.00 35.42 H new ATOM 0 HD2 PRO B 83 15.554 -22.070 19.175 1.00 35.22 H new ATOM 0 HD3 PRO B 83 16.021 -21.479 17.809 1.00 35.22 H new ATOM 1362 N HIS B 84 20.269 -24.284 19.563 1.00 35.13 N ATOM 1363 CA HIS B 84 20.992 -25.016 20.599 1.00 35.09 C ATOM 1364 C HIS B 84 21.378 -24.085 21.751 1.00 35.03 C ATOM 1365 O HIS B 84 21.618 -22.896 21.539 1.00 35.01 O ATOM 1366 CB HIS B 84 22.242 -25.641 19.978 1.00 35.13 C ATOM 1367 CG HIS B 84 22.888 -26.695 20.821 1.00 34.92 C ATOM 1368 ND1 HIS B 84 23.747 -26.398 21.855 1.00 34.90 N ATOM 1369 CD2 HIS B 84 22.824 -28.047 20.763 1.00 35.05 C ATOM 1370 CE1 HIS B 84 24.173 -27.520 22.409 1.00 35.05 C ATOM 1371 NE2 HIS B 84 23.626 -28.535 21.764 1.00 34.83 N ATOM 0 H HIS B 84 20.648 -24.316 18.792 1.00 35.13 H new ATOM 0 HA HIS B 84 20.421 -25.712 20.960 1.00 35.09 H new ATOM 0 HB2 HIS B 84 22.005 -26.028 19.121 1.00 35.13 H new ATOM 0 HB3 HIS B 84 22.889 -24.940 19.804 1.00 35.13 H new ATOM 0 HD2 HIS B 84 22.329 -28.550 20.158 1.00 35.05 H new ATOM 0 HE1 HIS B 84 24.758 -27.584 23.129 1.00 35.05 H new ATOM 0 HE2 HIS B 84 23.752 -29.367 21.943 1.00 34.83 H new ATOM 1372 N GLU B 85 21.437 -24.635 22.962 1.00 34.98 N ATOM 1373 CA GLU B 85 21.777 -23.867 24.170 1.00 35.21 C ATOM 1374 C GLU B 85 23.162 -23.206 24.114 1.00 33.74 C ATOM 1375 O GLU B 85 23.345 -22.100 24.628 1.00 33.70 O ATOM 1376 CB GLU B 85 21.673 -24.748 25.418 1.00 35.26 C ATOM 1377 CG GLU B 85 20.270 -25.248 25.732 1.00 37.32 C ATOM 1378 CD GLU B 85 20.204 -25.988 27.053 1.00 37.89 C ATOM 1379 OE1 GLU B 85 20.375 -25.336 28.109 1.00 41.62 O ATOM 1380 OE2 GLU B 85 19.976 -27.221 27.038 1.00 41.77 O ATOM 0 H GLU B 85 21.281 -25.467 23.111 1.00 34.98 H new ATOM 0 HA GLU B 85 21.127 -23.148 24.216 1.00 35.21 H new ATOM 0 HB2 GLU B 85 22.258 -25.514 25.308 1.00 35.26 H new ATOM 0 HB3 GLU B 85 22.002 -24.247 26.180 1.00 35.26 H new ATOM 0 HG2 GLU B 85 19.658 -24.495 25.755 1.00 37.32 H new ATOM 0 HG3 GLU B 85 19.971 -25.835 25.020 1.00 37.32 H new ATOM 1381 N ASN B 86 24.125 -23.894 23.501 1.00 32.36 N ATOM 1382 CA ASN B 86 25.482 -23.371 23.312 1.00 31.03 C ATOM 1383 C ASN B 86 25.483 -22.100 22.456 1.00 30.21 C ATOM 1384 O ASN B 86 26.274 -21.188 22.694 1.00 29.89 O ATOM 1385 CB ASN B 86 26.382 -24.451 22.691 1.00 30.90 C ATOM 1386 CG ASN B 86 27.878 -24.173 22.870 1.00 30.36 C ATOM 1387 OD1 ASN B 86 28.224 -23.006 23.408 1.00 29.06 O flip ATOM 1388 ND2 ASN B 86 28.709 -25.014 22.524 1.00 29.37 N flip ATOM 0 H ASN B 86 24.010 -24.684 23.180 1.00 32.36 H new ATOM 0 HA ASN B 86 25.836 -23.131 24.183 1.00 31.03 H new ATOM 0 HB2 ASN B 86 26.169 -25.309 23.091 1.00 30.90 H new ATOM 0 HB3 ASN B 86 26.184 -24.522 21.744 1.00 30.90 H new ATOM 0 HD21 ASN B 86 28.450 -25.758 22.179 1.00 29.37 H new ATOM 0 HD22 ASN B 86 29.548 -24.857 22.627 1.00 29.37 H new ATOM 1389 N VAL B 87 24.585 -22.053 21.474 1.00 29.27 N ATOM 1390 CA VAL B 87 24.418 -20.887 20.604 1.00 28.66 C ATOM 1391 C VAL B 87 23.782 -19.731 21.381 1.00 28.25 C ATOM 1392 O VAL B 87 24.262 -18.597 21.329 1.00 28.24 O ATOM 1393 CB VAL B 87 23.537 -21.219 19.373 1.00 28.58 C ATOM 1394 CG1 VAL B 87 23.412 -20.015 18.457 1.00 28.28 C ATOM 1395 CG2 VAL B 87 24.093 -22.421 18.617 1.00 28.30 C ATOM 0 H VAL B 87 24.051 -22.702 21.292 1.00 29.27 H new ATOM 0 HA VAL B 87 25.299 -20.628 20.293 1.00 28.66 H new ATOM 0 HB VAL B 87 22.650 -21.448 19.691 1.00 28.58 H new ATOM 0 HG11 VAL B 87 22.858 -20.244 17.695 1.00 28.28 H new ATOM 0 HG12 VAL B 87 23.006 -19.280 18.942 1.00 28.28 H new ATOM 0 HG13 VAL B 87 24.293 -19.750 18.148 1.00 28.28 H new ATOM 0 HG21 VAL B 87 23.528 -22.612 17.852 1.00 28.30 H new ATOM 0 HG22 VAL B 87 24.993 -22.224 18.313 1.00 28.30 H new ATOM 0 HG23 VAL B 87 24.112 -23.193 19.205 1.00 28.30 H new ATOM 1396 N VAL B 88 22.703 -20.042 22.097 1.00 27.65 N ATOM 1397 CA VAL B 88 21.992 -19.088 22.952 1.00 27.22 C ATOM 1398 C VAL B 88 22.913 -18.456 24.007 1.00 27.00 C ATOM 1399 O VAL B 88 22.767 -17.277 24.330 1.00 26.98 O ATOM 1400 CB VAL B 88 20.754 -19.760 23.630 1.00 27.25 C ATOM 1401 CG1 VAL B 88 20.088 -18.832 24.625 1.00 26.88 C ATOM 1402 CG2 VAL B 88 19.746 -20.210 22.584 1.00 27.03 C ATOM 0 H VAL B 88 22.356 -20.829 22.100 1.00 27.65 H new ATOM 0 HA VAL B 88 21.679 -18.372 22.378 1.00 27.22 H new ATOM 0 HB VAL B 88 21.077 -20.537 24.113 1.00 27.25 H new ATOM 0 HG11 VAL B 88 19.326 -19.280 25.025 1.00 26.88 H new ATOM 0 HG12 VAL B 88 20.722 -18.591 25.318 1.00 26.88 H new ATOM 0 HG13 VAL B 88 19.788 -18.030 24.169 1.00 26.88 H new ATOM 0 HG21 VAL B 88 18.986 -20.624 23.023 1.00 27.03 H new ATOM 0 HG22 VAL B 88 19.445 -19.442 22.073 1.00 27.03 H new ATOM 0 HG23 VAL B 88 20.163 -20.851 21.988 1.00 27.03 H new ATOM 1403 N ALA B 89 23.861 -19.234 24.525 1.00 26.81 N ATOM 1404 CA ALA B 89 24.791 -18.742 25.547 1.00 26.77 C ATOM 1405 C ALA B 89 25.881 -17.824 24.984 1.00 26.81 C ATOM 1406 O ALA B 89 26.170 -16.769 25.559 1.00 27.04 O ATOM 1407 CB ALA B 89 25.416 -19.906 26.316 1.00 26.53 C ATOM 0 H ALA B 89 23.985 -20.054 24.298 1.00 26.81 H new ATOM 0 HA ALA B 89 24.263 -18.202 26.156 1.00 26.77 H new ATOM 0 HB1 ALA B 89 26.027 -19.561 26.986 1.00 26.53 H new ATOM 0 HB2 ALA B 89 24.717 -20.420 26.750 1.00 26.53 H new ATOM 0 HB3 ALA B 89 25.901 -20.477 25.700 1.00 26.53 H new ATOM 1408 N VAL B 90 26.477 -18.223 23.862 1.00 26.69 N ATOM 1409 CA VAL B 90 27.611 -17.493 23.284 1.00 26.62 C ATOM 1410 C VAL B 90 27.195 -16.240 22.498 1.00 26.74 C ATOM 1411 O VAL B 90 27.792 -15.176 22.661 1.00 26.66 O ATOM 1412 CB VAL B 90 28.522 -18.427 22.432 1.00 26.57 C ATOM 1413 CG1 VAL B 90 29.524 -17.628 21.613 1.00 26.20 C ATOM 1414 CG2 VAL B 90 29.256 -19.416 23.337 1.00 26.17 C ATOM 0 H VAL B 90 26.240 -18.919 23.415 1.00 26.69 H new ATOM 0 HA VAL B 90 28.132 -17.174 24.038 1.00 26.62 H new ATOM 0 HB VAL B 90 27.954 -18.916 21.817 1.00 26.57 H new ATOM 0 HG11 VAL B 90 30.075 -18.235 21.095 1.00 26.20 H new ATOM 0 HG12 VAL B 90 29.049 -17.031 21.014 1.00 26.20 H new ATOM 0 HG13 VAL B 90 30.087 -17.108 22.208 1.00 26.20 H new ATOM 0 HG21 VAL B 90 29.820 -19.992 22.797 1.00 26.17 H new ATOM 0 HG22 VAL B 90 29.805 -18.929 23.971 1.00 26.17 H new ATOM 0 HG23 VAL B 90 28.610 -19.956 23.818 1.00 26.17 H new ATOM 1415 N LEU B 91 26.176 -16.373 21.655 1.00 27.12 N ATOM 1416 CA LEU B 91 25.706 -15.266 20.819 1.00 27.40 C ATOM 1417 C LEU B 91 24.652 -14.456 21.557 1.00 27.95 C ATOM 1418 O LEU B 91 23.925 -15.012 22.382 1.00 27.71 O ATOM 1419 CB LEU B 91 25.146 -15.792 19.495 1.00 27.20 C ATOM 1420 CG LEU B 91 26.087 -16.582 18.571 1.00 27.56 C ATOM 1421 CD1 LEU B 91 25.383 -16.928 17.266 1.00 26.60 C ATOM 1422 CD2 LEU B 91 27.390 -15.832 18.286 1.00 26.87 C ATOM 0 H LEU B 91 25.737 -17.105 21.550 1.00 27.12 H new ATOM 0 HA LEU B 91 26.460 -14.687 20.624 1.00 27.40 H new ATOM 0 HB2 LEU B 91 24.386 -16.359 19.699 1.00 27.20 H new ATOM 0 HB3 LEU B 91 24.807 -15.033 18.994 1.00 27.20 H new ATOM 0 HG LEU B 91 26.322 -17.400 19.037 1.00 27.56 H new ATOM 0 HD11 LEU B 91 25.988 -17.426 16.694 1.00 26.60 H new ATOM 0 HD12 LEU B 91 24.599 -17.468 17.454 1.00 26.60 H new ATOM 0 HD13 LEU B 91 25.113 -16.111 16.818 1.00 26.60 H new ATOM 0 HD21 LEU B 91 27.950 -16.366 17.701 1.00 26.87 H new ATOM 0 HD22 LEU B 91 27.189 -14.986 17.856 1.00 26.87 H new ATOM 0 HD23 LEU B 91 27.858 -15.667 19.120 1.00 26.87 H new ATOM 1423 N PRO B 92 24.557 -13.138 21.265 1.00 28.68 N ATOM 1424 CA PRO B 92 23.639 -12.275 22.016 1.00 29.19 C ATOM 1425 C PRO B 92 22.179 -12.420 21.563 1.00 29.76 C ATOM 1426 O PRO B 92 21.559 -11.446 21.117 1.00 30.01 O ATOM 1427 CB PRO B 92 24.182 -10.869 21.722 1.00 29.16 C ATOM 1428 CG PRO B 92 24.755 -10.983 20.349 1.00 28.68 C ATOM 1429 CD PRO B 92 25.298 -12.381 20.234 1.00 28.52 C ATOM 0 HA PRO B 92 23.612 -12.495 22.960 1.00 29.19 H new ATOM 0 HB2 PRO B 92 23.479 -10.202 21.759 1.00 29.16 H new ATOM 0 HB3 PRO B 92 24.857 -10.607 22.368 1.00 29.16 H new ATOM 0 HG2 PRO B 92 24.076 -10.819 19.676 1.00 28.68 H new ATOM 0 HG3 PRO B 92 25.456 -10.327 20.211 1.00 28.68 H new ATOM 0 HD2 PRO B 92 25.150 -12.748 19.348 1.00 28.52 H new ATOM 0 HD3 PRO B 92 26.254 -12.405 20.394 1.00 28.52 H new ATOM 1430 N ILE B 93 21.638 -13.630 21.687 1.00 30.40 N ATOM 1431 CA ILE B 93 20.262 -13.918 21.267 1.00 31.01 C ATOM 1432 C ILE B 93 19.348 -14.378 22.419 1.00 31.81 C ATOM 1433 O ILE B 93 18.179 -14.701 22.197 1.00 31.75 O ATOM 1434 CB ILE B 93 20.218 -14.959 20.107 1.00 30.94 C ATOM 1435 CG1 ILE B 93 20.834 -16.299 20.551 1.00 30.83 C ATOM 1436 CG2 ILE B 93 20.907 -14.402 18.857 1.00 30.45 C ATOM 1437 CD1 ILE B 93 20.473 -17.484 19.673 1.00 31.00 C ATOM 0 H ILE B 93 22.054 -14.307 22.016 1.00 30.40 H new ATOM 0 HA ILE B 93 19.914 -13.071 20.948 1.00 31.01 H new ATOM 0 HB ILE B 93 19.291 -15.129 19.878 1.00 30.94 H new ATOM 0 HG12 ILE B 93 21.799 -16.207 20.569 1.00 30.83 H new ATOM 0 HG13 ILE B 93 20.550 -16.486 21.459 1.00 30.83 H new ATOM 0 HG21 ILE B 93 20.871 -15.061 18.146 1.00 30.45 H new ATOM 0 HG22 ILE B 93 20.454 -13.593 18.571 1.00 30.45 H new ATOM 0 HG23 ILE B 93 21.833 -14.198 19.061 1.00 30.45 H new ATOM 0 HD11 ILE B 93 20.898 -18.284 20.019 1.00 31.00 H new ATOM 0 HD12 ILE B 93 19.511 -17.605 19.672 1.00 31.00 H new ATOM 0 HD13 ILE B 93 20.779 -17.321 18.767 1.00 31.00 H new ATOM 1438 N ASP B 94 19.874 -14.408 23.641 1.00 32.76 N ATOM 1439 CA ASP B 94 19.095 -14.868 24.790 1.00 33.94 C ATOM 1440 C ASP B 94 18.210 -13.754 25.338 1.00 34.59 C ATOM 1441 O ASP B 94 18.452 -12.568 25.085 1.00 34.41 O ATOM 1442 CB ASP B 94 20.013 -15.418 25.891 1.00 34.16 C ATOM 1443 CG ASP B 94 19.277 -16.321 26.890 1.00 35.73 C ATOM 1444 OD1 ASP B 94 18.128 -16.753 26.612 1.00 36.56 O ATOM 1445 OD2 ASP B 94 19.860 -16.610 27.960 1.00 37.31 O ATOM 0 H ASP B 94 20.678 -14.167 23.827 1.00 32.76 H new ATOM 0 HA ASP B 94 18.519 -15.587 24.486 1.00 33.94 H new ATOM 0 HB2 ASP B 94 20.736 -15.919 25.482 1.00 34.16 H new ATOM 0 HB3 ASP B 94 20.416 -14.677 26.369 1.00 34.16 H new ATOM 1446 N PHE B 95 17.176 -14.154 26.078 1.00 35.61 N ATOM 1447 CA PHE B 95 16.306 -13.227 26.794 1.00 36.79 C ATOM 1448 C PHE B 95 17.048 -12.601 27.970 1.00 38.36 C ATOM 1449 O PHE B 95 17.916 -13.233 28.578 1.00 38.25 O ATOM 1450 CB PHE B 95 15.063 -13.946 27.326 1.00 35.86 C ATOM 1451 CG PHE B 95 14.154 -14.484 26.256 1.00 34.73 C ATOM 1452 CD1 PHE B 95 13.185 -13.671 25.671 1.00 33.28 C ATOM 1453 CD2 PHE B 95 14.245 -15.815 25.853 1.00 33.28 C ATOM 1454 CE1 PHE B 95 12.333 -14.171 24.685 1.00 32.48 C ATOM 1455 CE2 PHE B 95 13.396 -16.326 24.867 1.00 32.65 C ATOM 1456 CZ PHE B 95 12.438 -15.503 24.286 1.00 32.85 C ATOM 0 H PHE B 95 16.959 -14.980 26.178 1.00 35.61 H new ATOM 0 HA PHE B 95 16.036 -12.536 26.169 1.00 36.79 H new ATOM 0 HB2 PHE B 95 15.345 -14.679 27.895 1.00 35.86 H new ATOM 0 HB3 PHE B 95 14.561 -13.332 27.884 1.00 35.86 H new ATOM 0 HD1 PHE B 95 13.105 -12.785 25.941 1.00 33.28 H new ATOM 0 HD2 PHE B 95 14.879 -16.371 26.245 1.00 33.28 H new ATOM 0 HE1 PHE B 95 11.696 -13.617 24.295 1.00 32.48 H new ATOM 0 HE2 PHE B 95 13.472 -17.214 24.601 1.00 32.65 H new ATOM 0 HZ PHE B 95 11.868 -15.840 23.633 1.00 32.85 H new ATOM 1457 N SER B 96 16.694 -11.358 28.277 1.00 40.66 N ATOM 1458 CA SER B 96 17.204 -10.660 29.451 1.00 43.06 C ATOM 1459 C SER B 96 16.023 -10.114 30.264 1.00 44.96 C ATOM 1460 O SER B 96 14.906 -10.033 29.747 1.00 44.89 O ATOM 1461 CB SER B 96 18.153 -9.533 29.032 1.00 42.90 C ATOM 1462 OG SER B 96 17.450 -8.481 28.399 1.00 42.94 O ATOM 0 H SER B 96 16.146 -10.892 27.806 1.00 40.66 H new ATOM 0 HA SER B 96 17.708 -11.277 30.004 1.00 43.06 H new ATOM 0 HB2 SER B 96 18.618 -9.191 29.812 1.00 42.90 H new ATOM 0 HB3 SER B 96 18.828 -9.883 28.430 1.00 42.90 H new ATOM 0 HG SER B 96 17.347 -8.662 27.585 1.00 42.94 H new ATOM 1463 N PRO B 97 16.252 -9.749 31.541 1.00 47.14 N ATOM 1464 CA PRO B 97 15.148 -9.219 32.354 1.00 48.99 C ATOM 1465 C PRO B 97 14.492 -7.950 31.789 1.00 51.07 C ATOM 1466 O PRO B 97 13.315 -7.704 32.054 1.00 50.98 O ATOM 1467 CB PRO B 97 15.816 -8.931 33.699 1.00 48.89 C ATOM 1468 CG PRO B 97 17.016 -9.821 33.726 1.00 47.98 C ATOM 1469 CD PRO B 97 17.503 -9.834 32.317 1.00 47.14 C ATOM 0 HA PRO B 97 14.413 -9.851 32.394 1.00 48.99 H new ATOM 0 HB2 PRO B 97 16.068 -7.997 33.774 1.00 48.89 H new ATOM 0 HB3 PRO B 97 15.218 -9.124 34.438 1.00 48.89 H new ATOM 0 HG2 PRO B 97 17.694 -9.481 34.331 1.00 47.98 H new ATOM 0 HG3 PRO B 97 16.787 -10.714 34.029 1.00 47.98 H new ATOM 0 HD2 PRO B 97 18.093 -9.086 32.133 1.00 47.14 H new ATOM 0 HD3 PRO B 97 17.998 -10.643 32.114 1.00 47.14 H new ATOM 1470 N GLU B 98 15.249 -7.169 31.016 1.00 53.73 N ATOM 1471 CA GLU B 98 14.741 -5.958 30.356 1.00 56.65 C ATOM 1472 C GLU B 98 13.578 -6.234 29.407 1.00 57.92 C ATOM 1473 O GLU B 98 12.657 -5.423 29.290 1.00 58.09 O ATOM 1474 CB GLU B 98 15.853 -5.275 29.562 1.00 56.53 C ATOM 1475 CG GLU B 98 16.825 -4.459 30.388 1.00 57.99 C ATOM 1476 CD GLU B 98 17.916 -3.812 29.544 1.00 58.22 C ATOM 1477 OE1 GLU B 98 19.038 -3.636 30.068 1.00 60.54 O ATOM 1478 OE2 GLU B 98 17.656 -3.484 28.362 1.00 60.13 O ATOM 0 H GLU B 98 16.079 -7.327 30.857 1.00 53.73 H new ATOM 0 HA GLU B 98 14.420 -5.384 31.069 1.00 56.65 H new ATOM 0 HB2 GLU B 98 16.351 -5.954 29.080 1.00 56.53 H new ATOM 0 HB3 GLU B 98 15.448 -4.695 28.898 1.00 56.53 H new ATOM 0 HG2 GLU B 98 16.338 -3.769 30.865 1.00 57.99 H new ATOM 0 HG3 GLU B 98 17.235 -5.030 31.056 1.00 57.99 H new ATOM 1479 N VAL B 99 13.640 -7.374 28.723 1.00 59.86 N ATOM 1480 CA VAL B 99 12.638 -7.735 27.721 1.00 61.77 C ATOM 1481 C VAL B 99 11.655 -8.788 28.242 1.00 63.29 C ATOM 1482 O VAL B 99 10.851 -9.338 27.484 1.00 63.32 O ATOM 1483 CB VAL B 99 13.297 -8.171 26.379 1.00 61.63 C ATOM 1484 CG1 VAL B 99 14.151 -7.042 25.824 1.00 61.51 C ATOM 1485 CG2 VAL B 99 14.128 -9.441 26.552 1.00 61.46 C ATOM 0 H VAL B 99 14.262 -7.959 28.826 1.00 59.86 H new ATOM 0 HA VAL B 99 12.120 -6.935 27.539 1.00 61.77 H new ATOM 0 HB VAL B 99 12.589 -8.369 25.746 1.00 61.63 H new ATOM 0 HG11 VAL B 99 14.557 -7.323 24.989 1.00 61.51 H new ATOM 0 HG12 VAL B 99 13.595 -6.263 25.667 1.00 61.51 H new ATOM 0 HG13 VAL B 99 14.847 -6.819 26.462 1.00 61.51 H new ATOM 0 HG21 VAL B 99 14.525 -9.687 25.702 1.00 61.46 H new ATOM 0 HG22 VAL B 99 14.830 -9.282 27.202 1.00 61.46 H new ATOM 0 HG23 VAL B 99 13.558 -10.161 26.862 1.00 61.46 H new ATOM 1486 N GLU B 100 11.720 -9.037 29.549 1.00 65.41 N ATOM 1487 CA GLU B 100 10.868 -10.020 30.223 1.00 67.48 C ATOM 1488 C GLU B 100 9.360 -9.712 30.163 1.00 68.71 C ATOM 1489 O GLU B 100 8.569 -10.627 29.932 1.00 68.75 O ATOM 1490 CB GLU B 100 11.335 -10.239 31.671 1.00 67.61 C ATOM 1491 CG GLU B 100 10.735 -11.460 32.371 1.00 68.89 C ATOM 1492 CD GLU B 100 11.244 -12.796 31.830 1.00 70.45 C ATOM 1493 OE1 GLU B 100 12.122 -12.810 30.936 1.00 70.89 O ATOM 1494 OE2 GLU B 100 10.757 -13.842 32.312 1.00 71.18 O ATOM 0 H GLU B 100 12.267 -8.635 30.077 1.00 65.41 H new ATOM 0 HA GLU B 100 10.974 -10.844 29.722 1.00 67.48 H new ATOM 0 HB2 GLU B 100 12.301 -10.324 31.675 1.00 67.61 H new ATOM 0 HB3 GLU B 100 11.118 -9.448 32.189 1.00 67.61 H new ATOM 0 HG2 GLU B 100 10.933 -11.408 33.319 1.00 68.89 H new ATOM 0 HG3 GLU B 100 9.770 -11.431 32.281 1.00 68.89 H new ATOM 1495 N PRO B 101 8.955 -8.435 30.368 1.00 70.09 N ATOM 1496 CA PRO B 101 7.529 -8.111 30.223 1.00 71.30 C ATOM 1497 C PRO B 101 6.989 -8.355 28.812 1.00 72.59 C ATOM 1498 O PRO B 101 5.796 -8.619 28.644 1.00 72.69 O ATOM 1499 CB PRO B 101 7.472 -6.614 30.554 1.00 71.23 C ATOM 1500 CG PRO B 101 8.855 -6.117 30.338 1.00 70.69 C ATOM 1501 CD PRO B 101 9.734 -7.245 30.757 1.00 70.16 C ATOM 0 HA PRO B 101 6.982 -8.672 30.795 1.00 71.30 H new ATOM 0 HB2 PRO B 101 6.840 -6.152 29.982 1.00 71.23 H new ATOM 0 HB3 PRO B 101 7.186 -6.468 31.469 1.00 71.23 H new ATOM 0 HG2 PRO B 101 9.003 -5.881 29.409 1.00 70.69 H new ATOM 0 HG3 PRO B 101 9.029 -5.321 30.864 1.00 70.69 H new ATOM 0 HD2 PRO B 101 10.594 -7.216 30.309 1.00 70.16 H new ATOM 0 HD3 PRO B 101 9.911 -7.227 31.711 1.00 70.16 H new ATOM 1502 N PHE B 102 7.867 -8.269 27.815 1.00 74.11 N ATOM 1503 CA PHE B 102 7.491 -8.475 26.420 1.00 75.62 C ATOM 1504 C PHE B 102 7.477 -9.958 26.057 1.00 76.91 C ATOM 1505 O PHE B 102 6.754 -10.368 25.150 1.00 77.05 O ATOM 1506 CB PHE B 102 8.419 -7.680 25.493 1.00 75.37 C ATOM 1507 CG PHE B 102 8.617 -6.250 25.921 1.00 75.09 C ATOM 1508 CD1 PHE B 102 7.606 -5.310 25.746 1.00 74.72 C ATOM 1509 CD2 PHE B 102 9.809 -5.846 26.515 1.00 74.71 C ATOM 1510 CE1 PHE B 102 7.781 -3.991 26.152 1.00 74.49 C ATOM 1511 CE2 PHE B 102 9.994 -4.526 26.923 1.00 74.50 C ATOM 1512 CZ PHE B 102 8.978 -3.598 26.741 1.00 74.58 C ATOM 0 H PHE B 102 8.700 -8.089 27.930 1.00 74.11 H new ATOM 0 HA PHE B 102 6.587 -8.145 26.300 1.00 75.62 H new ATOM 0 HB2 PHE B 102 9.282 -8.121 25.456 1.00 75.37 H new ATOM 0 HB3 PHE B 102 8.055 -7.693 24.594 1.00 75.37 H new ATOM 0 HD1 PHE B 102 6.803 -5.567 25.353 1.00 74.72 H new ATOM 0 HD2 PHE B 102 10.491 -6.465 26.641 1.00 74.71 H new ATOM 0 HE1 PHE B 102 7.098 -3.372 26.030 1.00 74.49 H new ATOM 0 HE2 PHE B 102 10.796 -4.268 27.316 1.00 74.50 H new ATOM 0 HZ PHE B 102 9.097 -2.716 27.012 1.00 74.58 H new ATOM 1513 N ARG B 103 8.272 -10.750 26.777 1.00 78.65 N ATOM 1514 CA ARG B 103 8.283 -12.209 26.637 1.00 80.39 C ATOM 1515 C ARG B 103 6.986 -12.814 27.172 1.00 81.77 C ATOM 1516 O ARG B 103 6.385 -13.682 26.534 1.00 81.87 O ATOM 1517 CB ARG B 103 9.480 -12.806 27.380 1.00 80.22 C ATOM 1518 CG ARG B 103 9.685 -14.295 27.150 1.00 80.11 C ATOM 1519 CD ARG B 103 10.503 -14.916 28.268 1.00 79.86 C ATOM 1520 NE ARG B 103 11.255 -16.082 27.808 1.00 79.78 N ATOM 1521 CZ ARG B 103 11.930 -16.910 28.601 1.00 79.73 C ATOM 1522 NH1 ARG B 103 11.949 -16.721 29.915 1.00 79.79 N ATOM 1523 NH2 ARG B 103 12.585 -17.938 28.079 1.00 79.60 N ATOM 0 H ARG B 103 8.825 -10.454 27.365 1.00 78.65 H new ATOM 0 HA ARG B 103 8.358 -12.421 25.693 1.00 80.39 H new ATOM 0 HB2 ARG B 103 10.283 -12.335 27.108 1.00 80.22 H new ATOM 0 HB3 ARG B 103 9.367 -12.649 28.331 1.00 80.22 H new ATOM 0 HG2 ARG B 103 8.824 -14.737 27.092 1.00 80.11 H new ATOM 0 HG3 ARG B 103 10.134 -14.435 26.301 1.00 80.11 H new ATOM 0 HD2 ARG B 103 11.117 -14.255 28.625 1.00 79.86 H new ATOM 0 HD3 ARG B 103 9.914 -15.177 28.993 1.00 79.86 H new ATOM 0 HE ARG B 103 11.262 -16.245 26.964 1.00 79.78 H new ATOM 0 HH11 ARG B 103 11.523 -16.059 30.260 1.00 79.79 H new ATOM 0 HH12 ARG B 103 12.388 -17.261 30.421 1.00 79.79 H new ATOM 0 HH21 ARG B 103 12.573 -18.069 27.229 1.00 79.60 H new ATOM 0 HH22 ARG B 103 13.022 -18.474 28.590 1.00 79.60 H new ATOM 1524 N GLU B 104 6.573 -12.347 28.350 1.00 83.54 N ATOM 1525 CA GLU B 104 5.347 -12.800 29.006 1.00 85.35 C ATOM 1526 C GLU B 104 4.107 -12.441 28.187 1.00 86.31 C ATOM 1527 O GLU B 104 3.157 -13.223 28.114 1.00 86.46 O ATOM 1528 CB GLU B 104 5.242 -12.205 30.416 1.00 85.29 C ATOM 1529 CG GLU B 104 6.342 -12.654 31.381 1.00 85.84 C ATOM 1530 CD GLU B 104 6.360 -11.863 32.684 1.00 85.96 C ATOM 1531 OE1 GLU B 104 5.723 -10.789 32.756 1.00 86.79 O ATOM 1532 OE2 GLU B 104 7.021 -12.317 33.643 1.00 86.81 O ATOM 0 H GLU B 104 7.003 -11.750 28.796 1.00 83.54 H new ATOM 0 HA GLU B 104 5.390 -13.767 29.074 1.00 85.35 H new ATOM 0 HB2 GLU B 104 5.263 -11.238 30.348 1.00 85.29 H new ATOM 0 HB3 GLU B 104 4.381 -12.445 30.792 1.00 85.29 H new ATOM 0 HG2 GLU B 104 6.222 -13.595 31.583 1.00 85.84 H new ATOM 0 HG3 GLU B 104 7.203 -12.565 30.944 1.00 85.84 H new ATOM 1533 N ALA B 105 4.133 -11.260 27.570 1.00 87.67 N ATOM 1534 CA ALA B 105 3.040 -10.788 26.720 1.00 88.95 C ATOM 1535 C ALA B 105 2.960 -11.550 25.395 1.00 89.87 C ATOM 1536 O ALA B 105 1.874 -11.721 24.839 1.00 90.02 O ATOM 1537 CB ALA B 105 3.172 -9.292 26.466 1.00 88.90 C ATOM 0 H ALA B 105 4.789 -10.707 27.633 1.00 87.67 H new ATOM 0 HA ALA B 105 2.213 -10.959 27.198 1.00 88.95 H new ATOM 0 HB1 ALA B 105 2.442 -8.994 25.902 1.00 88.90 H new ATOM 0 HB2 ALA B 105 3.143 -8.816 27.311 1.00 88.90 H new ATOM 0 HB3 ALA B 105 4.016 -9.112 26.023 1.00 88.90 H new ATOM 1538 N ALA B 106 4.112 -12.001 24.900 1.00 90.99 N ATOM 1539 CA ALA B 106 4.187 -12.741 23.640 1.00 92.03 C ATOM 1540 C ALA B 106 3.661 -14.170 23.767 1.00 92.74 C ATOM 1541 O ALA B 106 3.134 -14.729 22.804 1.00 92.89 O ATOM 1542 CB ALA B 106 5.616 -12.748 23.109 1.00 92.02 C ATOM 0 H ALA B 106 4.872 -11.887 25.285 1.00 90.99 H new ATOM 0 HA ALA B 106 3.613 -12.281 23.008 1.00 92.03 H new ATOM 0 HB1 ALA B 106 5.649 -13.242 22.275 1.00 92.02 H new ATOM 0 HB2 ALA B 106 5.909 -11.836 22.956 1.00 92.02 H new ATOM 0 HB3 ALA B 106 6.200 -13.171 23.758 1.00 92.02 H new ATOM 1543 N GLU B 107 3.806 -14.753 24.955 1.00 93.55 N ATOM 1544 CA GLU B 107 3.422 -16.145 25.187 1.00 94.28 C ATOM 1545 C GLU B 107 2.179 -16.257 26.069 1.00 94.42 C ATOM 1546 O GLU B 107 1.087 -16.550 25.580 1.00 94.55 O ATOM 1547 CB GLU B 107 4.590 -16.936 25.787 1.00 94.47 C ATOM 1548 CG GLU B 107 5.891 -16.811 24.997 1.00 95.47 C ATOM 1549 CD GLU B 107 6.874 -17.928 25.287 1.00 96.60 C ATOM 1550 OE1 GLU B 107 7.335 -18.570 24.321 1.00 97.06 O ATOM 1551 OE2 GLU B 107 7.186 -18.168 26.474 1.00 97.10 O ATOM 0 H GLU B 107 4.128 -14.356 25.646 1.00 93.55 H new ATOM 0 HA GLU B 107 3.197 -16.531 24.326 1.00 94.28 H new ATOM 0 HB2 GLU B 107 4.743 -16.632 26.695 1.00 94.47 H new ATOM 0 HB3 GLU B 107 4.342 -17.872 25.839 1.00 94.47 H new ATOM 0 HG2 GLU B 107 5.688 -16.805 24.049 1.00 95.47 H new ATOM 0 HG3 GLU B 107 6.308 -15.960 25.203 1.00 95.47 H new TER 1552 GLU B 107 ATOM 1553 N GLN C 4 24.946 30.853 23.597 1.00 42.06 N ATOM 1554 CA GLN C 4 25.804 29.767 23.032 1.00 41.93 C ATOM 1555 C GLN C 4 26.683 30.292 21.898 1.00 41.15 C ATOM 1556 O GLN C 4 26.175 30.780 20.884 1.00 41.34 O ATOM 1557 CB GLN C 4 24.946 28.597 22.528 1.00 42.34 C ATOM 1558 CG GLN C 4 24.152 27.849 23.608 1.00 44.24 C ATOM 1559 CD GLN C 4 25.017 26.963 24.505 1.00 46.67 C ATOM 1560 OE1 GLN C 4 26.142 26.602 24.155 1.00 47.40 O ATOM 1561 NE2 GLN C 4 24.486 26.610 25.672 1.00 47.50 N ATOM 0 HA GLN C 4 26.379 29.449 23.746 1.00 41.93 H new ATOM 0 HB2 GLN C 4 24.323 28.935 21.866 1.00 42.34 H new ATOM 0 HB3 GLN C 4 25.524 27.963 22.076 1.00 42.34 H new ATOM 0 HG2 GLN C 4 23.684 28.495 24.160 1.00 44.24 H new ATOM 0 HG3 GLN C 4 23.477 27.300 23.180 1.00 44.24 H new ATOM 0 HE21 GLN C 4 23.698 26.880 25.885 1.00 47.50 H new ATOM 0 HE22 GLN C 4 24.931 26.112 26.214 1.00 47.50 H new ATOM 1562 N SER C 5 28.000 30.197 22.077 1.00 39.89 N ATOM 1563 CA SER C 5 28.950 30.552 21.023 1.00 38.59 C ATOM 1564 C SER C 5 28.906 29.523 19.892 1.00 37.30 C ATOM 1565 O SER C 5 28.467 28.385 20.092 1.00 37.18 O ATOM 1566 CB SER C 5 30.370 30.675 21.588 1.00 38.84 C ATOM 1567 OG SER C 5 30.860 29.422 22.024 1.00 39.54 O ATOM 0 H SER C 5 28.366 29.927 22.807 1.00 39.89 H new ATOM 0 HA SER C 5 28.694 31.415 20.662 1.00 38.59 H new ATOM 0 HB2 SER C 5 30.960 31.037 20.909 1.00 38.84 H new ATOM 0 HB3 SER C 5 30.372 31.301 22.329 1.00 38.84 H new ATOM 0 HG SER C 5 31.638 29.515 22.327 1.00 39.54 H new ATOM 1568 N ALA C 6 29.362 29.934 18.710 1.00 35.75 N ATOM 1569 CA ALA C 6 29.315 29.099 17.508 1.00 34.28 C ATOM 1570 C ALA C 6 30.097 27.798 17.648 1.00 33.13 C ATOM 1571 O ALA C 6 30.985 27.683 18.488 1.00 32.83 O ATOM 1572 CB ALA C 6 29.808 29.889 16.293 1.00 34.18 C ATOM 0 H ALA C 6 29.710 30.710 18.581 1.00 35.75 H new ATOM 0 HA ALA C 6 28.386 28.850 17.381 1.00 34.28 H new ATOM 0 HB1 ALA C 6 29.772 29.326 15.504 1.00 34.18 H new ATOM 0 HB2 ALA C 6 29.243 30.666 16.161 1.00 34.18 H new ATOM 0 HB3 ALA C 6 30.722 30.177 16.443 1.00 34.18 H new ATOM 1573 N VAL C 7 29.748 26.819 16.821 1.00 31.91 N ATOM 1574 CA VAL C 7 30.500 25.572 16.743 1.00 30.74 C ATOM 1575 C VAL C 7 30.974 25.335 15.309 1.00 30.33 C ATOM 1576 O VAL C 7 30.209 25.493 14.353 1.00 30.30 O ATOM 1577 CB VAL C 7 29.699 24.352 17.311 1.00 30.82 C ATOM 1578 CG1 VAL C 7 28.303 24.248 16.698 1.00 30.16 C ATOM 1579 CG2 VAL C 7 30.481 23.035 17.148 1.00 30.11 C ATOM 0 H VAL C 7 29.072 26.858 16.291 1.00 31.91 H new ATOM 0 HA VAL C 7 31.281 25.658 17.311 1.00 30.74 H new ATOM 0 HB VAL C 7 29.584 24.509 18.261 1.00 30.82 H new ATOM 0 HG11 VAL C 7 27.840 23.483 17.074 1.00 30.16 H new ATOM 0 HG12 VAL C 7 27.803 25.056 16.893 1.00 30.16 H new ATOM 0 HG13 VAL C 7 28.379 24.139 15.737 1.00 30.16 H new ATOM 0 HG21 VAL C 7 29.959 22.302 17.509 1.00 30.11 H new ATOM 0 HG22 VAL C 7 30.654 22.876 16.207 1.00 30.11 H new ATOM 0 HG23 VAL C 7 31.323 23.097 17.626 1.00 30.11 H new ATOM 1580 N GLY C 8 32.249 24.993 15.173 1.00 29.63 N ATOM 1581 CA GLY C 8 32.814 24.587 13.892 1.00 28.79 C ATOM 1582 C GLY C 8 33.201 23.121 13.956 1.00 28.46 C ATOM 1583 O GLY C 8 33.699 22.642 14.979 1.00 28.12 O ATOM 0 H GLY C 8 32.813 24.990 15.822 1.00 29.63 H new ATOM 0 HA2 GLY C 8 32.169 24.731 13.182 1.00 28.79 H new ATOM 0 HA3 GLY C 8 33.591 25.129 13.683 1.00 28.79 H new ATOM 1584 N SER C 9 32.955 22.406 12.864 1.00 27.98 N ATOM 1585 CA SER C 9 33.257 20.983 12.794 1.00 27.77 C ATOM 1586 C SER C 9 33.892 20.672 11.450 1.00 27.40 C ATOM 1587 O SER C 9 33.369 21.057 10.406 1.00 27.69 O ATOM 1588 CB SER C 9 31.987 20.156 12.996 1.00 27.55 C ATOM 1589 OG SER C 9 32.292 18.780 13.162 1.00 27.91 O ATOM 0 H SER C 9 32.610 22.731 12.146 1.00 27.98 H new ATOM 0 HA SER C 9 33.879 20.751 13.501 1.00 27.77 H new ATOM 0 HB2 SER C 9 31.507 20.480 13.775 1.00 27.55 H new ATOM 0 HB3 SER C 9 31.399 20.270 12.233 1.00 27.55 H new ATOM 0 HG SER C 9 32.469 18.627 13.969 1.00 27.91 H new ATOM 1590 N ILE C 10 35.026 19.985 11.483 1.00 27.02 N ATOM 1591 CA ILE C 10 35.747 19.630 10.265 1.00 26.62 C ATOM 1592 C ILE C 10 36.162 18.167 10.341 1.00 26.68 C ATOM 1593 O ILE C 10 36.521 17.663 11.410 1.00 26.41 O ATOM 1594 CB ILE C 10 36.960 20.582 10.017 1.00 26.68 C ATOM 1595 CG1 ILE C 10 37.486 20.457 8.577 1.00 26.79 C ATOM 1596 CG2 ILE C 10 38.057 20.398 11.087 1.00 26.40 C ATOM 1597 CD1 ILE C 10 38.344 21.648 8.130 1.00 26.48 C ATOM 0 H ILE C 10 35.399 19.712 12.208 1.00 27.02 H new ATOM 0 HA ILE C 10 35.162 19.744 9.500 1.00 26.62 H new ATOM 0 HB ILE C 10 36.649 21.496 10.112 1.00 26.68 H new ATOM 0 HG12 ILE C 10 38.010 19.644 8.502 1.00 26.79 H new ATOM 0 HG13 ILE C 10 36.733 20.366 7.973 1.00 26.79 H new ATOM 0 HG21 ILE C 10 38.793 21.002 10.903 1.00 26.40 H new ATOM 0 HG22 ILE C 10 37.690 20.593 11.964 1.00 26.40 H new ATOM 0 HG23 ILE C 10 38.378 19.483 11.067 1.00 26.40 H new ATOM 0 HD11 ILE C 10 38.643 21.508 7.218 1.00 26.48 H new ATOM 0 HD12 ILE C 10 37.818 22.462 8.176 1.00 26.48 H new ATOM 0 HD13 ILE C 10 39.115 21.729 8.713 1.00 26.48 H new ATOM 1598 N GLU C 11 36.083 17.486 9.208 1.00 26.80 N ATOM 1599 CA GLU C 11 36.423 16.077 9.144 1.00 27.14 C ATOM 1600 C GLU C 11 37.360 15.817 7.972 1.00 27.10 C ATOM 1601 O GLU C 11 37.167 16.348 6.872 1.00 26.98 O ATOM 1602 CB GLU C 11 35.150 15.229 9.030 1.00 26.84 C ATOM 1603 CG GLU C 11 35.349 13.744 9.284 1.00 27.57 C ATOM 1604 CD GLU C 11 34.038 13.001 9.493 1.00 28.04 C ATOM 1605 OE1 GLU C 11 33.311 13.317 10.462 1.00 29.68 O ATOM 1606 OE2 GLU C 11 33.737 12.090 8.694 1.00 29.48 O ATOM 0 H GLU C 11 35.832 17.826 8.459 1.00 26.80 H new ATOM 0 HA GLU C 11 36.881 15.824 9.961 1.00 27.14 H new ATOM 0 HB2 GLU C 11 34.494 15.567 9.659 1.00 26.84 H new ATOM 0 HB3 GLU C 11 34.777 15.345 8.142 1.00 26.84 H new ATOM 0 HG2 GLU C 11 35.822 13.352 8.533 1.00 27.57 H new ATOM 0 HG3 GLU C 11 35.911 13.626 10.066 1.00 27.57 H new ATOM 1607 N THR C 12 38.375 14.999 8.221 1.00 27.09 N ATOM 1608 CA THR C 12 39.335 14.643 7.193 1.00 27.26 C ATOM 1609 C THR C 12 39.652 13.153 7.225 1.00 27.02 C ATOM 1610 O THR C 12 39.297 12.449 8.167 1.00 26.84 O ATOM 1611 CB THR C 12 40.640 15.476 7.317 1.00 27.55 C ATOM 1612 OG1 THR C 12 41.481 15.219 6.179 1.00 28.90 O ATOM 1613 CG2 THR C 12 41.394 15.140 8.600 1.00 27.25 C ATOM 0 H THR C 12 38.524 14.638 8.987 1.00 27.09 H new ATOM 0 HA THR C 12 38.927 14.850 6.338 1.00 27.26 H new ATOM 0 HB THR C 12 40.400 16.415 7.347 1.00 27.55 H new ATOM 0 HG1 THR C 12 41.005 15.138 5.491 1.00 28.90 H new ATOM 0 HG21 THR C 12 42.202 15.674 8.650 1.00 27.25 H new ATOM 0 HG22 THR C 12 40.831 15.333 9.366 1.00 27.25 H new ATOM 0 HG23 THR C 12 41.628 14.199 8.601 1.00 27.25 H new ATOM 1614 N ILE C 13 40.318 12.675 6.182 1.00 26.96 N ATOM 1615 CA ILE C 13 40.855 11.328 6.198 1.00 26.80 C ATOM 1616 C ILE C 13 42.286 11.351 6.764 1.00 26.25 C ATOM 1617 O ILE C 13 43.141 12.100 6.291 1.00 26.03 O ATOM 1618 CB ILE C 13 40.751 10.656 4.800 1.00 27.24 C ATOM 1619 CG1 ILE C 13 41.012 9.146 4.912 1.00 27.76 C ATOM 1620 CG2 ILE C 13 41.663 11.358 3.765 1.00 27.77 C ATOM 1621 CD1 ILE C 13 40.383 8.328 3.799 1.00 30.12 C ATOM 0 H ILE C 13 40.468 13.115 5.458 1.00 26.96 H new ATOM 0 HA ILE C 13 40.320 10.773 6.787 1.00 26.80 H new ATOM 0 HB ILE C 13 39.846 10.762 4.467 1.00 27.24 H new ATOM 0 HG12 ILE C 13 41.970 8.992 4.913 1.00 27.76 H new ATOM 0 HG13 ILE C 13 40.673 8.831 5.764 1.00 27.76 H new ATOM 0 HG21 ILE C 13 41.576 10.917 2.905 1.00 27.77 H new ATOM 0 HG22 ILE C 13 41.400 12.288 3.679 1.00 27.77 H new ATOM 0 HG23 ILE C 13 42.585 11.310 4.061 1.00 27.77 H new ATOM 0 HD11 ILE C 13 40.587 7.389 3.932 1.00 30.12 H new ATOM 0 HD12 ILE C 13 39.421 8.454 3.808 1.00 30.12 H new ATOM 0 HD13 ILE C 13 40.738 8.617 2.944 1.00 30.12 H new ATOM 1622 N GLY C 14 42.517 10.554 7.807 1.00 25.74 N ATOM 1623 CA GLY C 14 43.820 10.478 8.459 1.00 25.03 C ATOM 1624 C GLY C 14 43.985 11.429 9.634 1.00 24.61 C ATOM 1625 O GLY C 14 43.448 12.545 9.637 1.00 24.48 O ATOM 0 H GLY C 14 41.920 10.042 8.156 1.00 25.74 H new ATOM 0 HA2 GLY C 14 43.963 9.570 8.768 1.00 25.03 H new ATOM 0 HA3 GLY C 14 44.510 10.667 7.804 1.00 25.03 H new ATOM 1626 N PHE C 15 44.741 10.985 10.634 1.00 24.13 N ATOM 1627 CA PHE C 15 45.000 11.795 11.828 1.00 23.70 C ATOM 1628 C PHE C 15 45.942 12.984 11.594 1.00 23.47 C ATOM 1629 O PHE C 15 45.699 14.060 12.144 1.00 23.58 O ATOM 1630 CB PHE C 15 45.510 10.921 12.982 1.00 23.63 C ATOM 1631 CG PHE C 15 45.733 11.672 14.263 1.00 23.53 C ATOM 1632 CD1 PHE C 15 44.679 11.896 15.147 1.00 23.19 C ATOM 1633 CD2 PHE C 15 46.998 12.160 14.588 1.00 23.35 C ATOM 1634 CE1 PHE C 15 44.884 12.585 16.344 1.00 23.51 C ATOM 1635 CE2 PHE C 15 47.212 12.859 15.778 1.00 23.36 C ATOM 1636 CZ PHE C 15 46.152 13.071 16.657 1.00 23.55 C ATOM 0 H PHE C 15 45.117 10.212 10.643 1.00 24.13 H new ATOM 0 HA PHE C 15 44.143 12.182 12.068 1.00 23.70 H new ATOM 0 HB2 PHE C 15 44.872 10.208 13.142 1.00 23.63 H new ATOM 0 HB3 PHE C 15 46.343 10.501 12.714 1.00 23.63 H new ATOM 0 HD1 PHE C 15 43.829 11.583 14.937 1.00 23.19 H new ATOM 0 HD2 PHE C 15 47.708 12.018 14.005 1.00 23.35 H new ATOM 0 HE1 PHE C 15 44.176 12.719 16.931 1.00 23.51 H new ATOM 0 HE2 PHE C 15 48.060 13.182 15.983 1.00 23.36 H new ATOM 0 HZ PHE C 15 46.290 13.536 17.451 1.00 23.55 H new ATOM 1637 N PRO C 16 47.037 12.800 10.817 1.00 23.26 N ATOM 1638 CA PRO C 16 47.908 13.953 10.579 1.00 23.23 C ATOM 1639 C PRO C 16 47.166 15.192 10.074 1.00 23.49 C ATOM 1640 O PRO C 16 47.465 16.303 10.520 1.00 23.38 O ATOM 1641 CB PRO C 16 48.902 13.429 9.537 1.00 23.23 C ATOM 1642 CG PRO C 16 48.992 11.975 9.838 1.00 22.92 C ATOM 1643 CD PRO C 16 47.575 11.585 10.172 1.00 23.14 C ATOM 0 HA PRO C 16 48.325 14.262 11.399 1.00 23.23 H new ATOM 0 HB2 PRO C 16 48.588 13.587 8.633 1.00 23.23 H new ATOM 0 HB3 PRO C 16 49.765 13.864 9.617 1.00 23.23 H new ATOM 0 HG2 PRO C 16 49.329 11.475 9.078 1.00 22.92 H new ATOM 0 HG3 PRO C 16 49.593 11.802 10.580 1.00 22.92 H new ATOM 0 HD2 PRO C 16 47.071 11.348 9.378 1.00 23.14 H new ATOM 0 HD3 PRO C 16 47.544 10.819 10.767 1.00 23.14 H new ATOM 1644 N GLY C 17 46.194 14.997 9.182 1.00 23.77 N ATOM 1645 CA GLY C 17 45.370 16.094 8.667 1.00 23.67 C ATOM 1646 C GLY C 17 44.558 16.805 9.736 1.00 23.82 C ATOM 1647 O GLY C 17 44.412 18.026 9.695 1.00 23.89 O ATOM 0 H GLY C 17 45.993 14.226 8.858 1.00 23.77 H new ATOM 0 HA2 GLY C 17 45.944 16.740 8.226 1.00 23.67 H new ATOM 0 HA3 GLY C 17 44.766 15.745 7.993 1.00 23.67 H new ATOM 1648 N ILE C 18 44.035 16.053 10.703 1.00 24.00 N ATOM 1649 CA ILE C 18 43.250 16.666 11.781 1.00 24.17 C ATOM 1650 C ILE C 18 44.152 17.395 12.777 1.00 24.20 C ATOM 1651 O ILE C 18 43.747 18.402 13.357 1.00 24.50 O ATOM 1652 CB ILE C 18 42.271 15.663 12.478 1.00 24.28 C ATOM 1653 CG1 ILE C 18 40.984 16.378 12.909 1.00 24.37 C ATOM 1654 CG2 ILE C 18 42.925 14.933 13.657 1.00 23.73 C ATOM 1655 CD1 ILE C 18 40.076 16.799 11.735 1.00 24.34 C ATOM 0 H ILE C 18 44.119 15.199 10.756 1.00 24.00 H new ATOM 0 HA ILE C 18 42.679 17.331 11.367 1.00 24.17 H new ATOM 0 HB ILE C 18 42.041 14.983 11.826 1.00 24.28 H new ATOM 0 HG12 ILE C 18 40.483 15.794 13.500 1.00 24.37 H new ATOM 0 HG13 ILE C 18 41.220 17.167 13.422 1.00 24.37 H new ATOM 0 HG21 ILE C 18 42.284 14.324 14.057 1.00 23.73 H new ATOM 0 HG22 ILE C 18 43.693 14.432 13.342 1.00 23.73 H new ATOM 0 HG23 ILE C 18 43.212 15.581 14.320 1.00 23.73 H new ATOM 0 HD11 ILE C 18 39.285 17.243 12.080 1.00 24.34 H new ATOM 0 HD12 ILE C 18 40.559 17.407 11.154 1.00 24.34 H new ATOM 0 HD13 ILE C 18 39.811 16.013 11.232 1.00 24.34 H new ATOM 1656 N LEU C 19 45.372 16.883 12.954 1.00 24.26 N ATOM 1657 CA LEU C 19 46.395 17.541 13.763 1.00 24.10 C ATOM 1658 C LEU C 19 46.798 18.884 13.145 1.00 24.24 C ATOM 1659 O LEU C 19 46.899 19.891 13.848 1.00 24.46 O ATOM 1660 CB LEU C 19 47.620 16.630 13.934 1.00 24.14 C ATOM 1661 CG LEU C 19 48.903 17.206 14.556 1.00 24.28 C ATOM 1662 CD1 LEU C 19 48.659 17.713 15.978 1.00 23.42 C ATOM 1663 CD2 LEU C 19 50.036 16.179 14.535 1.00 23.67 C ATOM 0 H LEU C 19 45.629 16.140 12.605 1.00 24.26 H new ATOM 0 HA LEU C 19 46.021 17.714 14.641 1.00 24.10 H new ATOM 0 HB2 LEU C 19 47.347 15.873 14.476 1.00 24.14 H new ATOM 0 HB3 LEU C 19 47.851 16.283 13.058 1.00 24.14 H new ATOM 0 HG LEU C 19 49.171 17.964 14.013 1.00 24.28 H new ATOM 0 HD11 LEU C 19 49.485 18.069 16.341 1.00 23.42 H new ATOM 0 HD12 LEU C 19 47.986 18.411 15.962 1.00 23.42 H new ATOM 0 HD13 LEU C 19 48.351 16.981 16.534 1.00 23.42 H new ATOM 0 HD21 LEU C 19 50.832 16.567 14.932 1.00 23.67 H new ATOM 0 HD22 LEU C 19 49.772 15.395 15.041 1.00 23.67 H new ATOM 0 HD23 LEU C 19 50.224 15.923 13.618 1.00 23.67 H new ATOM 1664 N ALA C 20 47.015 18.891 11.831 1.00 24.33 N ATOM 1665 CA ALA C 20 47.342 20.110 11.096 1.00 24.40 C ATOM 1666 C ALA C 20 46.216 21.147 11.167 1.00 24.60 C ATOM 1667 O ALA C 20 46.468 22.340 11.373 1.00 24.90 O ATOM 1668 CB ALA C 20 47.674 19.782 9.654 1.00 24.45 C ATOM 0 H ALA C 20 46.976 18.186 11.340 1.00 24.33 H new ATOM 0 HA ALA C 20 48.121 20.504 11.519 1.00 24.40 H new ATOM 0 HB1 ALA C 20 47.889 20.599 9.177 1.00 24.45 H new ATOM 0 HB2 ALA C 20 48.435 19.182 9.626 1.00 24.45 H new ATOM 0 HB3 ALA C 20 46.910 19.355 9.235 1.00 24.45 H new ATOM 1669 N ALA C 21 44.979 20.689 10.992 1.00 24.75 N ATOM 1670 CA ALA C 21 43.811 21.559 11.114 1.00 24.85 C ATOM 1671 C ALA C 21 43.709 22.128 12.530 1.00 25.09 C ATOM 1672 O ALA C 21 43.508 23.323 12.699 1.00 25.20 O ATOM 1673 CB ALA C 21 42.536 20.807 10.748 1.00 24.52 C ATOM 0 H ALA C 21 44.793 19.871 10.801 1.00 24.75 H new ATOM 0 HA ALA C 21 43.918 22.297 10.494 1.00 24.85 H new ATOM 0 HB1 ALA C 21 41.774 21.400 10.835 1.00 24.52 H new ATOM 0 HB2 ALA C 21 42.597 20.492 9.833 1.00 24.52 H new ATOM 0 HB3 ALA C 21 42.425 20.049 11.343 1.00 24.52 H new ATOM 1674 N ALA C 22 43.855 21.270 13.539 1.00 25.35 N ATOM 1675 CA ALA C 22 43.763 21.698 14.936 1.00 25.68 C ATOM 1676 C ALA C 22 44.685 22.871 15.231 1.00 26.02 C ATOM 1677 O ALA C 22 44.237 23.896 15.750 1.00 25.97 O ATOM 1678 CB ALA C 22 44.061 20.537 15.876 1.00 25.40 C ATOM 0 H ALA C 22 44.009 20.430 13.435 1.00 25.35 H new ATOM 0 HA ALA C 22 42.852 21.996 15.087 1.00 25.68 H new ATOM 0 HB1 ALA C 22 43.995 20.840 16.795 1.00 25.40 H new ATOM 0 HB2 ALA C 22 43.420 19.825 15.724 1.00 25.40 H new ATOM 0 HB3 ALA C 22 44.957 20.206 15.708 1.00 25.40 H new ATOM 1679 N ASP C 23 45.964 22.717 14.882 1.00 26.49 N ATOM 1680 CA ASP C 23 46.977 23.719 15.186 1.00 27.11 C ATOM 1681 C ASP C 23 46.768 25.031 14.430 1.00 27.28 C ATOM 1682 O ASP C 23 46.987 26.106 14.986 1.00 27.37 O ATOM 1683 CB ASP C 23 48.384 23.173 14.931 1.00 27.16 C ATOM 1684 CG ASP C 23 49.463 24.066 15.509 1.00 27.77 C ATOM 1685 OD1 ASP C 23 49.515 24.220 16.746 1.00 28.77 O ATOM 1686 OD2 ASP C 23 50.258 24.618 14.726 1.00 28.91 O ATOM 0 H ASP C 23 46.264 22.029 14.463 1.00 26.49 H new ATOM 0 HA ASP C 23 46.882 23.921 16.130 1.00 27.11 H new ATOM 0 HB2 ASP C 23 48.459 22.287 15.318 1.00 27.16 H new ATOM 0 HB3 ASP C 23 48.523 23.078 13.976 1.00 27.16 H new ATOM 1687 N ALA C 24 46.353 24.937 13.169 1.00 27.62 N ATOM 1688 CA ALA C 24 46.097 26.126 12.356 1.00 27.85 C ATOM 1689 C ALA C 24 44.879 26.890 12.865 1.00 28.16 C ATOM 1690 O ALA C 24 44.907 28.110 12.943 1.00 27.99 O ATOM 1691 CB ALA C 24 45.911 25.749 10.896 1.00 27.65 C ATOM 0 H ALA C 24 46.213 24.192 12.763 1.00 27.62 H new ATOM 0 HA ALA C 24 46.870 26.707 12.430 1.00 27.85 H new ATOM 0 HB1 ALA C 24 45.743 26.549 10.374 1.00 27.65 H new ATOM 0 HB2 ALA C 24 46.714 25.313 10.569 1.00 27.65 H new ATOM 0 HB3 ALA C 24 45.158 25.144 10.811 1.00 27.65 H new ATOM 1692 N MET C 25 43.820 26.160 13.216 1.00 28.78 N ATOM 1693 CA MET C 25 42.559 26.760 13.670 1.00 29.56 C ATOM 1694 C MET C 25 42.714 27.584 14.949 1.00 29.67 C ATOM 1695 O MET C 25 42.276 28.738 15.003 1.00 29.76 O ATOM 1696 CB MET C 25 41.477 25.686 13.856 1.00 29.34 C ATOM 1697 CG MET C 25 41.038 25.015 12.555 1.00 29.60 C ATOM 1698 SD MET C 25 39.968 23.578 12.806 1.00 31.03 S ATOM 1699 CE MET C 25 38.409 24.200 12.183 1.00 31.39 C ATOM 0 H MET C 25 43.811 25.300 13.198 1.00 28.78 H new ATOM 0 HA MET C 25 42.283 27.374 12.971 1.00 29.56 H new ATOM 0 HB2 MET C 25 41.809 25.007 14.463 1.00 29.34 H new ATOM 0 HB3 MET C 25 40.703 26.090 14.278 1.00 29.34 H new ATOM 0 HG2 MET C 25 40.571 25.665 12.007 1.00 29.60 H new ATOM 0 HG3 MET C 25 41.826 24.740 12.060 1.00 29.60 H new ATOM 0 HE1 MET C 25 37.682 23.663 12.536 1.00 31.39 H new ATOM 0 HE2 MET C 25 38.294 25.122 12.461 1.00 31.39 H new ATOM 0 HE3 MET C 25 38.405 24.152 11.214 1.00 31.39 H new ATOM 1700 N VAL C 26 43.348 26.998 15.967 1.00 29.91 N ATOM 1701 CA VAL C 26 43.518 27.672 17.259 1.00 30.32 C ATOM 1702 C VAL C 26 44.508 28.849 17.191 1.00 30.70 C ATOM 1703 O VAL C 26 44.422 29.784 17.994 1.00 30.93 O ATOM 1704 CB VAL C 26 43.873 26.661 18.396 1.00 30.29 C ATOM 1705 CG1 VAL C 26 45.281 26.100 18.224 1.00 29.97 C ATOM 1706 CG2 VAL C 26 43.697 27.294 19.772 1.00 30.14 C ATOM 0 H VAL C 26 43.688 26.209 15.931 1.00 29.91 H new ATOM 0 HA VAL C 26 42.659 28.062 17.483 1.00 30.32 H new ATOM 0 HB VAL C 26 43.252 25.918 18.330 1.00 30.29 H new ATOM 0 HG11 VAL C 26 45.472 25.477 18.943 1.00 29.97 H new ATOM 0 HG12 VAL C 26 45.344 25.639 17.373 1.00 29.97 H new ATOM 0 HG13 VAL C 26 45.924 26.826 18.247 1.00 29.97 H new ATOM 0 HG21 VAL C 26 43.923 26.646 20.458 1.00 30.14 H new ATOM 0 HG22 VAL C 26 44.280 28.065 19.851 1.00 30.14 H new ATOM 0 HG23 VAL C 26 42.775 27.574 19.884 1.00 30.14 H new ATOM 1707 N LYS C 27 45.424 28.808 16.225 1.00 31.00 N ATOM 1708 CA LYS C 27 46.378 29.897 16.020 1.00 31.41 C ATOM 1709 C LYS C 27 45.798 31.050 15.198 1.00 31.71 C ATOM 1710 O LYS C 27 46.129 32.212 15.436 1.00 31.63 O ATOM 1711 CB LYS C 27 47.670 29.377 15.386 1.00 31.33 C ATOM 1712 CG LYS C 27 48.614 28.718 16.382 1.00 31.35 C ATOM 1713 CD LYS C 27 49.744 27.990 15.678 1.00 31.27 C ATOM 1714 CE LYS C 27 50.728 27.403 16.678 1.00 31.21 C ATOM 1715 NZ LYS C 27 51.697 26.493 16.007 1.00 30.71 N ATOM 0 H LYS C 27 45.510 28.153 15.674 1.00 31.00 H new ATOM 0 HA LYS C 27 46.581 30.255 16.898 1.00 31.41 H new ATOM 0 HB2 LYS C 27 47.446 28.738 14.692 1.00 31.33 H new ATOM 0 HB3 LYS C 27 48.130 30.114 14.955 1.00 31.33 H new ATOM 0 HG2 LYS C 27 48.981 29.391 16.976 1.00 31.35 H new ATOM 0 HG3 LYS C 27 48.119 28.093 16.934 1.00 31.35 H new ATOM 0 HD2 LYS C 27 49.380 27.281 15.124 1.00 31.27 H new ATOM 0 HD3 LYS C 27 50.208 28.603 15.086 1.00 31.27 H new ATOM 0 HE2 LYS C 27 51.207 28.119 17.123 1.00 31.21 H new ATOM 0 HE3 LYS C 27 50.245 26.916 17.364 1.00 31.21 H new ATOM 0 HZ1 LYS C 27 52.072 25.960 16.613 1.00 30.71 H new ATOM 0 HZ2 LYS C 27 51.271 25.999 15.401 1.00 30.71 H new ATOM 0 HZ3 LYS C 27 52.328 26.975 15.605 1.00 30.71 H new ATOM 1716 N ALA C 28 44.927 30.725 14.245 1.00 32.04 N ATOM 1717 CA ALA C 28 44.349 31.729 13.346 1.00 32.44 C ATOM 1718 C ALA C 28 43.180 32.501 13.954 1.00 32.57 C ATOM 1719 O ALA C 28 43.007 33.683 13.670 1.00 32.87 O ATOM 1720 CB ALA C 28 43.932 31.090 12.037 1.00 32.35 C ATOM 0 H ALA C 28 44.654 29.922 14.100 1.00 32.04 H new ATOM 0 HA ALA C 28 45.050 32.380 13.186 1.00 32.44 H new ATOM 0 HB1 ALA C 28 43.552 31.765 11.454 1.00 32.35 H new ATOM 0 HB2 ALA C 28 44.707 30.693 11.609 1.00 32.35 H new ATOM 0 HB3 ALA C 28 43.270 30.402 12.209 1.00 32.35 H new ATOM 1721 N GLY C 29 42.376 31.829 14.772 1.00 32.66 N ATOM 1722 CA GLY C 29 41.215 32.461 15.394 1.00 32.75 C ATOM 1723 C GLY C 29 41.163 32.316 16.903 1.00 32.67 C ATOM 1724 O GLY C 29 41.837 31.460 17.490 1.00 32.82 O ATOM 0 H GLY C 29 42.485 31.002 14.981 1.00 32.66 H new ATOM 0 HA2 GLY C 29 41.214 33.405 15.170 1.00 32.75 H new ATOM 0 HA3 GLY C 29 40.409 32.078 15.014 1.00 32.75 H new ATOM 1725 N ARG C 30 40.343 33.155 17.527 1.00 32.30 N ATOM 1726 CA ARG C 30 40.129 33.109 18.968 1.00 32.03 C ATOM 1727 C ARG C 30 39.070 32.051 19.263 1.00 31.95 C ATOM 1728 O ARG C 30 37.913 32.362 19.543 1.00 32.21 O ATOM 1729 CB ARG C 30 39.721 34.488 19.495 1.00 31.79 C ATOM 1730 CG ARG C 30 40.741 35.575 19.185 1.00 31.85 C ATOM 1731 CD ARG C 30 40.387 36.897 19.843 1.00 31.28 C ATOM 1732 NE ARG C 30 41.412 37.906 19.590 1.00 30.90 N ATOM 1733 CZ ARG C 30 41.336 38.847 18.653 1.00 30.63 C ATOM 1734 NH1 ARG C 30 40.272 38.925 17.863 1.00 30.51 N ATOM 1735 NH2 ARG C 30 42.326 39.718 18.511 1.00 30.22 N ATOM 0 H ARG C 30 39.894 33.769 17.125 1.00 32.30 H new ATOM 0 HA ARG C 30 40.951 32.868 19.424 1.00 32.03 H new ATOM 0 HB2 ARG C 30 38.866 34.735 19.109 1.00 31.79 H new ATOM 0 HB3 ARG C 30 39.594 34.436 20.455 1.00 31.79 H new ATOM 0 HG2 ARG C 30 41.618 35.290 19.487 1.00 31.85 H new ATOM 0 HG3 ARG C 30 40.798 35.698 18.225 1.00 31.85 H new ATOM 0 HD2 ARG C 30 39.532 37.210 19.507 1.00 31.28 H new ATOM 0 HD3 ARG C 30 40.286 36.768 20.799 1.00 31.28 H new ATOM 0 HE ARG C 30 42.116 37.891 20.083 1.00 30.90 H new ATOM 0 HH11 ARG C 30 39.626 38.365 17.955 1.00 30.51 H new ATOM 0 HH12 ARG C 30 40.229 39.536 17.259 1.00 30.51 H new ATOM 0 HH21 ARG C 30 43.015 39.673 19.024 1.00 30.22 H new ATOM 0 HH22 ARG C 30 42.279 40.327 17.906 1.00 30.22 H new ATOM 1736 N ILE C 31 39.478 30.790 19.165 1.00 31.83 N ATOM 1737 CA ILE C 31 38.566 29.662 19.318 1.00 31.43 C ATOM 1738 C ILE C 31 39.109 28.665 20.331 1.00 31.05 C ATOM 1739 O ILE C 31 40.288 28.708 20.679 1.00 31.06 O ATOM 1740 CB ILE C 31 38.268 28.949 17.953 1.00 31.46 C ATOM 1741 CG1 ILE C 31 39.543 28.375 17.316 1.00 31.24 C ATOM 1742 CG2 ILE C 31 37.566 29.905 16.979 1.00 31.67 C ATOM 1743 CD1 ILE C 31 39.872 26.954 17.724 1.00 31.32 C ATOM 0 H ILE C 31 40.293 30.564 19.008 1.00 31.83 H new ATOM 0 HA ILE C 31 37.726 30.019 19.646 1.00 31.43 H new ATOM 0 HB ILE C 31 37.674 28.206 18.142 1.00 31.46 H new ATOM 0 HG12 ILE C 31 39.450 28.408 16.351 1.00 31.24 H new ATOM 0 HG13 ILE C 31 40.291 28.947 17.549 1.00 31.24 H new ATOM 0 HG21 ILE C 31 37.391 29.445 16.143 1.00 31.67 H new ATOM 0 HG22 ILE C 31 36.727 30.202 17.365 1.00 31.67 H new ATOM 0 HG23 ILE C 31 38.135 30.673 16.812 1.00 31.67 H new ATOM 0 HD11 ILE C 31 40.686 26.670 17.280 1.00 31.32 H new ATOM 0 HD12 ILE C 31 39.997 26.914 18.685 1.00 31.32 H new ATOM 0 HD13 ILE C 31 39.143 26.367 17.469 1.00 31.32 H new ATOM 1744 N THR C 32 38.242 27.767 20.789 1.00 30.47 N ATOM 1745 CA THR C 32 38.636 26.689 21.681 1.00 29.88 C ATOM 1746 C THR C 32 38.353 25.345 21.019 1.00 29.22 C ATOM 1747 O THR C 32 37.234 25.093 20.558 1.00 29.09 O ATOM 1748 CB THR C 32 37.892 26.790 23.028 1.00 30.01 C ATOM 1749 OG1 THR C 32 38.154 28.069 23.616 1.00 31.08 O ATOM 1750 CG2 THR C 32 38.355 25.712 23.992 1.00 30.18 C ATOM 0 H THR C 32 37.406 27.768 20.589 1.00 30.47 H new ATOM 0 HA THR C 32 39.587 26.764 21.858 1.00 29.88 H new ATOM 0 HB THR C 32 36.944 26.675 22.860 1.00 30.01 H new ATOM 0 HG1 THR C 32 37.456 28.536 23.593 1.00 31.08 H new ATOM 0 HG21 THR C 32 37.873 25.798 24.829 1.00 30.18 H new ATOM 0 HG22 THR C 32 38.182 24.838 23.608 1.00 30.18 H new ATOM 0 HG23 THR C 32 39.306 25.811 24.156 1.00 30.18 H new ATOM 1751 N ILE C 33 39.377 24.496 20.953 1.00 28.28 N ATOM 1752 CA ILE C 33 39.203 23.114 20.510 1.00 27.42 C ATOM 1753 C ILE C 33 38.558 22.344 21.662 1.00 26.98 C ATOM 1754 O ILE C 33 39.129 22.272 22.757 1.00 26.60 O ATOM 1755 CB ILE C 33 40.551 22.453 20.117 1.00 27.44 C ATOM 1756 CG1 ILE C 33 41.240 23.241 18.999 1.00 27.23 C ATOM 1757 CG2 ILE C 33 40.331 21.000 19.683 1.00 27.17 C ATOM 1758 CD1 ILE C 33 42.724 22.931 18.843 1.00 27.24 C ATOM 0 H ILE C 33 40.185 24.702 21.162 1.00 28.28 H new ATOM 0 HA ILE C 33 38.645 23.098 19.717 1.00 27.42 H new ATOM 0 HB ILE C 33 41.128 22.461 20.897 1.00 27.44 H new ATOM 0 HG12 ILE C 33 40.790 23.054 18.160 1.00 27.23 H new ATOM 0 HG13 ILE C 33 41.134 24.190 19.172 1.00 27.23 H new ATOM 0 HG21 ILE C 33 41.182 20.602 19.441 1.00 27.17 H new ATOM 0 HG22 ILE C 33 39.937 20.500 20.415 1.00 27.17 H new ATOM 0 HG23 ILE C 33 39.735 20.977 18.918 1.00 27.17 H new ATOM 0 HD11 ILE C 33 43.092 23.464 18.121 1.00 27.24 H new ATOM 0 HD12 ILE C 33 43.187 23.142 19.668 1.00 27.24 H new ATOM 0 HD13 ILE C 33 42.839 21.989 18.641 1.00 27.24 H new ATOM 1759 N VAL C 34 37.368 21.793 21.426 1.00 26.21 N ATOM 1760 CA VAL C 34 36.623 21.125 22.501 1.00 25.93 C ATOM 1761 C VAL C 34 36.736 19.597 22.487 1.00 25.67 C ATOM 1762 O VAL C 34 36.517 18.946 23.503 1.00 25.76 O ATOM 1763 CB VAL C 34 35.141 21.567 22.570 1.00 25.82 C ATOM 1764 CG1 VAL C 34 35.050 23.023 22.988 1.00 26.01 C ATOM 1765 CG2 VAL C 34 34.423 21.330 21.237 1.00 25.73 C ATOM 0 H VAL C 34 36.976 21.793 20.661 1.00 26.21 H new ATOM 0 HA VAL C 34 37.062 21.424 23.313 1.00 25.93 H new ATOM 0 HB VAL C 34 34.693 21.024 23.238 1.00 25.82 H new ATOM 0 HG11 VAL C 34 34.119 23.291 23.028 1.00 26.01 H new ATOM 0 HG12 VAL C 34 35.456 23.135 23.862 1.00 26.01 H new ATOM 0 HG13 VAL C 34 35.517 23.575 22.342 1.00 26.01 H new ATOM 0 HG21 VAL C 34 33.499 21.616 21.312 1.00 25.73 H new ATOM 0 HG22 VAL C 34 34.863 21.838 20.538 1.00 25.73 H new ATOM 0 HG23 VAL C 34 34.452 20.386 21.017 1.00 25.73 H new ATOM 1766 N GLY C 35 37.083 19.030 21.340 1.00 25.28 N ATOM 1767 CA GLY C 35 37.287 17.593 21.253 1.00 24.63 C ATOM 1768 C GLY C 35 37.529 17.145 19.832 1.00 24.32 C ATOM 1769 O GLY C 35 37.479 17.951 18.901 1.00 24.12 O ATOM 0 H GLY C 35 37.205 19.457 20.604 1.00 25.28 H new ATOM 0 HA2 GLY C 35 38.043 17.340 21.805 1.00 24.63 H new ATOM 0 HA3 GLY C 35 36.510 17.134 21.609 1.00 24.63 H new ATOM 1770 N TYR C 36 37.808 15.853 19.678 1.00 23.84 N ATOM 1771 CA TYR C 36 37.966 15.242 18.375 1.00 23.48 C ATOM 1772 C TYR C 36 37.273 13.892 18.387 1.00 23.66 C ATOM 1773 O TYR C 36 37.070 13.297 19.449 1.00 23.50 O ATOM 1774 CB TYR C 36 39.449 15.095 18.005 1.00 23.41 C ATOM 1775 CG TYR C 36 40.141 13.869 18.574 1.00 22.93 C ATOM 1776 CD1 TYR C 36 40.461 12.790 17.758 1.00 22.94 C ATOM 1777 CD2 TYR C 36 40.481 13.798 19.927 1.00 22.71 C ATOM 1778 CE1 TYR C 36 41.094 11.655 18.274 1.00 22.66 C ATOM 1779 CE2 TYR C 36 41.114 12.677 20.452 1.00 22.53 C ATOM 1780 CZ TYR C 36 41.420 11.610 19.616 1.00 22.71 C ATOM 1781 OH TYR C 36 42.051 10.498 20.125 1.00 23.48 O ATOM 0 H TYR C 36 37.910 15.308 20.335 1.00 23.84 H new ATOM 0 HA TYR C 36 37.562 15.811 17.701 1.00 23.48 H new ATOM 0 HB2 TYR C 36 39.525 15.072 17.038 1.00 23.41 H new ATOM 0 HB3 TYR C 36 39.923 15.885 18.308 1.00 23.41 H new ATOM 0 HD1 TYR C 36 40.250 12.824 16.853 1.00 22.94 H new ATOM 0 HD2 TYR C 36 40.280 14.513 20.487 1.00 22.71 H new ATOM 0 HE1 TYR C 36 41.294 10.936 17.719 1.00 22.66 H new ATOM 0 HE2 TYR C 36 41.331 12.642 21.356 1.00 22.53 H new ATOM 0 HH TYR C 36 42.139 9.923 19.519 1.00 23.48 H new ATOM 1782 N ILE C 37 36.892 13.418 17.204 1.00 23.73 N ATOM 1783 CA ILE C 37 36.210 12.139 17.086 1.00 23.99 C ATOM 1784 C ILE C 37 36.974 11.233 16.146 1.00 24.39 C ATOM 1785 O ILE C 37 37.424 11.654 15.081 1.00 24.55 O ATOM 1786 CB ILE C 37 34.747 12.297 16.589 1.00 23.76 C ATOM 1787 CG1 ILE C 37 33.976 13.247 17.506 1.00 23.60 C ATOM 1788 CG2 ILE C 37 34.043 10.942 16.514 1.00 23.56 C ATOM 1789 CD1 ILE C 37 32.592 13.603 17.004 1.00 24.07 C ATOM 0 H ILE C 37 37.021 13.825 16.457 1.00 23.73 H new ATOM 0 HA ILE C 37 36.177 11.745 17.972 1.00 23.99 H new ATOM 0 HB ILE C 37 34.770 12.673 15.695 1.00 23.76 H new ATOM 0 HG12 ILE C 37 33.897 12.841 18.383 1.00 23.60 H new ATOM 0 HG13 ILE C 37 34.489 14.063 17.616 1.00 23.60 H new ATOM 0 HG21 ILE C 37 33.133 11.067 16.202 1.00 23.56 H new ATOM 0 HG22 ILE C 37 34.519 10.363 15.898 1.00 23.56 H new ATOM 0 HG23 ILE C 37 34.029 10.535 17.394 1.00 23.56 H new ATOM 0 HD11 ILE C 37 32.165 14.205 17.633 1.00 24.07 H new ATOM 0 HD12 ILE C 37 32.663 14.036 16.139 1.00 24.07 H new ATOM 0 HD13 ILE C 37 32.061 12.796 16.918 1.00 24.07 H new ATOM 1790 N ARG C 38 37.129 9.990 16.572 1.00 24.84 N ATOM 1791 CA ARG C 38 37.609 8.929 15.721 1.00 25.66 C ATOM 1792 C ARG C 38 36.350 8.349 15.076 1.00 25.89 C ATOM 1793 O ARG C 38 35.608 7.585 15.699 1.00 25.73 O ATOM 1794 CB ARG C 38 38.330 7.907 16.591 1.00 25.88 C ATOM 1795 CG ARG C 38 39.042 6.785 15.883 0.75 27.32 C ATOM 1796 CD ARG C 38 39.902 6.080 16.912 0.75 29.42 C ATOM 1797 NE ARG C 38 39.645 4.647 16.958 0.75 31.93 N ATOM 1798 CZ ARG C 38 39.566 3.934 18.079 0.75 32.75 C ATOM 1799 NH1 ARG C 38 39.699 4.521 19.262 0.75 33.25 N ATOM 1800 NH2 ARG C 38 39.330 2.631 18.016 0.75 32.72 N ATOM 0 H ARG C 38 36.955 9.740 17.376 1.00 24.84 H new ATOM 0 HA ARG C 38 38.237 9.218 15.041 1.00 25.66 H new ATOM 0 HB2 ARG C 38 38.979 8.379 17.135 1.00 25.88 H new ATOM 0 HB3 ARG C 38 37.681 7.517 17.198 1.00 25.88 H new ATOM 0 HG2 ARG C 38 38.404 6.169 15.490 0.75 27.32 H new ATOM 0 HG3 ARG C 38 39.588 7.129 15.159 0.75 27.32 H new ATOM 0 HD2 ARG C 38 40.838 6.232 16.708 0.75 29.42 H new ATOM 0 HD3 ARG C 38 39.737 6.465 17.787 0.75 29.42 H new ATOM 0 HE ARG C 38 39.537 4.234 16.211 0.75 31.93 H new ATOM 0 HH11 ARG C 38 39.837 5.369 19.308 0.75 33.25 H new ATOM 0 HH12 ARG C 38 39.647 4.054 19.982 0.75 33.25 H new ATOM 0 HH21 ARG C 38 39.228 2.249 17.252 0.75 32.72 H new ATOM 0 HH22 ARG C 38 39.278 2.168 18.739 0.75 32.72 H new ATOM 1801 N ALA C 39 36.109 8.750 13.831 1.00 26.24 N ATOM 1802 CA ALA C 39 34.827 8.529 13.163 1.00 26.66 C ATOM 1803 C ALA C 39 34.694 7.157 12.499 1.00 26.93 C ATOM 1804 O ALA C 39 33.595 6.758 12.116 1.00 27.33 O ATOM 1805 CB ALA C 39 34.571 9.641 12.148 1.00 26.66 C ATOM 0 H ALA C 39 36.688 9.161 13.346 1.00 26.24 H new ATOM 0 HA ALA C 39 34.152 8.548 13.859 1.00 26.66 H new ATOM 0 HB1 ALA C 39 33.720 9.489 11.709 1.00 26.66 H new ATOM 0 HB2 ALA C 39 34.551 10.497 12.604 1.00 26.66 H new ATOM 0 HB3 ALA C 39 35.280 9.645 11.486 1.00 26.66 H new ATOM 1806 N GLY C 40 35.804 6.433 12.383 1.00 26.88 N ATOM 1807 CA GLY C 40 35.819 5.166 11.652 1.00 26.74 C ATOM 1808 C GLY C 40 36.277 5.405 10.227 1.00 26.72 C ATOM 1809 O GLY C 40 36.172 6.520 9.715 1.00 26.91 O ATOM 0 H GLY C 40 36.562 6.658 12.721 1.00 26.88 H new ATOM 0 HA2 GLY C 40 36.412 4.536 12.091 1.00 26.74 H new ATOM 0 HA3 GLY C 40 34.933 4.770 11.655 1.00 26.74 H new ATOM 1810 N SER C 41 36.793 4.357 9.592 1.00 26.78 N ATOM 1811 CA SER C 41 37.350 4.435 8.232 1.00 26.88 C ATOM 1812 C SER C 41 38.510 5.426 8.105 1.00 26.53 C ATOM 1813 O SER C 41 38.679 6.073 7.067 1.00 26.52 O ATOM 1814 CB SER C 41 36.254 4.730 7.203 1.00 26.82 C ATOM 1815 OG SER C 41 35.365 3.631 7.121 1.00 28.29 O ATOM 0 H SER C 41 36.833 3.570 9.937 1.00 26.78 H new ATOM 0 HA SER C 41 37.724 3.560 8.044 1.00 26.88 H new ATOM 0 HB2 SER C 41 35.769 5.531 7.455 1.00 26.82 H new ATOM 0 HB3 SER C 41 36.651 4.901 6.335 1.00 26.82 H new ATOM 0 HG SER C 41 34.849 3.736 6.466 1.00 28.29 H new ATOM 1816 N ALA C 42 39.299 5.533 9.175 1.00 26.17 N ATOM 1817 CA ALA C 42 40.451 6.442 9.241 1.00 25.64 C ATOM 1818 C ALA C 42 40.072 7.917 9.137 1.00 25.34 C ATOM 1819 O ALA C 42 40.926 8.765 8.892 1.00 25.38 O ATOM 1820 CB ALA C 42 41.490 6.078 8.194 1.00 25.71 C ATOM 0 H ALA C 42 39.180 5.075 9.893 1.00 26.17 H new ATOM 0 HA ALA C 42 40.835 6.323 10.124 1.00 25.64 H new ATOM 0 HB1 ALA C 42 42.240 6.690 8.256 1.00 25.71 H new ATOM 0 HB2 ALA C 42 41.799 5.171 8.346 1.00 25.71 H new ATOM 0 HB3 ALA C 42 41.095 6.140 7.310 1.00 25.71 H new ATOM 1821 N ARG C 43 38.792 8.219 9.325 1.00 25.01 N ATOM 1822 CA ARG C 43 38.337 9.602 9.347 1.00 24.57 C ATOM 1823 C ARG C 43 38.305 10.155 10.768 1.00 24.19 C ATOM 1824 O ARG C 43 37.962 9.448 11.720 1.00 23.87 O ATOM 1825 CB ARG C 43 36.986 9.750 8.635 1.00 24.71 C ATOM 1826 CG ARG C 43 37.130 9.684 7.110 1.00 24.88 C ATOM 1827 CD ARG C 43 35.808 9.556 6.374 1.00 24.73 C ATOM 1828 NE ARG C 43 34.916 10.699 6.596 1.00 24.78 N ATOM 1829 CZ ARG C 43 34.073 11.184 5.685 1.00 24.54 C ATOM 1830 NH1 ARG C 43 34.010 10.652 4.468 1.00 23.90 N ATOM 1831 NH2 ARG C 43 33.302 12.217 5.988 1.00 24.10 N ATOM 0 H ARG C 43 38.171 7.636 9.442 1.00 25.01 H new ATOM 0 HA ARG C 43 38.979 10.137 8.854 1.00 24.57 H new ATOM 0 HB2 ARG C 43 36.386 9.049 8.933 1.00 24.71 H new ATOM 0 HB3 ARG C 43 36.581 10.595 8.884 1.00 24.71 H new ATOM 0 HG2 ARG C 43 37.586 10.483 6.802 1.00 24.88 H new ATOM 0 HG3 ARG C 43 37.693 8.929 6.879 1.00 24.88 H new ATOM 0 HD2 ARG C 43 35.980 9.466 5.424 1.00 24.73 H new ATOM 0 HD3 ARG C 43 35.362 8.743 6.660 1.00 24.73 H new ATOM 0 HE ARG C 43 34.939 11.082 7.366 1.00 24.78 H new ATOM 0 HH11 ARG C 43 34.516 9.988 4.262 1.00 23.90 H new ATOM 0 HH12 ARG C 43 33.463 10.972 3.887 1.00 23.90 H new ATOM 0 HH21 ARG C 43 33.347 12.572 6.770 1.00 24.10 H new ATOM 0 HH22 ARG C 43 32.757 12.533 5.403 1.00 24.10 H new ATOM 1832 N PHE C 44 38.700 11.416 10.897 1.00 23.86 N ATOM 1833 CA PHE C 44 38.758 12.091 12.188 1.00 23.73 C ATOM 1834 C PHE C 44 38.019 13.423 12.130 1.00 24.05 C ATOM 1835 O PHE C 44 38.142 14.171 11.156 1.00 23.98 O ATOM 1836 CB PHE C 44 40.216 12.294 12.630 1.00 23.26 C ATOM 1837 CG PHE C 44 40.917 11.017 13.026 1.00 22.55 C ATOM 1838 CD1 PHE C 44 40.902 10.581 14.349 1.00 22.10 C ATOM 1839 CD2 PHE C 44 41.585 10.247 12.076 1.00 21.43 C ATOM 1840 CE1 PHE C 44 41.546 9.402 14.724 1.00 21.53 C ATOM 1841 CE2 PHE C 44 42.225 9.058 12.436 1.00 21.53 C ATOM 1842 CZ PHE C 44 42.208 8.636 13.765 1.00 21.77 C ATOM 0 H PHE C 44 38.943 11.907 10.234 1.00 23.86 H new ATOM 0 HA PHE C 44 38.319 11.529 12.846 1.00 23.73 H new ATOM 0 HB2 PHE C 44 40.709 12.713 11.907 1.00 23.26 H new ATOM 0 HB3 PHE C 44 40.235 12.909 13.380 1.00 23.26 H new ATOM 0 HD1 PHE C 44 40.456 11.084 14.992 1.00 22.10 H new ATOM 0 HD2 PHE C 44 41.605 10.528 11.190 1.00 21.43 H new ATOM 0 HE1 PHE C 44 41.534 9.127 15.612 1.00 21.53 H new ATOM 0 HE2 PHE C 44 42.661 8.549 11.791 1.00 21.53 H new ATOM 0 HZ PHE C 44 42.636 7.848 14.011 1.00 21.77 H new ATOM 1843 N THR C 45 37.243 13.700 13.176 1.00 24.28 N ATOM 1844 CA THR C 45 36.493 14.946 13.285 1.00 24.48 C ATOM 1845 C THR C 45 37.130 15.831 14.347 1.00 24.73 C ATOM 1846 O THR C 45 37.568 15.336 15.388 1.00 24.87 O ATOM 1847 CB THR C 45 35.016 14.694 13.684 1.00 24.44 C ATOM 1848 OG1 THR C 45 34.464 13.629 12.897 1.00 25.09 O ATOM 1849 CG2 THR C 45 34.182 15.948 13.478 1.00 24.14 C ATOM 0 H THR C 45 37.137 13.168 13.843 1.00 24.28 H new ATOM 0 HA THR C 45 36.513 15.376 12.416 1.00 24.48 H new ATOM 0 HB THR C 45 34.997 14.450 14.623 1.00 24.44 H new ATOM 0 HG1 THR C 45 34.190 13.935 12.164 1.00 25.09 H new ATOM 0 HG21 THR C 45 33.263 15.771 13.733 1.00 24.14 H new ATOM 0 HG22 THR C 45 34.536 16.666 14.026 1.00 24.14 H new ATOM 0 HG23 THR C 45 34.214 16.208 12.544 1.00 24.14 H new ATOM 1850 N LEU C 46 37.190 17.130 14.078 1.00 24.81 N ATOM 1851 CA LEU C 46 37.587 18.097 15.079 1.00 25.27 C ATOM 1852 C LEU C 46 36.450 19.078 15.295 1.00 25.67 C ATOM 1853 O LEU C 46 35.875 19.592 14.331 1.00 25.64 O ATOM 1854 CB LEU C 46 38.856 18.857 14.664 1.00 25.14 C ATOM 1855 CG LEU C 46 39.540 19.633 15.802 1.00 24.92 C ATOM 1856 CD1 LEU C 46 40.442 18.718 16.652 1.00 22.91 C ATOM 1857 CD2 LEU C 46 40.322 20.801 15.253 1.00 24.72 C ATOM 0 H LEU C 46 37.001 17.470 13.311 1.00 24.81 H new ATOM 0 HA LEU C 46 37.785 17.622 15.901 1.00 25.27 H new ATOM 0 HB2 LEU C 46 39.491 18.224 14.293 1.00 25.14 H new ATOM 0 HB3 LEU C 46 38.629 19.479 13.955 1.00 25.14 H new ATOM 0 HG LEU C 46 38.844 19.976 16.385 1.00 24.92 H new ATOM 0 HD11 LEU C 46 40.857 19.238 17.358 1.00 22.91 H new ATOM 0 HD12 LEU C 46 39.907 18.010 17.044 1.00 22.91 H new ATOM 0 HD13 LEU C 46 41.131 18.330 16.090 1.00 22.91 H new ATOM 0 HD21 LEU C 46 40.746 21.279 15.983 1.00 24.72 H new ATOM 0 HD22 LEU C 46 41.001 20.477 14.641 1.00 24.72 H new ATOM 0 HD23 LEU C 46 39.722 21.399 14.781 1.00 24.72 H new ATOM 1858 N ASN C 47 36.145 19.335 16.564 1.00 26.09 N ATOM 1859 CA ASN C 47 35.098 20.274 16.947 1.00 26.67 C ATOM 1860 C ASN C 47 35.660 21.472 17.703 1.00 27.00 C ATOM 1861 O ASN C 47 36.458 21.312 18.629 1.00 26.72 O ATOM 1862 CB ASN C 47 34.025 19.564 17.777 1.00 26.41 C ATOM 1863 CG ASN C 47 33.385 18.409 17.024 1.00 27.07 C ATOM 1864 OD1 ASN C 47 32.840 18.705 15.854 1.00 28.42 O flip ATOM 1865 ND2 ASN C 47 33.399 17.255 17.482 1.00 26.35 N flip ATOM 0 H ASN C 47 36.543 18.966 17.231 1.00 26.09 H new ATOM 0 HA ASN C 47 34.693 20.612 16.133 1.00 26.67 H new ATOM 0 HB2 ASN C 47 34.421 19.232 18.598 1.00 26.41 H new ATOM 0 HB3 ASN C 47 33.340 20.202 18.030 1.00 26.41 H new ATOM 0 HD21 ASN C 47 33.762 17.100 18.246 1.00 26.35 H new ATOM 0 HD22 ASN C 47 33.046 16.611 17.035 1.00 26.35 H new ATOM 1866 N ILE C 48 35.246 22.668 17.288 1.00 27.51 N ATOM 1867 CA ILE C 48 35.717 23.911 17.898 1.00 28.04 C ATOM 1868 C ILE C 48 34.566 24.841 18.304 1.00 28.63 C ATOM 1869 O ILE C 48 33.462 24.757 17.758 1.00 28.69 O ATOM 1870 CB ILE C 48 36.736 24.664 16.984 1.00 28.04 C ATOM 1871 CG1 ILE C 48 36.058 25.200 15.718 1.00 27.86 C ATOM 1872 CG2 ILE C 48 37.943 23.759 16.646 1.00 27.99 C ATOM 1873 CD1 ILE C 48 36.861 26.265 14.977 1.00 28.12 C ATOM 0 H ILE C 48 34.685 22.782 16.646 1.00 27.51 H new ATOM 0 HA ILE C 48 36.179 23.649 18.710 1.00 28.04 H new ATOM 0 HB ILE C 48 37.071 25.431 17.475 1.00 28.04 H new ATOM 0 HG12 ILE C 48 35.891 24.459 15.115 1.00 27.86 H new ATOM 0 HG13 ILE C 48 35.194 25.570 15.959 1.00 27.86 H new ATOM 0 HG21 ILE C 48 38.563 24.244 16.079 1.00 27.99 H new ATOM 0 HG22 ILE C 48 38.392 23.498 17.466 1.00 27.99 H new ATOM 0 HG23 ILE C 48 37.633 22.966 16.181 1.00 27.99 H new ATOM 0 HD11 ILE C 48 36.370 26.553 14.192 1.00 28.12 H new ATOM 0 HD12 ILE C 48 37.009 27.024 15.562 1.00 28.12 H new ATOM 0 HD13 ILE C 48 37.716 25.895 14.705 1.00 28.12 H new ATOM 1874 N ARG C 49 34.833 25.717 19.271 1.00 29.21 N ATOM 1875 CA ARG C 49 33.851 26.695 19.728 1.00 29.85 C ATOM 1876 C ARG C 49 34.454 28.101 19.794 1.00 30.70 C ATOM 1877 O ARG C 49 35.659 28.263 19.975 1.00 30.56 O ATOM 1878 CB ARG C 49 33.272 26.303 21.094 1.00 29.47 C ATOM 1879 CG ARG C 49 32.580 24.933 21.160 1.00 28.80 C ATOM 1880 CD ARG C 49 31.228 24.876 20.434 1.00 27.83 C ATOM 1881 NE ARG C 49 30.255 25.839 20.953 1.00 27.41 N ATOM 1882 CZ ARG C 49 29.515 25.664 22.047 1.00 26.89 C ATOM 1883 NH1 ARG C 49 29.621 24.555 22.768 1.00 26.29 N ATOM 1884 NH2 ARG C 49 28.669 26.615 22.428 1.00 26.68 N ATOM 0 H ARG C 49 35.589 25.760 19.680 1.00 29.21 H new ATOM 0 HA ARG C 49 33.130 26.703 19.079 1.00 29.85 H new ATOM 0 HB2 ARG C 49 33.990 26.315 21.746 1.00 29.47 H new ATOM 0 HB3 ARG C 49 32.633 26.982 21.362 1.00 29.47 H new ATOM 0 HG2 ARG C 49 33.170 24.265 20.777 1.00 28.80 H new ATOM 0 HG3 ARG C 49 32.447 24.694 22.090 1.00 28.80 H new ATOM 0 HD2 ARG C 49 31.368 25.043 19.489 1.00 27.83 H new ATOM 0 HD3 ARG C 49 30.862 23.981 20.513 1.00 27.83 H new ATOM 0 HE ARG C 49 30.153 26.574 20.518 1.00 27.41 H new ATOM 0 HH11 ARG C 49 30.172 23.939 22.531 1.00 26.29 H new ATOM 0 HH12 ARG C 49 29.139 24.452 23.472 1.00 26.29 H new ATOM 0 HH21 ARG C 49 28.601 27.339 21.969 1.00 26.68 H new ATOM 0 HH22 ARG C 49 28.189 26.506 23.133 1.00 26.68 H new ATOM 1885 N GLY C 50 33.603 29.109 19.641 1.00 31.69 N ATOM 1886 CA GLY C 50 34.028 30.507 19.706 1.00 33.19 C ATOM 1887 C GLY C 50 33.026 31.410 19.016 1.00 34.33 C ATOM 1888 O GLY C 50 31.982 30.946 18.551 1.00 34.19 O ATOM 0 H GLY C 50 32.762 29.004 19.496 1.00 31.69 H new ATOM 0 HA2 GLY C 50 34.127 30.776 20.633 1.00 33.19 H new ATOM 0 HA3 GLY C 50 34.898 30.604 19.288 1.00 33.19 H new ATOM 1889 N ASP C 51 33.339 32.703 18.961 1.00 35.49 N ATOM 1890 CA ASP C 51 32.524 33.675 18.229 1.00 36.83 C ATOM 1891 C ASP C 51 32.431 33.257 16.764 1.00 36.95 C ATOM 1892 O ASP C 51 33.405 32.760 16.196 1.00 36.89 O ATOM 1893 CB ASP C 51 33.131 35.082 18.351 1.00 37.30 C ATOM 1894 CG ASP C 51 32.405 36.110 17.499 1.00 39.41 C ATOM 1895 OD1 ASP C 51 31.408 36.700 17.980 1.00 41.95 O ATOM 1896 OD2 ASP C 51 32.836 36.334 16.345 1.00 41.57 O ATOM 0 H ASP C 51 34.029 33.043 19.346 1.00 35.49 H new ATOM 0 HA ASP C 51 31.632 33.697 18.610 1.00 36.83 H new ATOM 0 HB2 ASP C 51 33.106 35.361 19.280 1.00 37.30 H new ATOM 0 HB3 ASP C 51 34.064 35.051 18.089 1.00 37.30 H new ATOM 1897 N VAL C 52 31.262 33.466 16.162 1.00 37.39 N ATOM 1898 CA VAL C 52 30.992 33.048 14.777 1.00 37.65 C ATOM 1899 C VAL C 52 32.065 33.479 13.760 1.00 37.63 C ATOM 1900 O VAL C 52 32.450 32.693 12.893 1.00 37.51 O ATOM 1901 CB VAL C 52 29.551 33.446 14.314 1.00 37.78 C ATOM 1902 CG1 VAL C 52 29.394 34.962 14.195 1.00 38.29 C ATOM 1903 CG2 VAL C 52 29.187 32.754 13.006 1.00 38.26 C ATOM 0 H VAL C 52 30.597 33.856 16.543 1.00 37.39 H new ATOM 0 HA VAL C 52 31.040 32.079 14.795 1.00 37.65 H new ATOM 0 HB VAL C 52 28.933 33.144 14.998 1.00 37.78 H new ATOM 0 HG11 VAL C 52 28.492 35.172 13.907 1.00 38.29 H new ATOM 0 HG12 VAL C 52 29.562 35.374 15.057 1.00 38.29 H new ATOM 0 HG13 VAL C 52 30.028 35.303 13.545 1.00 38.29 H new ATOM 0 HG21 VAL C 52 28.292 33.015 12.740 1.00 38.26 H new ATOM 0 HG22 VAL C 52 29.818 33.013 12.316 1.00 38.26 H new ATOM 0 HG23 VAL C 52 29.220 31.792 13.128 1.00 38.26 H new ATOM 1904 N GLN C 53 32.549 34.715 13.887 1.00 37.63 N ATOM 1905 CA GLN C 53 33.570 35.254 12.986 1.00 37.75 C ATOM 1906 C GLN C 53 34.941 34.622 13.224 1.00 36.89 C ATOM 1907 O GLN C 53 35.710 34.425 12.282 1.00 36.63 O ATOM 1908 CB GLN C 53 33.663 36.784 13.106 1.00 38.25 C ATOM 1909 CG GLN C 53 32.359 37.532 12.815 1.00 40.95 C ATOM 1910 CD GLN C 53 32.076 37.708 11.328 1.00 44.26 C ATOM 1911 OE1 GLN C 53 31.829 36.741 10.604 1.00 45.41 O ATOM 1912 NE2 GLN C 53 32.090 38.956 10.872 1.00 45.74 N ATOM 0 H GLN C 53 32.295 35.265 14.498 1.00 37.63 H new ATOM 0 HA GLN C 53 33.293 35.027 12.084 1.00 37.75 H new ATOM 0 HB2 GLN C 53 33.956 37.008 14.003 1.00 38.25 H new ATOM 0 HB3 GLN C 53 34.347 37.103 12.496 1.00 38.25 H new ATOM 0 HG2 GLN C 53 31.621 37.051 13.222 1.00 40.95 H new ATOM 0 HG3 GLN C 53 32.395 38.405 13.235 1.00 40.95 H new ATOM 0 HE21 GLN C 53 32.266 39.607 11.406 1.00 45.74 H new ATOM 0 HE22 GLN C 53 31.923 39.113 10.043 1.00 45.74 H new ATOM 1913 N GLU C 54 35.238 34.313 14.484 1.00 36.08 N ATOM 1914 CA GLU C 54 36.495 33.658 14.847 1.00 35.41 C ATOM 1915 C GLU C 54 36.524 32.210 14.361 1.00 34.74 C ATOM 1916 O GLU C 54 37.558 31.726 13.897 1.00 34.53 O ATOM 1917 CB GLU C 54 36.736 33.725 16.359 1.00 35.46 C ATOM 1918 CG GLU C 54 36.939 35.140 16.908 1.00 36.26 C ATOM 1919 CD GLU C 54 38.175 35.841 16.349 1.00 36.87 C ATOM 1920 OE1 GLU C 54 39.173 35.161 16.027 1.00 36.62 O ATOM 1921 OE2 GLU C 54 38.148 37.083 16.240 1.00 38.05 O ATOM 0 H GLU C 54 34.720 34.476 15.151 1.00 36.08 H new ATOM 0 HA GLU C 54 37.213 34.138 14.405 1.00 35.41 H new ATOM 0 HB2 GLU C 54 35.981 33.319 16.814 1.00 35.46 H new ATOM 0 HB3 GLU C 54 37.517 33.192 16.574 1.00 35.46 H new ATOM 0 HG2 GLU C 54 36.155 35.673 16.705 1.00 36.26 H new ATOM 0 HG3 GLU C 54 37.010 35.097 17.874 1.00 36.26 H new ATOM 1922 N VAL C 55 35.379 31.538 14.468 1.00 33.93 N ATOM 1923 CA VAL C 55 35.204 30.175 13.959 1.00 33.26 C ATOM 1924 C VAL C 55 35.347 30.152 12.431 1.00 32.99 C ATOM 1925 O VAL C 55 35.942 29.227 11.877 1.00 32.87 O ATOM 1926 CB VAL C 55 33.842 29.563 14.415 1.00 33.19 C ATOM 1927 CG1 VAL C 55 33.595 28.194 13.774 1.00 32.65 C ATOM 1928 CG2 VAL C 55 33.785 29.453 15.937 1.00 32.91 C ATOM 0 H VAL C 55 34.675 31.862 14.841 1.00 33.93 H new ATOM 0 HA VAL C 55 35.904 29.620 14.337 1.00 33.26 H new ATOM 0 HB VAL C 55 33.139 30.161 14.117 1.00 33.19 H new ATOM 0 HG11 VAL C 55 32.743 27.843 14.078 1.00 32.65 H new ATOM 0 HG12 VAL C 55 33.581 28.286 12.809 1.00 32.65 H new ATOM 0 HG13 VAL C 55 34.305 27.584 14.029 1.00 32.65 H new ATOM 0 HG21 VAL C 55 32.934 29.072 16.202 1.00 32.91 H new ATOM 0 HG22 VAL C 55 34.505 28.882 16.248 1.00 32.91 H new ATOM 0 HG23 VAL C 55 33.880 30.335 16.329 1.00 32.91 H new ATOM 1929 N LYS C 56 34.816 31.179 11.763 1.00 32.62 N ATOM 1930 CA LYS C 56 34.942 31.312 10.308 1.00 32.48 C ATOM 1931 C LYS C 56 36.403 31.452 9.874 1.00 31.99 C ATOM 1932 O LYS C 56 36.839 30.789 8.926 1.00 31.87 O ATOM 1933 CB LYS C 56 34.124 32.497 9.788 1.00 32.60 C ATOM 1934 CG LYS C 56 32.644 32.222 9.629 1.00 33.93 C ATOM 1935 CD LYS C 56 31.931 33.442 9.054 1.00 36.73 C ATOM 1936 CE LYS C 56 30.448 33.174 8.855 1.00 38.74 C ATOM 1937 NZ LYS C 56 29.741 34.379 8.317 1.00 40.53 N ATOM 0 H LYS C 56 34.375 31.815 12.138 1.00 32.62 H new ATOM 0 HA LYS C 56 34.590 30.496 9.919 1.00 32.48 H new ATOM 0 HB2 LYS C 56 34.238 33.245 10.395 1.00 32.60 H new ATOM 0 HB3 LYS C 56 34.484 32.771 8.930 1.00 32.60 H new ATOM 0 HG2 LYS C 56 32.512 31.459 9.045 1.00 33.93 H new ATOM 0 HG3 LYS C 56 32.259 31.991 10.489 1.00 33.93 H new ATOM 0 HD2 LYS C 56 32.048 34.198 9.650 1.00 36.73 H new ATOM 0 HD3 LYS C 56 32.334 33.685 8.206 1.00 36.73 H new ATOM 0 HE2 LYS C 56 30.332 32.429 8.244 1.00 38.74 H new ATOM 0 HE3 LYS C 56 30.049 32.913 9.700 1.00 38.74 H new ATOM 0 HZ1 LYS C 56 28.877 34.194 8.211 1.00 40.53 H new ATOM 0 HZ2 LYS C 56 29.831 35.056 8.888 1.00 40.53 H new ATOM 0 HZ3 LYS C 56 30.094 34.605 7.532 1.00 40.53 H new ATOM 1938 N THR C 57 37.145 32.314 10.573 1.00 31.28 N ATOM 1939 CA THR C 57 38.573 32.529 10.317 1.00 30.89 C ATOM 1940 C THR C 57 39.382 31.251 10.554 1.00 30.48 C ATOM 1941 O THR C 57 40.235 30.886 9.739 1.00 30.50 O ATOM 1942 CB THR C 57 39.136 33.663 11.200 1.00 30.85 C ATOM 1943 OG1 THR C 57 38.395 34.868 10.966 1.00 31.32 O ATOM 1944 CG2 THR C 57 40.606 33.920 10.886 1.00 31.14 C ATOM 0 H THR C 57 36.832 32.794 11.214 1.00 31.28 H new ATOM 0 HA THR C 57 38.656 32.784 9.385 1.00 30.89 H new ATOM 0 HB THR C 57 39.055 33.393 12.128 1.00 30.85 H new ATOM 0 HG1 THR C 57 37.628 34.795 11.300 1.00 31.32 H new ATOM 0 HG21 THR C 57 40.938 34.635 11.452 1.00 31.14 H new ATOM 0 HG22 THR C 57 41.118 33.113 11.052 1.00 31.14 H new ATOM 0 HG23 THR C 57 40.698 34.176 9.955 1.00 31.14 H new ATOM 1945 N ALA C 58 39.102 30.586 11.673 1.00 29.86 N ATOM 1946 CA ALA C 58 39.731 29.317 12.019 1.00 29.43 C ATOM 1947 C ALA C 58 39.434 28.240 10.979 1.00 29.07 C ATOM 1948 O ALA C 58 40.336 27.513 10.567 1.00 28.95 O ATOM 1949 CB ALA C 58 39.280 28.856 13.410 1.00 29.27 C ATOM 0 H ALA C 58 38.535 30.863 12.258 1.00 29.86 H new ATOM 0 HA ALA C 58 40.691 29.459 12.031 1.00 29.43 H new ATOM 0 HB1 ALA C 58 39.706 28.012 13.625 1.00 29.27 H new ATOM 0 HB2 ALA C 58 39.531 29.522 14.069 1.00 29.27 H new ATOM 0 HB3 ALA C 58 38.317 28.742 13.417 1.00 29.27 H new ATOM 1950 N MET C 59 38.173 28.148 10.555 1.00 28.85 N ATOM 1951 CA MET C 59 37.757 27.135 9.583 1.00 28.76 C ATOM 1952 C MET C 59 38.525 27.267 8.268 1.00 28.52 C ATOM 1953 O MET C 59 38.987 26.268 7.721 1.00 28.75 O ATOM 1954 CB MET C 59 36.241 27.178 9.347 1.00 28.79 C ATOM 1955 CG MET C 59 35.680 26.021 8.497 1.00 29.47 C ATOM 1956 SD MET C 59 35.854 24.361 9.215 1.00 31.72 S ATOM 1957 CE MET C 59 34.973 24.552 10.768 1.00 29.70 C ATOM 0 H MET C 59 37.540 28.666 10.820 1.00 28.85 H new ATOM 0 HA MET C 59 37.973 26.268 9.960 1.00 28.76 H new ATOM 0 HB2 MET C 59 35.793 27.176 10.208 1.00 28.79 H new ATOM 0 HB3 MET C 59 36.019 28.017 8.914 1.00 28.79 H new ATOM 0 HG2 MET C 59 34.738 26.188 8.334 1.00 29.47 H new ATOM 0 HG3 MET C 59 36.123 26.031 7.634 1.00 29.47 H new ATOM 0 HE1 MET C 59 34.787 23.678 11.144 1.00 29.70 H new ATOM 0 HE2 MET C 59 35.517 25.061 11.389 1.00 29.70 H new ATOM 0 HE3 MET C 59 34.138 25.020 10.611 1.00 29.70 H new ATOM 1958 N ALA C 60 38.669 28.499 7.779 1.00 28.19 N ATOM 1959 CA ALA C 60 39.446 28.779 6.562 1.00 28.03 C ATOM 1960 C ALA C 60 40.906 28.333 6.687 1.00 27.94 C ATOM 1961 O ALA C 60 41.459 27.743 5.762 1.00 27.84 O ATOM 1962 CB ALA C 60 39.370 30.256 6.210 1.00 27.98 C ATOM 0 H ALA C 60 38.321 29.197 8.141 1.00 28.19 H new ATOM 0 HA ALA C 60 39.049 28.260 5.845 1.00 28.03 H new ATOM 0 HB1 ALA C 60 39.887 30.424 5.406 1.00 27.98 H new ATOM 0 HB2 ALA C 60 38.445 30.505 6.057 1.00 27.98 H new ATOM 0 HB3 ALA C 60 39.730 30.782 6.941 1.00 27.98 H new ATOM 1963 N ALA C 61 41.514 28.615 7.837 1.00 27.85 N ATOM 1964 CA ALA C 61 42.890 28.206 8.117 1.00 27.94 C ATOM 1965 C ALA C 61 43.018 26.685 8.265 1.00 28.10 C ATOM 1966 O ALA C 61 44.012 26.093 7.837 1.00 28.08 O ATOM 1967 CB ALA C 61 43.390 28.895 9.357 1.00 27.90 C ATOM 0 H ALA C 61 41.140 29.049 8.478 1.00 27.85 H new ATOM 0 HA ALA C 61 43.435 28.470 7.359 1.00 27.94 H new ATOM 0 HB1 ALA C 61 44.302 28.618 9.535 1.00 27.90 H new ATOM 0 HB2 ALA C 61 43.363 29.856 9.227 1.00 27.90 H new ATOM 0 HB3 ALA C 61 42.827 28.656 10.110 1.00 27.90 H new ATOM 1968 N GLY C 62 42.010 26.062 8.873 1.00 28.30 N ATOM 1969 CA GLY C 62 41.960 24.604 9.001 1.00 28.62 C ATOM 1970 C GLY C 62 41.902 23.906 7.652 1.00 28.79 C ATOM 1971 O GLY C 62 42.684 22.993 7.392 1.00 28.88 O ATOM 0 H GLY C 62 41.338 26.470 9.222 1.00 28.30 H new ATOM 0 HA2 GLY C 62 42.741 24.298 9.488 1.00 28.62 H new ATOM 0 HA3 GLY C 62 41.183 24.354 9.525 1.00 28.62 H new ATOM 1972 N ILE C 63 40.971 24.336 6.800 1.00 29.06 N ATOM 1973 CA ILE C 63 40.849 23.813 5.434 1.00 29.65 C ATOM 1974 C ILE C 63 42.181 23.956 4.685 1.00 30.22 C ATOM 1975 O ILE C 63 42.642 23.016 4.028 1.00 30.22 O ATOM 1976 CB ILE C 63 39.695 24.515 4.655 1.00 29.54 C ATOM 1977 CG1 ILE C 63 38.334 24.088 5.221 1.00 29.45 C ATOM 1978 CG2 ILE C 63 39.774 24.211 3.156 1.00 29.36 C ATOM 1979 CD1 ILE C 63 37.163 24.974 4.803 1.00 29.66 C ATOM 0 H ILE C 63 40.391 24.940 6.996 1.00 29.06 H new ATOM 0 HA ILE C 63 40.628 22.870 5.494 1.00 29.65 H new ATOM 0 HB ILE C 63 39.793 25.473 4.769 1.00 29.54 H new ATOM 0 HG12 ILE C 63 38.152 23.178 4.940 1.00 29.45 H new ATOM 0 HG13 ILE C 63 38.388 24.080 6.189 1.00 29.45 H new ATOM 0 HG21 ILE C 63 39.047 24.659 2.696 1.00 29.36 H new ATOM 0 HG22 ILE C 63 40.621 24.528 2.806 1.00 29.36 H new ATOM 0 HG23 ILE C 63 39.704 23.254 3.016 1.00 29.36 H new ATOM 0 HD11 ILE C 63 36.345 24.638 5.201 1.00 29.66 H new ATOM 0 HD12 ILE C 63 37.320 25.882 5.106 1.00 29.66 H new ATOM 0 HD13 ILE C 63 37.080 24.966 3.837 1.00 29.66 H new ATOM 1980 N ASP C 64 42.794 25.131 4.814 1.00 30.78 N ATOM 1981 CA ASP C 64 44.091 25.428 4.213 1.00 31.61 C ATOM 1982 C ASP C 64 45.210 24.494 4.707 1.00 31.39 C ATOM 1983 O ASP C 64 46.000 23.984 3.913 1.00 31.12 O ATOM 1984 CB ASP C 64 44.450 26.887 4.481 1.00 32.18 C ATOM 1985 CG ASP C 64 45.338 27.474 3.412 1.00 34.97 C ATOM 1986 OD1 ASP C 64 46.502 27.031 3.290 1.00 37.87 O ATOM 1987 OD2 ASP C 64 44.874 28.395 2.698 1.00 38.56 O ATOM 0 H ASP C 64 42.462 25.787 5.260 1.00 30.78 H new ATOM 0 HA ASP C 64 44.013 25.275 3.258 1.00 31.61 H new ATOM 0 HB2 ASP C 64 43.636 27.410 4.543 1.00 32.18 H new ATOM 0 HB3 ASP C 64 44.896 26.954 5.340 1.00 32.18 H new ATOM 1988 N ALA C 65 45.266 24.274 6.018 1.00 31.32 N ATOM 1989 CA ALA C 65 46.245 23.366 6.611 1.00 31.34 C ATOM 1990 C ALA C 65 46.073 21.925 6.112 1.00 31.38 C ATOM 1991 O ALA C 65 47.061 21.244 5.825 1.00 30.88 O ATOM 1992 CB ALA C 65 46.165 23.421 8.126 1.00 31.27 C ATOM 0 H ALA C 65 44.739 24.645 6.587 1.00 31.32 H new ATOM 0 HA ALA C 65 47.125 23.662 6.330 1.00 31.34 H new ATOM 0 HB1 ALA C 65 46.819 22.814 8.507 1.00 31.27 H new ATOM 0 HB2 ALA C 65 46.348 24.325 8.427 1.00 31.27 H new ATOM 0 HB3 ALA C 65 45.276 23.159 8.413 1.00 31.27 H new ATOM 1993 N ILE C 66 44.823 21.475 6.002 1.00 31.61 N ATOM 1994 CA ILE C 66 44.524 20.132 5.496 1.00 32.12 C ATOM 1995 C ILE C 66 44.923 19.978 4.022 1.00 32.81 C ATOM 1996 O ILE C 66 45.517 18.968 3.647 1.00 32.72 O ATOM 1997 CB ILE C 66 43.040 19.732 5.720 1.00 32.10 C ATOM 1998 CG1 ILE C 66 42.750 19.576 7.219 1.00 31.94 C ATOM 1999 CG2 ILE C 66 42.711 18.433 4.978 1.00 31.87 C ATOM 2000 CD1 ILE C 66 41.272 19.493 7.579 1.00 31.79 C ATOM 0 H ILE C 66 44.129 21.935 6.216 1.00 31.61 H new ATOM 0 HA ILE C 66 45.066 19.517 6.015 1.00 32.12 H new ATOM 0 HB ILE C 66 42.477 20.438 5.365 1.00 32.10 H new ATOM 0 HG12 ILE C 66 43.193 18.775 7.540 1.00 31.94 H new ATOM 0 HG13 ILE C 66 43.143 20.326 7.691 1.00 31.94 H new ATOM 0 HG21 ILE C 66 41.782 18.200 5.130 1.00 31.87 H new ATOM 0 HG22 ILE C 66 42.862 18.556 4.028 1.00 31.87 H new ATOM 0 HG23 ILE C 66 43.280 17.720 5.306 1.00 31.87 H new ATOM 0 HD11 ILE C 66 41.178 19.396 8.540 1.00 31.79 H new ATOM 0 HD12 ILE C 66 40.823 20.303 7.291 1.00 31.79 H new ATOM 0 HD13 ILE C 66 40.873 18.727 7.136 1.00 31.79 H new ATOM 2001 N ASN C 67 44.618 20.987 3.204 1.00 33.65 N ATOM 2002 CA ASN C 67 45.041 21.008 1.800 1.00 34.81 C ATOM 2003 C ASN C 67 46.563 20.917 1.629 1.00 35.34 C ATOM 2004 O ASN C 67 47.047 20.243 0.720 1.00 35.29 O ATOM 2005 CB ASN C 67 44.490 22.245 1.074 1.00 34.88 C ATOM 2006 CG ASN C 67 42.977 22.174 0.835 1.00 35.71 C ATOM 2007 OD1 ASN C 67 42.374 21.100 0.847 1.00 36.37 O ATOM 2008 ND2 ASN C 67 42.365 23.328 0.607 1.00 36.58 N ATOM 0 H ASN C 67 44.162 21.676 3.445 1.00 33.65 H new ATOM 0 HA ASN C 67 44.665 20.211 1.393 1.00 34.81 H new ATOM 0 HB2 ASN C 67 44.693 23.037 1.595 1.00 34.88 H new ATOM 0 HB3 ASN C 67 44.943 22.342 0.222 1.00 34.88 H new ATOM 0 HD21 ASN C 67 41.518 23.344 0.461 1.00 36.58 H new ATOM 0 HD22 ASN C 67 42.815 24.061 0.606 1.00 36.58 H new ATOM 2009 N ARG C 68 47.303 21.585 2.514 1.00 35.92 N ATOM 2010 CA ARG C 68 48.770 21.557 2.498 1.00 37.09 C ATOM 2011 C ARG C 68 49.375 20.257 3.062 1.00 36.30 C ATOM 2012 O ARG C 68 50.540 19.955 2.804 1.00 36.46 O ATOM 2013 CB ARG C 68 49.338 22.770 3.247 1.00 37.11 C ATOM 2014 CG ARG C 68 49.039 24.122 2.587 1.00 39.15 C ATOM 2015 CD ARG C 68 49.582 25.296 3.399 1.00 40.17 C ATOM 2016 NE ARG C 68 49.030 25.335 4.755 1.00 47.53 N ATOM 2017 CZ ARG C 68 49.300 26.275 5.660 1.00 50.32 C ATOM 2018 NH1 ARG C 68 50.120 27.281 5.367 1.00 52.11 N ATOM 2019 NH2 ARG C 68 48.745 26.209 6.865 1.00 51.71 N ATOM 0 H ARG C 68 46.970 22.068 3.142 1.00 35.92 H new ATOM 0 HA ARG C 68 49.026 21.594 1.563 1.00 37.09 H new ATOM 0 HB2 ARG C 68 48.979 22.776 4.148 1.00 37.11 H new ATOM 0 HB3 ARG C 68 50.299 22.667 3.325 1.00 37.11 H new ATOM 0 HG2 ARG C 68 49.428 24.139 1.698 1.00 39.15 H new ATOM 0 HG3 ARG C 68 48.080 24.222 2.479 1.00 39.15 H new ATOM 0 HD2 ARG C 68 50.549 25.234 3.447 1.00 40.17 H new ATOM 0 HD3 ARG C 68 49.373 26.126 2.943 1.00 40.17 H new ATOM 0 HE ARG C 68 48.492 24.705 4.984 1.00 47.53 H new ATOM 0 HH11 ARG C 68 50.481 27.329 4.588 1.00 52.11 H new ATOM 0 HH12 ARG C 68 50.289 27.884 5.957 1.00 52.11 H new ATOM 0 HH21 ARG C 68 48.214 25.561 7.059 1.00 51.71 H new ATOM 0 HH22 ARG C 68 48.917 26.814 7.451 1.00 51.71 H new ATOM 2020 N THR C 69 48.588 19.500 3.828 1.00 35.54 N ATOM 2021 CA THR C 69 49.057 18.259 4.451 1.00 34.78 C ATOM 2022 C THR C 69 49.050 17.089 3.467 1.00 34.48 C ATOM 2023 O THR C 69 48.027 16.788 2.862 1.00 34.09 O ATOM 2024 CB THR C 69 48.210 17.900 5.699 1.00 34.65 C ATOM 2025 OG1 THR C 69 48.314 18.955 6.656 1.00 33.93 O ATOM 2026 CG2 THR C 69 48.682 16.595 6.346 1.00 34.59 C ATOM 0 H THR C 69 47.768 19.691 4.001 1.00 35.54 H new ATOM 0 HA THR C 69 49.973 18.417 4.728 1.00 34.78 H new ATOM 0 HB THR C 69 47.290 17.783 5.414 1.00 34.65 H new ATOM 0 HG1 THR C 69 47.920 19.637 6.365 1.00 33.93 H new ATOM 0 HG21 THR C 69 48.132 16.401 7.121 1.00 34.59 H new ATOM 0 HG22 THR C 69 48.605 15.870 5.706 1.00 34.59 H new ATOM 0 HG23 THR C 69 49.608 16.686 6.621 1.00 34.59 H new ATOM 2027 N GLU C 70 50.198 16.434 3.327 1.00 34.36 N ATOM 2028 CA GLU C 70 50.345 15.277 2.442 1.00 34.54 C ATOM 2029 C GLU C 70 49.356 14.153 2.770 1.00 33.94 C ATOM 2030 O GLU C 70 49.273 13.704 3.914 1.00 33.59 O ATOM 2031 CB GLU C 70 51.776 14.738 2.511 1.00 34.90 C ATOM 2032 CG GLU C 70 52.158 13.849 1.339 1.00 37.05 C ATOM 2033 CD GLU C 70 52.393 14.634 0.055 1.00 39.71 C ATOM 2034 OE1 GLU C 70 52.084 14.094 -1.030 1.00 41.10 O ATOM 2035 OE2 GLU C 70 52.888 15.785 0.128 1.00 40.23 O ATOM 0 H GLU C 70 50.919 16.648 3.744 1.00 34.36 H new ATOM 0 HA GLU C 70 50.148 15.584 1.543 1.00 34.54 H new ATOM 0 HB2 GLU C 70 52.392 15.486 2.552 1.00 34.90 H new ATOM 0 HB3 GLU C 70 51.884 14.236 3.334 1.00 34.90 H new ATOM 0 HG2 GLU C 70 52.962 13.354 1.562 1.00 37.05 H new ATOM 0 HG3 GLU C 70 51.455 13.197 1.191 1.00 37.05 H new ATOM 2036 N GLY C 71 48.609 13.721 1.755 1.00 33.47 N ATOM 2037 CA GLY C 71 47.665 12.612 1.876 1.00 33.11 C ATOM 2038 C GLY C 71 46.359 12.926 2.590 1.00 32.96 C ATOM 2039 O GLY C 71 45.549 12.027 2.816 1.00 32.81 O ATOM 0 H GLY C 71 48.637 14.068 0.968 1.00 33.47 H new ATOM 0 HA2 GLY C 71 47.457 12.288 0.986 1.00 33.11 H new ATOM 0 HA3 GLY C 71 48.104 11.886 2.346 1.00 33.11 H new ATOM 2040 N ALA C 72 46.153 14.195 2.941 1.00 32.71 N ATOM 2041 CA ALA C 72 44.958 14.619 3.672 1.00 32.71 C ATOM 2042 C ALA C 72 44.001 15.432 2.804 1.00 32.65 C ATOM 2043 O ALA C 72 44.426 16.253 1.995 1.00 32.64 O ATOM 2044 CB ALA C 72 45.348 15.412 4.911 1.00 32.61 C ATOM 0 H ALA C 72 46.701 14.833 2.763 1.00 32.71 H new ATOM 0 HA ALA C 72 44.488 13.814 3.940 1.00 32.71 H new ATOM 0 HB1 ALA C 72 44.547 15.686 5.385 1.00 32.61 H new ATOM 0 HB2 ALA C 72 45.893 14.858 5.491 1.00 32.61 H new ATOM 0 HB3 ALA C 72 45.852 16.198 4.647 1.00 32.61 H new ATOM 2045 N ASP C 73 42.706 15.199 2.985 1.00 32.62 N ATOM 2046 CA ASP C 73 41.668 15.931 2.263 1.00 32.79 C ATOM 2047 C ASP C 73 40.524 16.258 3.207 1.00 32.33 C ATOM 2048 O ASP C 73 40.139 15.423 4.023 1.00 32.30 O ATOM 2049 CB ASP C 73 41.131 15.109 1.087 1.00 33.07 C ATOM 2050 CG ASP C 73 42.148 14.933 -0.028 1.00 35.09 C ATOM 2051 OD1 ASP C 73 42.368 13.773 -0.444 1.00 37.08 O ATOM 2052 OD2 ASP C 73 42.720 15.947 -0.498 1.00 37.10 O ATOM 0 H ASP C 73 42.402 14.609 3.532 1.00 32.62 H new ATOM 0 HA ASP C 73 42.059 16.748 1.917 1.00 32.79 H new ATOM 0 HB2 ASP C 73 40.856 14.236 1.408 1.00 33.07 H new ATOM 0 HB3 ASP C 73 40.340 15.542 0.731 1.00 33.07 H new ATOM 2053 N VAL C 74 39.995 17.474 3.102 1.00 31.97 N ATOM 2054 CA VAL C 74 38.796 17.857 3.842 1.00 31.69 C ATOM 2055 C VAL C 74 37.631 17.117 3.211 1.00 31.45 C ATOM 2056 O VAL C 74 37.361 17.267 2.016 1.00 31.50 O ATOM 2057 CB VAL C 74 38.498 19.380 3.782 1.00 31.80 C ATOM 2058 CG1 VAL C 74 37.297 19.721 4.655 1.00 31.70 C ATOM 2059 CG2 VAL C 74 39.701 20.202 4.192 1.00 31.51 C ATOM 0 H VAL C 74 40.318 18.096 2.604 1.00 31.97 H new ATOM 0 HA VAL C 74 38.930 17.633 4.776 1.00 31.69 H new ATOM 0 HB VAL C 74 38.291 19.603 2.861 1.00 31.80 H new ATOM 0 HG11 VAL C 74 37.123 20.674 4.608 1.00 31.70 H new ATOM 0 HG12 VAL C 74 36.519 19.235 4.340 1.00 31.70 H new ATOM 0 HG13 VAL C 74 37.483 19.472 5.574 1.00 31.70 H new ATOM 0 HG21 VAL C 74 39.480 21.145 4.143 1.00 31.51 H new ATOM 0 HG22 VAL C 74 39.953 19.976 5.101 1.00 31.51 H new ATOM 0 HG23 VAL C 74 40.442 20.012 3.595 1.00 31.51 H new ATOM 2060 N LYS C 75 36.946 16.315 4.013 1.00 31.08 N ATOM 2061 CA LYS C 75 35.824 15.534 3.518 1.00 30.89 C ATOM 2062 C LYS C 75 34.504 16.281 3.697 1.00 30.37 C ATOM 2063 O LYS C 75 33.630 16.233 2.828 1.00 30.19 O ATOM 2064 CB LYS C 75 35.785 14.170 4.217 1.00 31.08 C ATOM 2065 CG LYS C 75 36.883 13.219 3.758 1.00 32.37 C ATOM 2066 CD LYS C 75 36.562 12.663 2.376 1.00 35.24 C ATOM 2067 CE LYS C 75 37.794 12.118 1.688 1.00 36.88 C ATOM 2068 NZ LYS C 75 37.439 11.578 0.350 1.00 38.79 N ATOM 0 H LYS C 75 37.115 16.209 4.849 1.00 31.08 H new ATOM 0 HA LYS C 75 35.947 15.392 2.566 1.00 30.89 H new ATOM 0 HB2 LYS C 75 35.862 14.303 5.175 1.00 31.08 H new ATOM 0 HB3 LYS C 75 34.922 13.757 4.057 1.00 31.08 H new ATOM 0 HG2 LYS C 75 37.734 13.685 3.736 1.00 32.37 H new ATOM 0 HG3 LYS C 75 36.974 12.491 4.393 1.00 32.37 H new ATOM 0 HD2 LYS C 75 35.899 11.960 2.457 1.00 35.24 H new ATOM 0 HD3 LYS C 75 36.169 13.362 1.830 1.00 35.24 H new ATOM 0 HE2 LYS C 75 38.458 12.819 1.595 1.00 36.88 H new ATOM 0 HE3 LYS C 75 38.193 11.420 2.230 1.00 36.88 H new ATOM 0 HZ1 LYS C 75 38.170 11.260 -0.046 1.00 38.79 H new ATOM 0 HZ2 LYS C 75 36.844 10.923 0.442 1.00 38.79 H new ATOM 0 HZ3 LYS C 75 37.090 12.227 -0.149 1.00 38.79 H new ATOM 2069 N THR C 76 34.381 16.982 4.823 1.00 29.70 N ATOM 2070 CA THR C 76 33.134 17.627 5.214 1.00 29.22 C ATOM 2071 C THR C 76 33.391 18.621 6.347 1.00 28.84 C ATOM 2072 O THR C 76 34.287 18.418 7.172 1.00 28.81 O ATOM 2073 CB THR C 76 32.028 16.567 5.579 1.00 29.37 C ATOM 2074 OG1 THR C 76 30.813 17.217 5.979 1.00 29.81 O ATOM 2075 CG2 THR C 76 32.489 15.631 6.682 1.00 28.93 C ATOM 0 H THR C 76 35.024 17.096 5.383 1.00 29.70 H new ATOM 0 HA THR C 76 32.789 18.127 4.458 1.00 29.22 H new ATOM 0 HB THR C 76 31.864 16.041 4.781 1.00 29.37 H new ATOM 0 HG1 THR C 76 30.605 17.798 5.409 1.00 29.81 H new ATOM 0 HG21 THR C 76 31.785 14.993 6.881 1.00 28.93 H new ATOM 0 HG22 THR C 76 33.283 15.156 6.392 1.00 28.93 H new ATOM 0 HG23 THR C 76 32.693 16.145 7.479 1.00 28.93 H new ATOM 2076 N TRP C 77 32.631 19.713 6.354 1.00 28.41 N ATOM 2077 CA TRP C 77 32.741 20.738 7.394 1.00 28.02 C ATOM 2078 C TRP C 77 31.448 21.530 7.520 1.00 27.76 C ATOM 2079 O TRP C 77 30.654 21.586 6.587 1.00 27.58 O ATOM 2080 CB TRP C 77 33.923 21.685 7.131 1.00 27.97 C ATOM 2081 CG TRP C 77 33.766 22.559 5.915 1.00 28.08 C ATOM 2082 CD1 TRP C 77 34.135 22.253 4.635 1.00 27.87 C ATOM 2083 CD2 TRP C 77 33.204 23.883 5.867 1.00 27.53 C ATOM 2084 NE1 TRP C 77 33.835 23.299 3.796 1.00 27.75 N ATOM 2085 CE2 TRP C 77 33.265 24.311 4.523 1.00 27.74 C ATOM 2086 CE3 TRP C 77 32.657 24.745 6.828 1.00 27.67 C ATOM 2087 CZ2 TRP C 77 32.797 25.572 4.111 1.00 28.20 C ATOM 2088 CZ3 TRP C 77 32.189 25.999 6.420 1.00 28.20 C ATOM 2089 CH2 TRP C 77 32.262 26.397 5.070 1.00 28.31 C ATOM 0 H TRP C 77 32.036 19.882 5.756 1.00 28.41 H new ATOM 0 HA TRP C 77 32.905 20.279 8.233 1.00 28.02 H new ATOM 0 HB2 TRP C 77 34.048 22.252 7.908 1.00 27.97 H new ATOM 0 HB3 TRP C 77 34.730 21.156 7.033 1.00 27.97 H new ATOM 0 HD1 TRP C 77 34.531 21.454 4.371 1.00 27.87 H new ATOM 0 HE1 TRP C 77 33.982 23.316 2.949 1.00 27.75 H new ATOM 0 HE3 TRP C 77 32.606 24.488 7.720 1.00 27.67 H new ATOM 0 HZ2 TRP C 77 32.848 25.838 3.221 1.00 28.20 H new ATOM 0 HZ3 TRP C 77 31.824 26.579 7.049 1.00 28.20 H new ATOM 0 HH2 TRP C 77 31.942 27.235 4.824 1.00 28.31 H new ATOM 2090 N VAL C 78 31.246 22.139 8.684 1.00 27.63 N ATOM 2091 CA VAL C 78 30.095 23.005 8.911 1.00 27.59 C ATOM 2092 C VAL C 78 30.414 24.011 10.019 1.00 27.85 C ATOM 2093 O VAL C 78 31.302 23.780 10.845 1.00 27.47 O ATOM 2094 CB VAL C 78 28.811 22.179 9.250 1.00 27.70 C ATOM 2095 CG1 VAL C 78 28.809 21.704 10.716 1.00 26.70 C ATOM 2096 CG2 VAL C 78 27.542 22.966 8.903 1.00 26.97 C ATOM 0 H VAL C 78 31.770 22.062 9.362 1.00 27.63 H new ATOM 0 HA VAL C 78 29.910 23.490 8.091 1.00 27.59 H new ATOM 0 HB VAL C 78 28.820 21.382 8.697 1.00 27.70 H new ATOM 0 HG11 VAL C 78 28.001 21.197 10.891 1.00 26.70 H new ATOM 0 HG12 VAL C 78 29.584 21.143 10.875 1.00 26.70 H new ATOM 0 HG13 VAL C 78 28.841 22.473 11.306 1.00 26.70 H new ATOM 0 HG21 VAL C 78 26.761 22.434 9.122 1.00 26.97 H new ATOM 0 HG22 VAL C 78 27.523 23.791 9.412 1.00 26.97 H new ATOM 0 HG23 VAL C 78 27.537 23.171 7.955 1.00 26.97 H new ATOM 2097 N ILE C 79 29.708 25.138 9.996 1.00 28.24 N ATOM 2098 CA ILE C 79 29.718 26.098 11.089 1.00 28.77 C ATOM 2099 C ILE C 79 28.268 26.341 11.510 1.00 29.38 C ATOM 2100 O ILE C 79 27.424 26.670 10.676 1.00 29.29 O ATOM 2101 CB ILE C 79 30.400 27.436 10.684 1.00 28.81 C ATOM 2102 CG1 ILE C 79 31.887 27.212 10.363 1.00 28.59 C ATOM 2103 CG2 ILE C 79 30.225 28.499 11.791 1.00 28.16 C ATOM 2104 CD1 ILE C 79 32.565 28.387 9.663 1.00 28.65 C ATOM 0 H ILE C 79 29.205 25.367 9.337 1.00 28.24 H new ATOM 0 HA ILE C 79 30.235 25.738 11.826 1.00 28.77 H new ATOM 0 HB ILE C 79 29.967 27.768 9.882 1.00 28.81 H new ATOM 0 HG12 ILE C 79 32.360 27.025 11.189 1.00 28.59 H new ATOM 0 HG13 ILE C 79 31.971 26.424 9.803 1.00 28.59 H new ATOM 0 HG21 ILE C 79 30.657 29.324 11.519 1.00 28.16 H new ATOM 0 HG22 ILE C 79 29.280 28.662 11.937 1.00 28.16 H new ATOM 0 HG23 ILE C 79 30.628 28.180 12.613 1.00 28.16 H new ATOM 0 HD11 ILE C 79 33.496 28.171 9.495 1.00 28.65 H new ATOM 0 HD12 ILE C 79 32.118 28.564 8.821 1.00 28.65 H new ATOM 0 HD13 ILE C 79 32.513 29.174 10.228 1.00 28.65 H new ATOM 2105 N ILE C 80 27.983 26.158 12.797 1.00 30.21 N ATOM 2106 CA ILE C 80 26.662 26.446 13.350 1.00 31.12 C ATOM 2107 C ILE C 80 26.773 27.640 14.295 1.00 31.97 C ATOM 2108 O ILE C 80 27.367 27.516 15.365 1.00 32.18 O ATOM 2109 CB ILE C 80 26.069 25.237 14.127 1.00 31.19 C ATOM 2110 CG1 ILE C 80 26.164 23.931 13.317 1.00 30.66 C ATOM 2111 CG2 ILE C 80 24.642 25.546 14.607 1.00 31.04 C ATOM 2112 CD1 ILE C 80 25.282 23.870 12.098 1.00 30.38 C ATOM 0 H ILE C 80 28.549 25.864 13.374 1.00 30.21 H new ATOM 0 HA ILE C 80 26.066 26.639 12.609 1.00 31.12 H new ATOM 0 HB ILE C 80 26.608 25.092 14.920 1.00 31.19 H new ATOM 0 HG12 ILE C 80 27.085 23.805 13.039 1.00 30.66 H new ATOM 0 HG13 ILE C 80 25.939 23.188 13.899 1.00 30.66 H new ATOM 0 HG21 ILE C 80 24.290 24.781 15.089 1.00 31.04 H new ATOM 0 HG22 ILE C 80 24.658 26.318 15.194 1.00 31.04 H new ATOM 0 HG23 ILE C 80 24.077 25.734 13.842 1.00 31.04 H new ATOM 0 HD11 ILE C 80 25.405 23.018 11.651 1.00 30.38 H new ATOM 0 HD12 ILE C 80 24.354 23.963 12.365 1.00 30.38 H new ATOM 0 HD13 ILE C 80 25.518 24.589 11.492 1.00 30.38 H new ATOM 2113 N PRO C 81 26.197 28.795 13.907 1.00 32.71 N ATOM 2114 CA PRO C 81 26.319 30.058 14.653 1.00 33.29 C ATOM 2115 C PRO C 81 25.850 30.039 16.116 1.00 33.98 C ATOM 2116 O PRO C 81 26.556 30.556 16.983 1.00 34.23 O ATOM 2117 CB PRO C 81 25.471 31.041 13.834 1.00 33.21 C ATOM 2118 CG PRO C 81 25.419 30.447 12.464 1.00 33.31 C ATOM 2119 CD PRO C 81 25.393 28.963 12.683 1.00 32.80 C ATOM 0 HA PRO C 81 27.257 30.287 14.741 1.00 33.29 H new ATOM 0 HB2 PRO C 81 24.582 31.138 14.210 1.00 33.21 H new ATOM 0 HB3 PRO C 81 25.871 31.925 13.820 1.00 33.21 H new ATOM 0 HG2 PRO C 81 24.631 30.744 11.982 1.00 33.31 H new ATOM 0 HG3 PRO C 81 26.190 30.711 11.938 1.00 33.31 H new ATOM 0 HD2 PRO C 81 24.488 28.633 12.799 1.00 32.80 H new ATOM 0 HD3 PRO C 81 25.776 28.482 11.933 1.00 32.80 H new ATOM 2120 N ARG C 82 24.674 29.482 16.395 1.00 34.57 N ATOM 2121 CA ARG C 82 24.130 29.513 17.765 1.00 35.22 C ATOM 2122 C ARG C 82 23.474 28.176 18.108 1.00 35.12 C ATOM 2123 O ARG C 82 22.246 28.070 18.099 1.00 34.90 O ATOM 2124 CB ARG C 82 23.116 30.662 17.957 1.00 35.42 C ATOM 2125 CG ARG C 82 23.637 32.081 17.712 1.00 37.33 C ATOM 2126 CD ARG C 82 24.397 32.627 18.915 1.00 41.18 C ATOM 2127 NE ARG C 82 24.892 33.991 18.711 1.00 43.43 N ATOM 2128 CZ ARG C 82 24.301 35.092 19.180 1.00 44.43 C ATOM 2129 NH1 ARG C 82 24.839 36.282 18.942 1.00 44.44 N ATOM 2130 NH2 ARG C 82 23.177 35.010 19.886 1.00 44.90 N ATOM 0 H ARG C 82 24.176 29.084 15.818 1.00 34.57 H new ATOM 0 HA ARG C 82 24.874 29.671 18.367 1.00 35.22 H new ATOM 0 HB2 ARG C 82 22.366 30.507 17.362 1.00 35.42 H new ATOM 0 HB3 ARG C 82 22.774 30.617 18.863 1.00 35.42 H new ATOM 0 HG2 ARG C 82 24.219 32.081 16.936 1.00 37.33 H new ATOM 0 HG3 ARG C 82 22.892 32.667 17.508 1.00 37.33 H new ATOM 0 HD2 ARG C 82 23.816 32.612 19.692 1.00 41.18 H new ATOM 0 HD3 ARG C 82 25.146 32.043 19.110 1.00 41.18 H new ATOM 0 HE ARG C 82 25.615 34.089 18.256 1.00 43.43 H new ATOM 0 HH11 ARG C 82 25.566 36.342 18.487 1.00 44.44 H new ATOM 0 HH12 ARG C 82 24.460 36.993 19.243 1.00 44.44 H new ATOM 0 HH21 ARG C 82 22.824 34.242 20.044 1.00 44.90 H new ATOM 0 HH22 ARG C 82 22.803 35.725 20.184 1.00 44.90 H new ATOM 2131 N PRO C 83 24.293 27.154 18.429 1.00 35.26 N ATOM 2132 CA PRO C 83 23.777 25.795 18.626 1.00 35.33 C ATOM 2133 C PRO C 83 22.830 25.702 19.821 1.00 35.31 C ATOM 2134 O PRO C 83 23.129 26.229 20.896 1.00 35.27 O ATOM 2135 CB PRO C 83 25.044 24.966 18.873 1.00 35.34 C ATOM 2136 CG PRO C 83 26.052 25.952 19.378 1.00 35.46 C ATOM 2137 CD PRO C 83 25.749 27.228 18.646 1.00 35.21 C ATOM 0 HA PRO C 83 23.254 25.490 17.868 1.00 35.33 H new ATOM 0 HB2 PRO C 83 24.884 24.263 19.521 1.00 35.34 H new ATOM 0 HB3 PRO C 83 25.349 24.537 18.058 1.00 35.34 H new ATOM 0 HG2 PRO C 83 25.976 26.071 20.338 1.00 35.46 H new ATOM 0 HG3 PRO C 83 26.957 25.651 19.200 1.00 35.46 H new ATOM 0 HD2 PRO C 83 25.994 28.008 19.168 1.00 35.21 H new ATOM 0 HD3 PRO C 83 26.234 27.284 17.808 1.00 35.21 H new ATOM 2138 N HIS C 84 21.689 25.052 19.606 1.00 35.15 N ATOM 2139 CA HIS C 84 20.696 24.802 20.648 1.00 35.10 C ATOM 2140 C HIS C 84 21.313 24.000 21.797 1.00 35.07 C ATOM 2141 O HIS C 84 22.236 23.208 21.584 1.00 34.98 O ATOM 2142 CB HIS C 84 19.527 24.031 20.035 1.00 35.13 C ATOM 2143 CG HIS C 84 18.295 23.999 20.882 1.00 34.92 C ATOM 2144 ND1 HIS C 84 18.119 23.094 21.907 1.00 34.88 N ATOM 2145 CD2 HIS C 84 17.162 24.739 20.835 1.00 35.04 C ATOM 2146 CE1 HIS C 84 16.938 23.288 22.466 1.00 35.00 C ATOM 2147 NE2 HIS C 84 16.337 24.281 21.835 1.00 34.87 N ATOM 0 H HIS C 84 21.466 24.738 18.837 1.00 35.15 H new ATOM 0 HA HIS C 84 20.383 25.647 21.007 1.00 35.10 H new ATOM 0 HB2 HIS C 84 19.306 24.428 19.178 1.00 35.13 H new ATOM 0 HB3 HIS C 84 19.811 23.120 19.861 1.00 35.13 H new ATOM 0 HD2 HIS C 84 16.977 25.428 20.238 1.00 35.04 H new ATOM 0 HE1 HIS C 84 16.589 22.807 23.182 1.00 35.00 H new ATOM 0 HE2 HIS C 84 15.556 24.591 22.020 1.00 34.87 H new ATOM 2148 N GLU C 85 20.799 24.209 23.007 1.00 34.96 N ATOM 2149 CA GLU C 85 21.304 23.536 24.211 1.00 35.17 C ATOM 2150 C GLU C 85 21.182 22.006 24.162 1.00 33.72 C ATOM 2151 O GLU C 85 22.039 21.294 24.687 1.00 33.68 O ATOM 2152 CB GLU C 85 20.604 24.073 25.461 1.00 35.24 C ATOM 2153 CG GLU C 85 20.867 25.543 25.760 1.00 37.32 C ATOM 2154 CD GLU C 85 20.265 25.976 27.086 1.00 37.95 C ATOM 2155 OE1 GLU C 85 20.738 25.500 28.146 1.00 41.66 O ATOM 2156 OE2 GLU C 85 19.319 26.796 27.071 1.00 41.88 O ATOM 0 H GLU C 85 20.145 24.747 23.157 1.00 34.96 H new ATOM 0 HA GLU C 85 22.252 23.737 24.248 1.00 35.17 H new ATOM 0 HB2 GLU C 85 19.648 23.942 25.362 1.00 35.24 H new ATOM 0 HB3 GLU C 85 20.885 23.545 26.225 1.00 35.24 H new ATOM 0 HG2 GLU C 85 21.824 25.702 25.774 1.00 37.32 H new ATOM 0 HG3 GLU C 85 20.499 26.087 25.046 1.00 37.32 H new ATOM 2157 N ASN C 86 20.113 21.513 23.537 1.00 32.38 N ATOM 2158 CA ASN C 86 19.887 20.076 23.360 1.00 31.01 C ATOM 2159 C ASN C 86 20.984 19.446 22.499 1.00 30.19 C ATOM 2160 O ASN C 86 21.386 18.307 22.731 1.00 29.91 O ATOM 2161 CB ASN C 86 18.500 19.835 22.742 1.00 30.90 C ATOM 2162 CG ASN C 86 17.996 18.396 22.905 1.00 30.31 C ATOM 2163 OD1 ASN C 86 16.852 18.103 22.556 1.00 29.09 O ATOM 2164 ND2 ASN C 86 18.833 17.504 23.425 1.00 29.29 N ATOM 0 H ASN C 86 19.493 22.006 23.201 1.00 32.38 H new ATOM 0 HA ASN C 86 19.919 19.651 24.231 1.00 31.01 H new ATOM 0 HB2 ASN C 86 17.862 20.441 23.151 1.00 30.90 H new ATOM 0 HB3 ASN C 86 18.533 20.053 21.797 1.00 30.90 H new ATOM 0 HD21 ASN C 86 18.582 16.688 23.528 1.00 29.29 H new ATOM 0 HD22 ASN C 86 19.626 17.743 23.658 1.00 29.29 H new ATOM 2165 N VAL C 87 21.465 20.204 21.515 1.00 29.30 N ATOM 2166 CA VAL C 87 22.556 19.767 20.639 1.00 28.65 C ATOM 2167 C VAL C 87 23.871 19.736 21.419 1.00 28.22 C ATOM 2168 O VAL C 87 24.606 18.744 21.374 1.00 28.14 O ATOM 2169 CB VAL C 87 22.710 20.700 19.406 1.00 28.53 C ATOM 2170 CG1 VAL C 87 23.822 20.213 18.492 1.00 28.29 C ATOM 2171 CG2 VAL C 87 21.405 20.804 18.648 1.00 28.27 C ATOM 0 H VAL C 87 21.167 20.990 21.335 1.00 29.30 H new ATOM 0 HA VAL C 87 22.338 18.877 20.321 1.00 28.65 H new ATOM 0 HB VAL C 87 22.949 21.584 19.727 1.00 28.53 H new ATOM 0 HG11 VAL C 87 23.900 20.809 17.731 1.00 28.29 H new ATOM 0 HG12 VAL C 87 24.660 20.201 18.980 1.00 28.29 H new ATOM 0 HG13 VAL C 87 23.617 19.317 18.181 1.00 28.29 H new ATOM 0 HG21 VAL C 87 21.521 21.389 17.883 1.00 28.27 H new ATOM 0 HG22 VAL C 87 21.137 19.923 18.343 1.00 28.27 H new ATOM 0 HG23 VAL C 87 20.720 21.166 19.231 1.00 28.27 H new ATOM 2172 N VAL C 88 24.138 20.825 22.140 1.00 27.55 N ATOM 2173 CA VAL C 88 25.324 20.962 22.982 1.00 27.18 C ATOM 2174 C VAL C 88 25.420 19.840 24.030 1.00 26.99 C ATOM 2175 O VAL C 88 26.516 19.368 24.339 1.00 26.94 O ATOM 2176 CB VAL C 88 25.369 22.368 23.659 1.00 27.24 C ATOM 2177 CG1 VAL C 88 26.508 22.473 24.645 1.00 26.87 C ATOM 2178 CG2 VAL C 88 25.486 23.475 22.604 1.00 27.00 C ATOM 0 H VAL C 88 23.626 21.516 22.153 1.00 27.55 H new ATOM 0 HA VAL C 88 26.098 20.879 22.403 1.00 27.18 H new ATOM 0 HB VAL C 88 24.537 22.481 24.145 1.00 27.24 H new ATOM 0 HG11 VAL C 88 26.508 23.356 25.047 1.00 26.87 H new ATOM 0 HG12 VAL C 88 26.399 21.803 25.338 1.00 26.87 H new ATOM 0 HG13 VAL C 88 27.349 22.328 24.185 1.00 26.87 H new ATOM 0 HG21 VAL C 88 25.512 24.339 23.043 1.00 27.00 H new ATOM 0 HG22 VAL C 88 26.299 23.349 22.091 1.00 27.00 H new ATOM 0 HG23 VAL C 88 24.720 23.438 22.010 1.00 27.00 H new ATOM 2179 N ALA C 89 24.273 19.406 24.551 1.00 26.78 N ATOM 2180 CA ALA C 89 24.230 18.360 25.580 1.00 26.75 C ATOM 2181 C ALA C 89 24.480 16.964 25.013 1.00 26.77 C ATOM 2182 O ALA C 89 25.244 16.184 25.588 1.00 27.07 O ATOM 2183 CB ALA C 89 22.894 18.399 26.343 1.00 26.51 C ATOM 0 H ALA C 89 23.501 19.706 24.321 1.00 26.78 H new ATOM 0 HA ALA C 89 24.954 18.549 26.198 1.00 26.75 H new ATOM 0 HB1 ALA C 89 22.886 17.701 27.017 1.00 26.51 H new ATOM 0 HB2 ALA C 89 22.791 19.263 26.771 1.00 26.51 H new ATOM 0 HB3 ALA C 89 22.162 18.257 25.722 1.00 26.51 H new ATOM 2184 N VAL C 90 23.847 16.655 23.885 1.00 26.61 N ATOM 2185 CA VAL C 90 23.902 15.307 23.314 1.00 26.61 C ATOM 2186 C VAL C 90 25.180 15.037 22.513 1.00 26.73 C ATOM 2187 O VAL C 90 25.786 13.975 22.649 1.00 26.63 O ATOM 2188 CB VAL C 90 22.627 14.982 22.475 1.00 26.51 C ATOM 2189 CG1 VAL C 90 22.820 13.729 21.644 1.00 26.26 C ATOM 2190 CG2 VAL C 90 21.418 14.815 23.392 1.00 26.14 C ATOM 0 H VAL C 90 23.377 17.214 23.431 1.00 26.61 H new ATOM 0 HA VAL C 90 23.925 14.702 24.072 1.00 26.61 H new ATOM 0 HB VAL C 90 22.471 15.726 21.872 1.00 26.51 H new ATOM 0 HG11 VAL C 90 22.014 13.551 21.134 1.00 26.26 H new ATOM 0 HG12 VAL C 90 23.565 13.855 21.036 1.00 26.26 H new ATOM 0 HG13 VAL C 90 23.004 12.978 22.229 1.00 26.26 H new ATOM 0 HG21 VAL C 90 20.633 14.614 22.859 1.00 26.14 H new ATOM 0 HG22 VAL C 90 21.581 14.089 24.014 1.00 26.14 H new ATOM 0 HG23 VAL C 90 21.271 15.636 23.886 1.00 26.14 H new ATOM 2191 N LEU C 91 25.581 15.998 21.686 1.00 27.10 N ATOM 2192 CA LEU C 91 26.771 15.851 20.847 1.00 27.44 C ATOM 2193 C LEU C 91 28.014 16.350 21.578 1.00 27.99 C ATOM 2194 O LEU C 91 27.914 17.253 22.411 1.00 27.74 O ATOM 2195 CB LEU C 91 26.587 16.593 19.519 1.00 27.26 C ATOM 2196 CG LEU C 91 25.423 16.161 18.613 1.00 27.51 C ATOM 2197 CD1 LEU C 91 25.476 16.923 17.300 1.00 26.71 C ATOM 2198 CD2 LEU C 91 25.415 14.655 18.348 1.00 26.85 C ATOM 0 H LEU C 91 25.175 16.750 21.594 1.00 27.10 H new ATOM 0 HA LEU C 91 26.894 14.908 20.655 1.00 27.44 H new ATOM 0 HB2 LEU C 91 26.476 17.536 19.717 1.00 27.26 H new ATOM 0 HB3 LEU C 91 27.409 16.504 19.011 1.00 27.26 H new ATOM 0 HG LEU C 91 24.600 16.372 19.082 1.00 27.51 H new ATOM 0 HD11 LEU C 91 24.739 16.645 16.734 1.00 26.71 H new ATOM 0 HD12 LEU C 91 25.408 17.875 17.475 1.00 26.71 H new ATOM 0 HD13 LEU C 91 26.315 16.737 16.851 1.00 26.71 H new ATOM 0 HD21 LEU C 91 24.666 14.431 17.774 1.00 26.85 H new ATOM 0 HD22 LEU C 91 26.243 14.398 17.913 1.00 26.85 H new ATOM 0 HD23 LEU C 91 25.331 14.179 19.189 1.00 26.85 H new ATOM 2199 N PRO C 92 29.194 15.765 21.275 1.00 28.74 N ATOM 2200 CA PRO C 92 30.405 16.127 22.021 1.00 29.17 C ATOM 2201 C PRO C 92 31.014 17.460 21.568 1.00 29.81 C ATOM 2202 O PRO C 92 32.169 17.504 21.127 1.00 30.03 O ATOM 2203 CB PRO C 92 31.346 14.951 21.733 1.00 29.19 C ATOM 2204 CG PRO C 92 30.953 14.501 20.353 1.00 28.74 C ATOM 2205 CD PRO C 92 29.466 14.740 20.244 1.00 28.56 C ATOM 0 HA PRO C 92 30.228 16.265 22.965 1.00 29.17 H new ATOM 0 HB2 PRO C 92 32.276 15.224 21.766 1.00 29.19 H new ATOM 0 HB3 PRO C 92 31.236 14.240 22.384 1.00 29.19 H new ATOM 0 HG2 PRO C 92 31.435 15.000 19.675 1.00 28.74 H new ATOM 0 HG3 PRO C 92 31.165 13.564 20.220 1.00 28.74 H new ATOM 0 HD2 PRO C 92 29.220 15.052 19.359 1.00 28.56 H new ATOM 0 HD3 PRO C 92 28.962 13.928 20.409 1.00 28.56 H new ATOM 2206 N ILE C 93 30.239 18.538 21.698 1.00 30.44 N ATOM 2207 CA ILE C 93 30.672 19.876 21.279 1.00 31.03 C ATOM 2208 C ILE C 93 30.721 20.899 22.433 1.00 31.85 C ATOM 2209 O ILE C 93 31.004 22.081 22.212 1.00 31.75 O ATOM 2210 CB ILE C 93 29.786 20.428 20.123 1.00 31.00 C ATOM 2211 CG1 ILE C 93 28.320 20.558 20.570 1.00 30.85 C ATOM 2212 CG2 ILE C 93 29.913 19.540 18.868 1.00 30.54 C ATOM 2213 CD1 ILE C 93 27.480 21.482 19.701 1.00 31.12 C ATOM 0 H ILE C 93 29.447 18.515 22.032 1.00 30.44 H new ATOM 0 HA ILE C 93 31.581 19.761 20.961 1.00 31.03 H new ATOM 0 HB ILE C 93 30.103 21.315 19.893 1.00 31.00 H new ATOM 0 HG12 ILE C 93 27.914 19.677 20.573 1.00 30.85 H new ATOM 0 HG13 ILE C 93 28.299 20.883 21.484 1.00 30.85 H new ATOM 0 HG21 ILE C 93 29.355 19.899 18.160 1.00 30.54 H new ATOM 0 HG22 ILE C 93 30.837 19.525 18.575 1.00 30.54 H new ATOM 0 HG23 ILE C 93 29.626 18.638 19.079 1.00 30.54 H new ATOM 0 HD11 ILE C 93 26.573 21.513 20.043 1.00 31.12 H new ATOM 0 HD12 ILE C 93 27.861 22.374 19.715 1.00 31.12 H new ATOM 0 HD13 ILE C 93 27.470 21.149 18.790 1.00 31.12 H new ATOM 2214 N ASP C 94 30.451 20.451 23.657 1.00 32.82 N ATOM 2215 CA ASP C 94 30.439 21.359 24.805 1.00 33.98 C ATOM 2216 C ASP C 94 31.843 21.561 25.351 1.00 34.61 C ATOM 2217 O ASP C 94 32.738 20.747 25.105 1.00 34.50 O ATOM 2218 CB ASP C 94 29.501 20.846 25.909 1.00 34.16 C ATOM 2219 CG ASP C 94 29.113 21.936 26.922 1.00 35.70 C ATOM 2220 OD1 ASP C 94 29.326 23.146 26.655 1.00 36.57 O ATOM 2221 OD2 ASP C 94 28.578 21.576 27.997 1.00 37.31 O ATOM 0 H ASP C 94 30.273 19.631 23.845 1.00 32.82 H new ATOM 0 HA ASP C 94 30.103 22.216 24.499 1.00 33.98 H new ATOM 0 HB2 ASP C 94 28.696 20.488 25.502 1.00 34.16 H new ATOM 0 HB3 ASP C 94 29.931 20.114 26.378 1.00 34.16 H new ATOM 2222 N PHE C 95 32.025 22.662 26.079 1.00 35.62 N ATOM 2223 CA PHE C 95 33.267 22.956 26.787 1.00 36.78 C ATOM 2224 C PHE C 95 33.441 21.997 27.957 1.00 38.33 C ATOM 2225 O PHE C 95 32.464 21.558 28.559 1.00 38.23 O ATOM 2226 CB PHE C 95 33.259 24.393 27.323 1.00 35.83 C ATOM 2227 CG PHE C 95 33.246 25.451 26.255 1.00 34.71 C ATOM 2228 CD1 PHE C 95 34.432 25.882 25.666 1.00 33.28 C ATOM 2229 CD2 PHE C 95 32.046 26.038 25.854 1.00 33.26 C ATOM 2230 CE1 PHE C 95 34.423 26.870 24.682 1.00 32.48 C ATOM 2231 CE2 PHE C 95 32.028 27.032 24.871 1.00 32.65 C ATOM 2232 CZ PHE C 95 33.219 27.447 24.286 1.00 32.83 C ATOM 0 H PHE C 95 31.421 23.267 26.176 1.00 35.62 H new ATOM 0 HA PHE C 95 34.001 22.851 26.161 1.00 36.78 H new ATOM 0 HB2 PHE C 95 32.481 24.511 27.890 1.00 35.83 H new ATOM 0 HB3 PHE C 95 34.041 24.523 27.883 1.00 35.83 H new ATOM 0 HD1 PHE C 95 35.240 25.506 25.932 1.00 33.28 H new ATOM 0 HD2 PHE C 95 31.248 25.765 26.245 1.00 33.26 H new ATOM 0 HE1 PHE C 95 35.221 27.144 24.290 1.00 32.48 H new ATOM 0 HE2 PHE C 95 31.222 27.414 24.609 1.00 32.65 H new ATOM 0 HZ PHE C 95 33.212 28.108 23.632 1.00 32.83 H new ATOM 2233 N SER C 96 34.694 21.684 28.267 1.00 40.67 N ATOM 2234 CA SER C 96 35.044 20.898 29.449 1.00 43.06 C ATOM 2235 C SER C 96 36.106 21.658 30.253 1.00 44.96 C ATOM 2236 O SER C 96 36.726 22.587 29.728 1.00 44.88 O ATOM 2237 CB SER C 96 35.546 19.508 29.039 1.00 42.89 C ATOM 2238 OG SER C 96 36.798 19.586 28.382 1.00 42.97 O ATOM 0 H SER C 96 35.372 21.923 27.795 1.00 40.67 H new ATOM 0 HA SER C 96 34.259 20.770 30.004 1.00 43.06 H new ATOM 0 HB2 SER C 96 35.626 18.946 29.825 1.00 42.89 H new ATOM 0 HB3 SER C 96 34.897 19.087 28.454 1.00 42.89 H new ATOM 0 HG SER C 96 36.677 19.732 27.564 1.00 42.97 H new ATOM 2239 N PRO C 97 36.313 21.282 31.533 1.00 47.16 N ATOM 2240 CA PRO C 97 37.331 21.968 32.340 1.00 48.98 C ATOM 2241 C PRO C 97 38.756 21.899 31.769 1.00 51.07 C ATOM 2242 O PRO C 97 39.558 22.800 32.025 1.00 50.98 O ATOM 2243 CB PRO C 97 37.252 21.244 33.685 1.00 48.93 C ATOM 2244 CG PRO C 97 35.872 20.659 33.719 1.00 48.01 C ATOM 2245 CD PRO C 97 35.611 20.245 32.314 1.00 47.14 C ATOM 0 HA PRO C 97 37.154 22.921 32.380 1.00 48.98 H new ATOM 0 HB2 PRO C 97 37.930 20.553 33.754 1.00 48.93 H new ATOM 0 HB3 PRO C 97 37.394 21.856 34.424 1.00 48.93 H new ATOM 0 HG2 PRO C 97 35.823 19.903 34.325 1.00 48.01 H new ATOM 0 HG3 PRO C 97 35.220 21.309 34.023 1.00 48.01 H new ATOM 0 HD2 PRO C 97 35.958 19.358 32.129 1.00 47.14 H new ATOM 0 HD3 PRO C 97 34.662 20.225 32.115 1.00 47.14 H new ATOM 2246 N GLU C 98 39.053 20.850 31.001 1.00 53.73 N ATOM 2247 CA GLU C 98 40.352 20.683 30.333 1.00 56.65 C ATOM 2248 C GLU C 98 40.693 21.827 29.381 1.00 57.94 C ATOM 2249 O GLU C 98 41.857 22.220 29.260 1.00 58.13 O ATOM 2250 CB GLU C 98 40.381 19.377 29.539 1.00 56.52 C ATOM 2251 CG GLU C 98 40.612 18.128 30.366 1.00 57.99 C ATOM 2252 CD GLU C 98 40.631 16.862 29.523 1.00 58.20 C ATOM 2253 OE1 GLU C 98 40.223 15.803 30.049 1.00 60.57 O ATOM 2254 OE2 GLU C 98 41.047 16.922 28.342 1.00 60.08 O ATOM 0 H GLU C 98 38.502 20.207 30.850 1.00 53.73 H new ATOM 0 HA GLU C 98 41.013 20.674 31.043 1.00 56.65 H new ATOM 0 HB2 GLU C 98 39.540 19.284 29.065 1.00 56.52 H new ATOM 0 HB3 GLU C 98 41.079 19.438 28.868 1.00 56.52 H new ATOM 0 HG2 GLU C 98 41.454 18.209 30.840 1.00 57.99 H new ATOM 0 HG3 GLU C 98 39.915 18.055 31.037 1.00 57.99 H new ATOM 2255 N VAL C 99 39.673 22.345 28.701 1.00 59.85 N ATOM 2256 CA VAL C 99 39.856 23.393 27.698 1.00 61.78 C ATOM 2257 C VAL C 99 39.433 24.771 28.218 1.00 63.29 C ATOM 2258 O VAL C 99 39.355 25.741 27.458 1.00 63.27 O ATOM 2259 CB VAL C 99 39.145 23.035 26.359 1.00 61.64 C ATOM 2260 CG1 VAL C 99 39.699 21.731 25.805 1.00 61.55 C ATOM 2261 CG2 VAL C 99 37.628 22.941 26.536 1.00 61.46 C ATOM 0 H VAL C 99 38.856 22.099 28.808 1.00 59.85 H new ATOM 0 HA VAL C 99 40.807 23.445 27.514 1.00 61.78 H new ATOM 0 HB VAL C 99 39.322 23.748 25.726 1.00 61.64 H new ATOM 0 HG11 VAL C 99 39.251 21.517 24.972 1.00 61.55 H new ATOM 0 HG12 VAL C 99 40.651 21.826 25.644 1.00 61.55 H new ATOM 0 HG13 VAL C 99 39.549 21.018 26.445 1.00 61.55 H new ATOM 0 HG21 VAL C 99 37.216 22.717 25.687 1.00 61.46 H new ATOM 0 HG22 VAL C 99 37.420 22.253 27.187 1.00 61.46 H new ATOM 0 HG23 VAL C 99 37.285 23.793 26.847 1.00 61.46 H new ATOM 2262 N GLU C 100 39.188 24.841 29.526 1.00 65.42 N ATOM 2263 CA GLU C 100 38.769 26.072 30.203 1.00 67.49 C ATOM 2264 C GLU C 100 39.792 27.224 30.141 1.00 68.72 C ATOM 2265 O GLU C 100 39.396 28.368 29.912 1.00 68.74 O ATOM 2266 CB GLU C 100 38.354 25.775 31.652 1.00 67.61 C ATOM 2267 CG GLU C 100 37.595 26.903 32.354 1.00 68.90 C ATOM 2268 CD GLU C 100 36.184 27.130 31.811 1.00 70.44 C ATOM 2269 OE1 GLU C 100 35.730 26.375 30.920 1.00 70.89 O ATOM 2270 OE2 GLU C 100 35.523 28.078 32.287 1.00 71.19 O ATOM 0 H GLU C 100 39.261 24.166 30.054 1.00 65.42 H new ATOM 0 HA GLU C 100 38.002 26.395 29.705 1.00 67.49 H new ATOM 0 HB2 GLU C 100 37.800 24.979 31.658 1.00 67.61 H new ATOM 0 HB3 GLU C 100 39.151 25.571 32.167 1.00 67.61 H new ATOM 0 HG2 GLU C 100 37.539 26.703 33.302 1.00 68.90 H new ATOM 0 HG3 GLU C 100 38.102 27.725 32.267 1.00 68.90 H new ATOM 2271 N PRO C 101 41.101 26.936 30.341 1.00 70.10 N ATOM 2272 CA PRO C 101 42.094 28.009 30.188 1.00 71.30 C ATOM 2273 C PRO C 101 42.145 28.594 28.775 1.00 72.58 C ATOM 2274 O PRO C 101 42.513 29.758 28.602 1.00 72.69 O ATOM 2275 CB PRO C 101 43.420 27.310 30.512 1.00 71.22 C ATOM 2276 CG PRO C 101 43.157 25.863 30.293 1.00 70.71 C ATOM 2277 CD PRO C 101 41.743 25.665 30.724 1.00 70.17 C ATOM 0 HA PRO C 101 41.885 28.764 30.760 1.00 71.30 H new ATOM 0 HB2 PRO C 101 44.134 27.628 29.937 1.00 71.22 H new ATOM 0 HB3 PRO C 101 43.694 27.483 31.426 1.00 71.22 H new ATOM 0 HG2 PRO C 101 43.279 25.620 29.362 1.00 70.71 H new ATOM 0 HG3 PRO C 101 43.764 25.312 30.812 1.00 70.71 H new ATOM 0 HD2 PRO C 101 41.334 24.907 30.278 1.00 70.17 H new ATOM 0 HD3 PRO C 101 41.677 25.502 31.678 1.00 70.17 H new ATOM 2278 N PHE C 102 41.777 27.788 27.782 1.00 74.11 N ATOM 2279 CA PHE C 102 41.782 28.213 26.385 1.00 75.63 C ATOM 2280 C PHE C 102 40.505 28.971 26.024 1.00 76.92 C ATOM 2281 O PHE C 102 40.508 29.804 25.117 1.00 77.04 O ATOM 2282 CB PHE C 102 42.004 27.011 25.458 1.00 75.37 C ATOM 2283 CG PHE C 102 43.146 26.126 25.884 1.00 75.10 C ATOM 2284 CD1 PHE C 102 44.465 26.534 25.705 1.00 74.71 C ATOM 2285 CD2 PHE C 102 42.902 24.893 26.481 1.00 74.72 C ATOM 2286 CE1 PHE C 102 45.521 25.724 26.111 1.00 74.50 C ATOM 2287 CE2 PHE C 102 43.953 24.073 26.889 1.00 74.51 C ATOM 2288 CZ PHE C 102 45.265 24.491 26.703 1.00 74.59 C ATOM 0 H PHE C 102 41.517 26.977 27.900 1.00 74.11 H new ATOM 0 HA PHE C 102 42.521 28.829 26.261 1.00 75.63 H new ATOM 0 HB2 PHE C 102 41.191 26.483 25.424 1.00 75.37 H new ATOM 0 HB3 PHE C 102 42.172 27.332 24.558 1.00 75.37 H new ATOM 0 HD1 PHE C 102 44.642 27.357 25.310 1.00 74.71 H new ATOM 0 HD2 PHE C 102 42.025 24.612 26.610 1.00 74.72 H new ATOM 0 HE1 PHE C 102 46.398 26.007 25.987 1.00 74.50 H new ATOM 0 HE2 PHE C 102 43.777 23.250 27.284 1.00 74.51 H new ATOM 0 HZ PHE C 102 45.970 23.948 26.973 1.00 74.59 H new ATOM 2289 N ARG C 103 39.424 28.678 26.748 1.00 78.66 N ATOM 2290 CA ARG C 103 38.156 29.396 26.614 1.00 80.39 C ATOM 2291 C ARG C 103 38.282 30.824 27.146 1.00 81.77 C ATOM 2292 O ARG C 103 37.831 31.777 26.506 1.00 81.87 O ATOM 2293 CB ARG C 103 37.045 28.659 27.366 1.00 80.21 C ATOM 2294 CG ARG C 103 35.653 29.224 27.138 1.00 80.11 C ATOM 2295 CD ARG C 103 34.710 28.825 28.258 1.00 79.86 C ATOM 2296 NE ARG C 103 33.323 28.758 27.802 1.00 79.77 N ATOM 2297 CZ ARG C 103 32.270 28.591 28.598 1.00 79.74 C ATOM 2298 NH1 ARG C 103 32.428 28.483 29.912 1.00 79.78 N ATOM 2299 NH2 ARG C 103 31.050 28.539 28.079 1.00 79.60 N ATOM 0 H ARG C 103 39.406 28.051 27.336 1.00 78.66 H new ATOM 0 HA ARG C 103 37.930 29.435 25.671 1.00 80.39 H new ATOM 0 HB2 ARG C 103 37.052 27.727 27.099 1.00 80.21 H new ATOM 0 HB3 ARG C 103 37.241 28.683 28.316 1.00 80.21 H new ATOM 0 HG2 ARG C 103 35.699 30.191 27.079 1.00 80.11 H new ATOM 0 HG3 ARG C 103 35.306 28.905 26.290 1.00 80.11 H new ATOM 0 HD2 ARG C 103 34.976 27.962 28.613 1.00 79.86 H new ATOM 0 HD3 ARG C 103 34.781 29.464 28.984 1.00 79.86 H new ATOM 0 HE ARG C 103 33.177 28.832 26.958 1.00 79.77 H new ATOM 0 HH11 ARG C 103 33.216 28.521 30.255 1.00 79.78 H new ATOM 0 HH12 ARG C 103 31.743 28.375 30.420 1.00 79.78 H new ATOM 0 HH21 ARG C 103 30.941 28.613 27.229 1.00 79.60 H new ATOM 0 HH22 ARG C 103 30.369 28.431 28.592 1.00 79.60 H new ATOM 2300 N GLU C 104 38.897 30.951 28.321 1.00 83.55 N ATOM 2301 CA GLU C 104 39.122 32.240 28.973 1.00 85.35 C ATOM 2302 C GLU C 104 40.052 33.132 28.148 1.00 86.31 C ATOM 2303 O GLU C 104 39.851 34.346 28.071 1.00 86.45 O ATOM 2304 CB GLU C 104 39.695 32.035 30.381 1.00 85.30 C ATOM 2305 CG GLU C 104 38.763 31.299 31.349 1.00 85.85 C ATOM 2306 CD GLU C 104 39.445 30.894 32.654 1.00 85.98 C ATOM 2307 OE1 GLU C 104 40.695 30.906 32.721 1.00 86.79 O ATOM 2308 OE2 GLU C 104 38.725 30.556 33.619 1.00 86.82 O ATOM 0 H GLU C 104 39.199 30.281 28.768 1.00 83.55 H new ATOM 0 HA GLU C 104 38.265 32.688 29.043 1.00 85.35 H new ATOM 0 HB2 GLU C 104 40.525 31.539 30.310 1.00 85.30 H new ATOM 0 HB3 GLU C 104 39.914 32.902 30.758 1.00 85.30 H new ATOM 0 HG2 GLU C 104 38.003 31.867 31.551 1.00 85.85 H new ATOM 0 HG3 GLU C 104 38.416 30.505 30.913 1.00 85.85 H new ATOM 2309 N ALA C 105 41.060 32.519 27.531 1.00 87.66 N ATOM 2310 CA ALA C 105 42.011 33.228 26.675 1.00 88.95 C ATOM 2311 C ALA C 105 41.387 33.676 25.352 1.00 89.87 C ATOM 2312 O ALA C 105 41.779 34.701 24.792 1.00 90.02 O ATOM 2313 CB ALA C 105 43.240 32.365 26.419 1.00 88.90 C ATOM 0 H ALA C 105 41.213 31.675 27.597 1.00 87.66 H new ATOM 0 HA ALA C 105 42.277 34.031 27.149 1.00 88.95 H new ATOM 0 HB1 ALA C 105 43.861 32.847 25.851 1.00 88.90 H new ATOM 0 HB2 ALA C 105 43.670 32.155 27.263 1.00 88.90 H new ATOM 0 HB3 ALA C 105 42.972 31.542 25.980 1.00 88.90 H new ATOM 2314 N ALA C 106 40.419 32.902 24.860 1.00 91.00 N ATOM 2315 CA ALA C 106 39.735 33.205 23.603 1.00 92.02 C ATOM 2316 C ALA C 106 38.761 34.376 23.731 1.00 92.74 C ATOM 2317 O ALA C 106 38.539 35.111 22.767 1.00 92.91 O ATOM 2318 CB ALA C 106 39.012 31.972 23.080 1.00 92.03 C ATOM 0 H ALA C 106 40.141 32.186 25.246 1.00 91.00 H new ATOM 0 HA ALA C 106 40.418 33.471 22.968 1.00 92.02 H new ATOM 0 HB1 ALA C 106 38.564 32.188 22.247 1.00 92.03 H new ATOM 0 HB2 ALA C 106 39.654 31.261 22.926 1.00 92.03 H new ATOM 0 HB3 ALA C 106 38.357 31.680 23.733 1.00 92.03 H new ATOM 2319 N GLU C 107 38.188 34.544 24.922 1.00 93.55 N ATOM 2320 CA GLU C 107 37.179 35.577 25.157 1.00 94.28 C ATOM 2321 C GLU C 107 37.709 36.710 26.037 1.00 94.42 C ATOM 2322 O GLU C 107 38.002 37.801 25.547 1.00 94.55 O ATOM 2323 CB GLU C 107 35.909 34.964 25.759 1.00 94.46 C ATOM 2324 CG GLU C 107 35.367 33.775 24.975 1.00 95.47 C ATOM 2325 CD GLU C 107 33.910 33.480 25.271 1.00 96.60 C ATOM 2326 OE1 GLU C 107 33.120 33.399 24.307 1.00 97.06 O ATOM 2327 OE2 GLU C 107 33.551 33.332 26.459 1.00 97.11 O ATOM 0 H GLU C 107 38.372 34.066 25.613 1.00 93.55 H new ATOM 0 HA GLU C 107 36.957 35.966 24.297 1.00 94.28 H new ATOM 0 HB2 GLU C 107 36.096 34.683 26.668 1.00 94.46 H new ATOM 0 HB3 GLU C 107 35.223 35.648 25.809 1.00 94.46 H new ATOM 0 HG2 GLU C 107 35.470 33.947 24.026 1.00 95.47 H new ATOM 0 HG3 GLU C 107 35.898 32.990 25.181 1.00 95.47 H new TER 2328 GLU C 107 HETATM 2329 N NH4 A 126 25.572 18.311 1.238 1.00 26.33 N HETATM 2330 N NH4 B 126 14.426 0.651 1.184 1.00 21.18 N HETATM 2331 N NH4 C 126 46.206 17.559 1.324 1.00 24.26 N HETATM 2332 O HOH A 127 29.067 15.366 7.289 1.00 23.76 O HETATM 2333 O HOH A 128 17.936 9.941 25.764 1.00 32.43 O HETATM 2334 O HOH A 129 3.975 -0.769 23.311 1.00 37.72 O HETATM 2335 O HOH A 130 11.795 6.608 5.197 1.00 22.85 O HETATM 2336 O HOH A 131 27.894 10.456 -0.022 1.00 67.40 O HETATM 2337 O HOH A 132 24.089 16.717 -0.338 1.00 34.79 O HETATM 2338 O HOH A 133 0.477 17.791 15.960 1.00 83.99 O HETATM 2339 O HOH A 134 23.825 9.662 22.681 1.00 27.22 O HETATM 2340 O HOH A 135 21.348 14.236 1.046 1.00 37.83 O HETATM 2341 O HOH A 136 17.420 4.865 25.011 1.00 27.98 O HETATM 2342 O HOH A 137 9.714 6.803 25.215 1.00 32.68 O HETATM 2343 O HOH A 138 21.978 23.567 10.724 1.00 31.55 O HETATM 2344 O HOH A 139 1.575 8.368 24.527 1.00 51.43 O HETATM 2345 O HOH A 140 12.349 22.109 20.397 1.00 38.09 O HETATM 2346 O HOH A 141 27.934 5.897 19.406 1.00 26.81 O HETATM 2347 O HOH A 142 28.560 19.027 -0.573 1.00 42.33 O HETATM 2348 O HOH A 143 6.293 17.193 20.060 1.00 31.88 O HETATM 2349 O HOH A 144 17.538 20.607 0.850 1.00 58.46 O HETATM 2350 O HOH A 145 27.462 -0.468 12.616 1.00 29.00 O HETATM 2351 O HOH A 146 20.533 7.259 19.945 1.00 26.57 O HETATM 2352 O HOH A 147 13.670 18.846 3.045 1.00 35.77 O HETATM 2353 O HOH A 148 16.365 2.340 25.075 1.00 27.15 O HETATM 2354 O HOH A 149 29.818 11.392 22.889 1.00 27.80 O HETATM 2355 O HOH A 150 22.856 6.441 21.005 1.00 30.12 O HETATM 2356 O HOH A 151 31.361 13.225 4.276 1.00 44.87 O HETATM 2357 O HOH A 152 20.013 -2.810 23.822 1.00 35.06 O HETATM 2358 O HOH A 153 31.469 9.643 19.177 1.00 33.28 O HETATM 2359 O HOH A 154 15.728 2.393 27.678 1.00 30.69 O HETATM 2360 O HOH A 155 17.080 23.324 7.412 1.00 34.55 O HETATM 2361 O HOH A 156 15.776 24.899 11.562 1.00 38.36 O HETATM 2362 O HOH B 127 18.755 2.286 7.261 1.00 23.38 O HETATM 2363 O HOH B 128 14.803 -1.575 -0.573 1.00 35.41 O HETATM 2364 O HOH B 129 26.531 -3.486 19.482 1.00 24.77 O HETATM 2365 O HOH B 130 20.217 -27.323 23.254 1.00 38.45 O HETATM 2366 O HOH B 131 16.564 -25.374 14.118 1.00 35.06 O HETATM 2367 O HOH B 132 25.031 1.455 19.084 1.00 37.72 O HETATM 2368 O HOH B 133 22.697 1.173 22.835 1.00 24.42 O HETATM 2369 O HOH B 134 -0.396 -14.955 27.305 1.00 56.38 O HETATM 2370 O HOH B 135 17.448 -26.756 22.135 1.00 52.45 O HETATM 2371 O HOH B 136 4.771 -23.541 15.947 1.00 79.15 O HETATM 2372 O HOH B 137 10.551 8.778 0.908 1.00 65.49 O HETATM 2373 O HOH B 138 20.187 -7.076 24.421 1.00 43.42 O HETATM 2374 O HOH B 139 21.479 -8.927 19.950 1.00 22.02 O HETATM 2375 O HOH B 140 18.011 -16.951 5.128 1.00 21.61 O HETATM 2376 O HOH B 141 31.869 -6.849 12.503 1.00 30.76 O HETATM 2377 O HOH B 142 15.843 -4.676 1.023 1.00 35.86 O HETATM 2378 O HOH B 143 17.510 -9.818 25.789 1.00 35.01 O HETATM 2379 O HOH B 144 5.615 -16.411 20.073 1.00 50.11 O HETATM 2380 O HOH B 145 23.318 -7.461 21.225 1.00 32.77 O HETATM 2381 O HOH B 146 21.154 -4.962 22.589 1.00 28.76 O HETATM 2382 O HOH B 147 23.813 -15.137 24.980 1.00 28.74 O HETATM 2383 O HOH B 148 22.287 -13.130 25.070 1.00 34.10 O HETATM 2384 O HOH C 127 30.534 17.829 25.138 1.00 26.14 O HETATM 2385 O HOH C 128 29.180 23.459 5.274 1.00 21.66 O HETATM 2386 O HOH C 129 29.103 34.634 17.534 1.00 51.04 O HETATM 2387 O HOH C 130 36.608 9.341 19.605 1.00 29.13 O HETATM 2388 O HOH C 131 34.296 16.355 20.008 1.00 21.94 O HETATM 2389 O HOH C 132 40.867 19.005 0.992 1.00 45.85 O HETATM 2390 O HOH C 133 45.552 13.014 7.287 1.00 23.91 O HETATM 2391 O HOH C 134 48.309 16.213 -0.480 1.00 52.73 O HETATM 2392 O HOH C 135 28.328 25.533 25.256 1.00 40.30 O HETATM 2393 O HOH C 136 24.870 33.277 22.237 1.00 64.48 O HETATM 2394 O HOH C 137 44.030 18.262 -0.388 1.00 34.33 O HETATM 2395 O HOH C 138 42.692 10.418 22.624 1.00 33.30 O HETATM 2396 O HOH C 139 25.192 11.657 23.628 1.00 24.00 O HETATM 2397 O HOH C 140 32.848 17.383 24.855 1.00 43.86 O HETATM 2398 O HOH C 141 50.262 15.056 -2.579 1.00 56.97 O HETATM 2399 O HOH C 142 38.140 10.479 21.209 1.00 45.03 O HETATM 2400 O HOH C 143 30.911 6.331 12.431 1.00 28.35 O HETATM 2401 O HOH C 144 38.057 14.691 22.591 1.00 24.90 O HETATM 2402 O HOH C 145 28.081 17.290 25.070 1.00 34.74 O HETATM 2403 O HOH C 146 35.719 33.567 20.194 1.00 28.60 O HETATM 2404 O HOH C 147 41.785 8.127 19.211 1.00 30.55 O HETATM 2405 O HOH C 148 48.955 23.375 10.896 1.00 28.95 O HETATM 2406 O HOH C 149 35.570 20.095 25.697 1.00 36.34 O HETATM 2407 O HOH C 150 43.155 30.858 20.186 1.00 45.08 O HETATM 2408 O HOH C 151 43.626 25.877 1.008 1.00 54.04 O HETATM 2409 O HOH C 152 34.838 14.019 21.068 1.00 35.72 O HETATM 2410 O HOH C 153 36.166 29.897 22.786 1.00 44.36 O HETATM 2411 O HOH C 154 38.192 2.927 15.278 1.00 41.66 O END