USER MOD reduce.3.24.130724 H: found=0, std=0, add=3707, rem=0, adj=87 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER TRANSFERASE 06-DEC-05 2F9T TITLE STRUCTURE OF THE TYPE III COAA FROM PSEUDOMONAS AERUGINOSA COMPND MOL_ID: 1; COMPND 2 MOLECULE: PANTOTHENATE KINASE; COMPND 3 CHAIN: A, B; COMPND 4 EC: 2.7.1.33; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: PSEUDOMONAS AERUGINOSA; SOURCE 3 ORGANISM_TAXID: 208964; SOURCE 4 STRAIN: PAO1; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: ROSETTA(DE3); SOURCE 8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 9 EXPRESSION_SYSTEM_PLASMID: PET-28A KEYWDS PANTOTHENATE KINASE, COAA, TRANSFERASE EXPDTA X-RAY DIFFRACTION AUTHOR R.LEONARDI,M.K.YUN,S.CHOHNAN,S.W.WHITE,C.O.ROCK,S.JACKOWSKI REVDAT 3 13-JUL-11 2F9T 1 VERSN REVDAT 2 24-FEB-09 2F9T 1 VERSN REVDAT 1 22-AUG-06 2F9T 0 JRNL AUTH B.S.HONG,M.K.YUN,Y.M.ZHANG,S.CHOHNAN,C.O.ROCK,S.W.WHITE, JRNL AUTH 2 S.JACKOWSKI,H.W.PARK,R.LEONARDI JRNL TITL PROKARYOTIC TYPE II AND TYPE III PANTOTHENATE KINASES: THE JRNL TITL 2 SAME MONOMER FOLD CREATES DIMERS WITH DISTINCT CATALYTIC JRNL TITL 3 PROPERTIES. JRNL REF STRUCTURE V. 14 1251 2006 JRNL REFN ISSN 0969-2126 JRNL PMID 16905099 JRNL DOI 10.1016/J.STR.2006.06.008 REMARK 2 REMARK 2 RESOLUTION. 2.20 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.1 REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- REMARK 3 : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES,PANNU, REMARK 3 : READ,RICE,SIMONSON,WARREN REMARK 3 REMARK 3 REFINEMENT TARGET : ENGH & HUBER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.20 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 49.98 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 374363.910 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 95.0 REMARK 3 NUMBER OF REFLECTIONS : 37343 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 SET) : 0.227 REMARK 3 FREE R VALUE : 0.268 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 1873 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.006 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 10 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.20 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.28 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 76.80 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 2813 REMARK 3 BIN R VALUE (WORKING SET) : 0.3070 REMARK 3 BIN FREE R VALUE : 0.3380 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 5.20 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 154 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.027 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 3636 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 180 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 28.20 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 44.10 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 3.96000 REMARK 3 B22 (A**2) : 3.96000 REMARK 3 B33 (A**2) : -7.93000 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 COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.28 REMARK 3 ESD FROM SIGMAA (A) : 0.27 REMARK 3 LOW RESOLUTION CUTOFF (A) : 5.00 REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : 0.32 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.28 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.005 REMARK 3 BOND ANGLES (DEGREES) : 1.20 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 22.70 REMARK 3 IMPROPER ANGLES (DEGREES) : 0.68 REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : RESTRAINED REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : 1.380 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 2.270 ; 2.000 REMARK 3 SIDE-CHAIN BOND (A**2) : 2.470 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 3.450 ; 2.500 REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : FLAT MODEL REMARK 3 KSOL : 0.37 REMARK 3 BSOL : 62.72 REMARK 3 REMARK 3 NCS MODEL : NULL REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : PROTEIN_REP.PARAM REMARK 3 PARAMETER FILE 2 : WATER.PARAM REMARK 3 PARAMETER FILE 3 : NULL REMARK 3 PARAMETER FILE 4 : NULL REMARK 3 PARAMETER FILE 5 : NULL REMARK 3 PARAMETER FILE 6 : NULL REMARK 3 TOPOLOGY FILE 1 : &_1_TOPOLOGY_INFILE_1 REMARK 3 TOPOLOGY FILE 2 : &_1_TOPOLOGY_INFILE_2 REMARK 3 TOPOLOGY FILE 3 : &_1_TOPOLOGY_INFILE_3 REMARK 3 TOPOLOGY FILE 4 : &_1_TOPOLOGY_INFILE_4 REMARK 3 TOPOLOGY FILE 5 : &_1_TOPOLOGY_INFILE_5 REMARK 3 TOPOLOGY FILE 6 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 2F9T COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 11-JAN-06. REMARK 100 THE RCSB ID CODE IS RCSB035630. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 07-AUG-05 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 22-ID REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.97946, 0.97970, 0.97178 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARMOSAIC 225 MM CCD REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 38666 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.200 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -3.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 98.3 REMARK 200 DATA REDUNDANCY : 7.100 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 0.01000 REMARK 200 FOR THE DATA SET : 20.8000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.20 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.28 REMARK 200 COMPLETENESS FOR SHELL (%) : 86.8 REMARK 200 DATA REDUNDANCY IN SHELL : 5.00 REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : 0.45000 REMARK 200 FOR SHELL : 2.200 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: MAD REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MAD REMARK 200 SOFTWARE USED: SOLVE REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 60.92 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.15 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: WATER, TIRS-HCL, PH 7.5, VAPOR REMARK 280 DIFFUSION, HANGING DROP, TEMPERATURE 291.0K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 41 21 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -Y+1/2,X+1/2,Z+1/4 REMARK 290 4555 Y+1/2,-X+1/2,Z+3/4 REMARK 290 5555 -X+1/2,Y+1/2,-Z+1/4 REMARK 290 6555 X+1/2,-Y+1/2,-Z+3/4 REMARK 290 7555 Y,X,-Z REMARK 290 8555 -Y,-X,-Z+1/2 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 89.60050 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 45.62500 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 45.62500 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 44.80025 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 45.62500 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 45.62500 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 134.40075 REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 45.62500 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 45.62500 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 44.80025 REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 45.62500 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 45.62500 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 134.40075 REMARK 290 SMTRY1 7 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 7 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 89.60050 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 3910 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 20920 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -29.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MSE A -22 REMARK 465 GLY A -21 REMARK 465 SER A -20 REMARK 465 SER A -19 REMARK 465 HIS A -18 REMARK 465 HIS A -17 REMARK 465 HIS A -16 REMARK 465 HIS A -15 REMARK 465 HIS A -14 REMARK 465 HIS A -13 REMARK 465 SER A -12 REMARK 465 SER A -11 REMARK 465 GLY A -10 REMARK 465 LEU A -9 REMARK 465 VAL A -8 REMARK 465 PRO A -7 REMARK 465 ARG A -6 REMARK 465 GLY A -5 REMARK 465 SER A -4 REMARK 465 HIS A -3 REMARK 465 MSE A -2 REMARK 465 THR A 155 REMARK 465 HIS A 156 REMARK 465 THR A 157 REMARK 465 ARG A 158 REMARK 465 ARG A 159 REMARK 465 ILE A 160 REMARK 465 ARG A 161 REMARK 465 TYR A 162 REMARK 465 ASP A 163 REMARK 465 MSE B -22 REMARK 465 GLY B -21 REMARK 465 SER B -20 REMARK 465 SER B -19 REMARK 465 HIS B -18 REMARK 465 HIS B -17 REMARK 465 HIS B -16 REMARK 465 HIS B -15 REMARK 465 HIS B -14 REMARK 465 HIS B -13 REMARK 465 SER B -12 REMARK 465 SER B -11 REMARK 465 GLY B -10 REMARK 465 LEU B -9 REMARK 465 VAL B -8 REMARK 465 PRO B -7 REMARK 465 ARG B -6 REMARK 465 GLY B -5 REMARK 465 SER B -4 REMARK 465 HIS B -3 REMARK 465 MSE B -2 REMARK 465 ALA B -1 REMARK 465 GLU B 248 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 ARG A 154 CG CD NE CZ NH1 NH2 REMARK 470 ASP A 164 CG OD1 OD2 REMARK 470 ARG A 168 CG CD NE CZ NH1 NH2 REMARK 470 SER B 41 OG REMARK 470 GLN B 42 CG CD OE1 NE2 REMARK 470 GLN B 43 CG CD OE1 NE2 REMARK 470 LEU B 64 CG CD1 CD2 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ALA A 21 21.44 -163.53 REMARK 500 PRO A 46 57.18 -66.95 REMARK 500 SER A 151 -2.25 -52.59 REMARK 500 SER B 10 -85.43 -108.82 REMARK 500 ALA B 21 23.71 -165.15 REMARK 500 GLU B 30 0.69 -67.00 REMARK 500 ALA B 34 21.44 -68.52 REMARK 500 LEU B 35 -61.76 -122.44 REMARK 500 SER B 41 -97.82 -29.51 REMARK 500 ALA B 44 -66.19 162.11 REMARK 500 LEU B 45 119.03 -15.00 REMARK 500 ALA B 66 -72.29 -59.53 REMARK 500 ARG B 67 5.82 -60.14 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A 460 DISTANCE = 5.63 ANGSTROMS REMARK 525 HOH B 553 DISTANCE = 5.70 ANGSTROMS REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 2F9W RELATED DB: PDB REMARK 900 SAME STRUCTURE, COMPLEXED WITH PANTOTHENIC ACID DBREF 2F9T A 1 248 UNP Q9HWC1 Q9HWC1_PSEAE 1 248 DBREF 2F9T B 1 248 UNP Q9HWC1 Q9HWC1_PSEAE 1 248 SEQADV 2F9T MSE A -22 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T GLY A -21 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T SER A -20 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T SER A -19 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T HIS A -18 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T HIS A -17 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T HIS A -16 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T HIS A -15 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T HIS A -14 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T HIS A -13 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T SER A -12 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T SER A -11 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T GLY A -10 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T LEU A -9 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T VAL A -8 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T PRO A -7 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T ARG A -6 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T GLY A -5 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T SER A -4 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T HIS A -3 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T MSE A -2 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T ALA A -1 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T SER A 0 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T MSE A 1 UNP Q9HWC1 MET 1 MODIFIED RESIDUE SEQADV 2F9T MSE A 146 UNP Q9HWC1 MET 146 MODIFIED RESIDUE SEQADV 2F9T MSE A 149 UNP Q9HWC1 MET 149 MODIFIED RESIDUE SEQADV 2F9T MSE A 191 UNP Q9HWC1 MET 191 MODIFIED RESIDUE SEQADV 2F9T MSE A 202 UNP Q9HWC1 MET 202 MODIFIED RESIDUE SEQADV 2F9T MSE A 233 UNP Q9HWC1 MET 233 MODIFIED RESIDUE SEQADV 2F9T MSE B -22 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T GLY B -21 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T SER B -20 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T SER B -19 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T HIS B -18 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T HIS B -17 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T HIS B -16 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T HIS B -15 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T HIS B -14 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T HIS B -13 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T SER B -12 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T SER B -11 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T GLY B -10 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T LEU B -9 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T VAL B -8 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T PRO B -7 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T ARG B -6 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T GLY B -5 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T SER B -4 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T HIS B -3 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T MSE B -2 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T ALA B -1 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T SER B 0 UNP Q9HWC1 CLONING ARTIFACT SEQADV 2F9T MSE B 1 UNP Q9HWC1 MET 1 MODIFIED RESIDUE SEQADV 2F9T MSE B 146 UNP Q9HWC1 MET 146 MODIFIED RESIDUE SEQADV 2F9T MSE B 149 UNP Q9HWC1 MET 149 MODIFIED RESIDUE SEQADV 2F9T MSE B 191 UNP Q9HWC1 MET 191 MODIFIED RESIDUE SEQADV 2F9T MSE B 202 UNP Q9HWC1 MET 202 MODIFIED RESIDUE SEQADV 2F9T MSE B 233 UNP Q9HWC1 MET 233 MODIFIED RESIDUE SEQRES 1 A 271 MSE GLY SER SER HIS HIS HIS HIS HIS HIS SER SER GLY SEQRES 2 A 271 LEU VAL PRO ARG GLY SER HIS MSE ALA SER MSE ILE LEU SEQRES 3 A 271 GLU LEU ASP CYS GLY ASN SER LEU ILE LYS TRP ARG VAL SEQRES 4 A 271 ILE GLU GLY ALA ALA ARG SER VAL ALA GLY GLY LEU ALA SEQRES 5 A 271 GLU SER ASP ASP ALA LEU VAL GLU GLN LEU THR SER GLN SEQRES 6 A 271 GLN ALA LEU PRO VAL ARG ALA CYS ARG LEU VAL SER VAL SEQRES 7 A 271 ARG SER GLU GLN GLU THR SER GLN LEU VAL ALA ARG LEU SEQRES 8 A 271 GLU GLN LEU PHE PRO VAL SER ALA LEU VAL ALA SER SER SEQRES 9 A 271 GLY LYS GLN LEU ALA GLY VAL ARG ASN GLY TYR LEU ASP SEQRES 10 A 271 TYR GLN ARG LEU GLY LEU ASP ARG TRP LEU ALA LEU VAL SEQRES 11 A 271 ALA ALA HIS HIS LEU ALA LYS LYS ALA CYS LEU VAL ILE SEQRES 12 A 271 ASP LEU GLY THR ALA VAL THR SER ASP LEU VAL ALA ALA SEQRES 13 A 271 ASP GLY VAL HIS LEU GLY GLY TYR ILE CYS PRO GLY MSE SEQRES 14 A 271 THR LEU MSE ARG SER GLN LEU ARG THR HIS THR ARG ARG SEQRES 15 A 271 ILE ARG TYR ASP ASP ALA GLU ALA ARG ARG ALA LEU ALA SEQRES 16 A 271 SER LEU GLN PRO GLY GLN ALA THR ALA GLU ALA VAL GLU SEQRES 17 A 271 ARG GLY CYS LEU LEU MSE LEU ARG GLY PHE VAL ARG GLU SEQRES 18 A 271 GLN TYR ALA MSE ALA CYS GLU LEU LEU GLY PRO ASP CYS SEQRES 19 A 271 GLU ILE PHE LEU THR GLY GLY ASP ALA GLU LEU VAL ARG SEQRES 20 A 271 ASP GLU LEU ALA GLY ALA ARG ILE MSE PRO ASP LEU VAL SEQRES 21 A 271 PHE VAL GLY LEU ALA LEU ALA CYS PRO ILE GLU SEQRES 1 B 271 MSE GLY SER SER HIS HIS HIS HIS HIS HIS SER SER GLY SEQRES 2 B 271 LEU VAL PRO ARG GLY SER HIS MSE ALA SER MSE ILE LEU SEQRES 3 B 271 GLU LEU ASP CYS GLY ASN SER LEU ILE LYS TRP ARG VAL SEQRES 4 B 271 ILE GLU GLY ALA ALA ARG SER VAL ALA GLY GLY LEU ALA SEQRES 5 B 271 GLU SER ASP ASP ALA LEU VAL GLU GLN LEU THR SER GLN SEQRES 6 B 271 GLN ALA LEU PRO VAL ARG ALA CYS ARG LEU VAL SER VAL SEQRES 7 B 271 ARG SER GLU GLN GLU THR SER GLN LEU VAL ALA ARG LEU SEQRES 8 B 271 GLU GLN LEU PHE PRO VAL SER ALA LEU VAL ALA SER SER SEQRES 9 B 271 GLY LYS GLN LEU ALA GLY VAL ARG ASN GLY TYR LEU ASP SEQRES 10 B 271 TYR GLN ARG LEU GLY LEU ASP ARG TRP LEU ALA LEU VAL SEQRES 11 B 271 ALA ALA HIS HIS LEU ALA LYS LYS ALA CYS LEU VAL ILE SEQRES 12 B 271 ASP LEU GLY THR ALA VAL THR SER ASP LEU VAL ALA ALA SEQRES 13 B 271 ASP GLY VAL HIS LEU GLY GLY TYR ILE CYS PRO GLY MSE SEQRES 14 B 271 THR LEU MSE ARG SER GLN LEU ARG THR HIS THR ARG ARG SEQRES 15 B 271 ILE ARG TYR ASP ASP ALA GLU ALA ARG ARG ALA LEU ALA SEQRES 16 B 271 SER LEU GLN PRO GLY GLN ALA THR ALA GLU ALA VAL GLU SEQRES 17 B 271 ARG GLY CYS LEU LEU MSE LEU ARG GLY PHE VAL ARG GLU SEQRES 18 B 271 GLN TYR ALA MSE ALA CYS GLU LEU LEU GLY PRO ASP CYS SEQRES 19 B 271 GLU ILE PHE LEU THR GLY GLY ASP ALA GLU LEU VAL ARG SEQRES 20 B 271 ASP GLU LEU ALA GLY ALA ARG ILE MSE PRO ASP LEU VAL SEQRES 21 B 271 PHE VAL GLY LEU ALA LEU ALA CYS PRO ILE GLU MODRES 2F9T MSE A 1 MET SELENOMETHIONINE MODRES 2F9T MSE A 146 MET SELENOMETHIONINE MODRES 2F9T MSE A 149 MET SELENOMETHIONINE MODRES 2F9T MSE A 191 MET SELENOMETHIONINE MODRES 2F9T MSE A 202 MET SELENOMETHIONINE MODRES 2F9T MSE A 233 MET SELENOMETHIONINE MODRES 2F9T MSE B 1 MET SELENOMETHIONINE MODRES 2F9T MSE B 146 MET SELENOMETHIONINE MODRES 2F9T MSE B 149 MET SELENOMETHIONINE MODRES 2F9T MSE B 191 MET SELENOMETHIONINE MODRES 2F9T MSE B 202 MET SELENOMETHIONINE MODRES 2F9T MSE B 233 MET SELENOMETHIONINE HET MSE A 1 8 HET MSE A 146 8 HET MSE A 149 8 HET MSE A 191 8 HET MSE A 202 8 HET MSE A 233 8 HET MSE B 1 8 HET MSE B 146 8 HET MSE B 149 8 HET MSE B 191 8 HET MSE B 202 8 HET MSE B 233 8 HETNAM MSE SELENOMETHIONINE FORMUL 1 MSE 12(C5 H11 N O2 SE) FORMUL 3 HOH *180(H2 O) HELIX 1 1 SER A 31 SER A 41 1 11 HELIX 2 2 SER A 57 PHE A 72 1 16 HELIX 3 3 ASP A 94 LEU A 98 5 5 HELIX 4 4 GLY A 99 LYS A 114 1 16 HELIX 5 5 GLY A 145 ARG A 154 1 10 HELIX 6 6 GLU A 166 ALA A 167 5 2 HELIX 7 7 ARG A 169 SER A 173 5 5 HELIX 8 8 ALA A 179 GLY A 208 1 30 HELIX 9 9 ASP A 219 LEU A 227 5 9 HELIX 10 10 ASP A 235 CYS A 245 1 11 HELIX 11 11 ASP B 32 GLU B 37 1 6 HELIX 12 12 SER B 57 GLN B 63 1 7 HELIX 13 13 VAL B 65 GLN B 70 1 6 HELIX 14 14 ASP B 94 LEU B 98 5 5 HELIX 15 15 GLY B 99 LYS B 114 1 16 HELIX 16 16 GLY B 145 THR B 157 1 13 HELIX 17 17 ASP B 163 LEU B 171 1 9 HELIX 18 18 ALA B 179 LEU B 207 1 29 HELIX 19 19 ASP B 219 ALA B 228 5 10 HELIX 20 20 ASP B 235 CYS B 245 1 11 SHEET 1 A 5 ARG A 22 ALA A 29 0 SHEET 2 A 5 ILE A 12 GLU A 18 -1 N GLU A 18 O ARG A 22 SHEET 3 A 5 MSE A 1 CYS A 7 -1 N ASP A 6 O LYS A 13 SHEET 4 A 5 VAL A 47 SER A 54 1 O VAL A 53 N CYS A 7 SHEET 5 A 5 LEU A 77 VAL A 78 1 O LEU A 77 N CYS A 50 SHEET 1 B 2 GLN A 84 LEU A 85 0 SHEET 2 B 2 VAL A 88 ARG A 89 -1 O VAL A 88 N LEU A 85 SHEET 1 C 5 HIS A 137 PRO A 144 0 SHEET 2 C 5 ALA A 125 VAL A 131 -1 N VAL A 126 O CYS A 143 SHEET 3 C 5 CYS A 117 LEU A 122 -1 N ASP A 121 O THR A 127 SHEET 4 C 5 GLU A 212 THR A 216 1 O PHE A 214 N LEU A 118 SHEET 5 C 5 ARG A 231 ILE A 232 1 O ARG A 231 N ILE A 213 SHEET 1 D 5 ARG B 22 ALA B 29 0 SHEET 2 D 5 ILE B 12 GLU B 18 -1 N VAL B 16 O ALA B 25 SHEET 3 D 5 MSE B 1 CYS B 7 -1 N GLU B 4 O ARG B 15 SHEET 4 D 5 VAL B 47 SER B 54 1 O VAL B 53 N CYS B 7 SHEET 5 D 5 LEU B 77 VAL B 78 1 O LEU B 77 N LEU B 52 SHEET 1 E 2 GLN B 84 LEU B 85 0 SHEET 2 E 2 VAL B 88 ARG B 89 -1 O VAL B 88 N LEU B 85 SHEET 1 F 5 HIS B 137 PRO B 144 0 SHEET 2 F 5 ALA B 125 VAL B 131 -1 N VAL B 126 O CYS B 143 SHEET 3 F 5 CYS B 117 LEU B 122 -1 N VAL B 119 O ASP B 129 SHEET 4 F 5 GLU B 212 THR B 216 1 O PHE B 214 N LEU B 118 SHEET 5 F 5 ARG B 231 ILE B 232 1 O ARG B 231 N LEU B 215 LINK C SER A 0 N MSE A 1 1555 1555 1.33 LINK C MSE A 1 N ILE A 2 1555 1555 1.33 LINK C GLY A 145 N MSE A 146 1555 1555 1.33 LINK C MSE A 146 N THR A 147 1555 1555 1.33 LINK C LEU A 148 N MSE A 149 1555 1555 1.33 LINK C MSE A 149 N ARG A 150 1555 1555 1.33 LINK C LEU A 190 N MSE A 191 1555 1555 1.32 LINK C MSE A 191 N LEU A 192 1555 1555 1.33 LINK C ALA A 201 N MSE A 202 1555 1555 1.33 LINK C MSE A 202 N ALA A 203 1555 1555 1.33 LINK C ILE A 232 N MSE A 233 1555 1555 1.33 LINK C MSE A 233 N PRO A 234 1555 1555 1.34 LINK C SER B 0 N MSE B 1 1555 1555 1.33 LINK C MSE B 1 N ILE B 2 1555 1555 1.33 LINK C GLY B 145 N MSE B 146 1555 1555 1.33 LINK C MSE B 146 N THR B 147 1555 1555 1.33 LINK C LEU B 148 N MSE B 149 1555 1555 1.33 LINK C MSE B 149 N ARG B 150 1555 1555 1.33 LINK C LEU B 190 N MSE B 191 1555 1555 1.32 LINK C MSE B 191 N LEU B 192 1555 1555 1.33 LINK C ALA B 201 N MSE B 202 1555 1555 1.33 LINK C MSE B 202 N ALA B 203 1555 1555 1.33 LINK C ILE B 232 N MSE B 233 1555 1555 1.33 LINK C MSE B 233 N PRO B 234 1555 1555 1.34 CRYST1 91.250 91.250 179.201 90.00 90.00 90.00 P 41 21 2 16 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 0.010959 0.000000 0.000000 0.00000 SCALE2 0.000000 0.010959 0.000000 0.00000 SCALE3 0.000000 0.000000 0.005580 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: B 128 SER OG : rot -160:sc= 1.1 USER MOD Set 1.2: B 199 GLN :FLIP amide:sc= 1.51 F(o=-2.1!,f=2.6) USER MOD Set 2.1: B 54 SER OG : rot 180:sc= 0.00291 USER MOD Set 2.2: B 61 THR OG1 : rot 70:sc= 0.561 USER MOD Set 3.1: A 128 SER OG : rot -131:sc= 0.735 USER MOD Set 3.2: A 199 GLN :FLIP amide:sc= 1.43 F(o=-1.3,f=2.2) USER MOD Set 4.1: A 54 SER OG : rot -150:sc= 0.349 USER MOD Set 4.2: A 61 THR OG1 : rot 73:sc= 0.324 USER MOD Set 5.1: A 10 SER OG : rot 180:sc= 0 USER MOD Set 5.2: B 156 HIS : no HD1:sc= -0.0661 X(o=-0.066,f=0) USER MOD Set 6.1: A 9 ASN :FLIP amide:sc= 0.0175 F(o=-0.46,f=0.18) USER MOD Set 6.2: B 157 THR OG1 : rot 107:sc= 0.16 USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 7 CYS SG : rot 150:sc= -0.531 USER MOD Single : A -1 ALA N :NH3+ -122:sc= 0.0971 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ 155:sc= 1.1 (180deg=0.697) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 38 GLN : amide:sc= 0.341 K(o=0.34,f=-1.6!) USER MOD Single : A 40 THR OG1 : rot 59:sc= 1.41 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= -0.198 K(o=-0.2,f=-2.2) USER MOD Single : A 43 GLN :FLIP amide:sc= -0.191 F(o=-1.5!,f=-0.19) USER MOD Single : A 50 CYS SG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 140:sc= -1.25 USER MOD Single : A 59 GLN :FLIP amide:sc= 0 F(o=-1.1!,f=0) USER MOD Single : A 62 SER OG : rot 80:sc= 0.352 USER MOD Single : A 63 GLN : amide:sc= -0.163 K(o=-0.16,f=-1.8!) USER MOD Single : A 70 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot -90:sc= 1.02 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 GLN :FLIP amide:sc= -0.457 F(o=-1.5!,f=-0.46) USER MOD Single : A 90 ASN : amide:sc= -0.152 K(o=-0.15,f=-6.9!) USER MOD Single : A 92 TYR OH : rot 150:sc= 0.645 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 110 HIS : no HD1:sc= 1.51 K(o=1.5,f=-2.6!) USER MOD Single : A 111 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 114 LYS NZ :NH3+ -173:sc= 0.66 (180deg=0.634) USER MOD Single : A 115 LYS NZ :NH3+ 158:sc= 1.48 (180deg=1.07) USER MOD Single : A 117 CYS SG : rot -55:sc= 0.209 USER MOD Single : A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 THR OG1 : rot 85:sc= 0.611 USER MOD Single : A 137 HIS :FLIP no HD1:sc= 0.542 F(o=-4.1!,f=0.54) USER MOD Single : A 141 TYR OH : rot 163:sc= 1.31 USER MOD Single : A 143 CYS SG : rot -126:sc= -1.97! USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD Single : A 152 GLN : amide:sc= -0.902 K(o=-0.9,f=-2.7!) USER MOD Single : A 173 SER OG : rot 180:sc= -0.0396 USER MOD Single : A 175 GLN :FLIP amide:sc= -0.382 F(o=-2.7!,f=-0.38) USER MOD Single : A 178 GLN :FLIP amide:sc= 0 F(o=-0.9,f=0) USER MOD Single : A 180 THR OG1 : rot 180:sc= 0 USER MOD Single : A 188 CYS SG : rot 86:sc= -0.357 USER MOD Single : A 200 TYR OH : rot 180:sc= 0 USER MOD Single : A 204 CYS SG : rot 72:sc= -0.0989 USER MOD Single : A 211 CYS SG : rot 18:sc= 0.0626 USER MOD Single : A 216 THR OG1 : rot 84:sc= 2.42 USER MOD Single : A 245 CYS SG : rot 180:sc= 0 USER MOD Single : B 0 SER N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 0 SER OG : rot 180:sc= 0 USER MOD Single : B 7 CYS SG : rot 180:sc= 0 USER MOD Single : B 9 ASN : amide:sc=-0.000221 X(o=-0.00022,f=-0.0079) USER MOD Single : B 10 SER OG : rot 180:sc= 0 USER MOD Single : B 13 LYS NZ :NH3+ -175:sc= -0.464 (180deg=-0.569) USER MOD Single : B 23 SER OG : rot 180:sc= 0 USER MOD Single : B 31 SER OG : rot 180:sc= 0.0197 USER MOD Single : B 38 GLN : amide:sc= -0.647 K(o=-0.65,f=-1.9!) USER MOD Single : B 40 THR OG1 : rot 180:sc= 0 USER MOD Single : B 50 CYS SG : rot 180:sc= -0.127 USER MOD Single : B 57 SER OG : rot 99:sc= 0.0206 USER MOD Single : B 59 GLN : amide:sc=-0.00472 X(o=-0.0047,f=-0.02) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 63 GLN : amide:sc= -0.127 X(o=-0.13,f=-0.012) USER MOD Single : B 70 GLN : amide:sc= -0.308 X(o=-0.31,f=-0.31) USER MOD Single : B 75 SER OG : rot 180:sc= 0 USER MOD Single : B 80 SER OG : rot 180:sc= 0 USER MOD Single : B 81 SER OG : rot 180:sc= 0 USER MOD Single : B 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 84 GLN :FLIP amide:sc=-0.00404 F(o=-1.4!,f=-0.004) USER MOD Single : B 90 ASN : amide:sc= 0.206 K(o=0.21,f=-8.1!) USER MOD Single : B 92 TYR OH : rot 180:sc= 0.0433 USER MOD Single : B 95 TYR OH : rot 180:sc= 0 USER MOD Single : B 96 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 110 HIS : no HD1:sc= -0.0223 K(o=-0.022,f=-1.9) USER MOD Single : B 111 HIS : no HD1:sc= -0.0166 X(o=-0.017,f=-0.017) USER MOD Single : B 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 115 LYS NZ :NH3+ 171:sc= 1.94 (180deg=1.85) USER MOD Single : B 117 CYS SG : rot -38:sc= 0.28 USER MOD Single : B 124 THR OG1 : rot 180:sc= 0 USER MOD Single : B 127 THR OG1 : rot 85:sc= 2.21 USER MOD Single : B 137 HIS :FLIP no HD1:sc= 0.266 F(o=-4.8!,f=0.27) USER MOD Single : B 141 TYR OH : rot 149:sc= 1.14 USER MOD Single : B 143 CYS SG : rot -126:sc= 0.168 USER MOD Single : B 147 THR OG1 : rot -160:sc= -0.636 USER MOD Single : B 151 SER OG : rot 180:sc= 0 USER MOD Single : B 152 GLN :FLIP amide:sc= -2.06! C(o=-6.4!,f=-2.1!) USER MOD Single : B 155 THR OG1 : rot 80:sc= 0.127 USER MOD Single : B 162 TYR OH : rot -176:sc= 1.28 USER MOD Single : B 173 SER OG : rot 180:sc= 0.02 USER MOD Single : B 175 GLN : amide:sc=-0.00799 X(o=-0.008,f=0) USER MOD Single : B 178 GLN :FLIP amide:sc= -0.0125 F(o=-1.5!,f=-0.012) USER MOD Single : B 180 THR OG1 : rot 180:sc= 0 USER MOD Single : B 188 CYS SG : rot 80:sc= 0.0486 USER MOD Single : B 200 TYR OH : rot 180:sc= 0 USER MOD Single : B 204 CYS SG : rot 137:sc= -0.671 USER MOD Single : B 211 CYS SG : rot 8:sc= 0.0312 USER MOD Single : B 216 THR OG1 : rot 82:sc= 1.75 USER MOD Single : B 245 CYS SG : rot 180:sc= -0.0108 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A -1 32.165 15.228 29.234 1.00 62.07 N ATOM 2 CA ALA A -1 31.429 14.125 29.915 1.00 62.14 C ATOM 3 C ALA A -1 30.698 14.653 31.146 1.00 61.20 C ATOM 4 O ALA A -1 30.669 15.858 31.394 1.00 61.93 O ATOM 5 CB ALA A -1 32.399 13.015 30.320 1.00 62.86 C ATOM 0 H1 ALA A -1 31.884 15.297 28.392 1.00 62.07 H new ATOM 0 H2 ALA A -1 32.014 15.994 29.661 1.00 62.07 H new ATOM 0 H3 ALA A -1 33.037 15.052 29.241 1.00 62.07 H new ATOM 0 HA ALA A -1 30.776 13.763 29.296 1.00 62.14 H new ATOM 0 HB1 ALA A -1 31.910 12.303 30.762 1.00 62.86 H new ATOM 0 HB2 ALA A -1 32.837 12.663 29.529 1.00 62.86 H new ATOM 0 HB3 ALA A -1 33.066 13.373 30.926 1.00 62.86 H new ATOM 6 N SER A 0 30.108 13.743 31.912 1.00 58.89 N ATOM 7 CA SER A 0 29.375 14.123 33.110 1.00 56.46 C ATOM 8 C SER A 0 30.080 13.657 34.381 1.00 53.42 C ATOM 9 O SER A 0 30.575 12.528 34.461 1.00 54.79 O ATOM 10 CB SER A 0 27.957 13.546 33.063 1.00 57.51 C ATOM 11 OG SER A 0 27.983 12.132 32.997 1.00 61.55 O ATOM 0 H SER A 0 30.121 12.898 31.754 1.00 58.89 H new ATOM 0 HA SER A 0 29.334 15.092 33.132 1.00 56.46 H new ATOM 0 HB2 SER A 0 27.464 13.827 33.850 1.00 57.51 H new ATOM 0 HB3 SER A 0 27.486 13.900 32.292 1.00 57.51 H new ATOM 0 HG SER A 0 27.197 11.838 32.974 1.00 61.55 H new HETATM 12 N MSE A 1 30.125 14.541 35.370 1.00 48.41 N HETATM 13 CA MSE A 1 30.757 14.233 36.638 1.00 43.49 C HETATM 14 C MSE A 1 29.720 14.065 37.736 1.00 40.16 C HETATM 15 O MSE A 1 28.547 14.402 37.556 1.00 37.82 O HETATM 16 CB MSE A 1 31.745 15.332 37.008 1.00 46.28 C HETATM 17 CG MSE A 1 32.947 15.370 36.094 1.00 48.23 C HETATM 18 SE MSE A 1 34.262 16.624 36.694 1.00 59.09 SE HETATM 19 CE MSE A 1 35.365 16.698 35.095 1.00 51.03 C HETATM 0 H MSE A 1 29.791 15.332 35.323 1.00 48.41 H new HETATM 0 HA MSE A 1 31.236 13.394 36.545 1.00 43.49 H new HETATM 0 HB2 MSE A 1 31.294 16.190 36.978 1.00 46.28 H new HETATM 0 HB3 MSE A 1 32.043 15.200 37.922 1.00 46.28 H new HETATM 0 HG2 MSE A 1 33.343 14.486 36.044 1.00 48.23 H new HETATM 0 HG3 MSE A 1 32.663 15.604 35.197 1.00 48.23 H new HETATM 0 HE1 MSE A 1 36.102 17.312 35.238 1.00 51.03 H new HETATM 0 HE2 MSE A 1 35.714 15.814 34.901 1.00 51.03 H new HETATM 0 HE3 MSE A 1 34.830 17.006 34.347 1.00 51.03 H new ATOM 20 N ILE A 2 30.158 13.549 38.876 1.00 36.17 N ATOM 21 CA ILE A 2 29.257 13.317 39.990 1.00 33.32 C ATOM 22 C ILE A 2 29.666 14.047 41.256 1.00 33.98 C ATOM 23 O ILE A 2 30.825 13.991 41.677 1.00 33.19 O ATOM 24 CB ILE A 2 29.170 11.821 40.318 1.00 32.49 C ATOM 25 CG1 ILE A 2 28.721 11.043 39.079 1.00 30.51 C ATOM 26 CG2 ILE A 2 28.211 11.598 41.491 1.00 31.70 C ATOM 27 CD1 ILE A 2 28.808 9.539 39.244 1.00 30.95 C ATOM 0 H ILE A 2 30.975 13.326 39.023 1.00 36.17 H new ATOM 0 HA ILE A 2 28.398 13.662 39.701 1.00 33.32 H new ATOM 0 HB ILE A 2 30.045 11.495 40.579 1.00 32.49 H new ATOM 0 HG12 ILE A 2 27.806 11.285 38.868 1.00 30.51 H new ATOM 0 HG13 ILE A 2 29.267 11.310 38.323 1.00 30.51 H new ATOM 0 HG21 ILE A 2 28.161 10.651 41.693 1.00 31.70 H new ATOM 0 HG22 ILE A 2 28.535 12.077 42.270 1.00 31.70 H new ATOM 0 HG23 ILE A 2 27.329 11.925 41.255 1.00 31.70 H new ATOM 0 HD11 ILE A 2 28.511 9.106 38.428 1.00 30.95 H new ATOM 0 HD12 ILE A 2 29.726 9.286 39.428 1.00 30.95 H new ATOM 0 HD13 ILE A 2 28.243 9.261 39.981 1.00 30.95 H new ATOM 28 N LEU A 3 28.697 14.733 41.853 1.00 32.62 N ATOM 29 CA LEU A 3 28.907 15.452 43.099 1.00 30.88 C ATOM 30 C LEU A 3 28.460 14.514 44.216 1.00 30.55 C ATOM 31 O LEU A 3 27.326 14.031 44.215 1.00 30.77 O ATOM 32 CB LEU A 3 28.059 16.730 43.135 1.00 31.04 C ATOM 33 CG LEU A 3 28.040 17.517 44.456 1.00 33.33 C ATOM 34 CD1 LEU A 3 29.447 18.018 44.803 1.00 30.43 C ATOM 35 CD2 LEU A 3 27.079 18.701 44.329 1.00 32.70 C ATOM 0 H LEU A 3 27.897 14.793 41.544 1.00 32.62 H new ATOM 0 HA LEU A 3 29.837 15.712 43.194 1.00 30.88 H new ATOM 0 HB2 LEU A 3 28.376 17.322 42.436 1.00 31.04 H new ATOM 0 HB3 LEU A 3 27.145 16.492 42.912 1.00 31.04 H new ATOM 0 HG LEU A 3 27.740 16.931 45.168 1.00 33.33 H new ATOM 0 HD11 LEU A 3 29.418 18.512 45.637 1.00 30.43 H new ATOM 0 HD12 LEU A 3 30.046 17.261 44.896 1.00 30.43 H new ATOM 0 HD13 LEU A 3 29.768 18.599 44.095 1.00 30.43 H new ATOM 0 HD21 LEU A 3 27.066 19.198 45.162 1.00 32.70 H new ATOM 0 HD22 LEU A 3 27.374 19.282 43.610 1.00 32.70 H new ATOM 0 HD23 LEU A 3 26.187 18.374 44.134 1.00 32.70 H new ATOM 36 N GLU A 4 29.354 14.243 45.158 1.00 29.86 N ATOM 37 CA GLU A 4 29.025 13.366 46.276 1.00 29.54 C ATOM 38 C GLU A 4 29.182 14.138 47.575 1.00 29.93 C ATOM 39 O GLU A 4 30.084 14.972 47.705 1.00 29.87 O ATOM 40 CB GLU A 4 29.953 12.141 46.300 1.00 28.66 C ATOM 41 CG GLU A 4 29.996 11.346 44.998 1.00 28.10 C ATOM 42 CD GLU A 4 30.844 10.082 45.113 1.00 29.72 C ATOM 43 OE1 GLU A 4 32.040 10.192 45.458 1.00 31.16 O ATOM 44 OE2 GLU A 4 30.310 8.980 44.860 1.00 26.61 O ATOM 0 H GLU A 4 30.155 14.555 45.170 1.00 29.86 H new ATOM 0 HA GLU A 4 28.110 13.060 46.174 1.00 29.54 H new ATOM 0 HB2 GLU A 4 30.852 12.436 46.514 1.00 28.66 H new ATOM 0 HB3 GLU A 4 29.670 11.551 47.016 1.00 28.66 H new ATOM 0 HG2 GLU A 4 29.093 11.104 44.740 1.00 28.10 H new ATOM 0 HG3 GLU A 4 30.352 11.907 44.291 1.00 28.10 H new ATOM 45 N LEU A 5 28.314 13.856 48.539 1.00 29.84 N ATOM 46 CA LEU A 5 28.392 14.543 49.820 1.00 32.22 C ATOM 47 C LEU A 5 28.109 13.644 51.015 1.00 32.84 C ATOM 48 O LEU A 5 27.323 12.695 50.935 1.00 30.06 O ATOM 49 CB LEU A 5 27.408 15.724 49.868 1.00 31.97 C ATOM 50 CG LEU A 5 27.425 16.749 48.734 1.00 33.87 C ATOM 51 CD1 LEU A 5 26.588 16.231 47.565 1.00 28.71 C ATOM 52 CD2 LEU A 5 26.865 18.068 49.240 1.00 34.91 C ATOM 0 H LEU A 5 27.681 13.278 48.473 1.00 29.84 H new ATOM 0 HA LEU A 5 29.310 14.851 49.886 1.00 32.22 H new ATOM 0 HB2 LEU A 5 26.512 15.357 49.917 1.00 31.97 H new ATOM 0 HB3 LEU A 5 27.565 16.202 50.697 1.00 31.97 H new ATOM 0 HG LEU A 5 28.336 16.888 48.430 1.00 33.87 H new ATOM 0 HD11 LEU A 5 26.599 16.882 46.846 1.00 28.71 H new ATOM 0 HD12 LEU A 5 26.959 15.393 47.248 1.00 28.71 H new ATOM 0 HD13 LEU A 5 25.674 16.090 47.859 1.00 28.71 H new ATOM 0 HD21 LEU A 5 26.875 18.720 48.522 1.00 34.91 H new ATOM 0 HD22 LEU A 5 25.954 17.937 49.545 1.00 34.91 H new ATOM 0 HD23 LEU A 5 27.409 18.390 49.976 1.00 34.91 H new ATOM 53 N ASP A 6 28.770 13.961 52.124 1.00 34.39 N ATOM 54 CA ASP A 6 28.572 13.249 53.383 1.00 36.98 C ATOM 55 C ASP A 6 28.174 14.351 54.359 1.00 35.52 C ATOM 56 O ASP A 6 28.998 15.185 54.732 1.00 33.51 O ATOM 57 CB ASP A 6 29.861 12.561 53.857 1.00 38.04 C ATOM 58 CG ASP A 6 29.712 11.921 55.242 1.00 43.94 C ATOM 59 OD1 ASP A 6 30.657 11.242 55.705 1.00 48.70 O ATOM 60 OD2 ASP A 6 28.651 12.096 55.879 1.00 46.28 O ATOM 0 H ASP A 6 29.348 14.597 52.168 1.00 34.39 H new ATOM 0 HA ASP A 6 27.911 12.543 53.303 1.00 36.98 H new ATOM 0 HB2 ASP A 6 30.115 11.880 53.215 1.00 38.04 H new ATOM 0 HB3 ASP A 6 30.581 13.211 53.880 1.00 38.04 H new ATOM 61 N CYS A 7 26.905 14.355 54.750 1.00 37.28 N ATOM 62 CA CYS A 7 26.383 15.368 55.656 1.00 40.20 C ATOM 63 C CYS A 7 26.377 14.913 57.104 1.00 40.27 C ATOM 64 O CYS A 7 25.449 14.235 57.554 1.00 39.43 O ATOM 65 CB CYS A 7 24.974 15.760 55.227 1.00 41.66 C ATOM 66 SG CYS A 7 24.905 16.239 53.498 1.00 48.24 S ATOM 0 H CYS A 7 26.325 13.772 54.498 1.00 37.28 H new ATOM 0 HA CYS A 7 26.975 16.135 55.604 1.00 40.20 H new ATOM 0 HB2 CYS A 7 24.372 15.015 55.380 1.00 41.66 H new ATOM 0 HB3 CYS A 7 24.662 16.495 55.778 1.00 41.66 H new ATOM 0 HG CYS A 7 23.823 15.973 53.052 1.00 48.24 H new ATOM 67 N GLY A 8 27.425 15.301 57.825 1.00 42.06 N ATOM 68 CA GLY A 8 27.550 14.931 59.221 1.00 44.56 C ATOM 69 C GLY A 8 26.790 15.888 60.115 1.00 47.26 C ATOM 70 O GLY A 8 26.121 16.801 59.626 1.00 45.71 O ATOM 0 H GLY A 8 28.072 15.779 57.521 1.00 42.06 H new ATOM 0 HA2 GLY A 8 27.215 14.030 59.350 1.00 44.56 H new ATOM 0 HA3 GLY A 8 28.487 14.924 59.473 1.00 44.56 H new ATOM 71 N ASN A 9 26.897 15.686 61.426 1.00 48.97 N ATOM 72 CA ASN A 9 26.203 16.543 62.375 1.00 50.48 C ATOM 73 C ASN A 9 26.751 17.965 62.407 1.00 51.12 C ATOM 74 O ASN A 9 25.978 18.918 62.484 1.00 54.20 O ATOM 75 CB ASN A 9 26.245 15.933 63.783 1.00 52.75 C ATOM 76 CG ASN A 9 25.508 14.600 63.867 1.00 53.99 C ATOM 77 OD1 ASN A 9 24.219 14.656 64.176 1.00 55.38 O flip ATOM 78 ND2 ASN A 9 26.090 13.537 63.644 1.00 54.73 N flip ATOM 0 H ASN A 9 27.366 15.059 61.783 1.00 48.97 H new ATOM 0 HA ASN A 9 25.284 16.600 62.071 1.00 50.48 H new ATOM 0 HB2 ASN A 9 27.169 15.805 64.049 1.00 52.75 H new ATOM 0 HB3 ASN A 9 25.852 16.556 64.414 1.00 52.75 H new ATOM 0 HD21 ASN A 9 26.927 13.538 63.446 1.00 54.73 H new ATOM 0 HD22 ASN A 9 25.659 12.794 63.686 1.00 54.73 H new ATOM 79 N SER A 10 28.069 18.123 62.332 1.00 50.86 N ATOM 80 CA SER A 10 28.651 19.464 62.370 1.00 51.32 C ATOM 81 C SER A 10 29.494 19.836 61.150 1.00 51.35 C ATOM 82 O SER A 10 30.079 20.920 61.100 1.00 53.60 O ATOM 83 CB SER A 10 29.499 19.639 63.637 1.00 51.93 C ATOM 84 OG SER A 10 30.675 18.845 63.598 1.00 56.49 O ATOM 0 H SER A 10 28.636 17.481 62.260 1.00 50.86 H new ATOM 0 HA SER A 10 27.891 20.067 62.368 1.00 51.32 H new ATOM 0 HB2 SER A 10 29.742 20.573 63.737 1.00 51.93 H new ATOM 0 HB3 SER A 10 28.972 19.398 64.415 1.00 51.93 H new ATOM 0 HG SER A 10 31.117 18.964 64.302 1.00 56.49 H new ATOM 85 N LEU A 11 29.563 18.949 60.166 1.00 48.91 N ATOM 86 CA LEU A 11 30.349 19.228 58.972 1.00 45.22 C ATOM 87 C LEU A 11 29.769 18.566 57.738 1.00 42.38 C ATOM 88 O LEU A 11 29.027 17.587 57.822 1.00 41.72 O ATOM 89 CB LEU A 11 31.791 18.748 59.156 1.00 46.48 C ATOM 90 CG LEU A 11 32.716 19.543 60.078 1.00 48.24 C ATOM 91 CD1 LEU A 11 33.961 18.721 60.385 1.00 48.68 C ATOM 92 CD2 LEU A 11 33.089 20.866 59.419 1.00 49.28 C ATOM 0 H LEU A 11 29.166 18.186 60.169 1.00 48.91 H new ATOM 0 HA LEU A 11 30.329 20.189 58.844 1.00 45.22 H new ATOM 0 HB2 LEU A 11 31.758 17.837 59.487 1.00 46.48 H new ATOM 0 HB3 LEU A 11 32.205 18.717 58.279 1.00 46.48 H new ATOM 0 HG LEU A 11 32.259 19.735 60.912 1.00 48.24 H new ATOM 0 HD11 LEU A 11 34.547 19.227 60.970 1.00 48.68 H new ATOM 0 HD12 LEU A 11 33.703 17.894 60.822 1.00 48.68 H new ATOM 0 HD13 LEU A 11 34.427 18.518 59.559 1.00 48.68 H new ATOM 0 HD21 LEU A 11 33.676 21.367 60.007 1.00 49.28 H new ATOM 0 HD22 LEU A 11 33.544 20.693 58.580 1.00 49.28 H new ATOM 0 HD23 LEU A 11 32.285 21.381 59.250 1.00 49.28 H new ATOM 93 N ILE A 12 30.105 19.119 56.586 1.00 40.05 N ATOM 94 CA ILE A 12 29.651 18.551 55.332 1.00 38.57 C ATOM 95 C ILE A 12 30.868 18.389 54.450 1.00 36.96 C ATOM 96 O ILE A 12 31.533 19.369 54.106 1.00 33.98 O ATOM 97 CB ILE A 12 28.654 19.454 54.601 1.00 40.26 C ATOM 98 CG1 ILE A 12 27.418 19.680 55.474 1.00 40.18 C ATOM 99 CG2 ILE A 12 28.270 18.811 53.263 1.00 39.03 C ATOM 100 CD1 ILE A 12 26.358 20.545 54.818 1.00 40.75 C ATOM 0 H ILE A 12 30.594 19.822 56.508 1.00 40.05 H new ATOM 0 HA ILE A 12 29.203 17.712 55.520 1.00 38.57 H new ATOM 0 HB ILE A 12 29.062 20.317 54.425 1.00 40.26 H new ATOM 0 HG12 ILE A 12 27.029 18.820 55.699 1.00 40.18 H new ATOM 0 HG13 ILE A 12 27.692 20.094 56.307 1.00 40.18 H new ATOM 0 HG21 ILE A 12 27.638 19.382 52.799 1.00 39.03 H new ATOM 0 HG22 ILE A 12 29.064 18.698 52.718 1.00 39.03 H new ATOM 0 HG23 ILE A 12 27.864 17.945 53.425 1.00 39.03 H new ATOM 0 HD11 ILE A 12 25.605 20.648 55.421 1.00 40.75 H new ATOM 0 HD12 ILE A 12 26.731 21.417 54.615 1.00 40.75 H new ATOM 0 HD13 ILE A 12 26.058 20.123 53.997 1.00 40.75 H new ATOM 101 N LYS A 13 31.174 17.143 54.112 1.00 34.72 N ATOM 102 CA LYS A 13 32.304 16.867 53.245 1.00 33.77 C ATOM 103 C LYS A 13 31.746 16.590 51.858 1.00 31.27 C ATOM 104 O LYS A 13 30.751 15.872 51.710 1.00 31.05 O ATOM 105 CB LYS A 13 33.093 15.656 53.753 1.00 35.19 C ATOM 106 CG LYS A 13 34.259 15.268 52.844 1.00 38.95 C ATOM 107 CD LYS A 13 35.022 14.078 53.401 1.00 40.46 C ATOM 108 CE LYS A 13 36.103 13.616 52.434 1.00 41.47 C ATOM 109 NZ LYS A 13 36.776 12.377 52.917 1.00 42.87 N ATOM 0 H LYS A 13 30.741 16.448 54.374 1.00 34.72 H new ATOM 0 HA LYS A 13 32.913 17.622 53.229 1.00 33.77 H new ATOM 0 HB2 LYS A 13 33.434 15.849 54.640 1.00 35.19 H new ATOM 0 HB3 LYS A 13 32.492 14.899 53.838 1.00 35.19 H new ATOM 0 HG2 LYS A 13 33.924 15.055 51.959 1.00 38.95 H new ATOM 0 HG3 LYS A 13 34.860 16.023 52.746 1.00 38.95 H new ATOM 0 HD2 LYS A 13 35.425 14.318 54.250 1.00 40.46 H new ATOM 0 HD3 LYS A 13 34.407 13.349 53.575 1.00 40.46 H new ATOM 0 HE2 LYS A 13 35.710 13.453 51.562 1.00 41.47 H new ATOM 0 HE3 LYS A 13 36.761 14.320 52.322 1.00 41.47 H new ATOM 0 HZ1 LYS A 13 37.116 11.934 52.224 1.00 42.87 H new ATOM 0 HZ2 LYS A 13 37.430 12.594 53.480 1.00 42.87 H new ATOM 0 HZ3 LYS A 13 36.184 11.861 53.336 1.00 42.87 H new ATOM 110 N TRP A 14 32.380 17.168 50.847 1.00 31.63 N ATOM 111 CA TRP A 14 31.941 16.976 49.467 1.00 31.32 C ATOM 112 C TRP A 14 33.119 16.815 48.507 1.00 30.79 C ATOM 113 O TRP A 14 34.242 17.219 48.800 1.00 30.10 O ATOM 114 CB TRP A 14 31.109 18.176 48.990 1.00 29.38 C ATOM 115 CG TRP A 14 31.921 19.424 48.868 1.00 29.95 C ATOM 116 CD1 TRP A 14 32.250 20.286 49.874 1.00 32.49 C ATOM 117 CD2 TRP A 14 32.617 19.886 47.701 1.00 28.96 C ATOM 118 NE1 TRP A 14 33.115 21.247 49.411 1.00 30.28 N ATOM 119 CE2 TRP A 14 33.357 21.026 48.081 1.00 30.13 C ATOM 120 CE3 TRP A 14 32.694 19.442 46.375 1.00 28.89 C ATOM 121 CZ2 TRP A 14 34.168 21.733 47.182 1.00 31.19 C ATOM 122 CZ3 TRP A 14 33.502 20.144 45.477 1.00 30.04 C ATOM 123 CH2 TRP A 14 34.229 21.277 45.889 1.00 31.05 C ATOM 0 H TRP A 14 33.068 17.676 50.936 1.00 31.63 H new ATOM 0 HA TRP A 14 31.409 16.165 49.461 1.00 31.32 H new ATOM 0 HB2 TRP A 14 30.710 17.968 48.131 1.00 29.38 H new ATOM 0 HB3 TRP A 14 30.380 18.328 49.612 1.00 29.38 H new ATOM 0 HD1 TRP A 14 31.934 20.231 50.747 1.00 32.49 H new ATOM 0 HE1 TRP A 14 33.451 21.885 49.880 1.00 30.28 H new ATOM 0 HE3 TRP A 14 32.216 18.694 46.097 1.00 28.89 H new ATOM 0 HZ2 TRP A 14 34.647 22.483 47.452 1.00 31.19 H new ATOM 0 HZ3 TRP A 14 33.560 19.859 44.594 1.00 30.04 H new ATOM 0 HH2 TRP A 14 34.761 21.726 45.272 1.00 31.05 H new ATOM 124 N ARG A 15 32.836 16.235 47.348 1.00 30.86 N ATOM 125 CA ARG A 15 33.840 16.069 46.308 1.00 30.67 C ATOM 126 C ARG A 15 33.142 15.845 44.977 1.00 30.21 C ATOM 127 O ARG A 15 31.972 15.455 44.927 1.00 30.36 O ATOM 128 CB ARG A 15 34.750 14.872 46.604 1.00 29.08 C ATOM 129 CG ARG A 15 34.083 13.515 46.411 1.00 29.69 C ATOM 130 CD ARG A 15 35.079 12.370 46.603 1.00 26.98 C ATOM 131 NE ARG A 15 34.483 11.083 46.257 1.00 29.27 N ATOM 132 CZ ARG A 15 35.162 9.940 46.179 1.00 30.16 C ATOM 133 NH1 ARG A 15 34.543 8.810 45.849 1.00 28.26 N ATOM 134 NH2 ARG A 15 36.461 9.929 46.435 1.00 27.47 N ATOM 0 H ARG A 15 32.059 15.928 47.143 1.00 30.86 H new ATOM 0 HA ARG A 15 34.386 16.870 46.277 1.00 30.67 H new ATOM 0 HB2 ARG A 15 35.530 14.922 46.029 1.00 29.08 H new ATOM 0 HB3 ARG A 15 35.067 14.938 47.518 1.00 29.08 H new ATOM 0 HG2 ARG A 15 33.352 13.419 47.042 1.00 29.69 H new ATOM 0 HG3 ARG A 15 33.698 13.465 45.522 1.00 29.69 H new ATOM 0 HD2 ARG A 15 35.862 12.524 46.052 1.00 26.98 H new ATOM 0 HD3 ARG A 15 35.380 12.352 47.525 1.00 26.98 H new ATOM 0 HE ARG A 15 33.639 11.062 46.093 1.00 29.27 H new ATOM 0 HH11 ARG A 15 33.699 8.814 45.684 1.00 28.26 H new ATOM 0 HH12 ARG A 15 34.987 8.075 45.800 1.00 28.26 H new ATOM 0 HH21 ARG A 15 36.863 10.658 46.651 1.00 27.47 H new ATOM 0 HH22 ARG A 15 36.903 9.193 46.386 1.00 27.47 H new ATOM 135 N VAL A 16 33.851 16.122 43.894 1.00 30.82 N ATOM 136 CA VAL A 16 33.304 15.878 42.571 1.00 29.85 C ATOM 137 C VAL A 16 34.258 14.875 41.939 1.00 30.62 C ATOM 138 O VAL A 16 35.471 15.074 41.961 1.00 30.88 O ATOM 139 CB VAL A 16 33.249 17.161 41.715 1.00 30.69 C ATOM 140 CG1 VAL A 16 32.833 16.808 40.273 1.00 28.39 C ATOM 141 CG2 VAL A 16 32.244 18.139 42.318 1.00 26.01 C ATOM 0 H VAL A 16 34.646 16.450 43.903 1.00 30.82 H new ATOM 0 HA VAL A 16 32.390 15.557 42.627 1.00 29.85 H new ATOM 0 HB VAL A 16 34.127 17.574 41.701 1.00 30.69 H new ATOM 0 HG11 VAL A 16 32.800 17.617 39.738 1.00 28.39 H new ATOM 0 HG12 VAL A 16 33.480 16.195 39.890 1.00 28.39 H new ATOM 0 HG13 VAL A 16 31.958 16.390 40.282 1.00 28.39 H new ATOM 0 HG21 VAL A 16 32.212 18.944 41.778 1.00 26.01 H new ATOM 0 HG22 VAL A 16 31.365 17.729 42.339 1.00 26.01 H new ATOM 0 HG23 VAL A 16 32.515 18.367 43.221 1.00 26.01 H new ATOM 142 N ILE A 17 33.713 13.779 41.421 1.00 30.76 N ATOM 143 CA ILE A 17 34.530 12.757 40.789 1.00 30.31 C ATOM 144 C ILE A 17 34.264 12.642 39.299 1.00 31.82 C ATOM 145 O ILE A 17 33.147 12.848 38.826 1.00 30.79 O ATOM 146 CB ILE A 17 34.290 11.354 41.394 1.00 30.84 C ATOM 147 CG1 ILE A 17 32.783 11.058 41.416 1.00 32.00 C ATOM 148 CG2 ILE A 17 34.926 11.255 42.780 1.00 30.43 C ATOM 149 CD1 ILE A 17 32.432 9.617 41.743 1.00 26.92 C ATOM 0 H ILE A 17 32.870 13.610 41.427 1.00 30.76 H new ATOM 0 HA ILE A 17 35.443 13.043 40.948 1.00 30.31 H new ATOM 0 HB ILE A 17 34.716 10.679 40.843 1.00 30.84 H new ATOM 0 HG12 ILE A 17 32.360 11.638 42.068 1.00 32.00 H new ATOM 0 HG13 ILE A 17 32.408 11.283 40.550 1.00 32.00 H new ATOM 0 HG21 ILE A 17 34.768 10.371 43.147 1.00 30.43 H new ATOM 0 HG22 ILE A 17 35.881 11.409 42.710 1.00 30.43 H new ATOM 0 HG23 ILE A 17 34.534 11.922 43.365 1.00 30.43 H new ATOM 0 HD11 ILE A 17 31.468 9.509 41.738 1.00 26.92 H new ATOM 0 HD12 ILE A 17 32.826 9.029 41.080 1.00 26.92 H new ATOM 0 HD13 ILE A 17 32.777 9.391 42.621 1.00 26.92 H new ATOM 150 N GLU A 18 35.318 12.297 38.571 1.00 33.72 N ATOM 151 CA GLU A 18 35.261 12.095 37.135 1.00 33.52 C ATOM 152 C GLU A 18 35.386 10.591 36.994 1.00 34.01 C ATOM 153 O GLU A 18 36.190 9.971 37.684 1.00 34.78 O ATOM 154 CB GLU A 18 36.447 12.778 36.456 1.00 34.37 C ATOM 155 CG GLU A 18 36.468 12.641 34.938 1.00 35.82 C ATOM 156 CD GLU A 18 37.755 13.176 34.325 1.00 36.31 C ATOM 157 OE1 GLU A 18 37.717 13.598 33.155 1.00 38.60 O ATOM 158 OE2 GLU A 18 38.805 13.171 35.007 1.00 38.24 O ATOM 0 H GLU A 18 36.100 12.172 38.906 1.00 33.72 H new ATOM 0 HA GLU A 18 34.458 12.458 36.731 1.00 33.52 H new ATOM 0 HB2 GLU A 18 36.438 13.721 36.685 1.00 34.37 H new ATOM 0 HB3 GLU A 18 37.268 12.407 36.815 1.00 34.37 H new ATOM 0 HG2 GLU A 18 36.362 11.707 34.699 1.00 35.82 H new ATOM 0 HG3 GLU A 18 35.711 13.117 34.562 1.00 35.82 H new ATOM 159 N GLY A 19 34.591 10.001 36.117 1.00 34.93 N ATOM 160 CA GLY A 19 34.654 8.565 35.936 1.00 35.10 C ATOM 161 C GLY A 19 34.175 7.828 37.169 1.00 37.18 C ATOM 162 O GLY A 19 33.320 8.319 37.911 1.00 37.55 O ATOM 0 H GLY A 19 34.016 10.408 35.624 1.00 34.93 H new ATOM 0 HA2 GLY A 19 34.111 8.310 35.174 1.00 35.10 H new ATOM 0 HA3 GLY A 19 35.566 8.303 35.735 1.00 35.10 H new ATOM 163 N ALA A 20 34.742 6.652 37.406 1.00 36.74 N ATOM 164 CA ALA A 20 34.344 5.839 38.544 1.00 37.14 C ATOM 165 C ALA A 20 34.617 6.443 39.919 1.00 37.20 C ATOM 166 O ALA A 20 33.756 6.384 40.801 1.00 37.25 O ATOM 167 CB ALA A 20 34.995 4.466 38.449 1.00 36.75 C ATOM 0 H ALA A 20 35.360 6.307 36.918 1.00 36.74 H new ATOM 0 HA ALA A 20 33.378 5.781 38.483 1.00 37.14 H new ATOM 0 HB1 ALA A 20 34.727 3.927 39.210 1.00 36.75 H new ATOM 0 HB2 ALA A 20 34.713 4.030 37.629 1.00 36.75 H new ATOM 0 HB3 ALA A 20 35.960 4.565 38.447 1.00 36.75 H new ATOM 168 N ALA A 21 35.796 7.032 40.112 1.00 36.26 N ATOM 169 CA ALA A 21 36.120 7.567 41.428 1.00 33.67 C ATOM 170 C ALA A 21 37.275 8.543 41.488 1.00 33.42 C ATOM 171 O ALA A 21 37.857 8.732 42.551 1.00 33.34 O ATOM 172 CB ALA A 21 36.398 6.413 42.381 1.00 35.32 C ATOM 0 H ALA A 21 36.405 7.130 39.512 1.00 36.26 H new ATOM 0 HA ALA A 21 35.341 8.085 41.684 1.00 33.67 H new ATOM 0 HB1 ALA A 21 36.614 6.763 43.259 1.00 35.32 H new ATOM 0 HB2 ALA A 21 35.612 5.848 42.443 1.00 35.32 H new ATOM 0 HB3 ALA A 21 37.145 5.891 42.048 1.00 35.32 H new ATOM 173 N ARG A 22 37.619 9.170 40.370 1.00 33.27 N ATOM 174 CA ARG A 22 38.726 10.119 40.396 1.00 32.86 C ATOM 175 C ARG A 22 38.245 11.492 40.867 1.00 32.96 C ATOM 176 O ARG A 22 37.464 12.158 40.186 1.00 32.95 O ATOM 177 CB ARG A 22 39.368 10.242 39.016 1.00 31.16 C ATOM 178 CG ARG A 22 40.707 10.971 39.042 1.00 33.50 C ATOM 179 CD ARG A 22 41.283 11.124 37.639 1.00 33.74 C ATOM 180 NE ARG A 22 40.762 12.291 36.938 1.00 31.56 N ATOM 181 CZ ARG A 22 41.275 13.510 37.053 1.00 33.18 C ATOM 182 NH1 ARG A 22 40.747 14.529 36.383 1.00 33.45 N ATOM 183 NH2 ARG A 22 42.325 13.703 37.838 1.00 33.32 N ATOM 0 H ARG A 22 37.238 9.066 39.606 1.00 33.27 H new ATOM 0 HA ARG A 22 39.390 9.786 41.020 1.00 32.86 H new ATOM 0 HB2 ARG A 22 39.496 9.355 38.645 1.00 31.16 H new ATOM 0 HB3 ARG A 22 38.761 10.713 38.424 1.00 31.16 H new ATOM 0 HG2 ARG A 22 40.593 11.846 39.444 1.00 33.50 H new ATOM 0 HG3 ARG A 22 41.333 10.482 39.599 1.00 33.50 H new ATOM 0 HD2 ARG A 22 42.249 11.191 37.696 1.00 33.74 H new ATOM 0 HD3 ARG A 22 41.084 10.327 37.124 1.00 33.74 H new ATOM 0 HE ARG A 22 40.084 12.184 36.420 1.00 31.56 H new ATOM 0 HH11 ARG A 22 40.068 14.401 35.871 1.00 33.45 H new ATOM 0 HH12 ARG A 22 41.084 15.316 36.462 1.00 33.45 H new ATOM 0 HH21 ARG A 22 42.668 13.042 38.267 1.00 33.32 H new ATOM 0 HH22 ARG A 22 42.663 14.490 37.918 1.00 33.32 H new ATOM 184 N SER A 23 38.725 11.911 42.032 1.00 32.79 N ATOM 185 CA SER A 23 38.346 13.193 42.605 1.00 35.04 C ATOM 186 C SER A 23 39.095 14.348 41.946 1.00 36.23 C ATOM 187 O SER A 23 40.315 14.311 41.816 1.00 37.87 O ATOM 188 CB SER A 23 38.623 13.182 44.114 1.00 36.33 C ATOM 189 OG SER A 23 38.339 14.440 44.705 1.00 41.63 O ATOM 0 H SER A 23 39.279 11.460 42.511 1.00 32.79 H new ATOM 0 HA SER A 23 37.399 13.327 42.445 1.00 35.04 H new ATOM 0 HB2 SER A 23 38.085 12.495 44.538 1.00 36.33 H new ATOM 0 HB3 SER A 23 39.552 12.952 44.272 1.00 36.33 H new ATOM 0 HG SER A 23 38.498 14.405 45.529 1.00 41.63 H new ATOM 190 N VAL A 24 38.364 15.374 41.521 1.00 35.73 N ATOM 191 CA VAL A 24 38.996 16.526 40.891 1.00 35.81 C ATOM 192 C VAL A 24 38.790 17.786 41.721 1.00 36.34 C ATOM 193 O VAL A 24 39.356 18.835 41.422 1.00 38.03 O ATOM 194 CB VAL A 24 38.451 16.773 39.464 1.00 36.35 C ATOM 195 CG1 VAL A 24 38.735 15.563 38.586 1.00 36.60 C ATOM 196 CG2 VAL A 24 36.960 17.047 39.511 1.00 37.60 C ATOM 0 H VAL A 24 37.508 15.422 41.587 1.00 35.73 H new ATOM 0 HA VAL A 24 39.943 16.324 40.834 1.00 35.81 H new ATOM 0 HB VAL A 24 38.896 17.548 39.087 1.00 36.35 H new ATOM 0 HG11 VAL A 24 38.391 15.723 37.693 1.00 36.60 H new ATOM 0 HG12 VAL A 24 39.692 15.413 38.542 1.00 36.60 H new ATOM 0 HG13 VAL A 24 38.303 14.781 38.963 1.00 36.60 H new ATOM 0 HG21 VAL A 24 36.630 17.200 38.612 1.00 37.60 H new ATOM 0 HG22 VAL A 24 36.503 16.284 39.897 1.00 37.60 H new ATOM 0 HG23 VAL A 24 36.792 17.833 40.054 1.00 37.60 H new ATOM 197 N ALA A 25 37.982 17.674 42.769 1.00 36.52 N ATOM 198 CA ALA A 25 37.695 18.809 43.641 1.00 34.80 C ATOM 199 C ALA A 25 36.917 18.334 44.858 1.00 35.33 C ATOM 200 O ALA A 25 36.261 17.300 44.814 1.00 33.48 O ATOM 201 CB ALA A 25 36.883 19.854 42.882 1.00 33.46 C ATOM 0 H ALA A 25 37.587 16.944 42.994 1.00 36.52 H new ATOM 0 HA ALA A 25 38.530 19.208 43.931 1.00 34.80 H new ATOM 0 HB1 ALA A 25 36.695 20.605 43.466 1.00 33.46 H new ATOM 0 HB2 ALA A 25 37.388 20.161 42.113 1.00 33.46 H new ATOM 0 HB3 ALA A 25 36.048 19.461 42.583 1.00 33.46 H new ATOM 202 N GLY A 26 36.991 19.095 45.944 1.00 35.41 N ATOM 203 CA GLY A 26 36.267 18.725 47.145 1.00 37.36 C ATOM 204 C GLY A 26 36.561 19.674 48.286 1.00 37.47 C ATOM 205 O GLY A 26 37.419 20.542 48.166 1.00 38.59 O ATOM 0 H GLY A 26 37.450 19.820 46.003 1.00 35.41 H new ATOM 0 HA2 GLY A 26 35.314 18.723 46.962 1.00 37.36 H new ATOM 0 HA3 GLY A 26 36.508 17.822 47.404 1.00 37.36 H new ATOM 206 N GLY A 27 35.851 19.523 49.395 1.00 38.15 N ATOM 207 CA GLY A 27 36.098 20.407 50.516 1.00 38.22 C ATOM 208 C GLY A 27 35.318 20.049 51.754 1.00 39.24 C ATOM 209 O GLY A 27 34.586 19.060 51.775 1.00 38.18 O ATOM 0 H GLY A 27 35.239 18.931 49.516 1.00 38.15 H new ATOM 0 HA2 GLY A 27 37.045 20.394 50.725 1.00 38.22 H new ATOM 0 HA3 GLY A 27 35.878 21.315 50.256 1.00 38.22 H new ATOM 210 N LEU A 28 35.492 20.866 52.789 1.00 42.45 N ATOM 211 CA LEU A 28 34.814 20.690 54.070 1.00 45.73 C ATOM 212 C LEU A 28 34.087 21.978 54.424 1.00 47.03 C ATOM 213 O LEU A 28 34.698 23.042 54.484 1.00 47.10 O ATOM 214 CB LEU A 28 35.825 20.372 55.172 1.00 46.01 C ATOM 215 CG LEU A 28 35.911 18.927 55.655 1.00 48.66 C ATOM 216 CD1 LEU A 28 34.568 18.491 56.228 1.00 48.18 C ATOM 217 CD2 LEU A 28 36.314 18.034 54.500 1.00 51.02 C ATOM 0 H LEU A 28 36.015 21.548 52.766 1.00 42.45 H new ATOM 0 HA LEU A 28 34.186 19.954 53.996 1.00 45.73 H new ATOM 0 HB2 LEU A 28 36.704 20.635 54.857 1.00 46.01 H new ATOM 0 HB3 LEU A 28 35.619 20.931 55.937 1.00 46.01 H new ATOM 0 HG LEU A 28 36.579 18.856 56.355 1.00 48.66 H new ATOM 0 HD11 LEU A 28 34.629 17.572 56.533 1.00 48.18 H new ATOM 0 HD12 LEU A 28 34.333 19.064 56.974 1.00 48.18 H new ATOM 0 HD13 LEU A 28 33.886 18.559 55.542 1.00 48.18 H new ATOM 0 HD21 LEU A 28 36.369 17.115 54.805 1.00 51.02 H new ATOM 0 HD22 LEU A 28 35.653 18.100 53.793 1.00 51.02 H new ATOM 0 HD23 LEU A 28 37.178 18.314 54.161 1.00 51.02 H new ATOM 218 N ALA A 29 32.785 21.882 54.656 1.00 49.16 N ATOM 219 CA ALA A 29 31.995 23.056 54.999 1.00 52.77 C ATOM 220 C ALA A 29 31.474 22.971 56.432 1.00 55.59 C ATOM 221 O ALA A 29 30.889 21.961 56.831 1.00 55.19 O ATOM 222 CB ALA A 29 30.834 23.201 54.028 1.00 51.28 C ATOM 0 H ALA A 29 32.340 21.147 54.620 1.00 49.16 H new ATOM 0 HA ALA A 29 32.567 23.836 54.934 1.00 52.77 H new ATOM 0 HB1 ALA A 29 30.312 23.984 54.262 1.00 51.28 H new ATOM 0 HB2 ALA A 29 31.177 23.299 53.126 1.00 51.28 H new ATOM 0 HB3 ALA A 29 30.271 22.412 54.076 1.00 51.28 H new ATOM 223 N GLU A 30 31.692 24.039 57.196 1.00 58.95 N ATOM 224 CA GLU A 30 31.253 24.108 58.589 1.00 61.78 C ATOM 225 C GLU A 30 29.831 24.637 58.683 1.00 61.81 C ATOM 226 O GLU A 30 29.264 24.731 59.768 1.00 62.08 O ATOM 227 CB GLU A 30 32.183 25.017 59.392 1.00 64.59 C ATOM 228 CG GLU A 30 33.622 24.536 59.438 1.00 68.91 C ATOM 229 CD GLU A 30 34.561 25.558 60.044 1.00 71.97 C ATOM 230 OE1 GLU A 30 35.780 25.283 60.097 1.00 73.48 O ATOM 231 OE2 GLU A 30 34.085 26.636 60.465 1.00 74.65 O ATOM 0 H GLU A 30 32.099 24.745 56.921 1.00 58.95 H new ATOM 0 HA GLU A 30 31.280 23.210 58.955 1.00 61.78 H new ATOM 0 HB2 GLU A 30 32.161 25.908 59.009 1.00 64.59 H new ATOM 0 HB3 GLU A 30 31.846 25.090 60.299 1.00 64.59 H new ATOM 0 HG2 GLU A 30 33.668 23.715 59.952 1.00 68.91 H new ATOM 0 HG3 GLU A 30 33.917 24.324 58.539 1.00 68.91 H new ATOM 232 N SER A 31 29.263 24.986 57.537 1.00 62.27 N ATOM 233 CA SER A 31 27.904 25.504 57.486 1.00 63.10 C ATOM 234 C SER A 31 27.396 25.431 56.059 1.00 63.73 C ATOM 235 O SER A 31 28.186 25.390 55.118 1.00 63.68 O ATOM 236 CB SER A 31 27.869 26.955 57.976 1.00 62.17 C ATOM 237 OG SER A 31 28.749 27.776 57.225 1.00 61.20 O ATOM 0 H SER A 31 29.651 24.930 56.772 1.00 62.27 H new ATOM 0 HA SER A 31 27.337 24.969 58.063 1.00 63.10 H new ATOM 0 HB2 SER A 31 26.965 27.300 57.908 1.00 62.17 H new ATOM 0 HB3 SER A 31 28.115 26.988 58.914 1.00 62.17 H new ATOM 0 HG SER A 31 28.710 28.565 57.512 1.00 61.20 H new ATOM 238 N ASP A 32 26.078 25.407 55.899 1.00 65.27 N ATOM 239 CA ASP A 32 25.481 25.343 54.573 1.00 66.74 C ATOM 240 C ASP A 32 25.924 26.519 53.712 1.00 65.94 C ATOM 241 O ASP A 32 26.157 26.366 52.516 1.00 66.05 O ATOM 242 CB ASP A 32 23.956 25.319 54.674 1.00 69.49 C ATOM 243 CG ASP A 32 23.421 23.965 55.095 1.00 71.98 C ATOM 244 OD1 ASP A 32 23.815 23.480 56.178 1.00 74.51 O ATOM 245 OD2 ASP A 32 22.607 23.385 54.342 1.00 72.29 O ATOM 0 H ASP A 32 25.512 25.427 56.546 1.00 65.27 H new ATOM 0 HA ASP A 32 25.785 24.524 54.151 1.00 66.74 H new ATOM 0 HB2 ASP A 32 23.667 25.990 55.312 1.00 69.49 H new ATOM 0 HB3 ASP A 32 23.575 25.561 53.816 1.00 69.49 H new ATOM 246 N ASP A 33 26.045 27.693 54.319 1.00 65.36 N ATOM 247 CA ASP A 33 26.470 28.869 53.574 1.00 65.34 C ATOM 248 C ASP A 33 27.902 28.700 53.087 1.00 63.33 C ATOM 249 O ASP A 33 28.248 29.130 51.987 1.00 62.50 O ATOM 250 CB ASP A 33 26.357 30.124 54.442 1.00 68.07 C ATOM 251 CG ASP A 33 24.921 30.595 54.602 1.00 70.55 C ATOM 252 OD1 ASP A 33 24.699 31.572 55.350 1.00 71.37 O ATOM 253 OD2 ASP A 33 24.019 29.991 53.977 1.00 71.57 O ATOM 0 H ASP A 33 25.888 27.829 55.153 1.00 65.36 H new ATOM 0 HA ASP A 33 25.887 28.969 52.805 1.00 65.34 H new ATOM 0 HB2 ASP A 33 26.734 29.943 55.317 1.00 68.07 H new ATOM 0 HB3 ASP A 33 26.885 30.835 54.047 1.00 68.07 H new ATOM 254 N ALA A 34 28.735 28.076 53.911 1.00 60.90 N ATOM 255 CA ALA A 34 30.121 27.849 53.535 1.00 58.30 C ATOM 256 C ALA A 34 30.121 26.842 52.389 1.00 57.10 C ATOM 257 O ALA A 34 30.916 26.941 51.454 1.00 55.52 O ATOM 258 CB ALA A 34 30.904 27.305 54.721 1.00 57.02 C ATOM 0 H ALA A 34 28.518 27.778 54.688 1.00 60.90 H new ATOM 0 HA ALA A 34 30.543 28.678 53.259 1.00 58.30 H new ATOM 0 HB1 ALA A 34 31.826 27.157 54.460 1.00 57.02 H new ATOM 0 HB2 ALA A 34 30.873 27.944 55.450 1.00 57.02 H new ATOM 0 HB3 ALA A 34 30.512 26.466 55.010 1.00 57.02 H new ATOM 259 N LEU A 35 29.206 25.881 52.469 1.00 55.66 N ATOM 260 CA LEU A 35 29.078 24.846 51.454 1.00 55.19 C ATOM 261 C LEU A 35 28.693 25.458 50.116 1.00 55.42 C ATOM 262 O LEU A 35 29.327 25.194 49.093 1.00 53.89 O ATOM 263 CB LEU A 35 28.021 23.825 51.880 1.00 53.54 C ATOM 264 CG LEU A 35 27.691 22.724 50.871 1.00 51.87 C ATOM 265 CD1 LEU A 35 28.960 21.981 50.480 1.00 51.43 C ATOM 266 CD2 LEU A 35 26.681 21.776 51.476 1.00 51.89 C ATOM 0 H LEU A 35 28.642 25.812 53.115 1.00 55.66 H new ATOM 0 HA LEU A 35 29.934 24.400 51.358 1.00 55.19 H new ATOM 0 HB2 LEU A 35 28.319 23.404 52.702 1.00 53.54 H new ATOM 0 HB3 LEU A 35 27.203 24.303 52.086 1.00 53.54 H new ATOM 0 HG LEU A 35 27.311 23.118 50.071 1.00 51.87 H new ATOM 0 HD11 LEU A 35 28.743 21.285 49.840 1.00 51.43 H new ATOM 0 HD12 LEU A 35 29.589 22.602 50.081 1.00 51.43 H new ATOM 0 HD13 LEU A 35 29.358 21.582 51.270 1.00 51.43 H new ATOM 0 HD21 LEU A 35 26.470 21.077 50.838 1.00 51.89 H new ATOM 0 HD22 LEU A 35 27.051 21.379 52.280 1.00 51.89 H new ATOM 0 HD23 LEU A 35 25.873 22.263 51.699 1.00 51.89 H new ATOM 267 N VAL A 36 27.645 26.274 50.130 1.00 56.44 N ATOM 268 CA VAL A 36 27.181 26.930 48.918 1.00 58.17 C ATOM 269 C VAL A 36 28.306 27.785 48.353 1.00 58.44 C ATOM 270 O VAL A 36 28.485 27.874 47.143 1.00 59.04 O ATOM 271 CB VAL A 36 25.960 27.823 49.208 1.00 59.01 C ATOM 272 CG1 VAL A 36 25.609 28.649 47.979 1.00 59.76 C ATOM 273 CG2 VAL A 36 24.780 26.959 49.616 1.00 58.36 C ATOM 0 H VAL A 36 27.188 26.461 50.835 1.00 56.44 H new ATOM 0 HA VAL A 36 26.919 26.250 48.277 1.00 58.17 H new ATOM 0 HB VAL A 36 26.175 28.429 49.935 1.00 59.01 H new ATOM 0 HG11 VAL A 36 24.840 29.207 48.173 1.00 59.76 H new ATOM 0 HG12 VAL A 36 26.363 29.210 47.740 1.00 59.76 H new ATOM 0 HG13 VAL A 36 25.400 28.057 47.240 1.00 59.76 H new ATOM 0 HG21 VAL A 36 24.013 27.524 49.798 1.00 58.36 H new ATOM 0 HG22 VAL A 36 24.565 26.344 48.897 1.00 58.36 H new ATOM 0 HG23 VAL A 36 25.007 26.456 50.414 1.00 58.36 H new ATOM 274 N GLU A 37 29.066 28.405 49.246 1.00 58.69 N ATOM 275 CA GLU A 37 30.181 29.249 48.855 1.00 60.59 C ATOM 276 C GLU A 37 31.221 28.441 48.082 1.00 60.24 C ATOM 277 O GLU A 37 31.667 28.845 47.007 1.00 59.67 O ATOM 278 CB GLU A 37 30.825 29.854 50.103 1.00 64.44 C ATOM 279 CG GLU A 37 32.017 30.755 49.829 1.00 69.50 C ATOM 280 CD GLU A 37 31.625 32.055 49.160 1.00 73.74 C ATOM 281 OE1 GLU A 37 32.516 32.909 48.955 1.00 75.70 O ATOM 282 OE2 GLU A 37 30.427 32.226 48.840 1.00 75.70 O ATOM 0 H GLU A 37 28.948 28.347 50.096 1.00 58.69 H new ATOM 0 HA GLU A 37 29.850 29.957 48.281 1.00 60.59 H new ATOM 0 HB2 GLU A 37 30.154 30.363 50.584 1.00 64.44 H new ATOM 0 HB3 GLU A 37 31.107 29.134 50.688 1.00 64.44 H new ATOM 0 HG2 GLU A 37 32.470 30.949 50.665 1.00 69.50 H new ATOM 0 HG3 GLU A 37 32.651 30.284 49.266 1.00 69.50 H new ATOM 283 N GLN A 38 31.599 27.292 48.634 1.00 58.86 N ATOM 284 CA GLN A 38 32.597 26.436 48.005 1.00 57.99 C ATOM 285 C GLN A 38 32.111 25.853 46.683 1.00 56.86 C ATOM 286 O GLN A 38 32.823 25.892 45.685 1.00 57.45 O ATOM 287 CB GLN A 38 32.993 25.300 48.954 1.00 57.45 C ATOM 288 CG GLN A 38 33.459 25.766 50.328 1.00 58.16 C ATOM 289 CD GLN A 38 33.834 24.614 51.247 1.00 58.00 C ATOM 290 OE1 GLN A 38 33.182 23.571 51.254 1.00 56.57 O ATOM 291 NE2 GLN A 38 34.880 24.806 52.038 1.00 59.27 N ATOM 0 H GLN A 38 31.287 26.990 49.376 1.00 58.86 H new ATOM 0 HA GLN A 38 33.369 26.992 47.815 1.00 57.99 H new ATOM 0 HB2 GLN A 38 32.234 24.706 49.065 1.00 57.45 H new ATOM 0 HB3 GLN A 38 33.701 24.781 48.542 1.00 57.45 H new ATOM 0 HG2 GLN A 38 34.224 26.353 50.223 1.00 58.16 H new ATOM 0 HG3 GLN A 38 32.755 26.289 50.743 1.00 58.16 H new ATOM 0 HE21 GLN A 38 35.313 25.549 52.006 1.00 59.27 H new ATOM 0 HE22 GLN A 38 35.126 24.188 52.583 1.00 59.27 H new ATOM 292 N LEU A 39 30.895 25.318 46.676 1.00 56.12 N ATOM 293 CA LEU A 39 30.334 24.718 45.474 1.00 55.95 C ATOM 294 C LEU A 39 30.140 25.706 44.330 1.00 57.29 C ATOM 295 O LEU A 39 30.296 25.347 43.161 1.00 56.63 O ATOM 296 CB LEU A 39 28.996 24.047 45.793 1.00 55.08 C ATOM 297 CG LEU A 39 29.057 22.794 46.668 1.00 54.72 C ATOM 298 CD1 LEU A 39 27.649 22.294 46.953 1.00 52.59 C ATOM 299 CD2 LEU A 39 29.872 21.722 45.961 1.00 53.70 C ATOM 0 H LEU A 39 30.377 25.293 47.362 1.00 56.12 H new ATOM 0 HA LEU A 39 30.984 24.062 45.175 1.00 55.95 H new ATOM 0 HB2 LEU A 39 28.426 24.698 46.232 1.00 55.08 H new ATOM 0 HB3 LEU A 39 28.566 23.813 44.956 1.00 55.08 H new ATOM 0 HG LEU A 39 29.484 23.007 47.512 1.00 54.72 H new ATOM 0 HD11 LEU A 39 27.694 21.500 47.508 1.00 52.59 H new ATOM 0 HD12 LEU A 39 27.148 22.984 47.416 1.00 52.59 H new ATOM 0 HD13 LEU A 39 27.206 22.079 46.117 1.00 52.59 H new ATOM 0 HD21 LEU A 39 29.911 20.927 46.515 1.00 53.70 H new ATOM 0 HD22 LEU A 39 29.454 21.504 45.113 1.00 53.70 H new ATOM 0 HD23 LEU A 39 30.771 22.050 45.803 1.00 53.70 H new ATOM 300 N THR A 40 29.793 26.944 44.666 1.00 57.85 N ATOM 301 CA THR A 40 29.578 27.967 43.650 1.00 59.32 C ATOM 302 C THR A 40 30.812 28.126 42.773 1.00 60.20 C ATOM 303 O THR A 40 30.706 28.447 41.591 1.00 60.91 O ATOM 304 CB THR A 40 29.239 29.330 44.287 1.00 59.43 C ATOM 305 OG1 THR A 40 27.998 29.229 44.995 1.00 58.58 O ATOM 306 CG2 THR A 40 29.116 30.405 43.216 1.00 59.33 C ATOM 0 H THR A 40 29.677 27.211 45.475 1.00 57.85 H new ATOM 0 HA THR A 40 28.828 27.676 43.108 1.00 59.32 H new ATOM 0 HB THR A 40 29.953 29.573 44.897 1.00 59.43 H new ATOM 0 HG1 THR A 40 28.059 28.632 45.583 1.00 58.58 H new ATOM 0 HG21 THR A 40 28.903 31.255 43.633 1.00 59.33 H new ATOM 0 HG22 THR A 40 29.956 30.482 42.737 1.00 59.33 H new ATOM 0 HG23 THR A 40 28.411 30.164 42.595 1.00 59.33 H new ATOM 307 N SER A 41 31.983 27.893 43.356 1.00 60.87 N ATOM 308 CA SER A 41 33.235 28.009 42.620 1.00 61.63 C ATOM 309 C SER A 41 33.490 26.805 41.713 1.00 62.10 C ATOM 310 O SER A 41 34.425 26.817 40.913 1.00 62.61 O ATOM 311 CB SER A 41 34.402 28.155 43.596 1.00 61.89 C ATOM 312 OG SER A 41 34.210 29.264 44.453 1.00 60.37 O ATOM 0 H SER A 41 32.074 27.666 44.180 1.00 60.87 H new ATOM 0 HA SER A 41 33.163 28.796 42.058 1.00 61.63 H new ATOM 0 HB2 SER A 41 34.490 27.346 44.123 1.00 61.89 H new ATOM 0 HB3 SER A 41 35.230 28.263 43.102 1.00 61.89 H new ATOM 0 HG SER A 41 34.860 29.326 44.981 1.00 60.37 H new ATOM 313 N GLN A 42 32.662 25.770 41.836 1.00 62.26 N ATOM 314 CA GLN A 42 32.834 24.564 41.026 1.00 62.31 C ATOM 315 C GLN A 42 31.707 24.321 40.030 1.00 62.12 C ATOM 316 O GLN A 42 31.689 23.295 39.348 1.00 61.19 O ATOM 317 CB GLN A 42 32.959 23.326 41.922 1.00 62.35 C ATOM 318 CG GLN A 42 34.127 23.339 42.896 1.00 61.14 C ATOM 319 CD GLN A 42 35.452 23.620 42.224 1.00 60.78 C ATOM 320 OE1 GLN A 42 35.669 23.248 41.073 1.00 61.14 O ATOM 321 NE2 GLN A 42 36.357 24.269 42.950 1.00 61.80 N ATOM 0 H GLN A 42 31.997 25.745 42.380 1.00 62.26 H new ATOM 0 HA GLN A 42 33.647 24.713 40.518 1.00 62.31 H new ATOM 0 HB2 GLN A 42 32.137 23.228 42.428 1.00 62.35 H new ATOM 0 HB3 GLN A 42 33.039 22.543 41.356 1.00 62.35 H new ATOM 0 HG2 GLN A 42 33.966 24.011 43.577 1.00 61.14 H new ATOM 0 HG3 GLN A 42 34.174 22.482 43.348 1.00 61.14 H new ATOM 0 HE21 GLN A 42 36.169 24.514 43.753 1.00 61.80 H new ATOM 0 HE22 GLN A 42 37.130 24.444 42.617 1.00 61.80 H new ATOM 322 N GLN A 43 30.763 25.252 39.946 1.00 62.07 N ATOM 323 CA GLN A 43 29.653 25.088 39.019 1.00 62.35 C ATOM 324 C GLN A 43 30.158 25.071 37.578 1.00 62.06 C ATOM 325 O GLN A 43 29.402 24.787 36.647 1.00 61.71 O ATOM 326 CB GLN A 43 28.614 26.196 39.231 1.00 62.73 C ATOM 327 CG GLN A 43 29.190 27.593 39.307 1.00 64.80 C ATOM 328 CD GLN A 43 28.190 28.608 39.841 1.00 66.71 C ATOM 329 OE1 GLN A 43 26.991 28.139 40.180 1.00 66.80 O flip ATOM 330 NE2 GLN A 43 28.495 29.800 39.951 1.00 65.63 N flip ATOM 0 H GLN A 43 30.747 25.976 40.410 1.00 62.07 H new ATOM 0 HA GLN A 43 29.223 24.236 39.193 1.00 62.35 H new ATOM 0 HB2 GLN A 43 27.971 26.163 38.506 1.00 62.73 H new ATOM 0 HB3 GLN A 43 28.127 26.014 40.050 1.00 62.73 H new ATOM 0 HG2 GLN A 43 29.974 27.585 39.877 1.00 64.80 H new ATOM 0 HG3 GLN A 43 29.484 27.867 38.424 1.00 64.80 H new ATOM 0 HE21 GLN A 43 29.280 30.066 39.722 1.00 65.63 H new ATOM 0 HE22 GLN A 43 27.922 30.364 40.257 1.00 65.63 H new ATOM 331 N ALA A 44 31.447 25.361 37.407 1.00 61.32 N ATOM 332 CA ALA A 44 32.074 25.350 36.090 1.00 60.42 C ATOM 333 C ALA A 44 32.293 23.901 35.661 1.00 59.53 C ATOM 334 O ALA A 44 32.393 23.603 34.471 1.00 60.58 O ATOM 335 CB ALA A 44 33.406 26.081 36.136 1.00 62.13 C ATOM 0 H ALA A 44 31.979 25.569 38.050 1.00 61.32 H new ATOM 0 HA ALA A 44 31.498 25.800 35.453 1.00 60.42 H new ATOM 0 HB1 ALA A 44 33.813 26.067 35.256 1.00 62.13 H new ATOM 0 HB2 ALA A 44 33.262 27.000 36.411 1.00 62.13 H new ATOM 0 HB3 ALA A 44 33.994 25.643 36.771 1.00 62.13 H new ATOM 336 N LEU A 45 32.364 23.004 36.642 1.00 56.79 N ATOM 337 CA LEU A 45 32.564 21.581 36.379 1.00 53.72 C ATOM 338 C LEU A 45 31.281 20.953 35.844 1.00 51.20 C ATOM 339 O LEU A 45 30.191 21.237 36.325 1.00 51.15 O ATOM 340 CB LEU A 45 32.989 20.858 37.661 1.00 52.98 C ATOM 341 CG LEU A 45 34.248 21.372 38.362 1.00 52.52 C ATOM 342 CD1 LEU A 45 34.408 20.645 39.685 1.00 51.70 C ATOM 343 CD2 LEU A 45 35.473 21.170 37.473 1.00 51.45 C ATOM 0 H LEU A 45 32.298 23.202 37.476 1.00 56.79 H new ATOM 0 HA LEU A 45 33.264 21.491 35.714 1.00 53.72 H new ATOM 0 HB2 LEU A 45 32.253 20.904 38.291 1.00 52.98 H new ATOM 0 HB3 LEU A 45 33.123 19.921 37.449 1.00 52.98 H new ATOM 0 HG LEU A 45 34.163 22.323 38.532 1.00 52.52 H new ATOM 0 HD11 LEU A 45 35.205 20.965 40.136 1.00 51.70 H new ATOM 0 HD12 LEU A 45 33.632 20.812 40.242 1.00 51.70 H new ATOM 0 HD13 LEU A 45 34.490 19.692 39.523 1.00 51.70 H new ATOM 0 HD21 LEU A 45 36.263 21.500 37.930 1.00 51.45 H new ATOM 0 HD22 LEU A 45 35.582 20.225 37.282 1.00 51.45 H new ATOM 0 HD23 LEU A 45 35.354 21.656 36.642 1.00 51.45 H new ATOM 344 N PRO A 46 31.404 20.071 34.848 1.00 48.83 N ATOM 345 CA PRO A 46 30.249 19.403 34.247 1.00 46.92 C ATOM 346 C PRO A 46 29.506 18.427 35.163 1.00 45.21 C ATOM 347 O PRO A 46 29.358 17.251 34.828 1.00 44.97 O ATOM 348 CB PRO A 46 30.859 18.709 33.029 1.00 47.24 C ATOM 349 CG PRO A 46 32.223 18.338 33.523 1.00 46.55 C ATOM 350 CD PRO A 46 32.662 19.597 34.240 1.00 47.51 C ATOM 0 HA PRO A 46 29.547 20.037 34.035 1.00 46.92 H new ATOM 0 HB2 PRO A 46 30.347 17.930 32.762 1.00 47.24 H new ATOM 0 HB3 PRO A 46 30.901 19.298 32.260 1.00 47.24 H new ATOM 0 HG2 PRO A 46 32.196 17.573 34.119 1.00 46.55 H new ATOM 0 HG3 PRO A 46 32.822 18.109 32.795 1.00 46.55 H new ATOM 0 HD2 PRO A 46 33.340 19.414 34.909 1.00 47.51 H new ATOM 0 HD3 PRO A 46 33.036 20.250 33.628 1.00 47.51 H new ATOM 351 N VAL A 47 29.035 18.909 36.310 1.00 43.90 N ATOM 352 CA VAL A 47 28.292 18.056 37.241 1.00 42.08 C ATOM 353 C VAL A 47 26.903 17.755 36.681 1.00 42.10 C ATOM 354 O VAL A 47 26.138 18.672 36.384 1.00 41.80 O ATOM 355 CB VAL A 47 28.133 18.733 38.626 1.00 42.98 C ATOM 356 CG1 VAL A 47 27.200 17.905 39.510 1.00 39.49 C ATOM 357 CG2 VAL A 47 29.494 18.875 39.293 1.00 40.96 C ATOM 0 H VAL A 47 29.133 19.723 36.569 1.00 43.90 H new ATOM 0 HA VAL A 47 28.796 17.235 37.349 1.00 42.08 H new ATOM 0 HB VAL A 47 27.748 19.615 38.504 1.00 42.98 H new ATOM 0 HG11 VAL A 47 27.106 18.335 40.374 1.00 39.49 H new ATOM 0 HG12 VAL A 47 26.330 17.836 39.087 1.00 39.49 H new ATOM 0 HG13 VAL A 47 27.571 17.017 39.630 1.00 39.49 H new ATOM 0 HG21 VAL A 47 29.388 19.299 40.159 1.00 40.96 H new ATOM 0 HG22 VAL A 47 29.890 17.997 39.410 1.00 40.96 H new ATOM 0 HG23 VAL A 47 30.072 19.419 38.736 1.00 40.96 H new ATOM 358 N ARG A 48 26.576 16.473 36.546 1.00 42.01 N ATOM 359 CA ARG A 48 25.280 16.076 36.007 1.00 42.55 C ATOM 360 C ARG A 48 24.643 14.934 36.777 1.00 41.66 C ATOM 361 O ARG A 48 23.690 14.305 36.312 1.00 41.63 O ATOM 362 CB ARG A 48 25.427 15.691 34.538 1.00 47.63 C ATOM 363 CG ARG A 48 26.003 16.811 33.696 1.00 53.09 C ATOM 364 CD ARG A 48 26.438 16.330 32.338 1.00 59.04 C ATOM 365 NE ARG A 48 27.420 17.240 31.758 1.00 64.71 N ATOM 366 CZ ARG A 48 28.178 16.946 30.708 1.00 67.44 C ATOM 367 NH1 ARG A 48 29.048 17.838 30.251 1.00 69.14 N ATOM 368 NH2 ARG A 48 28.069 15.760 30.120 1.00 68.76 N ATOM 0 H ARG A 48 27.090 15.818 36.761 1.00 42.01 H new ATOM 0 HA ARG A 48 24.690 16.841 36.097 1.00 42.55 H new ATOM 0 HB2 ARG A 48 25.999 14.911 34.467 1.00 47.63 H new ATOM 0 HB3 ARG A 48 24.559 15.439 34.185 1.00 47.63 H new ATOM 0 HG2 ARG A 48 25.339 17.511 33.593 1.00 53.09 H new ATOM 0 HG3 ARG A 48 26.761 17.204 34.157 1.00 53.09 H new ATOM 0 HD2 ARG A 48 26.818 15.441 32.411 1.00 59.04 H new ATOM 0 HD3 ARG A 48 25.668 16.262 31.752 1.00 59.04 H new ATOM 0 HE ARG A 48 27.514 18.015 32.119 1.00 64.71 H new ATOM 0 HH11 ARG A 48 29.120 18.604 30.635 1.00 69.14 H new ATOM 0 HH12 ARG A 48 29.540 17.650 29.571 1.00 69.14 H new ATOM 0 HH21 ARG A 48 27.507 15.182 30.419 1.00 68.76 H new ATOM 0 HH22 ARG A 48 28.560 15.570 29.440 1.00 68.76 H new ATOM 369 N ALA A 49 25.178 14.663 37.959 1.00 39.46 N ATOM 370 CA ALA A 49 24.649 13.612 38.813 1.00 37.48 C ATOM 371 C ALA A 49 25.066 13.962 40.229 1.00 36.56 C ATOM 372 O ALA A 49 26.031 14.702 40.430 1.00 34.80 O ATOM 373 CB ALA A 49 25.206 12.255 38.406 1.00 40.01 C ATOM 0 H ALA A 49 25.854 15.081 38.287 1.00 39.46 H new ATOM 0 HA ALA A 49 23.684 13.552 38.737 1.00 37.48 H new ATOM 0 HB1 ALA A 49 24.842 11.568 38.986 1.00 40.01 H new ATOM 0 HB2 ALA A 49 24.959 12.066 37.487 1.00 40.01 H new ATOM 0 HB3 ALA A 49 26.173 12.265 38.485 1.00 40.01 H new ATOM 374 N CYS A 50 24.340 13.433 41.207 1.00 35.43 N ATOM 375 CA CYS A 50 24.629 13.726 42.597 1.00 35.87 C ATOM 376 C CYS A 50 24.094 12.634 43.517 1.00 36.03 C ATOM 377 O CYS A 50 23.003 12.105 43.306 1.00 35.80 O ATOM 378 CB CYS A 50 24.010 15.083 42.955 1.00 37.42 C ATOM 379 SG CYS A 50 24.261 15.635 44.651 1.00 39.13 S ATOM 0 H CYS A 50 23.675 12.902 41.083 1.00 35.43 H new ATOM 0 HA CYS A 50 25.591 13.760 42.720 1.00 35.87 H new ATOM 0 HB2 CYS A 50 24.375 15.754 42.357 1.00 37.42 H new ATOM 0 HB3 CYS A 50 23.056 15.040 42.785 1.00 37.42 H new ATOM 0 HG CYS A 50 23.736 16.703 44.807 1.00 39.13 H new ATOM 380 N ARG A 51 24.881 12.286 44.527 1.00 34.67 N ATOM 381 CA ARG A 51 24.494 11.265 45.497 1.00 34.16 C ATOM 382 C ARG A 51 25.028 11.734 46.844 1.00 33.47 C ATOM 383 O ARG A 51 26.050 12.411 46.907 1.00 32.48 O ATOM 384 CB ARG A 51 25.112 9.911 45.127 1.00 35.50 C ATOM 385 CG ARG A 51 26.542 10.041 44.617 1.00 37.54 C ATOM 386 CD ARG A 51 27.369 8.779 44.805 1.00 38.44 C ATOM 387 NE ARG A 51 26.930 7.675 43.973 1.00 36.89 N ATOM 388 CZ ARG A 51 27.701 7.055 43.083 1.00 37.03 C ATOM 389 NH1 ARG A 51 28.963 7.432 42.904 1.00 34.28 N ATOM 390 NH2 ARG A 51 27.205 6.054 42.369 1.00 32.33 N ATOM 0 H ARG A 51 25.654 12.634 44.671 1.00 34.67 H new ATOM 0 HA ARG A 51 23.531 11.148 45.517 1.00 34.16 H new ATOM 0 HB2 ARG A 51 25.101 9.331 45.904 1.00 35.50 H new ATOM 0 HB3 ARG A 51 24.567 9.485 44.447 1.00 35.50 H new ATOM 0 HG2 ARG A 51 26.522 10.269 43.674 1.00 37.54 H new ATOM 0 HG3 ARG A 51 26.977 10.776 45.078 1.00 37.54 H new ATOM 0 HD2 ARG A 51 28.298 8.976 44.606 1.00 38.44 H new ATOM 0 HD3 ARG A 51 27.329 8.510 45.736 1.00 38.44 H new ATOM 0 HE ARG A 51 26.119 7.403 44.061 1.00 36.89 H new ATOM 0 HH11 ARG A 51 29.287 8.081 43.365 1.00 34.28 H new ATOM 0 HH12 ARG A 51 29.455 7.027 42.327 1.00 34.28 H new ATOM 0 HH21 ARG A 51 26.389 5.808 42.482 1.00 32.33 H new ATOM 0 HH22 ARG A 51 27.700 5.650 41.793 1.00 32.33 H new ATOM 391 N LEU A 52 24.347 11.391 47.926 1.00 33.36 N ATOM 392 CA LEU A 52 24.833 11.830 49.226 1.00 33.99 C ATOM 393 C LEU A 52 24.290 11.002 50.366 1.00 33.08 C ATOM 394 O LEU A 52 23.311 10.262 50.212 1.00 35.08 O ATOM 395 CB LEU A 52 24.478 13.306 49.447 1.00 34.41 C ATOM 396 CG LEU A 52 22.993 13.691 49.540 1.00 36.96 C ATOM 397 CD1 LEU A 52 22.404 13.272 50.893 1.00 34.81 C ATOM 398 CD2 LEU A 52 22.871 15.194 49.379 1.00 35.33 C ATOM 0 H LEU A 52 23.626 10.922 47.934 1.00 33.36 H new ATOM 0 HA LEU A 52 25.796 11.713 49.220 1.00 33.99 H new ATOM 0 HB2 LEU A 52 24.911 13.595 50.266 1.00 34.41 H new ATOM 0 HB3 LEU A 52 24.871 13.817 48.722 1.00 34.41 H new ATOM 0 HG LEU A 52 22.502 13.233 48.840 1.00 36.96 H new ATOM 0 HD11 LEU A 52 21.468 13.524 50.931 1.00 34.81 H new ATOM 0 HD12 LEU A 52 22.484 12.311 50.997 1.00 34.81 H new ATOM 0 HD13 LEU A 52 22.887 13.716 51.608 1.00 34.81 H new ATOM 0 HD21 LEU A 52 21.937 15.451 49.436 1.00 35.33 H new ATOM 0 HD22 LEU A 52 23.371 15.637 50.082 1.00 35.33 H new ATOM 0 HD23 LEU A 52 23.226 15.457 48.516 1.00 35.33 H new ATOM 399 N VAL A 53 24.957 11.112 51.507 1.00 31.63 N ATOM 400 CA VAL A 53 24.533 10.421 52.707 1.00 30.51 C ATOM 401 C VAL A 53 24.419 11.500 53.774 1.00 31.30 C ATOM 402 O VAL A 53 25.230 12.429 53.818 1.00 30.34 O ATOM 403 CB VAL A 53 25.549 9.328 53.163 1.00 29.62 C ATOM 404 CG1 VAL A 53 26.944 9.919 53.331 1.00 26.75 C ATOM 405 CG2 VAL A 53 25.074 8.717 54.484 1.00 28.57 C ATOM 0 H VAL A 53 25.666 11.589 51.604 1.00 31.63 H new ATOM 0 HA VAL A 53 23.698 9.954 52.549 1.00 30.51 H new ATOM 0 HB VAL A 53 25.595 8.639 52.482 1.00 29.62 H new ATOM 0 HG11 VAL A 53 27.558 9.224 53.614 1.00 26.75 H new ATOM 0 HG12 VAL A 53 27.243 10.289 52.486 1.00 26.75 H new ATOM 0 HG13 VAL A 53 26.920 10.621 54.000 1.00 26.75 H new ATOM 0 HG21 VAL A 53 25.703 8.037 54.771 1.00 28.57 H new ATOM 0 HG22 VAL A 53 25.018 9.411 55.160 1.00 28.57 H new ATOM 0 HG23 VAL A 53 24.200 8.316 54.359 1.00 28.57 H new ATOM 406 N SER A 54 23.413 11.383 54.630 1.00 33.44 N ATOM 407 CA SER A 54 23.208 12.379 55.669 1.00 37.28 C ATOM 408 C SER A 54 22.717 11.758 56.968 1.00 38.99 C ATOM 409 O SER A 54 21.977 10.779 56.959 1.00 38.56 O ATOM 410 CB SER A 54 22.197 13.425 55.175 1.00 38.39 C ATOM 411 OG SER A 54 21.914 14.391 56.173 1.00 39.43 O ATOM 0 H SER A 54 22.842 10.740 54.627 1.00 33.44 H new ATOM 0 HA SER A 54 24.063 12.799 55.855 1.00 37.28 H new ATOM 0 HB2 SER A 54 22.548 13.867 54.386 1.00 38.39 H new ATOM 0 HB3 SER A 54 21.376 12.982 54.910 1.00 38.39 H new ATOM 0 HG SER A 54 21.129 14.674 56.075 1.00 39.43 H new ATOM 412 N VAL A 55 23.141 12.332 58.087 1.00 42.22 N ATOM 413 CA VAL A 55 22.713 11.852 59.397 1.00 44.45 C ATOM 414 C VAL A 55 21.836 12.939 60.023 1.00 48.03 C ATOM 415 O VAL A 55 21.499 12.886 61.208 1.00 48.55 O ATOM 416 CB VAL A 55 23.920 11.573 60.333 1.00 44.22 C ATOM 417 CG1 VAL A 55 24.785 10.446 59.760 1.00 42.28 C ATOM 418 CG2 VAL A 55 24.741 12.838 60.513 1.00 41.44 C ATOM 0 H VAL A 55 23.679 13.003 58.111 1.00 42.22 H new ATOM 0 HA VAL A 55 22.230 11.018 59.286 1.00 44.45 H new ATOM 0 HB VAL A 55 23.589 11.293 61.201 1.00 44.22 H new ATOM 0 HG11 VAL A 55 25.535 10.281 60.352 1.00 42.28 H new ATOM 0 HG12 VAL A 55 24.253 9.639 59.679 1.00 42.28 H new ATOM 0 HG13 VAL A 55 25.115 10.704 58.885 1.00 42.28 H new ATOM 0 HG21 VAL A 55 25.493 12.656 61.099 1.00 41.44 H new ATOM 0 HG22 VAL A 55 25.069 13.137 59.650 1.00 41.44 H new ATOM 0 HG23 VAL A 55 24.187 13.531 60.905 1.00 41.44 H new ATOM 419 N ARG A 56 21.476 13.930 59.212 1.00 49.29 N ATOM 420 CA ARG A 56 20.641 15.030 59.674 1.00 51.77 C ATOM 421 C ARG A 56 19.164 14.686 59.533 1.00 52.64 C ATOM 422 O ARG A 56 18.811 13.621 59.020 1.00 52.24 O ATOM 423 CB ARG A 56 20.961 16.300 58.887 1.00 52.66 C ATOM 424 CG ARG A 56 22.391 16.772 59.057 1.00 54.16 C ATOM 425 CD ARG A 56 22.610 18.122 58.413 1.00 57.35 C ATOM 426 NE ARG A 56 23.989 18.576 58.561 1.00 60.44 N ATOM 427 CZ ARG A 56 24.472 19.685 58.010 1.00 62.42 C ATOM 428 NH1 ARG A 56 23.683 20.458 57.271 1.00 63.17 N ATOM 429 NH2 ARG A 56 25.743 20.021 58.193 1.00 62.18 N ATOM 0 H ARG A 56 21.708 13.982 58.385 1.00 49.29 H new ATOM 0 HA ARG A 56 20.831 15.182 60.613 1.00 51.77 H new ATOM 0 HB2 ARG A 56 20.790 16.140 57.946 1.00 52.66 H new ATOM 0 HB3 ARG A 56 20.359 17.007 59.168 1.00 52.66 H new ATOM 0 HG2 ARG A 56 22.605 16.824 60.002 1.00 54.16 H new ATOM 0 HG3 ARG A 56 22.996 16.123 58.664 1.00 54.16 H new ATOM 0 HD2 ARG A 56 22.386 18.071 57.471 1.00 57.35 H new ATOM 0 HD3 ARG A 56 22.011 18.772 58.812 1.00 57.35 H new ATOM 0 HE ARG A 56 24.523 18.096 59.034 1.00 60.44 H new ATOM 0 HH11 ARG A 56 22.860 20.241 57.149 1.00 63.17 H new ATOM 0 HH12 ARG A 56 23.996 21.176 56.915 1.00 63.17 H new ATOM 0 HH21 ARG A 56 26.256 19.521 58.669 1.00 62.18 H new ATOM 0 HH22 ARG A 56 26.054 20.739 57.836 1.00 62.18 H new ATOM 430 N SER A 57 18.301 15.587 59.992 1.00 53.64 N ATOM 431 CA SER A 57 16.862 15.359 59.918 1.00 54.73 C ATOM 432 C SER A 57 16.381 15.265 58.479 1.00 54.10 C ATOM 433 O SER A 57 16.985 15.831 57.573 1.00 53.12 O ATOM 434 CB SER A 57 16.101 16.476 60.641 1.00 55.51 C ATOM 435 OG SER A 57 16.385 17.745 60.080 1.00 56.80 O ATOM 0 H SER A 57 18.528 16.336 60.349 1.00 53.64 H new ATOM 0 HA SER A 57 16.683 14.512 60.355 1.00 54.73 H new ATOM 0 HB2 SER A 57 15.148 16.305 60.590 1.00 55.51 H new ATOM 0 HB3 SER A 57 16.340 16.476 61.581 1.00 55.51 H new ATOM 0 HG SER A 57 15.680 18.201 60.047 1.00 56.80 H new ATOM 436 N GLU A 58 15.288 14.541 58.282 1.00 55.45 N ATOM 437 CA GLU A 58 14.704 14.364 56.962 1.00 57.44 C ATOM 438 C GLU A 58 14.426 15.721 56.314 1.00 56.98 C ATOM 439 O GLU A 58 14.571 15.883 55.100 1.00 56.04 O ATOM 440 CB GLU A 58 13.410 13.555 57.084 1.00 60.58 C ATOM 441 CG GLU A 58 12.860 13.016 55.773 1.00 67.20 C ATOM 442 CD GLU A 58 12.438 14.112 54.813 1.00 71.44 C ATOM 443 OE1 GLU A 58 11.580 14.940 55.191 1.00 74.61 O ATOM 444 OE2 GLU A 58 12.965 14.146 53.679 1.00 74.12 O ATOM 0 H GLU A 58 14.863 14.138 58.912 1.00 55.45 H new ATOM 0 HA GLU A 58 15.330 13.883 56.398 1.00 57.44 H new ATOM 0 HB2 GLU A 58 13.567 12.809 57.684 1.00 60.58 H new ATOM 0 HB3 GLU A 58 12.733 14.114 57.497 1.00 60.58 H new ATOM 0 HG2 GLU A 58 13.534 12.463 55.348 1.00 67.20 H new ATOM 0 HG3 GLU A 58 12.099 12.444 55.958 1.00 67.20 H new ATOM 445 N GLN A 59 14.037 16.698 57.128 1.00 56.43 N ATOM 446 CA GLN A 59 13.742 18.036 56.626 1.00 56.27 C ATOM 447 C GLN A 59 15.015 18.794 56.257 1.00 54.42 C ATOM 448 O GLN A 59 15.084 19.434 55.207 1.00 52.50 O ATOM 449 CB GLN A 59 12.960 18.837 57.672 1.00 57.83 C ATOM 450 CG GLN A 59 12.574 20.235 57.211 1.00 61.97 C ATOM 451 CD GLN A 59 11.863 21.040 58.287 1.00 65.11 C ATOM 452 OE1 GLN A 59 11.730 20.458 59.474 1.00 66.01 O flip ATOM 453 NE2 GLN A 59 11.440 22.173 58.053 1.00 67.34 N flip ATOM 0 H GLN A 59 13.938 16.606 57.977 1.00 56.43 H new ATOM 0 HA GLN A 59 13.206 17.932 55.825 1.00 56.27 H new ATOM 0 HB2 GLN A 59 12.155 18.349 57.906 1.00 57.83 H new ATOM 0 HB3 GLN A 59 13.494 18.907 58.479 1.00 57.83 H new ATOM 0 HG2 GLN A 59 13.372 20.710 56.933 1.00 61.97 H new ATOM 0 HG3 GLN A 59 11.999 20.166 56.433 1.00 61.97 H new ATOM 0 HE21 GLN A 59 11.544 22.518 57.272 1.00 67.34 H new ATOM 0 HE22 GLN A 59 11.041 22.619 58.670 1.00 67.34 H new ATOM 454 N GLU A 60 16.016 18.726 57.129 1.00 52.94 N ATOM 455 CA GLU A 60 17.283 19.410 56.894 1.00 52.81 C ATOM 456 C GLU A 60 17.973 18.918 55.626 1.00 50.94 C ATOM 457 O GLU A 60 18.644 19.684 54.934 1.00 48.21 O ATOM 458 CB GLU A 60 18.213 19.214 58.094 1.00 55.65 C ATOM 459 CG GLU A 60 17.851 20.067 59.306 1.00 60.08 C ATOM 460 CD GLU A 60 18.722 19.778 60.517 1.00 61.63 C ATOM 461 OE1 GLU A 60 18.767 20.629 61.430 1.00 63.35 O ATOM 462 OE2 GLU A 60 19.351 18.698 60.563 1.00 64.00 O ATOM 0 H GLU A 60 15.981 18.286 57.867 1.00 52.94 H new ATOM 0 HA GLU A 60 17.087 20.353 56.778 1.00 52.81 H new ATOM 0 HB2 GLU A 60 18.200 18.279 58.352 1.00 55.65 H new ATOM 0 HB3 GLU A 60 19.122 19.421 57.824 1.00 55.65 H new ATOM 0 HG2 GLU A 60 17.933 21.005 59.071 1.00 60.08 H new ATOM 0 HG3 GLU A 60 16.922 19.913 59.538 1.00 60.08 H new ATOM 463 N THR A 61 17.806 17.634 55.331 1.00 49.84 N ATOM 464 CA THR A 61 18.419 17.041 54.153 1.00 50.72 C ATOM 465 C THR A 61 17.703 17.504 52.890 1.00 50.73 C ATOM 466 O THR A 61 18.352 17.896 51.917 1.00 50.70 O ATOM 467 CB THR A 61 18.391 15.504 54.229 1.00 51.28 C ATOM 468 OG1 THR A 61 19.070 15.075 55.418 1.00 51.54 O ATOM 469 CG2 THR A 61 19.079 14.897 53.015 1.00 50.18 C ATOM 0 H THR A 61 17.339 17.088 55.803 1.00 49.84 H new ATOM 0 HA THR A 61 19.344 17.333 54.122 1.00 50.72 H new ATOM 0 HB THR A 61 17.467 15.209 54.247 1.00 51.28 H new ATOM 0 HG1 THR A 61 18.595 15.246 56.089 1.00 51.54 H new ATOM 0 HG21 THR A 61 19.053 13.929 53.078 1.00 50.18 H new ATOM 0 HG22 THR A 61 18.621 15.180 52.208 1.00 50.18 H new ATOM 0 HG23 THR A 61 20.002 15.194 52.984 1.00 50.18 H new ATOM 470 N SER A 62 16.371 17.469 52.912 1.00 49.59 N ATOM 471 CA SER A 62 15.576 17.905 51.766 1.00 48.44 C ATOM 472 C SER A 62 15.899 19.347 51.422 1.00 47.33 C ATOM 473 O SER A 62 15.883 19.732 50.257 1.00 46.91 O ATOM 474 CB SER A 62 14.082 17.785 52.062 1.00 48.57 C ATOM 475 OG SER A 62 13.716 16.438 52.292 1.00 50.09 O ATOM 0 H SER A 62 15.908 17.195 53.583 1.00 49.59 H new ATOM 0 HA SER A 62 15.797 17.332 51.015 1.00 48.44 H new ATOM 0 HB2 SER A 62 13.859 18.321 52.839 1.00 48.57 H new ATOM 0 HB3 SER A 62 13.572 18.139 51.317 1.00 48.57 H new ATOM 0 HG SER A 62 13.921 16.222 53.077 1.00 50.09 H new ATOM 476 N GLN A 63 16.189 20.148 52.441 1.00 47.02 N ATOM 477 CA GLN A 63 16.518 21.548 52.215 1.00 48.42 C ATOM 478 C GLN A 63 17.830 21.626 51.460 1.00 48.51 C ATOM 479 O GLN A 63 17.940 22.313 50.443 1.00 48.76 O ATOM 480 CB GLN A 63 16.642 22.290 53.547 1.00 48.56 C ATOM 481 CG GLN A 63 15.370 22.281 54.369 1.00 50.33 C ATOM 482 CD GLN A 63 15.517 23.031 55.672 1.00 52.05 C ATOM 483 OE1 GLN A 63 16.392 22.727 56.479 1.00 53.36 O ATOM 484 NE2 GLN A 63 14.657 24.017 55.887 1.00 53.15 N ATOM 0 H GLN A 63 16.201 19.902 53.265 1.00 47.02 H new ATOM 0 HA GLN A 63 15.811 21.965 51.697 1.00 48.42 H new ATOM 0 HB2 GLN A 63 17.356 21.889 54.066 1.00 48.56 H new ATOM 0 HB3 GLN A 63 16.899 23.209 53.374 1.00 48.56 H new ATOM 0 HG2 GLN A 63 14.651 22.676 53.851 1.00 50.33 H new ATOM 0 HG3 GLN A 63 15.115 21.364 54.554 1.00 50.33 H new ATOM 0 HE21 GLN A 63 14.058 24.201 55.298 1.00 53.15 H new ATOM 0 HE22 GLN A 63 14.699 24.473 56.615 1.00 53.15 H new ATOM 485 N LEU A 64 18.823 20.904 51.966 1.00 49.21 N ATOM 486 CA LEU A 64 20.139 20.873 51.351 1.00 47.94 C ATOM 487 C LEU A 64 20.030 20.365 49.918 1.00 44.91 C ATOM 488 O LEU A 64 20.652 20.910 49.013 1.00 43.73 O ATOM 489 CB LEU A 64 21.069 19.971 52.165 1.00 51.48 C ATOM 490 CG LEU A 64 22.513 19.848 51.673 1.00 52.42 C ATOM 491 CD1 LEU A 64 23.109 21.234 51.437 1.00 52.46 C ATOM 492 CD2 LEU A 64 23.325 19.078 52.708 1.00 54.17 C ATOM 0 H LEU A 64 18.751 20.420 52.673 1.00 49.21 H new ATOM 0 HA LEU A 64 20.507 21.770 51.336 1.00 47.94 H new ATOM 0 HB2 LEU A 64 21.087 20.300 53.077 1.00 51.48 H new ATOM 0 HB3 LEU A 64 20.682 19.082 52.191 1.00 51.48 H new ATOM 0 HG LEU A 64 22.533 19.367 50.831 1.00 52.42 H new ATOM 0 HD11 LEU A 64 24.023 21.145 51.126 1.00 52.46 H new ATOM 0 HD12 LEU A 64 22.585 21.702 50.769 1.00 52.46 H new ATOM 0 HD13 LEU A 64 23.098 21.737 52.267 1.00 52.46 H new ATOM 0 HD21 LEU A 64 24.242 18.995 52.404 1.00 54.17 H new ATOM 0 HD22 LEU A 64 23.307 19.554 53.553 1.00 54.17 H new ATOM 0 HD23 LEU A 64 22.943 18.194 52.827 1.00 54.17 H new ATOM 493 N VAL A 65 19.240 19.317 49.722 1.00 43.04 N ATOM 494 CA VAL A 65 19.043 18.756 48.398 1.00 45.08 C ATOM 495 C VAL A 65 18.476 19.822 47.467 1.00 47.84 C ATOM 496 O VAL A 65 18.886 19.927 46.308 1.00 47.85 O ATOM 497 CB VAL A 65 18.082 17.553 48.442 1.00 44.83 C ATOM 498 CG1 VAL A 65 17.621 17.193 47.032 1.00 44.38 C ATOM 499 CG2 VAL A 65 18.784 16.360 49.076 1.00 46.38 C ATOM 0 H VAL A 65 18.808 18.916 50.348 1.00 43.04 H new ATOM 0 HA VAL A 65 19.903 18.451 48.068 1.00 45.08 H new ATOM 0 HB VAL A 65 17.306 17.789 48.973 1.00 44.83 H new ATOM 0 HG11 VAL A 65 17.017 16.435 47.072 1.00 44.38 H new ATOM 0 HG12 VAL A 65 17.162 17.951 46.638 1.00 44.38 H new ATOM 0 HG13 VAL A 65 18.391 16.964 46.488 1.00 44.38 H new ATOM 0 HG21 VAL A 65 18.177 15.604 49.103 1.00 46.38 H new ATOM 0 HG22 VAL A 65 19.566 16.128 48.551 1.00 46.38 H new ATOM 0 HG23 VAL A 65 19.057 16.587 49.979 1.00 46.38 H new ATOM 500 N ALA A 66 17.538 20.614 47.987 1.00 49.37 N ATOM 501 CA ALA A 66 16.918 21.681 47.214 1.00 50.83 C ATOM 502 C ALA A 66 17.965 22.700 46.778 1.00 51.13 C ATOM 503 O ALA A 66 17.976 23.128 45.624 1.00 51.30 O ATOM 504 CB ALA A 66 15.829 22.368 48.041 1.00 52.64 C ATOM 0 H ALA A 66 17.247 20.546 48.793 1.00 49.37 H new ATOM 0 HA ALA A 66 16.514 21.293 46.422 1.00 50.83 H new ATOM 0 HB1 ALA A 66 15.423 23.076 47.517 1.00 52.64 H new ATOM 0 HB2 ALA A 66 15.151 21.719 48.287 1.00 52.64 H new ATOM 0 HB3 ALA A 66 16.222 22.745 48.844 1.00 52.64 H new ATOM 505 N ARG A 67 18.845 23.089 47.696 1.00 50.59 N ATOM 506 CA ARG A 67 19.883 24.055 47.363 1.00 51.43 C ATOM 507 C ARG A 67 20.841 23.464 46.336 1.00 52.34 C ATOM 508 O ARG A 67 21.333 24.170 45.460 1.00 52.49 O ATOM 509 CB ARG A 67 20.654 24.477 48.616 1.00 52.27 C ATOM 510 CG ARG A 67 19.868 25.404 49.536 1.00 57.40 C ATOM 511 CD ARG A 67 20.559 26.756 49.712 1.00 58.14 C ATOM 512 NE ARG A 67 21.251 26.861 50.996 1.00 59.88 N ATOM 513 CZ ARG A 67 21.989 27.905 51.367 1.00 60.19 C ATOM 514 NH1 ARG A 67 22.580 27.916 52.556 1.00 60.35 N ATOM 515 NH2 ARG A 67 22.144 28.936 50.547 1.00 61.06 N ATOM 0 H ARG A 67 18.858 22.808 48.509 1.00 50.59 H new ATOM 0 HA ARG A 67 19.458 24.840 46.985 1.00 51.43 H new ATOM 0 HB2 ARG A 67 20.910 23.683 49.111 1.00 52.27 H new ATOM 0 HB3 ARG A 67 21.474 24.920 48.348 1.00 52.27 H new ATOM 0 HG2 ARG A 67 18.979 25.541 49.173 1.00 57.40 H new ATOM 0 HG3 ARG A 67 19.759 24.982 50.403 1.00 57.40 H new ATOM 0 HD2 ARG A 67 21.195 26.888 48.992 1.00 58.14 H new ATOM 0 HD3 ARG A 67 19.901 27.465 49.642 1.00 58.14 H new ATOM 0 HE ARG A 67 21.176 26.205 51.548 1.00 59.88 H new ATOM 0 HH11 ARG A 67 22.487 27.247 53.089 1.00 60.35 H new ATOM 0 HH12 ARG A 67 23.056 28.592 52.793 1.00 60.35 H new ATOM 0 HH21 ARG A 67 21.767 28.931 49.774 1.00 61.06 H new ATOM 0 HH22 ARG A 67 22.621 29.610 50.788 1.00 61.06 H new ATOM 516 N LEU A 68 21.092 22.161 46.440 1.00 52.52 N ATOM 517 CA LEU A 68 21.991 21.482 45.516 1.00 52.09 C ATOM 518 C LEU A 68 21.410 21.453 44.115 1.00 51.66 C ATOM 519 O LEU A 68 22.064 21.867 43.162 1.00 50.01 O ATOM 520 CB LEU A 68 22.270 20.048 45.983 1.00 51.30 C ATOM 521 CG LEU A 68 23.146 19.874 47.227 1.00 50.96 C ATOM 522 CD1 LEU A 68 23.295 18.391 47.537 1.00 51.94 C ATOM 523 CD2 LEU A 68 24.508 20.507 46.996 1.00 49.40 C ATOM 0 H LEU A 68 20.749 21.652 47.042 1.00 52.52 H new ATOM 0 HA LEU A 68 22.824 21.979 45.501 1.00 52.09 H new ATOM 0 HB2 LEU A 68 21.418 19.616 46.153 1.00 51.30 H new ATOM 0 HB3 LEU A 68 22.690 19.570 45.251 1.00 51.30 H new ATOM 0 HG LEU A 68 22.727 20.315 47.982 1.00 50.96 H new ATOM 0 HD11 LEU A 68 23.850 18.279 48.325 1.00 51.94 H new ATOM 0 HD12 LEU A 68 22.420 18.005 47.700 1.00 51.94 H new ATOM 0 HD13 LEU A 68 23.710 17.943 46.784 1.00 51.94 H new ATOM 0 HD21 LEU A 68 25.057 20.393 47.788 1.00 49.40 H new ATOM 0 HD22 LEU A 68 24.940 20.080 46.240 1.00 49.40 H new ATOM 0 HD23 LEU A 68 24.398 21.453 46.813 1.00 49.40 H new ATOM 524 N GLU A 69 20.179 20.965 43.997 1.00 52.78 N ATOM 525 CA GLU A 69 19.510 20.886 42.703 1.00 54.46 C ATOM 526 C GLU A 69 19.319 22.261 42.060 1.00 54.76 C ATOM 527 O GLU A 69 18.874 22.361 40.919 1.00 53.91 O ATOM 528 CB GLU A 69 18.164 20.174 42.847 1.00 54.07 C ATOM 529 CG GLU A 69 18.303 18.723 43.278 1.00 58.02 C ATOM 530 CD GLU A 69 16.989 17.965 43.265 1.00 59.30 C ATOM 531 OE1 GLU A 69 17.009 16.738 43.497 1.00 60.60 O ATOM 532 OE2 GLU A 69 15.938 18.592 43.024 1.00 61.21 O ATOM 0 H GLU A 69 19.712 20.673 44.658 1.00 52.78 H new ATOM 0 HA GLU A 69 20.085 20.373 42.113 1.00 54.46 H new ATOM 0 HB2 GLU A 69 17.621 20.648 43.496 1.00 54.07 H new ATOM 0 HB3 GLU A 69 17.692 20.211 42.000 1.00 54.07 H new ATOM 0 HG2 GLU A 69 18.933 18.277 42.691 1.00 58.02 H new ATOM 0 HG3 GLU A 69 18.678 18.692 44.172 1.00 58.02 H new ATOM 533 N GLN A 70 19.664 23.312 42.799 1.00 55.73 N ATOM 534 CA GLN A 70 19.563 24.680 42.299 1.00 57.51 C ATOM 535 C GLN A 70 20.898 25.073 41.683 1.00 57.16 C ATOM 536 O GLN A 70 20.949 25.772 40.672 1.00 57.55 O ATOM 537 CB GLN A 70 19.249 25.659 43.436 1.00 59.47 C ATOM 538 CG GLN A 70 17.796 25.726 43.869 1.00 61.55 C ATOM 539 CD GLN A 70 17.595 26.661 45.054 1.00 63.21 C ATOM 540 OE1 GLN A 70 18.139 27.767 45.087 1.00 63.95 O ATOM 541 NE2 GLN A 70 16.805 26.223 46.027 1.00 63.09 N ATOM 0 H GLN A 70 19.963 23.252 43.603 1.00 55.73 H new ATOM 0 HA GLN A 70 18.848 24.719 41.644 1.00 57.51 H new ATOM 0 HB2 GLN A 70 19.787 25.417 44.206 1.00 59.47 H new ATOM 0 HB3 GLN A 70 19.528 26.547 43.162 1.00 59.47 H new ATOM 0 HG2 GLN A 70 17.251 26.027 43.125 1.00 61.55 H new ATOM 0 HG3 GLN A 70 17.488 24.837 44.104 1.00 61.55 H new ATOM 0 HE21 GLN A 70 16.443 25.445 45.969 1.00 63.09 H new ATOM 0 HE22 GLN A 70 16.656 26.717 46.715 1.00 63.09 H new ATOM 542 N LEU A 71 21.977 24.619 42.314 1.00 56.92 N ATOM 543 CA LEU A 71 23.334 24.919 41.865 1.00 56.15 C ATOM 544 C LEU A 71 23.807 24.033 40.721 1.00 54.27 C ATOM 545 O LEU A 71 24.682 24.422 39.949 1.00 54.21 O ATOM 546 CB LEU A 71 24.307 24.775 43.033 1.00 57.51 C ATOM 547 CG LEU A 71 24.180 25.785 44.171 1.00 58.85 C ATOM 548 CD1 LEU A 71 24.970 25.299 45.382 1.00 57.36 C ATOM 549 CD2 LEU A 71 24.682 27.140 43.695 1.00 57.93 C ATOM 0 H LEU A 71 21.943 24.126 43.018 1.00 56.92 H new ATOM 0 HA LEU A 71 23.315 25.830 41.533 1.00 56.15 H new ATOM 0 HB2 LEU A 71 24.200 23.886 43.406 1.00 57.51 H new ATOM 0 HB3 LEU A 71 25.210 24.829 42.682 1.00 57.51 H new ATOM 0 HG LEU A 71 23.251 25.874 44.435 1.00 58.85 H new ATOM 0 HD11 LEU A 71 24.887 25.943 46.103 1.00 57.36 H new ATOM 0 HD12 LEU A 71 24.621 24.442 45.673 1.00 57.36 H new ATOM 0 HD13 LEU A 71 25.905 25.203 45.141 1.00 57.36 H new ATOM 0 HD21 LEU A 71 24.603 27.786 44.415 1.00 57.93 H new ATOM 0 HD22 LEU A 71 25.612 27.065 43.428 1.00 57.93 H new ATOM 0 HD23 LEU A 71 24.152 27.434 42.938 1.00 57.93 H new ATOM 550 N PHE A 72 23.229 22.843 40.615 1.00 51.93 N ATOM 551 CA PHE A 72 23.621 21.900 39.576 1.00 51.42 C ATOM 552 C PHE A 72 22.411 21.212 38.976 1.00 50.13 C ATOM 553 O PHE A 72 21.441 20.925 39.675 1.00 49.10 O ATOM 554 CB PHE A 72 24.558 20.835 40.158 1.00 50.20 C ATOM 555 CG PHE A 72 25.814 21.392 40.752 1.00 51.29 C ATOM 556 CD1 PHE A 72 26.825 21.887 39.936 1.00 52.36 C ATOM 557 CD2 PHE A 72 25.989 21.428 42.131 1.00 52.27 C ATOM 558 CE1 PHE A 72 27.995 22.410 40.485 1.00 53.09 C ATOM 559 CE2 PHE A 72 27.156 21.951 42.690 1.00 52.53 C ATOM 560 CZ PHE A 72 28.160 22.442 41.865 1.00 52.34 C ATOM 0 H PHE A 72 22.606 22.561 41.136 1.00 51.93 H new ATOM 0 HA PHE A 72 24.076 22.400 38.881 1.00 51.42 H new ATOM 0 HB2 PHE A 72 24.082 20.336 40.840 1.00 50.20 H new ATOM 0 HB3 PHE A 72 24.793 20.206 39.458 1.00 50.20 H new ATOM 0 HD1 PHE A 72 26.719 21.869 39.012 1.00 52.36 H new ATOM 0 HD2 PHE A 72 25.320 21.100 42.688 1.00 52.27 H new ATOM 0 HE1 PHE A 72 28.664 22.737 39.929 1.00 53.09 H new ATOM 0 HE2 PHE A 72 27.261 21.971 43.614 1.00 52.53 H new ATOM 0 HZ PHE A 72 28.939 22.791 42.234 1.00 52.34 H new ATOM 561 N PRO A 73 22.456 20.931 37.666 1.00 49.61 N ATOM 562 CA PRO A 73 21.349 20.266 36.977 1.00 49.85 C ATOM 563 C PRO A 73 21.368 18.777 37.287 1.00 50.32 C ATOM 564 O PRO A 73 21.802 17.965 36.470 1.00 51.87 O ATOM 565 CB PRO A 73 21.637 20.561 35.509 1.00 49.67 C ATOM 566 CG PRO A 73 23.137 20.543 35.467 1.00 49.23 C ATOM 567 CD PRO A 73 23.514 21.320 36.714 1.00 49.88 C ATOM 0 HA PRO A 73 20.467 20.571 37.242 1.00 49.85 H new ATOM 0 HB2 PRO A 73 21.251 19.892 34.923 1.00 49.67 H new ATOM 0 HB3 PRO A 73 21.278 21.419 35.235 1.00 49.67 H new ATOM 0 HG2 PRO A 73 23.487 19.639 35.486 1.00 49.23 H new ATOM 0 HG3 PRO A 73 23.480 20.963 34.663 1.00 49.23 H new ATOM 0 HD2 PRO A 73 24.396 21.079 37.037 1.00 49.88 H new ATOM 0 HD3 PRO A 73 23.522 22.277 36.554 1.00 49.88 H new ATOM 568 N VAL A 74 20.893 18.420 38.472 1.00 50.42 N ATOM 569 CA VAL A 74 20.886 17.025 38.880 1.00 51.81 C ATOM 570 C VAL A 74 19.661 16.664 39.702 1.00 52.41 C ATOM 571 O VAL A 74 18.951 17.534 40.202 1.00 53.81 O ATOM 572 CB VAL A 74 22.127 16.698 39.750 1.00 51.81 C ATOM 573 CG1 VAL A 74 23.408 17.070 39.015 1.00 50.15 C ATOM 574 CG2 VAL A 74 22.040 17.458 41.068 1.00 51.89 C ATOM 0 H VAL A 74 20.572 18.968 39.052 1.00 50.42 H new ATOM 0 HA VAL A 74 20.887 16.513 38.056 1.00 51.81 H new ATOM 0 HB VAL A 74 22.143 15.745 39.929 1.00 51.81 H new ATOM 0 HG11 VAL A 74 24.174 16.859 39.572 1.00 50.15 H new ATOM 0 HG12 VAL A 74 23.463 16.568 38.187 1.00 50.15 H new ATOM 0 HG13 VAL A 74 23.404 18.020 38.817 1.00 50.15 H new ATOM 0 HG21 VAL A 74 22.817 17.253 41.612 1.00 51.89 H new ATOM 0 HG22 VAL A 74 22.012 18.411 40.891 1.00 51.89 H new ATOM 0 HG23 VAL A 74 21.236 17.194 41.541 1.00 51.89 H new ATOM 575 N SER A 75 19.430 15.365 39.833 1.00 52.56 N ATOM 576 CA SER A 75 18.341 14.844 40.639 1.00 52.17 C ATOM 577 C SER A 75 19.054 14.002 41.700 1.00 52.24 C ATOM 578 O SER A 75 19.284 12.806 41.517 1.00 52.84 O ATOM 579 CB SER A 75 17.412 13.971 39.801 1.00 52.91 C ATOM 580 OG SER A 75 16.325 13.509 40.585 1.00 55.09 O ATOM 0 H SER A 75 19.906 14.758 39.453 1.00 52.56 H new ATOM 0 HA SER A 75 17.785 15.544 41.016 1.00 52.17 H new ATOM 0 HB2 SER A 75 17.079 14.477 39.043 1.00 52.91 H new ATOM 0 HB3 SER A 75 17.904 13.216 39.443 1.00 52.91 H new ATOM 0 HG SER A 75 15.821 13.031 40.112 1.00 55.09 H new ATOM 581 N ALA A 76 19.410 14.656 42.800 1.00 51.12 N ATOM 582 CA ALA A 76 20.134 14.041 43.908 1.00 49.33 C ATOM 583 C ALA A 76 19.598 12.723 44.455 1.00 48.49 C ATOM 584 O ALA A 76 18.413 12.593 44.755 1.00 49.64 O ATOM 585 CB ALA A 76 20.258 15.048 45.047 1.00 48.49 C ATOM 0 H ALA A 76 19.234 15.488 42.926 1.00 51.12 H new ATOM 0 HA ALA A 76 20.990 13.799 43.521 1.00 49.33 H new ATOM 0 HB1 ALA A 76 20.739 14.643 45.786 1.00 48.49 H new ATOM 0 HB2 ALA A 76 20.741 15.830 44.737 1.00 48.49 H new ATOM 0 HB3 ALA A 76 19.373 15.312 45.344 1.00 48.49 H new ATOM 586 N LEU A 77 20.491 11.745 44.584 1.00 47.11 N ATOM 587 CA LEU A 77 20.136 10.449 45.144 1.00 44.60 C ATOM 588 C LEU A 77 20.516 10.538 46.616 1.00 42.96 C ATOM 589 O LEU A 77 21.545 11.114 46.954 1.00 40.52 O ATOM 590 CB LEU A 77 20.923 9.326 44.466 1.00 46.15 C ATOM 591 CG LEU A 77 20.604 9.049 42.994 1.00 47.90 C ATOM 592 CD1 LEU A 77 21.489 7.923 42.482 1.00 46.63 C ATOM 593 CD2 LEU A 77 19.130 8.678 42.849 1.00 46.97 C ATOM 0 H LEU A 77 21.316 11.816 44.350 1.00 47.11 H new ATOM 0 HA LEU A 77 19.196 10.249 45.015 1.00 44.60 H new ATOM 0 HB2 LEU A 77 21.868 9.534 44.536 1.00 46.15 H new ATOM 0 HB3 LEU A 77 20.775 8.508 44.966 1.00 46.15 H new ATOM 0 HG LEU A 77 20.778 9.845 42.468 1.00 47.90 H new ATOM 0 HD11 LEU A 77 21.285 7.749 41.550 1.00 46.63 H new ATOM 0 HD12 LEU A 77 22.421 8.179 42.567 1.00 46.63 H new ATOM 0 HD13 LEU A 77 21.326 7.121 43.003 1.00 46.63 H new ATOM 0 HD21 LEU A 77 18.930 8.503 41.916 1.00 46.97 H new ATOM 0 HD22 LEU A 77 18.943 7.884 43.374 1.00 46.97 H new ATOM 0 HD23 LEU A 77 18.579 9.411 43.165 1.00 46.97 H new ATOM 594 N VAL A 78 19.678 9.987 47.486 1.00 42.43 N ATOM 595 CA VAL A 78 19.928 10.035 48.921 1.00 41.51 C ATOM 596 C VAL A 78 19.984 8.633 49.492 1.00 41.19 C ATOM 597 O VAL A 78 19.037 7.865 49.349 1.00 42.03 O ATOM 598 CB VAL A 78 18.814 10.828 49.645 1.00 42.23 C ATOM 599 CG1 VAL A 78 19.051 10.824 51.148 1.00 42.72 C ATOM 600 CG2 VAL A 78 18.774 12.248 49.122 1.00 41.21 C ATOM 0 H VAL A 78 18.955 9.578 47.264 1.00 42.43 H new ATOM 0 HA VAL A 78 20.779 10.479 49.060 1.00 41.51 H new ATOM 0 HB VAL A 78 17.960 10.403 49.470 1.00 42.23 H new ATOM 0 HG11 VAL A 78 18.346 11.324 51.588 1.00 42.72 H new ATOM 0 HG12 VAL A 78 19.050 9.910 51.473 1.00 42.72 H new ATOM 0 HG13 VAL A 78 19.908 11.235 51.342 1.00 42.72 H new ATOM 0 HG21 VAL A 78 18.075 12.742 49.578 1.00 41.21 H new ATOM 0 HG22 VAL A 78 19.629 12.677 49.283 1.00 41.21 H new ATOM 0 HG23 VAL A 78 18.593 12.237 48.169 1.00 41.21 H new ATOM 601 N ALA A 79 21.097 8.299 50.136 1.00 41.38 N ATOM 602 CA ALA A 79 21.259 6.973 50.726 1.00 40.78 C ATOM 603 C ALA A 79 20.287 6.791 51.887 1.00 41.81 C ATOM 604 O ALA A 79 19.995 7.743 52.616 1.00 39.96 O ATOM 605 CB ALA A 79 22.685 6.789 51.208 1.00 41.00 C ATOM 0 H ALA A 79 21.770 8.824 50.243 1.00 41.38 H new ATOM 0 HA ALA A 79 21.067 6.305 50.050 1.00 40.78 H new ATOM 0 HB1 ALA A 79 22.784 5.906 51.598 1.00 41.00 H new ATOM 0 HB2 ALA A 79 23.294 6.881 50.459 1.00 41.00 H new ATOM 0 HB3 ALA A 79 22.890 7.462 51.876 1.00 41.00 H new ATOM 606 N SER A 80 19.794 5.567 52.060 1.00 42.32 N ATOM 607 CA SER A 80 18.852 5.277 53.136 1.00 44.16 C ATOM 608 C SER A 80 19.200 3.999 53.906 1.00 43.42 C ATOM 609 O SER A 80 20.004 3.182 53.448 1.00 43.62 O ATOM 610 CB SER A 80 17.439 5.157 52.564 1.00 44.82 C ATOM 611 OG SER A 80 17.351 4.044 51.691 1.00 47.83 O ATOM 0 H SER A 80 19.992 4.892 51.566 1.00 42.32 H new ATOM 0 HA SER A 80 18.905 6.014 53.765 1.00 44.16 H new ATOM 0 HB2 SER A 80 16.799 5.060 53.286 1.00 44.82 H new ATOM 0 HB3 SER A 80 17.207 5.969 52.086 1.00 44.82 H new ATOM 0 HG SER A 80 16.571 3.989 51.385 1.00 47.83 H new ATOM 612 N SER A 81 18.581 3.832 55.072 1.00 41.83 N ATOM 613 CA SER A 81 18.810 2.665 55.922 1.00 40.84 C ATOM 614 C SER A 81 18.438 1.355 55.242 1.00 41.10 C ATOM 615 O SER A 81 17.567 1.316 54.374 1.00 39.66 O ATOM 616 CB SER A 81 18.007 2.784 57.221 1.00 41.53 C ATOM 617 OG SER A 81 18.429 3.891 57.996 1.00 43.65 O ATOM 0 H SER A 81 18.015 4.394 55.394 1.00 41.83 H new ATOM 0 HA SER A 81 19.762 2.649 56.107 1.00 40.84 H new ATOM 0 HB2 SER A 81 17.064 2.875 57.012 1.00 41.53 H new ATOM 0 HB3 SER A 81 18.105 1.970 57.739 1.00 41.53 H new ATOM 0 HG SER A 81 19.041 3.650 58.518 1.00 43.65 H new ATOM 618 N GLY A 82 19.098 0.277 55.656 1.00 41.79 N ATOM 619 CA GLY A 82 18.820 -1.026 55.084 1.00 40.93 C ATOM 620 C GLY A 82 19.238 -2.157 56.005 1.00 41.37 C ATOM 621 O GLY A 82 20.132 -1.990 56.832 1.00 39.85 O ATOM 0 H GLY A 82 19.706 0.283 56.264 1.00 41.79 H new ATOM 0 HA2 GLY A 82 17.871 -1.099 54.895 1.00 40.93 H new ATOM 0 HA3 GLY A 82 19.285 -1.112 54.237 1.00 40.93 H new ATOM 622 N LYS A 83 18.578 -3.303 55.876 1.00 40.79 N ATOM 623 CA LYS A 83 18.900 -4.466 56.687 1.00 42.67 C ATOM 624 C LYS A 83 20.096 -5.156 56.056 1.00 42.45 C ATOM 625 O LYS A 83 20.778 -5.956 56.692 1.00 41.56 O ATOM 626 CB LYS A 83 17.720 -5.441 56.740 1.00 44.37 C ATOM 627 CG LYS A 83 16.534 -4.959 57.558 1.00 47.96 C ATOM 628 CD LYS A 83 15.490 -6.065 57.696 1.00 50.54 C ATOM 629 CE LYS A 83 14.341 -5.655 58.608 1.00 53.01 C ATOM 630 NZ LYS A 83 13.435 -6.805 58.911 1.00 54.13 N ATOM 0 H LYS A 83 17.935 -3.426 55.319 1.00 40.79 H new ATOM 0 HA LYS A 83 19.097 -4.185 57.594 1.00 42.67 H new ATOM 0 HB2 LYS A 83 17.422 -5.618 55.834 1.00 44.37 H new ATOM 0 HB3 LYS A 83 18.029 -6.284 57.107 1.00 44.37 H new ATOM 0 HG2 LYS A 83 16.834 -4.679 58.437 1.00 47.96 H new ATOM 0 HG3 LYS A 83 16.136 -4.183 57.133 1.00 47.96 H new ATOM 0 HD2 LYS A 83 15.141 -6.291 56.819 1.00 50.54 H new ATOM 0 HD3 LYS A 83 15.912 -6.865 58.048 1.00 50.54 H new ATOM 0 HE2 LYS A 83 14.697 -5.297 59.436 1.00 53.01 H new ATOM 0 HE3 LYS A 83 13.832 -4.944 58.188 1.00 53.01 H new ATOM 0 HZ1 LYS A 83 12.777 -6.532 59.444 1.00 54.13 H new ATOM 0 HZ2 LYS A 83 13.091 -7.120 58.153 1.00 54.13 H new ATOM 0 HZ3 LYS A 83 13.897 -7.449 59.316 1.00 54.13 H new ATOM 631 N GLN A 84 20.349 -4.841 54.793 1.00 43.77 N ATOM 632 CA GLN A 84 21.476 -5.438 54.100 1.00 46.45 C ATOM 633 C GLN A 84 21.909 -4.577 52.926 1.00 44.64 C ATOM 634 O GLN A 84 21.108 -3.846 52.346 1.00 43.49 O ATOM 635 CB GLN A 84 21.114 -6.846 53.622 1.00 51.96 C ATOM 636 CG GLN A 84 22.313 -7.698 53.237 1.00 59.17 C ATOM 637 CD GLN A 84 21.965 -9.171 53.102 1.00 65.24 C ATOM 638 OE1 GLN A 84 20.683 -9.498 53.276 1.00 67.07 O flip ATOM 639 NE2 GLN A 84 22.837 -10.009 52.845 1.00 67.18 N flip ATOM 0 H GLN A 84 19.885 -4.289 54.325 1.00 43.77 H new ATOM 0 HA GLN A 84 22.219 -5.497 54.721 1.00 46.45 H new ATOM 0 HB2 GLN A 84 20.620 -7.298 54.324 1.00 51.96 H new ATOM 0 HB3 GLN A 84 20.521 -6.775 52.858 1.00 51.96 H new ATOM 0 HG2 GLN A 84 22.677 -7.377 52.397 1.00 59.17 H new ATOM 0 HG3 GLN A 84 23.008 -7.593 53.906 1.00 59.17 H new ATOM 0 HE21 GLN A 84 23.654 -9.761 52.739 1.00 67.18 H new ATOM 0 HE22 GLN A 84 22.627 -10.840 52.772 1.00 67.18 H new ATOM 640 N LEU A 85 23.189 -4.660 52.590 1.00 43.85 N ATOM 641 CA LEU A 85 23.738 -3.893 51.482 1.00 41.51 C ATOM 642 C LEU A 85 25.061 -4.508 51.055 1.00 41.27 C ATOM 643 O LEU A 85 25.954 -4.705 51.879 1.00 40.57 O ATOM 644 CB LEU A 85 23.954 -2.430 51.895 1.00 39.56 C ATOM 645 CG LEU A 85 24.583 -1.519 50.830 1.00 40.18 C ATOM 646 CD1 LEU A 85 23.696 -1.488 49.588 1.00 38.00 C ATOM 647 CD2 LEU A 85 24.770 -0.119 51.390 1.00 37.06 C ATOM 0 H LEU A 85 23.761 -5.159 52.995 1.00 43.85 H new ATOM 0 HA LEU A 85 23.112 -3.914 50.741 1.00 41.51 H new ATOM 0 HB2 LEU A 85 23.097 -2.055 52.152 1.00 39.56 H new ATOM 0 HB3 LEU A 85 24.519 -2.414 52.684 1.00 39.56 H new ATOM 0 HG LEU A 85 25.453 -1.869 50.581 1.00 40.18 H new ATOM 0 HD11 LEU A 85 24.097 -0.912 48.918 1.00 38.00 H new ATOM 0 HD12 LEU A 85 23.608 -2.385 49.231 1.00 38.00 H new ATOM 0 HD13 LEU A 85 22.819 -1.147 49.825 1.00 38.00 H new ATOM 0 HD21 LEU A 85 25.167 0.450 50.713 1.00 37.06 H new ATOM 0 HD22 LEU A 85 23.909 0.243 51.651 1.00 37.06 H new ATOM 0 HD23 LEU A 85 25.353 -0.155 52.164 1.00 37.06 H new ATOM 648 N ALA A 86 25.169 -4.820 49.767 1.00 40.33 N ATOM 649 CA ALA A 86 26.378 -5.407 49.195 1.00 40.27 C ATOM 650 C ALA A 86 26.904 -6.637 49.934 1.00 40.79 C ATOM 651 O ALA A 86 28.111 -6.823 50.056 1.00 40.96 O ATOM 652 CB ALA A 86 27.476 -4.343 49.108 1.00 39.46 C ATOM 0 H ALA A 86 24.538 -4.696 49.196 1.00 40.33 H new ATOM 0 HA ALA A 86 26.126 -5.722 48.313 1.00 40.27 H new ATOM 0 HB1 ALA A 86 28.278 -4.735 48.728 1.00 39.46 H new ATOM 0 HB2 ALA A 86 27.175 -3.613 48.545 1.00 39.46 H new ATOM 0 HB3 ALA A 86 27.671 -4.006 49.996 1.00 39.46 H new ATOM 653 N GLY A 87 26.001 -7.478 50.423 1.00 41.36 N ATOM 654 CA GLY A 87 26.424 -8.679 51.118 1.00 41.80 C ATOM 655 C GLY A 87 26.779 -8.473 52.578 1.00 42.87 C ATOM 656 O GLY A 87 27.396 -9.340 53.198 1.00 42.49 O ATOM 0 H GLY A 87 25.150 -7.372 50.363 1.00 41.36 H new ATOM 0 HA2 GLY A 87 25.715 -9.339 51.060 1.00 41.80 H new ATOM 0 HA3 GLY A 87 27.194 -9.049 50.659 1.00 41.80 H new ATOM 657 N VAL A 88 26.384 -7.328 53.127 1.00 42.30 N ATOM 658 CA VAL A 88 26.655 -7.002 54.523 1.00 41.26 C ATOM 659 C VAL A 88 25.341 -6.884 55.284 1.00 40.69 C ATOM 660 O VAL A 88 24.412 -6.219 54.828 1.00 40.59 O ATOM 661 CB VAL A 88 27.428 -5.667 54.641 1.00 40.65 C ATOM 662 CG1 VAL A 88 27.723 -5.360 56.100 1.00 40.74 C ATOM 663 CG2 VAL A 88 28.715 -5.747 53.844 1.00 40.50 C ATOM 0 H VAL A 88 25.952 -6.719 52.701 1.00 42.30 H new ATOM 0 HA VAL A 88 27.198 -7.712 54.900 1.00 41.26 H new ATOM 0 HB VAL A 88 26.882 -4.950 54.282 1.00 40.65 H new ATOM 0 HG11 VAL A 88 28.207 -4.522 56.163 1.00 40.74 H new ATOM 0 HG12 VAL A 88 26.889 -5.289 56.591 1.00 40.74 H new ATOM 0 HG13 VAL A 88 28.261 -6.073 56.479 1.00 40.74 H new ATOM 0 HG21 VAL A 88 29.196 -4.908 53.921 1.00 40.50 H new ATOM 0 HG22 VAL A 88 29.265 -6.468 54.189 1.00 40.50 H new ATOM 0 HG23 VAL A 88 28.508 -5.916 52.912 1.00 40.50 H new ATOM 664 N ARG A 89 25.276 -7.515 56.452 1.00 41.97 N ATOM 665 CA ARG A 89 24.064 -7.504 57.268 1.00 43.44 C ATOM 666 C ARG A 89 24.125 -6.528 58.442 1.00 41.40 C ATOM 667 O ARG A 89 24.970 -6.674 59.325 1.00 41.11 O ATOM 668 CB ARG A 89 23.806 -8.904 57.819 1.00 47.87 C ATOM 669 CG ARG A 89 22.344 -9.290 57.906 1.00 55.52 C ATOM 670 CD ARG A 89 22.000 -10.217 56.751 1.00 61.37 C ATOM 671 NE ARG A 89 22.912 -11.358 56.729 1.00 65.16 N ATOM 672 CZ ARG A 89 22.955 -12.271 55.766 1.00 67.23 C ATOM 673 NH1 ARG A 89 23.825 -13.273 55.840 1.00 67.13 N ATOM 674 NH2 ARG A 89 22.132 -12.181 54.729 1.00 68.63 N ATOM 0 H ARG A 89 25.928 -7.959 56.793 1.00 41.97 H new ATOM 0 HA ARG A 89 23.347 -7.211 56.684 1.00 43.44 H new ATOM 0 HB2 ARG A 89 24.265 -9.549 57.258 1.00 47.87 H new ATOM 0 HB3 ARG A 89 24.198 -8.967 58.704 1.00 47.87 H new ATOM 0 HG2 ARG A 89 22.165 -9.730 58.752 1.00 55.52 H new ATOM 0 HG3 ARG A 89 21.787 -8.497 57.875 1.00 55.52 H new ATOM 0 HD2 ARG A 89 21.085 -10.528 56.839 1.00 61.37 H new ATOM 0 HD3 ARG A 89 22.056 -9.734 55.912 1.00 61.37 H new ATOM 0 HE ARG A 89 23.460 -11.444 57.386 1.00 65.16 H new ATOM 0 HH11 ARG A 89 24.360 -13.330 56.511 1.00 67.13 H new ATOM 0 HH12 ARG A 89 23.853 -13.865 55.217 1.00 67.13 H new ATOM 0 HH21 ARG A 89 21.571 -11.531 54.681 1.00 68.63 H new ATOM 0 HH22 ARG A 89 22.160 -12.772 54.105 1.00 68.63 H new ATOM 675 N ASN A 90 23.209 -5.558 58.455 1.00 39.11 N ATOM 676 CA ASN A 90 23.120 -4.555 59.517 1.00 38.14 C ATOM 677 C ASN A 90 22.967 -5.273 60.861 1.00 38.80 C ATOM 678 O ASN A 90 22.098 -6.133 61.015 1.00 40.36 O ATOM 679 CB ASN A 90 21.907 -3.650 59.269 1.00 38.61 C ATOM 680 CG ASN A 90 21.863 -2.451 60.199 1.00 37.56 C ATOM 681 OD1 ASN A 90 22.198 -2.551 61.379 1.00 38.99 O ATOM 682 ND2 ASN A 90 21.430 -1.314 59.674 1.00 37.30 N ATOM 0 H ASN A 90 22.615 -5.463 57.840 1.00 39.11 H new ATOM 0 HA ASN A 90 23.922 -4.010 59.526 1.00 38.14 H new ATOM 0 HB2 ASN A 90 21.923 -3.340 58.350 1.00 38.61 H new ATOM 0 HB3 ASN A 90 21.095 -4.169 59.379 1.00 38.61 H new ATOM 0 HD21 ASN A 90 21.375 -0.608 60.163 1.00 37.30 H new ATOM 0 HD22 ASN A 90 21.204 -1.282 58.845 1.00 37.30 H new ATOM 683 N GLY A 91 23.798 -4.906 61.834 1.00 37.45 N ATOM 684 CA GLY A 91 23.763 -5.554 63.135 1.00 35.25 C ATOM 685 C GLY A 91 22.923 -4.940 64.243 1.00 35.99 C ATOM 686 O GLY A 91 22.836 -5.507 65.333 1.00 35.63 O ATOM 0 H GLY A 91 24.388 -4.284 61.758 1.00 37.45 H new ATOM 0 HA2 GLY A 91 23.451 -6.463 63.001 1.00 35.25 H new ATOM 0 HA3 GLY A 91 24.676 -5.612 63.458 1.00 35.25 H new ATOM 687 N TYR A 92 22.301 -3.795 63.991 1.00 35.10 N ATOM 688 CA TYR A 92 21.476 -3.165 65.014 1.00 36.61 C ATOM 689 C TYR A 92 20.138 -3.872 65.239 1.00 38.93 C ATOM 690 O TYR A 92 19.565 -4.456 64.316 1.00 36.68 O ATOM 691 CB TYR A 92 21.204 -1.697 64.662 1.00 35.49 C ATOM 692 CG TYR A 92 22.135 -0.719 65.349 1.00 36.48 C ATOM 693 CD1 TYR A 92 21.702 0.565 65.688 1.00 35.85 C ATOM 694 CD2 TYR A 92 23.444 -1.080 65.677 1.00 34.29 C ATOM 695 CE1 TYR A 92 22.547 1.464 66.343 1.00 35.62 C ATOM 696 CE2 TYR A 92 24.298 -0.187 66.329 1.00 34.85 C ATOM 697 CZ TYR A 92 23.843 1.080 66.659 1.00 35.02 C ATOM 698 OH TYR A 92 24.683 1.961 67.310 1.00 36.53 O ATOM 0 H TYR A 92 22.342 -3.371 63.244 1.00 35.10 H new ATOM 0 HA TYR A 92 21.986 -3.231 65.837 1.00 36.61 H new ATOM 0 HB2 TYR A 92 21.282 -1.584 63.702 1.00 35.49 H new ATOM 0 HB3 TYR A 92 20.289 -1.481 64.900 1.00 35.49 H new ATOM 0 HD1 TYR A 92 20.835 0.826 65.474 1.00 35.85 H new ATOM 0 HD2 TYR A 92 23.752 -1.930 65.458 1.00 34.29 H new ATOM 0 HE1 TYR A 92 22.243 2.314 66.566 1.00 35.62 H new ATOM 0 HE2 TYR A 92 25.167 -0.441 66.540 1.00 34.85 H new ATOM 0 HH TYR A 92 25.226 1.531 67.786 1.00 36.53 H new ATOM 699 N LEU A 93 19.653 -3.822 66.477 1.00 41.97 N ATOM 700 CA LEU A 93 18.366 -4.417 66.819 1.00 44.54 C ATOM 701 C LEU A 93 17.339 -3.768 65.895 1.00 44.41 C ATOM 702 O LEU A 93 16.490 -4.443 65.316 1.00 45.72 O ATOM 703 CB LEU A 93 18.026 -4.128 68.282 1.00 47.12 C ATOM 704 CG LEU A 93 18.307 -5.230 69.310 1.00 50.60 C ATOM 705 CD1 LEU A 93 19.714 -5.776 69.155 1.00 51.94 C ATOM 706 CD2 LEU A 93 18.099 -4.662 70.706 1.00 52.08 C ATOM 0 H LEU A 93 20.057 -3.446 67.136 1.00 41.97 H new ATOM 0 HA LEU A 93 18.378 -5.381 66.709 1.00 44.54 H new ATOM 0 HB2 LEU A 93 18.517 -3.336 68.552 1.00 47.12 H new ATOM 0 HB3 LEU A 93 17.083 -3.907 68.331 1.00 47.12 H new ATOM 0 HG LEU A 93 17.695 -5.968 69.164 1.00 50.60 H new ATOM 0 HD11 LEU A 93 19.867 -6.470 69.815 1.00 51.94 H new ATOM 0 HD12 LEU A 93 19.821 -6.147 68.265 1.00 51.94 H new ATOM 0 HD13 LEU A 93 20.355 -5.060 69.285 1.00 51.94 H new ATOM 0 HD21 LEU A 93 18.274 -5.351 71.365 1.00 52.08 H new ATOM 0 HD22 LEU A 93 18.706 -3.919 70.847 1.00 52.08 H new ATOM 0 HD23 LEU A 93 17.184 -4.353 70.797 1.00 52.08 H new ATOM 707 N ASP A 94 17.435 -2.449 65.769 1.00 42.99 N ATOM 708 CA ASP A 94 16.574 -1.674 64.886 1.00 42.23 C ATOM 709 C ASP A 94 17.528 -1.113 63.838 1.00 42.82 C ATOM 710 O ASP A 94 18.215 -0.116 64.082 1.00 42.27 O ATOM 711 CB ASP A 94 15.903 -0.530 65.648 1.00 42.73 C ATOM 712 CG ASP A 94 15.101 0.387 64.738 1.00 43.38 C ATOM 713 OD1 ASP A 94 14.408 1.283 65.266 1.00 43.86 O ATOM 714 OD2 ASP A 94 15.164 0.218 63.498 1.00 43.16 O ATOM 0 H ASP A 94 18.009 -1.974 66.199 1.00 42.99 H new ATOM 0 HA ASP A 94 15.861 -2.209 64.504 1.00 42.23 H new ATOM 0 HB2 ASP A 94 15.317 -0.898 66.328 1.00 42.73 H new ATOM 0 HB3 ASP A 94 16.581 -0.011 66.108 1.00 42.73 H new ATOM 715 N TYR A 95 17.571 -1.758 62.676 1.00 42.82 N ATOM 716 CA TYR A 95 18.475 -1.350 61.608 1.00 45.15 C ATOM 717 C TYR A 95 18.492 0.148 61.295 1.00 45.09 C ATOM 718 O TYR A 95 19.515 0.677 60.872 1.00 45.59 O ATOM 719 CB TYR A 95 18.177 -2.138 60.326 1.00 45.65 C ATOM 720 CG TYR A 95 16.941 -1.683 59.588 1.00 48.55 C ATOM 721 CD1 TYR A 95 15.663 -1.978 60.070 1.00 49.69 C ATOM 722 CD2 TYR A 95 17.049 -0.941 58.413 1.00 49.50 C ATOM 723 CE1 TYR A 95 14.523 -1.542 59.398 1.00 50.82 C ATOM 724 CE2 TYR A 95 15.918 -0.499 57.734 1.00 50.96 C ATOM 725 CZ TYR A 95 14.660 -0.802 58.231 1.00 52.29 C ATOM 726 OH TYR A 95 13.545 -0.355 57.564 1.00 54.06 O ATOM 0 H TYR A 95 17.081 -2.439 62.486 1.00 42.82 H new ATOM 0 HA TYR A 95 19.361 -1.554 61.947 1.00 45.15 H new ATOM 0 HB2 TYR A 95 18.940 -2.067 59.731 1.00 45.65 H new ATOM 0 HB3 TYR A 95 18.079 -3.076 60.551 1.00 45.65 H new ATOM 0 HD1 TYR A 95 15.572 -2.473 60.852 1.00 49.69 H new ATOM 0 HD2 TYR A 95 17.892 -0.738 58.077 1.00 49.50 H new ATOM 0 HE1 TYR A 95 13.678 -1.745 59.728 1.00 50.82 H new ATOM 0 HE2 TYR A 95 16.005 -0.004 56.952 1.00 50.96 H new ATOM 0 HH TYR A 95 13.780 0.076 56.882 1.00 54.06 H new ATOM 727 N GLN A 96 17.371 0.830 61.506 1.00 45.61 N ATOM 728 CA GLN A 96 17.288 2.263 61.228 1.00 46.27 C ATOM 729 C GLN A 96 18.003 3.148 62.247 1.00 45.39 C ATOM 730 O GLN A 96 18.241 4.330 61.991 1.00 43.23 O ATOM 731 CB GLN A 96 15.825 2.690 61.133 1.00 48.60 C ATOM 732 CG GLN A 96 15.101 2.112 59.943 1.00 52.61 C ATOM 733 CD GLN A 96 13.611 2.357 60.005 1.00 56.75 C ATOM 734 OE1 GLN A 96 12.921 1.830 60.879 1.00 60.07 O ATOM 735 NE2 GLN A 96 13.104 3.164 59.082 1.00 57.70 N ATOM 0 H GLN A 96 16.645 0.483 61.810 1.00 45.61 H new ATOM 0 HA GLN A 96 17.748 2.392 60.384 1.00 46.27 H new ATOM 0 HB2 GLN A 96 15.365 2.421 61.943 1.00 48.60 H new ATOM 0 HB3 GLN A 96 15.781 3.658 61.089 1.00 48.60 H new ATOM 0 HG2 GLN A 96 15.457 2.502 59.129 1.00 52.61 H new ATOM 0 HG3 GLN A 96 15.268 1.158 59.897 1.00 52.61 H new ATOM 0 HE21 GLN A 96 13.618 3.514 58.487 1.00 57.70 H new ATOM 0 HE22 GLN A 96 12.262 3.338 59.078 1.00 57.70 H new ATOM 736 N ARG A 97 18.344 2.573 63.397 1.00 45.11 N ATOM 737 CA ARG A 97 19.031 3.306 64.459 1.00 43.66 C ATOM 738 C ARG A 97 20.516 3.513 64.170 1.00 42.24 C ATOM 739 O ARG A 97 21.160 4.373 64.772 1.00 41.06 O ATOM 740 CB ARG A 97 18.873 2.560 65.786 1.00 48.05 C ATOM 741 CG ARG A 97 17.676 2.969 66.636 1.00 51.03 C ATOM 742 CD ARG A 97 16.471 3.328 65.796 1.00 55.52 C ATOM 743 NE ARG A 97 16.205 4.763 65.843 1.00 59.48 N ATOM 744 CZ ARG A 97 15.795 5.408 66.931 1.00 62.04 C ATOM 745 NH1 ARG A 97 15.601 4.743 68.064 1.00 63.24 N ATOM 746 NH2 ARG A 97 15.579 6.718 66.889 1.00 63.86 N ATOM 0 H ARG A 97 18.184 1.749 63.584 1.00 45.11 H new ATOM 0 HA ARG A 97 18.620 4.183 64.509 1.00 43.66 H new ATOM 0 HB2 ARG A 97 18.806 1.611 65.598 1.00 48.05 H new ATOM 0 HB3 ARG A 97 19.680 2.690 66.309 1.00 48.05 H new ATOM 0 HG2 ARG A 97 17.445 2.243 67.236 1.00 51.03 H new ATOM 0 HG3 ARG A 97 17.919 3.727 67.190 1.00 51.03 H new ATOM 0 HD2 ARG A 97 16.620 3.054 64.878 1.00 55.52 H new ATOM 0 HD3 ARG A 97 15.695 2.842 66.115 1.00 55.52 H new ATOM 0 HE ARG A 97 16.321 5.219 65.123 1.00 59.48 H new ATOM 0 HH11 ARG A 97 15.741 3.895 68.094 1.00 63.24 H new ATOM 0 HH12 ARG A 97 15.336 5.160 68.768 1.00 63.24 H new ATOM 0 HH21 ARG A 97 15.704 7.151 66.157 1.00 63.86 H new ATOM 0 HH22 ARG A 97 15.314 7.133 67.594 1.00 63.86 H new ATOM 747 N LEU A 98 21.059 2.719 63.252 1.00 39.77 N ATOM 748 CA LEU A 98 22.472 2.816 62.897 1.00 36.76 C ATOM 749 C LEU A 98 22.754 4.049 62.038 1.00 34.55 C ATOM 750 O LEU A 98 22.172 4.206 60.968 1.00 33.81 O ATOM 751 CB LEU A 98 22.902 1.545 62.152 1.00 37.20 C ATOM 752 CG LEU A 98 24.354 1.416 61.668 1.00 37.30 C ATOM 753 CD1 LEU A 98 25.316 1.425 62.856 1.00 34.01 C ATOM 754 CD2 LEU A 98 24.505 0.125 60.871 1.00 33.36 C ATOM 0 H LEU A 98 20.624 2.115 62.821 1.00 39.77 H new ATOM 0 HA LEU A 98 22.984 2.906 63.716 1.00 36.76 H new ATOM 0 HB2 LEU A 98 22.720 0.790 62.733 1.00 37.20 H new ATOM 0 HB3 LEU A 98 22.326 1.452 61.377 1.00 37.20 H new ATOM 0 HG LEU A 98 24.571 2.172 61.099 1.00 37.30 H new ATOM 0 HD11 LEU A 98 26.228 1.343 62.535 1.00 34.01 H new ATOM 0 HD12 LEU A 98 25.219 2.257 63.345 1.00 34.01 H new ATOM 0 HD13 LEU A 98 25.112 0.680 63.443 1.00 34.01 H new ATOM 0 HD21 LEU A 98 25.421 0.040 60.563 1.00 33.36 H new ATOM 0 HD22 LEU A 98 24.282 -0.632 61.435 1.00 33.36 H new ATOM 0 HD23 LEU A 98 23.908 0.145 60.107 1.00 33.36 H new ATOM 755 N GLY A 99 23.636 4.928 62.513 1.00 33.87 N ATOM 756 CA GLY A 99 23.974 6.114 61.744 1.00 32.31 C ATOM 757 C GLY A 99 24.362 5.695 60.333 1.00 33.83 C ATOM 758 O GLY A 99 25.182 4.795 60.151 1.00 31.62 O ATOM 0 H GLY A 99 24.042 4.855 63.267 1.00 33.87 H new ATOM 0 HA2 GLY A 99 23.219 6.722 61.717 1.00 32.31 H new ATOM 0 HA3 GLY A 99 24.707 6.589 62.166 1.00 32.31 H new ATOM 759 N LEU A 100 23.768 6.336 59.334 1.00 36.95 N ATOM 760 CA LEU A 100 24.041 6.003 57.937 1.00 39.47 C ATOM 761 C LEU A 100 25.492 6.126 57.499 1.00 39.62 C ATOM 762 O LEU A 100 25.935 5.393 56.616 1.00 39.71 O ATOM 763 CB LEU A 100 23.167 6.847 57.006 1.00 40.47 C ATOM 764 CG LEU A 100 21.750 6.312 56.816 1.00 43.03 C ATOM 765 CD1 LEU A 100 21.036 7.132 55.751 1.00 42.74 C ATOM 766 CD2 LEU A 100 21.814 4.843 56.407 1.00 43.40 C ATOM 0 H LEU A 100 23.199 6.972 59.443 1.00 36.95 H new ATOM 0 HA LEU A 100 23.825 5.059 57.872 1.00 39.47 H new ATOM 0 HB2 LEU A 100 23.116 7.749 57.358 1.00 40.47 H new ATOM 0 HB3 LEU A 100 23.598 6.905 56.139 1.00 40.47 H new ATOM 0 HG LEU A 100 21.256 6.384 57.648 1.00 43.03 H new ATOM 0 HD11 LEU A 100 20.136 6.792 55.630 1.00 42.74 H new ATOM 0 HD12 LEU A 100 20.996 8.060 56.030 1.00 42.74 H new ATOM 0 HD13 LEU A 100 21.521 7.067 54.913 1.00 42.74 H new ATOM 0 HD21 LEU A 100 20.914 4.501 56.286 1.00 43.40 H new ATOM 0 HD22 LEU A 100 22.306 4.760 55.575 1.00 43.40 H new ATOM 0 HD23 LEU A 100 22.262 4.333 57.100 1.00 43.40 H new ATOM 767 N ASP A 101 26.220 7.061 58.104 1.00 38.47 N ATOM 768 CA ASP A 101 27.623 7.265 57.779 1.00 39.14 C ATOM 769 C ASP A 101 28.434 6.022 58.172 1.00 36.94 C ATOM 770 O ASP A 101 29.244 5.529 57.382 1.00 36.40 O ATOM 771 CB ASP A 101 28.144 8.520 58.500 1.00 42.64 C ATOM 772 CG ASP A 101 27.960 8.453 60.014 1.00 45.97 C ATOM 773 OD1 ASP A 101 26.974 7.839 60.479 1.00 46.93 O ATOM 774 OD2 ASP A 101 28.797 9.029 60.742 1.00 47.86 O ATOM 0 H ASP A 101 25.915 7.590 58.710 1.00 38.47 H new ATOM 0 HA ASP A 101 27.721 7.400 56.824 1.00 39.14 H new ATOM 0 HB2 ASP A 101 29.086 8.636 58.298 1.00 42.64 H new ATOM 0 HB3 ASP A 101 27.682 9.300 58.157 1.00 42.64 H new ATOM 775 N ARG A 102 28.202 5.524 59.388 1.00 34.57 N ATOM 776 CA ARG A 102 28.873 4.328 59.899 1.00 32.11 C ATOM 777 C ARG A 102 28.529 3.145 59.008 1.00 30.59 C ATOM 778 O ARG A 102 29.388 2.355 58.634 1.00 29.92 O ATOM 779 CB ARG A 102 28.388 3.976 61.316 1.00 31.88 C ATOM 780 CG ARG A 102 28.872 4.849 62.446 1.00 31.95 C ATOM 781 CD ARG A 102 28.111 4.524 63.747 1.00 31.14 C ATOM 782 NE ARG A 102 28.398 3.188 64.281 1.00 31.65 N ATOM 783 CZ ARG A 102 27.707 2.614 65.268 1.00 33.04 C ATOM 784 NH1 ARG A 102 28.026 1.401 65.698 1.00 28.92 N ATOM 785 NH2 ARG A 102 26.683 3.252 65.827 1.00 33.37 N ATOM 0 H ARG A 102 27.646 5.874 59.943 1.00 34.57 H new ATOM 0 HA ARG A 102 29.826 4.509 59.912 1.00 32.11 H new ATOM 0 HB2 ARG A 102 27.418 3.995 61.315 1.00 31.88 H new ATOM 0 HB3 ARG A 102 28.654 3.063 61.507 1.00 31.88 H new ATOM 0 HG2 ARG A 102 29.823 4.715 62.580 1.00 31.95 H new ATOM 0 HG3 ARG A 102 28.746 5.783 62.217 1.00 31.95 H new ATOM 0 HD2 ARG A 102 28.336 5.187 64.418 1.00 31.14 H new ATOM 0 HD3 ARG A 102 27.158 4.600 63.582 1.00 31.14 H new ATOM 0 HE ARG A 102 29.052 2.748 63.937 1.00 31.65 H new ATOM 0 HH11 ARG A 102 28.683 0.977 65.340 1.00 28.92 H new ATOM 0 HH12 ARG A 102 27.576 1.038 66.335 1.00 28.92 H new ATOM 0 HH21 ARG A 102 26.464 4.037 65.553 1.00 33.37 H new ATOM 0 HH22 ARG A 102 26.240 2.879 66.463 1.00 33.37 H new ATOM 786 N TRP A 103 27.246 3.026 58.691 1.00 31.10 N ATOM 787 CA TRP A 103 26.749 1.930 57.872 1.00 30.21 C ATOM 788 C TRP A 103 27.456 1.847 56.527 1.00 28.92 C ATOM 789 O TRP A 103 28.025 0.811 56.182 1.00 28.62 O ATOM 790 CB TRP A 103 25.240 2.094 57.672 1.00 32.50 C ATOM 791 CG TRP A 103 24.601 1.108 56.741 1.00 33.89 C ATOM 792 CD1 TRP A 103 23.799 1.399 55.671 1.00 34.08 C ATOM 793 CD2 TRP A 103 24.647 -0.320 56.830 1.00 35.45 C ATOM 794 NE1 TRP A 103 23.339 0.243 55.094 1.00 34.67 N ATOM 795 CE2 TRP A 103 23.843 -0.829 55.783 1.00 35.97 C ATOM 796 CE3 TRP A 103 25.285 -1.223 57.693 1.00 36.07 C ATOM 797 CZ2 TRP A 103 23.660 -2.203 55.575 1.00 36.61 C ATOM 798 CZ3 TRP A 103 25.103 -2.594 57.487 1.00 35.23 C ATOM 799 CH2 TRP A 103 24.295 -3.068 56.433 1.00 35.40 C ATOM 0 H TRP A 103 26.639 3.579 58.945 1.00 31.10 H new ATOM 0 HA TRP A 103 26.934 1.100 58.338 1.00 30.21 H new ATOM 0 HB2 TRP A 103 24.806 2.027 58.537 1.00 32.50 H new ATOM 0 HB3 TRP A 103 25.069 2.988 57.338 1.00 32.50 H new ATOM 0 HD1 TRP A 103 23.595 2.258 55.377 1.00 34.08 H new ATOM 0 HE1 TRP A 103 22.819 0.198 54.411 1.00 34.67 H new ATOM 0 HE3 TRP A 103 25.819 -0.916 58.389 1.00 36.07 H new ATOM 0 HZ2 TRP A 103 23.128 -2.518 54.881 1.00 36.61 H new ATOM 0 HZ3 TRP A 103 25.521 -3.202 58.053 1.00 35.23 H new ATOM 0 HH2 TRP A 103 24.190 -3.985 56.316 1.00 35.40 H new ATOM 800 N LEU A 104 27.446 2.938 55.773 1.00 28.75 N ATOM 801 CA LEU A 104 28.084 2.916 54.462 1.00 30.55 C ATOM 802 C LEU A 104 29.580 2.623 54.529 1.00 29.87 C ATOM 803 O LEU A 104 30.118 1.941 53.662 1.00 32.04 O ATOM 804 CB LEU A 104 27.847 4.230 53.712 1.00 28.52 C ATOM 805 CG LEU A 104 26.403 4.640 53.392 1.00 33.17 C ATOM 806 CD1 LEU A 104 26.423 5.602 52.204 1.00 27.27 C ATOM 807 CD2 LEU A 104 25.549 3.424 53.052 1.00 29.76 C ATOM 0 H LEU A 104 27.084 3.686 55.994 1.00 28.75 H new ATOM 0 HA LEU A 104 27.668 2.186 53.976 1.00 30.55 H new ATOM 0 HB2 LEU A 104 28.248 4.943 54.233 1.00 28.52 H new ATOM 0 HB3 LEU A 104 28.333 4.183 52.874 1.00 28.52 H new ATOM 0 HG LEU A 104 26.016 5.069 54.171 1.00 33.17 H new ATOM 0 HD11 LEU A 104 25.516 5.870 51.989 1.00 27.27 H new ATOM 0 HD12 LEU A 104 26.947 6.386 52.431 1.00 27.27 H new ATOM 0 HD13 LEU A 104 26.819 5.160 51.436 1.00 27.27 H new ATOM 0 HD21 LEU A 104 24.643 3.709 52.854 1.00 29.76 H new ATOM 0 HD22 LEU A 104 25.922 2.973 52.278 1.00 29.76 H new ATOM 0 HD23 LEU A 104 25.538 2.815 53.807 1.00 29.76 H new ATOM 808 N ALA A 105 30.249 3.116 55.563 1.00 29.34 N ATOM 809 CA ALA A 105 31.678 2.888 55.684 1.00 28.94 C ATOM 810 C ALA A 105 31.998 1.433 56.003 1.00 27.68 C ATOM 811 O ALA A 105 32.887 0.840 55.392 1.00 28.71 O ATOM 812 CB ALA A 105 32.271 3.812 56.752 1.00 27.17 C ATOM 0 H ALA A 105 29.898 3.579 56.197 1.00 29.34 H new ATOM 0 HA ALA A 105 32.081 3.091 54.826 1.00 28.94 H new ATOM 0 HB1 ALA A 105 33.225 3.652 56.825 1.00 27.17 H new ATOM 0 HB2 ALA A 105 32.117 4.736 56.502 1.00 27.17 H new ATOM 0 HB3 ALA A 105 31.847 3.633 57.606 1.00 27.17 H new ATOM 813 N LEU A 106 31.280 0.852 56.959 1.00 28.46 N ATOM 814 CA LEU A 106 31.534 -0.539 57.321 1.00 29.80 C ATOM 815 C LEU A 106 31.166 -1.484 56.165 1.00 30.51 C ATOM 816 O LEU A 106 31.805 -2.520 55.975 1.00 30.90 O ATOM 817 CB LEU A 106 30.772 -0.907 58.601 1.00 27.40 C ATOM 818 CG LEU A 106 29.250 -1.062 58.573 1.00 29.74 C ATOM 819 CD1 LEU A 106 28.888 -2.474 58.129 1.00 26.19 C ATOM 820 CD2 LEU A 106 28.686 -0.809 59.982 1.00 28.30 C ATOM 0 H LEU A 106 30.652 1.237 57.403 1.00 28.46 H new ATOM 0 HA LEU A 106 32.483 -0.642 57.494 1.00 29.80 H new ATOM 0 HB2 LEU A 106 31.140 -1.744 58.924 1.00 27.40 H new ATOM 0 HB3 LEU A 106 30.980 -0.230 59.264 1.00 27.40 H new ATOM 0 HG LEU A 106 28.872 -0.422 57.950 1.00 29.74 H new ATOM 0 HD11 LEU A 106 27.923 -2.571 58.112 1.00 26.19 H new ATOM 0 HD12 LEU A 106 29.245 -2.636 57.242 1.00 26.19 H new ATOM 0 HD13 LEU A 106 29.266 -3.116 58.751 1.00 26.19 H new ATOM 0 HD21 LEU A 106 27.721 -0.907 59.967 1.00 28.30 H new ATOM 0 HD22 LEU A 106 29.066 -1.450 60.603 1.00 28.30 H new ATOM 0 HD23 LEU A 106 28.915 0.090 60.266 1.00 28.30 H new ATOM 821 N VAL A 107 30.148 -1.126 55.387 1.00 30.73 N ATOM 822 CA VAL A 107 29.754 -1.952 54.249 1.00 31.93 C ATOM 823 C VAL A 107 30.854 -1.862 53.189 1.00 34.23 C ATOM 824 O VAL A 107 31.246 -2.870 52.587 1.00 34.15 O ATOM 825 CB VAL A 107 28.419 -1.477 53.635 1.00 34.31 C ATOM 826 CG1 VAL A 107 28.197 -2.156 52.285 1.00 32.67 C ATOM 827 CG2 VAL A 107 27.268 -1.794 54.589 1.00 33.37 C ATOM 0 H VAL A 107 29.676 -0.416 55.499 1.00 30.73 H new ATOM 0 HA VAL A 107 29.632 -2.865 54.554 1.00 31.93 H new ATOM 0 HB VAL A 107 28.453 -0.517 53.497 1.00 34.31 H new ATOM 0 HG11 VAL A 107 27.357 -1.854 51.905 1.00 32.67 H new ATOM 0 HG12 VAL A 107 28.924 -1.928 51.685 1.00 32.67 H new ATOM 0 HG13 VAL A 107 28.168 -3.118 52.407 1.00 32.67 H new ATOM 0 HG21 VAL A 107 26.432 -1.494 54.199 1.00 33.37 H new ATOM 0 HG22 VAL A 107 27.228 -2.751 54.741 1.00 33.37 H new ATOM 0 HG23 VAL A 107 27.412 -1.339 55.433 1.00 33.37 H new ATOM 828 N ALA A 108 31.352 -0.647 52.972 1.00 32.27 N ATOM 829 CA ALA A 108 32.425 -0.428 52.008 1.00 32.20 C ATOM 830 C ALA A 108 33.637 -1.281 52.393 1.00 31.95 C ATOM 831 O ALA A 108 34.225 -1.953 51.550 1.00 32.47 O ATOM 832 CB ALA A 108 32.815 1.045 51.981 1.00 27.82 C ATOM 0 H ALA A 108 31.082 0.064 53.373 1.00 32.27 H new ATOM 0 HA ALA A 108 32.117 -0.684 51.125 1.00 32.20 H new ATOM 0 HB1 ALA A 108 33.528 1.179 51.338 1.00 27.82 H new ATOM 0 HB2 ALA A 108 32.046 1.579 51.727 1.00 27.82 H new ATOM 0 HB3 ALA A 108 33.119 1.316 52.861 1.00 27.82 H new ATOM 833 N ALA A 109 33.998 -1.254 53.674 1.00 31.75 N ATOM 834 CA ALA A 109 35.146 -2.013 54.167 1.00 30.25 C ATOM 835 C ALA A 109 35.026 -3.514 53.896 1.00 30.86 C ATOM 836 O ALA A 109 35.944 -4.128 53.358 1.00 29.35 O ATOM 837 CB ALA A 109 35.334 -1.766 55.656 1.00 26.66 C ATOM 0 H ALA A 109 33.588 -0.799 54.278 1.00 31.75 H new ATOM 0 HA ALA A 109 35.923 -1.699 53.679 1.00 30.25 H new ATOM 0 HB1 ALA A 109 36.097 -2.273 55.974 1.00 26.66 H new ATOM 0 HB2 ALA A 109 35.487 -0.821 55.811 1.00 26.66 H new ATOM 0 HB3 ALA A 109 34.538 -2.047 56.134 1.00 26.66 H new ATOM 838 N HIS A 110 33.903 -4.112 54.270 1.00 31.61 N ATOM 839 CA HIS A 110 33.747 -5.534 54.025 1.00 34.59 C ATOM 840 C HIS A 110 33.694 -5.822 52.526 1.00 34.84 C ATOM 841 O HIS A 110 34.230 -6.831 52.063 1.00 34.63 O ATOM 842 CB HIS A 110 32.494 -6.082 54.707 1.00 35.85 C ATOM 843 CG HIS A 110 32.363 -7.565 54.585 1.00 39.20 C ATOM 844 ND1 HIS A 110 31.717 -8.171 53.529 1.00 39.81 N ATOM 845 CD2 HIS A 110 32.862 -8.567 55.347 1.00 39.75 C ATOM 846 CE1 HIS A 110 31.823 -9.482 53.645 1.00 40.83 C ATOM 847 NE2 HIS A 110 32.514 -9.749 54.739 1.00 43.09 N ATOM 0 H HIS A 110 33.239 -3.725 54.656 1.00 31.61 H new ATOM 0 HA HIS A 110 34.520 -5.981 54.404 1.00 34.59 H new ATOM 0 HB2 HIS A 110 32.511 -5.840 55.646 1.00 35.85 H new ATOM 0 HB3 HIS A 110 31.711 -5.660 54.320 1.00 35.85 H new ATOM 0 HD2 HIS A 110 33.349 -8.473 56.134 1.00 39.75 H new ATOM 0 HE1 HIS A 110 31.471 -10.111 53.057 1.00 40.83 H new ATOM 0 HE2 HIS A 110 32.714 -10.535 55.024 1.00 43.09 H new ATOM 848 N HIS A 111 33.055 -4.935 51.770 1.00 33.31 N ATOM 849 CA HIS A 111 32.973 -5.105 50.325 1.00 34.30 C ATOM 850 C HIS A 111 34.378 -5.187 49.735 1.00 35.61 C ATOM 851 O HIS A 111 34.644 -6.000 48.856 1.00 34.06 O ATOM 852 CB HIS A 111 32.240 -3.923 49.685 1.00 34.87 C ATOM 853 CG HIS A 111 32.221 -3.964 48.187 1.00 37.01 C ATOM 854 ND1 HIS A 111 31.430 -4.841 47.475 1.00 37.90 N ATOM 855 CD2 HIS A 111 32.919 -3.255 47.268 1.00 36.64 C ATOM 856 CE1 HIS A 111 31.643 -4.671 46.182 1.00 36.78 C ATOM 857 NE2 HIS A 111 32.542 -3.715 46.030 1.00 37.16 N ATOM 0 H HIS A 111 32.664 -4.231 52.073 1.00 33.31 H new ATOM 0 HA HIS A 111 32.485 -5.923 50.142 1.00 34.30 H new ATOM 0 HB2 HIS A 111 31.327 -3.904 50.011 1.00 34.87 H new ATOM 0 HB3 HIS A 111 32.661 -3.098 49.973 1.00 34.87 H new ATOM 0 HD2 HIS A 111 33.538 -2.583 47.443 1.00 36.64 H new ATOM 0 HE1 HIS A 111 31.230 -5.144 45.496 1.00 36.78 H new ATOM 0 HE2 HIS A 111 32.843 -3.427 45.277 1.00 37.16 H new ATOM 858 N LEU A 112 35.274 -4.334 50.226 1.00 36.85 N ATOM 859 CA LEU A 112 36.647 -4.287 49.743 1.00 36.78 C ATOM 860 C LEU A 112 37.531 -5.421 50.261 1.00 38.27 C ATOM 861 O LEU A 112 38.362 -5.956 49.523 1.00 38.68 O ATOM 862 CB LEU A 112 37.295 -2.951 50.127 1.00 36.96 C ATOM 863 CG LEU A 112 36.785 -1.671 49.460 1.00 40.19 C ATOM 864 CD1 LEU A 112 37.439 -0.455 50.104 1.00 39.18 C ATOM 865 CD2 LEU A 112 37.084 -1.715 47.965 1.00 40.67 C ATOM 0 H LEU A 112 35.101 -3.767 50.849 1.00 36.85 H new ATOM 0 HA LEU A 112 36.586 -4.388 48.780 1.00 36.78 H new ATOM 0 HB2 LEU A 112 37.199 -2.842 51.086 1.00 36.96 H new ATOM 0 HB3 LEU A 112 38.245 -3.021 49.943 1.00 36.96 H new ATOM 0 HG LEU A 112 35.825 -1.604 49.582 1.00 40.19 H new ATOM 0 HD11 LEU A 112 37.112 0.352 49.677 1.00 39.18 H new ATOM 0 HD12 LEU A 112 37.221 -0.432 51.049 1.00 39.18 H new ATOM 0 HD13 LEU A 112 38.401 -0.510 49.996 1.00 39.18 H new ATOM 0 HD21 LEU A 112 36.760 -0.903 47.546 1.00 40.67 H new ATOM 0 HD22 LEU A 112 38.041 -1.789 47.828 1.00 40.67 H new ATOM 0 HD23 LEU A 112 36.641 -2.482 47.569 1.00 40.67 H new ATOM 866 N ALA A 113 37.351 -5.791 51.523 1.00 37.73 N ATOM 867 CA ALA A 113 38.180 -6.826 52.131 1.00 39.83 C ATOM 868 C ALA A 113 37.684 -8.255 51.962 1.00 40.50 C ATOM 869 O ALA A 113 38.485 -9.174 51.822 1.00 40.79 O ATOM 870 CB ALA A 113 38.368 -6.521 53.618 1.00 38.41 C ATOM 0 H ALA A 113 36.755 -5.456 52.045 1.00 37.73 H new ATOM 0 HA ALA A 113 39.020 -6.793 51.647 1.00 39.83 H new ATOM 0 HB1 ALA A 113 38.919 -7.209 54.023 1.00 38.41 H new ATOM 0 HB2 ALA A 113 38.801 -5.659 53.719 1.00 38.41 H new ATOM 0 HB3 ALA A 113 37.503 -6.501 54.056 1.00 38.41 H new ATOM 871 N LYS A 114 36.370 -8.442 51.989 1.00 41.46 N ATOM 872 CA LYS A 114 35.792 -9.773 51.864 1.00 43.12 C ATOM 873 C LYS A 114 36.343 -10.683 52.960 1.00 44.45 C ATOM 874 O LYS A 114 36.469 -11.895 52.779 1.00 45.57 O ATOM 875 CB LYS A 114 36.090 -10.356 50.478 1.00 44.82 C ATOM 876 CG LYS A 114 35.357 -9.647 49.347 1.00 43.76 C ATOM 877 CD LYS A 114 33.847 -9.718 49.551 1.00 45.28 C ATOM 878 CE LYS A 114 33.095 -8.882 48.512 1.00 46.38 C ATOM 879 NZ LYS A 114 31.622 -8.910 48.735 1.00 43.79 N ATOM 0 H LYS A 114 35.795 -7.809 52.079 1.00 41.46 H new ATOM 0 HA LYS A 114 34.829 -9.710 51.966 1.00 43.12 H new ATOM 0 HB2 LYS A 114 37.045 -10.309 50.314 1.00 44.82 H new ATOM 0 HB3 LYS A 114 35.847 -11.295 50.472 1.00 44.82 H new ATOM 0 HG2 LYS A 114 35.639 -8.720 49.305 1.00 43.76 H new ATOM 0 HG3 LYS A 114 35.592 -10.054 48.498 1.00 43.76 H new ATOM 0 HD2 LYS A 114 33.556 -10.642 49.496 1.00 45.28 H new ATOM 0 HD3 LYS A 114 33.625 -9.404 50.441 1.00 45.28 H new ATOM 0 HE2 LYS A 114 33.409 -7.965 48.547 1.00 46.38 H new ATOM 0 HE3 LYS A 114 33.293 -9.217 47.623 1.00 46.38 H new ATOM 0 HZ1 LYS A 114 31.211 -8.501 48.059 1.00 43.79 H new ATOM 0 HZ2 LYS A 114 31.345 -9.754 48.783 1.00 43.79 H new ATOM 0 HZ3 LYS A 114 31.429 -8.491 49.496 1.00 43.79 H new ATOM 880 N LYS A 115 36.673 -10.066 54.092 1.00 44.35 N ATOM 881 CA LYS A 115 37.198 -10.742 55.281 1.00 43.88 C ATOM 882 C LYS A 115 36.610 -9.996 56.474 1.00 42.55 C ATOM 883 O LYS A 115 35.944 -8.975 56.308 1.00 40.98 O ATOM 884 CB LYS A 115 38.714 -10.597 55.390 1.00 45.42 C ATOM 885 CG LYS A 115 39.551 -11.266 54.335 1.00 50.10 C ATOM 886 CD LYS A 115 41.024 -10.942 54.594 1.00 50.84 C ATOM 887 CE LYS A 115 41.442 -11.341 56.015 1.00 52.75 C ATOM 888 NZ LYS A 115 42.816 -10.873 56.373 1.00 52.85 N ATOM 0 H LYS A 115 36.596 -9.216 54.194 1.00 44.35 H new ATOM 0 HA LYS A 115 36.973 -11.685 55.243 1.00 43.88 H new ATOM 0 HB2 LYS A 115 38.926 -9.650 55.385 1.00 45.42 H new ATOM 0 HB3 LYS A 115 38.987 -10.944 56.254 1.00 45.42 H new ATOM 0 HG2 LYS A 115 39.410 -12.226 54.353 1.00 50.10 H new ATOM 0 HG3 LYS A 115 39.289 -10.958 53.453 1.00 50.10 H new ATOM 0 HD2 LYS A 115 41.578 -11.409 53.949 1.00 50.84 H new ATOM 0 HD3 LYS A 115 41.176 -9.993 54.465 1.00 50.84 H new ATOM 0 HE2 LYS A 115 40.806 -10.975 56.649 1.00 52.75 H new ATOM 0 HE3 LYS A 115 41.402 -12.307 56.099 1.00 52.75 H new ATOM 0 HZ1 LYS A 115 42.895 -10.835 57.259 1.00 52.85 H new ATOM 0 HZ2 LYS A 115 43.418 -11.441 56.046 1.00 52.85 H new ATOM 0 HZ3 LYS A 115 42.954 -10.064 56.028 1.00 52.85 H new ATOM 889 N ALA A 116 36.870 -10.488 57.677 1.00 39.03 N ATOM 890 CA ALA A 116 36.373 -9.792 58.849 1.00 38.95 C ATOM 891 C ALA A 116 37.189 -8.507 58.958 1.00 38.51 C ATOM 892 O ALA A 116 38.388 -8.499 58.666 1.00 38.37 O ATOM 893 CB ALA A 116 36.571 -10.639 60.094 1.00 37.74 C ATOM 0 H ALA A 116 37.320 -11.204 57.833 1.00 39.03 H new ATOM 0 HA ALA A 116 35.424 -9.608 58.770 1.00 38.95 H new ATOM 0 HB1 ALA A 116 36.234 -10.161 60.868 1.00 37.74 H new ATOM 0 HB2 ALA A 116 36.089 -11.475 59.997 1.00 37.74 H new ATOM 0 HB3 ALA A 116 37.516 -10.823 60.214 1.00 37.74 H new ATOM 894 N CYS A 117 36.547 -7.411 59.341 1.00 36.28 N ATOM 895 CA CYS A 117 37.292 -6.179 59.503 1.00 36.24 C ATOM 896 C CYS A 117 36.843 -5.298 60.652 1.00 34.04 C ATOM 897 O CYS A 117 35.720 -5.396 61.144 1.00 33.57 O ATOM 898 CB CYS A 117 37.333 -5.355 58.201 1.00 39.63 C ATOM 899 SG CYS A 117 36.034 -5.642 56.987 1.00 42.68 S ATOM 0 H CYS A 117 35.705 -7.361 59.507 1.00 36.28 H new ATOM 0 HA CYS A 117 38.185 -6.482 59.729 1.00 36.24 H new ATOM 0 HB2 CYS A 117 37.314 -4.416 58.442 1.00 39.63 H new ATOM 0 HB3 CYS A 117 38.186 -5.520 57.770 1.00 39.63 H new ATOM 0 HG CYS A 117 35.993 -6.809 56.712 1.00 42.68 H new ATOM 900 N LEU A 118 37.779 -4.464 61.086 1.00 31.36 N ATOM 901 CA LEU A 118 37.584 -3.505 62.149 1.00 29.69 C ATOM 902 C LEU A 118 37.581 -2.182 61.402 1.00 28.88 C ATOM 903 O LEU A 118 38.515 -1.895 60.654 1.00 29.49 O ATOM 904 CB LEU A 118 38.759 -3.560 63.129 1.00 26.70 C ATOM 905 CG LEU A 118 38.840 -2.459 64.200 1.00 28.57 C ATOM 906 CD1 LEU A 118 37.565 -2.437 65.036 1.00 24.35 C ATOM 907 CD2 LEU A 118 40.065 -2.704 65.086 1.00 24.50 C ATOM 0 H LEU A 118 38.572 -4.444 60.754 1.00 31.36 H new ATOM 0 HA LEU A 118 36.782 -3.657 62.672 1.00 29.69 H new ATOM 0 HB2 LEU A 118 38.732 -4.417 63.582 1.00 26.70 H new ATOM 0 HB3 LEU A 118 39.580 -3.538 62.614 1.00 26.70 H new ATOM 0 HG LEU A 118 38.929 -1.595 63.768 1.00 28.57 H new ATOM 0 HD11 LEU A 118 37.629 -1.739 65.707 1.00 24.35 H new ATOM 0 HD12 LEU A 118 36.804 -2.263 64.461 1.00 24.35 H new ATOM 0 HD13 LEU A 118 37.450 -3.295 65.473 1.00 24.35 H new ATOM 0 HD21 LEU A 118 40.119 -2.011 65.763 1.00 24.50 H new ATOM 0 HD22 LEU A 118 39.986 -3.570 65.516 1.00 24.50 H new ATOM 0 HD23 LEU A 118 40.867 -2.686 64.541 1.00 24.50 H new ATOM 908 N VAL A 119 36.530 -1.391 61.597 1.00 28.13 N ATOM 909 CA VAL A 119 36.388 -0.108 60.931 1.00 27.31 C ATOM 910 C VAL A 119 36.280 1.019 61.954 1.00 29.05 C ATOM 911 O VAL A 119 35.300 1.098 62.701 1.00 29.18 O ATOM 912 CB VAL A 119 35.135 -0.103 60.051 1.00 28.18 C ATOM 913 CG1 VAL A 119 35.081 1.171 59.227 1.00 27.47 C ATOM 914 CG2 VAL A 119 35.136 -1.332 59.158 1.00 27.97 C ATOM 0 H VAL A 119 35.878 -1.587 62.122 1.00 28.13 H new ATOM 0 HA VAL A 119 37.174 0.033 60.380 1.00 27.31 H new ATOM 0 HB VAL A 119 34.344 -0.130 60.612 1.00 28.18 H new ATOM 0 HG11 VAL A 119 34.285 1.165 58.673 1.00 27.47 H new ATOM 0 HG12 VAL A 119 35.057 1.939 59.819 1.00 27.47 H new ATOM 0 HG13 VAL A 119 35.867 1.224 58.661 1.00 27.47 H new ATOM 0 HG21 VAL A 119 34.342 -1.328 58.601 1.00 27.97 H new ATOM 0 HG22 VAL A 119 35.926 -1.322 58.595 1.00 27.97 H new ATOM 0 HG23 VAL A 119 35.141 -2.131 59.707 1.00 27.97 H new ATOM 915 N ILE A 120 37.285 1.893 61.977 1.00 27.43 N ATOM 916 CA ILE A 120 37.303 2.999 62.917 1.00 27.21 C ATOM 917 C ILE A 120 37.336 4.342 62.198 1.00 28.24 C ATOM 918 O ILE A 120 38.175 4.575 61.326 1.00 27.43 O ATOM 919 CB ILE A 120 38.529 2.921 63.852 1.00 28.96 C ATOM 920 CG1 ILE A 120 38.697 1.493 64.383 1.00 28.75 C ATOM 921 CG2 ILE A 120 38.344 3.881 65.025 1.00 28.01 C ATOM 922 CD1 ILE A 120 39.891 1.312 65.316 1.00 25.22 C ATOM 0 H ILE A 120 37.966 1.859 61.453 1.00 27.43 H new ATOM 0 HA ILE A 120 36.488 2.929 63.438 1.00 27.21 H new ATOM 0 HB ILE A 120 39.322 3.169 63.351 1.00 28.96 H new ATOM 0 HG12 ILE A 120 37.889 1.236 64.854 1.00 28.75 H new ATOM 0 HG13 ILE A 120 38.792 0.888 63.631 1.00 28.75 H new ATOM 0 HG21 ILE A 120 39.116 3.830 65.610 1.00 28.01 H new ATOM 0 HG22 ILE A 120 38.252 4.787 64.691 1.00 28.01 H new ATOM 0 HG23 ILE A 120 37.546 3.637 65.520 1.00 28.01 H new ATOM 0 HD11 ILE A 120 39.934 0.389 65.611 1.00 25.22 H new ATOM 0 HD12 ILE A 120 40.708 1.539 64.844 1.00 25.22 H new ATOM 0 HD13 ILE A 120 39.791 1.893 66.086 1.00 25.22 H new ATOM 923 N ASP A 121 36.406 5.215 62.574 1.00 29.41 N ATOM 924 CA ASP A 121 36.302 6.549 62.003 1.00 31.34 C ATOM 925 C ASP A 121 36.708 7.559 63.069 1.00 32.22 C ATOM 926 O ASP A 121 35.987 7.774 64.053 1.00 31.07 O ATOM 927 CB ASP A 121 34.864 6.811 61.544 1.00 34.45 C ATOM 928 CG ASP A 121 34.663 8.218 61.015 1.00 40.45 C ATOM 929 OD1 ASP A 121 35.616 8.803 60.460 1.00 42.98 O ATOM 930 OD2 ASP A 121 33.536 8.742 61.142 1.00 47.58 O ATOM 0 H ASP A 121 35.813 5.046 63.174 1.00 29.41 H new ATOM 0 HA ASP A 121 36.886 6.630 61.233 1.00 31.34 H new ATOM 0 HB2 ASP A 121 34.628 6.173 60.852 1.00 34.45 H new ATOM 0 HB3 ASP A 121 34.259 6.660 62.287 1.00 34.45 H new ATOM 931 N LEU A 122 37.875 8.165 62.879 1.00 31.59 N ATOM 932 CA LEU A 122 38.381 9.146 63.831 1.00 31.33 C ATOM 933 C LEU A 122 37.981 10.555 63.385 1.00 32.25 C ATOM 934 O LEU A 122 38.770 11.273 62.765 1.00 30.96 O ATOM 935 CB LEU A 122 39.911 9.043 63.938 1.00 32.00 C ATOM 936 CG LEU A 122 40.584 7.720 64.359 1.00 33.44 C ATOM 937 CD1 LEU A 122 40.174 7.340 65.771 1.00 32.51 C ATOM 938 CD2 LEU A 122 40.221 6.607 63.375 1.00 28.38 C ATOM 0 H LEU A 122 38.389 8.022 62.205 1.00 31.59 H new ATOM 0 HA LEU A 122 37.995 8.966 64.703 1.00 31.33 H new ATOM 0 HB2 LEU A 122 40.275 9.285 63.072 1.00 32.00 H new ATOM 0 HB3 LEU A 122 40.200 9.723 64.567 1.00 32.00 H new ATOM 0 HG LEU A 122 41.546 7.843 64.345 1.00 33.44 H new ATOM 0 HD11 LEU A 122 40.605 6.507 66.020 1.00 32.51 H new ATOM 0 HD12 LEU A 122 40.444 8.040 66.386 1.00 32.51 H new ATOM 0 HD13 LEU A 122 39.211 7.230 65.810 1.00 32.51 H new ATOM 0 HD21 LEU A 122 40.649 5.781 63.649 1.00 28.38 H new ATOM 0 HD22 LEU A 122 39.259 6.485 63.365 1.00 28.38 H new ATOM 0 HD23 LEU A 122 40.525 6.849 62.486 1.00 28.38 H new ATOM 939 N GLY A 123 36.748 10.941 63.697 1.00 32.01 N ATOM 940 CA GLY A 123 36.271 12.262 63.318 1.00 31.08 C ATOM 941 C GLY A 123 35.926 13.104 64.536 1.00 30.54 C ATOM 942 O GLY A 123 36.498 12.918 65.610 1.00 28.64 O ATOM 0 H GLY A 123 36.179 10.458 64.123 1.00 32.01 H new ATOM 0 HA2 GLY A 123 36.950 12.714 62.793 1.00 31.08 H new ATOM 0 HA3 GLY A 123 35.488 12.174 62.752 1.00 31.08 H new ATOM 943 N THR A 124 34.996 14.037 64.362 1.00 30.06 N ATOM 944 CA THR A 124 34.550 14.908 65.449 1.00 31.10 C ATOM 945 C THR A 124 34.128 13.965 66.555 1.00 29.68 C ATOM 946 O THR A 124 34.506 14.133 67.707 1.00 32.31 O ATOM 947 CB THR A 124 33.371 15.783 64.984 1.00 32.77 C ATOM 948 OG1 THR A 124 33.800 16.572 63.868 1.00 36.24 O ATOM 949 CG2 THR A 124 32.906 16.711 66.095 1.00 33.34 C ATOM 0 H THR A 124 34.604 14.185 63.611 1.00 30.06 H new ATOM 0 HA THR A 124 35.244 15.518 65.744 1.00 31.10 H new ATOM 0 HB THR A 124 32.632 15.206 64.737 1.00 32.77 H new ATOM 0 HG1 THR A 124 33.164 17.053 63.604 1.00 36.24 H new ATOM 0 HG21 THR A 124 32.165 17.250 65.778 1.00 33.34 H new ATOM 0 HG22 THR A 124 32.619 16.185 66.858 1.00 33.34 H new ATOM 0 HG23 THR A 124 33.637 17.291 66.359 1.00 33.34 H new ATOM 950 N ALA A 125 33.330 12.969 66.188 1.00 29.20 N ATOM 951 CA ALA A 125 32.924 11.928 67.114 1.00 27.72 C ATOM 952 C ALA A 125 33.726 10.718 66.611 1.00 27.54 C ATOM 953 O ALA A 125 34.155 10.693 65.456 1.00 27.67 O ATOM 954 CB ALA A 125 31.440 11.655 66.991 1.00 30.99 C ATOM 0 H ALA A 125 33.010 12.880 65.395 1.00 29.20 H new ATOM 0 HA ALA A 125 33.083 12.151 68.045 1.00 27.72 H new ATOM 0 HB1 ALA A 125 31.186 10.958 67.616 1.00 30.99 H new ATOM 0 HB2 ALA A 125 30.944 12.464 67.191 1.00 30.99 H new ATOM 0 HB3 ALA A 125 31.237 11.368 66.087 1.00 30.99 H new ATOM 955 N VAL A 126 33.956 9.733 67.465 1.00 27.33 N ATOM 956 CA VAL A 126 34.688 8.539 67.043 1.00 27.03 C ATOM 957 C VAL A 126 33.722 7.356 66.983 1.00 28.24 C ATOM 958 O VAL A 126 32.847 7.219 67.834 1.00 29.50 O ATOM 959 CB VAL A 126 35.837 8.200 68.032 1.00 28.01 C ATOM 960 CG1 VAL A 126 36.481 6.845 67.656 1.00 24.61 C ATOM 961 CG2 VAL A 126 36.903 9.317 68.000 1.00 25.35 C ATOM 0 H VAL A 126 33.702 9.731 68.287 1.00 27.33 H new ATOM 0 HA VAL A 126 35.075 8.712 66.171 1.00 27.03 H new ATOM 0 HB VAL A 126 35.472 8.135 68.928 1.00 28.01 H new ATOM 0 HG11 VAL A 126 37.197 6.643 68.279 1.00 24.61 H new ATOM 0 HG12 VAL A 126 35.810 6.145 67.696 1.00 24.61 H new ATOM 0 HG13 VAL A 126 36.841 6.896 66.757 1.00 24.61 H new ATOM 0 HG21 VAL A 126 37.618 9.100 68.619 1.00 25.35 H new ATOM 0 HG22 VAL A 126 37.265 9.394 67.103 1.00 25.35 H new ATOM 0 HG23 VAL A 126 36.497 10.159 68.258 1.00 25.35 H new ATOM 962 N THR A 127 33.841 6.528 65.953 1.00 28.86 N ATOM 963 CA THR A 127 32.991 5.345 65.856 1.00 29.15 C ATOM 964 C THR A 127 33.865 4.167 65.454 1.00 29.87 C ATOM 965 O THR A 127 34.877 4.335 64.765 1.00 27.10 O ATOM 966 CB THR A 127 31.857 5.490 64.810 1.00 30.44 C ATOM 967 OG1 THR A 127 32.421 5.654 63.505 1.00 32.10 O ATOM 968 CG2 THR A 127 30.968 6.679 65.137 1.00 29.67 C ATOM 0 H THR A 127 34.399 6.629 65.307 1.00 28.86 H new ATOM 0 HA THR A 127 32.570 5.217 66.720 1.00 29.15 H new ATOM 0 HB THR A 127 31.315 4.686 64.832 1.00 30.44 H new ATOM 0 HG1 THR A 127 32.583 4.900 63.173 1.00 32.10 H new ATOM 0 HG21 THR A 127 30.266 6.751 64.471 1.00 29.67 H new ATOM 0 HG22 THR A 127 30.570 6.555 66.013 1.00 29.67 H new ATOM 0 HG23 THR A 127 31.499 7.491 65.136 1.00 29.67 H new ATOM 969 N SER A 128 33.479 2.981 65.916 1.00 29.26 N ATOM 970 CA SER A 128 34.193 1.757 65.603 1.00 27.93 C ATOM 971 C SER A 128 33.165 0.654 65.371 1.00 28.98 C ATOM 972 O SER A 128 32.268 0.464 66.183 1.00 28.34 O ATOM 973 CB SER A 128 35.112 1.369 66.756 1.00 28.32 C ATOM 974 OG SER A 128 36.000 0.341 66.350 1.00 30.83 O ATOM 0 H SER A 128 32.792 2.868 66.421 1.00 29.26 H new ATOM 0 HA SER A 128 34.737 1.887 64.811 1.00 27.93 H new ATOM 0 HB2 SER A 128 35.616 2.143 67.051 1.00 28.32 H new ATOM 0 HB3 SER A 128 34.584 1.069 67.512 1.00 28.32 H new ATOM 0 HG SER A 128 35.990 -0.278 66.917 1.00 30.83 H new ATOM 975 N ASP A 129 33.291 -0.063 64.261 1.00 29.49 N ATOM 976 CA ASP A 129 32.365 -1.144 63.945 1.00 30.68 C ATOM 977 C ASP A 129 33.128 -2.403 63.541 1.00 31.39 C ATOM 978 O ASP A 129 34.203 -2.335 62.946 1.00 28.34 O ATOM 979 CB ASP A 129 31.408 -0.710 62.831 1.00 30.90 C ATOM 980 CG ASP A 129 30.382 0.317 63.310 1.00 36.24 C ATOM 981 OD1 ASP A 129 29.398 -0.084 63.975 1.00 34.62 O ATOM 982 OD2 ASP A 129 30.565 1.526 63.037 1.00 34.78 O ATOM 0 H ASP A 129 33.908 0.061 63.675 1.00 29.49 H new ATOM 0 HA ASP A 129 31.844 -1.348 64.737 1.00 30.68 H new ATOM 0 HB2 ASP A 129 31.919 -0.334 62.097 1.00 30.90 H new ATOM 0 HB3 ASP A 129 30.945 -1.489 62.485 1.00 30.90 H new ATOM 983 N LEU A 130 32.575 -3.555 63.895 1.00 31.20 N ATOM 984 CA LEU A 130 33.211 -4.820 63.579 1.00 32.54 C ATOM 985 C LEU A 130 32.295 -5.673 62.707 1.00 32.81 C ATOM 986 O LEU A 130 31.098 -5.777 62.967 1.00 32.50 O ATOM 987 CB LEU A 130 33.559 -5.572 64.872 1.00 34.06 C ATOM 988 CG LEU A 130 34.652 -4.985 65.779 1.00 32.78 C ATOM 989 CD1 LEU A 130 34.163 -3.715 66.450 1.00 34.08 C ATOM 990 CD2 LEU A 130 35.030 -6.008 66.832 1.00 34.44 C ATOM 0 H LEU A 130 31.830 -3.624 64.320 1.00 31.20 H new ATOM 0 HA LEU A 130 34.028 -4.642 63.088 1.00 32.54 H new ATOM 0 HB2 LEU A 130 32.747 -5.650 65.398 1.00 34.06 H new ATOM 0 HB3 LEU A 130 33.827 -6.472 64.629 1.00 34.06 H new ATOM 0 HG LEU A 130 35.427 -4.768 65.238 1.00 32.78 H new ATOM 0 HD11 LEU A 130 34.864 -3.358 67.018 1.00 34.08 H new ATOM 0 HD12 LEU A 130 33.931 -3.060 65.773 1.00 34.08 H new ATOM 0 HD13 LEU A 130 33.381 -3.914 66.989 1.00 34.08 H new ATOM 0 HD21 LEU A 130 35.720 -5.641 67.407 1.00 34.44 H new ATOM 0 HD22 LEU A 130 34.250 -6.228 67.364 1.00 34.44 H new ATOM 0 HD23 LEU A 130 35.363 -6.810 66.400 1.00 34.44 H new ATOM 991 N VAL A 131 32.861 -6.272 61.667 1.00 33.28 N ATOM 992 CA VAL A 131 32.081 -7.113 60.768 1.00 33.97 C ATOM 993 C VAL A 131 32.735 -8.471 60.602 1.00 33.00 C ATOM 994 O VAL A 131 33.933 -8.558 60.343 1.00 32.87 O ATOM 995 CB VAL A 131 31.946 -6.481 59.373 1.00 34.66 C ATOM 996 CG1 VAL A 131 30.949 -7.290 58.539 1.00 35.06 C ATOM 997 CG2 VAL A 131 31.504 -5.022 59.499 1.00 33.41 C ATOM 0 H VAL A 131 33.694 -6.205 61.464 1.00 33.28 H new ATOM 0 HA VAL A 131 31.202 -7.206 61.168 1.00 33.97 H new ATOM 0 HB VAL A 131 32.806 -6.495 58.924 1.00 34.66 H new ATOM 0 HG11 VAL A 131 30.864 -6.891 57.659 1.00 35.06 H new ATOM 0 HG12 VAL A 131 31.266 -8.202 58.451 1.00 35.06 H new ATOM 0 HG13 VAL A 131 30.084 -7.290 58.978 1.00 35.06 H new ATOM 0 HG21 VAL A 131 31.421 -4.631 58.615 1.00 33.41 H new ATOM 0 HG22 VAL A 131 30.647 -4.981 59.951 1.00 33.41 H new ATOM 0 HG23 VAL A 131 32.163 -4.527 60.010 1.00 33.41 H new ATOM 998 N ALA A 132 31.942 -9.526 60.751 1.00 33.54 N ATOM 999 CA ALA A 132 32.452 -10.885 60.614 1.00 35.66 C ATOM 1000 C ALA A 132 32.862 -11.152 59.169 1.00 35.05 C ATOM 1001 O ALA A 132 32.446 -10.440 58.252 1.00 34.69 O ATOM 1002 CB ALA A 132 31.391 -11.890 61.061 1.00 34.40 C ATOM 0 H ALA A 132 31.103 -9.476 60.932 1.00 33.54 H new ATOM 0 HA ALA A 132 33.234 -10.985 61.179 1.00 35.66 H new ATOM 0 HB1 ALA A 132 31.738 -12.791 60.967 1.00 34.40 H new ATOM 0 HB2 ALA A 132 31.162 -11.728 61.990 1.00 34.40 H new ATOM 0 HB3 ALA A 132 30.598 -11.790 60.511 1.00 34.40 H new ATOM 1003 N ALA A 133 33.684 -12.176 58.972 1.00 36.56 N ATOM 1004 CA ALA A 133 34.152 -12.528 57.638 1.00 37.60 C ATOM 1005 C ALA A 133 32.994 -12.862 56.700 1.00 38.93 C ATOM 1006 O ALA A 133 33.114 -12.706 55.485 1.00 40.26 O ATOM 1007 CB ALA A 133 35.119 -13.701 57.717 1.00 36.83 C ATOM 0 H ALA A 133 33.983 -12.681 59.600 1.00 36.56 H new ATOM 0 HA ALA A 133 34.611 -11.755 57.273 1.00 37.60 H new ATOM 0 HB1 ALA A 133 35.425 -13.929 56.825 1.00 36.83 H new ATOM 0 HB2 ALA A 133 35.880 -13.457 58.267 1.00 36.83 H new ATOM 0 HB3 ALA A 133 34.669 -14.466 58.109 1.00 36.83 H new ATOM 1008 N ASP A 134 31.871 -13.308 57.262 1.00 40.34 N ATOM 1009 CA ASP A 134 30.708 -13.649 56.450 1.00 41.73 C ATOM 1010 C ASP A 134 29.812 -12.446 56.128 1.00 41.64 C ATOM 1011 O ASP A 134 28.716 -12.611 55.589 1.00 40.06 O ATOM 1012 CB ASP A 134 29.875 -14.739 57.130 1.00 44.80 C ATOM 1013 CG ASP A 134 29.335 -14.306 58.478 1.00 49.44 C ATOM 1014 OD1 ASP A 134 28.519 -15.055 59.057 1.00 49.54 O ATOM 1015 OD2 ASP A 134 29.730 -13.222 58.963 1.00 51.11 O ATOM 0 H ASP A 134 31.764 -13.419 58.108 1.00 40.34 H new ATOM 0 HA ASP A 134 31.061 -13.975 55.607 1.00 41.73 H new ATOM 0 HB2 ASP A 134 29.135 -14.983 56.552 1.00 44.80 H new ATOM 0 HB3 ASP A 134 30.420 -15.533 57.244 1.00 44.80 H new ATOM 1016 N GLY A 135 30.265 -11.240 56.467 1.00 39.93 N ATOM 1017 CA GLY A 135 29.480 -10.055 56.160 1.00 37.61 C ATOM 1018 C GLY A 135 28.484 -9.614 57.214 1.00 36.09 C ATOM 1019 O GLY A 135 27.730 -8.660 57.010 1.00 35.52 O ATOM 0 H GLY A 135 31.011 -11.091 56.868 1.00 39.93 H new ATOM 0 HA2 GLY A 135 30.091 -9.320 55.993 1.00 37.61 H new ATOM 0 HA3 GLY A 135 28.997 -10.216 55.334 1.00 37.61 H new ATOM 1020 N VAL A 136 28.463 -10.300 58.345 1.00 36.09 N ATOM 1021 CA VAL A 136 27.543 -9.924 59.408 1.00 35.49 C ATOM 1022 C VAL A 136 28.152 -8.881 60.344 1.00 35.26 C ATOM 1023 O VAL A 136 29.202 -9.100 60.949 1.00 35.16 O ATOM 1024 CB VAL A 136 27.109 -11.152 60.232 1.00 35.77 C ATOM 1025 CG1 VAL A 136 26.313 -10.713 61.445 1.00 36.03 C ATOM 1026 CG2 VAL A 136 26.268 -12.075 59.367 1.00 37.99 C ATOM 0 H VAL A 136 28.965 -10.977 58.518 1.00 36.09 H new ATOM 0 HA VAL A 136 26.766 -9.537 58.976 1.00 35.49 H new ATOM 0 HB VAL A 136 27.899 -11.627 60.533 1.00 35.77 H new ATOM 0 HG11 VAL A 136 26.045 -11.493 61.956 1.00 36.03 H new ATOM 0 HG12 VAL A 136 26.860 -10.136 62.000 1.00 36.03 H new ATOM 0 HG13 VAL A 136 25.523 -10.229 61.156 1.00 36.03 H new ATOM 0 HG21 VAL A 136 25.996 -12.847 59.887 1.00 37.99 H new ATOM 0 HG22 VAL A 136 25.481 -11.600 59.057 1.00 37.99 H new ATOM 0 HG23 VAL A 136 26.790 -12.368 58.603 1.00 37.99 H new ATOM 1027 N HIS A 137 27.477 -7.743 60.441 1.00 35.30 N ATOM 1028 CA HIS A 137 27.887 -6.639 61.300 1.00 35.18 C ATOM 1029 C HIS A 137 27.562 -7.043 62.738 1.00 35.14 C ATOM 1030 O HIS A 137 26.421 -7.368 63.051 1.00 36.84 O ATOM 1031 CB HIS A 137 27.108 -5.384 60.885 1.00 33.98 C ATOM 1032 CG HIS A 137 27.262 -4.219 61.811 1.00 31.86 C ATOM 1033 ND1 HIS A 137 26.344 -3.370 62.328 1.00 34.92 N flip ATOM 1034 CD2 HIS A 137 28.491 -3.752 62.225 1.00 31.16 C flip ATOM 1035 CE1 HIS A 137 27.029 -2.408 63.030 1.00 32.94 C flip ATOM 1036 NE2 HIS A 137 28.323 -2.662 62.954 1.00 34.29 N flip ATOM 0 H HIS A 137 26.754 -7.587 60.002 1.00 35.30 H new ATOM 0 HA HIS A 137 28.835 -6.446 61.223 1.00 35.18 H new ATOM 0 HB2 HIS A 137 27.397 -5.117 59.998 1.00 33.98 H new ATOM 0 HB3 HIS A 137 26.167 -5.609 60.821 1.00 33.98 H new ATOM 0 HD2 HIS A 137 29.310 -4.143 62.023 1.00 31.16 H new ATOM 0 HE1 HIS A 137 26.644 -1.694 63.485 1.00 32.94 H new ATOM 0 HE2 HIS A 137 28.949 -2.198 63.317 1.00 34.29 H new ATOM 1037 N LEU A 138 28.574 -7.036 63.599 1.00 34.68 N ATOM 1038 CA LEU A 138 28.413 -7.410 65.002 1.00 34.46 C ATOM 1039 C LEU A 138 27.865 -6.280 65.858 1.00 34.40 C ATOM 1040 O LEU A 138 27.216 -6.512 66.882 1.00 35.18 O ATOM 1041 CB LEU A 138 29.761 -7.847 65.583 1.00 33.81 C ATOM 1042 CG LEU A 138 30.271 -9.263 65.304 1.00 35.41 C ATOM 1043 CD1 LEU A 138 29.916 -9.714 63.915 1.00 36.00 C ATOM 1044 CD2 LEU A 138 31.765 -9.281 65.511 1.00 35.57 C ATOM 0 H LEU A 138 29.377 -6.813 63.386 1.00 34.68 H new ATOM 0 HA LEU A 138 27.772 -8.137 65.020 1.00 34.46 H new ATOM 0 HB2 LEU A 138 30.433 -7.226 65.261 1.00 33.81 H new ATOM 0 HB3 LEU A 138 29.713 -7.738 66.546 1.00 33.81 H new ATOM 0 HG LEU A 138 29.845 -9.883 65.916 1.00 35.41 H new ATOM 0 HD11 LEU A 138 30.252 -10.612 63.770 1.00 36.00 H new ATOM 0 HD12 LEU A 138 28.952 -9.709 63.810 1.00 36.00 H new ATOM 0 HD13 LEU A 138 30.314 -9.112 63.267 1.00 36.00 H new ATOM 0 HD21 LEU A 138 32.105 -10.173 65.338 1.00 35.57 H new ATOM 0 HD22 LEU A 138 32.184 -8.652 64.903 1.00 35.57 H new ATOM 0 HD23 LEU A 138 31.968 -9.030 66.426 1.00 35.57 H new ATOM 1045 N GLY A 139 28.136 -5.055 65.434 1.00 33.34 N ATOM 1046 CA GLY A 139 27.696 -3.898 66.187 1.00 32.01 C ATOM 1047 C GLY A 139 28.885 -2.967 66.265 1.00 31.00 C ATOM 1048 O GLY A 139 29.879 -3.183 65.565 1.00 31.49 O ATOM 0 H GLY A 139 28.572 -4.874 64.715 1.00 33.34 H new ATOM 0 HA2 GLY A 139 26.946 -3.465 65.750 1.00 32.01 H new ATOM 0 HA3 GLY A 139 27.398 -4.155 67.074 1.00 32.01 H new ATOM 1049 N GLY A 140 28.809 -1.953 67.117 1.00 29.51 N ATOM 1050 CA GLY A 140 29.914 -1.020 67.217 1.00 28.20 C ATOM 1051 C GLY A 140 29.903 -0.127 68.440 1.00 28.26 C ATOM 1052 O GLY A 140 29.135 -0.347 69.382 1.00 27.61 O ATOM 0 H GLY A 140 28.141 -1.791 67.634 1.00 29.51 H new ATOM 0 HA2 GLY A 140 30.743 -1.523 67.210 1.00 28.20 H new ATOM 0 HA3 GLY A 140 29.916 -0.459 66.426 1.00 28.20 H new ATOM 1053 N TYR A 141 30.752 0.899 68.409 1.00 26.80 N ATOM 1054 CA TYR A 141 30.888 1.820 69.523 1.00 26.14 C ATOM 1055 C TYR A 141 30.916 3.286 69.111 1.00 27.44 C ATOM 1056 O TYR A 141 31.205 3.624 67.964 1.00 29.71 O ATOM 1057 CB TYR A 141 32.169 1.511 70.287 1.00 22.90 C ATOM 1058 CG TYR A 141 32.346 0.058 70.658 1.00 27.11 C ATOM 1059 CD1 TYR A 141 33.023 -0.823 69.807 1.00 24.84 C ATOM 1060 CD2 TYR A 141 31.861 -0.438 71.875 1.00 26.52 C ATOM 1061 CE1 TYR A 141 33.220 -2.152 70.160 1.00 23.88 C ATOM 1062 CE2 TYR A 141 32.053 -1.772 72.235 1.00 25.32 C ATOM 1063 CZ TYR A 141 32.734 -2.618 71.377 1.00 26.17 C ATOM 1064 OH TYR A 141 32.952 -3.925 71.741 1.00 29.74 O ATOM 0 H TYR A 141 31.263 1.076 67.740 1.00 26.80 H new ATOM 0 HA TYR A 141 30.101 1.691 70.075 1.00 26.14 H new ATOM 0 HB2 TYR A 141 32.927 1.790 69.750 1.00 22.90 H new ATOM 0 HB3 TYR A 141 32.184 2.044 71.098 1.00 22.90 H new ATOM 0 HD1 TYR A 141 33.346 -0.514 68.992 1.00 24.84 H new ATOM 0 HD2 TYR A 141 31.404 0.131 72.452 1.00 26.52 H new ATOM 0 HE1 TYR A 141 33.674 -2.726 69.586 1.00 23.88 H new ATOM 0 HE2 TYR A 141 31.726 -2.090 73.045 1.00 25.32 H new ATOM 0 HH TYR A 141 32.823 -4.011 72.566 1.00 29.74 H new ATOM 1065 N ILE A 142 30.621 4.155 70.068 1.00 27.90 N ATOM 1066 CA ILE A 142 30.641 5.583 69.817 1.00 28.25 C ATOM 1067 C ILE A 142 31.243 6.295 71.014 1.00 29.01 C ATOM 1068 O ILE A 142 30.932 5.970 72.162 1.00 28.76 O ATOM 1069 CB ILE A 142 29.225 6.162 69.608 1.00 29.18 C ATOM 1070 CG1 ILE A 142 28.588 5.576 68.348 1.00 30.37 C ATOM 1071 CG2 ILE A 142 29.302 7.689 69.505 1.00 27.29 C ATOM 1072 CD1 ILE A 142 27.168 6.078 68.099 1.00 32.69 C ATOM 0 H ILE A 142 30.406 3.935 70.871 1.00 27.90 H new ATOM 0 HA ILE A 142 31.162 5.720 69.010 1.00 28.25 H new ATOM 0 HB ILE A 142 28.672 5.923 70.368 1.00 29.18 H new ATOM 0 HG12 ILE A 142 29.141 5.796 67.582 1.00 30.37 H new ATOM 0 HG13 ILE A 142 28.574 4.609 68.420 1.00 30.37 H new ATOM 0 HG21 ILE A 142 28.411 8.050 69.374 1.00 27.29 H new ATOM 0 HG22 ILE A 142 29.680 8.050 70.322 1.00 27.29 H new ATOM 0 HG23 ILE A 142 29.864 7.935 68.754 1.00 27.29 H new ATOM 0 HD11 ILE A 142 26.819 5.673 67.290 1.00 32.69 H new ATOM 0 HD12 ILE A 142 26.603 5.838 68.850 1.00 32.69 H new ATOM 0 HD13 ILE A 142 27.179 7.043 67.999 1.00 32.69 H new ATOM 1073 N CYS A 143 32.121 7.249 70.742 1.00 29.19 N ATOM 1074 CA CYS A 143 32.721 8.054 71.794 1.00 31.84 C ATOM 1075 C CYS A 143 33.178 9.352 71.156 1.00 31.77 C ATOM 1076 O CYS A 143 33.227 9.464 69.929 1.00 31.43 O ATOM 1077 CB CYS A 143 33.871 7.318 72.494 1.00 35.13 C ATOM 1078 SG CYS A 143 35.165 6.679 71.459 1.00 43.70 S ATOM 0 H CYS A 143 32.385 7.447 69.948 1.00 29.19 H new ATOM 0 HA CYS A 143 32.073 8.234 72.493 1.00 31.84 H new ATOM 0 HB2 CYS A 143 34.271 7.925 73.137 1.00 35.13 H new ATOM 0 HB3 CYS A 143 33.494 6.579 72.997 1.00 35.13 H new ATOM 0 HG CYS A 143 35.309 5.508 71.675 1.00 43.70 H new ATOM 1079 N PRO A 144 33.487 10.368 71.970 1.00 31.37 N ATOM 1080 CA PRO A 144 33.919 11.636 71.378 1.00 31.50 C ATOM 1081 C PRO A 144 35.289 11.610 70.713 1.00 30.91 C ATOM 1082 O PRO A 144 36.138 10.777 71.042 1.00 30.19 O ATOM 1083 CB PRO A 144 33.863 12.594 72.562 1.00 32.44 C ATOM 1084 CG PRO A 144 34.252 11.709 73.707 1.00 31.62 C ATOM 1085 CD PRO A 144 33.443 10.460 73.440 1.00 30.90 C ATOM 0 HA PRO A 144 33.351 11.890 70.634 1.00 31.50 H new ATOM 0 HB2 PRO A 144 34.476 13.338 72.455 1.00 32.44 H new ATOM 0 HB3 PRO A 144 32.977 12.971 72.681 1.00 32.44 H new ATOM 0 HG2 PRO A 144 35.205 11.528 73.716 1.00 31.62 H new ATOM 0 HG3 PRO A 144 34.031 12.107 74.563 1.00 31.62 H new ATOM 0 HD2 PRO A 144 33.832 9.679 73.864 1.00 30.90 H new ATOM 0 HD3 PRO A 144 32.535 10.539 73.771 1.00 30.90 H new ATOM 1086 N GLY A 145 35.483 12.527 69.767 1.00 31.26 N ATOM 1087 CA GLY A 145 36.757 12.648 69.073 1.00 31.84 C ATOM 1088 C GLY A 145 37.563 13.793 69.671 1.00 32.29 C ATOM 1089 O GLY A 145 37.114 14.427 70.634 1.00 31.51 O ATOM 0 H GLY A 145 34.885 13.090 69.513 1.00 31.26 H new ATOM 0 HA2 GLY A 145 37.255 11.819 69.146 1.00 31.84 H new ATOM 0 HA3 GLY A 145 36.606 12.806 68.128 1.00 31.84 H new HETATM 1090 N MSE A 146 38.743 14.070 69.117 1.00 32.98 N HETATM 1091 CA MSE A 146 39.591 15.158 69.626 1.00 34.19 C HETATM 1092 C MSE A 146 38.869 16.506 69.700 1.00 34.87 C HETATM 1093 O MSE A 146 39.004 17.238 70.678 1.00 34.45 O HETATM 1094 CB MSE A 146 40.845 15.331 68.758 1.00 36.01 C HETATM 1095 CG MSE A 146 41.849 14.181 68.816 1.00 39.56 C HETATM 1096 SE MSE A 146 42.552 13.831 70.600 1.00 47.04 SE HETATM 1097 CE MSE A 146 43.800 15.329 70.761 1.00 39.69 C HETATM 0 H MSE A 146 39.073 13.643 68.447 1.00 32.98 H new HETATM 0 HA MSE A 146 39.833 14.894 70.527 1.00 34.19 H new HETATM 0 HB2 MSE A 146 40.567 15.451 67.836 1.00 36.01 H new HETATM 0 HB3 MSE A 146 41.295 16.147 69.027 1.00 36.01 H new HETATM 0 HG2 MSE A 146 41.424 13.376 68.482 1.00 39.56 H new HETATM 0 HG3 MSE A 146 42.588 14.379 68.220 1.00 39.56 H new HETATM 0 HE1 MSE A 146 44.242 15.291 71.624 1.00 39.69 H new HETATM 0 HE2 MSE A 146 44.464 15.275 70.056 1.00 39.69 H new HETATM 0 HE3 MSE A 146 43.314 16.165 70.683 1.00 39.69 H new ATOM 1098 N THR A 147 38.108 16.832 68.662 1.00 36.12 N ATOM 1099 CA THR A 147 37.387 18.100 68.614 1.00 38.61 C ATOM 1100 C THR A 147 36.425 18.273 69.789 1.00 38.48 C ATOM 1101 O THR A 147 36.472 19.278 70.487 1.00 39.96 O ATOM 1102 CB THR A 147 36.597 18.231 67.302 1.00 41.45 C ATOM 1103 OG1 THR A 147 37.473 17.992 66.193 1.00 44.98 O ATOM 1104 CG2 THR A 147 36.002 19.624 67.171 1.00 41.97 C ATOM 0 H THR A 147 37.995 16.331 67.972 1.00 36.12 H new ATOM 0 HA THR A 147 38.061 18.796 68.668 1.00 38.61 H new ATOM 0 HB THR A 147 35.878 17.580 67.308 1.00 41.45 H new ATOM 0 HG1 THR A 147 37.042 18.062 65.475 1.00 44.98 H new ATOM 0 HG21 THR A 147 35.508 19.688 66.339 1.00 41.97 H new ATOM 0 HG22 THR A 147 35.403 19.792 67.916 1.00 41.97 H new ATOM 0 HG23 THR A 147 36.715 20.282 67.175 1.00 41.97 H new ATOM 1105 N LEU A 148 35.556 17.295 70.013 1.00 38.28 N ATOM 1106 CA LEU A 148 34.607 17.390 71.113 1.00 38.65 C ATOM 1107 C LEU A 148 35.307 17.422 72.466 1.00 39.66 C ATOM 1108 O LEU A 148 34.915 18.175 73.350 1.00 38.91 O ATOM 1109 CB LEU A 148 33.617 16.221 71.073 1.00 36.61 C ATOM 1110 CG LEU A 148 32.748 16.149 69.820 1.00 36.46 C ATOM 1111 CD1 LEU A 148 31.798 14.967 69.936 1.00 35.06 C ATOM 1112 CD2 LEU A 148 31.975 17.462 69.657 1.00 34.92 C ATOM 0 H LEU A 148 35.499 16.576 69.545 1.00 38.28 H new ATOM 0 HA LEU A 148 34.126 18.225 71.003 1.00 38.65 H new ATOM 0 HB2 LEU A 148 34.114 15.392 71.153 1.00 36.61 H new ATOM 0 HB3 LEU A 148 33.037 16.280 71.848 1.00 36.61 H new ATOM 0 HG LEU A 148 33.304 16.023 69.035 1.00 36.46 H new ATOM 0 HD11 LEU A 148 31.244 14.918 69.141 1.00 35.06 H new ATOM 0 HD12 LEU A 148 32.310 14.148 70.024 1.00 35.06 H new ATOM 0 HD13 LEU A 148 31.234 15.081 70.717 1.00 35.06 H new ATOM 0 HD21 LEU A 148 31.423 17.416 68.861 1.00 34.92 H new ATOM 0 HD22 LEU A 148 31.411 17.604 70.433 1.00 34.92 H new ATOM 0 HD23 LEU A 148 32.601 18.198 69.574 1.00 34.92 H new HETATM 1113 N MSE A 149 36.337 16.597 72.626 1.00 42.21 N HETATM 1114 CA MSE A 149 37.084 16.546 73.876 1.00 45.86 C HETATM 1115 C MSE A 149 37.784 17.874 74.156 1.00 49.11 C HETATM 1116 O MSE A 149 37.985 18.243 75.309 1.00 50.14 O HETATM 1117 CB MSE A 149 38.132 15.424 73.840 1.00 45.81 C HETATM 1118 CG MSE A 149 37.570 14.010 73.858 1.00 46.72 C HETATM 1119 SE MSE A 149 38.925 12.648 74.217 1.00 56.59 SE HETATM 1120 CE MSE A 149 39.313 12.132 72.395 1.00 44.32 C HETATM 0 H MSE A 149 36.620 16.057 72.020 1.00 42.21 H new HETATM 0 HA MSE A 149 36.446 16.369 74.585 1.00 45.86 H new HETATM 0 HB2 MSE A 149 38.672 15.532 73.042 1.00 45.81 H new HETATM 0 HB3 MSE A 149 38.725 15.531 74.600 1.00 45.81 H new HETATM 0 HG2 MSE A 149 36.876 13.953 74.533 1.00 46.72 H new HETATM 0 HG3 MSE A 149 37.151 13.824 73.003 1.00 46.72 H new HETATM 0 HE1 MSE A 149 39.991 11.438 72.392 1.00 44.32 H new HETATM 0 HE2 MSE A 149 38.506 11.796 71.975 1.00 44.32 H new HETATM 0 HE3 MSE A 149 39.637 12.902 71.902 1.00 44.32 H new ATOM 1121 N ARG A 150 38.154 18.589 73.100 1.00 52.66 N ATOM 1122 CA ARG A 150 38.841 19.868 73.249 1.00 56.82 C ATOM 1123 C ARG A 150 37.927 21.011 73.675 1.00 59.40 C ATOM 1124 O ARG A 150 38.084 21.565 74.763 1.00 60.38 O ATOM 1125 CB ARG A 150 39.542 20.247 71.943 1.00 56.45 C ATOM 1126 CG ARG A 150 40.811 19.460 71.674 1.00 58.42 C ATOM 1127 CD ARG A 150 41.319 19.671 70.256 1.00 57.70 C ATOM 1128 NE ARG A 150 42.538 18.906 70.015 1.00 59.32 N ATOM 1129 CZ ARG A 150 43.025 18.630 68.810 1.00 60.24 C ATOM 1130 NH1 ARG A 150 42.396 19.055 67.722 1.00 61.05 N ATOM 1131 NH2 ARG A 150 44.145 17.928 68.694 1.00 61.45 N ATOM 0 H ARG A 150 38.016 18.351 72.285 1.00 52.66 H new ATOM 0 HA ARG A 150 39.486 19.740 73.962 1.00 56.82 H new ATOM 0 HB2 ARG A 150 38.927 20.113 71.205 1.00 56.45 H new ATOM 0 HB3 ARG A 150 39.757 21.193 71.965 1.00 56.45 H new ATOM 0 HG2 ARG A 150 41.497 19.727 72.306 1.00 58.42 H new ATOM 0 HG3 ARG A 150 40.643 18.516 71.820 1.00 58.42 H new ATOM 0 HD2 ARG A 150 40.636 19.404 69.621 1.00 57.70 H new ATOM 0 HD3 ARG A 150 41.491 20.614 70.108 1.00 57.70 H new ATOM 0 HE ARG A 150 42.970 18.614 70.699 1.00 59.32 H new ATOM 0 HH11 ARG A 150 41.670 19.511 67.795 1.00 61.05 H new ATOM 0 HH12 ARG A 150 42.714 18.875 66.943 1.00 61.05 H new ATOM 0 HH21 ARG A 150 44.555 17.652 69.398 1.00 61.45 H new ATOM 0 HH22 ARG A 150 44.461 17.749 67.915 1.00 61.45 H new ATOM 1132 N SER A 151 36.976 21.357 72.812 1.00 61.67 N ATOM 1133 CA SER A 151 36.048 22.451 73.082 1.00 64.13 C ATOM 1134 C SER A 151 35.347 22.320 74.429 1.00 64.66 C ATOM 1135 O SER A 151 34.570 23.191 74.821 1.00 66.34 O ATOM 1136 CB SER A 151 34.999 22.548 71.964 1.00 64.44 C ATOM 1137 OG SER A 151 34.167 21.402 71.925 1.00 66.61 O ATOM 0 H SER A 151 36.851 20.966 72.056 1.00 61.67 H new ATOM 0 HA SER A 151 36.580 23.261 73.112 1.00 64.13 H new ATOM 0 HB2 SER A 151 34.454 23.339 72.099 1.00 64.44 H new ATOM 0 HB3 SER A 151 35.445 22.653 71.109 1.00 64.44 H new ATOM 0 HG SER A 151 33.605 21.485 71.307 1.00 66.61 H new ATOM 1138 N GLN A 152 35.629 21.235 75.138 1.00 65.04 N ATOM 1139 CA GLN A 152 35.015 20.999 76.434 1.00 65.29 C ATOM 1140 C GLN A 152 35.945 21.375 77.580 1.00 64.89 C ATOM 1141 O GLN A 152 35.509 21.937 78.586 1.00 64.85 O ATOM 1142 CB GLN A 152 34.632 19.527 76.564 1.00 66.76 C ATOM 1143 CG GLN A 152 33.836 19.207 77.811 1.00 69.56 C ATOM 1144 CD GLN A 152 32.463 19.834 77.785 1.00 70.51 C ATOM 1145 OE1 GLN A 152 32.330 21.056 77.729 1.00 73.06 O ATOM 1146 NE2 GLN A 152 31.429 18.999 77.819 1.00 71.26 N ATOM 0 H GLN A 152 36.176 20.622 74.884 1.00 65.04 H new ATOM 0 HA GLN A 152 34.225 21.559 76.489 1.00 65.29 H new ATOM 0 HB2 GLN A 152 34.115 19.267 75.786 1.00 66.76 H new ATOM 0 HB3 GLN A 152 35.440 18.990 76.560 1.00 66.76 H new ATOM 0 HG2 GLN A 152 33.749 18.245 77.900 1.00 69.56 H new ATOM 0 HG3 GLN A 152 34.319 19.521 78.591 1.00 69.56 H new ATOM 0 HE21 GLN A 152 31.563 18.150 77.858 1.00 71.26 H new ATOM 0 HE22 GLN A 152 30.626 19.308 77.802 1.00 71.26 H new ATOM 1147 N LEU A 153 37.227 21.062 77.419 1.00 63.72 N ATOM 1148 CA LEU A 153 38.225 21.328 78.449 1.00 62.67 C ATOM 1149 C LEU A 153 39.078 22.565 78.168 1.00 63.36 C ATOM 1150 O LEU A 153 39.985 22.888 78.937 1.00 63.23 O ATOM 1151 CB LEU A 153 39.130 20.100 78.606 1.00 60.14 C ATOM 1152 CG LEU A 153 38.425 18.789 78.974 1.00 57.37 C ATOM 1153 CD1 LEU A 153 39.335 17.608 78.695 1.00 55.92 C ATOM 1154 CD2 LEU A 153 38.014 18.824 80.436 1.00 55.57 C ATOM 0 H LEU A 153 37.542 20.690 76.711 1.00 63.72 H new ATOM 0 HA LEU A 153 37.741 21.509 79.270 1.00 62.67 H new ATOM 0 HB2 LEU A 153 39.611 19.966 77.774 1.00 60.14 H new ATOM 0 HB3 LEU A 153 39.792 20.293 79.288 1.00 60.14 H new ATOM 0 HG LEU A 153 37.628 18.689 78.430 1.00 57.37 H new ATOM 0 HD11 LEU A 153 38.879 16.785 78.931 1.00 55.92 H new ATOM 0 HD12 LEU A 153 39.564 17.591 77.753 1.00 55.92 H new ATOM 0 HD13 LEU A 153 40.145 17.691 79.223 1.00 55.92 H new ATOM 0 HD21 LEU A 153 37.568 17.994 80.667 1.00 55.57 H new ATOM 0 HD22 LEU A 153 38.802 18.933 80.991 1.00 55.57 H new ATOM 0 HD23 LEU A 153 37.409 19.568 80.585 1.00 55.57 H new ATOM 1155 N ARG A 154 38.785 23.256 77.070 1.00 63.61 N ATOM 1156 CA ARG A 154 39.534 24.455 76.706 1.00 64.20 C ATOM 1157 C ARG A 154 38.608 25.505 76.104 1.00 64.29 C ATOM 1158 O ARG A 154 38.682 25.680 74.869 1.00 64.64 O ATOM 1159 CB ARG A 154 40.645 24.101 75.715 1.00 63.01 C ATOM 0 H ARG A 154 38.156 23.047 76.522 1.00 63.61 H new ATOM 0 HA ARG A 154 39.934 24.823 77.509 1.00 64.20 H new ATOM 1160 N ASP A 164 46.395 25.148 65.333 1.00 61.15 N ATOM 1161 CA ASP A 164 46.571 23.752 64.836 1.00 61.92 C ATOM 1162 C ASP A 164 48.052 23.383 64.807 1.00 62.50 C ATOM 1163 O ASP A 164 48.432 22.255 65.130 1.00 62.14 O ATOM 1164 CB ASP A 164 45.969 23.616 63.445 1.00 61.17 C ATOM 0 HA ASP A 164 46.113 23.145 65.438 1.00 61.92 H new ATOM 1165 N ALA A 165 48.887 24.337 64.410 1.00 61.97 N ATOM 1166 CA ALA A 165 50.324 24.111 64.361 1.00 61.93 C ATOM 1167 C ALA A 165 50.852 24.171 65.792 1.00 61.48 C ATOM 1168 O ALA A 165 51.867 23.555 66.125 1.00 60.50 O ATOM 1169 CB ALA A 165 50.995 25.179 63.507 1.00 61.02 C ATOM 0 H ALA A 165 48.640 25.123 64.165 1.00 61.97 H new ATOM 0 HA ALA A 165 50.518 23.247 63.965 1.00 61.93 H new ATOM 0 HB1 ALA A 165 51.951 25.019 63.481 1.00 61.02 H new ATOM 0 HB2 ALA A 165 50.637 25.145 62.606 1.00 61.02 H new ATOM 0 HB3 ALA A 165 50.824 26.054 63.889 1.00 61.02 H new ATOM 1170 N GLU A 166 50.141 24.915 66.633 1.00 60.61 N ATOM 1171 CA GLU A 166 50.520 25.082 68.028 1.00 60.96 C ATOM 1172 C GLU A 166 50.100 23.860 68.849 1.00 60.77 C ATOM 1173 O GLU A 166 50.805 23.441 69.771 1.00 59.80 O ATOM 1174 CB GLU A 166 49.873 26.359 68.574 1.00 61.06 C ATOM 1175 CG GLU A 166 50.449 26.850 69.890 1.00 62.97 C ATOM 1176 CD GLU A 166 49.853 26.148 71.089 1.00 64.61 C ATOM 1177 OE1 GLU A 166 50.299 26.429 72.223 1.00 66.63 O ATOM 1178 OE2 GLU A 166 48.933 25.322 70.903 1.00 67.28 O ATOM 0 H GLU A 166 49.426 25.337 66.409 1.00 60.61 H new ATOM 0 HA GLU A 166 51.484 25.162 68.095 1.00 60.96 H new ATOM 0 HB2 GLU A 166 49.966 27.062 67.912 1.00 61.06 H new ATOM 0 HB3 GLU A 166 48.923 26.202 68.690 1.00 61.06 H new ATOM 0 HG2 GLU A 166 51.410 26.717 69.887 1.00 62.97 H new ATOM 0 HG3 GLU A 166 50.295 27.804 69.970 1.00 62.97 H new ATOM 1179 N ALA A 167 48.949 23.289 68.506 1.00 59.92 N ATOM 1180 CA ALA A 167 48.449 22.110 69.198 1.00 58.80 C ATOM 1181 C ALA A 167 49.347 20.938 68.831 1.00 58.61 C ATOM 1182 O ALA A 167 49.656 20.090 69.672 1.00 58.19 O ATOM 1183 CB ALA A 167 47.019 21.823 68.779 1.00 58.55 C ATOM 0 H ALA A 167 48.442 23.572 67.872 1.00 59.92 H new ATOM 0 HA ALA A 167 48.457 22.254 70.157 1.00 58.80 H new ATOM 0 HB1 ALA A 167 46.697 21.036 69.246 1.00 58.55 H new ATOM 0 HB2 ALA A 167 46.458 22.583 69.001 1.00 58.55 H new ATOM 0 HB3 ALA A 167 46.987 21.666 67.822 1.00 58.55 H new ATOM 1184 N ARG A 168 49.770 20.903 67.569 1.00 56.70 N ATOM 1185 CA ARG A 168 50.641 19.842 67.088 1.00 55.53 C ATOM 1186 C ARG A 168 51.958 19.917 67.838 1.00 53.67 C ATOM 1187 O ARG A 168 52.690 18.929 67.925 1.00 53.38 O ATOM 1188 CB ARG A 168 50.880 19.987 65.584 1.00 56.68 C ATOM 0 H ARG A 168 49.561 21.489 66.975 1.00 56.70 H new ATOM 0 HA ARG A 168 50.222 18.981 67.244 1.00 55.53 H new ATOM 1189 N ARG A 169 52.257 21.098 68.375 1.00 51.54 N ATOM 1190 CA ARG A 169 53.484 21.296 69.134 1.00 50.06 C ATOM 1191 C ARG A 169 53.332 20.691 70.525 1.00 46.46 C ATOM 1192 O ARG A 169 54.254 20.061 71.041 1.00 44.32 O ATOM 1193 CB ARG A 169 53.825 22.786 69.211 1.00 53.30 C ATOM 1194 CG ARG A 169 54.633 23.271 68.004 1.00 58.92 C ATOM 1195 CD ARG A 169 54.226 24.665 67.563 1.00 62.55 C ATOM 1196 NE ARG A 169 54.268 25.623 68.662 1.00 66.02 N ATOM 1197 CZ ARG A 169 53.725 26.833 68.608 1.00 66.64 C ATOM 1198 NH1 ARG A 169 53.101 27.229 67.504 1.00 67.19 N ATOM 1199 NH2 ARG A 169 53.795 27.640 69.658 1.00 67.37 N ATOM 0 H ARG A 169 51.760 21.797 68.310 1.00 51.54 H new ATOM 0 HA ARG A 169 54.217 20.847 68.684 1.00 50.06 H new ATOM 0 HB2 ARG A 169 53.004 23.299 69.273 1.00 53.30 H new ATOM 0 HB3 ARG A 169 54.328 22.957 70.022 1.00 53.30 H new ATOM 0 HG2 ARG A 169 55.577 23.267 68.226 1.00 58.92 H new ATOM 0 HG3 ARG A 169 54.512 22.652 67.267 1.00 58.92 H new ATOM 0 HD2 ARG A 169 54.816 24.963 66.853 1.00 62.55 H new ATOM 0 HD3 ARG A 169 53.329 24.637 67.194 1.00 62.55 H new ATOM 0 HE ARG A 169 54.668 25.390 69.387 1.00 66.02 H new ATOM 0 HH11 ARG A 169 53.050 26.702 66.827 1.00 67.19 H new ATOM 0 HH12 ARG A 169 52.748 28.013 67.467 1.00 67.19 H new ATOM 0 HH21 ARG A 169 54.193 27.380 70.375 1.00 67.37 H new ATOM 0 HH22 ARG A 169 53.443 28.424 69.622 1.00 67.37 H new ATOM 1200 N ALA A 170 52.158 20.868 71.120 1.00 42.86 N ATOM 1201 CA ALA A 170 51.893 20.299 72.433 1.00 41.75 C ATOM 1202 C ALA A 170 51.929 18.777 72.297 1.00 40.20 C ATOM 1203 O ALA A 170 52.311 18.073 73.225 1.00 40.42 O ATOM 1204 CB ALA A 170 50.524 20.747 72.935 1.00 41.00 C ATOM 0 H ALA A 170 51.504 21.313 70.781 1.00 42.86 H new ATOM 0 HA ALA A 170 52.559 20.599 73.071 1.00 41.75 H new ATOM 0 HB1 ALA A 170 50.358 20.362 73.810 1.00 41.00 H new ATOM 0 HB2 ALA A 170 50.503 21.715 72.999 1.00 41.00 H new ATOM 0 HB3 ALA A 170 49.839 20.449 72.316 1.00 41.00 H new ATOM 1205 N LEU A 171 51.546 18.281 71.125 1.00 38.09 N ATOM 1206 CA LEU A 171 51.524 16.845 70.869 1.00 38.12 C ATOM 1207 C LEU A 171 52.856 16.265 70.397 1.00 38.14 C ATOM 1208 O LEU A 171 52.928 15.093 70.030 1.00 36.55 O ATOM 1209 CB LEU A 171 50.433 16.514 69.846 1.00 38.36 C ATOM 1210 CG LEU A 171 48.991 16.787 70.293 1.00 38.44 C ATOM 1211 CD1 LEU A 171 48.024 16.348 69.205 1.00 38.28 C ATOM 1212 CD2 LEU A 171 48.701 16.026 71.586 1.00 37.75 C ATOM 0 H LEU A 171 51.293 18.764 70.460 1.00 38.09 H new ATOM 0 HA LEU A 171 51.337 16.430 71.725 1.00 38.12 H new ATOM 0 HB2 LEU A 171 50.605 17.024 69.039 1.00 38.36 H new ATOM 0 HB3 LEU A 171 50.508 15.576 69.611 1.00 38.36 H new ATOM 0 HG LEU A 171 48.879 17.737 70.451 1.00 38.44 H new ATOM 0 HD11 LEU A 171 47.114 16.522 69.491 1.00 38.28 H new ATOM 0 HD12 LEU A 171 48.207 16.842 68.391 1.00 38.28 H new ATOM 0 HD13 LEU A 171 48.134 15.399 69.038 1.00 38.28 H new ATOM 0 HD21 LEU A 171 47.789 16.200 71.867 1.00 37.75 H new ATOM 0 HD22 LEU A 171 48.816 15.075 71.435 1.00 37.75 H new ATOM 0 HD23 LEU A 171 49.313 16.319 72.279 1.00 37.75 H new ATOM 1213 N ALA A 172 53.911 17.076 70.419 1.00 37.83 N ATOM 1214 CA ALA A 172 55.230 16.615 69.994 1.00 37.52 C ATOM 1215 C ALA A 172 55.735 15.512 70.918 1.00 37.68 C ATOM 1216 O ALA A 172 56.667 14.778 70.587 1.00 38.95 O ATOM 1217 CB ALA A 172 56.215 17.784 69.984 1.00 38.89 C ATOM 0 H ALA A 172 53.884 17.896 70.676 1.00 37.83 H new ATOM 0 HA ALA A 172 55.157 16.255 69.096 1.00 37.52 H new ATOM 0 HB1 ALA A 172 57.088 17.470 69.701 1.00 38.89 H new ATOM 0 HB2 ALA A 172 55.902 18.466 69.369 1.00 38.89 H new ATOM 0 HB3 ALA A 172 56.281 18.160 70.876 1.00 38.89 H new ATOM 1218 N SER A 173 55.122 15.408 72.087 1.00 35.73 N ATOM 1219 CA SER A 173 55.499 14.388 73.052 1.00 35.42 C ATOM 1220 C SER A 173 54.246 13.939 73.791 1.00 34.99 C ATOM 1221 O SER A 173 53.305 14.717 73.953 1.00 35.34 O ATOM 1222 CB SER A 173 56.514 14.947 74.055 1.00 34.91 C ATOM 1223 OG SER A 173 56.959 13.933 74.941 1.00 33.39 O ATOM 0 H SER A 173 54.481 15.922 72.342 1.00 35.73 H new ATOM 0 HA SER A 173 55.907 13.639 72.590 1.00 35.42 H new ATOM 0 HB2 SER A 173 57.272 15.322 73.579 1.00 34.91 H new ATOM 0 HB3 SER A 173 56.111 15.670 74.561 1.00 34.91 H new ATOM 0 HG SER A 173 57.515 14.257 75.481 1.00 33.39 H new ATOM 1224 N LEU A 174 54.224 12.690 74.232 1.00 33.72 N ATOM 1225 CA LEU A 174 53.066 12.206 74.966 1.00 35.73 C ATOM 1226 C LEU A 174 53.422 12.010 76.434 1.00 35.30 C ATOM 1227 O LEU A 174 52.666 11.410 77.196 1.00 35.90 O ATOM 1228 CB LEU A 174 52.523 10.909 74.342 1.00 34.11 C ATOM 1229 CG LEU A 174 51.816 11.161 73.001 1.00 35.95 C ATOM 1230 CD1 LEU A 174 51.309 9.859 72.389 1.00 35.20 C ATOM 1231 CD2 LEU A 174 50.660 12.126 73.226 1.00 34.08 C ATOM 0 H LEU A 174 54.855 12.117 74.120 1.00 33.72 H new ATOM 0 HA LEU A 174 52.362 12.871 74.911 1.00 35.73 H new ATOM 0 HB2 LEU A 174 53.254 10.286 74.208 1.00 34.11 H new ATOM 0 HB3 LEU A 174 51.903 10.490 74.959 1.00 34.11 H new ATOM 0 HG LEU A 174 52.451 11.547 72.378 1.00 35.95 H new ATOM 0 HD11 LEU A 174 50.868 10.048 71.546 1.00 35.20 H new ATOM 0 HD12 LEU A 174 52.057 9.260 72.236 1.00 35.20 H new ATOM 0 HD13 LEU A 174 50.679 9.440 72.996 1.00 35.20 H new ATOM 0 HD21 LEU A 174 50.207 12.291 72.384 1.00 34.08 H new ATOM 0 HD22 LEU A 174 50.034 11.740 73.859 1.00 34.08 H new ATOM 0 HD23 LEU A 174 51.001 12.963 73.579 1.00 34.08 H new ATOM 1232 N GLN A 175 54.581 12.533 76.821 1.00 34.79 N ATOM 1233 CA GLN A 175 55.025 12.446 78.204 1.00 35.21 C ATOM 1234 C GLN A 175 54.158 13.382 79.044 1.00 31.74 C ATOM 1235 O GLN A 175 53.437 14.214 78.509 1.00 31.12 O ATOM 1236 CB GLN A 175 56.512 12.822 78.319 1.00 38.11 C ATOM 1237 CG GLN A 175 57.427 11.846 77.580 1.00 43.12 C ATOM 1238 CD GLN A 175 58.735 11.571 78.306 1.00 46.73 C ATOM 1239 OE1 GLN A 175 58.902 12.162 79.484 1.00 49.85 O flip ATOM 1240 NE2 GLN A 175 59.582 10.827 77.811 1.00 47.10 N flip ATOM 0 H GLN A 175 55.125 12.943 76.296 1.00 34.79 H new ATOM 0 HA GLN A 175 54.932 11.536 78.527 1.00 35.21 H new ATOM 0 HB2 GLN A 175 56.644 13.715 77.964 1.00 38.11 H new ATOM 0 HB3 GLN A 175 56.763 12.849 79.255 1.00 38.11 H new ATOM 0 HG2 GLN A 175 56.956 11.008 77.449 1.00 43.12 H new ATOM 0 HG3 GLN A 175 57.623 12.202 76.699 1.00 43.12 H new ATOM 0 HE21 GLN A 175 59.439 10.462 77.046 1.00 47.10 H new ATOM 0 HE22 GLN A 175 60.317 10.673 78.231 1.00 47.10 H new ATOM 1241 N PRO A 176 54.215 13.251 80.373 1.00 30.98 N ATOM 1242 CA PRO A 176 53.411 14.099 81.259 1.00 31.12 C ATOM 1243 C PRO A 176 53.493 15.588 80.938 1.00 31.45 C ATOM 1244 O PRO A 176 54.575 16.129 80.713 1.00 33.26 O ATOM 1245 CB PRO A 176 53.969 13.776 82.643 1.00 30.70 C ATOM 1246 CG PRO A 176 54.389 12.343 82.499 1.00 31.59 C ATOM 1247 CD PRO A 176 55.068 12.336 81.149 1.00 29.19 C ATOM 0 HA PRO A 176 52.463 13.916 81.169 1.00 31.12 H new ATOM 0 HB2 PRO A 176 54.716 14.350 82.874 1.00 30.70 H new ATOM 0 HB3 PRO A 176 53.301 13.888 83.337 1.00 30.70 H new ATOM 0 HG2 PRO A 176 54.992 12.070 83.208 1.00 31.59 H new ATOM 0 HG3 PRO A 176 53.630 11.740 82.525 1.00 31.59 H new ATOM 0 HD2 PRO A 176 55.984 12.650 81.202 1.00 29.19 H new ATOM 0 HD3 PRO A 176 55.095 11.448 80.761 1.00 29.19 H new ATOM 1248 N GLY A 177 52.341 16.245 80.915 1.00 31.15 N ATOM 1249 CA GLY A 177 52.309 17.667 80.640 1.00 29.78 C ATOM 1250 C GLY A 177 52.689 18.477 81.868 1.00 31.56 C ATOM 1251 O GLY A 177 52.382 18.089 83.004 1.00 28.63 O ATOM 0 H GLY A 177 51.572 15.886 81.056 1.00 31.15 H new ATOM 0 HA2 GLY A 177 52.919 17.872 79.914 1.00 29.78 H new ATOM 0 HA3 GLY A 177 51.421 17.921 80.345 1.00 29.78 H new ATOM 1252 N GLN A 178 53.355 19.608 81.645 1.00 31.28 N ATOM 1253 CA GLN A 178 53.770 20.465 82.742 1.00 32.36 C ATOM 1254 C GLN A 178 53.114 21.824 82.618 1.00 33.18 C ATOM 1255 O GLN A 178 53.523 22.798 83.251 1.00 34.48 O ATOM 1256 CB GLN A 178 55.287 20.580 82.752 1.00 34.78 C ATOM 1257 CG GLN A 178 55.946 19.230 82.980 1.00 38.70 C ATOM 1258 CD GLN A 178 57.454 19.289 82.974 1.00 42.31 C ATOM 1259 OE1 GLN A 178 58.011 20.250 82.245 1.00 45.58 O flip ATOM 1260 NE2 GLN A 178 58.116 18.470 83.615 1.00 42.36 N flip ATOM 0 H GLN A 178 53.575 19.894 80.864 1.00 31.28 H new ATOM 0 HA GLN A 178 53.488 20.076 83.585 1.00 32.36 H new ATOM 0 HB2 GLN A 178 55.590 20.951 81.909 1.00 34.78 H new ATOM 0 HB3 GLN A 178 55.561 21.197 83.448 1.00 34.78 H new ATOM 0 HG2 GLN A 178 55.647 18.871 83.830 1.00 38.70 H new ATOM 0 HG3 GLN A 178 55.651 18.613 82.292 1.00 38.70 H new ATOM 0 HE21 GLN A 178 57.719 17.862 84.075 1.00 42.36 H new ATOM 0 HE22 GLN A 178 58.975 18.507 83.602 1.00 42.36 H new ATOM 1261 N ALA A 179 52.073 21.862 81.797 1.00 32.56 N ATOM 1262 CA ALA A 179 51.301 23.067 81.552 1.00 33.10 C ATOM 1263 C ALA A 179 49.925 22.620 81.076 1.00 34.21 C ATOM 1264 O ALA A 179 49.783 21.560 80.472 1.00 35.10 O ATOM 1265 CB ALA A 179 51.985 23.933 80.481 1.00 30.57 C ATOM 0 H ALA A 179 51.792 21.176 81.360 1.00 32.56 H new ATOM 0 HA ALA A 179 51.231 23.604 82.357 1.00 33.10 H new ATOM 0 HB1 ALA A 179 51.459 24.734 80.328 1.00 30.57 H new ATOM 0 HB2 ALA A 179 52.872 24.182 80.784 1.00 30.57 H new ATOM 0 HB3 ALA A 179 52.056 23.430 79.655 1.00 30.57 H new ATOM 1266 N THR A 180 48.921 23.439 81.351 1.00 36.49 N ATOM 1267 CA THR A 180 47.542 23.157 80.984 1.00 35.89 C ATOM 1268 C THR A 180 47.346 22.662 79.556 1.00 37.86 C ATOM 1269 O THR A 180 46.759 21.599 79.340 1.00 38.83 O ATOM 1270 CB THR A 180 46.666 24.414 81.220 1.00 38.16 C ATOM 1271 OG1 THR A 180 46.548 24.642 82.632 1.00 38.67 O ATOM 1272 CG2 THR A 180 45.276 24.238 80.621 1.00 40.61 C ATOM 0 H THR A 180 49.023 24.187 81.763 1.00 36.49 H new ATOM 0 HA THR A 180 47.268 22.424 81.558 1.00 35.89 H new ATOM 0 HB THR A 180 47.090 25.172 80.787 1.00 38.16 H new ATOM 0 HG1 THR A 180 46.075 25.323 82.768 1.00 38.67 H new ATOM 0 HG21 THR A 180 44.750 25.037 80.783 1.00 40.61 H new ATOM 0 HG22 THR A 180 45.352 24.089 79.665 1.00 40.61 H new ATOM 0 HG23 THR A 180 44.840 23.476 81.033 1.00 40.61 H new ATOM 1273 N ALA A 181 47.828 23.425 78.581 1.00 37.90 N ATOM 1274 CA ALA A 181 47.669 23.042 77.181 1.00 37.24 C ATOM 1275 C ALA A 181 48.226 21.652 76.906 1.00 36.27 C ATOM 1276 O ALA A 181 47.581 20.846 76.235 1.00 37.68 O ATOM 1277 CB ALA A 181 48.342 24.060 76.274 1.00 37.96 C ATOM 0 H ALA A 181 48.248 24.165 78.707 1.00 37.90 H new ATOM 0 HA ALA A 181 46.718 23.022 76.993 1.00 37.24 H new ATOM 0 HB1 ALA A 181 48.229 23.794 75.348 1.00 37.96 H new ATOM 0 HB2 ALA A 181 47.939 24.932 76.411 1.00 37.96 H new ATOM 0 HB3 ALA A 181 49.288 24.105 76.484 1.00 37.96 H new ATOM 1278 N GLU A 182 49.416 21.373 77.429 1.00 35.54 N ATOM 1279 CA GLU A 182 50.053 20.073 77.236 1.00 33.84 C ATOM 1280 C GLU A 182 49.271 18.931 77.891 1.00 32.79 C ATOM 1281 O GLU A 182 49.092 17.867 77.288 1.00 30.95 O ATOM 1282 CB GLU A 182 51.478 20.077 77.809 1.00 38.94 C ATOM 1283 CG GLU A 182 52.486 20.943 77.055 1.00 46.45 C ATOM 1284 CD GLU A 182 53.877 20.959 77.704 1.00 51.26 C ATOM 1285 OE1 GLU A 182 54.787 21.575 77.104 1.00 55.10 O ATOM 1286 OE2 GLU A 182 54.069 20.374 78.802 1.00 47.11 O ATOM 0 H GLU A 182 49.874 21.926 77.902 1.00 35.54 H new ATOM 0 HA GLU A 182 50.073 19.922 76.278 1.00 33.84 H new ATOM 0 HB2 GLU A 182 51.439 20.380 78.730 1.00 38.94 H new ATOM 0 HB3 GLU A 182 51.806 19.164 77.824 1.00 38.94 H new ATOM 0 HG2 GLU A 182 52.565 20.618 76.144 1.00 46.45 H new ATOM 0 HG3 GLU A 182 52.149 21.851 77.004 1.00 46.45 H new ATOM 1287 N ALA A 183 48.818 19.149 79.126 1.00 28.93 N ATOM 1288 CA ALA A 183 48.083 18.117 79.854 1.00 27.96 C ATOM 1289 C ALA A 183 46.829 17.668 79.111 1.00 26.99 C ATOM 1290 O ALA A 183 46.602 16.480 78.963 1.00 28.11 O ATOM 1291 CB ALA A 183 47.711 18.614 81.247 1.00 24.67 C ATOM 0 H ALA A 183 48.926 19.885 79.558 1.00 28.93 H new ATOM 0 HA ALA A 183 48.670 17.348 79.929 1.00 27.96 H new ATOM 0 HB1 ALA A 183 47.224 17.920 81.719 1.00 24.67 H new ATOM 0 HB2 ALA A 183 48.518 18.834 81.739 1.00 24.67 H new ATOM 0 HB3 ALA A 183 47.154 19.404 81.171 1.00 24.67 H new ATOM 1292 N VAL A 184 46.040 18.633 78.644 1.00 26.67 N ATOM 1293 CA VAL A 184 44.797 18.384 77.926 1.00 26.75 C ATOM 1294 C VAL A 184 44.980 17.699 76.572 1.00 29.70 C ATOM 1295 O VAL A 184 44.344 16.673 76.300 1.00 29.39 O ATOM 1296 CB VAL A 184 44.032 19.709 77.705 1.00 26.43 C ATOM 1297 CG1 VAL A 184 42.823 19.480 76.817 1.00 26.25 C ATOM 1298 CG2 VAL A 184 43.617 20.292 79.042 1.00 23.18 C ATOM 0 H VAL A 184 46.218 19.469 78.739 1.00 26.67 H new ATOM 0 HA VAL A 184 44.295 17.775 78.489 1.00 26.75 H new ATOM 0 HB VAL A 184 44.616 20.342 77.259 1.00 26.43 H new ATOM 0 HG11 VAL A 184 42.353 20.319 76.687 1.00 26.25 H new ATOM 0 HG12 VAL A 184 43.113 19.136 75.958 1.00 26.25 H new ATOM 0 HG13 VAL A 184 42.229 18.839 77.238 1.00 26.25 H new ATOM 0 HG21 VAL A 184 43.138 21.123 78.898 1.00 23.18 H new ATOM 0 HG22 VAL A 184 43.042 19.663 79.505 1.00 23.18 H new ATOM 0 HG23 VAL A 184 44.406 20.463 79.579 1.00 23.18 H new ATOM 1299 N GLU A 185 45.831 18.279 75.723 1.00 28.19 N ATOM 1300 CA GLU A 185 46.099 17.732 74.395 1.00 28.45 C ATOM 1301 C GLU A 185 46.684 16.321 74.463 1.00 28.60 C ATOM 1302 O GLU A 185 46.264 15.424 73.729 1.00 28.90 O ATOM 1303 CB GLU A 185 47.079 18.632 73.631 1.00 30.91 C ATOM 1304 CG GLU A 185 46.538 19.994 73.258 1.00 35.07 C ATOM 1305 CD GLU A 185 45.355 19.906 72.310 1.00 39.27 C ATOM 1306 OE1 GLU A 185 45.461 19.206 71.281 1.00 40.96 O ATOM 1307 OE2 GLU A 185 44.319 20.541 72.591 1.00 42.67 O ATOM 0 H GLU A 185 46.267 18.998 75.902 1.00 28.19 H new ATOM 0 HA GLU A 185 45.247 17.693 73.932 1.00 28.45 H new ATOM 0 HB2 GLU A 185 47.875 18.752 74.172 1.00 30.91 H new ATOM 0 HB3 GLU A 185 47.353 18.175 72.821 1.00 30.91 H new ATOM 0 HG2 GLU A 185 46.270 20.465 74.063 1.00 35.07 H new ATOM 0 HG3 GLU A 185 47.243 20.517 72.845 1.00 35.07 H new ATOM 1308 N ARG A 186 47.675 16.128 75.322 1.00 27.78 N ATOM 1309 CA ARG A 186 48.286 14.810 75.445 1.00 29.01 C ATOM 1310 C ARG A 186 47.333 13.846 76.157 1.00 29.18 C ATOM 1311 O ARG A 186 47.300 12.658 75.849 1.00 27.77 O ATOM 1312 CB ARG A 186 49.612 14.915 76.201 1.00 29.53 C ATOM 1313 CG ARG A 186 50.630 15.825 75.516 1.00 30.62 C ATOM 1314 CD ARG A 186 51.875 16.027 76.372 1.00 32.50 C ATOM 1315 NE ARG A 186 52.820 16.953 75.750 1.00 34.07 N ATOM 1316 CZ ARG A 186 53.995 17.289 76.275 1.00 34.55 C ATOM 1317 NH1 ARG A 186 54.381 16.777 77.437 1.00 33.02 N ATOM 1318 NH2 ARG A 186 54.785 18.145 75.641 1.00 34.04 N ATOM 0 H ARG A 186 48.005 16.734 75.835 1.00 27.78 H new ATOM 0 HA ARG A 186 48.463 14.462 74.557 1.00 29.01 H new ATOM 0 HB2 ARG A 186 49.441 15.248 77.096 1.00 29.53 H new ATOM 0 HB3 ARG A 186 49.993 14.028 76.296 1.00 29.53 H new ATOM 0 HG2 ARG A 186 50.883 15.441 74.662 1.00 30.62 H new ATOM 0 HG3 ARG A 186 50.222 16.685 75.331 1.00 30.62 H new ATOM 0 HD2 ARG A 186 51.616 16.366 77.243 1.00 32.50 H new ATOM 0 HD3 ARG A 186 52.309 15.172 76.518 1.00 32.50 H new ATOM 0 HE ARG A 186 52.602 17.303 74.995 1.00 34.07 H new ATOM 0 HH11 ARG A 186 53.871 16.225 77.854 1.00 33.02 H new ATOM 0 HH12 ARG A 186 55.142 16.997 77.772 1.00 33.02 H new ATOM 0 HH21 ARG A 186 54.538 18.483 74.890 1.00 34.04 H new ATOM 0 HH22 ARG A 186 55.545 18.362 75.981 1.00 34.04 H new ATOM 1319 N GLY A 187 46.550 14.369 77.097 1.00 28.58 N ATOM 1320 CA GLY A 187 45.613 13.529 77.820 1.00 28.12 C ATOM 1321 C GLY A 187 44.595 12.938 76.863 1.00 27.84 C ATOM 1322 O GLY A 187 44.405 11.727 76.805 1.00 27.50 O ATOM 0 H GLY A 187 46.548 15.198 77.326 1.00 28.58 H new ATOM 0 HA2 GLY A 187 46.090 12.818 78.275 1.00 28.12 H new ATOM 0 HA3 GLY A 187 45.161 14.050 78.503 1.00 28.12 H new ATOM 1323 N CYS A 188 43.962 13.811 76.090 1.00 28.45 N ATOM 1324 CA CYS A 188 42.956 13.411 75.130 1.00 28.43 C ATOM 1325 C CYS A 188 43.489 12.504 74.011 1.00 28.98 C ATOM 1326 O CYS A 188 42.802 11.558 73.602 1.00 27.18 O ATOM 1327 CB CYS A 188 42.294 14.660 74.544 1.00 29.60 C ATOM 1328 SG CYS A 188 41.298 15.564 75.767 1.00 35.67 S ATOM 0 H CYS A 188 44.109 14.658 76.111 1.00 28.45 H new ATOM 0 HA CYS A 188 42.305 12.875 75.609 1.00 28.43 H new ATOM 0 HB2 CYS A 188 42.979 15.249 74.191 1.00 29.60 H new ATOM 0 HB3 CYS A 188 41.729 14.403 73.799 1.00 29.60 H new ATOM 0 HG CYS A 188 42.003 16.316 76.381 1.00 35.67 H new ATOM 1329 N LEU A 189 44.693 12.785 73.510 1.00 25.85 N ATOM 1330 CA LEU A 189 45.260 11.940 72.463 1.00 27.32 C ATOM 1331 C LEU A 189 45.560 10.545 73.046 1.00 27.18 C ATOM 1332 O LEU A 189 45.369 9.537 72.376 1.00 27.57 O ATOM 1333 CB LEU A 189 46.555 12.540 71.901 1.00 27.00 C ATOM 1334 CG LEU A 189 46.918 12.225 70.442 1.00 31.48 C ATOM 1335 CD1 LEU A 189 48.430 12.249 70.280 1.00 30.02 C ATOM 1336 CD2 LEU A 189 46.367 10.877 70.012 1.00 28.62 C ATOM 0 H LEU A 189 45.186 13.445 73.757 1.00 25.85 H new ATOM 0 HA LEU A 189 44.616 11.876 71.741 1.00 27.32 H new ATOM 0 HB2 LEU A 189 46.501 13.504 71.993 1.00 27.00 H new ATOM 0 HB3 LEU A 189 47.289 12.242 72.461 1.00 27.00 H new ATOM 0 HG LEU A 189 46.517 12.901 69.874 1.00 31.48 H new ATOM 0 HD11 LEU A 189 48.660 12.050 69.359 1.00 30.02 H new ATOM 0 HD12 LEU A 189 48.767 13.128 70.515 1.00 30.02 H new ATOM 0 HD13 LEU A 189 48.829 11.584 70.863 1.00 30.02 H new ATOM 0 HD21 LEU A 189 46.612 10.707 69.089 1.00 28.62 H new ATOM 0 HD22 LEU A 189 46.736 10.181 70.578 1.00 28.62 H new ATOM 0 HD23 LEU A 189 45.400 10.881 70.094 1.00 28.62 H new ATOM 1337 N LEU A 190 46.035 10.486 74.288 1.00 27.43 N ATOM 1338 CA LEU A 190 46.318 9.191 74.905 1.00 30.42 C ATOM 1339 C LEU A 190 45.027 8.415 75.138 1.00 30.60 C ATOM 1340 O LEU A 190 45.017 7.187 75.138 1.00 32.11 O ATOM 1341 CB LEU A 190 47.052 9.357 76.237 1.00 27.66 C ATOM 1342 CG LEU A 190 48.539 9.712 76.149 1.00 29.05 C ATOM 1343 CD1 LEU A 190 49.071 10.002 77.535 1.00 29.09 C ATOM 1344 CD2 LEU A 190 49.311 8.566 75.498 1.00 30.10 C ATOM 0 H LEU A 190 46.198 11.170 74.783 1.00 27.43 H new ATOM 0 HA LEU A 190 46.888 8.698 74.294 1.00 30.42 H new ATOM 0 HB2 LEU A 190 46.603 10.048 76.749 1.00 27.66 H new ATOM 0 HB3 LEU A 190 46.965 8.531 76.738 1.00 27.66 H new ATOM 0 HG LEU A 190 48.653 10.504 75.600 1.00 29.05 H new ATOM 0 HD11 LEU A 190 50.013 10.227 77.480 1.00 29.09 H new ATOM 0 HD12 LEU A 190 48.583 10.747 77.920 1.00 29.09 H new ATOM 0 HD13 LEU A 190 48.959 9.218 78.096 1.00 29.09 H new ATOM 0 HD21 LEU A 190 50.251 8.798 75.446 1.00 30.10 H new ATOM 0 HD22 LEU A 190 49.206 7.762 76.030 1.00 30.10 H new ATOM 0 HD23 LEU A 190 48.967 8.410 74.605 1.00 30.10 H new HETATM 1345 N MSE A 191 43.940 9.143 75.336 1.00 31.55 N HETATM 1346 CA MSE A 191 42.651 8.520 75.561 1.00 31.95 C HETATM 1347 C MSE A 191 42.189 7.949 74.227 1.00 31.56 C HETATM 1348 O MSE A 191 41.675 6.832 74.159 1.00 32.45 O HETATM 1349 CB MSE A 191 41.656 9.560 76.093 1.00 33.89 C HETATM 1350 CG MSE A 191 40.226 9.061 76.182 1.00 36.98 C HETATM 1351 SE MSE A 191 39.114 10.080 77.405 1.00 45.05 SE HETATM 1352 CE MSE A 191 39.504 9.076 79.005 1.00 39.69 C HETATM 0 H MSE A 191 43.929 10.003 75.344 1.00 31.55 H new HETATM 0 HA MSE A 191 42.711 7.813 76.222 1.00 31.95 H new HETATM 0 HB2 MSE A 191 41.943 9.847 76.974 1.00 33.89 H new HETATM 0 HB3 MSE A 191 41.681 10.341 75.518 1.00 33.89 H new HETATM 0 HG2 MSE A 191 39.828 9.087 75.298 1.00 36.98 H new HETATM 0 HG3 MSE A 191 40.233 8.132 76.462 1.00 36.98 H new HETATM 0 HE1 MSE A 191 39.016 9.456 79.753 1.00 39.69 H new HETATM 0 HE2 MSE A 191 39.236 8.152 78.881 1.00 39.69 H new HETATM 0 HE3 MSE A 191 40.456 9.115 79.188 1.00 39.69 H new ATOM 1353 N LEU A 192 42.394 8.716 73.163 1.00 29.09 N ATOM 1354 CA LEU A 192 42.019 8.269 71.832 1.00 30.43 C ATOM 1355 C LEU A 192 42.879 7.062 71.433 1.00 29.55 C ATOM 1356 O LEU A 192 42.364 6.057 70.929 1.00 29.49 O ATOM 1357 CB LEU A 192 42.209 9.409 70.825 1.00 33.46 C ATOM 1358 CG LEU A 192 41.778 9.125 69.385 1.00 36.21 C ATOM 1359 CD1 LEU A 192 40.291 8.853 69.364 1.00 37.80 C ATOM 1360 CD2 LEU A 192 42.119 10.313 68.480 1.00 34.24 C ATOM 0 H LEU A 192 42.749 9.499 73.192 1.00 29.09 H new ATOM 0 HA LEU A 192 41.085 8.007 71.833 1.00 30.43 H new ATOM 0 HB2 LEU A 192 41.715 10.181 71.143 1.00 33.46 H new ATOM 0 HB3 LEU A 192 43.147 9.655 70.818 1.00 33.46 H new ATOM 0 HG LEU A 192 42.254 8.349 69.051 1.00 36.21 H new ATOM 0 HD11 LEU A 192 40.008 8.672 68.454 1.00 37.80 H new ATOM 0 HD12 LEU A 192 40.094 8.085 69.923 1.00 37.80 H new ATOM 0 HD13 LEU A 192 39.815 9.628 69.702 1.00 37.80 H new ATOM 0 HD21 LEU A 192 41.840 10.118 67.572 1.00 34.24 H new ATOM 0 HD22 LEU A 192 41.657 11.105 68.797 1.00 34.24 H new ATOM 0 HD23 LEU A 192 43.076 10.469 68.498 1.00 34.24 H new ATOM 1361 N ARG A 193 44.187 7.159 71.650 1.00 26.80 N ATOM 1362 CA ARG A 193 45.076 6.047 71.307 1.00 28.74 C ATOM 1363 C ARG A 193 44.707 4.811 72.137 1.00 28.07 C ATOM 1364 O ARG A 193 44.792 3.686 71.649 1.00 28.67 O ATOM 1365 CB ARG A 193 46.550 6.437 71.525 1.00 25.25 C ATOM 1366 CG ARG A 193 47.058 7.492 70.519 1.00 27.07 C ATOM 1367 CD ARG A 193 48.473 8.005 70.844 1.00 26.05 C ATOM 1368 NE ARG A 193 49.508 6.977 70.695 1.00 26.44 N ATOM 1369 CZ ARG A 193 50.037 6.608 69.532 1.00 26.15 C ATOM 1370 NH1 ARG A 193 50.969 5.659 69.494 1.00 24.79 N ATOM 1371 NH2 ARG A 193 49.645 7.196 68.405 1.00 22.54 N ATOM 0 H ARG A 193 44.577 7.846 71.989 1.00 26.80 H new ATOM 0 HA ARG A 193 44.964 5.835 70.367 1.00 28.74 H new ATOM 0 HB2 ARG A 193 46.657 6.780 72.426 1.00 25.25 H new ATOM 0 HB3 ARG A 193 47.102 5.642 71.457 1.00 25.25 H new ATOM 0 HG2 ARG A 193 47.056 7.109 69.628 1.00 27.07 H new ATOM 0 HG3 ARG A 193 46.443 8.242 70.507 1.00 27.07 H new ATOM 0 HD2 ARG A 193 48.681 8.752 70.262 1.00 26.05 H new ATOM 0 HD3 ARG A 193 48.488 8.341 71.754 1.00 26.05 H new ATOM 0 HE ARG A 193 49.792 6.587 71.407 1.00 26.44 H new ATOM 0 HH11 ARG A 193 51.230 5.283 70.222 1.00 24.79 H new ATOM 0 HH12 ARG A 193 51.310 5.421 68.741 1.00 24.79 H new ATOM 0 HH21 ARG A 193 49.049 7.815 68.428 1.00 22.54 H new ATOM 0 HH22 ARG A 193 49.988 6.957 67.653 1.00 22.54 H new ATOM 1372 N GLY A 194 44.288 5.037 73.383 1.00 27.69 N ATOM 1373 CA GLY A 194 43.894 3.941 74.256 1.00 26.83 C ATOM 1374 C GLY A 194 42.665 3.229 73.704 1.00 27.85 C ATOM 1375 O GLY A 194 42.604 2.000 73.674 1.00 26.34 O ATOM 0 H GLY A 194 44.226 5.818 73.738 1.00 27.69 H new ATOM 0 HA2 GLY A 194 44.627 3.311 74.343 1.00 26.83 H new ATOM 0 HA3 GLY A 194 43.705 4.281 75.145 1.00 26.83 H new ATOM 1376 N PHE A 195 41.683 4.016 73.270 1.00 27.52 N ATOM 1377 CA PHE A 195 40.459 3.483 72.695 1.00 26.58 C ATOM 1378 C PHE A 195 40.769 2.589 71.496 1.00 26.24 C ATOM 1379 O PHE A 195 40.197 1.501 71.351 1.00 25.84 O ATOM 1380 CB PHE A 195 39.541 4.625 72.246 1.00 25.58 C ATOM 1381 CG PHE A 195 38.295 4.154 71.551 1.00 27.65 C ATOM 1382 CD1 PHE A 195 38.178 4.236 70.169 1.00 27.12 C ATOM 1383 CD2 PHE A 195 37.250 3.582 72.279 1.00 29.00 C ATOM 1384 CE1 PHE A 195 37.037 3.752 69.515 1.00 29.45 C ATOM 1385 CE2 PHE A 195 36.109 3.095 71.639 1.00 27.71 C ATOM 1386 CZ PHE A 195 36.002 3.178 70.255 1.00 27.33 C ATOM 0 H PHE A 195 41.711 4.875 73.302 1.00 27.52 H new ATOM 0 HA PHE A 195 40.013 2.957 73.377 1.00 26.58 H new ATOM 0 HB2 PHE A 195 39.291 5.153 73.020 1.00 25.58 H new ATOM 0 HB3 PHE A 195 40.033 5.211 71.650 1.00 25.58 H new ATOM 0 HD1 PHE A 195 38.865 4.617 69.672 1.00 27.12 H new ATOM 0 HD2 PHE A 195 37.315 3.525 73.205 1.00 29.00 H new ATOM 0 HE1 PHE A 195 36.970 3.813 68.589 1.00 29.45 H new ATOM 0 HE2 PHE A 195 35.422 2.716 72.137 1.00 27.71 H new ATOM 0 HZ PHE A 195 35.245 2.853 69.825 1.00 27.33 H new ATOM 1387 N VAL A 196 41.663 3.058 70.633 1.00 26.64 N ATOM 1388 CA VAL A 196 42.036 2.302 69.449 1.00 27.32 C ATOM 1389 C VAL A 196 42.649 0.953 69.812 1.00 28.87 C ATOM 1390 O VAL A 196 42.365 -0.049 69.158 1.00 29.94 O ATOM 1391 CB VAL A 196 43.016 3.095 68.551 1.00 27.41 C ATOM 1392 CG1 VAL A 196 43.612 2.172 67.479 1.00 24.44 C ATOM 1393 CG2 VAL A 196 42.268 4.259 67.880 1.00 27.17 C ATOM 0 H VAL A 196 42.065 3.814 70.717 1.00 26.64 H new ATOM 0 HA VAL A 196 41.218 2.146 68.952 1.00 27.32 H new ATOM 0 HB VAL A 196 43.736 3.446 69.097 1.00 27.41 H new ATOM 0 HG11 VAL A 196 44.224 2.677 66.921 1.00 24.44 H new ATOM 0 HG12 VAL A 196 44.090 1.445 67.907 1.00 24.44 H new ATOM 0 HG13 VAL A 196 42.899 1.810 66.930 1.00 24.44 H new ATOM 0 HG21 VAL A 196 42.882 4.757 67.317 1.00 27.17 H new ATOM 0 HG22 VAL A 196 41.544 3.909 67.338 1.00 27.17 H new ATOM 0 HG23 VAL A 196 41.906 4.847 68.561 1.00 27.17 H new ATOM 1394 N ARG A 197 43.486 0.921 70.843 1.00 29.36 N ATOM 1395 CA ARG A 197 44.082 -0.345 71.265 1.00 32.73 C ATOM 1396 C ARG A 197 43.004 -1.278 71.835 1.00 31.84 C ATOM 1397 O ARG A 197 43.082 -2.493 71.671 1.00 31.99 O ATOM 1398 CB ARG A 197 45.181 -0.115 72.309 1.00 34.15 C ATOM 1399 CG ARG A 197 46.455 0.494 71.737 1.00 40.92 C ATOM 1400 CD ARG A 197 47.502 0.693 72.824 1.00 42.79 C ATOM 1401 NE ARG A 197 48.501 1.692 72.455 1.00 45.38 N ATOM 1402 CZ ARG A 197 49.411 1.531 71.502 1.00 46.79 C ATOM 1403 NH1 ARG A 197 50.275 2.503 71.243 1.00 46.15 N ATOM 1404 NH2 ARG A 197 49.466 0.398 70.816 1.00 47.30 N ATOM 0 H ARG A 197 43.720 1.607 71.306 1.00 29.36 H new ATOM 0 HA ARG A 197 44.483 -0.762 70.486 1.00 32.73 H new ATOM 0 HB2 ARG A 197 44.838 0.468 73.004 1.00 34.15 H new ATOM 0 HB3 ARG A 197 45.398 -0.962 72.730 1.00 34.15 H new ATOM 0 HG2 ARG A 197 46.810 -0.084 71.043 1.00 40.92 H new ATOM 0 HG3 ARG A 197 46.251 1.346 71.320 1.00 40.92 H new ATOM 0 HD2 ARG A 197 47.064 0.965 73.646 1.00 42.79 H new ATOM 0 HD3 ARG A 197 47.943 -0.152 73.004 1.00 42.79 H new ATOM 0 HE ARG A 197 48.500 2.437 72.885 1.00 45.38 H new ATOM 0 HH11 ARG A 197 50.245 3.236 71.692 1.00 46.15 H new ATOM 0 HH12 ARG A 197 50.865 2.401 70.626 1.00 46.15 H new ATOM 0 HH21 ARG A 197 48.911 -0.236 70.988 1.00 47.30 H new ATOM 0 HH22 ARG A 197 50.057 0.297 70.199 1.00 47.30 H new ATOM 1405 N GLU A 198 41.996 -0.714 72.497 1.00 30.35 N ATOM 1406 CA GLU A 198 40.922 -1.536 73.046 1.00 29.78 C ATOM 1407 C GLU A 198 40.111 -2.144 71.896 1.00 30.12 C ATOM 1408 O GLU A 198 39.608 -3.265 72.004 1.00 30.24 O ATOM 1409 CB GLU A 198 39.996 -0.705 73.942 1.00 29.51 C ATOM 1410 CG GLU A 198 40.620 -0.210 75.252 1.00 32.74 C ATOM 1411 CD GLU A 198 40.872 -1.322 76.264 1.00 35.47 C ATOM 1412 OE1 GLU A 198 39.932 -2.077 76.580 1.00 38.49 O ATOM 1413 OE2 GLU A 198 42.011 -1.441 76.754 1.00 41.09 O ATOM 0 H GLU A 198 41.916 0.131 72.638 1.00 30.35 H new ATOM 0 HA GLU A 198 41.317 -2.240 73.584 1.00 29.78 H new ATOM 0 HB2 GLU A 198 39.687 0.064 73.438 1.00 29.51 H new ATOM 0 HB3 GLU A 198 39.214 -1.237 74.155 1.00 29.51 H new ATOM 0 HG2 GLU A 198 41.459 0.234 75.054 1.00 32.74 H new ATOM 0 HG3 GLU A 198 40.035 0.453 75.650 1.00 32.74 H new ATOM 1414 N GLN A 199 39.987 -1.400 70.800 1.00 29.05 N ATOM 1415 CA GLN A 199 39.241 -1.875 69.639 1.00 29.34 C ATOM 1416 C GLN A 199 40.000 -2.994 68.954 1.00 30.07 C ATOM 1417 O GLN A 199 39.414 -4.016 68.587 1.00 31.73 O ATOM 1418 CB GLN A 199 38.979 -0.735 68.647 1.00 29.14 C ATOM 1419 CG GLN A 199 37.943 0.262 69.141 1.00 31.68 C ATOM 1420 CD GLN A 199 36.594 -0.393 69.427 1.00 35.14 C ATOM 1421 OE1 GLN A 199 36.188 -1.316 68.568 1.00 39.04 O flip ATOM 1422 NE2 GLN A 199 35.927 -0.063 70.409 1.00 32.53 N flip ATOM 0 H GLN A 199 40.328 -0.616 70.709 1.00 29.05 H new ATOM 0 HA GLN A 199 38.385 -2.211 69.948 1.00 29.34 H new ATOM 0 HB2 GLN A 199 39.811 -0.268 68.473 1.00 29.14 H new ATOM 0 HB3 GLN A 199 38.682 -1.110 67.803 1.00 29.14 H new ATOM 0 HG2 GLN A 199 38.269 0.690 69.948 1.00 31.68 H new ATOM 0 HG3 GLN A 199 37.827 0.959 68.477 1.00 31.68 H new ATOM 0 HE21 GLN A 199 36.222 0.540 70.946 1.00 32.53 H new ATOM 0 HE22 GLN A 199 35.166 -0.436 70.557 1.00 32.53 H new ATOM 1423 N TYR A 200 41.301 -2.816 68.790 1.00 28.58 N ATOM 1424 CA TYR A 200 42.099 -3.858 68.165 1.00 30.75 C ATOM 1425 C TYR A 200 42.026 -5.137 69.002 1.00 32.06 C ATOM 1426 O TYR A 200 41.879 -6.230 68.447 1.00 31.33 O ATOM 1427 CB TYR A 200 43.553 -3.411 68.011 1.00 31.43 C ATOM 1428 CG TYR A 200 44.452 -4.483 67.439 1.00 32.41 C ATOM 1429 CD1 TYR A 200 45.433 -5.081 68.225 1.00 34.23 C ATOM 1430 CD2 TYR A 200 44.311 -4.912 66.119 1.00 33.80 C ATOM 1431 CE1 TYR A 200 46.259 -6.085 67.715 1.00 36.67 C ATOM 1432 CE2 TYR A 200 45.138 -5.922 65.590 1.00 35.65 C ATOM 1433 CZ TYR A 200 46.107 -6.502 66.403 1.00 37.43 C ATOM 1434 OH TYR A 200 46.914 -7.511 65.925 1.00 41.68 O ATOM 0 H TYR A 200 41.736 -2.113 69.028 1.00 28.58 H new ATOM 0 HA TYR A 200 41.741 -4.033 67.281 1.00 30.75 H new ATOM 0 HB2 TYR A 200 43.585 -2.630 67.436 1.00 31.43 H new ATOM 0 HB3 TYR A 200 43.895 -3.140 68.877 1.00 31.43 H new ATOM 0 HD1 TYR A 200 45.540 -4.807 69.107 1.00 34.23 H new ATOM 0 HD2 TYR A 200 43.660 -4.525 65.579 1.00 33.80 H new ATOM 0 HE1 TYR A 200 46.909 -6.473 68.255 1.00 36.67 H new ATOM 0 HE2 TYR A 200 45.038 -6.198 64.708 1.00 35.65 H new ATOM 0 HH TYR A 200 46.721 -7.668 65.123 1.00 41.68 H new ATOM 1435 N ALA A 201 42.117 -5.000 70.328 1.00 31.46 N ATOM 1436 CA ALA A 201 42.042 -6.157 71.223 1.00 32.85 C ATOM 1437 C ALA A 201 40.687 -6.859 71.100 1.00 34.60 C ATOM 1438 O ALA A 201 40.616 -8.088 71.056 1.00 35.13 O ATOM 1439 CB ALA A 201 42.268 -5.729 72.674 1.00 33.39 C ATOM 0 H ALA A 201 42.222 -4.246 70.728 1.00 31.46 H new ATOM 0 HA ALA A 201 42.739 -6.778 70.962 1.00 32.85 H new ATOM 0 HB1 ALA A 201 42.215 -6.506 73.253 1.00 33.39 H new ATOM 0 HB2 ALA A 201 43.144 -5.322 72.759 1.00 33.39 H new ATOM 0 HB3 ALA A 201 41.588 -5.087 72.932 1.00 33.39 H new HETATM 1440 N MSE A 202 39.613 -6.074 71.044 1.00 34.91 N HETATM 1441 CA MSE A 202 38.269 -6.627 70.923 1.00 35.11 C HETATM 1442 C MSE A 202 38.121 -7.347 69.583 1.00 35.50 C HETATM 1443 O MSE A 202 37.525 -8.420 69.512 1.00 36.63 O HETATM 1444 CB MSE A 202 37.226 -5.510 71.045 1.00 36.89 C HETATM 1445 CG MSE A 202 35.768 -5.975 71.037 1.00 41.87 C HETATM 1446 SE MSE A 202 35.244 -7.009 72.619 1.00 46.84 SE HETATM 1447 CE MSE A 202 35.458 -5.605 73.949 1.00 42.75 C HETATM 0 H MSE A 202 39.643 -5.215 71.075 1.00 34.91 H new HETATM 0 HA MSE A 202 38.124 -7.265 71.639 1.00 35.11 H new HETATM 0 HB2 MSE A 202 37.390 -5.022 71.867 1.00 36.89 H new HETATM 0 HB3 MSE A 202 37.355 -4.885 70.314 1.00 36.89 H new HETATM 0 HG2 MSE A 202 35.192 -5.198 70.966 1.00 41.87 H new HETATM 0 HG3 MSE A 202 35.616 -6.515 70.245 1.00 41.87 H new HETATM 0 HE1 MSE A 202 35.232 -5.953 74.826 1.00 42.75 H new HETATM 0 HE2 MSE A 202 36.378 -5.298 73.950 1.00 42.75 H new HETATM 0 HE3 MSE A 202 34.870 -4.864 73.735 1.00 42.75 H new ATOM 1448 N ALA A 203 38.668 -6.760 68.521 1.00 34.73 N ATOM 1449 CA ALA A 203 38.593 -7.372 67.196 1.00 34.81 C ATOM 1450 C ALA A 203 39.375 -8.690 67.163 1.00 35.09 C ATOM 1451 O ALA A 203 38.910 -9.675 66.604 1.00 35.66 O ATOM 1452 CB ALA A 203 39.135 -6.410 66.129 1.00 33.12 C ATOM 0 H ALA A 203 39.086 -6.009 68.546 1.00 34.73 H new ATOM 0 HA ALA A 203 37.662 -7.561 67.002 1.00 34.81 H new ATOM 0 HB1 ALA A 203 39.079 -6.830 65.256 1.00 33.12 H new ATOM 0 HB2 ALA A 203 38.609 -5.595 66.130 1.00 33.12 H new ATOM 0 HB3 ALA A 203 40.061 -6.197 66.326 1.00 33.12 H new ATOM 1453 N CYS A 204 40.563 -8.710 67.753 1.00 35.79 N ATOM 1454 CA CYS A 204 41.354 -9.936 67.776 1.00 38.26 C ATOM 1455 C CYS A 204 40.529 -11.042 68.424 1.00 39.02 C ATOM 1456 O CYS A 204 40.500 -12.171 67.945 1.00 38.74 O ATOM 1457 CB CYS A 204 42.651 -9.736 68.572 1.00 39.00 C ATOM 1458 SG CYS A 204 43.894 -8.681 67.776 1.00 44.91 S ATOM 0 H CYS A 204 40.927 -8.035 68.142 1.00 35.79 H new ATOM 0 HA CYS A 204 41.588 -10.176 66.866 1.00 38.26 H new ATOM 0 HB2 CYS A 204 42.428 -9.353 69.435 1.00 39.00 H new ATOM 0 HB3 CYS A 204 43.047 -10.605 68.741 1.00 39.00 H new ATOM 0 HG CYS A 204 43.527 -7.539 67.803 1.00 44.91 H new ATOM 1459 N GLU A 205 39.840 -10.694 69.502 1.00 39.64 N ATOM 1460 CA GLU A 205 39.021 -11.646 70.237 1.00 42.25 C ATOM 1461 C GLU A 205 37.779 -12.142 69.494 1.00 41.81 C ATOM 1462 O GLU A 205 37.464 -13.325 69.537 1.00 42.16 O ATOM 1463 CB GLU A 205 38.590 -11.031 71.569 1.00 44.80 C ATOM 1464 CG GLU A 205 37.729 -11.943 72.430 1.00 52.26 C ATOM 1465 CD GLU A 205 38.463 -13.198 72.884 1.00 56.88 C ATOM 1466 OE1 GLU A 205 38.891 -13.994 72.018 1.00 58.86 O ATOM 1467 OE2 GLU A 205 38.611 -13.388 74.111 1.00 60.28 O ATOM 0 H GLU A 205 39.834 -9.898 69.828 1.00 39.64 H new ATOM 0 HA GLU A 205 39.585 -12.425 70.364 1.00 42.25 H new ATOM 0 HB2 GLU A 205 39.383 -10.784 72.071 1.00 44.80 H new ATOM 0 HB3 GLU A 205 38.100 -10.213 71.392 1.00 44.80 H new ATOM 0 HG2 GLU A 205 37.425 -11.452 73.209 1.00 52.26 H new ATOM 0 HG3 GLU A 205 36.938 -12.200 71.930 1.00 52.26 H new ATOM 1468 N LEU A 206 37.073 -11.244 68.815 1.00 41.26 N ATOM 1469 CA LEU A 206 35.855 -11.632 68.113 1.00 39.34 C ATOM 1470 C LEU A 206 36.042 -11.908 66.632 1.00 40.13 C ATOM 1471 O LEU A 206 35.252 -12.630 66.033 1.00 41.12 O ATOM 1472 CB LEU A 206 34.784 -10.549 68.283 1.00 39.32 C ATOM 1473 CG LEU A 206 34.467 -10.076 69.706 1.00 42.02 C ATOM 1474 CD1 LEU A 206 33.437 -8.957 69.641 1.00 40.86 C ATOM 1475 CD2 LEU A 206 33.941 -11.239 70.552 1.00 42.16 C ATOM 0 H LEU A 206 37.280 -10.412 68.748 1.00 41.26 H new ATOM 0 HA LEU A 206 35.580 -12.469 68.519 1.00 39.34 H new ATOM 0 HB2 LEU A 206 35.057 -9.775 67.766 1.00 39.32 H new ATOM 0 HB3 LEU A 206 33.962 -10.878 67.888 1.00 39.32 H new ATOM 0 HG LEU A 206 35.277 -9.744 70.123 1.00 42.02 H new ATOM 0 HD11 LEU A 206 33.232 -8.653 70.539 1.00 40.86 H new ATOM 0 HD12 LEU A 206 33.794 -8.218 69.124 1.00 40.86 H new ATOM 0 HD13 LEU A 206 32.628 -9.286 69.219 1.00 40.86 H new ATOM 0 HD21 LEU A 206 33.745 -10.925 71.448 1.00 42.16 H new ATOM 0 HD22 LEU A 206 33.132 -11.592 70.150 1.00 42.16 H new ATOM 0 HD23 LEU A 206 34.612 -11.938 70.594 1.00 42.16 H new ATOM 1476 N LEU A 207 37.087 -11.342 66.038 1.00 39.85 N ATOM 1477 CA LEU A 207 37.319 -11.525 64.615 1.00 39.95 C ATOM 1478 C LEU A 207 38.562 -12.333 64.258 1.00 40.39 C ATOM 1479 O LEU A 207 38.660 -12.863 63.155 1.00 41.06 O ATOM 1480 CB LEU A 207 37.403 -10.158 63.933 1.00 39.41 C ATOM 1481 CG LEU A 207 36.255 -9.178 64.183 1.00 37.70 C ATOM 1482 CD1 LEU A 207 36.527 -7.889 63.421 1.00 37.23 C ATOM 1483 CD2 LEU A 207 34.928 -9.788 63.748 1.00 36.29 C ATOM 0 H LEU A 207 37.669 -10.852 66.439 1.00 39.85 H new ATOM 0 HA LEU A 207 36.564 -12.045 64.297 1.00 39.95 H new ATOM 0 HB2 LEU A 207 38.228 -9.732 64.214 1.00 39.41 H new ATOM 0 HB3 LEU A 207 37.471 -10.303 62.976 1.00 39.41 H new ATOM 0 HG LEU A 207 36.197 -8.984 65.132 1.00 37.70 H new ATOM 0 HD11 LEU A 207 35.802 -7.263 63.575 1.00 37.23 H new ATOM 0 HD12 LEU A 207 37.361 -7.501 63.729 1.00 37.23 H new ATOM 0 HD13 LEU A 207 36.591 -8.081 62.472 1.00 37.23 H new ATOM 0 HD21 LEU A 207 34.211 -9.155 63.913 1.00 36.29 H new ATOM 0 HD22 LEU A 207 34.963 -9.997 62.802 1.00 36.29 H new ATOM 0 HD23 LEU A 207 34.764 -10.600 64.253 1.00 36.29 H new ATOM 1484 N GLY A 208 39.502 -12.441 65.187 1.00 40.86 N ATOM 1485 CA GLY A 208 40.725 -13.160 64.895 1.00 43.02 C ATOM 1486 C GLY A 208 41.820 -12.132 64.659 1.00 45.96 C ATOM 1487 O GLY A 208 41.536 -11.036 64.175 1.00 43.55 O ATOM 0 H GLY A 208 39.451 -12.110 65.979 1.00 40.86 H new ATOM 0 HA2 GLY A 208 40.960 -13.745 65.632 1.00 43.02 H new ATOM 0 HA3 GLY A 208 40.611 -13.722 64.112 1.00 43.02 H new ATOM 1488 N PRO A 209 43.082 -12.452 64.990 1.00 48.85 N ATOM 1489 CA PRO A 209 44.249 -11.572 64.835 1.00 49.93 C ATOM 1490 C PRO A 209 44.532 -11.069 63.419 1.00 51.00 C ATOM 1491 O PRO A 209 45.167 -10.028 63.241 1.00 51.22 O ATOM 1492 CB PRO A 209 45.400 -12.430 65.360 1.00 49.60 C ATOM 1493 CG PRO A 209 44.739 -13.315 66.352 1.00 51.41 C ATOM 1494 CD PRO A 209 43.475 -13.716 65.633 1.00 50.00 C ATOM 0 HA PRO A 209 44.105 -10.740 65.313 1.00 49.93 H new ATOM 0 HB2 PRO A 209 45.820 -12.939 64.649 1.00 49.60 H new ATOM 0 HB3 PRO A 209 46.093 -11.888 65.769 1.00 49.60 H new ATOM 0 HG2 PRO A 209 45.288 -14.083 66.574 1.00 51.41 H new ATOM 0 HG3 PRO A 209 44.551 -12.851 67.183 1.00 51.41 H new ATOM 0 HD2 PRO A 209 43.633 -14.420 64.985 1.00 50.00 H new ATOM 0 HD3 PRO A 209 42.795 -14.040 66.245 1.00 50.00 H new ATOM 1495 N ASP A 210 44.064 -11.806 62.419 1.00 51.45 N ATOM 1496 CA ASP A 210 44.307 -11.437 61.029 1.00 53.84 C ATOM 1497 C ASP A 210 43.197 -10.629 60.361 1.00 52.01 C ATOM 1498 O ASP A 210 43.124 -10.585 59.136 1.00 52.59 O ATOM 1499 CB ASP A 210 44.555 -12.698 60.205 1.00 58.38 C ATOM 1500 CG ASP A 210 43.334 -13.590 60.139 1.00 61.63 C ATOM 1501 OD1 ASP A 210 42.797 -13.938 61.215 1.00 63.04 O ATOM 1502 OD2 ASP A 210 42.910 -13.938 59.014 1.00 64.83 O ATOM 0 H ASP A 210 43.603 -12.524 62.523 1.00 51.45 H new ATOM 0 HA ASP A 210 45.082 -10.854 61.055 1.00 53.84 H new ATOM 0 HB2 ASP A 210 44.819 -12.448 59.306 1.00 58.38 H new ATOM 0 HB3 ASP A 210 45.295 -13.193 60.590 1.00 58.38 H new ATOM 1503 N CYS A 211 42.335 -9.991 61.144 1.00 48.98 N ATOM 1504 CA CYS A 211 41.252 -9.208 60.553 1.00 46.13 C ATOM 1505 C CYS A 211 41.795 -7.948 59.894 1.00 42.65 C ATOM 1506 O CYS A 211 42.817 -7.412 60.314 1.00 41.60 O ATOM 1507 CB CYS A 211 40.234 -8.816 61.620 1.00 46.68 C ATOM 1508 SG CYS A 211 40.914 -7.715 62.860 1.00 47.64 S ATOM 0 H CYS A 211 42.356 -9.996 62.004 1.00 48.98 H new ATOM 0 HA CYS A 211 40.820 -9.758 59.881 1.00 46.13 H new ATOM 0 HB2 CYS A 211 39.475 -8.387 61.195 1.00 46.68 H new ATOM 0 HB3 CYS A 211 39.901 -9.618 62.053 1.00 46.68 H new ATOM 0 HG CYS A 211 41.919 -7.211 62.440 1.00 47.64 H new ATOM 1509 N GLU A 212 41.117 -7.480 58.853 1.00 41.02 N ATOM 1510 CA GLU A 212 41.552 -6.264 58.177 1.00 37.96 C ATOM 1511 C GLU A 212 41.135 -5.063 59.022 1.00 35.49 C ATOM 1512 O GLU A 212 40.073 -5.070 59.642 1.00 33.70 O ATOM 1513 CB GLU A 212 40.920 -6.163 56.789 1.00 38.74 C ATOM 1514 CG GLU A 212 41.460 -7.161 55.793 1.00 41.66 C ATOM 1515 CD GLU A 212 42.960 -7.063 55.639 1.00 43.72 C ATOM 1516 OE1 GLU A 212 43.464 -5.946 55.392 1.00 45.68 O ATOM 1517 OE2 GLU A 212 43.640 -8.105 55.762 1.00 48.51 O ATOM 0 H GLU A 212 40.411 -7.846 58.525 1.00 41.02 H new ATOM 0 HA GLU A 212 42.516 -6.282 58.070 1.00 37.96 H new ATOM 0 HB2 GLU A 212 39.962 -6.288 56.871 1.00 38.74 H new ATOM 0 HB3 GLU A 212 41.061 -5.267 56.444 1.00 38.74 H new ATOM 0 HG2 GLU A 212 41.224 -8.058 56.077 1.00 41.66 H new ATOM 0 HG3 GLU A 212 41.038 -7.016 54.932 1.00 41.66 H new ATOM 1518 N ILE A 213 41.983 -4.043 59.049 1.00 31.23 N ATOM 1519 CA ILE A 213 41.702 -2.843 59.808 1.00 29.71 C ATOM 1520 C ILE A 213 41.588 -1.644 58.873 1.00 30.31 C ATOM 1521 O ILE A 213 42.470 -1.402 58.045 1.00 31.05 O ATOM 1522 CB ILE A 213 42.809 -2.566 60.840 1.00 30.70 C ATOM 1523 CG1 ILE A 213 42.952 -3.770 61.784 1.00 31.92 C ATOM 1524 CG2 ILE A 213 42.468 -1.320 61.650 1.00 28.71 C ATOM 1525 CD1 ILE A 213 44.109 -3.666 62.734 1.00 30.36 C ATOM 0 H ILE A 213 42.733 -4.030 58.629 1.00 31.23 H new ATOM 0 HA ILE A 213 40.863 -2.980 60.275 1.00 29.71 H new ATOM 0 HB ILE A 213 43.646 -2.422 60.372 1.00 30.70 H new ATOM 0 HG12 ILE A 213 42.133 -3.868 62.295 1.00 31.92 H new ATOM 0 HG13 ILE A 213 43.053 -4.576 61.253 1.00 31.92 H new ATOM 0 HG21 ILE A 213 43.170 -1.153 62.298 1.00 28.71 H new ATOM 0 HG22 ILE A 213 42.390 -0.558 61.055 1.00 28.71 H new ATOM 0 HG23 ILE A 213 41.627 -1.455 62.114 1.00 28.71 H new ATOM 0 HD11 ILE A 213 44.138 -4.456 63.296 1.00 30.36 H new ATOM 0 HD12 ILE A 213 44.936 -3.597 62.231 1.00 30.36 H new ATOM 0 HD13 ILE A 213 44.002 -2.878 63.289 1.00 30.36 H new ATOM 1526 N PHE A 214 40.490 -0.904 59.011 1.00 29.54 N ATOM 1527 CA PHE A 214 40.237 0.279 58.196 1.00 29.21 C ATOM 1528 C PHE A 214 40.094 1.518 59.081 1.00 29.28 C ATOM 1529 O PHE A 214 39.299 1.534 60.023 1.00 28.20 O ATOM 1530 CB PHE A 214 38.949 0.101 57.390 1.00 30.26 C ATOM 1531 CG PHE A 214 39.042 -0.934 56.291 1.00 32.71 C ATOM 1532 CD1 PHE A 214 39.441 -0.571 55.008 1.00 32.51 C ATOM 1533 CD2 PHE A 214 38.693 -2.260 56.531 1.00 32.58 C ATOM 1534 CE1 PHE A 214 39.485 -1.514 53.976 1.00 33.72 C ATOM 1535 CE2 PHE A 214 38.732 -3.212 55.509 1.00 33.94 C ATOM 1536 CZ PHE A 214 39.127 -2.839 54.229 1.00 34.99 C ATOM 0 H PHE A 214 39.870 -1.075 59.582 1.00 29.54 H new ATOM 0 HA PHE A 214 40.989 0.395 57.594 1.00 29.21 H new ATOM 0 HB2 PHE A 214 38.233 -0.148 57.995 1.00 30.26 H new ATOM 0 HB3 PHE A 214 38.705 0.954 56.997 1.00 30.26 H new ATOM 0 HD1 PHE A 214 39.682 0.310 54.835 1.00 32.51 H new ATOM 0 HD2 PHE A 214 38.430 -2.516 57.385 1.00 32.58 H new ATOM 0 HE1 PHE A 214 39.752 -1.259 53.123 1.00 33.72 H new ATOM 0 HE2 PHE A 214 38.494 -4.094 55.685 1.00 33.94 H new ATOM 0 HZ PHE A 214 39.152 -3.469 53.545 1.00 34.99 H new ATOM 1537 N LEU A 215 40.877 2.549 58.789 1.00 26.95 N ATOM 1538 CA LEU A 215 40.788 3.783 59.548 1.00 26.50 C ATOM 1539 C LEU A 215 40.356 4.881 58.573 1.00 26.90 C ATOM 1540 O LEU A 215 40.758 4.875 57.408 1.00 28.19 O ATOM 1541 CB LEU A 215 42.143 4.144 60.172 1.00 23.16 C ATOM 1542 CG LEU A 215 42.868 3.124 61.061 1.00 26.63 C ATOM 1543 CD1 LEU A 215 44.148 3.768 61.601 1.00 22.92 C ATOM 1544 CD2 LEU A 215 41.974 2.659 62.219 1.00 24.72 C ATOM 0 H LEU A 215 41.462 2.553 58.159 1.00 26.95 H new ATOM 0 HA LEU A 215 40.151 3.684 60.273 1.00 26.50 H new ATOM 0 HB2 LEU A 215 42.744 4.374 59.446 1.00 23.16 H new ATOM 0 HB3 LEU A 215 42.014 4.948 60.699 1.00 23.16 H new ATOM 0 HG LEU A 215 43.087 2.341 60.532 1.00 26.63 H new ATOM 0 HD11 LEU A 215 44.617 3.133 62.165 1.00 22.92 H new ATOM 0 HD12 LEU A 215 44.719 4.024 60.860 1.00 22.92 H new ATOM 0 HD13 LEU A 215 43.920 4.555 62.120 1.00 22.92 H new ATOM 0 HD21 LEU A 215 42.456 2.017 62.763 1.00 24.72 H new ATOM 0 HD22 LEU A 215 41.727 3.422 62.764 1.00 24.72 H new ATOM 0 HD23 LEU A 215 41.173 2.244 61.863 1.00 24.72 H new ATOM 1545 N THR A 216 39.522 5.802 59.044 1.00 26.10 N ATOM 1546 CA THR A 216 39.062 6.918 58.224 1.00 26.11 C ATOM 1547 C THR A 216 38.875 8.121 59.160 1.00 26.70 C ATOM 1548 O THR A 216 39.179 8.038 60.350 1.00 27.51 O ATOM 1549 CB THR A 216 37.722 6.569 57.482 1.00 27.54 C ATOM 1550 OG1 THR A 216 37.460 7.552 56.470 1.00 26.37 O ATOM 1551 CG2 THR A 216 36.545 6.526 58.456 1.00 25.15 C ATOM 0 H THR A 216 39.208 5.798 59.844 1.00 26.10 H new ATOM 0 HA THR A 216 39.713 7.119 57.534 1.00 26.11 H new ATOM 0 HB THR A 216 37.821 5.692 57.079 1.00 27.54 H new ATOM 0 HG1 THR A 216 37.884 7.356 55.772 1.00 26.37 H new ATOM 0 HG21 THR A 216 35.732 6.309 57.973 1.00 25.15 H new ATOM 0 HG22 THR A 216 36.709 5.850 59.132 1.00 25.15 H new ATOM 0 HG23 THR A 216 36.446 7.392 58.882 1.00 25.15 H new ATOM 1552 N GLY A 217 38.381 9.238 58.641 1.00 27.94 N ATOM 1553 CA GLY A 217 38.204 10.402 59.493 1.00 26.18 C ATOM 1554 C GLY A 217 39.456 11.268 59.460 1.00 29.46 C ATOM 1555 O GLY A 217 40.548 10.793 59.134 1.00 29.53 O ATOM 0 H GLY A 217 38.148 9.341 57.820 1.00 27.94 H new ATOM 0 HA2 GLY A 217 37.438 10.917 59.195 1.00 26.18 H new ATOM 0 HA3 GLY A 217 38.020 10.121 60.403 1.00 26.18 H new ATOM 1556 N GLY A 218 39.306 12.539 59.812 1.00 29.96 N ATOM 1557 CA GLY A 218 40.436 13.454 59.789 1.00 30.12 C ATOM 1558 C GLY A 218 41.548 13.246 60.802 1.00 30.50 C ATOM 1559 O GLY A 218 42.633 13.805 60.630 1.00 31.60 O ATOM 0 H GLY A 218 38.562 12.889 60.066 1.00 29.96 H new ATOM 0 HA2 GLY A 218 40.831 13.415 58.904 1.00 30.12 H new ATOM 0 HA3 GLY A 218 40.092 14.353 59.907 1.00 30.12 H new ATOM 1560 N ASP A 219 41.302 12.471 61.856 1.00 29.17 N ATOM 1561 CA ASP A 219 42.329 12.226 62.867 1.00 28.30 C ATOM 1562 C ASP A 219 42.970 10.842 62.782 1.00 28.85 C ATOM 1563 O ASP A 219 43.638 10.411 63.723 1.00 27.64 O ATOM 1564 CB ASP A 219 41.748 12.416 64.266 1.00 32.86 C ATOM 1565 CG ASP A 219 41.458 13.867 64.583 1.00 37.37 C ATOM 1566 OD1 ASP A 219 40.687 14.134 65.535 1.00 36.66 O ATOM 1567 OD2 ASP A 219 42.008 14.742 63.881 1.00 41.65 O ATOM 0 H ASP A 219 40.551 12.079 62.004 1.00 29.17 H new ATOM 0 HA ASP A 219 43.029 12.874 62.689 1.00 28.30 H new ATOM 0 HB2 ASP A 219 40.930 11.901 64.345 1.00 32.86 H new ATOM 0 HB3 ASP A 219 42.370 12.063 64.922 1.00 32.86 H new ATOM 1568 N ALA A 220 42.776 10.145 61.667 1.00 28.57 N ATOM 1569 CA ALA A 220 43.342 8.805 61.512 1.00 30.89 C ATOM 1570 C ALA A 220 44.852 8.839 61.682 1.00 31.82 C ATOM 1571 O ALA A 220 45.447 7.950 62.296 1.00 32.81 O ATOM 1572 CB ALA A 220 42.982 8.225 60.135 1.00 27.08 C ATOM 0 H ALA A 220 42.323 10.426 60.992 1.00 28.57 H new ATOM 0 HA ALA A 220 42.964 8.236 62.200 1.00 30.89 H new ATOM 0 HB1 ALA A 220 43.364 7.338 60.048 1.00 27.08 H new ATOM 0 HB2 ALA A 220 42.017 8.171 60.048 1.00 27.08 H new ATOM 0 HB3 ALA A 220 43.337 8.799 59.439 1.00 27.08 H new ATOM 1573 N GLU A 221 45.465 9.880 61.139 1.00 32.30 N ATOM 1574 CA GLU A 221 46.911 10.037 61.213 1.00 34.92 C ATOM 1575 C GLU A 221 47.456 10.007 62.653 1.00 33.10 C ATOM 1576 O GLU A 221 48.552 9.511 62.902 1.00 32.44 O ATOM 1577 CB GLU A 221 47.317 11.344 60.523 1.00 38.01 C ATOM 1578 CG GLU A 221 48.810 11.541 60.424 1.00 48.33 C ATOM 1579 CD GLU A 221 49.476 10.510 59.525 1.00 52.89 C ATOM 1580 OE1 GLU A 221 50.726 10.439 59.533 1.00 55.35 O ATOM 1581 OE2 GLU A 221 48.750 9.781 58.810 1.00 54.68 O ATOM 0 H GLU A 221 45.059 10.512 60.720 1.00 32.30 H new ATOM 0 HA GLU A 221 47.304 9.276 60.758 1.00 34.92 H new ATOM 0 HB2 GLU A 221 46.937 11.361 59.631 1.00 38.01 H new ATOM 0 HB3 GLU A 221 46.932 12.090 61.009 1.00 38.01 H new ATOM 0 HG2 GLU A 221 48.994 12.430 60.083 1.00 48.33 H new ATOM 0 HG3 GLU A 221 49.199 11.492 61.311 1.00 48.33 H new ATOM 1582 N LEU A 222 46.687 10.531 63.596 1.00 30.18 N ATOM 1583 CA LEU A 222 47.119 10.561 64.990 1.00 29.90 C ATOM 1584 C LEU A 222 47.247 9.186 65.636 1.00 29.28 C ATOM 1585 O LEU A 222 47.880 9.051 66.678 1.00 29.12 O ATOM 1586 CB LEU A 222 46.152 11.402 65.835 1.00 27.10 C ATOM 1587 CG LEU A 222 45.958 12.875 65.457 1.00 30.87 C ATOM 1588 CD1 LEU A 222 44.970 13.516 66.426 1.00 30.01 C ATOM 1589 CD2 LEU A 222 47.293 13.610 65.498 1.00 31.00 C ATOM 0 H LEU A 222 45.912 10.875 63.453 1.00 30.18 H new ATOM 0 HA LEU A 222 48.005 10.955 64.970 1.00 29.90 H new ATOM 0 HB2 LEU A 222 45.283 10.972 65.808 1.00 27.10 H new ATOM 0 HB3 LEU A 222 46.456 11.369 66.755 1.00 27.10 H new ATOM 0 HG LEU A 222 45.606 12.933 64.555 1.00 30.87 H new ATOM 0 HD11 LEU A 222 44.844 14.449 66.190 1.00 30.01 H new ATOM 0 HD12 LEU A 222 44.119 13.052 66.375 1.00 30.01 H new ATOM 0 HD13 LEU A 222 45.317 13.455 67.330 1.00 30.01 H new ATOM 0 HD21 LEU A 222 47.158 14.540 65.257 1.00 31.00 H new ATOM 0 HD22 LEU A 222 47.664 13.558 66.393 1.00 31.00 H new ATOM 0 HD23 LEU A 222 47.908 13.200 64.870 1.00 31.00 H new ATOM 1590 N VAL A 223 46.655 8.165 65.027 1.00 28.79 N ATOM 1591 CA VAL A 223 46.703 6.836 65.623 1.00 27.02 C ATOM 1592 C VAL A 223 47.182 5.723 64.703 1.00 28.59 C ATOM 1593 O VAL A 223 47.312 4.583 65.147 1.00 28.37 O ATOM 1594 CB VAL A 223 45.308 6.406 66.152 1.00 25.32 C ATOM 1595 CG1 VAL A 223 44.731 7.485 67.073 1.00 26.03 C ATOM 1596 CG2 VAL A 223 44.364 6.134 64.985 1.00 21.36 C ATOM 0 H VAL A 223 46.228 8.218 64.282 1.00 28.79 H new ATOM 0 HA VAL A 223 47.355 6.938 66.334 1.00 27.02 H new ATOM 0 HB VAL A 223 45.407 5.589 66.665 1.00 25.32 H new ATOM 0 HG11 VAL A 223 43.861 7.204 67.396 1.00 26.03 H new ATOM 0 HG12 VAL A 223 45.327 7.620 67.827 1.00 26.03 H new ATOM 0 HG13 VAL A 223 44.640 8.316 66.581 1.00 26.03 H new ATOM 0 HG21 VAL A 223 43.496 5.866 65.326 1.00 21.36 H new ATOM 0 HG22 VAL A 223 44.267 6.939 64.452 1.00 21.36 H new ATOM 0 HG23 VAL A 223 44.727 5.424 64.433 1.00 21.36 H new ATOM 1597 N ARG A 224 47.443 6.035 63.436 1.00 28.00 N ATOM 1598 CA ARG A 224 47.852 4.984 62.509 1.00 31.24 C ATOM 1599 C ARG A 224 49.118 4.227 62.898 1.00 31.71 C ATOM 1600 O ARG A 224 49.247 3.051 62.590 1.00 31.47 O ATOM 1601 CB ARG A 224 47.997 5.532 61.087 1.00 32.80 C ATOM 1602 CG ARG A 224 49.135 6.504 60.864 1.00 35.83 C ATOM 1603 CD ARG A 224 49.160 6.940 59.388 1.00 39.61 C ATOM 1604 NE ARG A 224 49.246 5.790 58.490 1.00 42.82 N ATOM 1605 CZ ARG A 224 49.051 5.837 57.171 1.00 43.84 C ATOM 1606 NH1 ARG A 224 49.157 4.728 56.448 1.00 41.51 N ATOM 1607 NH2 ARG A 224 48.749 6.985 56.570 1.00 40.45 N ATOM 0 H ARG A 224 47.392 6.825 63.100 1.00 28.00 H new ATOM 0 HA ARG A 224 47.133 4.335 62.552 1.00 31.24 H new ATOM 0 HB2 ARG A 224 48.111 4.783 60.481 1.00 32.80 H new ATOM 0 HB3 ARG A 224 47.167 5.971 60.842 1.00 32.80 H new ATOM 0 HG2 ARG A 224 49.028 7.279 61.438 1.00 35.83 H new ATOM 0 HG3 ARG A 224 49.979 6.089 61.102 1.00 35.83 H new ATOM 0 HD2 ARG A 224 48.360 7.450 59.187 1.00 39.61 H new ATOM 0 HD3 ARG A 224 49.917 7.528 59.236 1.00 39.61 H new ATOM 0 HE ARG A 224 49.436 5.027 58.837 1.00 42.82 H new ATOM 0 HH11 ARG A 224 49.351 3.982 56.830 1.00 41.51 H new ATOM 0 HH12 ARG A 224 49.032 4.755 55.598 1.00 41.51 H new ATOM 0 HH21 ARG A 224 48.678 7.707 57.032 1.00 40.45 H new ATOM 0 HH22 ARG A 224 48.625 7.005 55.719 1.00 40.45 H new ATOM 1608 N ASP A 225 50.039 4.891 63.587 1.00 33.23 N ATOM 1609 CA ASP A 225 51.280 4.248 63.998 1.00 35.32 C ATOM 1610 C ASP A 225 51.018 3.057 64.914 1.00 36.93 C ATOM 1611 O ASP A 225 51.838 2.151 65.000 1.00 38.36 O ATOM 1612 CB ASP A 225 52.197 5.250 64.713 1.00 34.23 C ATOM 1613 CG ASP A 225 51.579 5.806 65.979 1.00 35.54 C ATOM 1614 OD1 ASP A 225 50.575 6.547 65.878 1.00 36.27 O ATOM 1615 OD2 ASP A 225 52.091 5.502 67.078 1.00 36.47 O ATOM 0 H ASP A 225 49.965 5.714 63.826 1.00 33.23 H new ATOM 0 HA ASP A 225 51.717 3.927 63.194 1.00 35.32 H new ATOM 0 HB2 ASP A 225 53.037 4.816 64.931 1.00 34.23 H new ATOM 0 HB3 ASP A 225 52.404 5.981 64.110 1.00 34.23 H new ATOM 1616 N GLU A 226 49.872 3.056 65.591 1.00 39.29 N ATOM 1617 CA GLU A 226 49.521 1.964 66.500 1.00 41.06 C ATOM 1618 C GLU A 226 49.218 0.651 65.779 1.00 41.77 C ATOM 1619 O GLU A 226 49.458 -0.433 66.313 1.00 42.98 O ATOM 1620 CB GLU A 226 48.298 2.335 67.339 1.00 39.33 C ATOM 1621 CG GLU A 226 48.436 3.603 68.141 1.00 40.04 C ATOM 1622 CD GLU A 226 47.204 3.881 68.974 1.00 39.61 C ATOM 1623 OE1 GLU A 226 46.937 3.116 69.926 1.00 39.75 O ATOM 1624 OE2 GLU A 226 46.493 4.859 68.667 1.00 39.07 O ATOM 0 H GLU A 226 49.282 3.679 65.539 1.00 39.29 H new ATOM 0 HA GLU A 226 50.302 1.831 67.060 1.00 41.06 H new ATOM 0 HB2 GLU A 226 47.533 2.423 66.749 1.00 39.33 H new ATOM 0 HB3 GLU A 226 48.105 1.604 67.946 1.00 39.33 H new ATOM 0 HG2 GLU A 226 49.210 3.535 68.722 1.00 40.04 H new ATOM 0 HG3 GLU A 226 48.596 4.349 67.541 1.00 40.04 H new ATOM 1625 N LEU A 227 48.677 0.757 64.574 1.00 41.23 N ATOM 1626 CA LEU A 227 48.307 -0.414 63.790 1.00 41.58 C ATOM 1627 C LEU A 227 49.038 -0.374 62.453 1.00 40.93 C ATOM 1628 O LEU A 227 48.508 0.096 61.445 1.00 39.23 O ATOM 1629 CB LEU A 227 46.789 -0.420 63.588 1.00 40.84 C ATOM 1630 CG LEU A 227 46.000 -0.225 64.889 1.00 40.81 C ATOM 1631 CD1 LEU A 227 44.522 -0.092 64.597 1.00 42.51 C ATOM 1632 CD2 LEU A 227 46.257 -1.393 65.822 1.00 41.58 C ATOM 0 H LEU A 227 48.514 1.508 64.187 1.00 41.23 H new ATOM 0 HA LEU A 227 48.561 -1.227 64.254 1.00 41.58 H new ATOM 0 HB2 LEU A 227 46.550 0.283 62.964 1.00 40.84 H new ATOM 0 HB3 LEU A 227 46.527 -1.261 63.182 1.00 40.84 H new ATOM 0 HG LEU A 227 46.296 0.592 65.319 1.00 40.81 H new ATOM 0 HD11 LEU A 227 44.037 0.030 65.428 1.00 42.51 H new ATOM 0 HD12 LEU A 227 44.373 0.674 64.021 1.00 42.51 H new ATOM 0 HD13 LEU A 227 44.206 -0.895 64.154 1.00 42.51 H new ATOM 0 HD21 LEU A 227 45.757 -1.267 66.644 1.00 41.58 H new ATOM 0 HD22 LEU A 227 45.974 -2.217 65.395 1.00 41.58 H new ATOM 0 HD23 LEU A 227 47.204 -1.443 66.025 1.00 41.58 H new ATOM 1633 N ALA A 228 50.269 -0.875 62.473 1.00 42.67 N ATOM 1634 CA ALA A 228 51.152 -0.903 61.310 1.00 42.96 C ATOM 1635 C ALA A 228 50.508 -1.284 59.979 1.00 40.81 C ATOM 1636 O ALA A 228 50.799 -0.673 58.953 1.00 43.60 O ATOM 1637 CB ALA A 228 52.337 -1.831 61.598 1.00 44.38 C ATOM 0 H ALA A 228 50.623 -1.216 63.179 1.00 42.67 H new ATOM 0 HA ALA A 228 51.431 0.018 61.186 1.00 42.96 H new ATOM 0 HB1 ALA A 228 52.926 -1.852 60.828 1.00 44.38 H new ATOM 0 HB2 ALA A 228 52.825 -1.503 62.369 1.00 44.38 H new ATOM 0 HB3 ALA A 228 52.011 -2.726 61.780 1.00 44.38 H new ATOM 1638 N GLY A 229 49.637 -2.284 59.980 1.00 38.63 N ATOM 1639 CA GLY A 229 49.016 -2.684 58.728 1.00 38.42 C ATOM 1640 C GLY A 229 47.657 -2.077 58.406 1.00 37.31 C ATOM 1641 O GLY A 229 47.041 -2.433 57.407 1.00 35.98 O ATOM 0 H GLY A 229 49.397 -2.732 60.674 1.00 38.63 H new ATOM 0 HA2 GLY A 229 49.624 -2.462 58.005 1.00 38.42 H new ATOM 0 HA3 GLY A 229 48.921 -3.649 58.733 1.00 38.42 H new ATOM 1642 N ALA A 230 47.177 -1.166 59.242 1.00 36.81 N ATOM 1643 CA ALA A 230 45.874 -0.553 59.003 1.00 36.77 C ATOM 1644 C ALA A 230 45.801 0.173 57.664 1.00 36.47 C ATOM 1645 O ALA A 230 46.774 0.779 57.219 1.00 37.66 O ATOM 1646 CB ALA A 230 45.548 0.410 60.124 1.00 37.02 C ATOM 0 H ALA A 230 47.584 -0.890 59.947 1.00 36.81 H new ATOM 0 HA ALA A 230 45.222 -1.271 58.976 1.00 36.77 H new ATOM 0 HB1 ALA A 230 44.682 0.815 59.961 1.00 37.02 H new ATOM 0 HB2 ALA A 230 45.527 -0.069 60.967 1.00 37.02 H new ATOM 0 HB3 ALA A 230 46.226 1.103 60.163 1.00 37.02 H new ATOM 1647 N ARG A 231 44.642 0.099 57.020 1.00 36.84 N ATOM 1648 CA ARG A 231 44.431 0.783 55.747 1.00 35.92 C ATOM 1649 C ARG A 231 43.771 2.123 56.042 1.00 33.99 C ATOM 1650 O ARG A 231 42.679 2.166 56.601 1.00 31.98 O ATOM 1651 CB ARG A 231 43.495 -0.010 54.839 1.00 37.71 C ATOM 1652 CG ARG A 231 43.950 -1.413 54.502 1.00 45.42 C ATOM 1653 CD ARG A 231 43.000 -2.025 53.490 1.00 49.27 C ATOM 1654 NE ARG A 231 43.227 -3.452 53.318 1.00 54.25 N ATOM 1655 CZ ARG A 231 42.756 -4.160 52.300 1.00 56.35 C ATOM 1656 NH1 ARG A 231 42.031 -3.571 51.360 1.00 55.96 N ATOM 1657 NH2 ARG A 231 43.016 -5.458 52.220 1.00 60.68 N ATOM 0 H ARG A 231 43.961 -0.344 57.304 1.00 36.84 H new ATOM 0 HA ARG A 231 45.286 0.885 55.301 1.00 35.92 H new ATOM 0 HB2 ARG A 231 42.625 -0.062 55.264 1.00 37.71 H new ATOM 0 HB3 ARG A 231 43.378 0.483 54.012 1.00 37.71 H new ATOM 0 HG2 ARG A 231 44.851 -1.394 54.143 1.00 45.42 H new ATOM 0 HG3 ARG A 231 43.976 -1.956 55.305 1.00 45.42 H new ATOM 0 HD2 ARG A 231 42.085 -1.877 53.776 1.00 49.27 H new ATOM 0 HD3 ARG A 231 43.106 -1.577 52.636 1.00 49.27 H new ATOM 0 HE ARG A 231 43.695 -3.861 53.912 1.00 54.25 H new ATOM 0 HH11 ARG A 231 41.865 -2.729 51.409 1.00 55.96 H new ATOM 0 HH12 ARG A 231 41.726 -4.031 50.700 1.00 55.96 H new ATOM 0 HH21 ARG A 231 43.490 -5.840 52.828 1.00 60.68 H new ATOM 0 HH22 ARG A 231 42.711 -5.918 51.560 1.00 60.68 H new ATOM 1658 N ILE A 232 44.431 3.214 55.676 1.00 32.41 N ATOM 1659 CA ILE A 232 43.859 4.526 55.909 1.00 30.64 C ATOM 1660 C ILE A 232 43.095 4.953 54.663 1.00 29.68 C ATOM 1661 O ILE A 232 43.659 5.065 53.578 1.00 29.20 O ATOM 1662 CB ILE A 232 44.947 5.570 56.262 1.00 31.15 C ATOM 1663 CG1 ILE A 232 45.455 5.341 57.692 1.00 32.38 C ATOM 1664 CG2 ILE A 232 44.355 6.986 56.211 1.00 27.18 C ATOM 1665 CD1 ILE A 232 46.006 3.965 57.970 1.00 34.92 C ATOM 0 H ILE A 232 45.202 3.215 55.296 1.00 32.41 H new ATOM 0 HA ILE A 232 43.257 4.476 56.668 1.00 30.64 H new ATOM 0 HB ILE A 232 45.670 5.476 55.622 1.00 31.15 H new ATOM 0 HG12 ILE A 232 46.147 5.994 57.882 1.00 32.38 H new ATOM 0 HG13 ILE A 232 44.726 5.512 58.309 1.00 32.38 H new ATOM 0 HG21 ILE A 232 45.043 7.633 56.433 1.00 27.18 H new ATOM 0 HG22 ILE A 232 44.020 7.165 55.318 1.00 27.18 H new ATOM 0 HG23 ILE A 232 43.628 7.056 56.849 1.00 27.18 H new ATOM 0 HD11 ILE A 232 46.301 3.915 58.893 1.00 34.92 H new ATOM 0 HD12 ILE A 232 45.315 3.302 57.815 1.00 34.92 H new ATOM 0 HD13 ILE A 232 46.757 3.792 57.381 1.00 34.92 H new HETATM 1666 N MSE A 233 41.799 5.185 54.819 1.00 29.02 N HETATM 1667 CA MSE A 233 40.974 5.573 53.680 1.00 31.29 C HETATM 1668 C MSE A 233 40.062 6.754 53.996 1.00 30.35 C HETATM 1669 O MSE A 233 38.944 6.588 54.483 1.00 28.17 O HETATM 1670 CB MSE A 233 40.159 4.371 53.218 1.00 31.37 C HETATM 1671 CG MSE A 233 41.017 3.273 52.606 1.00 37.66 C HETATM 1672 SE MSE A 233 39.942 1.786 52.046 1.00 47.68 SE HETATM 1673 CE MSE A 233 38.965 2.667 50.607 1.00 39.19 C HETATM 0 H MSE A 233 41.379 5.125 55.567 1.00 29.02 H new HETATM 0 HA MSE A 233 41.564 5.865 52.968 1.00 31.29 H new HETATM 0 HB2 MSE A 233 39.669 4.009 53.973 1.00 31.37 H new HETATM 0 HB3 MSE A 233 39.502 4.663 52.567 1.00 31.37 H new HETATM 0 HG2 MSE A 233 41.506 3.626 51.846 1.00 37.66 H new HETATM 0 HG3 MSE A 233 41.675 2.974 53.253 1.00 37.66 H new HETATM 0 HE1 MSE A 233 38.352 2.036 50.198 1.00 39.19 H new HETATM 0 HE2 MSE A 233 38.464 3.416 50.967 1.00 39.19 H new HETATM 0 HE3 MSE A 233 39.591 2.988 49.940 1.00 39.19 H new ATOM 1674 N PRO A 234 40.540 7.969 53.708 1.00 31.12 N ATOM 1675 CA PRO A 234 39.802 9.213 53.952 1.00 31.28 C ATOM 1676 C PRO A 234 38.406 9.222 53.331 1.00 31.04 C ATOM 1677 O PRO A 234 37.489 9.816 53.882 1.00 30.62 O ATOM 1678 CB PRO A 234 40.699 10.288 53.320 1.00 31.88 C ATOM 1679 CG PRO A 234 42.071 9.671 53.334 1.00 32.71 C ATOM 1680 CD PRO A 234 41.794 8.233 52.978 1.00 31.58 C ATOM 0 HA PRO A 234 39.635 9.350 54.898 1.00 31.28 H new ATOM 0 HB2 PRO A 234 40.415 10.502 52.418 1.00 31.88 H new ATOM 0 HB3 PRO A 234 40.676 11.114 53.828 1.00 31.88 H new ATOM 0 HG2 PRO A 234 42.662 10.093 52.691 1.00 32.71 H new ATOM 0 HG3 PRO A 234 42.493 9.752 54.204 1.00 32.71 H new ATOM 0 HD2 PRO A 234 41.690 8.110 52.022 1.00 31.58 H new ATOM 0 HD3 PRO A 234 42.510 7.644 53.263 1.00 31.58 H new ATOM 1681 N ASP A 235 38.256 8.552 52.192 1.00 28.79 N ATOM 1682 CA ASP A 235 36.982 8.532 51.480 1.00 29.86 C ATOM 1683 C ASP A 235 36.172 7.243 51.571 1.00 27.87 C ATOM 1684 O ASP A 235 35.359 6.965 50.689 1.00 30.07 O ATOM 1685 CB ASP A 235 37.231 8.862 50.008 1.00 32.26 C ATOM 1686 CG ASP A 235 37.856 10.243 49.808 1.00 39.32 C ATOM 1687 OD1 ASP A 235 38.419 10.475 48.716 1.00 45.01 O ATOM 1688 OD2 ASP A 235 37.778 11.100 50.720 1.00 37.40 O ATOM 0 H ASP A 235 38.883 8.101 51.813 1.00 28.79 H new ATOM 0 HA ASP A 235 36.437 9.197 51.929 1.00 29.86 H new ATOM 0 HB2 ASP A 235 37.814 8.189 49.624 1.00 32.26 H new ATOM 0 HB3 ASP A 235 36.391 8.819 49.525 1.00 32.26 H new ATOM 1689 N LEU A 236 36.381 6.469 52.632 1.00 26.73 N ATOM 1690 CA LEU A 236 35.673 5.201 52.831 1.00 28.12 C ATOM 1691 C LEU A 236 34.164 5.325 52.649 1.00 26.46 C ATOM 1692 O LEU A 236 33.558 4.559 51.903 1.00 25.40 O ATOM 1693 CB LEU A 236 35.930 4.644 54.239 1.00 27.00 C ATOM 1694 CG LEU A 236 36.290 3.160 54.401 1.00 32.23 C ATOM 1695 CD1 LEU A 236 35.887 2.685 55.793 1.00 29.31 C ATOM 1696 CD2 LEU A 236 35.614 2.324 53.341 1.00 31.58 C ATOM 0 H LEU A 236 36.937 6.662 53.259 1.00 26.73 H new ATOM 0 HA LEU A 236 36.021 4.602 52.152 1.00 28.12 H new ATOM 0 HB2 LEU A 236 36.648 5.164 54.632 1.00 27.00 H new ATOM 0 HB3 LEU A 236 35.135 4.812 54.769 1.00 27.00 H new ATOM 0 HG LEU A 236 37.249 3.057 54.294 1.00 32.23 H new ATOM 0 HD11 LEU A 236 36.115 1.748 55.894 1.00 29.31 H new ATOM 0 HD12 LEU A 236 36.358 3.206 56.462 1.00 29.31 H new ATOM 0 HD13 LEU A 236 34.931 2.799 55.910 1.00 29.31 H new ATOM 0 HD21 LEU A 236 35.854 1.392 53.462 1.00 31.58 H new ATOM 0 HD22 LEU A 236 34.652 2.422 53.416 1.00 31.58 H new ATOM 0 HD23 LEU A 236 35.901 2.620 52.463 1.00 31.58 H new ATOM 1697 N VAL A 237 33.559 6.281 53.351 1.00 26.54 N ATOM 1698 CA VAL A 237 32.117 6.462 53.263 1.00 27.82 C ATOM 1699 C VAL A 237 31.674 6.647 51.811 1.00 27.58 C ATOM 1700 O VAL A 237 30.650 6.101 51.398 1.00 28.12 O ATOM 1701 CB VAL A 237 31.636 7.659 54.140 1.00 28.36 C ATOM 1702 CG1 VAL A 237 32.196 8.961 53.618 1.00 31.39 C ATOM 1703 CG2 VAL A 237 30.125 7.715 54.153 1.00 30.09 C ATOM 0 H VAL A 237 33.962 6.828 53.878 1.00 26.54 H new ATOM 0 HA VAL A 237 31.703 5.656 53.608 1.00 27.82 H new ATOM 0 HB VAL A 237 31.958 7.526 55.045 1.00 28.36 H new ATOM 0 HG11 VAL A 237 31.887 9.693 54.175 1.00 31.39 H new ATOM 0 HG12 VAL A 237 33.165 8.928 53.638 1.00 31.39 H new ATOM 0 HG13 VAL A 237 31.896 9.100 52.706 1.00 31.39 H new ATOM 0 HG21 VAL A 237 29.833 8.461 54.700 1.00 30.09 H new ATOM 0 HG22 VAL A 237 29.797 7.831 53.247 1.00 30.09 H new ATOM 0 HG23 VAL A 237 29.774 6.889 54.520 1.00 30.09 H new ATOM 1704 N PHE A 238 32.450 7.390 51.030 1.00 28.05 N ATOM 1705 CA PHE A 238 32.101 7.600 49.626 1.00 31.08 C ATOM 1706 C PHE A 238 32.157 6.309 48.807 1.00 31.69 C ATOM 1707 O PHE A 238 31.466 6.182 47.795 1.00 32.00 O ATOM 1708 CB PHE A 238 33.004 8.667 48.999 1.00 32.65 C ATOM 1709 CG PHE A 238 32.694 10.060 49.463 1.00 32.42 C ATOM 1710 CD1 PHE A 238 31.382 10.520 49.485 1.00 35.91 C ATOM 1711 CD2 PHE A 238 33.706 10.915 49.867 1.00 35.80 C ATOM 1712 CE1 PHE A 238 31.077 11.822 49.907 1.00 36.92 C ATOM 1713 CE2 PHE A 238 33.418 12.214 50.289 1.00 38.69 C ATOM 1714 CZ PHE A 238 32.098 12.668 50.307 1.00 36.94 C ATOM 0 H PHE A 238 33.174 7.777 51.287 1.00 28.05 H new ATOM 0 HA PHE A 238 31.182 7.909 49.609 1.00 31.08 H new ATOM 0 HB2 PHE A 238 33.929 8.462 49.209 1.00 32.65 H new ATOM 0 HB3 PHE A 238 32.917 8.628 48.034 1.00 32.65 H new ATOM 0 HD1 PHE A 238 30.695 9.954 49.215 1.00 35.91 H new ATOM 0 HD2 PHE A 238 34.588 10.620 49.857 1.00 35.80 H new ATOM 0 HE1 PHE A 238 30.195 12.116 49.918 1.00 36.92 H new ATOM 0 HE2 PHE A 238 34.107 12.778 50.559 1.00 38.69 H new ATOM 0 HZ PHE A 238 31.905 13.534 50.586 1.00 36.94 H new ATOM 1715 N VAL A 239 32.984 5.357 49.235 1.00 31.54 N ATOM 1716 CA VAL A 239 33.059 4.078 48.542 1.00 30.87 C ATOM 1717 C VAL A 239 31.718 3.404 48.809 1.00 31.40 C ATOM 1718 O VAL A 239 31.097 2.846 47.909 1.00 30.98 O ATOM 1719 CB VAL A 239 34.191 3.175 49.099 1.00 33.05 C ATOM 1720 CG1 VAL A 239 34.076 1.766 48.510 1.00 30.79 C ATOM 1721 CG2 VAL A 239 35.558 3.777 48.760 1.00 31.09 C ATOM 0 H VAL A 239 33.503 5.432 49.916 1.00 31.54 H new ATOM 0 HA VAL A 239 33.247 4.214 47.600 1.00 30.87 H new ATOM 0 HB VAL A 239 34.103 3.120 50.063 1.00 33.05 H new ATOM 0 HG11 VAL A 239 34.787 1.208 48.863 1.00 30.79 H new ATOM 0 HG12 VAL A 239 33.217 1.384 48.749 1.00 30.79 H new ATOM 0 HG13 VAL A 239 34.151 1.812 47.544 1.00 30.79 H new ATOM 0 HG21 VAL A 239 36.259 3.207 49.112 1.00 31.09 H new ATOM 0 HG22 VAL A 239 35.651 3.847 47.797 1.00 31.09 H new ATOM 0 HG23 VAL A 239 35.630 4.659 49.156 1.00 31.09 H new ATOM 1722 N GLY A 240 31.267 3.481 50.057 1.00 31.17 N ATOM 1723 CA GLY A 240 29.993 2.879 50.411 1.00 30.69 C ATOM 1724 C GLY A 240 28.813 3.596 49.770 1.00 31.45 C ATOM 1725 O GLY A 240 27.811 2.968 49.436 1.00 28.89 O ATOM 0 H GLY A 240 31.678 3.872 50.703 1.00 31.17 H new ATOM 0 HA2 GLY A 240 29.991 1.949 50.136 1.00 30.69 H new ATOM 0 HA3 GLY A 240 29.890 2.890 51.375 1.00 30.69 H new ATOM 1726 N LEU A 241 28.928 4.910 49.596 1.00 31.64 N ATOM 1727 CA LEU A 241 27.847 5.685 48.999 1.00 32.78 C ATOM 1728 C LEU A 241 27.607 5.261 47.553 1.00 34.91 C ATOM 1729 O LEU A 241 26.474 5.287 47.072 1.00 35.50 O ATOM 1730 CB LEU A 241 28.166 7.184 49.052 1.00 30.31 C ATOM 1731 CG LEU A 241 27.141 8.135 48.403 1.00 32.63 C ATOM 1732 CD1 LEU A 241 25.752 7.943 49.031 1.00 28.57 C ATOM 1733 CD2 LEU A 241 27.609 9.574 48.580 1.00 24.79 C ATOM 0 H LEU A 241 29.621 5.369 49.816 1.00 31.64 H new ATOM 0 HA LEU A 241 27.041 5.514 49.511 1.00 32.78 H new ATOM 0 HB2 LEU A 241 28.268 7.439 49.982 1.00 30.31 H new ATOM 0 HB3 LEU A 241 29.024 7.326 48.623 1.00 30.31 H new ATOM 0 HG LEU A 241 27.073 7.932 47.457 1.00 32.63 H new ATOM 0 HD11 LEU A 241 25.121 8.548 48.612 1.00 28.57 H new ATOM 0 HD12 LEU A 241 25.460 7.028 48.897 1.00 28.57 H new ATOM 0 HD13 LEU A 241 25.797 8.132 49.981 1.00 28.57 H new ATOM 0 HD21 LEU A 241 26.966 10.176 48.173 1.00 24.79 H new ATOM 0 HD22 LEU A 241 27.686 9.775 49.526 1.00 24.79 H new ATOM 0 HD23 LEU A 241 28.473 9.688 48.154 1.00 24.79 H new ATOM 1734 N ALA A 242 28.670 4.868 46.858 1.00 35.14 N ATOM 1735 CA ALA A 242 28.521 4.446 45.472 1.00 35.51 C ATOM 1736 C ALA A 242 27.736 3.144 45.452 1.00 35.62 C ATOM 1737 O ALA A 242 26.932 2.905 44.558 1.00 36.61 O ATOM 1738 CB ALA A 242 29.886 4.256 44.817 1.00 32.28 C ATOM 0 H ALA A 242 29.473 4.839 47.165 1.00 35.14 H new ATOM 0 HA ALA A 242 28.047 5.127 44.970 1.00 35.51 H new ATOM 0 HB1 ALA A 242 29.767 3.975 43.896 1.00 32.28 H new ATOM 0 HB2 ALA A 242 30.375 5.093 44.839 1.00 32.28 H new ATOM 0 HB3 ALA A 242 30.385 3.578 45.299 1.00 32.28 H new ATOM 1739 N LEU A 243 27.965 2.305 46.453 1.00 37.11 N ATOM 1740 CA LEU A 243 27.264 1.033 46.535 1.00 37.94 C ATOM 1741 C LEU A 243 25.797 1.250 46.873 1.00 38.88 C ATOM 1742 O LEU A 243 24.923 0.567 46.340 1.00 39.44 O ATOM 1743 CB LEU A 243 27.919 0.137 47.590 1.00 36.61 C ATOM 1744 CG LEU A 243 29.349 -0.304 47.263 1.00 37.92 C ATOM 1745 CD1 LEU A 243 29.956 -1.045 48.453 1.00 35.88 C ATOM 1746 CD2 LEU A 243 29.332 -1.188 46.030 1.00 33.48 C ATOM 0 H LEU A 243 28.520 2.453 47.093 1.00 37.11 H new ATOM 0 HA LEU A 243 27.319 0.596 45.671 1.00 37.94 H new ATOM 0 HB2 LEU A 243 27.926 0.609 48.437 1.00 36.61 H new ATOM 0 HB3 LEU A 243 27.370 -0.654 47.710 1.00 36.61 H new ATOM 0 HG LEU A 243 29.897 0.476 47.083 1.00 37.92 H new ATOM 0 HD11 LEU A 243 30.861 -1.320 48.236 1.00 35.88 H new ATOM 0 HD12 LEU A 243 29.973 -0.458 49.225 1.00 35.88 H new ATOM 0 HD13 LEU A 243 29.420 -1.828 48.654 1.00 35.88 H new ATOM 0 HD21 LEU A 243 30.236 -1.469 45.820 1.00 33.48 H new ATOM 0 HD22 LEU A 243 28.782 -1.969 46.199 1.00 33.48 H new ATOM 0 HD23 LEU A 243 28.966 -0.692 45.281 1.00 33.48 H new ATOM 1747 N ALA A 244 25.533 2.212 47.751 1.00 39.90 N ATOM 1748 CA ALA A 244 24.171 2.522 48.176 1.00 41.38 C ATOM 1749 C ALA A 244 23.368 3.261 47.105 1.00 43.29 C ATOM 1750 O ALA A 244 22.153 3.073 46.987 1.00 43.28 O ATOM 1751 CB ALA A 244 24.205 3.350 49.459 1.00 40.41 C ATOM 0 H ALA A 244 26.137 2.703 48.117 1.00 39.90 H new ATOM 0 HA ALA A 244 23.724 1.676 48.334 1.00 41.38 H new ATOM 0 HB1 ALA A 244 23.298 3.553 49.737 1.00 40.41 H new ATOM 0 HB2 ALA A 244 24.652 2.847 50.157 1.00 40.41 H new ATOM 0 HB3 ALA A 244 24.686 4.177 49.298 1.00 40.41 H new ATOM 1752 N CYS A 245 24.046 4.104 46.330 1.00 43.34 N ATOM 1753 CA CYS A 245 23.384 4.874 45.282 1.00 42.43 C ATOM 1754 C CYS A 245 24.143 4.766 43.962 1.00 43.13 C ATOM 1755 O CYS A 245 24.854 5.690 43.558 1.00 39.63 O ATOM 1756 CB CYS A 245 23.282 6.343 45.700 1.00 41.75 C ATOM 1757 SG CYS A 245 22.381 6.642 47.233 1.00 43.13 S ATOM 0 H CYS A 245 24.892 4.244 46.396 1.00 43.34 H new ATOM 0 HA CYS A 245 22.494 4.510 45.155 1.00 42.43 H new ATOM 0 HB2 CYS A 245 24.179 6.701 45.793 1.00 41.75 H new ATOM 0 HB3 CYS A 245 22.851 6.839 44.986 1.00 41.75 H new ATOM 0 HG CYS A 245 22.364 7.819 47.465 1.00 43.13 H new ATOM 1758 N PRO A 246 24.008 3.623 43.274 1.00 45.64 N ATOM 1759 CA PRO A 246 24.700 3.428 41.998 1.00 48.09 C ATOM 1760 C PRO A 246 24.179 4.381 40.930 1.00 50.73 C ATOM 1761 O PRO A 246 22.992 4.697 40.897 1.00 51.86 O ATOM 1762 CB PRO A 246 24.426 1.960 41.679 1.00 47.36 C ATOM 1763 CG PRO A 246 23.096 1.712 42.324 1.00 47.03 C ATOM 1764 CD PRO A 246 23.223 2.429 43.641 1.00 46.33 C ATOM 0 HA PRO A 246 25.650 3.622 42.035 1.00 48.09 H new ATOM 0 HB2 PRO A 246 24.396 1.801 40.723 1.00 47.36 H new ATOM 0 HB3 PRO A 246 25.114 1.380 42.042 1.00 47.36 H new ATOM 0 HG2 PRO A 246 22.366 2.065 41.791 1.00 47.03 H new ATOM 0 HG3 PRO A 246 22.926 0.765 42.445 1.00 47.03 H new ATOM 0 HD2 PRO A 246 22.357 2.664 44.010 1.00 46.33 H new ATOM 0 HD3 PRO A 246 23.677 1.888 44.306 1.00 46.33 H new ATOM 1765 N ILE A 247 25.074 4.851 40.071 1.00 53.58 N ATOM 1766 CA ILE A 247 24.694 5.773 39.011 1.00 56.99 C ATOM 1767 C ILE A 247 25.161 5.283 37.644 1.00 59.61 C ATOM 1768 O ILE A 247 26.252 4.729 37.517 1.00 58.92 O ATOM 1769 CB ILE A 247 25.273 7.181 39.270 1.00 56.77 C ATOM 1770 CG1 ILE A 247 24.616 7.787 40.511 1.00 56.68 C ATOM 1771 CG2 ILE A 247 25.049 8.075 38.061 1.00 56.55 C ATOM 1772 CD1 ILE A 247 25.136 9.160 40.874 1.00 55.65 C ATOM 0 H ILE A 247 25.909 4.647 40.085 1.00 53.58 H new ATOM 0 HA ILE A 247 23.725 5.817 39.011 1.00 56.99 H new ATOM 0 HB ILE A 247 26.228 7.108 39.422 1.00 56.77 H new ATOM 0 HG12 ILE A 247 23.659 7.842 40.364 1.00 56.68 H new ATOM 0 HG13 ILE A 247 24.754 7.190 41.263 1.00 56.68 H new ATOM 0 HG21 ILE A 247 25.417 8.955 38.237 1.00 56.55 H new ATOM 0 HG22 ILE A 247 25.489 7.690 37.287 1.00 56.55 H new ATOM 0 HG23 ILE A 247 24.098 8.151 37.887 1.00 56.55 H new ATOM 0 HD11 ILE A 247 24.677 9.481 41.666 1.00 55.65 H new ATOM 0 HD12 ILE A 247 26.088 9.109 41.051 1.00 55.65 H new ATOM 0 HD13 ILE A 247 24.976 9.772 40.138 1.00 55.65 H new ATOM 1773 N GLU A 248 24.317 5.497 36.635 1.00 63.63 N ATOM 1774 CA GLU A 248 24.582 5.107 35.249 1.00 66.74 C ATOM 1775 C GLU A 248 25.709 4.095 35.088 1.00 67.23 C ATOM 1776 O GLU A 248 26.045 3.810 33.918 1.00 67.35 O ATOM 1777 CB GLU A 248 24.881 6.355 34.407 1.00 69.84 C ATOM 1778 CG GLU A 248 25.997 7.241 34.956 1.00 74.72 C ATOM 1779 CD GLU A 248 27.390 6.682 34.704 1.00 77.89 C ATOM 1780 OE1 GLU A 248 28.356 7.197 35.309 1.00 79.38 O ATOM 1781 OE2 GLU A 248 27.523 5.740 33.893 1.00 79.75 O ATOM 0 H GLU A 248 23.555 5.883 36.740 1.00 63.63 H new ATOM 0 HA GLU A 248 23.778 4.664 34.937 1.00 66.74 H new ATOM 0 HB2 GLU A 248 25.118 6.075 33.509 1.00 69.84 H new ATOM 0 HB3 GLU A 248 24.071 6.883 34.335 1.00 69.84 H new ATOM 0 HG2 GLU A 248 25.931 8.121 34.553 1.00 74.72 H new ATOM 0 HG3 GLU A 248 25.870 7.356 35.911 1.00 74.72 H new TER 1782 GLU A 248 ATOM 1783 N SER B 0 35.682 17.889 119.839 1.00 53.43 N ATOM 1784 CA SER B 0 35.705 18.809 118.662 1.00 54.42 C ATOM 1785 C SER B 0 36.137 18.073 117.399 1.00 53.71 C ATOM 1786 O SER B 0 37.072 17.268 117.414 1.00 55.46 O ATOM 1787 CB SER B 0 36.662 19.976 118.912 1.00 54.51 C ATOM 1788 OG SER B 0 38.007 19.532 118.931 1.00 57.62 O ATOM 0 H1 SER B 0 35.428 18.339 120.563 1.00 53.43 H new ATOM 0 H2 SER B 0 35.109 17.225 119.686 1.00 53.43 H new ATOM 0 H3 SER B 0 36.496 17.553 119.970 1.00 53.43 H new ATOM 0 HA SER B 0 34.804 19.147 118.538 1.00 54.42 H new ATOM 0 HB2 SER B 0 36.548 20.646 118.220 1.00 54.51 H new ATOM 0 HB3 SER B 0 36.446 20.401 119.757 1.00 54.51 H new ATOM 0 HG SER B 0 38.516 20.186 119.068 1.00 57.62 H new HETATM 1789 N MSE B 1 35.454 18.365 116.302 1.00 51.43 N HETATM 1790 CA MSE B 1 35.754 17.727 115.036 1.00 49.50 C HETATM 1791 C MSE B 1 36.176 18.744 113.988 1.00 47.76 C HETATM 1792 O MSE B 1 36.168 19.949 114.245 1.00 47.30 O HETATM 1793 CB MSE B 1 34.532 16.951 114.567 1.00 51.24 C HETATM 1794 CG MSE B 1 34.110 15.885 115.560 1.00 52.52 C HETATM 1795 SE MSE B 1 32.543 14.979 114.976 1.00 60.24 SE HETATM 1796 CE MSE B 1 32.059 14.092 116.631 1.00 56.22 C HETATM 0 H MSE B 1 34.810 18.934 116.272 1.00 51.43 H new HETATM 0 HA MSE B 1 36.498 17.118 115.162 1.00 49.50 H new HETATM 0 HB2 MSE B 1 33.796 17.566 114.424 1.00 51.24 H new HETATM 0 HB3 MSE B 1 34.724 16.535 113.712 1.00 51.24 H new HETATM 0 HG2 MSE B 1 34.830 15.246 115.678 1.00 52.52 H new HETATM 0 HG3 MSE B 1 33.947 16.292 116.425 1.00 52.52 H new HETATM 0 HE1 MSE B 1 31.252 13.571 116.495 1.00 56.22 H new HETATM 0 HE2 MSE B 1 32.780 13.505 116.906 1.00 56.22 H new HETATM 0 HE3 MSE B 1 31.902 14.756 117.320 1.00 56.22 H new ATOM 1797 N ILE B 2 36.540 18.253 112.809 1.00 45.10 N ATOM 1798 CA ILE B 2 36.983 19.116 111.723 1.00 43.25 C ATOM 1799 C ILE B 2 36.146 18.941 110.465 1.00 42.62 C ATOM 1800 O ILE B 2 35.864 17.820 110.044 1.00 43.47 O ATOM 1801 CB ILE B 2 38.454 18.828 111.358 1.00 44.18 C ATOM 1802 CG1 ILE B 2 39.345 19.001 112.590 1.00 43.41 C ATOM 1803 CG2 ILE B 2 38.904 19.754 110.237 1.00 43.60 C ATOM 1804 CD1 ILE B 2 40.774 18.518 112.390 1.00 42.35 C ATOM 0 H ILE B 2 36.537 17.415 112.617 1.00 45.10 H new ATOM 0 HA ILE B 2 36.882 20.025 112.046 1.00 43.25 H new ATOM 0 HB ILE B 2 38.530 17.911 111.050 1.00 44.18 H new ATOM 0 HG12 ILE B 2 39.362 19.939 112.837 1.00 43.41 H new ATOM 0 HG13 ILE B 2 38.951 18.519 113.334 1.00 43.41 H new ATOM 0 HG21 ILE B 2 39.829 19.566 110.014 1.00 43.60 H new ATOM 0 HG22 ILE B 2 38.348 19.610 109.455 1.00 43.60 H new ATOM 0 HG23 ILE B 2 38.822 20.676 110.526 1.00 43.60 H new ATOM 0 HD11 ILE B 2 41.280 18.657 113.206 1.00 42.35 H new ATOM 0 HD12 ILE B 2 40.769 17.573 112.170 1.00 42.35 H new ATOM 0 HD13 ILE B 2 41.186 19.016 111.666 1.00 42.35 H new ATOM 1805 N LEU B 3 35.741 20.059 109.875 1.00 42.36 N ATOM 1806 CA LEU B 3 34.963 20.032 108.643 1.00 41.05 C ATOM 1807 C LEU B 3 35.955 20.204 107.498 1.00 40.61 C ATOM 1808 O LEU B 3 36.760 21.140 107.499 1.00 39.03 O ATOM 1809 CB LEU B 3 33.949 21.177 108.623 1.00 42.01 C ATOM 1810 CG LEU B 3 33.215 21.410 107.301 1.00 42.18 C ATOM 1811 CD1 LEU B 3 32.437 20.164 106.902 1.00 41.10 C ATOM 1812 CD2 LEU B 3 32.284 22.601 107.453 1.00 44.07 C ATOM 0 H LEU B 3 35.907 20.848 110.174 1.00 42.36 H new ATOM 0 HA LEU B 3 34.470 19.200 108.566 1.00 41.05 H new ATOM 0 HB2 LEU B 3 33.288 21.010 109.313 1.00 42.01 H new ATOM 0 HB3 LEU B 3 34.410 21.996 108.864 1.00 42.01 H new ATOM 0 HG LEU B 3 33.859 21.597 106.600 1.00 42.18 H new ATOM 0 HD11 LEU B 3 31.977 20.324 106.063 1.00 41.10 H new ATOM 0 HD12 LEU B 3 33.050 19.420 106.797 1.00 41.10 H new ATOM 0 HD13 LEU B 3 31.788 19.953 107.591 1.00 41.10 H new ATOM 0 HD21 LEU B 3 31.815 22.754 106.618 1.00 44.07 H new ATOM 0 HD22 LEU B 3 31.640 22.421 108.156 1.00 44.07 H new ATOM 0 HD23 LEU B 3 32.801 23.389 107.682 1.00 44.07 H new ATOM 1813 N GLU B 4 35.900 19.300 106.527 1.00 39.40 N ATOM 1814 CA GLU B 4 36.812 19.361 105.396 1.00 38.62 C ATOM 1815 C GLU B 4 36.046 19.488 104.089 1.00 39.39 C ATOM 1816 O GLU B 4 35.037 18.816 103.884 1.00 39.35 O ATOM 1817 CB GLU B 4 37.694 18.107 105.363 1.00 35.94 C ATOM 1818 CG GLU B 4 38.432 17.833 106.667 1.00 35.53 C ATOM 1819 CD GLU B 4 39.501 16.747 106.528 1.00 35.20 C ATOM 1820 OE1 GLU B 4 39.182 15.646 106.036 1.00 32.84 O ATOM 1821 OE2 GLU B 4 40.659 16.995 106.920 1.00 34.79 O ATOM 0 H GLU B 4 35.343 18.645 106.505 1.00 39.40 H new ATOM 0 HA GLU B 4 37.373 20.145 105.501 1.00 38.62 H new ATOM 0 HB2 GLU B 4 37.141 17.340 105.148 1.00 35.94 H new ATOM 0 HB3 GLU B 4 38.343 18.198 104.648 1.00 35.94 H new ATOM 0 HG2 GLU B 4 38.848 18.653 106.976 1.00 35.53 H new ATOM 0 HG3 GLU B 4 37.792 17.566 107.346 1.00 35.53 H new ATOM 1822 N LEU B 5 36.529 20.349 103.201 1.00 40.51 N ATOM 1823 CA LEU B 5 35.857 20.538 101.923 1.00 44.11 C ATOM 1824 C LEU B 5 36.782 20.589 100.714 1.00 45.51 C ATOM 1825 O LEU B 5 37.896 21.116 100.772 1.00 45.11 O ATOM 1826 CB LEU B 5 35.012 21.817 101.948 1.00 44.24 C ATOM 1827 CG LEU B 5 34.057 22.015 103.127 1.00 44.25 C ATOM 1828 CD1 LEU B 5 34.808 22.665 104.282 1.00 45.50 C ATOM 1829 CD2 LEU B 5 32.901 22.903 102.700 1.00 46.68 C ATOM 0 H LEU B 5 37.234 20.827 103.316 1.00 40.51 H new ATOM 0 HA LEU B 5 35.303 19.749 101.816 1.00 44.11 H new ATOM 0 HB2 LEU B 5 35.617 22.575 101.923 1.00 44.24 H new ATOM 0 HB3 LEU B 5 34.489 21.845 101.132 1.00 44.24 H new ATOM 0 HG LEU B 5 33.710 21.156 103.413 1.00 44.25 H new ATOM 0 HD11 LEU B 5 34.204 22.791 105.031 1.00 45.50 H new ATOM 0 HD12 LEU B 5 35.543 22.093 104.553 1.00 45.50 H new ATOM 0 HD13 LEU B 5 35.156 23.525 103.999 1.00 45.50 H new ATOM 0 HD21 LEU B 5 32.296 23.028 103.448 1.00 46.68 H new ATOM 0 HD22 LEU B 5 33.243 23.764 102.413 1.00 46.68 H new ATOM 0 HD23 LEU B 5 32.425 22.484 101.966 1.00 46.68 H new ATOM 1830 N ASP B 6 36.293 20.028 99.617 1.00 47.97 N ATOM 1831 CA ASP B 6 37.010 20.008 98.354 1.00 51.41 C ATOM 1832 C ASP B 6 36.078 20.689 97.356 1.00 52.19 C ATOM 1833 O ASP B 6 35.126 20.077 96.862 1.00 49.74 O ATOM 1834 CB ASP B 6 37.282 18.569 97.907 1.00 53.13 C ATOM 1835 CG ASP B 6 37.914 18.499 96.530 1.00 56.76 C ATOM 1836 OD1 ASP B 6 38.006 17.388 95.964 1.00 60.22 O ATOM 1837 OD2 ASP B 6 38.321 19.561 96.012 1.00 58.71 O ATOM 0 H ASP B 6 35.525 19.643 99.586 1.00 47.97 H new ATOM 0 HA ASP B 6 37.869 20.453 98.425 1.00 51.41 H new ATOM 0 HB2 ASP B 6 37.867 18.139 98.550 1.00 53.13 H new ATOM 0 HB3 ASP B 6 36.449 18.072 97.903 1.00 53.13 H new ATOM 1838 N CYS B 7 36.347 21.957 97.070 1.00 53.83 N ATOM 1839 CA CYS B 7 35.507 22.711 96.146 1.00 56.53 C ATOM 1840 C CYS B 7 35.968 22.585 94.700 1.00 57.19 C ATOM 1841 O CYS B 7 36.934 23.223 94.285 1.00 56.91 O ATOM 1842 CB CYS B 7 35.483 24.180 96.556 1.00 56.56 C ATOM 1843 SG CYS B 7 35.110 24.426 98.311 1.00 61.91 S ATOM 0 H CYS B 7 37.008 22.399 97.398 1.00 53.83 H new ATOM 0 HA CYS B 7 34.614 22.335 96.195 1.00 56.53 H new ATOM 0 HB2 CYS B 7 36.344 24.580 96.355 1.00 56.56 H new ATOM 0 HB3 CYS B 7 34.822 24.648 96.022 1.00 56.56 H new ATOM 0 HG CYS B 7 35.110 25.600 98.560 1.00 61.91 H new ATOM 1844 N GLY B 8 35.277 21.747 93.939 1.00 59.13 N ATOM 1845 CA GLY B 8 35.625 21.572 92.544 1.00 63.30 C ATOM 1846 C GLY B 8 34.900 22.615 91.714 1.00 65.61 C ATOM 1847 O GLY B 8 34.249 23.505 92.265 1.00 65.14 O ATOM 0 H GLY B 8 34.610 21.276 94.210 1.00 59.13 H new ATOM 0 HA2 GLY B 8 36.584 21.658 92.425 1.00 63.30 H new ATOM 0 HA3 GLY B 8 35.381 20.681 92.248 1.00 63.30 H new ATOM 1848 N ASN B 9 35.007 22.513 90.394 1.00 67.99 N ATOM 1849 CA ASN B 9 34.342 23.465 89.513 1.00 70.03 C ATOM 1850 C ASN B 9 32.829 23.321 89.620 1.00 71.14 C ATOM 1851 O ASN B 9 32.095 24.306 89.538 1.00 71.56 O ATOM 1852 CB ASN B 9 34.772 23.243 88.060 1.00 70.90 C ATOM 1853 CG ASN B 9 36.257 23.467 87.849 1.00 72.21 C ATOM 1854 OD1 ASN B 9 36.795 24.518 88.203 1.00 73.22 O ATOM 1855 ND2 ASN B 9 36.927 22.481 87.265 1.00 71.82 N ATOM 0 H ASN B 9 35.458 21.902 89.990 1.00 67.99 H new ATOM 0 HA ASN B 9 34.599 24.359 89.788 1.00 70.03 H new ATOM 0 HB2 ASN B 9 34.544 22.339 87.794 1.00 70.90 H new ATOM 0 HB3 ASN B 9 34.273 23.843 87.484 1.00 70.90 H new ATOM 0 HD21 ASN B 9 37.771 22.561 87.120 1.00 71.82 H new ATOM 0 HD22 ASN B 9 36.517 21.762 87.032 1.00 71.82 H new ATOM 1856 N SER B 10 32.370 22.089 89.814 1.00 71.73 N ATOM 1857 CA SER B 10 30.943 21.814 89.917 1.00 71.46 C ATOM 1858 C SER B 10 30.506 21.446 91.331 1.00 71.19 C ATOM 1859 O SER B 10 30.065 22.303 92.098 1.00 70.70 O ATOM 1860 CB SER B 10 30.564 20.686 88.957 1.00 71.43 C ATOM 1861 OG SER B 10 30.954 21.003 87.632 1.00 72.65 O ATOM 0 H SER B 10 32.872 21.395 89.889 1.00 71.73 H new ATOM 0 HA SER B 10 30.481 22.634 89.680 1.00 71.46 H new ATOM 0 HB2 SER B 10 30.991 19.861 89.236 1.00 71.43 H new ATOM 0 HB3 SER B 10 29.606 20.535 88.990 1.00 71.43 H new ATOM 0 HG SER B 10 30.740 20.373 87.119 1.00 72.65 H new ATOM 1862 N LEU B 11 30.631 20.167 91.671 1.00 70.54 N ATOM 1863 CA LEU B 11 30.226 19.679 92.984 1.00 68.85 C ATOM 1864 C LEU B 11 31.223 20.032 94.074 1.00 67.41 C ATOM 1865 O LEU B 11 32.390 20.314 93.798 1.00 67.96 O ATOM 1866 CB LEU B 11 30.042 18.159 92.957 1.00 69.57 C ATOM 1867 CG LEU B 11 29.159 17.556 91.861 1.00 70.17 C ATOM 1868 CD1 LEU B 11 29.895 17.586 90.532 1.00 71.21 C ATOM 1869 CD2 LEU B 11 28.806 16.121 92.224 1.00 71.48 C ATOM 0 H LEU B 11 30.951 19.562 91.151 1.00 70.54 H new ATOM 0 HA LEU B 11 29.386 20.118 93.191 1.00 68.85 H new ATOM 0 HB2 LEU B 11 30.921 17.755 92.885 1.00 69.57 H new ATOM 0 HB3 LEU B 11 29.676 17.890 93.814 1.00 69.57 H new ATOM 0 HG LEU B 11 28.344 18.076 91.783 1.00 70.17 H new ATOM 0 HD11 LEU B 11 29.332 17.203 89.841 1.00 71.21 H new ATOM 0 HD12 LEU B 11 30.110 18.503 90.302 1.00 71.21 H new ATOM 0 HD13 LEU B 11 30.714 17.071 90.604 1.00 71.21 H new ATOM 0 HD21 LEU B 11 28.247 15.740 91.529 1.00 71.48 H new ATOM 0 HD22 LEU B 11 29.619 15.599 92.307 1.00 71.48 H new ATOM 0 HD23 LEU B 11 28.327 16.109 93.067 1.00 71.48 H new ATOM 1870 N ILE B 12 30.746 20.017 95.315 1.00 65.01 N ATOM 1871 CA ILE B 12 31.583 20.309 96.471 1.00 62.32 C ATOM 1872 C ILE B 12 31.535 19.137 97.443 1.00 60.09 C ATOM 1873 O ILE B 12 30.609 19.034 98.252 1.00 58.96 O ATOM 1874 CB ILE B 12 31.108 21.560 97.229 1.00 62.43 C ATOM 1875 CG1 ILE B 12 31.196 22.789 96.328 1.00 62.93 C ATOM 1876 CG2 ILE B 12 31.961 21.761 98.477 1.00 61.85 C ATOM 1877 CD1 ILE B 12 30.781 24.072 97.020 1.00 62.47 C ATOM 0 H ILE B 12 29.928 19.837 95.509 1.00 65.01 H new ATOM 0 HA ILE B 12 32.482 20.463 96.140 1.00 62.32 H new ATOM 0 HB ILE B 12 30.183 21.437 97.494 1.00 62.43 H new ATOM 0 HG12 ILE B 12 32.107 22.882 96.007 1.00 62.93 H new ATOM 0 HG13 ILE B 12 30.633 22.652 95.550 1.00 62.93 H new ATOM 0 HG21 ILE B 12 31.659 22.551 98.952 1.00 61.85 H new ATOM 0 HG22 ILE B 12 31.879 20.986 99.054 1.00 61.85 H new ATOM 0 HG23 ILE B 12 32.889 21.875 98.220 1.00 61.85 H new ATOM 0 HD11 ILE B 12 30.858 24.814 96.400 1.00 62.47 H new ATOM 0 HD12 ILE B 12 29.862 23.995 97.320 1.00 62.47 H new ATOM 0 HD13 ILE B 12 31.358 24.229 97.784 1.00 62.47 H new ATOM 1878 N LYS B 13 32.528 18.255 97.358 1.00 56.85 N ATOM 1879 CA LYS B 13 32.597 17.099 98.246 1.00 52.85 C ATOM 1880 C LYS B 13 33.087 17.540 99.618 1.00 50.94 C ATOM 1881 O LYS B 13 34.075 18.263 99.720 1.00 51.42 O ATOM 1882 CB LYS B 13 33.549 16.049 97.674 1.00 52.23 C ATOM 1883 CG LYS B 13 33.816 14.889 98.612 1.00 49.15 C ATOM 1884 CD LYS B 13 34.737 13.864 97.984 1.00 46.19 C ATOM 1885 CE LYS B 13 35.016 12.734 98.958 1.00 45.55 C ATOM 1886 NZ LYS B 13 35.823 11.659 98.342 1.00 45.27 N ATOM 0 H LYS B 13 33.173 18.309 96.791 1.00 56.85 H new ATOM 0 HA LYS B 13 31.712 16.710 98.326 1.00 52.85 H new ATOM 0 HB2 LYS B 13 33.178 15.706 96.846 1.00 52.23 H new ATOM 0 HB3 LYS B 13 34.392 16.475 97.452 1.00 52.23 H new ATOM 0 HG2 LYS B 13 34.212 15.221 99.433 1.00 49.15 H new ATOM 0 HG3 LYS B 13 32.977 14.466 98.852 1.00 49.15 H new ATOM 0 HD2 LYS B 13 34.333 13.510 97.176 1.00 46.19 H new ATOM 0 HD3 LYS B 13 35.570 14.287 97.723 1.00 46.19 H new ATOM 0 HE2 LYS B 13 35.483 13.084 99.733 1.00 45.55 H new ATOM 0 HE3 LYS B 13 34.176 12.366 99.275 1.00 45.55 H new ATOM 0 HZ1 LYS B 13 35.905 10.984 98.916 1.00 45.27 H new ATOM 0 HZ2 LYS B 13 35.420 11.372 97.602 1.00 45.27 H new ATOM 0 HZ3 LYS B 13 36.630 11.974 98.137 1.00 45.27 H new ATOM 1887 N TRP B 14 32.385 17.123 100.670 1.00 49.06 N ATOM 1888 CA TRP B 14 32.773 17.482 102.032 1.00 47.55 C ATOM 1889 C TRP B 14 32.650 16.290 102.981 1.00 45.10 C ATOM 1890 O TRP B 14 32.108 15.242 102.628 1.00 44.80 O ATOM 1891 CB TRP B 14 31.901 18.628 102.569 1.00 49.79 C ATOM 1892 CG TRP B 14 30.487 18.210 102.826 1.00 50.93 C ATOM 1893 CD1 TRP B 14 29.499 18.057 101.900 1.00 52.44 C ATOM 1894 CD2 TRP B 14 29.939 17.765 104.072 1.00 51.19 C ATOM 1895 NE1 TRP B 14 28.373 17.534 102.485 1.00 52.40 N ATOM 1896 CE2 TRP B 14 28.615 17.345 103.820 1.00 51.82 C ATOM 1897 CE3 TRP B 14 30.442 17.673 105.378 1.00 50.86 C ATOM 1898 CZ2 TRP B 14 27.784 16.838 104.824 1.00 52.08 C ATOM 1899 CZ3 TRP B 14 29.616 17.167 106.377 1.00 51.75 C ATOM 1900 CH2 TRP B 14 28.301 16.756 106.092 1.00 52.58 C ATOM 0 H TRP B 14 31.681 16.632 100.616 1.00 49.06 H new ATOM 0 HA TRP B 14 33.700 17.766 101.993 1.00 47.55 H new ATOM 0 HB2 TRP B 14 32.289 18.966 103.392 1.00 49.79 H new ATOM 0 HB3 TRP B 14 31.907 19.359 101.932 1.00 49.79 H new ATOM 0 HD1 TRP B 14 29.577 18.276 100.999 1.00 52.44 H new ATOM 0 HE1 TRP B 14 27.636 17.354 102.080 1.00 52.40 H new ATOM 0 HE3 TRP B 14 31.310 17.945 105.572 1.00 50.86 H new ATOM 0 HZ2 TRP B 14 26.914 16.567 104.639 1.00 52.08 H new ATOM 0 HZ3 TRP B 14 29.938 17.099 107.247 1.00 51.75 H new ATOM 0 HH2 TRP B 14 27.770 16.421 106.779 1.00 52.58 H new ATOM 1901 N ARG B 15 33.160 16.466 104.192 1.00 41.79 N ATOM 1902 CA ARG B 15 33.095 15.428 105.205 1.00 39.53 C ATOM 1903 C ARG B 15 33.486 16.032 106.539 1.00 38.58 C ATOM 1904 O ARG B 15 34.100 17.099 106.599 1.00 38.97 O ATOM 1905 CB ARG B 15 34.047 14.260 104.872 1.00 37.75 C ATOM 1906 CG ARG B 15 35.536 14.545 105.096 1.00 34.30 C ATOM 1907 CD ARG B 15 36.405 13.291 104.869 1.00 31.67 C ATOM 1908 NE ARG B 15 37.784 13.477 105.325 1.00 28.21 N ATOM 1909 CZ ARG B 15 38.679 12.492 105.461 1.00 29.42 C ATOM 1910 NH1 ARG B 15 38.349 11.238 105.170 1.00 23.52 N ATOM 1911 NH2 ARG B 15 39.902 12.755 105.918 1.00 23.84 N ATOM 0 H ARG B 15 33.552 17.188 104.448 1.00 41.79 H new ATOM 0 HA ARG B 15 32.191 15.078 105.238 1.00 39.53 H new ATOM 0 HB2 ARG B 15 33.795 13.493 105.410 1.00 37.75 H new ATOM 0 HB3 ARG B 15 33.917 14.010 103.944 1.00 37.75 H new ATOM 0 HG2 ARG B 15 35.824 15.250 104.495 1.00 34.30 H new ATOM 0 HG3 ARG B 15 35.670 14.871 106.000 1.00 34.30 H new ATOM 0 HD2 ARG B 15 36.011 12.538 105.337 1.00 31.67 H new ATOM 0 HD3 ARG B 15 36.407 13.068 103.925 1.00 31.67 H new ATOM 0 HE ARG B 15 38.036 14.276 105.519 1.00 28.21 H new ATOM 0 HH11 ARG B 15 37.556 11.055 104.892 1.00 23.52 H new ATOM 0 HH12 ARG B 15 38.929 10.609 105.259 1.00 23.52 H new ATOM 0 HH21 ARG B 15 40.119 13.561 106.127 1.00 23.84 H new ATOM 0 HH22 ARG B 15 40.475 12.119 106.004 1.00 23.84 H new ATOM 1912 N VAL B 16 33.098 15.354 107.610 1.00 39.51 N ATOM 1913 CA VAL B 16 33.442 15.781 108.956 1.00 38.23 C ATOM 1914 C VAL B 16 34.238 14.621 109.535 1.00 36.96 C ATOM 1915 O VAL B 16 33.869 13.464 109.347 1.00 36.19 O ATOM 1916 CB VAL B 16 32.190 16.002 109.822 1.00 40.40 C ATOM 1917 CG1 VAL B 16 32.602 16.413 111.235 1.00 37.37 C ATOM 1918 CG2 VAL B 16 31.303 17.064 109.184 1.00 40.93 C ATOM 0 H VAL B 16 32.628 14.634 107.577 1.00 39.51 H new ATOM 0 HA VAL B 16 33.927 16.621 108.940 1.00 38.23 H new ATOM 0 HB VAL B 16 31.686 15.175 109.879 1.00 40.40 H new ATOM 0 HG11 VAL B 16 31.809 16.551 111.776 1.00 37.37 H new ATOM 0 HG12 VAL B 16 33.145 15.713 111.630 1.00 37.37 H new ATOM 0 HG13 VAL B 16 33.114 17.236 111.197 1.00 37.37 H new ATOM 0 HG21 VAL B 16 30.515 17.200 109.733 1.00 40.93 H new ATOM 0 HG22 VAL B 16 31.795 17.897 109.113 1.00 40.93 H new ATOM 0 HG23 VAL B 16 31.033 16.772 108.299 1.00 40.93 H new ATOM 1919 N ILE B 17 35.329 14.921 110.226 1.00 35.89 N ATOM 1920 CA ILE B 17 36.141 13.863 110.809 1.00 35.52 C ATOM 1921 C ILE B 17 36.393 14.063 112.294 1.00 36.14 C ATOM 1922 O ILE B 17 36.537 15.192 112.770 1.00 36.60 O ATOM 1923 CB ILE B 17 37.516 13.742 110.108 1.00 33.79 C ATOM 1924 CG1 ILE B 17 38.276 15.070 110.214 1.00 34.07 C ATOM 1925 CG2 ILE B 17 37.325 13.353 108.646 1.00 32.73 C ATOM 1926 CD1 ILE B 17 39.762 14.952 109.880 1.00 30.82 C ATOM 0 H ILE B 17 35.614 15.720 110.368 1.00 35.89 H new ATOM 0 HA ILE B 17 35.625 13.052 110.680 1.00 35.52 H new ATOM 0 HB ILE B 17 38.036 13.050 110.547 1.00 33.79 H new ATOM 0 HG12 ILE B 17 37.868 15.716 109.616 1.00 34.07 H new ATOM 0 HG13 ILE B 17 38.181 15.417 111.115 1.00 34.07 H new ATOM 0 HG21 ILE B 17 38.191 13.279 108.215 1.00 32.73 H new ATOM 0 HG22 ILE B 17 36.865 12.500 108.595 1.00 32.73 H new ATOM 0 HG23 ILE B 17 36.797 14.032 108.197 1.00 32.73 H new ATOM 0 HD11 ILE B 17 40.183 15.822 109.965 1.00 30.82 H new ATOM 0 HD12 ILE B 17 40.183 14.328 110.492 1.00 30.82 H new ATOM 0 HD13 ILE B 17 39.865 14.631 108.970 1.00 30.82 H new ATOM 1927 N GLU B 18 36.438 12.951 113.019 1.00 34.05 N ATOM 1928 CA GLU B 18 36.711 12.971 114.445 1.00 33.86 C ATOM 1929 C GLU B 18 38.144 12.483 114.563 1.00 33.75 C ATOM 1930 O GLU B 18 38.573 11.615 113.802 1.00 33.70 O ATOM 1931 CB GLU B 18 35.770 12.018 115.187 1.00 35.90 C ATOM 1932 CG GLU B 18 35.922 12.052 116.702 1.00 37.43 C ATOM 1933 CD GLU B 18 35.101 10.980 117.401 1.00 39.06 C ATOM 1934 OE1 GLU B 18 34.618 11.247 118.516 1.00 40.56 O ATOM 1935 OE2 GLU B 18 34.947 9.871 116.843 1.00 39.66 O ATOM 0 H GLU B 18 36.311 12.164 112.695 1.00 34.05 H new ATOM 0 HA GLU B 18 36.581 13.851 114.831 1.00 33.86 H new ATOM 0 HB2 GLU B 18 34.854 12.240 114.958 1.00 35.90 H new ATOM 0 HB3 GLU B 18 35.929 11.113 114.875 1.00 35.90 H new ATOM 0 HG2 GLU B 18 36.858 11.938 116.932 1.00 37.43 H new ATOM 0 HG3 GLU B 18 35.654 12.924 117.030 1.00 37.43 H new ATOM 1936 N GLY B 19 38.890 13.032 115.510 1.00 34.88 N ATOM 1937 CA GLY B 19 40.270 12.620 115.663 1.00 35.74 C ATOM 1938 C GLY B 19 41.066 12.931 114.406 1.00 37.11 C ATOM 1939 O GLY B 19 40.717 13.826 113.638 1.00 37.49 O ATOM 0 H GLY B 19 38.621 13.633 116.063 1.00 34.88 H new ATOM 0 HA2 GLY B 19 40.666 13.075 116.423 1.00 35.74 H new ATOM 0 HA3 GLY B 19 40.310 11.669 115.850 1.00 35.74 H new ATOM 1940 N ALA B 20 42.128 12.168 114.186 1.00 36.38 N ATOM 1941 CA ALA B 20 43.012 12.362 113.047 1.00 35.48 C ATOM 1942 C ALA B 20 42.354 12.315 111.675 1.00 34.86 C ATOM 1943 O ALA B 20 42.620 13.175 110.832 1.00 34.62 O ATOM 1944 CB ALA B 20 44.143 11.337 113.102 1.00 34.61 C ATOM 0 H ALA B 20 42.358 11.517 114.699 1.00 36.38 H new ATOM 0 HA ALA B 20 43.338 13.271 113.137 1.00 35.48 H new ATOM 0 HB1 ALA B 20 44.733 11.465 112.343 1.00 34.61 H new ATOM 0 HB2 ALA B 20 44.645 11.452 113.924 1.00 34.61 H new ATOM 0 HB3 ALA B 20 43.770 10.442 113.074 1.00 34.61 H new ATOM 1945 N ALA B 21 41.504 11.320 111.441 1.00 32.58 N ATOM 1946 CA ALA B 21 40.885 11.191 110.135 1.00 31.78 C ATOM 1947 C ALA B 21 39.676 10.254 110.057 1.00 31.12 C ATOM 1948 O ALA B 21 39.360 9.753 108.985 1.00 31.73 O ATOM 1949 CB ALA B 21 41.945 10.740 109.126 1.00 33.46 C ATOM 0 H ALA B 21 41.278 10.721 112.015 1.00 32.58 H new ATOM 0 HA ALA B 21 40.531 12.070 109.930 1.00 31.78 H new ATOM 0 HB1 ALA B 21 41.540 10.651 108.249 1.00 33.46 H new ATOM 0 HB2 ALA B 21 42.656 11.398 109.088 1.00 33.46 H new ATOM 0 HB3 ALA B 21 42.311 9.885 109.401 1.00 33.46 H new ATOM 1950 N ARG B 22 38.987 10.012 111.163 1.00 29.36 N ATOM 1951 CA ARG B 22 37.840 9.121 111.074 1.00 31.09 C ATOM 1952 C ARG B 22 36.599 9.886 110.586 1.00 31.65 C ATOM 1953 O ARG B 22 36.042 10.727 111.292 1.00 29.65 O ATOM 1954 CB ARG B 22 37.565 8.444 112.421 1.00 27.42 C ATOM 1955 CG ARG B 22 36.607 7.252 112.302 1.00 30.62 C ATOM 1956 CD ARG B 22 36.281 6.648 113.668 1.00 29.96 C ATOM 1957 NE ARG B 22 35.430 7.514 114.484 1.00 30.98 N ATOM 1958 CZ ARG B 22 34.100 7.458 114.505 1.00 29.30 C ATOM 1959 NH1 ARG B 22 33.410 8.288 115.280 1.00 28.41 N ATOM 1960 NH2 ARG B 22 33.460 6.564 113.760 1.00 23.69 N ATOM 0 H ARG B 22 39.155 10.336 111.942 1.00 29.36 H new ATOM 0 HA ARG B 22 38.046 8.428 110.428 1.00 31.09 H new ATOM 0 HB2 ARG B 22 38.404 8.143 112.804 1.00 27.42 H new ATOM 0 HB3 ARG B 22 37.190 9.095 113.035 1.00 27.42 H new ATOM 0 HG2 ARG B 22 35.787 7.538 111.871 1.00 30.62 H new ATOM 0 HG3 ARG B 22 37.004 6.573 111.734 1.00 30.62 H new ATOM 0 HD2 ARG B 22 35.839 5.794 113.542 1.00 29.96 H new ATOM 0 HD3 ARG B 22 37.107 6.472 114.145 1.00 29.96 H new ATOM 0 HE ARG B 22 35.815 8.099 114.984 1.00 30.98 H new ATOM 0 HH11 ARG B 22 33.823 8.863 115.769 1.00 28.41 H new ATOM 0 HH12 ARG B 22 32.551 8.251 115.292 1.00 28.41 H new ATOM 0 HH21 ARG B 22 33.905 6.021 113.263 1.00 23.69 H new ATOM 0 HH22 ARG B 22 32.601 6.528 113.774 1.00 23.69 H new ATOM 1961 N SER B 23 36.178 9.584 109.364 1.00 34.03 N ATOM 1962 CA SER B 23 35.022 10.240 108.770 1.00 36.99 C ATOM 1963 C SER B 23 33.713 9.772 109.409 1.00 37.64 C ATOM 1964 O SER B 23 33.461 8.578 109.524 1.00 37.78 O ATOM 1965 CB SER B 23 34.992 9.969 107.263 1.00 35.89 C ATOM 1966 OG SER B 23 33.949 10.702 106.647 1.00 42.05 O ATOM 0 H SER B 23 36.552 8.997 108.859 1.00 34.03 H new ATOM 0 HA SER B 23 35.105 11.193 108.932 1.00 36.99 H new ATOM 0 HB2 SER B 23 35.843 10.214 106.868 1.00 35.89 H new ATOM 0 HB3 SER B 23 34.867 9.021 107.102 1.00 35.89 H new ATOM 0 HG SER B 23 33.945 10.545 105.822 1.00 42.05 H new ATOM 1967 N VAL B 24 32.880 10.718 109.827 1.00 39.04 N ATOM 1968 CA VAL B 24 31.609 10.369 110.449 1.00 40.97 C ATOM 1969 C VAL B 24 30.404 10.965 109.714 1.00 42.92 C ATOM 1970 O VAL B 24 29.258 10.697 110.070 1.00 41.18 O ATOM 1971 CB VAL B 24 31.581 10.811 111.935 1.00 40.76 C ATOM 1972 CG1 VAL B 24 32.738 10.173 112.685 1.00 37.77 C ATOM 1973 CG2 VAL B 24 31.649 12.321 112.040 1.00 40.41 C ATOM 0 H VAL B 24 33.030 11.562 109.761 1.00 39.04 H new ATOM 0 HA VAL B 24 31.538 9.403 110.394 1.00 40.97 H new ATOM 0 HB VAL B 24 30.748 10.516 112.335 1.00 40.76 H new ATOM 0 HG11 VAL B 24 32.716 10.453 113.613 1.00 37.77 H new ATOM 0 HG12 VAL B 24 32.662 9.207 112.637 1.00 37.77 H new ATOM 0 HG13 VAL B 24 33.576 10.451 112.284 1.00 37.77 H new ATOM 0 HG21 VAL B 24 31.631 12.582 112.974 1.00 40.41 H new ATOM 0 HG22 VAL B 24 32.471 12.637 111.633 1.00 40.41 H new ATOM 0 HG23 VAL B 24 30.889 12.712 111.581 1.00 40.41 H new ATOM 1974 N ALA B 25 30.677 11.761 108.683 1.00 44.15 N ATOM 1975 CA ALA B 25 29.633 12.395 107.878 1.00 46.04 C ATOM 1976 C ALA B 25 30.238 13.060 106.639 1.00 48.48 C ATOM 1977 O ALA B 25 31.398 13.474 106.652 1.00 47.15 O ATOM 1978 CB ALA B 25 28.891 13.434 108.710 1.00 42.41 C ATOM 0 H ALA B 25 31.477 11.950 108.429 1.00 44.15 H new ATOM 0 HA ALA B 25 29.009 11.710 107.590 1.00 46.04 H new ATOM 0 HB1 ALA B 25 28.201 13.849 108.169 1.00 42.41 H new ATOM 0 HB2 ALA B 25 28.484 13.003 109.478 1.00 42.41 H new ATOM 0 HB3 ALA B 25 29.515 14.112 109.013 1.00 42.41 H new ATOM 1979 N GLY B 26 29.449 13.161 105.573 1.00 51.64 N ATOM 1980 CA GLY B 26 29.929 13.787 104.351 1.00 56.04 C ATOM 1981 C GLY B 26 28.927 13.703 103.214 1.00 58.70 C ATOM 1982 O GLY B 26 27.867 13.095 103.366 1.00 58.47 O ATOM 0 H GLY B 26 28.639 12.875 105.539 1.00 51.64 H new ATOM 0 HA2 GLY B 26 30.133 14.719 104.528 1.00 56.04 H new ATOM 0 HA3 GLY B 26 30.757 13.362 104.079 1.00 56.04 H new ATOM 1983 N GLY B 27 29.254 14.309 102.074 1.00 60.57 N ATOM 1984 CA GLY B 27 28.350 14.271 100.936 1.00 64.18 C ATOM 1985 C GLY B 27 28.746 15.186 99.789 1.00 66.77 C ATOM 1986 O GLY B 27 29.595 16.061 99.954 1.00 66.83 O ATOM 0 H GLY B 27 29.986 14.741 101.943 1.00 60.57 H new ATOM 0 HA2 GLY B 27 28.301 13.360 100.606 1.00 64.18 H new ATOM 0 HA3 GLY B 27 27.460 14.513 101.236 1.00 64.18 H new ATOM 1987 N LEU B 28 28.126 14.979 98.627 1.00 68.88 N ATOM 1988 CA LEU B 28 28.397 15.776 97.429 1.00 70.65 C ATOM 1989 C LEU B 28 27.336 16.845 97.184 1.00 72.09 C ATOM 1990 O LEU B 28 26.197 16.532 96.836 1.00 72.56 O ATOM 1991 CB LEU B 28 28.464 14.874 96.197 1.00 71.01 C ATOM 1992 CG LEU B 28 29.654 13.932 96.043 1.00 71.31 C ATOM 1993 CD1 LEU B 28 29.445 13.049 94.823 1.00 71.62 C ATOM 1994 CD2 LEU B 28 30.930 14.744 95.903 1.00 72.57 C ATOM 0 H LEU B 28 27.532 14.368 98.511 1.00 68.88 H new ATOM 0 HA LEU B 28 29.248 16.217 97.580 1.00 70.65 H new ATOM 0 HB2 LEU B 28 27.658 14.334 96.183 1.00 71.01 H new ATOM 0 HB3 LEU B 28 28.437 15.444 95.413 1.00 71.01 H new ATOM 0 HG LEU B 28 29.731 13.367 96.828 1.00 71.31 H new ATOM 0 HD11 LEU B 28 30.201 12.449 94.724 1.00 71.62 H new ATOM 0 HD12 LEU B 28 28.633 12.530 94.934 1.00 71.62 H new ATOM 0 HD13 LEU B 28 29.367 13.604 94.031 1.00 71.62 H new ATOM 0 HD21 LEU B 28 31.686 14.144 95.805 1.00 72.57 H new ATOM 0 HD22 LEU B 28 30.867 15.314 95.121 1.00 72.57 H new ATOM 0 HD23 LEU B 28 31.053 15.293 96.693 1.00 72.57 H new ATOM 1995 N ALA B 29 27.720 18.106 97.354 1.00 73.40 N ATOM 1996 CA ALA B 29 26.811 19.230 97.150 1.00 74.53 C ATOM 1997 C ALA B 29 27.032 19.848 95.772 1.00 76.40 C ATOM 1998 O ALA B 29 28.041 20.516 95.540 1.00 76.37 O ATOM 1999 CB ALA B 29 27.034 20.277 98.228 1.00 74.14 C ATOM 0 H ALA B 29 28.515 18.335 97.591 1.00 73.40 H new ATOM 0 HA ALA B 29 25.898 18.906 97.203 1.00 74.53 H new ATOM 0 HB1 ALA B 29 26.428 21.021 98.087 1.00 74.14 H new ATOM 0 HB2 ALA B 29 26.867 19.885 99.099 1.00 74.14 H new ATOM 0 HB3 ALA B 29 27.950 20.595 98.186 1.00 74.14 H new ATOM 2000 N GLU B 30 26.081 19.631 94.866 1.00 78.20 N ATOM 2001 CA GLU B 30 26.177 20.158 93.506 1.00 79.23 C ATOM 2002 C GLU B 30 26.100 21.677 93.407 1.00 79.21 C ATOM 2003 O GLU B 30 26.161 22.233 92.311 1.00 79.31 O ATOM 2004 CB GLU B 30 25.088 19.550 92.622 1.00 79.87 C ATOM 2005 CG GLU B 30 25.231 18.058 92.408 1.00 82.19 C ATOM 2006 CD GLU B 30 24.400 17.562 91.244 1.00 83.40 C ATOM 2007 OE1 GLU B 30 23.170 17.780 91.261 1.00 85.42 O ATOM 2008 OE2 GLU B 30 24.974 16.957 90.312 1.00 83.52 O ATOM 0 H GLU B 30 25.367 19.178 95.020 1.00 78.20 H new ATOM 0 HA GLU B 30 27.061 19.904 93.199 1.00 79.23 H new ATOM 0 HB2 GLU B 30 24.222 19.729 93.022 1.00 79.87 H new ATOM 0 HB3 GLU B 30 25.099 19.994 91.760 1.00 79.87 H new ATOM 0 HG2 GLU B 30 26.164 17.844 92.251 1.00 82.19 H new ATOM 0 HG3 GLU B 30 24.965 17.591 93.215 1.00 82.19 H new ATOM 2009 N SER B 31 25.971 22.349 94.543 1.00 79.50 N ATOM 2010 CA SER B 31 25.890 23.802 94.542 1.00 80.07 C ATOM 2011 C SER B 31 26.113 24.383 95.931 1.00 80.69 C ATOM 2012 O SER B 31 25.886 23.714 96.937 1.00 81.09 O ATOM 2013 CB SER B 31 24.527 24.240 94.007 1.00 80.95 C ATOM 2014 OG SER B 31 23.480 23.599 94.714 1.00 81.59 O ATOM 0 H SER B 31 25.929 21.985 95.321 1.00 79.50 H new ATOM 0 HA SER B 31 26.594 24.139 93.967 1.00 80.07 H new ATOM 0 HB2 SER B 31 24.437 25.202 94.089 1.00 80.95 H new ATOM 0 HB3 SER B 31 24.462 24.028 93.063 1.00 80.95 H new ATOM 0 HG SER B 31 22.740 23.852 94.409 1.00 81.59 H new ATOM 2015 N ASP B 32 26.558 25.634 95.978 1.00 81.20 N ATOM 2016 CA ASP B 32 26.811 26.306 97.245 1.00 82.40 C ATOM 2017 C ASP B 32 25.589 26.237 98.149 1.00 83.25 C ATOM 2018 O ASP B 32 25.692 26.434 99.361 1.00 83.15 O ATOM 2019 CB ASP B 32 27.185 27.771 97.006 1.00 83.62 C ATOM 2020 CG ASP B 32 28.459 27.925 96.194 1.00 84.31 C ATOM 2021 OD1 ASP B 32 28.847 29.080 95.909 1.00 84.00 O ATOM 2022 OD2 ASP B 32 29.071 26.892 95.843 1.00 84.14 O ATOM 0 H ASP B 32 26.720 26.113 95.282 1.00 81.20 H new ATOM 0 HA ASP B 32 27.549 25.852 97.680 1.00 82.40 H new ATOM 0 HB2 ASP B 32 26.456 28.216 96.545 1.00 83.62 H new ATOM 0 HB3 ASP B 32 27.295 28.217 97.861 1.00 83.62 H new ATOM 2023 N ASP B 33 24.432 25.963 97.555 1.00 84.08 N ATOM 2024 CA ASP B 33 23.191 25.867 98.318 1.00 84.94 C ATOM 2025 C ASP B 33 22.950 24.444 98.806 1.00 84.09 C ATOM 2026 O ASP B 33 22.616 24.226 99.971 1.00 84.02 O ATOM 2027 CB ASP B 33 22.003 26.330 97.469 1.00 85.96 C ATOM 2028 CG ASP B 33 22.024 27.823 97.204 1.00 87.07 C ATOM 2029 OD1 ASP B 33 21.062 28.330 96.586 1.00 87.91 O ATOM 2030 OD2 ASP B 33 23.002 28.488 97.612 1.00 87.18 O ATOM 0 H ASP B 33 24.343 25.829 96.710 1.00 84.08 H new ATOM 0 HA ASP B 33 23.277 26.446 99.092 1.00 84.94 H new ATOM 0 HB2 ASP B 33 22.009 25.855 96.624 1.00 85.96 H new ATOM 0 HB3 ASP B 33 21.177 26.096 97.920 1.00 85.96 H new ATOM 2031 N ALA B 34 23.119 23.478 97.909 1.00 83.32 N ATOM 2032 CA ALA B 34 22.929 22.076 98.254 1.00 83.20 C ATOM 2033 C ALA B 34 24.032 21.630 99.210 1.00 83.07 C ATOM 2034 O ALA B 34 24.317 20.440 99.333 1.00 82.93 O ATOM 2035 CB ALA B 34 22.947 21.217 96.992 1.00 83.20 C ATOM 0 H ALA B 34 23.345 23.616 97.091 1.00 83.32 H new ATOM 0 HA ALA B 34 22.069 21.969 98.689 1.00 83.20 H new ATOM 0 HB1 ALA B 34 22.820 20.286 97.232 1.00 83.20 H new ATOM 0 HB2 ALA B 34 22.233 21.498 96.399 1.00 83.20 H new ATOM 0 HB3 ALA B 34 23.800 21.321 96.542 1.00 83.20 H new ATOM 2036 N LEU B 35 24.645 22.599 99.883 1.00 82.84 N ATOM 2037 CA LEU B 35 25.720 22.332 100.829 1.00 82.19 C ATOM 2038 C LEU B 35 25.387 22.870 102.214 1.00 82.14 C ATOM 2039 O LEU B 35 25.305 22.111 103.180 1.00 83.06 O ATOM 2040 CB LEU B 35 27.023 22.973 100.344 1.00 81.59 C ATOM 2041 CG LEU B 35 28.168 23.006 101.362 1.00 80.56 C ATOM 2042 CD1 LEU B 35 28.595 21.588 101.708 1.00 80.31 C ATOM 2043 CD2 LEU B 35 29.333 23.792 100.793 1.00 80.22 C ATOM 0 H LEU B 35 24.448 23.432 99.803 1.00 82.84 H new ATOM 0 HA LEU B 35 25.826 21.370 100.886 1.00 82.19 H new ATOM 0 HB2 LEU B 35 27.326 22.494 99.557 1.00 81.59 H new ATOM 0 HB3 LEU B 35 26.833 23.883 100.067 1.00 81.59 H new ATOM 0 HG LEU B 35 27.866 23.442 102.174 1.00 80.56 H new ATOM 0 HD11 LEU B 35 29.320 21.616 102.352 1.00 80.31 H new ATOM 0 HD12 LEU B 35 27.843 21.107 102.088 1.00 80.31 H new ATOM 0 HD13 LEU B 35 28.895 21.135 100.904 1.00 80.31 H new ATOM 0 HD21 LEU B 35 30.057 23.812 101.439 1.00 80.22 H new ATOM 0 HD22 LEU B 35 29.641 23.369 99.976 1.00 80.22 H new ATOM 0 HD23 LEU B 35 29.048 24.699 100.600 1.00 80.22 H new ATOM 2044 N VAL B 36 25.210 24.185 102.306 1.00 81.28 N ATOM 2045 CA VAL B 36 24.892 24.829 103.577 1.00 80.28 C ATOM 2046 C VAL B 36 23.695 24.142 104.223 1.00 79.73 C ATOM 2047 O VAL B 36 23.667 23.917 105.435 1.00 78.88 O ATOM 2048 CB VAL B 36 24.564 26.322 103.375 1.00 80.69 C ATOM 2049 CG1 VAL B 36 24.393 27.006 104.726 1.00 79.92 C ATOM 2050 CG2 VAL B 36 25.666 26.990 102.565 1.00 80.28 C ATOM 0 H VAL B 36 25.270 24.725 101.640 1.00 81.28 H new ATOM 0 HA VAL B 36 25.669 24.753 104.152 1.00 80.28 H new ATOM 0 HB VAL B 36 23.731 26.403 102.885 1.00 80.69 H new ATOM 0 HG11 VAL B 36 24.187 27.944 104.590 1.00 79.92 H new ATOM 0 HG12 VAL B 36 23.668 26.584 105.213 1.00 79.92 H new ATOM 0 HG13 VAL B 36 25.215 26.926 105.236 1.00 79.92 H new ATOM 0 HG21 VAL B 36 25.454 27.928 102.442 1.00 80.28 H new ATOM 0 HG22 VAL B 36 26.509 26.909 103.037 1.00 80.28 H new ATOM 0 HG23 VAL B 36 25.738 26.559 101.699 1.00 80.28 H new ATOM 2051 N GLU B 37 22.705 23.813 103.401 1.00 78.73 N ATOM 2052 CA GLU B 37 21.513 23.139 103.884 1.00 77.63 C ATOM 2053 C GLU B 37 21.849 21.671 104.091 1.00 76.44 C ATOM 2054 O GLU B 37 21.336 21.028 105.003 1.00 77.08 O ATOM 2055 CB GLU B 37 20.384 23.259 102.862 1.00 78.12 C ATOM 2056 CG GLU B 37 19.074 22.646 103.319 1.00 78.85 C ATOM 2057 CD GLU B 37 18.107 22.433 102.175 1.00 79.14 C ATOM 2058 OE1 GLU B 37 17.831 23.404 101.437 1.00 79.31 O ATOM 2059 OE2 GLU B 37 17.623 21.293 102.014 1.00 79.32 O ATOM 0 H GLU B 37 22.707 23.973 102.556 1.00 78.73 H new ATOM 0 HA GLU B 37 21.222 23.545 104.715 1.00 77.63 H new ATOM 0 HB2 GLU B 37 20.239 24.197 102.661 1.00 78.12 H new ATOM 0 HB3 GLU B 37 20.660 22.832 102.036 1.00 78.12 H new ATOM 0 HG2 GLU B 37 19.251 21.796 103.752 1.00 78.85 H new ATOM 0 HG3 GLU B 37 18.664 23.223 103.983 1.00 78.85 H new ATOM 2060 N GLN B 38 22.715 21.145 103.232 1.00 74.96 N ATOM 2061 CA GLN B 38 23.118 19.747 103.320 1.00 73.18 C ATOM 2062 C GLN B 38 23.835 19.496 104.645 1.00 71.48 C ATOM 2063 O GLN B 38 23.924 18.363 105.109 1.00 70.95 O ATOM 2064 CB GLN B 38 24.025 19.389 102.141 1.00 73.27 C ATOM 2065 CG GLN B 38 24.212 17.896 101.923 1.00 73.89 C ATOM 2066 CD GLN B 38 24.958 17.588 100.636 1.00 74.80 C ATOM 2067 OE1 GLN B 38 26.053 18.104 100.404 1.00 74.58 O ATOM 2068 NE2 GLN B 38 24.370 16.743 99.793 1.00 73.96 N ATOM 0 H GLN B 38 23.082 21.582 102.589 1.00 74.96 H new ATOM 0 HA GLN B 38 22.329 19.184 103.283 1.00 73.18 H new ATOM 0 HB2 GLN B 38 23.656 19.779 101.333 1.00 73.27 H new ATOM 0 HB3 GLN B 38 24.894 19.796 102.281 1.00 73.27 H new ATOM 0 HG2 GLN B 38 24.698 17.520 102.674 1.00 73.89 H new ATOM 0 HG3 GLN B 38 23.344 17.463 101.902 1.00 73.89 H new ATOM 0 HE21 GLN B 38 23.605 16.403 99.989 1.00 73.96 H new ATOM 0 HE22 GLN B 38 24.755 16.537 99.052 1.00 73.96 H new ATOM 2069 N LEU B 39 24.345 20.564 105.250 1.00 70.17 N ATOM 2070 CA LEU B 39 25.021 20.456 106.534 1.00 69.29 C ATOM 2071 C LEU B 39 23.964 20.603 107.619 1.00 69.60 C ATOM 2072 O LEU B 39 24.285 20.768 108.796 1.00 69.65 O ATOM 2073 CB LEU B 39 26.066 21.561 106.696 1.00 68.52 C ATOM 2074 CG LEU B 39 27.159 21.697 105.634 1.00 69.75 C ATOM 2075 CD1 LEU B 39 28.227 22.649 106.156 1.00 68.87 C ATOM 2076 CD2 LEU B 39 27.771 20.339 105.321 1.00 69.35 C ATOM 0 H LEU B 39 24.309 21.362 104.931 1.00 70.17 H new ATOM 0 HA LEU B 39 25.476 19.602 106.595 1.00 69.29 H new ATOM 0 HB2 LEU B 39 25.595 22.407 106.744 1.00 68.52 H new ATOM 0 HB3 LEU B 39 26.502 21.431 107.553 1.00 68.52 H new ATOM 0 HG LEU B 39 26.776 22.048 104.815 1.00 69.75 H new ATOM 0 HD11 LEU B 39 28.928 22.745 105.492 1.00 68.87 H new ATOM 0 HD12 LEU B 39 27.829 23.516 106.333 1.00 68.87 H new ATOM 0 HD13 LEU B 39 28.605 22.293 106.975 1.00 68.87 H new ATOM 0 HD21 LEU B 39 28.461 20.442 104.647 1.00 69.35 H new ATOM 0 HD22 LEU B 39 28.160 19.966 106.127 1.00 69.35 H new ATOM 0 HD23 LEU B 39 27.082 19.742 104.989 1.00 69.35 H new ATOM 2077 N THR B 40 22.700 20.551 107.204 1.00 69.60 N ATOM 2078 CA THR B 40 21.571 20.683 108.117 1.00 69.85 C ATOM 2079 C THR B 40 20.896 19.341 108.365 1.00 69.97 C ATOM 2080 O THR B 40 20.772 18.915 109.512 1.00 70.44 O ATOM 2081 CB THR B 40 20.517 21.669 107.562 1.00 70.08 C ATOM 2082 OG1 THR B 40 21.097 22.974 107.453 1.00 69.60 O ATOM 2083 CG2 THR B 40 19.296 21.728 108.475 1.00 70.22 C ATOM 0 H THR B 40 22.474 20.438 106.382 1.00 69.60 H new ATOM 0 HA THR B 40 21.927 21.023 108.953 1.00 69.85 H new ATOM 0 HB THR B 40 20.233 21.359 106.688 1.00 70.08 H new ATOM 0 HG1 THR B 40 20.526 23.510 107.150 1.00 69.60 H new ATOM 0 HG21 THR B 40 18.648 22.351 108.110 1.00 70.22 H new ATOM 0 HG22 THR B 40 18.896 20.847 108.538 1.00 70.22 H new ATOM 0 HG23 THR B 40 19.566 22.024 109.358 1.00 70.22 H new ATOM 2084 N SER B 41 20.459 18.690 107.286 1.00 69.54 N ATOM 2085 CA SER B 41 19.789 17.390 107.360 1.00 70.11 C ATOM 2086 C SER B 41 20.268 16.575 108.566 1.00 70.74 C ATOM 2087 O SER B 41 19.784 16.761 109.683 1.00 70.23 O ATOM 2088 CB SER B 41 20.030 16.610 106.068 1.00 69.88 C ATOM 0 H SER B 41 20.544 18.992 106.485 1.00 69.54 H new ATOM 0 HA SER B 41 18.839 17.548 107.472 1.00 70.11 H new ATOM 2089 N GLN B 42 21.205 15.661 108.338 1.00 71.28 N ATOM 2090 CA GLN B 42 21.749 14.861 109.430 1.00 70.73 C ATOM 2091 C GLN B 42 22.711 15.791 110.154 1.00 71.29 C ATOM 2092 O GLN B 42 23.872 15.924 109.757 1.00 72.60 O ATOM 2093 CB GLN B 42 22.495 13.652 108.879 1.00 69.94 C ATOM 0 H GLN B 42 21.538 15.489 107.564 1.00 71.28 H new ATOM 0 HA GLN B 42 21.055 14.522 110.017 1.00 70.73 H new ATOM 2094 N GLN B 43 22.232 16.450 111.204 1.00 70.76 N ATOM 2095 CA GLN B 43 23.080 17.386 111.930 1.00 70.28 C ATOM 2096 C GLN B 43 23.198 17.134 113.425 1.00 69.34 C ATOM 2097 O GLN B 43 22.352 16.477 114.034 1.00 69.27 O ATOM 2098 CB GLN B 43 22.605 18.815 111.683 1.00 69.63 C ATOM 0 H GLN B 43 21.431 16.371 111.508 1.00 70.76 H new ATOM 0 HA GLN B 43 23.972 17.246 111.577 1.00 70.28 H new ATOM 2099 N ALA B 44 24.265 17.688 113.993 1.00 68.30 N ATOM 2100 CA ALA B 44 24.586 17.582 115.409 1.00 67.57 C ATOM 2101 C ALA B 44 26.057 17.948 115.539 1.00 67.09 C ATOM 2102 O ALA B 44 26.411 18.969 116.127 1.00 68.31 O ATOM 2103 CB ALA B 44 24.363 16.157 115.901 1.00 68.23 C ATOM 0 H ALA B 44 24.839 18.150 113.549 1.00 68.30 H new ATOM 0 HA ALA B 44 24.022 18.166 115.939 1.00 67.57 H new ATOM 0 HB1 ALA B 44 24.581 16.102 116.845 1.00 68.23 H new ATOM 0 HB2 ALA B 44 23.434 15.911 115.769 1.00 68.23 H new ATOM 0 HB3 ALA B 44 24.932 15.550 115.403 1.00 68.23 H new ATOM 2104 N LEU B 45 26.896 17.093 114.963 1.00 65.56 N ATOM 2105 CA LEU B 45 28.349 17.234 114.959 1.00 62.39 C ATOM 2106 C LEU B 45 28.883 18.608 115.350 1.00 60.09 C ATOM 2107 O LEU B 45 28.600 19.610 114.694 1.00 61.18 O ATOM 2108 CB LEU B 45 28.882 16.855 113.579 1.00 62.37 C ATOM 2109 CG LEU B 45 28.313 15.546 113.025 1.00 63.26 C ATOM 2110 CD1 LEU B 45 28.938 15.254 111.670 1.00 63.35 C ATOM 2111 CD2 LEU B 45 28.583 14.404 114.003 1.00 63.45 C ATOM 0 H LEU B 45 26.625 16.390 114.549 1.00 65.56 H new ATOM 0 HA LEU B 45 28.668 16.635 115.653 1.00 62.39 H new ATOM 0 HB2 LEU B 45 28.681 17.572 112.957 1.00 62.37 H new ATOM 0 HB3 LEU B 45 29.848 16.782 113.625 1.00 62.37 H new ATOM 0 HG LEU B 45 27.353 15.631 112.914 1.00 63.26 H new ATOM 0 HD11 LEU B 45 28.577 14.425 111.319 1.00 63.35 H new ATOM 0 HD12 LEU B 45 28.736 15.979 111.057 1.00 63.35 H new ATOM 0 HD13 LEU B 45 29.900 15.172 111.768 1.00 63.35 H new ATOM 0 HD21 LEU B 45 28.220 13.579 113.645 1.00 63.45 H new ATOM 0 HD22 LEU B 45 29.540 14.307 114.131 1.00 63.45 H new ATOM 0 HD23 LEU B 45 28.161 14.600 114.854 1.00 63.45 H new ATOM 2112 N PRO B 46 29.670 18.664 116.434 1.00 57.86 N ATOM 2113 CA PRO B 46 30.272 19.893 116.954 1.00 56.77 C ATOM 2114 C PRO B 46 31.640 20.193 116.340 1.00 56.78 C ATOM 2115 O PRO B 46 32.678 19.843 116.910 1.00 55.54 O ATOM 2116 CB PRO B 46 30.373 19.603 118.441 1.00 56.72 C ATOM 2117 CG PRO B 46 30.766 18.157 118.435 1.00 55.54 C ATOM 2118 CD PRO B 46 29.830 17.561 117.401 1.00 56.10 C ATOM 0 HA PRO B 46 29.751 20.684 116.743 1.00 56.77 H new ATOM 0 HB2 PRO B 46 31.036 20.160 118.878 1.00 56.72 H new ATOM 0 HB3 PRO B 46 29.531 19.751 118.900 1.00 56.72 H new ATOM 0 HG2 PRO B 46 31.697 18.038 118.190 1.00 55.54 H new ATOM 0 HG3 PRO B 46 30.648 17.748 119.306 1.00 55.54 H new ATOM 0 HD2 PRO B 46 30.208 16.770 116.986 1.00 56.10 H new ATOM 0 HD3 PRO B 46 28.982 17.298 117.792 1.00 56.10 H new ATOM 2119 N VAL B 47 31.648 20.846 115.185 1.00 57.10 N ATOM 2120 CA VAL B 47 32.908 21.171 114.535 1.00 56.65 C ATOM 2121 C VAL B 47 33.525 22.393 115.207 1.00 56.81 C ATOM 2122 O VAL B 47 32.828 23.354 115.517 1.00 57.82 O ATOM 2123 CB VAL B 47 32.703 21.435 113.014 1.00 57.67 C ATOM 2124 CG1 VAL B 47 31.407 20.797 112.546 1.00 55.88 C ATOM 2125 CG2 VAL B 47 32.718 22.915 112.714 1.00 56.89 C ATOM 0 H VAL B 47 30.944 21.107 114.766 1.00 57.10 H new ATOM 0 HA VAL B 47 33.508 20.415 114.625 1.00 56.65 H new ATOM 0 HB VAL B 47 33.439 21.031 112.528 1.00 57.67 H new ATOM 0 HG11 VAL B 47 31.287 20.966 111.598 1.00 55.88 H new ATOM 0 HG12 VAL B 47 31.442 19.840 112.702 1.00 55.88 H new ATOM 0 HG13 VAL B 47 30.663 21.177 113.039 1.00 55.88 H new ATOM 0 HG21 VAL B 47 32.589 23.054 111.763 1.00 56.89 H new ATOM 0 HG22 VAL B 47 32.004 23.352 113.204 1.00 56.89 H new ATOM 0 HG23 VAL B 47 33.571 23.291 112.982 1.00 56.89 H new ATOM 2126 N ARG B 48 34.830 22.347 115.450 1.00 57.09 N ATOM 2127 CA ARG B 48 35.521 23.465 116.082 1.00 57.68 C ATOM 2128 C ARG B 48 36.779 23.833 115.306 1.00 56.70 C ATOM 2129 O ARG B 48 37.701 24.452 115.838 1.00 55.29 O ATOM 2130 CB ARG B 48 35.874 23.123 117.532 1.00 61.62 C ATOM 2131 CG ARG B 48 34.650 22.913 118.420 1.00 66.33 C ATOM 2132 CD ARG B 48 35.014 22.859 119.899 1.00 70.05 C ATOM 2133 NE ARG B 48 33.832 22.674 120.738 1.00 73.73 N ATOM 2134 CZ ARG B 48 33.851 22.634 122.068 1.00 76.04 C ATOM 2135 NH1 ARG B 48 32.723 22.460 122.745 1.00 75.78 N ATOM 2136 NH2 ARG B 48 34.997 22.772 122.725 1.00 77.45 N ATOM 0 H ARG B 48 35.334 21.678 115.257 1.00 57.09 H new ATOM 0 HA ARG B 48 34.925 24.230 116.078 1.00 57.68 H new ATOM 0 HB2 ARG B 48 36.416 22.319 117.545 1.00 61.62 H new ATOM 0 HB3 ARG B 48 36.416 23.837 117.903 1.00 61.62 H new ATOM 0 HG2 ARG B 48 34.017 23.632 118.271 1.00 66.33 H new ATOM 0 HG3 ARG B 48 34.207 22.088 118.167 1.00 66.33 H new ATOM 0 HD2 ARG B 48 35.638 22.132 120.053 1.00 70.05 H new ATOM 0 HD3 ARG B 48 35.466 23.679 120.152 1.00 70.05 H new ATOM 0 HE ARG B 48 33.072 22.585 120.345 1.00 73.73 H new ATOM 0 HH11 ARG B 48 31.978 22.373 122.324 1.00 75.78 H new ATOM 0 HH12 ARG B 48 32.737 22.434 123.605 1.00 75.78 H new ATOM 0 HH21 ARG B 48 35.730 22.888 122.291 1.00 77.45 H new ATOM 0 HH22 ARG B 48 35.006 22.746 123.585 1.00 77.45 H new ATOM 2137 N ALA B 49 36.800 23.441 114.038 1.00 55.54 N ATOM 2138 CA ALA B 49 37.920 23.715 113.148 1.00 53.86 C ATOM 2139 C ALA B 49 37.461 23.378 111.741 1.00 52.42 C ATOM 2140 O ALA B 49 36.494 22.645 111.561 1.00 53.06 O ATOM 2141 CB ALA B 49 39.123 22.866 113.532 1.00 53.42 C ATOM 0 H ALA B 49 36.159 23.005 113.667 1.00 55.54 H new ATOM 0 HA ALA B 49 38.190 24.645 113.209 1.00 53.86 H new ATOM 0 HB1 ALA B 49 39.860 23.059 112.932 1.00 53.42 H new ATOM 0 HB2 ALA B 49 39.386 23.071 114.443 1.00 53.42 H new ATOM 0 HB3 ALA B 49 38.890 21.927 113.467 1.00 53.42 H new ATOM 2142 N CYS B 50 38.155 23.910 110.745 1.00 51.37 N ATOM 2143 CA CYS B 50 37.786 23.670 109.360 1.00 50.69 C ATOM 2144 C CYS B 50 38.923 24.002 108.392 1.00 50.20 C ATOM 2145 O CYS B 50 39.687 24.942 108.613 1.00 51.00 O ATOM 2146 CB CYS B 50 36.550 24.504 109.020 1.00 50.03 C ATOM 2147 SG CYS B 50 36.187 24.648 107.266 1.00 53.31 S ATOM 0 H CYS B 50 38.844 24.414 110.851 1.00 51.37 H new ATOM 0 HA CYS B 50 37.593 22.725 109.260 1.00 50.69 H new ATOM 0 HB2 CYS B 50 35.781 24.113 109.464 1.00 50.03 H new ATOM 0 HB3 CYS B 50 36.667 25.395 109.386 1.00 50.03 H new ATOM 0 HG CYS B 50 35.202 25.317 107.114 1.00 53.31 H new ATOM 2148 N ARG B 51 39.036 23.215 107.327 1.00 48.17 N ATOM 2149 CA ARG B 51 40.060 23.434 106.313 1.00 46.36 C ATOM 2150 C ARG B 51 39.497 22.999 104.977 1.00 45.68 C ATOM 2151 O ARG B 51 38.661 22.100 104.914 1.00 44.33 O ATOM 2152 CB ARG B 51 41.348 22.657 106.643 1.00 43.96 C ATOM 2153 CG ARG B 51 41.185 21.155 106.836 1.00 41.41 C ATOM 2154 CD ARG B 51 42.472 20.527 107.384 1.00 41.30 C ATOM 2155 NE ARG B 51 42.259 19.147 107.811 1.00 39.89 N ATOM 2156 CZ ARG B 51 43.059 18.473 108.633 1.00 39.86 C ATOM 2157 NH1 ARG B 51 42.763 17.219 108.955 1.00 37.54 N ATOM 2158 NH2 ARG B 51 44.143 19.044 109.143 1.00 39.49 N ATOM 0 H ARG B 51 38.523 22.542 107.173 1.00 48.17 H new ATOM 0 HA ARG B 51 40.298 24.374 106.286 1.00 46.36 H new ATOM 0 HB2 ARG B 51 41.988 22.807 105.929 1.00 43.96 H new ATOM 0 HB3 ARG B 51 41.732 23.030 107.452 1.00 43.96 H new ATOM 0 HG2 ARG B 51 40.452 20.982 107.447 1.00 41.41 H new ATOM 0 HG3 ARG B 51 40.954 20.740 105.990 1.00 41.41 H new ATOM 0 HD2 ARG B 51 43.161 20.552 106.702 1.00 41.30 H new ATOM 0 HD3 ARG B 51 42.795 21.052 108.133 1.00 41.30 H new ATOM 0 HE ARG B 51 41.565 18.740 107.509 1.00 39.89 H new ATOM 0 HH11 ARG B 51 42.058 16.847 108.633 1.00 37.54 H new ATOM 0 HH12 ARG B 51 43.277 16.779 109.486 1.00 37.54 H new ATOM 0 HH21 ARG B 51 44.335 19.858 108.943 1.00 39.49 H new ATOM 0 HH22 ARG B 51 44.654 18.600 109.673 1.00 39.49 H new ATOM 2159 N LEU B 52 39.929 23.661 103.910 1.00 46.87 N ATOM 2160 CA LEU B 52 39.445 23.322 102.581 1.00 48.92 C ATOM 2161 C LEU B 52 40.388 23.737 101.467 1.00 49.67 C ATOM 2162 O LEU B 52 41.268 24.581 101.645 1.00 49.60 O ATOM 2163 CB LEU B 52 38.069 23.949 102.336 1.00 49.41 C ATOM 2164 CG LEU B 52 37.911 25.477 102.281 1.00 52.29 C ATOM 2165 CD1 LEU B 52 38.497 26.043 100.984 1.00 52.06 C ATOM 2166 CD2 LEU B 52 36.431 25.818 102.356 1.00 50.82 C ATOM 0 H LEU B 52 40.498 24.305 103.934 1.00 46.87 H new ATOM 0 HA LEU B 52 39.386 22.354 102.560 1.00 48.92 H new ATOM 0 HB2 LEU B 52 37.738 23.596 101.495 1.00 49.41 H new ATOM 0 HB3 LEU B 52 37.477 23.624 103.033 1.00 49.41 H new ATOM 0 HG LEU B 52 38.389 25.870 103.028 1.00 52.29 H new ATOM 0 HD11 LEU B 52 38.386 27.007 100.972 1.00 52.06 H new ATOM 0 HD12 LEU B 52 39.441 25.826 100.934 1.00 52.06 H new ATOM 0 HD13 LEU B 52 38.036 25.655 100.224 1.00 52.06 H new ATOM 0 HD21 LEU B 52 36.318 26.781 102.322 1.00 50.82 H new ATOM 0 HD22 LEU B 52 35.967 25.412 101.607 1.00 50.82 H new ATOM 0 HD23 LEU B 52 36.062 25.479 103.187 1.00 50.82 H new ATOM 2167 N VAL B 53 40.191 23.111 100.316 1.00 50.36 N ATOM 2168 CA VAL B 53 40.967 23.398 99.129 1.00 51.62 C ATOM 2169 C VAL B 53 39.930 23.783 98.084 1.00 52.29 C ATOM 2170 O VAL B 53 38.846 23.196 98.030 1.00 51.55 O ATOM 2171 CB VAL B 53 41.769 22.160 98.652 1.00 51.92 C ATOM 2172 CG1 VAL B 53 40.845 20.966 98.472 1.00 49.79 C ATOM 2173 CG2 VAL B 53 42.480 22.482 97.345 1.00 51.75 C ATOM 0 H VAL B 53 39.595 22.501 100.204 1.00 50.36 H new ATOM 0 HA VAL B 53 41.623 24.094 99.292 1.00 51.62 H new ATOM 0 HB VAL B 53 42.430 21.934 99.325 1.00 51.92 H new ATOM 0 HG11 VAL B 53 41.360 20.200 98.174 1.00 49.79 H new ATOM 0 HG12 VAL B 53 40.417 20.758 99.317 1.00 49.79 H new ATOM 0 HG13 VAL B 53 40.168 21.177 97.810 1.00 49.79 H new ATOM 0 HG21 VAL B 53 42.981 21.706 97.049 1.00 51.75 H new ATOM 0 HG22 VAL B 53 41.825 22.720 96.670 1.00 51.75 H new ATOM 0 HG23 VAL B 53 43.088 23.226 97.482 1.00 51.75 H new ATOM 2174 N SER B 54 40.248 24.776 97.266 1.00 53.44 N ATOM 2175 CA SER B 54 39.302 25.212 96.254 1.00 56.20 C ATOM 2176 C SER B 54 39.962 25.598 94.945 1.00 57.58 C ATOM 2177 O SER B 54 41.040 26.193 94.929 1.00 57.72 O ATOM 2178 CB SER B 54 38.490 26.397 96.777 1.00 55.21 C ATOM 2179 OG SER B 54 37.561 26.828 95.801 1.00 58.12 O ATOM 0 H SER B 54 40.994 25.204 97.279 1.00 53.44 H new ATOM 0 HA SER B 54 38.725 24.454 96.072 1.00 56.20 H new ATOM 0 HB2 SER B 54 38.022 26.143 97.588 1.00 55.21 H new ATOM 0 HB3 SER B 54 39.085 27.127 97.010 1.00 55.21 H new ATOM 0 HG SER B 54 37.121 27.478 96.101 1.00 58.12 H new ATOM 2180 N VAL B 55 39.298 25.255 93.849 1.00 60.06 N ATOM 2181 CA VAL B 55 39.787 25.572 92.517 1.00 63.40 C ATOM 2182 C VAL B 55 38.861 26.617 91.898 1.00 65.92 C ATOM 2183 O VAL B 55 38.689 26.670 90.680 1.00 66.45 O ATOM 2184 CB VAL B 55 39.806 24.317 91.618 1.00 62.74 C ATOM 2185 CG1 VAL B 55 40.709 23.256 92.232 1.00 63.07 C ATOM 2186 CG2 VAL B 55 38.395 23.779 91.439 1.00 62.06 C ATOM 0 H VAL B 55 38.550 24.831 93.858 1.00 60.06 H new ATOM 0 HA VAL B 55 40.694 25.910 92.587 1.00 63.40 H new ATOM 0 HB VAL B 55 40.155 24.556 90.745 1.00 62.74 H new ATOM 0 HG11 VAL B 55 40.718 22.470 91.664 1.00 63.07 H new ATOM 0 HG12 VAL B 55 41.610 23.605 92.313 1.00 63.07 H new ATOM 0 HG13 VAL B 55 40.375 23.016 93.111 1.00 63.07 H new ATOM 0 HG21 VAL B 55 38.418 22.991 90.873 1.00 62.06 H new ATOM 0 HG22 VAL B 55 38.026 23.544 92.305 1.00 62.06 H new ATOM 0 HG23 VAL B 55 37.840 24.458 91.025 1.00 62.06 H new ATOM 2187 N ARG B 56 38.265 27.444 92.751 1.00 67.81 N ATOM 2188 CA ARG B 56 37.350 28.480 92.294 1.00 70.40 C ATOM 2189 C ARG B 56 37.909 29.878 92.503 1.00 72.27 C ATOM 2190 O ARG B 56 38.909 30.066 93.200 1.00 72.40 O ATOM 2191 CB ARG B 56 36.012 28.362 93.022 1.00 70.70 C ATOM 2192 CG ARG B 56 35.252 27.093 92.717 1.00 71.67 C ATOM 2193 CD ARG B 56 33.983 27.025 93.540 1.00 72.07 C ATOM 2194 NE ARG B 56 33.251 25.783 93.318 1.00 72.85 N ATOM 2195 CZ ARG B 56 32.109 25.475 93.925 1.00 73.59 C ATOM 2196 NH1 ARG B 56 31.570 26.323 94.794 1.00 73.07 N ATOM 2197 NH2 ARG B 56 31.505 24.324 93.660 1.00 72.19 N ATOM 0 H ARG B 56 38.379 27.420 93.603 1.00 67.81 H new ATOM 0 HA ARG B 56 37.226 28.346 91.341 1.00 70.40 H new ATOM 0 HB2 ARG B 56 36.170 28.411 93.978 1.00 70.70 H new ATOM 0 HB3 ARG B 56 35.459 29.123 92.786 1.00 70.70 H new ATOM 0 HG2 ARG B 56 35.034 27.059 91.772 1.00 71.67 H new ATOM 0 HG3 ARG B 56 35.809 26.322 92.907 1.00 71.67 H new ATOM 0 HD2 ARG B 56 34.205 27.105 94.481 1.00 72.07 H new ATOM 0 HD3 ARG B 56 33.414 27.779 93.318 1.00 72.07 H new ATOM 0 HE ARG B 56 33.578 25.216 92.761 1.00 72.85 H new ATOM 0 HH11 ARG B 56 31.960 27.071 94.964 1.00 73.07 H new ATOM 0 HH12 ARG B 56 30.831 26.124 95.187 1.00 73.07 H new ATOM 0 HH21 ARG B 56 31.852 23.776 93.095 1.00 72.19 H new ATOM 0 HH22 ARG B 56 30.766 24.126 94.053 1.00 72.19 H new ATOM 2198 N SER B 57 37.246 30.854 91.894 1.00 74.21 N ATOM 2199 CA SER B 57 37.651 32.249 91.991 1.00 75.92 C ATOM 2200 C SER B 57 37.839 32.642 93.445 1.00 76.30 C ATOM 2201 O SER B 57 37.108 32.175 94.317 1.00 76.58 O ATOM 2202 CB SER B 57 36.583 33.144 91.363 1.00 76.92 C ATOM 2203 OG SER B 57 36.248 32.700 90.060 1.00 79.14 O ATOM 0 H SER B 57 36.546 30.725 91.411 1.00 74.21 H new ATOM 0 HA SER B 57 38.491 32.361 91.518 1.00 75.92 H new ATOM 0 HB2 SER B 57 35.790 33.146 91.921 1.00 76.92 H new ATOM 0 HB3 SER B 57 36.905 34.058 91.324 1.00 76.92 H new ATOM 0 HG SER B 57 35.539 32.251 90.091 1.00 79.14 H new ATOM 2204 N GLU B 58 38.819 33.500 93.709 1.00 77.13 N ATOM 2205 CA GLU B 58 39.064 33.954 95.070 1.00 78.29 C ATOM 2206 C GLU B 58 37.790 34.626 95.566 1.00 78.88 C ATOM 2207 O GLU B 58 37.641 34.921 96.752 1.00 78.56 O ATOM 2208 CB GLU B 58 40.223 34.946 95.106 1.00 79.18 C ATOM 2209 CG GLU B 58 40.578 35.396 96.507 1.00 81.72 C ATOM 2210 CD GLU B 58 40.871 34.224 97.425 1.00 84.20 C ATOM 2211 OE1 GLU B 58 41.831 33.473 97.142 1.00 85.18 O ATOM 2212 OE2 GLU B 58 40.140 34.048 98.426 1.00 85.37 O ATOM 0 H GLU B 58 39.350 33.829 93.117 1.00 77.13 H new ATOM 0 HA GLU B 58 39.301 33.202 95.635 1.00 78.29 H new ATOM 0 HB2 GLU B 58 41.002 34.539 94.696 1.00 79.18 H new ATOM 0 HB3 GLU B 58 39.994 35.722 94.571 1.00 79.18 H new ATOM 0 HG2 GLU B 58 41.352 35.979 96.472 1.00 81.72 H new ATOM 0 HG3 GLU B 58 39.847 35.917 96.873 1.00 81.72 H new ATOM 2213 N GLN B 59 36.876 34.865 94.629 1.00 79.39 N ATOM 2214 CA GLN B 59 35.590 35.481 94.920 1.00 79.63 C ATOM 2215 C GLN B 59 34.696 34.377 95.463 1.00 79.23 C ATOM 2216 O GLN B 59 34.329 34.374 96.639 1.00 79.02 O ATOM 2217 CB GLN B 59 34.962 36.034 93.638 1.00 80.44 C ATOM 2218 CG GLN B 59 35.913 36.812 92.744 1.00 81.90 C ATOM 2219 CD GLN B 59 35.316 37.102 91.376 1.00 82.41 C ATOM 2220 OE1 GLN B 59 34.976 36.184 90.627 1.00 82.20 O ATOM 2221 NE2 GLN B 59 35.185 38.382 91.046 1.00 82.65 N ATOM 0 H GLN B 59 36.989 34.671 93.799 1.00 79.39 H new ATOM 0 HA GLN B 59 35.696 36.211 95.550 1.00 79.63 H new ATOM 0 HB2 GLN B 59 34.592 35.295 93.130 1.00 80.44 H new ATOM 0 HB3 GLN B 59 34.221 36.611 93.879 1.00 80.44 H new ATOM 0 HG2 GLN B 59 36.147 37.648 93.176 1.00 81.90 H new ATOM 0 HG3 GLN B 59 36.735 36.309 92.635 1.00 81.90 H new ATOM 0 HE21 GLN B 59 35.434 38.995 91.595 1.00 82.65 H new ATOM 0 HE22 GLN B 59 34.852 38.597 90.283 1.00 82.65 H new ATOM 2222 N GLU B 60 34.357 33.439 94.583 1.00 79.01 N ATOM 2223 CA GLU B 60 33.507 32.310 94.929 1.00 79.19 C ATOM 2224 C GLU B 60 34.012 31.605 96.178 1.00 79.09 C ATOM 2225 O GLU B 60 33.223 31.073 96.959 1.00 79.39 O ATOM 2226 CB GLU B 60 33.458 31.310 93.772 1.00 79.54 C ATOM 2227 CG GLU B 60 32.927 31.881 92.473 1.00 81.23 C ATOM 2228 CD GLU B 60 32.853 30.839 91.373 1.00 82.82 C ATOM 2229 OE1 GLU B 60 32.121 29.841 91.549 1.00 83.71 O ATOM 2230 OE2 GLU B 60 33.530 31.013 90.337 1.00 83.62 O ATOM 0 H GLU B 60 34.617 33.442 93.763 1.00 79.01 H new ATOM 0 HA GLU B 60 32.617 32.654 95.103 1.00 79.19 H new ATOM 0 HB2 GLU B 60 34.352 30.965 93.619 1.00 79.54 H new ATOM 0 HB3 GLU B 60 32.904 30.558 94.032 1.00 79.54 H new ATOM 0 HG2 GLU B 60 32.044 32.253 92.623 1.00 81.23 H new ATOM 0 HG3 GLU B 60 33.498 32.611 92.186 1.00 81.23 H new ATOM 2231 N THR B 61 35.330 31.600 96.362 1.00 78.98 N ATOM 2232 CA THR B 61 35.927 30.951 97.523 1.00 78.40 C ATOM 2233 C THR B 61 35.357 31.537 98.805 1.00 78.80 C ATOM 2234 O THR B 61 34.726 30.827 99.588 1.00 79.48 O ATOM 2235 CB THR B 61 37.461 31.106 97.534 1.00 77.76 C ATOM 2236 OG1 THR B 61 38.015 30.427 96.401 1.00 77.51 O ATOM 2237 CG2 THR B 61 38.050 30.509 98.804 1.00 75.99 C ATOM 0 H THR B 61 35.894 31.967 95.826 1.00 78.98 H new ATOM 0 HA THR B 61 35.713 30.006 97.468 1.00 78.40 H new ATOM 0 HB THR B 61 37.677 32.051 97.498 1.00 77.76 H new ATOM 0 HG1 THR B 61 37.818 30.845 95.700 1.00 77.51 H new ATOM 0 HG21 THR B 61 39.014 30.615 98.795 1.00 75.99 H new ATOM 0 HG22 THR B 61 37.683 30.965 99.577 1.00 75.99 H new ATOM 0 HG23 THR B 61 37.829 29.566 98.851 1.00 75.99 H new ATOM 2238 N SER B 62 35.569 32.829 99.023 1.00 78.90 N ATOM 2239 CA SER B 62 35.046 33.457 100.228 1.00 78.79 C ATOM 2240 C SER B 62 33.521 33.449 100.202 1.00 78.02 C ATOM 2241 O SER B 62 32.871 33.668 101.223 1.00 78.21 O ATOM 2242 CB SER B 62 35.554 34.888 100.357 1.00 78.72 C ATOM 2243 OG SER B 62 35.118 35.440 101.587 1.00 80.46 O ATOM 0 H SER B 62 36.005 33.351 98.497 1.00 78.90 H new ATOM 0 HA SER B 62 35.356 32.950 100.995 1.00 78.79 H new ATOM 0 HB2 SER B 62 36.523 34.902 100.311 1.00 78.72 H new ATOM 0 HB3 SER B 62 35.227 35.424 99.618 1.00 78.72 H new ATOM 0 HG SER B 62 35.400 36.228 101.656 1.00 80.46 H new ATOM 2244 N GLN B 63 32.958 33.199 99.023 1.00 77.30 N ATOM 2245 CA GLN B 63 31.510 33.134 98.854 1.00 76.88 C ATOM 2246 C GLN B 63 31.003 31.864 99.532 1.00 76.58 C ATOM 2247 O GLN B 63 29.869 31.807 100.013 1.00 76.90 O ATOM 2248 CB GLN B 63 31.152 33.109 97.365 1.00 77.36 C ATOM 2249 CG GLN B 63 29.706 32.749 97.066 1.00 78.43 C ATOM 2250 CD GLN B 63 28.719 33.653 97.779 1.00 80.00 C ATOM 2251 OE1 GLN B 63 28.785 34.878 97.663 1.00 80.14 O ATOM 2252 NE2 GLN B 63 27.791 33.050 98.519 1.00 80.30 N ATOM 0 H GLN B 63 33.404 33.063 98.300 1.00 77.30 H new ATOM 0 HA GLN B 63 31.096 33.915 99.254 1.00 76.88 H new ATOM 0 HB2 GLN B 63 31.341 33.981 96.985 1.00 77.36 H new ATOM 0 HB3 GLN B 63 31.730 32.473 96.916 1.00 77.36 H new ATOM 0 HG2 GLN B 63 29.555 32.802 96.109 1.00 78.43 H new ATOM 0 HG3 GLN B 63 29.545 31.829 97.328 1.00 78.43 H new ATOM 0 HE21 GLN B 63 27.777 32.192 98.576 1.00 80.30 H new ATOM 0 HE22 GLN B 63 27.206 33.518 98.940 1.00 80.30 H new ATOM 2253 N LEU B 64 31.855 30.843 99.558 1.00 75.41 N ATOM 2254 CA LEU B 64 31.516 29.577 100.192 1.00 72.75 C ATOM 2255 C LEU B 64 31.977 29.657 101.638 1.00 70.68 C ATOM 2256 O LEU B 64 31.292 29.189 102.547 1.00 70.51 O ATOM 2257 CB LEU B 64 32.211 28.427 99.478 1.00 73.25 C ATOM 0 H LEU B 64 32.641 30.866 99.210 1.00 75.41 H new ATOM 0 HA LEU B 64 30.560 29.417 100.147 1.00 72.75 H new ATOM 2258 N VAL B 65 33.141 30.268 101.842 1.00 68.66 N ATOM 2259 CA VAL B 65 33.703 30.430 103.176 1.00 68.33 C ATOM 2260 C VAL B 65 32.782 31.316 103.999 1.00 69.03 C ATOM 2261 O VAL B 65 32.778 31.258 105.229 1.00 69.92 O ATOM 2262 CB VAL B 65 35.092 31.096 103.123 1.00 67.30 C ATOM 2263 CG1 VAL B 65 35.664 31.227 104.525 1.00 66.91 C ATOM 2264 CG2 VAL B 65 36.023 30.287 102.240 1.00 67.58 C ATOM 0 H VAL B 65 33.624 30.599 101.212 1.00 68.66 H new ATOM 0 HA VAL B 65 33.791 29.550 103.574 1.00 68.33 H new ATOM 0 HB VAL B 65 35.002 31.984 102.744 1.00 67.30 H new ATOM 0 HG11 VAL B 65 36.537 31.647 104.480 1.00 66.91 H new ATOM 0 HG12 VAL B 65 35.071 31.771 105.067 1.00 66.91 H new ATOM 0 HG13 VAL B 65 35.749 30.347 104.924 1.00 66.91 H new ATOM 0 HG21 VAL B 65 36.894 30.713 102.212 1.00 67.58 H new ATOM 0 HG22 VAL B 65 36.113 29.391 102.600 1.00 67.58 H new ATOM 0 HG23 VAL B 65 35.658 30.239 101.343 1.00 67.58 H new ATOM 2265 N ALA B 66 32.007 32.141 103.302 1.00 70.01 N ATOM 2266 CA ALA B 66 31.072 33.059 103.940 1.00 69.88 C ATOM 2267 C ALA B 66 30.048 32.309 104.785 1.00 69.66 C ATOM 2268 O ALA B 66 30.106 32.345 106.014 1.00 69.48 O ATOM 2269 CB ALA B 66 30.367 33.896 102.879 1.00 69.83 C ATOM 0 H ALA B 66 32.009 32.184 102.443 1.00 70.01 H new ATOM 0 HA ALA B 66 31.574 33.642 104.531 1.00 69.88 H new ATOM 0 HB1 ALA B 66 29.746 34.505 103.307 1.00 69.83 H new ATOM 0 HB2 ALA B 66 31.024 34.404 102.378 1.00 69.83 H new ATOM 0 HB3 ALA B 66 29.882 33.312 102.275 1.00 69.83 H new ATOM 2270 N ARG B 67 29.117 31.628 104.122 1.00 70.13 N ATOM 2271 CA ARG B 67 28.081 30.874 104.820 1.00 72.12 C ATOM 2272 C ARG B 67 28.617 29.769 105.733 1.00 73.57 C ATOM 2273 O ARG B 67 27.840 28.997 106.294 1.00 75.08 O ATOM 2274 CB ARG B 67 27.084 30.275 103.816 1.00 71.89 C ATOM 2275 CG ARG B 67 26.059 31.275 103.284 1.00 71.21 C ATOM 2276 CD ARG B 67 24.915 30.593 102.536 1.00 71.07 C ATOM 2277 NE ARG B 67 25.338 30.020 101.261 1.00 71.40 N ATOM 2278 CZ ARG B 67 24.530 29.376 100.421 1.00 72.12 C ATOM 2279 NH1 ARG B 67 25.008 28.891 99.282 1.00 72.54 N ATOM 2280 NH2 ARG B 67 23.246 29.215 100.717 1.00 70.89 N ATOM 0 H ARG B 67 29.068 31.590 103.264 1.00 70.13 H new ATOM 0 HA ARG B 67 27.638 31.515 105.397 1.00 72.12 H new ATOM 0 HB2 ARG B 67 27.577 29.903 103.068 1.00 71.89 H new ATOM 0 HB3 ARG B 67 26.615 29.540 104.240 1.00 71.89 H new ATOM 0 HG2 ARG B 67 25.698 31.789 104.023 1.00 71.21 H new ATOM 0 HG3 ARG B 67 26.501 31.903 102.691 1.00 71.21 H new ATOM 0 HD2 ARG B 67 24.541 29.892 103.093 1.00 71.07 H new ATOM 0 HD3 ARG B 67 24.207 31.237 102.378 1.00 71.07 H new ATOM 0 HE ARG B 67 26.164 30.104 101.038 1.00 71.40 H new ATOM 0 HH11 ARG B 67 25.839 28.993 99.087 1.00 72.54 H new ATOM 0 HH12 ARG B 67 24.486 28.475 98.739 1.00 72.54 H new ATOM 0 HH21 ARG B 67 22.932 29.527 101.454 1.00 70.89 H new ATOM 0 HH22 ARG B 67 22.728 28.798 100.171 1.00 70.89 H new ATOM 2281 N LEU B 68 29.937 29.693 105.885 1.00 74.51 N ATOM 2282 CA LEU B 68 30.552 28.688 106.748 1.00 74.78 C ATOM 2283 C LEU B 68 31.056 29.344 108.022 1.00 75.33 C ATOM 2284 O LEU B 68 30.843 28.837 109.123 1.00 75.41 O ATOM 2285 CB LEU B 68 31.725 28.004 106.042 1.00 75.13 C ATOM 2286 CG LEU B 68 31.420 27.047 104.889 1.00 74.80 C ATOM 2287 CD1 LEU B 68 32.725 26.563 104.286 1.00 75.02 C ATOM 2288 CD2 LEU B 68 30.598 25.875 105.391 1.00 74.80 C ATOM 0 H LEU B 68 30.496 30.217 105.495 1.00 74.51 H new ATOM 0 HA LEU B 68 29.881 28.021 106.960 1.00 74.78 H new ATOM 0 HB2 LEU B 68 32.311 28.698 105.703 1.00 75.13 H new ATOM 0 HB3 LEU B 68 32.226 27.511 106.711 1.00 75.13 H new ATOM 0 HG LEU B 68 30.907 27.509 104.208 1.00 74.80 H new ATOM 0 HD11 LEU B 68 32.538 25.955 103.554 1.00 75.02 H new ATOM 0 HD12 LEU B 68 33.230 27.322 103.954 1.00 75.02 H new ATOM 0 HD13 LEU B 68 33.243 26.102 104.964 1.00 75.02 H new ATOM 0 HD21 LEU B 68 30.409 25.273 104.654 1.00 74.80 H new ATOM 0 HD22 LEU B 68 31.095 25.401 106.076 1.00 74.80 H new ATOM 0 HD23 LEU B 68 29.764 26.201 105.764 1.00 74.80 H new ATOM 2289 N GLU B 69 31.732 30.474 107.863 1.00 75.84 N ATOM 2290 CA GLU B 69 32.266 31.206 109.001 1.00 77.01 C ATOM 2291 C GLU B 69 31.150 31.579 109.975 1.00 77.19 C ATOM 2292 O GLU B 69 31.408 31.960 111.120 1.00 75.66 O ATOM 2293 CB GLU B 69 32.988 32.465 108.513 1.00 78.27 C ATOM 2294 CG GLU B 69 34.281 32.176 107.769 1.00 78.91 C ATOM 2295 CD GLU B 69 35.348 31.606 108.683 1.00 80.35 C ATOM 2296 OE1 GLU B 69 35.060 30.613 109.384 1.00 80.70 O ATOM 2297 OE2 GLU B 69 36.475 32.147 108.702 1.00 80.32 O ATOM 0 H GLU B 69 31.893 30.835 107.099 1.00 75.84 H new ATOM 0 HA GLU B 69 32.898 30.638 109.469 1.00 77.01 H new ATOM 0 HB2 GLU B 69 32.394 32.964 107.931 1.00 78.27 H new ATOM 0 HB3 GLU B 69 33.182 33.033 109.275 1.00 78.27 H new ATOM 0 HG2 GLU B 69 34.106 31.550 107.049 1.00 78.91 H new ATOM 0 HG3 GLU B 69 34.608 32.993 107.362 1.00 78.91 H new ATOM 2298 N GLN B 70 29.910 31.451 109.510 1.00 77.44 N ATOM 2299 CA GLN B 70 28.739 31.771 110.319 1.00 77.76 C ATOM 2300 C GLN B 70 28.128 30.528 110.959 1.00 77.10 C ATOM 2301 O GLN B 70 27.655 30.575 112.096 1.00 77.48 O ATOM 2302 CB GLN B 70 27.680 32.460 109.456 1.00 78.61 C ATOM 2303 CG GLN B 70 27.275 31.654 108.230 1.00 79.88 C ATOM 2304 CD GLN B 70 26.056 32.221 107.526 1.00 80.13 C ATOM 2305 OE1 GLN B 70 26.029 33.395 107.153 1.00 80.73 O ATOM 2306 NE2 GLN B 70 25.041 31.384 107.334 1.00 80.74 N ATOM 0 H GLN B 70 29.725 31.176 108.716 1.00 77.44 H new ATOM 0 HA GLN B 70 29.033 32.363 111.029 1.00 77.76 H new ATOM 0 HB2 GLN B 70 26.893 32.629 109.997 1.00 78.61 H new ATOM 0 HB3 GLN B 70 28.018 33.323 109.169 1.00 78.61 H new ATOM 0 HG2 GLN B 70 28.018 31.626 107.607 1.00 79.88 H new ATOM 0 HG3 GLN B 70 27.093 30.739 108.496 1.00 79.88 H new ATOM 0 HE21 GLN B 70 25.096 30.571 107.609 1.00 80.74 H new ATOM 0 HE22 GLN B 70 24.329 31.656 106.935 1.00 80.74 H new ATOM 2307 N LEU B 71 28.138 29.419 110.224 1.00 75.96 N ATOM 2308 CA LEU B 71 27.572 28.165 110.714 1.00 73.79 C ATOM 2309 C LEU B 71 28.430 27.480 111.766 1.00 72.31 C ATOM 2310 O LEU B 71 27.939 26.638 112.516 1.00 73.32 O ATOM 2311 CB LEU B 71 27.352 27.189 109.554 1.00 73.54 C ATOM 2312 CG LEU B 71 26.305 27.539 108.499 1.00 73.62 C ATOM 2313 CD1 LEU B 71 26.260 26.443 107.444 1.00 73.14 C ATOM 2314 CD2 LEU B 71 24.948 27.693 109.159 1.00 74.32 C ATOM 0 H LEU B 71 28.471 29.372 109.432 1.00 75.96 H new ATOM 0 HA LEU B 71 26.730 28.404 111.132 1.00 73.79 H new ATOM 0 HB2 LEU B 71 28.201 27.073 109.100 1.00 73.54 H new ATOM 0 HB3 LEU B 71 27.113 26.329 109.933 1.00 73.54 H new ATOM 0 HG LEU B 71 26.541 28.377 108.071 1.00 73.62 H new ATOM 0 HD11 LEU B 71 25.595 26.666 106.774 1.00 73.14 H new ATOM 0 HD12 LEU B 71 27.130 26.364 107.022 1.00 73.14 H new ATOM 0 HD13 LEU B 71 26.027 25.600 107.863 1.00 73.14 H new ATOM 0 HD21 LEU B 71 24.285 27.915 108.487 1.00 74.32 H new ATOM 0 HD22 LEU B 71 24.702 26.861 109.592 1.00 74.32 H new ATOM 0 HD23 LEU B 71 24.988 28.402 109.820 1.00 74.32 H new ATOM 2315 N PHE B 72 29.707 27.836 111.830 1.00 69.93 N ATOM 2316 CA PHE B 72 30.600 27.203 112.788 1.00 68.42 C ATOM 2317 C PHE B 72 31.608 28.169 113.398 1.00 67.91 C ATOM 2318 O PHE B 72 32.162 29.021 112.708 1.00 67.99 O ATOM 2319 CB PHE B 72 31.349 26.052 112.104 1.00 66.59 C ATOM 2320 CG PHE B 72 30.444 25.019 111.485 1.00 64.97 C ATOM 2321 CD1 PHE B 72 29.694 24.158 112.283 1.00 64.41 C ATOM 2322 CD2 PHE B 72 30.342 24.906 110.104 1.00 63.98 C ATOM 2323 CE1 PHE B 72 28.855 23.198 111.711 1.00 62.92 C ATOM 2324 CE2 PHE B 72 29.506 23.949 109.523 1.00 63.88 C ATOM 2325 CZ PHE B 72 28.762 23.094 110.329 1.00 62.26 C ATOM 0 H PHE B 72 30.072 28.435 111.333 1.00 69.93 H new ATOM 0 HA PHE B 72 30.047 26.874 113.514 1.00 68.42 H new ATOM 0 HB2 PHE B 72 31.927 26.417 111.416 1.00 66.59 H new ATOM 0 HB3 PHE B 72 31.922 25.619 112.755 1.00 66.59 H new ATOM 0 HD1 PHE B 72 29.752 24.223 113.209 1.00 64.41 H new ATOM 0 HD2 PHE B 72 30.837 25.475 109.559 1.00 63.98 H new ATOM 0 HE1 PHE B 72 28.359 22.629 112.255 1.00 62.92 H new ATOM 0 HE2 PHE B 72 29.447 23.884 108.597 1.00 63.88 H new ATOM 0 HZ PHE B 72 28.205 22.456 109.945 1.00 62.26 H new ATOM 2326 N PRO B 73 31.856 28.042 114.711 1.00 67.71 N ATOM 2327 CA PRO B 73 32.807 28.900 115.426 1.00 68.36 C ATOM 2328 C PRO B 73 34.228 28.477 115.079 1.00 69.18 C ATOM 2329 O PRO B 73 34.975 28.007 115.941 1.00 68.81 O ATOM 2330 CB PRO B 73 32.474 28.628 116.887 1.00 67.85 C ATOM 2331 CG PRO B 73 32.109 27.178 116.861 1.00 67.85 C ATOM 2332 CD PRO B 73 31.215 27.091 115.637 1.00 67.18 C ATOM 0 HA PRO B 73 32.747 29.843 115.205 1.00 68.36 H new ATOM 0 HB2 PRO B 73 33.230 28.801 117.470 1.00 67.85 H new ATOM 0 HB3 PRO B 73 31.741 29.181 117.201 1.00 67.85 H new ATOM 0 HG2 PRO B 73 32.891 26.610 116.779 1.00 67.85 H new ATOM 0 HG3 PRO B 73 31.644 26.907 117.668 1.00 67.85 H new ATOM 0 HD2 PRO B 73 31.188 26.193 115.272 1.00 67.18 H new ATOM 0 HD3 PRO B 73 30.300 27.343 115.838 1.00 67.18 H new ATOM 2333 N VAL B 74 34.597 28.648 113.813 1.00 69.58 N ATOM 2334 CA VAL B 74 35.919 28.244 113.354 1.00 69.62 C ATOM 2335 C VAL B 74 36.585 29.236 112.408 1.00 69.83 C ATOM 2336 O VAL B 74 35.925 29.865 111.581 1.00 70.23 O ATOM 2337 CB VAL B 74 35.840 26.886 112.628 1.00 69.50 C ATOM 2338 CG1 VAL B 74 35.149 25.862 113.513 1.00 69.52 C ATOM 2339 CG2 VAL B 74 35.080 27.044 111.317 1.00 69.83 C ATOM 0 H VAL B 74 34.097 28.996 113.206 1.00 69.58 H new ATOM 0 HA VAL B 74 36.459 28.195 114.158 1.00 69.62 H new ATOM 0 HB VAL B 74 36.739 26.577 112.436 1.00 69.50 H new ATOM 0 HG11 VAL B 74 35.103 25.011 113.049 1.00 69.52 H new ATOM 0 HG12 VAL B 74 35.651 25.754 114.336 1.00 69.52 H new ATOM 0 HG13 VAL B 74 34.251 26.166 113.719 1.00 69.52 H new ATOM 0 HG21 VAL B 74 35.033 26.187 110.865 1.00 69.83 H new ATOM 0 HG22 VAL B 74 34.182 27.362 111.500 1.00 69.83 H new ATOM 0 HG23 VAL B 74 35.540 27.683 110.751 1.00 69.83 H new ATOM 2340 N SER B 75 37.902 29.360 112.535 1.00 69.35 N ATOM 2341 CA SER B 75 38.683 30.238 111.674 1.00 68.63 C ATOM 2342 C SER B 75 39.180 29.360 110.525 1.00 67.72 C ATOM 2343 O SER B 75 40.241 28.743 110.617 1.00 67.01 O ATOM 2344 CB SER B 75 39.869 30.821 112.450 1.00 69.57 C ATOM 2345 OG SER B 75 40.645 31.678 111.631 1.00 70.31 O ATOM 0 H SER B 75 38.367 28.938 113.122 1.00 69.35 H new ATOM 0 HA SER B 75 38.155 30.985 111.350 1.00 68.63 H new ATOM 0 HB2 SER B 75 39.544 31.312 113.221 1.00 69.57 H new ATOM 0 HB3 SER B 75 40.424 30.100 112.786 1.00 69.57 H new ATOM 0 HG SER B 75 41.287 31.986 112.077 1.00 70.31 H new ATOM 2346 N ALA B 76 38.393 29.308 109.453 1.00 66.53 N ATOM 2347 CA ALA B 76 38.695 28.494 108.278 1.00 65.81 C ATOM 2348 C ALA B 76 40.112 28.603 107.712 1.00 65.29 C ATOM 2349 O ALA B 76 40.670 29.695 107.580 1.00 65.40 O ATOM 2350 CB ALA B 76 37.680 28.793 107.178 1.00 65.83 C ATOM 0 H ALA B 76 37.659 29.751 109.387 1.00 66.53 H new ATOM 0 HA ALA B 76 38.634 27.580 108.596 1.00 65.81 H new ATOM 0 HB1 ALA B 76 37.880 28.253 106.397 1.00 65.83 H new ATOM 0 HB2 ALA B 76 36.788 28.584 107.495 1.00 65.83 H new ATOM 0 HB3 ALA B 76 37.727 29.732 106.941 1.00 65.83 H new ATOM 2351 N LEU B 77 40.681 27.448 107.375 1.00 63.82 N ATOM 2352 CA LEU B 77 42.015 27.373 106.792 1.00 61.91 C ATOM 2353 C LEU B 77 41.865 27.018 105.319 1.00 60.20 C ATOM 2354 O LEU B 77 41.145 26.086 104.972 1.00 60.18 O ATOM 2355 CB LEU B 77 42.851 26.306 107.499 1.00 62.08 C ATOM 2356 CG LEU B 77 43.150 26.547 108.980 1.00 63.18 C ATOM 2357 CD1 LEU B 77 44.017 25.415 109.512 1.00 63.66 C ATOM 2358 CD2 LEU B 77 43.856 27.885 109.155 1.00 63.88 C ATOM 0 H LEU B 77 40.301 26.683 107.479 1.00 63.82 H new ATOM 0 HA LEU B 77 42.467 28.225 106.894 1.00 61.91 H new ATOM 0 HB2 LEU B 77 42.392 25.456 107.416 1.00 62.08 H new ATOM 0 HB3 LEU B 77 43.695 26.220 107.029 1.00 62.08 H new ATOM 0 HG LEU B 77 42.319 26.570 109.480 1.00 63.18 H new ATOM 0 HD11 LEU B 77 44.207 25.567 110.451 1.00 63.66 H new ATOM 0 HD12 LEU B 77 43.548 24.572 109.410 1.00 63.66 H new ATOM 0 HD13 LEU B 77 44.849 25.384 109.015 1.00 63.66 H new ATOM 0 HD21 LEU B 77 44.043 28.032 110.095 1.00 63.88 H new ATOM 0 HD22 LEU B 77 44.689 27.879 108.657 1.00 63.88 H new ATOM 0 HD23 LEU B 77 43.287 28.597 108.824 1.00 63.88 H new ATOM 2359 N VAL B 78 42.535 27.770 104.454 1.00 59.46 N ATOM 2360 CA VAL B 78 42.461 27.530 103.017 1.00 57.97 C ATOM 2361 C VAL B 78 43.812 27.108 102.454 1.00 57.32 C ATOM 2362 O VAL B 78 44.831 27.768 102.680 1.00 56.60 O ATOM 2363 CB VAL B 78 41.992 28.788 102.265 1.00 58.54 C ATOM 2364 CG1 VAL B 78 41.861 28.487 100.785 1.00 57.51 C ATOM 2365 CG2 VAL B 78 40.668 29.272 102.837 1.00 57.86 C ATOM 0 H VAL B 78 43.041 28.428 104.680 1.00 59.46 H new ATOM 0 HA VAL B 78 41.819 26.815 102.888 1.00 57.97 H new ATOM 0 HB VAL B 78 42.650 29.492 102.378 1.00 58.54 H new ATOM 0 HG11 VAL B 78 41.565 29.284 100.317 1.00 57.51 H new ATOM 0 HG12 VAL B 78 42.721 28.207 100.434 1.00 57.51 H new ATOM 0 HG13 VAL B 78 41.213 27.777 100.655 1.00 57.51 H new ATOM 0 HG21 VAL B 78 40.379 30.065 102.358 1.00 57.86 H new ATOM 0 HG22 VAL B 78 40.000 28.575 102.741 1.00 57.86 H new ATOM 0 HG23 VAL B 78 40.780 29.485 103.777 1.00 57.86 H new ATOM 2366 N ALA B 79 43.813 25.998 101.722 1.00 55.59 N ATOM 2367 CA ALA B 79 45.031 25.480 101.117 1.00 53.47 C ATOM 2368 C ALA B 79 45.424 26.376 99.954 1.00 51.78 C ATOM 2369 O ALA B 79 44.561 26.878 99.232 1.00 52.60 O ATOM 2370 CB ALA B 79 44.806 24.061 100.625 1.00 51.99 C ATOM 0 H ALA B 79 43.111 25.528 101.564 1.00 55.59 H new ATOM 0 HA ALA B 79 45.742 25.469 101.776 1.00 53.47 H new ATOM 0 HB1 ALA B 79 45.622 23.724 100.224 1.00 51.99 H new ATOM 0 HB2 ALA B 79 44.556 23.495 101.372 1.00 51.99 H new ATOM 0 HB3 ALA B 79 44.096 24.056 99.965 1.00 51.99 H new ATOM 2371 N SER B 80 46.725 26.571 99.772 1.00 49.94 N ATOM 2372 CA SER B 80 47.218 27.407 98.685 1.00 48.43 C ATOM 2373 C SER B 80 48.284 26.693 97.856 1.00 46.53 C ATOM 2374 O SER B 80 48.923 25.744 98.323 1.00 44.26 O ATOM 2375 CB SER B 80 47.786 28.712 99.244 1.00 48.49 C ATOM 2376 OG SER B 80 48.836 28.454 100.159 1.00 51.40 O ATOM 0 H SER B 80 47.339 26.228 100.267 1.00 49.94 H new ATOM 0 HA SER B 80 46.468 27.600 98.101 1.00 48.43 H new ATOM 0 HB2 SER B 80 48.114 29.264 98.517 1.00 48.49 H new ATOM 0 HB3 SER B 80 47.082 29.213 99.686 1.00 48.49 H new ATOM 0 HG SER B 80 49.136 29.181 100.454 1.00 51.40 H new ATOM 2377 N SER B 81 48.465 27.159 96.622 1.00 45.46 N ATOM 2378 CA SER B 81 49.446 26.586 95.711 1.00 44.09 C ATOM 2379 C SER B 81 50.831 26.639 96.327 1.00 44.28 C ATOM 2380 O SER B 81 51.110 27.458 97.204 1.00 44.73 O ATOM 2381 CB SER B 81 49.466 27.352 94.387 1.00 43.59 C ATOM 2382 OG SER B 81 48.232 27.247 93.700 1.00 43.68 O ATOM 0 H SER B 81 48.021 27.817 96.291 1.00 45.46 H new ATOM 0 HA SER B 81 49.195 25.664 95.546 1.00 44.09 H new ATOM 0 HB2 SER B 81 49.663 28.286 94.557 1.00 43.59 H new ATOM 0 HB3 SER B 81 50.179 27.009 93.826 1.00 43.59 H new ATOM 0 HG SER B 81 48.274 27.678 92.980 1.00 43.68 H new ATOM 2383 N GLY B 82 51.702 25.762 95.859 1.00 43.59 N ATOM 2384 CA GLY B 82 53.050 25.737 96.377 1.00 43.15 C ATOM 2385 C GLY B 82 53.948 25.007 95.411 1.00 43.31 C ATOM 2386 O GLY B 82 53.471 24.247 94.571 1.00 43.45 O ATOM 0 H GLY B 82 51.533 25.180 95.249 1.00 43.59 H new ATOM 0 HA2 GLY B 82 53.372 26.642 96.511 1.00 43.15 H new ATOM 0 HA3 GLY B 82 53.066 25.299 97.242 1.00 43.15 H new ATOM 2387 N LYS B 83 55.247 25.249 95.520 1.00 43.17 N ATOM 2388 CA LYS B 83 56.221 24.596 94.663 1.00 44.74 C ATOM 2389 C LYS B 83 56.673 23.321 95.345 1.00 43.80 C ATOM 2390 O LYS B 83 57.346 22.486 94.745 1.00 44.33 O ATOM 2391 CB LYS B 83 57.437 25.502 94.437 1.00 46.81 C ATOM 2392 CG LYS B 83 57.160 26.740 93.603 1.00 50.71 C ATOM 2393 CD LYS B 83 58.429 27.563 93.434 1.00 53.79 C ATOM 2394 CE LYS B 83 58.178 28.820 92.617 1.00 55.46 C ATOM 2395 NZ LYS B 83 59.392 29.686 92.545 1.00 58.00 N ATOM 0 H LYS B 83 55.587 25.795 96.091 1.00 43.17 H new ATOM 0 HA LYS B 83 55.816 24.404 93.803 1.00 44.74 H new ATOM 0 HB2 LYS B 83 57.783 25.779 95.300 1.00 46.81 H new ATOM 0 HB3 LYS B 83 58.134 24.985 94.004 1.00 46.81 H new ATOM 0 HG2 LYS B 83 56.818 26.481 92.733 1.00 50.71 H new ATOM 0 HG3 LYS B 83 56.474 27.277 94.029 1.00 50.71 H new ATOM 0 HD2 LYS B 83 58.775 27.807 94.307 1.00 53.79 H new ATOM 0 HD3 LYS B 83 59.109 27.025 93.000 1.00 53.79 H new ATOM 0 HE2 LYS B 83 57.903 28.573 91.720 1.00 55.46 H new ATOM 0 HE3 LYS B 83 57.446 29.321 93.010 1.00 55.46 H new ATOM 0 HZ1 LYS B 83 59.212 30.411 92.061 1.00 58.00 H new ATOM 0 HZ2 LYS B 83 59.632 29.930 93.367 1.00 58.00 H new ATOM 0 HZ3 LYS B 83 60.057 29.234 92.164 1.00 58.00 H new ATOM 2396 N GLN B 84 56.300 23.169 96.607 1.00 42.71 N ATOM 2397 CA GLN B 84 56.702 21.991 97.353 1.00 43.77 C ATOM 2398 C GLN B 84 55.811 21.788 98.568 1.00 42.28 C ATOM 2399 O GLN B 84 55.369 22.749 99.198 1.00 41.13 O ATOM 2400 CB GLN B 84 58.163 22.142 97.788 1.00 46.92 C ATOM 2401 CG GLN B 84 58.748 20.944 98.507 1.00 52.49 C ATOM 2402 CD GLN B 84 60.258 21.051 98.671 1.00 57.43 C ATOM 2403 OE1 GLN B 84 60.814 22.201 98.292 1.00 59.05 O flip ATOM 2404 NE2 GLN B 84 60.916 20.114 99.129 1.00 59.15 N flip ATOM 0 H GLN B 84 55.819 23.731 97.045 1.00 42.71 H new ATOM 0 HA GLN B 84 56.611 21.212 96.782 1.00 43.77 H new ATOM 0 HB2 GLN B 84 58.702 22.325 97.003 1.00 46.92 H new ATOM 0 HB3 GLN B 84 58.235 22.916 98.368 1.00 46.92 H new ATOM 0 HG2 GLN B 84 58.335 20.860 99.381 1.00 52.49 H new ATOM 0 HG3 GLN B 84 58.535 20.137 98.013 1.00 52.49 H new ATOM 0 HE21 GLN B 84 60.522 19.386 99.363 1.00 59.15 H new ATOM 0 HE22 GLN B 84 61.769 20.188 99.214 1.00 59.15 H new ATOM 2405 N LEU B 85 55.540 20.530 98.890 1.00 40.95 N ATOM 2406 CA LEU B 85 54.705 20.219 100.040 1.00 39.52 C ATOM 2407 C LEU B 85 54.944 18.798 100.508 1.00 39.12 C ATOM 2408 O LEU B 85 54.850 17.848 99.728 1.00 39.80 O ATOM 2409 CB LEU B 85 53.220 20.404 99.707 1.00 37.09 C ATOM 2410 CG LEU B 85 52.276 19.974 100.842 1.00 40.42 C ATOM 2411 CD1 LEU B 85 52.535 20.855 102.067 1.00 41.78 C ATOM 2412 CD2 LEU B 85 50.819 20.080 100.410 1.00 36.85 C ATOM 0 H LEU B 85 55.829 19.845 98.458 1.00 40.95 H new ATOM 0 HA LEU B 85 54.946 20.833 100.751 1.00 39.52 H new ATOM 0 HB2 LEU B 85 53.057 21.337 99.497 1.00 37.09 H new ATOM 0 HB3 LEU B 85 53.009 19.893 98.910 1.00 37.09 H new ATOM 0 HG LEU B 85 52.450 19.046 101.064 1.00 40.42 H new ATOM 0 HD11 LEU B 85 51.943 20.590 102.788 1.00 41.78 H new ATOM 0 HD12 LEU B 85 53.457 20.751 102.351 1.00 41.78 H new ATOM 0 HD13 LEU B 85 52.370 21.783 101.839 1.00 41.78 H new ATOM 0 HD21 LEU B 85 50.244 19.804 101.141 1.00 36.85 H new ATOM 0 HD22 LEU B 85 50.618 20.998 100.170 1.00 36.85 H new ATOM 0 HD23 LEU B 85 50.666 19.505 99.644 1.00 36.85 H new ATOM 2413 N ALA B 86 55.262 18.661 101.787 1.00 38.35 N ATOM 2414 CA ALA B 86 55.500 17.356 102.383 1.00 38.99 C ATOM 2415 C ALA B 86 56.524 16.531 101.620 1.00 38.76 C ATOM 2416 O ALA B 86 56.394 15.312 101.527 1.00 40.57 O ATOM 2417 CB ALA B 86 54.185 16.587 102.481 1.00 38.48 C ATOM 0 H ALA B 86 55.346 19.320 102.333 1.00 38.35 H new ATOM 0 HA ALA B 86 55.867 17.512 103.267 1.00 38.99 H new ATOM 0 HB1 ALA B 86 54.347 15.717 102.879 1.00 38.48 H new ATOM 0 HB2 ALA B 86 53.560 17.083 103.033 1.00 38.48 H new ATOM 0 HB3 ALA B 86 53.811 16.471 101.594 1.00 38.48 H new ATOM 2418 N GLY B 87 57.534 17.192 101.068 1.00 38.89 N ATOM 2419 CA GLY B 87 58.571 16.476 100.341 1.00 38.98 C ATOM 2420 C GLY B 87 58.264 16.174 98.884 1.00 38.67 C ATOM 2421 O GLY B 87 58.938 15.355 98.260 1.00 37.94 O ATOM 0 H GLY B 87 57.637 18.045 101.102 1.00 38.89 H new ATOM 0 HA2 GLY B 87 59.389 16.996 100.381 1.00 38.98 H new ATOM 0 HA3 GLY B 87 58.744 15.638 100.798 1.00 38.98 H new ATOM 2422 N VAL B 88 57.250 16.834 98.338 1.00 37.68 N ATOM 2423 CA VAL B 88 56.866 16.622 96.949 1.00 36.52 C ATOM 2424 C VAL B 88 57.020 17.930 96.190 1.00 35.43 C ATOM 2425 O VAL B 88 56.591 18.979 96.662 1.00 37.50 O ATOM 2426 CB VAL B 88 55.399 16.134 96.852 1.00 37.05 C ATOM 2427 CG1 VAL B 88 55.014 15.919 95.397 1.00 35.54 C ATOM 2428 CG2 VAL B 88 55.231 14.848 97.649 1.00 34.82 C ATOM 0 H VAL B 88 56.770 17.411 98.757 1.00 37.68 H new ATOM 0 HA VAL B 88 57.439 15.941 96.563 1.00 36.52 H new ATOM 0 HB VAL B 88 54.812 16.810 97.225 1.00 37.05 H new ATOM 0 HG11 VAL B 88 54.095 15.614 95.347 1.00 35.54 H new ATOM 0 HG12 VAL B 88 55.104 16.754 94.911 1.00 35.54 H new ATOM 0 HG13 VAL B 88 55.598 15.252 95.003 1.00 35.54 H new ATOM 0 HG21 VAL B 88 54.311 14.546 97.586 1.00 34.82 H new ATOM 0 HG22 VAL B 88 55.820 14.166 97.291 1.00 34.82 H new ATOM 0 HG23 VAL B 88 55.454 15.012 98.579 1.00 34.82 H new ATOM 2429 N ARG B 89 57.609 17.857 95.003 1.00 34.43 N ATOM 2430 CA ARG B 89 57.854 19.040 94.180 1.00 34.36 C ATOM 2431 C ARG B 89 56.862 19.213 93.028 1.00 32.74 C ATOM 2432 O ARG B 89 56.719 18.319 92.200 1.00 33.83 O ATOM 2433 CB ARG B 89 59.275 18.953 93.619 1.00 38.42 C ATOM 2434 CG ARG B 89 59.869 20.262 93.113 1.00 45.23 C ATOM 2435 CD ARG B 89 61.161 20.544 93.878 1.00 51.49 C ATOM 2436 NE ARG B 89 61.949 19.320 94.028 1.00 54.53 N ATOM 2437 CZ ARG B 89 62.946 19.164 94.895 1.00 57.73 C ATOM 2438 NH1 ARG B 89 63.597 18.007 94.952 1.00 58.35 N ATOM 2439 NH2 ARG B 89 63.292 20.160 95.705 1.00 58.31 N ATOM 0 H ARG B 89 57.879 17.121 94.650 1.00 34.43 H new ATOM 0 HA ARG B 89 57.738 19.815 94.752 1.00 34.36 H new ATOM 0 HB2 ARG B 89 59.856 18.599 94.310 1.00 38.42 H new ATOM 0 HB3 ARG B 89 59.278 18.313 92.890 1.00 38.42 H new ATOM 0 HG2 ARG B 89 60.048 20.204 92.161 1.00 45.23 H new ATOM 0 HG3 ARG B 89 59.238 20.988 93.239 1.00 45.23 H new ATOM 0 HD2 ARG B 89 61.681 21.214 93.408 1.00 51.49 H new ATOM 0 HD3 ARG B 89 60.952 20.909 94.752 1.00 51.49 H new ATOM 0 HE ARG B 89 61.754 18.654 93.520 1.00 54.53 H new ATOM 0 HH11 ARG B 89 63.373 17.362 94.429 1.00 58.35 H new ATOM 0 HH12 ARG B 89 64.242 17.904 95.512 1.00 58.35 H new ATOM 0 HH21 ARG B 89 62.871 20.909 95.670 1.00 58.31 H new ATOM 0 HH22 ARG B 89 63.937 20.055 96.264 1.00 58.31 H new ATOM 2440 N ASN B 90 56.192 20.364 92.974 1.00 30.38 N ATOM 2441 CA ASN B 90 55.224 20.668 91.916 1.00 30.65 C ATOM 2442 C ASN B 90 55.943 20.605 90.562 1.00 32.86 C ATOM 2443 O ASN B 90 56.988 21.232 90.376 1.00 34.39 O ATOM 2444 CB ASN B 90 54.636 22.065 92.139 1.00 29.48 C ATOM 2445 CG ASN B 90 53.524 22.404 91.167 1.00 29.93 C ATOM 2446 OD1 ASN B 90 53.652 22.204 89.961 1.00 31.98 O ATOM 2447 ND2 ASN B 90 52.427 22.951 91.691 1.00 31.35 N ATOM 0 H ASN B 90 56.286 20.994 93.552 1.00 30.38 H new ATOM 0 HA ASN B 90 54.500 20.023 91.931 1.00 30.65 H new ATOM 0 HB2 ASN B 90 54.296 22.126 93.045 1.00 29.48 H new ATOM 0 HB3 ASN B 90 55.343 22.724 92.056 1.00 29.48 H new ATOM 0 HD21 ASN B 90 51.774 23.179 91.180 1.00 31.35 H new ATOM 0 HD22 ASN B 90 52.372 23.076 92.540 1.00 31.35 H new ATOM 2448 N GLY B 91 55.374 19.860 89.619 1.00 31.47 N ATOM 2449 CA GLY B 91 56.005 19.696 88.325 1.00 30.79 C ATOM 2450 C GLY B 91 55.602 20.618 87.194 1.00 32.38 C ATOM 2451 O GLY B 91 56.140 20.487 86.099 1.00 32.80 O ATOM 0 H GLY B 91 54.627 19.445 89.712 1.00 31.47 H new ATOM 0 HA2 GLY B 91 56.962 19.788 88.452 1.00 30.79 H new ATOM 0 HA3 GLY B 91 55.843 18.785 88.033 1.00 30.79 H new ATOM 2452 N TYR B 92 54.664 21.531 87.431 1.00 32.12 N ATOM 2453 CA TYR B 92 54.248 22.461 86.385 1.00 34.07 C ATOM 2454 C TYR B 92 55.242 23.620 86.253 1.00 35.98 C ATOM 2455 O TYR B 92 55.807 24.084 87.248 1.00 35.00 O ATOM 2456 CB TYR B 92 52.855 23.035 86.686 1.00 34.48 C ATOM 2457 CG TYR B 92 51.705 22.333 85.980 1.00 34.31 C ATOM 2458 CD1 TYR B 92 50.577 23.045 85.578 1.00 32.89 C ATOM 2459 CD2 TYR B 92 51.744 20.961 85.720 1.00 33.90 C ATOM 2460 CE1 TYR B 92 49.515 22.414 84.934 1.00 32.75 C ATOM 2461 CE2 TYR B 92 50.684 20.320 85.074 1.00 35.37 C ATOM 2462 CZ TYR B 92 49.574 21.055 84.684 1.00 35.36 C ATOM 2463 OH TYR B 92 48.522 20.434 84.038 1.00 39.72 O ATOM 0 H TYR B 92 54.259 21.628 88.183 1.00 32.12 H new ATOM 0 HA TYR B 92 54.221 21.964 85.552 1.00 34.07 H new ATOM 0 HB2 TYR B 92 52.703 22.994 87.643 1.00 34.48 H new ATOM 0 HB3 TYR B 92 52.846 23.973 86.437 1.00 34.48 H new ATOM 0 HD1 TYR B 92 50.532 23.959 85.743 1.00 32.89 H new ATOM 0 HD2 TYR B 92 52.487 20.467 85.981 1.00 33.90 H new ATOM 0 HE1 TYR B 92 48.769 22.905 84.673 1.00 32.75 H new ATOM 0 HE2 TYR B 92 50.722 19.406 84.906 1.00 35.37 H new ATOM 0 HH TYR B 92 48.690 19.615 83.952 1.00 39.72 H new ATOM 2464 N LEU B 93 55.453 24.082 85.023 1.00 36.49 N ATOM 2465 CA LEU B 93 56.362 25.197 84.764 1.00 36.96 C ATOM 2466 C LEU B 93 55.915 26.394 85.605 1.00 39.50 C ATOM 2467 O LEU B 93 56.741 27.100 86.186 1.00 40.66 O ATOM 2468 CB LEU B 93 56.353 25.534 83.269 1.00 34.86 C ATOM 2469 CG LEU B 93 57.372 24.799 82.387 1.00 36.42 C ATOM 2470 CD1 LEU B 93 57.707 23.427 82.941 1.00 38.22 C ATOM 2471 CD2 LEU B 93 56.829 24.706 80.981 1.00 34.46 C ATOM 0 H LEU B 93 55.077 23.761 84.320 1.00 36.49 H new ATOM 0 HA LEU B 93 57.270 24.960 85.009 1.00 36.96 H new ATOM 0 HB2 LEU B 93 55.466 25.350 82.923 1.00 34.86 H new ATOM 0 HB3 LEU B 93 56.503 26.488 83.173 1.00 34.86 H new ATOM 0 HG LEU B 93 58.201 25.302 82.378 1.00 36.42 H new ATOM 0 HD11 LEU B 93 58.351 22.992 82.361 1.00 38.22 H new ATOM 0 HD12 LEU B 93 58.084 23.520 83.830 1.00 38.22 H new ATOM 0 HD13 LEU B 93 56.900 22.890 82.987 1.00 38.22 H new ATOM 0 HD21 LEU B 93 57.468 24.242 80.417 1.00 34.46 H new ATOM 0 HD22 LEU B 93 55.991 24.217 80.989 1.00 34.46 H new ATOM 0 HD23 LEU B 93 56.679 25.599 80.632 1.00 34.46 H new ATOM 2472 N ASP B 94 54.606 26.625 85.655 1.00 39.73 N ATOM 2473 CA ASP B 94 54.041 27.688 86.480 1.00 40.84 C ATOM 2474 C ASP B 94 53.266 26.921 87.554 1.00 41.91 C ATOM 2475 O ASP B 94 52.111 26.535 87.343 1.00 40.05 O ATOM 2476 CB ASP B 94 53.088 28.576 85.671 1.00 42.89 C ATOM 2477 CG ASP B 94 52.395 29.626 86.534 1.00 46.50 C ATOM 2478 OD1 ASP B 94 51.595 30.425 85.996 1.00 46.29 O ATOM 2479 OD2 ASP B 94 52.648 29.651 87.760 1.00 48.11 O ATOM 0 H ASP B 94 54.023 26.172 85.214 1.00 39.73 H new ATOM 0 HA ASP B 94 54.718 28.283 86.838 1.00 40.84 H new ATOM 0 HB2 ASP B 94 53.584 29.018 84.964 1.00 42.89 H new ATOM 0 HB3 ASP B 94 52.418 28.020 85.242 1.00 42.89 H new ATOM 2480 N TYR B 95 53.910 26.689 88.696 1.00 42.48 N ATOM 2481 CA TYR B 95 53.303 25.927 89.783 1.00 43.90 C ATOM 2482 C TYR B 95 51.868 26.288 90.152 1.00 43.91 C ATOM 2483 O TYR B 95 51.137 25.448 90.677 1.00 44.06 O ATOM 2484 CB TYR B 95 54.173 25.998 91.046 1.00 45.13 C ATOM 2485 CG TYR B 95 54.023 27.268 91.858 1.00 46.27 C ATOM 2486 CD1 TYR B 95 54.688 28.445 91.493 1.00 46.15 C ATOM 2487 CD2 TYR B 95 53.234 27.285 93.009 1.00 46.58 C ATOM 2488 CE1 TYR B 95 54.571 29.605 92.264 1.00 46.32 C ATOM 2489 CE2 TYR B 95 53.108 28.435 93.784 1.00 47.21 C ATOM 2490 CZ TYR B 95 53.780 29.590 93.409 1.00 48.69 C ATOM 2491 OH TYR B 95 53.663 30.715 94.193 1.00 48.64 O ATOM 0 H TYR B 95 54.707 26.968 88.861 1.00 42.48 H new ATOM 0 HA TYR B 95 53.257 25.027 89.425 1.00 43.90 H new ATOM 0 HB2 TYR B 95 53.958 25.241 91.613 1.00 45.13 H new ATOM 0 HB3 TYR B 95 55.103 25.904 90.787 1.00 45.13 H new ATOM 0 HD1 TYR B 95 55.215 28.455 90.727 1.00 46.15 H new ATOM 0 HD2 TYR B 95 52.783 26.512 93.264 1.00 46.58 H new ATOM 0 HE1 TYR B 95 55.018 30.381 92.014 1.00 46.32 H new ATOM 0 HE2 TYR B 95 52.577 28.429 94.548 1.00 47.21 H new ATOM 0 HH TYR B 95 53.156 30.553 94.842 1.00 48.64 H new ATOM 2492 N GLN B 96 51.463 27.521 89.874 1.00 44.12 N ATOM 2493 CA GLN B 96 50.116 27.975 90.209 1.00 44.52 C ATOM 2494 C GLN B 96 49.023 27.541 89.240 1.00 43.60 C ATOM 2495 O GLN B 96 47.841 27.664 89.546 1.00 42.74 O ATOM 2496 CB GLN B 96 50.098 29.500 90.342 1.00 47.07 C ATOM 2497 CG GLN B 96 50.943 30.019 91.499 1.00 52.00 C ATOM 2498 CD GLN B 96 50.893 31.532 91.635 1.00 53.66 C ATOM 2499 OE1 GLN B 96 51.184 32.263 90.687 1.00 55.62 O ATOM 2500 NE2 GLN B 96 50.530 32.009 92.820 1.00 55.14 N ATOM 0 H GLN B 96 51.954 28.114 89.490 1.00 44.12 H new ATOM 0 HA GLN B 96 49.907 27.542 91.051 1.00 44.52 H new ATOM 0 HB2 GLN B 96 50.418 29.893 89.515 1.00 47.07 H new ATOM 0 HB3 GLN B 96 49.182 29.796 90.461 1.00 47.07 H new ATOM 0 HG2 GLN B 96 50.636 29.614 92.325 1.00 52.00 H new ATOM 0 HG3 GLN B 96 51.863 29.740 91.372 1.00 52.00 H new ATOM 0 HE21 GLN B 96 50.334 31.468 93.459 1.00 55.14 H new ATOM 0 HE22 GLN B 96 50.491 32.859 92.948 1.00 55.14 H new ATOM 2501 N ARG B 97 49.412 27.026 88.081 1.00 44.15 N ATOM 2502 CA ARG B 97 48.445 26.596 87.078 1.00 44.04 C ATOM 2503 C ARG B 97 47.917 25.182 87.315 1.00 42.19 C ATOM 2504 O ARG B 97 46.953 24.747 86.675 1.00 40.17 O ATOM 2505 CB ARG B 97 49.076 26.687 85.691 1.00 48.01 C ATOM 2506 CG ARG B 97 49.598 28.076 85.349 1.00 53.41 C ATOM 2507 CD ARG B 97 48.475 29.101 85.358 1.00 59.43 C ATOM 2508 NE ARG B 97 47.441 28.780 84.378 1.00 65.18 N ATOM 2509 CZ ARG B 97 47.613 28.835 83.059 1.00 68.03 C ATOM 2510 NH1 ARG B 97 46.613 28.518 82.244 1.00 67.55 N ATOM 2511 NH2 ARG B 97 48.780 29.218 82.555 1.00 69.13 N ATOM 0 H ARG B 97 50.234 26.916 87.854 1.00 44.15 H new ATOM 0 HA ARG B 97 47.682 27.192 87.146 1.00 44.04 H new ATOM 0 HB2 ARG B 97 49.807 26.052 85.634 1.00 48.01 H new ATOM 0 HB3 ARG B 97 48.419 26.424 85.027 1.00 48.01 H new ATOM 0 HG2 ARG B 97 50.281 28.334 85.988 1.00 53.41 H new ATOM 0 HG3 ARG B 97 50.019 28.060 84.475 1.00 53.41 H new ATOM 0 HD2 ARG B 97 48.081 29.141 86.243 1.00 59.43 H new ATOM 0 HD3 ARG B 97 48.838 29.980 85.169 1.00 59.43 H new ATOM 0 HE ARG B 97 46.670 28.539 84.673 1.00 65.18 H new ATOM 0 HH11 ARG B 97 45.854 28.277 82.568 1.00 67.55 H new ATOM 0 HH12 ARG B 97 46.725 28.554 81.392 1.00 67.55 H new ATOM 0 HH21 ARG B 97 49.426 29.431 83.081 1.00 69.13 H new ATOM 0 HH22 ARG B 97 48.890 29.253 81.703 1.00 69.13 H new ATOM 2512 N LEU B 98 48.549 24.472 88.240 1.00 38.62 N ATOM 2513 CA LEU B 98 48.156 23.112 88.562 1.00 36.44 C ATOM 2514 C LEU B 98 46.939 23.098 89.484 1.00 35.26 C ATOM 2515 O LEU B 98 46.943 23.737 90.536 1.00 33.38 O ATOM 2516 CB LEU B 98 49.332 22.387 89.223 1.00 34.71 C ATOM 2517 CG LEU B 98 49.135 20.936 89.657 1.00 36.95 C ATOM 2518 CD1 LEU B 98 48.847 20.048 88.445 1.00 32.75 C ATOM 2519 CD2 LEU B 98 50.386 20.468 90.386 1.00 35.07 C ATOM 0 H LEU B 98 49.216 24.766 88.697 1.00 38.62 H new ATOM 0 HA LEU B 98 47.913 22.654 87.742 1.00 36.44 H new ATOM 0 HB2 LEU B 98 50.080 22.413 88.606 1.00 34.71 H new ATOM 0 HB3 LEU B 98 49.592 22.897 90.006 1.00 34.71 H new ATOM 0 HG LEU B 98 48.373 20.874 90.254 1.00 36.95 H new ATOM 0 HD11 LEU B 98 48.725 19.131 88.737 1.00 32.75 H new ATOM 0 HD12 LEU B 98 48.041 20.356 88.002 1.00 32.75 H new ATOM 0 HD13 LEU B 98 49.593 20.093 87.826 1.00 32.75 H new ATOM 0 HD21 LEU B 98 50.272 19.547 90.666 1.00 35.07 H new ATOM 0 HD22 LEU B 98 51.150 20.532 89.792 1.00 35.07 H new ATOM 0 HD23 LEU B 98 50.535 21.026 91.165 1.00 35.07 H new ATOM 2520 N GLY B 99 45.892 22.379 89.077 1.00 34.82 N ATOM 2521 CA GLY B 99 44.692 22.295 89.894 1.00 34.51 C ATOM 2522 C GLY B 99 45.053 21.944 91.326 1.00 34.67 C ATOM 2523 O GLY B 99 45.702 20.931 91.571 1.00 33.98 O ATOM 0 H GLY B 99 45.860 21.939 88.339 1.00 34.82 H new ATOM 0 HA2 GLY B 99 44.218 23.141 89.871 1.00 34.51 H new ATOM 0 HA3 GLY B 99 44.093 21.624 89.531 1.00 34.51 H new ATOM 2524 N LEU B 100 44.649 22.782 92.274 1.00 37.06 N ATOM 2525 CA LEU B 100 44.968 22.543 93.679 1.00 40.08 C ATOM 2526 C LEU B 100 44.501 21.185 94.196 1.00 41.90 C ATOM 2527 O LEU B 100 45.172 20.576 95.030 1.00 43.11 O ATOM 2528 CB LEU B 100 44.394 23.654 94.559 1.00 40.35 C ATOM 2529 CG LEU B 100 45.396 24.678 95.103 1.00 43.25 C ATOM 2530 CD1 LEU B 100 44.674 25.594 96.089 1.00 42.65 C ATOM 2531 CD2 LEU B 100 46.559 23.973 95.808 1.00 40.56 C ATOM 0 H LEU B 100 44.190 23.494 92.126 1.00 37.06 H new ATOM 0 HA LEU B 100 45.937 22.542 93.730 1.00 40.08 H new ATOM 0 HB2 LEU B 100 43.721 24.129 94.048 1.00 40.35 H new ATOM 0 HB3 LEU B 100 43.941 23.242 95.311 1.00 40.35 H new ATOM 0 HG LEU B 100 45.756 25.196 94.367 1.00 43.25 H new ATOM 0 HD11 LEU B 100 45.299 26.247 96.441 1.00 42.65 H new ATOM 0 HD12 LEU B 100 43.949 26.052 95.635 1.00 42.65 H new ATOM 0 HD13 LEU B 100 44.315 25.065 96.819 1.00 42.65 H new ATOM 0 HD21 LEU B 100 47.182 24.635 96.145 1.00 40.56 H new ATOM 0 HD22 LEU B 100 46.218 23.445 96.547 1.00 40.56 H new ATOM 0 HD23 LEU B 100 47.014 23.392 95.179 1.00 40.56 H new ATOM 2532 N ASP B 101 43.359 20.709 93.708 1.00 42.32 N ATOM 2533 CA ASP B 101 42.851 19.411 94.134 1.00 43.86 C ATOM 2534 C ASP B 101 43.787 18.300 93.648 1.00 42.53 C ATOM 2535 O ASP B 101 44.131 17.398 94.419 1.00 44.10 O ATOM 2536 CB ASP B 101 41.435 19.183 93.598 1.00 47.75 C ATOM 2537 CG ASP B 101 41.354 19.310 92.094 1.00 52.48 C ATOM 2538 OD1 ASP B 101 40.359 18.829 91.507 1.00 56.51 O ATOM 2539 OD2 ASP B 101 42.278 19.898 91.491 1.00 55.99 O ATOM 0 H ASP B 101 42.867 21.119 93.134 1.00 42.32 H new ATOM 0 HA ASP B 101 42.816 19.394 95.103 1.00 43.86 H new ATOM 0 HB2 ASP B 101 41.132 18.300 93.861 1.00 47.75 H new ATOM 0 HB3 ASP B 101 40.832 19.824 94.006 1.00 47.75 H new ATOM 2540 N ARG B 102 44.188 18.357 92.376 1.00 38.66 N ATOM 2541 CA ARG B 102 45.110 17.368 91.817 1.00 36.31 C ATOM 2542 C ARG B 102 46.380 17.388 92.656 1.00 34.54 C ATOM 2543 O ARG B 102 46.884 16.347 93.083 1.00 34.64 O ATOM 2544 CB ARG B 102 45.504 17.723 90.379 1.00 39.34 C ATOM 2545 CG ARG B 102 44.629 17.172 89.282 1.00 40.65 C ATOM 2546 CD ARG B 102 45.014 17.776 87.933 1.00 40.53 C ATOM 2547 NE ARG B 102 46.291 17.291 87.412 1.00 40.05 N ATOM 2548 CZ ARG B 102 46.925 17.843 86.380 1.00 40.00 C ATOM 2549 NH1 ARG B 102 46.400 18.897 85.770 1.00 39.84 N ATOM 2550 NH2 ARG B 102 48.074 17.343 85.946 1.00 36.51 N ATOM 0 H ARG B 102 43.936 18.963 91.820 1.00 38.66 H new ATOM 0 HA ARG B 102 44.676 16.501 91.822 1.00 36.31 H new ATOM 0 HB2 ARG B 102 45.518 18.690 90.299 1.00 39.34 H new ATOM 0 HB3 ARG B 102 46.411 17.413 90.228 1.00 39.34 H new ATOM 0 HG2 ARG B 102 44.716 16.207 89.246 1.00 40.65 H new ATOM 0 HG3 ARG B 102 43.699 17.366 89.475 1.00 40.65 H new ATOM 0 HD2 ARG B 102 44.316 17.579 87.289 1.00 40.53 H new ATOM 0 HD3 ARG B 102 45.056 18.741 88.020 1.00 40.53 H new ATOM 0 HE ARG B 102 46.653 16.611 87.794 1.00 40.05 H new ATOM 0 HH11 ARG B 102 45.652 19.222 86.041 1.00 39.84 H new ATOM 0 HH12 ARG B 102 46.808 19.255 85.103 1.00 39.84 H new ATOM 0 HH21 ARG B 102 48.417 16.655 86.332 1.00 36.51 H new ATOM 0 HH22 ARG B 102 48.476 17.706 85.278 1.00 36.51 H new ATOM 2551 N TRP B 103 46.888 18.597 92.876 1.00 31.94 N ATOM 2552 CA TRP B 103 48.110 18.819 93.637 1.00 30.65 C ATOM 2553 C TRP B 103 48.081 18.133 95.004 1.00 29.46 C ATOM 2554 O TRP B 103 48.971 17.350 95.328 1.00 30.12 O ATOM 2555 CB TRP B 103 48.345 20.333 93.776 1.00 29.61 C ATOM 2556 CG TRP B 103 49.429 20.739 94.724 1.00 31.44 C ATOM 2557 CD1 TRP B 103 49.310 21.611 95.770 1.00 30.33 C ATOM 2558 CD2 TRP B 103 50.806 20.330 94.699 1.00 31.97 C ATOM 2559 NE1 TRP B 103 50.524 21.775 96.393 1.00 30.93 N ATOM 2560 CE2 TRP B 103 51.460 21.000 95.759 1.00 32.21 C ATOM 2561 CE3 TRP B 103 51.549 19.463 93.887 1.00 30.90 C ATOM 2562 CZ2 TRP B 103 52.827 20.829 96.030 1.00 32.39 C ATOM 2563 CZ3 TRP B 103 52.906 19.291 94.155 1.00 31.70 C ATOM 2564 CH2 TRP B 103 53.530 19.975 95.222 1.00 32.97 C ATOM 0 H TRP B 103 46.527 19.320 92.583 1.00 31.94 H new ATOM 0 HA TRP B 103 48.849 18.417 93.153 1.00 30.65 H new ATOM 0 HB2 TRP B 103 48.553 20.693 92.900 1.00 29.61 H new ATOM 0 HB3 TRP B 103 47.516 20.747 94.063 1.00 29.61 H new ATOM 0 HD1 TRP B 103 48.521 22.033 96.024 1.00 30.33 H new ATOM 0 HE1 TRP B 103 50.672 22.282 97.071 1.00 30.93 H new ATOM 0 HE3 TRP B 103 51.144 19.011 93.182 1.00 30.90 H new ATOM 0 HZ2 TRP B 103 53.240 21.279 96.732 1.00 32.39 H new ATOM 0 HZ3 TRP B 103 53.408 18.717 93.623 1.00 31.70 H new ATOM 0 HH2 TRP B 103 54.437 19.843 95.379 1.00 32.97 H new ATOM 2565 N LEU B 104 47.054 18.400 95.800 1.00 30.14 N ATOM 2566 CA LEU B 104 46.976 17.783 97.118 1.00 31.61 C ATOM 2567 C LEU B 104 46.826 16.261 97.060 1.00 31.23 C ATOM 2568 O LEU B 104 47.333 15.552 97.928 1.00 32.19 O ATOM 2569 CB LEU B 104 45.829 18.399 97.931 1.00 33.56 C ATOM 2570 CG LEU B 104 45.974 19.888 98.265 1.00 36.18 C ATOM 2571 CD1 LEU B 104 44.961 20.281 99.341 1.00 35.94 C ATOM 2572 CD2 LEU B 104 47.383 20.167 98.761 1.00 35.14 C ATOM 0 H LEU B 104 46.403 18.925 95.602 1.00 30.14 H new ATOM 0 HA LEU B 104 47.821 17.964 97.558 1.00 31.61 H new ATOM 0 HB2 LEU B 104 45.003 18.274 97.439 1.00 33.56 H new ATOM 0 HB3 LEU B 104 45.742 17.905 98.761 1.00 33.56 H new ATOM 0 HG LEU B 104 45.806 20.411 97.465 1.00 36.18 H new ATOM 0 HD11 LEU B 104 45.058 21.224 99.548 1.00 35.94 H new ATOM 0 HD12 LEU B 104 44.062 20.112 99.017 1.00 35.94 H new ATOM 0 HD13 LEU B 104 45.119 19.757 100.142 1.00 35.94 H new ATOM 0 HD21 LEU B 104 47.471 21.110 98.971 1.00 35.14 H new ATOM 0 HD22 LEU B 104 47.556 19.641 99.557 1.00 35.14 H new ATOM 0 HD23 LEU B 104 48.022 19.929 98.071 1.00 35.14 H new ATOM 2573 N ALA B 105 46.141 15.755 96.040 1.00 28.59 N ATOM 2574 CA ALA B 105 45.960 14.316 95.919 1.00 28.56 C ATOM 2575 C ALA B 105 47.271 13.607 95.559 1.00 29.36 C ATOM 2576 O ALA B 105 47.589 12.566 96.138 1.00 27.05 O ATOM 2577 CB ALA B 105 44.886 14.001 94.871 1.00 25.43 C ATOM 0 H ALA B 105 45.778 16.222 95.416 1.00 28.59 H new ATOM 0 HA ALA B 105 45.671 13.984 96.783 1.00 28.56 H new ATOM 0 HB1 ALA B 105 44.775 13.040 94.800 1.00 25.43 H new ATOM 0 HB2 ALA B 105 44.045 14.404 95.138 1.00 25.43 H new ATOM 0 HB3 ALA B 105 45.158 14.359 94.011 1.00 25.43 H new ATOM 2578 N LEU B 106 48.036 14.171 94.621 1.00 29.45 N ATOM 2579 CA LEU B 106 49.295 13.536 94.219 1.00 29.51 C ATOM 2580 C LEU B 106 50.339 13.629 95.334 1.00 29.56 C ATOM 2581 O LEU B 106 51.160 12.724 95.498 1.00 30.33 O ATOM 2582 CB LEU B 106 49.821 14.144 92.906 1.00 29.31 C ATOM 2583 CG LEU B 106 50.390 15.566 92.862 1.00 30.72 C ATOM 2584 CD1 LEU B 106 51.853 15.540 93.315 1.00 27.04 C ATOM 2585 CD2 LEU B 106 50.294 16.111 91.432 1.00 30.22 C ATOM 0 H LEU B 106 47.850 14.905 94.213 1.00 29.45 H new ATOM 0 HA LEU B 106 49.120 12.595 94.060 1.00 29.51 H new ATOM 0 HB2 LEU B 106 50.515 13.551 92.577 1.00 29.31 H new ATOM 0 HB3 LEU B 106 49.092 14.110 92.266 1.00 29.31 H new ATOM 0 HG LEU B 106 49.882 16.141 93.455 1.00 30.72 H new ATOM 0 HD11 LEU B 106 52.216 16.439 93.288 1.00 27.04 H new ATOM 0 HD12 LEU B 106 51.905 15.197 94.221 1.00 27.04 H new ATOM 0 HD13 LEU B 106 52.365 14.967 92.723 1.00 27.04 H new ATOM 0 HD21 LEU B 106 50.654 17.011 91.404 1.00 30.22 H new ATOM 0 HD22 LEU B 106 50.802 15.541 90.834 1.00 30.22 H new ATOM 0 HD23 LEU B 106 49.365 16.126 91.153 1.00 30.22 H new ATOM 2586 N VAL B 107 50.295 14.712 96.108 1.00 29.97 N ATOM 2587 CA VAL B 107 51.214 14.880 97.239 1.00 29.71 C ATOM 2588 C VAL B 107 50.872 13.814 98.284 1.00 29.41 C ATOM 2589 O VAL B 107 51.757 13.148 98.830 1.00 28.95 O ATOM 2590 CB VAL B 107 51.076 16.286 97.892 1.00 30.82 C ATOM 2591 CG1 VAL B 107 51.735 16.293 99.269 1.00 30.33 C ATOM 2592 CG2 VAL B 107 51.733 17.343 96.998 1.00 31.33 C ATOM 0 H VAL B 107 49.742 15.361 95.997 1.00 29.97 H new ATOM 0 HA VAL B 107 52.125 14.790 96.918 1.00 29.71 H new ATOM 0 HB VAL B 107 50.134 16.494 97.992 1.00 30.82 H new ATOM 0 HG11 VAL B 107 51.644 17.173 99.667 1.00 30.33 H new ATOM 0 HG12 VAL B 107 51.305 15.635 99.837 1.00 30.33 H new ATOM 0 HG13 VAL B 107 52.676 16.076 99.179 1.00 30.33 H new ATOM 0 HG21 VAL B 107 51.644 18.217 97.410 1.00 31.33 H new ATOM 0 HG22 VAL B 107 52.673 17.133 96.886 1.00 31.33 H new ATOM 0 HG23 VAL B 107 51.298 17.349 96.131 1.00 31.33 H new ATOM 2593 N ALA B 108 49.582 13.656 98.566 1.00 27.71 N ATOM 2594 CA ALA B 108 49.155 12.642 99.532 1.00 28.52 C ATOM 2595 C ALA B 108 49.657 11.262 99.091 1.00 27.96 C ATOM 2596 O ALA B 108 50.177 10.500 99.896 1.00 28.42 O ATOM 2597 CB ALA B 108 47.647 12.625 99.641 1.00 26.73 C ATOM 0 H ALA B 108 48.945 14.117 98.216 1.00 27.71 H new ATOM 0 HA ALA B 108 49.530 12.859 100.400 1.00 28.52 H new ATOM 0 HB1 ALA B 108 47.376 11.950 100.283 1.00 26.73 H new ATOM 0 HB2 ALA B 108 47.334 13.495 99.935 1.00 26.73 H new ATOM 0 HB3 ALA B 108 47.262 12.419 98.775 1.00 26.73 H new ATOM 2598 N ALA B 109 49.511 10.959 97.804 1.00 27.97 N ATOM 2599 CA ALA B 109 49.937 9.674 97.275 1.00 28.46 C ATOM 2600 C ALA B 109 51.406 9.399 97.552 1.00 29.13 C ATOM 2601 O ALA B 109 51.752 8.352 98.098 1.00 29.17 O ATOM 2602 CB ALA B 109 49.663 9.607 95.780 1.00 29.52 C ATOM 0 H ALA B 109 49.166 11.488 97.221 1.00 27.97 H new ATOM 0 HA ALA B 109 49.424 8.988 97.729 1.00 28.46 H new ATOM 0 HB1 ALA B 109 49.950 8.747 95.436 1.00 29.52 H new ATOM 0 HB2 ALA B 109 48.713 9.718 95.620 1.00 29.52 H new ATOM 0 HB3 ALA B 109 50.151 10.314 95.329 1.00 29.52 H new ATOM 2603 N HIS B 110 52.275 10.333 97.181 1.00 30.35 N ATOM 2604 CA HIS B 110 53.694 10.128 97.422 1.00 30.36 C ATOM 2605 C HIS B 110 53.983 10.113 98.923 1.00 30.39 C ATOM 2606 O HIS B 110 54.806 9.326 99.406 1.00 29.50 O ATOM 2607 CB HIS B 110 54.538 11.200 96.732 1.00 30.29 C ATOM 2608 CG HIS B 110 56.007 10.927 96.809 1.00 33.88 C ATOM 2609 ND1 HIS B 110 56.778 11.314 97.883 1.00 33.98 N ATOM 2610 CD2 HIS B 110 56.827 10.229 95.988 1.00 33.43 C ATOM 2611 CE1 HIS B 110 58.011 10.866 97.721 1.00 35.58 C ATOM 2612 NE2 HIS B 110 58.067 10.204 96.580 1.00 34.38 N ATOM 0 H HIS B 110 52.069 11.075 96.798 1.00 30.35 H new ATOM 0 HA HIS B 110 53.937 9.268 97.045 1.00 30.36 H new ATOM 0 HB2 HIS B 110 54.274 11.262 95.801 1.00 30.29 H new ATOM 0 HB3 HIS B 110 54.353 12.061 97.138 1.00 30.29 H new ATOM 0 HD2 HIS B 110 56.595 9.840 95.176 1.00 33.43 H new ATOM 0 HE1 HIS B 110 58.719 10.995 98.310 1.00 35.58 H new ATOM 0 HE2 HIS B 110 58.766 9.819 96.259 1.00 34.38 H new ATOM 2613 N HIS B 111 53.305 10.978 99.662 1.00 30.11 N ATOM 2614 CA HIS B 111 53.489 11.001 101.107 1.00 31.58 C ATOM 2615 C HIS B 111 53.232 9.602 101.690 1.00 31.72 C ATOM 2616 O HIS B 111 53.950 9.152 102.572 1.00 32.92 O ATOM 2617 CB HIS B 111 52.525 11.997 101.757 1.00 32.73 C ATOM 2618 CG HIS B 111 52.529 11.946 103.253 1.00 35.69 C ATOM 2619 ND1 HIS B 111 53.547 12.481 104.014 1.00 37.52 N ATOM 2620 CD2 HIS B 111 51.667 11.375 104.128 1.00 36.59 C ATOM 2621 CE1 HIS B 111 53.313 12.240 105.291 1.00 37.10 C ATOM 2622 NE2 HIS B 111 52.179 11.570 105.387 1.00 38.62 N ATOM 0 H HIS B 111 52.743 11.552 99.355 1.00 30.11 H new ATOM 0 HA HIS B 111 54.401 11.273 101.293 1.00 31.58 H new ATOM 0 HB2 HIS B 111 52.757 12.894 101.471 1.00 32.73 H new ATOM 0 HB3 HIS B 111 51.626 11.821 101.437 1.00 32.73 H new ATOM 0 HD2 HIS B 111 50.876 10.934 103.916 1.00 36.59 H new ATOM 0 HE1 HIS B 111 53.854 12.498 106.002 1.00 37.10 H new ATOM 0 HE2 HIS B 111 51.819 11.299 106.120 1.00 38.62 H new ATOM 2623 N LEU B 112 52.211 8.913 101.193 1.00 32.09 N ATOM 2624 CA LEU B 112 51.882 7.586 101.705 1.00 32.71 C ATOM 2625 C LEU B 112 52.765 6.457 101.178 1.00 34.06 C ATOM 2626 O LEU B 112 53.078 5.522 101.907 1.00 34.74 O ATOM 2627 CB LEU B 112 50.417 7.255 101.403 1.00 32.85 C ATOM 2628 CG LEU B 112 49.358 8.121 102.101 1.00 36.46 C ATOM 2629 CD1 LEU B 112 47.969 7.828 101.527 1.00 33.60 C ATOM 2630 CD2 LEU B 112 49.388 7.841 103.600 1.00 35.07 C ATOM 0 H LEU B 112 51.698 9.193 100.562 1.00 32.09 H new ATOM 0 HA LEU B 112 52.045 7.636 102.660 1.00 32.71 H new ATOM 0 HB2 LEU B 112 50.282 7.324 100.445 1.00 32.85 H new ATOM 0 HB3 LEU B 112 50.259 6.329 101.645 1.00 32.85 H new ATOM 0 HG LEU B 112 49.556 9.058 101.948 1.00 36.46 H new ATOM 0 HD11 LEU B 112 47.310 8.381 101.976 1.00 33.60 H new ATOM 0 HD12 LEU B 112 47.963 8.025 100.577 1.00 33.60 H new ATOM 0 HD13 LEU B 112 47.753 6.892 101.664 1.00 33.60 H new ATOM 0 HD21 LEU B 112 48.720 8.386 104.045 1.00 35.07 H new ATOM 0 HD22 LEU B 112 49.197 6.903 103.758 1.00 35.07 H new ATOM 0 HD23 LEU B 112 50.266 8.055 103.952 1.00 35.07 H new ATOM 2631 N ALA B 113 53.164 6.540 99.915 1.00 33.28 N ATOM 2632 CA ALA B 113 53.980 5.493 99.311 1.00 34.69 C ATOM 2633 C ALA B 113 55.480 5.642 99.542 1.00 35.94 C ATOM 2634 O ALA B 113 56.177 4.651 99.757 1.00 34.73 O ATOM 2635 CB ALA B 113 53.702 5.425 97.798 1.00 31.30 C ATOM 0 H ALA B 113 52.974 7.194 99.390 1.00 33.28 H new ATOM 0 HA ALA B 113 53.720 4.671 99.755 1.00 34.69 H new ATOM 0 HB1 ALA B 113 54.246 4.728 97.400 1.00 31.30 H new ATOM 0 HB2 ALA B 113 52.764 5.227 97.650 1.00 31.30 H new ATOM 0 HB3 ALA B 113 53.920 6.278 97.390 1.00 31.30 H new ATOM 2636 N LYS B 114 55.975 6.876 99.491 1.00 37.24 N ATOM 2637 CA LYS B 114 57.406 7.122 99.644 1.00 39.93 C ATOM 2638 C LYS B 114 58.121 6.395 98.509 1.00 40.96 C ATOM 2639 O LYS B 114 59.298 6.062 98.610 1.00 43.05 O ATOM 2640 CB LYS B 114 57.914 6.618 101.002 1.00 40.19 C ATOM 2641 CG LYS B 114 57.449 7.465 102.180 1.00 41.50 C ATOM 2642 CD LYS B 114 57.816 8.931 101.961 1.00 43.60 C ATOM 2643 CE LYS B 114 57.273 9.817 103.070 1.00 46.06 C ATOM 2644 NZ LYS B 114 57.410 11.258 102.717 1.00 47.54 N ATOM 0 H LYS B 114 55.500 7.583 99.369 1.00 37.24 H new ATOM 0 HA LYS B 114 57.583 8.075 99.609 1.00 39.93 H new ATOM 0 HB2 LYS B 114 57.615 5.705 101.132 1.00 40.19 H new ATOM 0 HB3 LYS B 114 58.884 6.600 100.989 1.00 40.19 H new ATOM 0 HG2 LYS B 114 56.489 7.379 102.289 1.00 41.50 H new ATOM 0 HG3 LYS B 114 57.857 7.142 102.999 1.00 41.50 H new ATOM 0 HD2 LYS B 114 58.781 9.021 101.918 1.00 43.60 H new ATOM 0 HD3 LYS B 114 57.465 9.229 101.107 1.00 43.60 H new ATOM 0 HE2 LYS B 114 56.339 9.607 103.229 1.00 46.06 H new ATOM 0 HE3 LYS B 114 57.749 9.636 103.896 1.00 46.06 H new ATOM 0 HZ1 LYS B 114 57.087 11.758 103.379 1.00 47.54 H new ATOM 0 HZ2 LYS B 114 58.269 11.453 102.591 1.00 47.54 H new ATOM 0 HZ3 LYS B 114 56.956 11.425 101.970 1.00 47.54 H new ATOM 2645 N LYS B 115 57.370 6.155 97.436 1.00 40.58 N ATOM 2646 CA LYS B 115 57.841 5.486 96.225 1.00 39.87 C ATOM 2647 C LYS B 115 57.274 6.266 95.044 1.00 37.71 C ATOM 2648 O LYS B 115 56.481 7.188 95.220 1.00 36.94 O ATOM 2649 CB LYS B 115 57.280 4.065 96.128 1.00 41.83 C ATOM 2650 CG LYS B 115 57.892 3.033 97.026 1.00 46.93 C ATOM 2651 CD LYS B 115 57.200 1.692 96.808 1.00 49.17 C ATOM 2652 CE LYS B 115 57.278 1.253 95.344 1.00 52.07 C ATOM 2653 NZ LYS B 115 56.562 -0.034 95.093 1.00 51.48 N ATOM 0 H LYS B 115 56.543 6.386 97.392 1.00 40.58 H new ATOM 0 HA LYS B 115 58.810 5.448 96.234 1.00 39.87 H new ATOM 0 HB2 LYS B 115 56.329 4.102 96.315 1.00 41.83 H new ATOM 0 HB3 LYS B 115 57.377 3.764 95.211 1.00 41.83 H new ATOM 0 HG2 LYS B 115 58.841 2.952 96.841 1.00 46.93 H new ATOM 0 HG3 LYS B 115 57.806 3.305 97.953 1.00 46.93 H new ATOM 0 HD2 LYS B 115 57.612 1.018 97.371 1.00 49.17 H new ATOM 0 HD3 LYS B 115 56.271 1.758 97.078 1.00 49.17 H new ATOM 0 HE2 LYS B 115 56.898 1.946 94.781 1.00 52.07 H new ATOM 0 HE3 LYS B 115 58.209 1.157 95.087 1.00 52.07 H new ATOM 0 HZ1 LYS B 115 56.520 -0.185 94.217 1.00 51.48 H new ATOM 0 HZ2 LYS B 115 57.001 -0.700 95.487 1.00 51.48 H new ATOM 0 HZ3 LYS B 115 55.738 0.015 95.425 1.00 51.48 H new ATOM 2654 N ALA B 116 57.668 5.882 93.840 1.00 35.50 N ATOM 2655 CA ALA B 116 57.144 6.534 92.651 1.00 35.74 C ATOM 2656 C ALA B 116 55.680 6.100 92.526 1.00 35.39 C ATOM 2657 O ALA B 116 55.338 4.946 92.828 1.00 34.15 O ATOM 2658 CB ALA B 116 57.928 6.087 91.416 1.00 33.88 C ATOM 0 H ALA B 116 58.233 5.251 93.689 1.00 35.50 H new ATOM 0 HA ALA B 116 57.222 7.499 92.718 1.00 35.74 H new ATOM 0 HB1 ALA B 116 57.571 6.527 90.629 1.00 33.88 H new ATOM 0 HB2 ALA B 116 58.863 6.324 91.522 1.00 33.88 H new ATOM 0 HB3 ALA B 116 57.848 5.126 91.312 1.00 33.88 H new ATOM 2659 N CYS B 117 54.806 7.018 92.124 1.00 33.26 N ATOM 2660 CA CYS B 117 53.417 6.634 91.945 1.00 33.46 C ATOM 2661 C CYS B 117 52.675 7.243 90.782 1.00 32.17 C ATOM 2662 O CYS B 117 53.016 8.314 90.258 1.00 30.24 O ATOM 2663 CB CYS B 117 52.570 6.861 93.208 1.00 39.65 C ATOM 2664 SG CYS B 117 53.261 7.765 94.589 1.00 41.14 S ATOM 0 H CYS B 117 54.991 7.841 91.955 1.00 33.26 H new ATOM 0 HA CYS B 117 53.517 5.690 91.744 1.00 33.46 H new ATOM 0 HB2 CYS B 117 51.761 7.322 92.935 1.00 39.65 H new ATOM 0 HB3 CYS B 117 52.302 5.989 93.538 1.00 39.65 H new ATOM 0 HG CYS B 117 54.418 7.475 94.719 1.00 41.14 H new ATOM 2665 N LEU B 118 51.646 6.509 90.382 1.00 31.08 N ATOM 2666 CA LEU B 118 50.753 6.905 89.317 1.00 30.30 C ATOM 2667 C LEU B 118 49.461 7.226 90.059 1.00 29.31 C ATOM 2668 O LEU B 118 48.966 6.397 90.829 1.00 27.78 O ATOM 2669 CB LEU B 118 50.550 5.744 88.350 1.00 30.42 C ATOM 2670 CG LEU B 118 49.502 5.964 87.257 1.00 31.91 C ATOM 2671 CD1 LEU B 118 49.861 7.181 86.406 1.00 29.22 C ATOM 2672 CD2 LEU B 118 49.423 4.706 86.404 1.00 29.46 C ATOM 0 H LEU B 118 51.447 5.750 90.733 1.00 31.08 H new ATOM 0 HA LEU B 118 51.080 7.648 88.786 1.00 30.30 H new ATOM 0 HB2 LEU B 118 51.399 5.547 87.925 1.00 30.42 H new ATOM 0 HB3 LEU B 118 50.299 4.959 88.862 1.00 30.42 H new ATOM 0 HG LEU B 118 48.636 6.137 87.659 1.00 31.91 H new ATOM 0 HD11 LEU B 118 49.188 7.306 85.719 1.00 29.22 H new ATOM 0 HD12 LEU B 118 49.898 7.970 86.969 1.00 29.22 H new ATOM 0 HD13 LEU B 118 50.725 7.041 85.989 1.00 29.22 H new ATOM 0 HD21 LEU B 118 48.762 4.830 85.705 1.00 29.46 H new ATOM 0 HD22 LEU B 118 50.289 4.532 86.002 1.00 29.46 H new ATOM 0 HD23 LEU B 118 49.168 3.953 86.960 1.00 29.46 H new ATOM 2673 N VAL B 119 48.932 8.427 89.837 1.00 29.35 N ATOM 2674 CA VAL B 119 47.720 8.885 90.510 1.00 28.20 C ATOM 2675 C VAL B 119 46.652 9.322 89.515 1.00 29.44 C ATOM 2676 O VAL B 119 46.809 10.334 88.832 1.00 30.03 O ATOM 2677 CB VAL B 119 48.053 10.072 91.437 1.00 29.20 C ATOM 2678 CG1 VAL B 119 46.837 10.469 92.250 1.00 29.33 C ATOM 2679 CG2 VAL B 119 49.219 9.698 92.337 1.00 28.07 C ATOM 0 H VAL B 119 49.267 9.000 89.290 1.00 29.35 H new ATOM 0 HA VAL B 119 47.374 8.140 91.025 1.00 28.20 H new ATOM 0 HB VAL B 119 48.308 10.839 90.900 1.00 29.20 H new ATOM 0 HG11 VAL B 119 47.063 11.215 92.827 1.00 29.33 H new ATOM 0 HG12 VAL B 119 46.119 10.729 91.652 1.00 29.33 H new ATOM 0 HG13 VAL B 119 46.550 9.717 92.792 1.00 29.33 H new ATOM 0 HG21 VAL B 119 49.430 10.444 92.921 1.00 28.07 H new ATOM 0 HG22 VAL B 119 48.980 8.926 92.873 1.00 28.07 H new ATOM 0 HG23 VAL B 119 49.993 9.485 91.793 1.00 28.07 H new ATOM 2680 N ILE B 120 45.560 8.564 89.450 1.00 28.65 N ATOM 2681 CA ILE B 120 44.471 8.855 88.529 1.00 26.69 C ATOM 2682 C ILE B 120 43.156 9.134 89.256 1.00 28.38 C ATOM 2683 O ILE B 120 42.728 8.355 90.108 1.00 26.84 O ATOM 2684 CB ILE B 120 44.246 7.677 87.565 1.00 29.22 C ATOM 2685 CG1 ILE B 120 45.570 7.289 86.910 1.00 29.98 C ATOM 2686 CG2 ILE B 120 43.223 8.061 86.489 1.00 26.50 C ATOM 2687 CD1 ILE B 120 45.514 5.973 86.170 1.00 32.87 C ATOM 0 H ILE B 120 45.432 7.868 89.939 1.00 28.65 H new ATOM 0 HA ILE B 120 44.734 9.650 88.040 1.00 26.69 H new ATOM 0 HB ILE B 120 43.902 6.920 88.065 1.00 29.22 H new ATOM 0 HG12 ILE B 120 45.834 7.988 86.292 1.00 29.98 H new ATOM 0 HG13 ILE B 120 46.258 7.239 87.592 1.00 29.98 H new ATOM 0 HG21 ILE B 120 43.089 7.312 85.888 1.00 26.50 H new ATOM 0 HG22 ILE B 120 42.380 8.291 86.911 1.00 26.50 H new ATOM 0 HG23 ILE B 120 43.552 8.823 85.987 1.00 26.50 H new ATOM 0 HD11 ILE B 120 46.381 5.784 85.779 1.00 32.87 H new ATOM 0 HD12 ILE B 120 45.277 5.264 86.788 1.00 32.87 H new ATOM 0 HD13 ILE B 120 44.847 6.025 85.467 1.00 32.87 H new ATOM 2688 N ASP B 121 42.524 10.250 88.904 1.00 29.02 N ATOM 2689 CA ASP B 121 41.248 10.666 89.491 1.00 30.68 C ATOM 2690 C ASP B 121 40.172 10.503 88.423 1.00 31.25 C ATOM 2691 O ASP B 121 40.143 11.248 87.437 1.00 32.19 O ATOM 2692 CB ASP B 121 41.347 12.130 89.948 1.00 33.83 C ATOM 2693 CG ASP B 121 40.014 12.703 90.439 1.00 40.59 C ATOM 2694 OD1 ASP B 121 39.071 11.931 90.735 1.00 42.08 O ATOM 2695 OD2 ASP B 121 39.917 13.949 90.539 1.00 42.00 O ATOM 0 H ASP B 121 42.826 10.795 88.311 1.00 29.02 H new ATOM 0 HA ASP B 121 41.027 10.125 90.265 1.00 30.68 H new ATOM 0 HB2 ASP B 121 42.002 12.196 90.660 1.00 33.83 H new ATOM 0 HB3 ASP B 121 41.673 12.671 89.212 1.00 33.83 H new ATOM 2696 N LEU B 122 39.305 9.512 88.614 1.00 30.94 N ATOM 2697 CA LEU B 122 38.224 9.215 87.674 1.00 31.44 C ATOM 2698 C LEU B 122 36.931 9.926 88.076 1.00 31.94 C ATOM 2699 O LEU B 122 36.049 9.318 88.678 1.00 32.98 O ATOM 2700 CB LEU B 122 37.960 7.702 87.626 1.00 32.61 C ATOM 2701 CG LEU B 122 39.035 6.708 87.148 1.00 34.35 C ATOM 2702 CD1 LEU B 122 39.482 7.075 85.760 1.00 31.87 C ATOM 2703 CD2 LEU B 122 40.225 6.696 88.100 1.00 35.63 C ATOM 0 H LEU B 122 39.327 8.989 89.296 1.00 30.94 H new ATOM 0 HA LEU B 122 38.502 9.532 86.800 1.00 31.44 H new ATOM 0 HB2 LEU B 122 37.707 7.432 88.523 1.00 32.61 H new ATOM 0 HB3 LEU B 122 37.183 7.570 87.060 1.00 32.61 H new ATOM 0 HG LEU B 122 38.651 5.817 87.136 1.00 34.35 H new ATOM 0 HD11 LEU B 122 40.159 6.448 85.461 1.00 31.87 H new ATOM 0 HD12 LEU B 122 38.723 7.043 85.156 1.00 31.87 H new ATOM 0 HD13 LEU B 122 39.853 7.971 85.766 1.00 31.87 H new ATOM 0 HD21 LEU B 122 40.889 6.065 87.781 1.00 35.63 H new ATOM 0 HD22 LEU B 122 40.616 7.583 88.141 1.00 35.63 H new ATOM 0 HD23 LEU B 122 39.929 6.433 88.985 1.00 35.63 H new ATOM 2704 N GLY B 123 36.821 11.207 87.746 1.00 32.78 N ATOM 2705 CA GLY B 123 35.628 11.961 88.091 1.00 32.73 C ATOM 2706 C GLY B 123 34.890 12.445 86.860 1.00 33.03 C ATOM 2707 O GLY B 123 34.912 11.782 85.823 1.00 34.18 O ATOM 0 H GLY B 123 37.423 11.654 87.325 1.00 32.78 H new ATOM 0 HA2 GLY B 123 35.038 11.406 88.624 1.00 32.73 H new ATOM 0 HA3 GLY B 123 35.874 12.722 88.640 1.00 32.73 H new ATOM 2708 N THR B 124 34.224 13.590 86.978 1.00 32.78 N ATOM 2709 CA THR B 124 33.494 14.177 85.860 1.00 32.90 C ATOM 2710 C THR B 124 34.534 14.374 84.763 1.00 31.67 C ATOM 2711 O THR B 124 34.288 14.128 83.582 1.00 30.17 O ATOM 2712 CB THR B 124 32.855 15.522 86.277 1.00 35.01 C ATOM 2713 OG1 THR B 124 31.801 15.265 87.216 1.00 37.82 O ATOM 2714 CG2 THR B 124 32.282 16.253 85.081 1.00 33.61 C ATOM 0 H THR B 124 34.183 14.047 87.706 1.00 32.78 H new ATOM 0 HA THR B 124 32.765 13.612 85.560 1.00 32.90 H new ATOM 0 HB THR B 124 33.543 16.078 86.675 1.00 35.01 H new ATOM 0 HG1 THR B 124 31.449 15.992 87.449 1.00 37.82 H new ATOM 0 HG21 THR B 124 31.889 17.091 85.371 1.00 33.61 H new ATOM 0 HG22 THR B 124 32.989 16.433 84.442 1.00 33.61 H new ATOM 0 HG23 THR B 124 31.600 15.704 84.662 1.00 33.61 H new ATOM 2715 N ALA B 125 35.710 14.813 85.184 1.00 30.60 N ATOM 2716 CA ALA B 125 36.838 14.980 84.287 1.00 30.30 C ATOM 2717 C ALA B 125 37.839 13.963 84.829 1.00 29.23 C ATOM 2718 O ALA B 125 37.768 13.583 86.001 1.00 29.22 O ATOM 2719 CB ALA B 125 37.398 16.388 84.388 1.00 31.23 C ATOM 0 H ALA B 125 35.876 15.023 86.001 1.00 30.60 H new ATOM 0 HA ALA B 125 36.616 14.849 83.352 1.00 30.30 H new ATOM 0 HB1 ALA B 125 38.150 16.482 83.783 1.00 31.23 H new ATOM 0 HB2 ALA B 125 36.710 17.028 84.149 1.00 31.23 H new ATOM 0 HB3 ALA B 125 37.693 16.555 85.297 1.00 31.23 H new ATOM 2720 N VAL B 126 38.750 13.501 83.988 1.00 28.76 N ATOM 2721 CA VAL B 126 39.743 12.535 84.437 1.00 28.20 C ATOM 2722 C VAL B 126 41.132 13.180 84.450 1.00 30.31 C ATOM 2723 O VAL B 126 41.504 13.874 83.496 1.00 29.65 O ATOM 2724 CB VAL B 126 39.759 11.295 83.505 1.00 29.07 C ATOM 2725 CG1 VAL B 126 40.930 10.361 83.862 1.00 26.91 C ATOM 2726 CG2 VAL B 126 38.438 10.534 83.630 1.00 27.70 C ATOM 0 H VAL B 126 38.813 13.730 83.161 1.00 28.76 H new ATOM 0 HA VAL B 126 39.508 12.251 85.334 1.00 28.20 H new ATOM 0 HB VAL B 126 39.872 11.600 82.591 1.00 29.07 H new ATOM 0 HG11 VAL B 126 40.924 9.593 83.270 1.00 26.91 H new ATOM 0 HG12 VAL B 126 41.768 10.839 83.762 1.00 26.91 H new ATOM 0 HG13 VAL B 126 40.837 10.062 84.780 1.00 26.91 H new ATOM 0 HG21 VAL B 126 38.454 9.760 83.045 1.00 27.70 H new ATOM 0 HG22 VAL B 126 38.317 10.243 84.548 1.00 27.70 H new ATOM 0 HG23 VAL B 126 37.704 11.115 83.376 1.00 27.70 H new ATOM 2727 N THR B 127 41.883 12.997 85.536 1.00 28.77 N ATOM 2728 CA THR B 127 43.247 13.531 85.580 1.00 31.05 C ATOM 2729 C THR B 127 44.211 12.423 85.995 1.00 30.06 C ATOM 2730 O THR B 127 43.837 11.474 86.696 1.00 29.34 O ATOM 2731 CB THR B 127 43.417 14.736 86.558 1.00 31.12 C ATOM 2732 OG1 THR B 127 43.378 14.277 87.918 1.00 36.20 O ATOM 2733 CG2 THR B 127 42.318 15.770 86.331 1.00 31.94 C ATOM 0 H THR B 127 41.631 12.577 86.243 1.00 28.77 H new ATOM 0 HA THR B 127 43.442 13.858 84.688 1.00 31.05 H new ATOM 0 HB THR B 127 44.276 15.151 86.385 1.00 31.12 H new ATOM 0 HG1 THR B 127 44.144 14.021 88.150 1.00 36.20 H new ATOM 0 HG21 THR B 127 42.438 16.511 86.946 1.00 31.94 H new ATOM 0 HG22 THR B 127 42.364 16.097 85.419 1.00 31.94 H new ATOM 0 HG23 THR B 127 41.452 15.361 86.484 1.00 31.94 H new ATOM 2734 N SER B 128 45.454 12.545 85.548 1.00 28.59 N ATOM 2735 CA SER B 128 46.476 11.560 85.863 1.00 26.92 C ATOM 2736 C SER B 128 47.813 12.254 86.085 1.00 28.87 C ATOM 2737 O SER B 128 48.244 13.070 85.264 1.00 28.19 O ATOM 2738 CB SER B 128 46.609 10.560 84.720 1.00 23.23 C ATOM 2739 OG SER B 128 47.517 9.526 85.053 1.00 25.56 O ATOM 0 H SER B 128 45.727 13.196 85.057 1.00 28.59 H new ATOM 0 HA SER B 128 46.218 11.090 86.671 1.00 26.92 H new ATOM 0 HB2 SER B 128 45.740 10.179 84.516 1.00 23.23 H new ATOM 0 HB3 SER B 128 46.913 11.017 83.920 1.00 23.23 H new ATOM 0 HG SER B 128 47.784 9.150 84.351 1.00 25.56 H new ATOM 2740 N ASP B 129 48.468 11.925 87.194 1.00 27.38 N ATOM 2741 CA ASP B 129 49.765 12.513 87.503 1.00 28.10 C ATOM 2742 C ASP B 129 50.788 11.460 87.918 1.00 27.45 C ATOM 2743 O ASP B 129 50.453 10.445 88.539 1.00 25.52 O ATOM 2744 CB ASP B 129 49.609 13.571 88.596 1.00 28.46 C ATOM 2745 CG ASP B 129 48.893 14.821 88.093 1.00 32.24 C ATOM 2746 OD1 ASP B 129 49.524 15.596 87.347 1.00 32.39 O ATOM 2747 OD2 ASP B 129 47.701 15.020 88.429 1.00 31.10 O ATOM 0 H ASP B 129 48.179 11.365 87.779 1.00 27.38 H new ATOM 0 HA ASP B 129 50.100 12.932 86.695 1.00 28.10 H new ATOM 0 HB2 ASP B 129 49.113 13.194 89.340 1.00 28.46 H new ATOM 0 HB3 ASP B 129 50.485 13.816 88.934 1.00 28.46 H new ATOM 2748 N LEU B 130 52.038 11.703 87.555 1.00 26.58 N ATOM 2749 CA LEU B 130 53.112 10.782 87.884 1.00 28.33 C ATOM 2750 C LEU B 130 54.143 11.471 88.773 1.00 30.30 C ATOM 2751 O LEU B 130 54.503 12.634 88.554 1.00 31.21 O ATOM 2752 CB LEU B 130 53.781 10.258 86.608 1.00 26.58 C ATOM 2753 CG LEU B 130 52.960 9.360 85.674 1.00 28.17 C ATOM 2754 CD1 LEU B 130 51.858 10.164 85.007 1.00 30.81 C ATOM 2755 CD2 LEU B 130 53.871 8.753 84.612 1.00 31.33 C ATOM 0 H LEU B 130 52.286 12.399 87.115 1.00 26.58 H new ATOM 0 HA LEU B 130 52.735 10.029 88.366 1.00 28.33 H new ATOM 0 HB2 LEU B 130 54.080 11.025 86.094 1.00 26.58 H new ATOM 0 HB3 LEU B 130 54.574 9.765 86.870 1.00 26.58 H new ATOM 0 HG LEU B 130 52.557 8.649 86.196 1.00 28.17 H new ATOM 0 HD11 LEU B 130 51.346 9.586 84.419 1.00 30.81 H new ATOM 0 HD12 LEU B 130 51.272 10.535 85.685 1.00 30.81 H new ATOM 0 HD13 LEU B 130 52.251 10.884 84.490 1.00 30.81 H new ATOM 0 HD21 LEU B 130 53.349 8.186 84.023 1.00 31.33 H new ATOM 0 HD22 LEU B 130 54.283 9.463 84.095 1.00 31.33 H new ATOM 0 HD23 LEU B 130 54.561 8.224 85.042 1.00 31.33 H new ATOM 2756 N VAL B 131 54.608 10.744 89.781 1.00 30.57 N ATOM 2757 CA VAL B 131 55.591 11.270 90.712 1.00 31.38 C ATOM 2758 C VAL B 131 56.752 10.299 90.854 1.00 31.66 C ATOM 2759 O VAL B 131 56.555 9.123 91.149 1.00 30.29 O ATOM 2760 CB VAL B 131 54.969 11.495 92.099 1.00 31.77 C ATOM 2761 CG1 VAL B 131 55.977 12.182 93.016 1.00 32.91 C ATOM 2762 CG2 VAL B 131 53.694 12.334 91.961 1.00 32.27 C ATOM 0 H VAL B 131 54.363 9.936 89.943 1.00 30.57 H new ATOM 0 HA VAL B 131 55.906 12.117 90.360 1.00 31.38 H new ATOM 0 HB VAL B 131 54.735 10.640 92.493 1.00 31.77 H new ATOM 0 HG11 VAL B 131 55.578 12.321 93.889 1.00 32.91 H new ATOM 0 HG12 VAL B 131 56.765 11.624 93.106 1.00 32.91 H new ATOM 0 HG13 VAL B 131 56.229 13.038 92.636 1.00 32.91 H new ATOM 0 HG21 VAL B 131 53.303 12.475 92.837 1.00 32.27 H new ATOM 0 HG22 VAL B 131 53.912 13.191 91.563 1.00 32.27 H new ATOM 0 HG23 VAL B 131 53.059 11.867 91.395 1.00 32.27 H new ATOM 2763 N ALA B 132 57.961 10.797 90.632 1.00 32.60 N ATOM 2764 CA ALA B 132 59.160 9.972 90.748 1.00 32.43 C ATOM 2765 C ALA B 132 59.342 9.582 92.210 1.00 32.11 C ATOM 2766 O ALA B 132 58.756 10.205 93.103 1.00 31.60 O ATOM 2767 CB ALA B 132 60.385 10.748 90.251 1.00 31.41 C ATOM 0 H ALA B 132 58.111 11.615 90.412 1.00 32.60 H new ATOM 0 HA ALA B 132 59.065 9.174 90.204 1.00 32.43 H new ATOM 0 HB1 ALA B 132 61.175 10.192 90.332 1.00 31.41 H new ATOM 0 HB2 ALA B 132 60.257 10.994 89.321 1.00 31.41 H new ATOM 0 HB3 ALA B 132 60.498 11.550 90.784 1.00 31.41 H new ATOM 2768 N ALA B 133 60.157 8.559 92.451 1.00 33.18 N ATOM 2769 CA ALA B 133 60.414 8.084 93.805 1.00 35.25 C ATOM 2770 C ALA B 133 61.008 9.161 94.716 1.00 36.37 C ATOM 2771 O ALA B 133 60.818 9.116 95.932 1.00 38.72 O ATOM 2772 CB ALA B 133 61.331 6.864 93.765 1.00 34.72 C ATOM 0 H ALA B 133 60.574 8.124 91.838 1.00 33.18 H new ATOM 0 HA ALA B 133 59.555 7.841 94.185 1.00 35.25 H new ATOM 0 HB1 ALA B 133 61.497 6.554 94.669 1.00 34.72 H new ATOM 0 HB2 ALA B 133 60.907 6.157 93.254 1.00 34.72 H new ATOM 0 HB3 ALA B 133 62.172 7.105 93.346 1.00 34.72 H new ATOM 2773 N ASP B 134 61.716 10.132 94.145 1.00 36.59 N ATOM 2774 CA ASP B 134 62.300 11.193 94.965 1.00 38.77 C ATOM 2775 C ASP B 134 61.292 12.302 95.285 1.00 38.86 C ATOM 2776 O ASP B 134 61.656 13.359 95.808 1.00 38.23 O ATOM 2777 CB ASP B 134 63.540 11.796 94.284 1.00 40.36 C ATOM 2778 CG ASP B 134 63.228 12.427 92.937 1.00 44.58 C ATOM 2779 OD1 ASP B 134 62.038 12.506 92.562 1.00 47.46 O ATOM 2780 OD2 ASP B 134 64.182 12.854 92.252 1.00 46.38 O ATOM 0 H ASP B 134 61.869 10.196 93.301 1.00 36.59 H new ATOM 0 HA ASP B 134 62.564 10.781 95.803 1.00 38.77 H new ATOM 0 HB2 ASP B 134 63.930 12.466 94.867 1.00 40.36 H new ATOM 0 HB3 ASP B 134 64.207 11.102 94.164 1.00 40.36 H new ATOM 2781 N GLY B 135 60.024 12.061 94.964 1.00 37.56 N ATOM 2782 CA GLY B 135 59.000 13.050 95.248 1.00 36.42 C ATOM 2783 C GLY B 135 58.841 14.133 94.197 1.00 35.19 C ATOM 2784 O GLY B 135 58.134 15.115 94.416 1.00 34.99 O ATOM 0 H GLY B 135 59.742 11.341 94.587 1.00 37.56 H new ATOM 0 HA2 GLY B 135 58.150 12.594 95.354 1.00 36.42 H new ATOM 0 HA3 GLY B 135 59.204 13.471 96.098 1.00 36.42 H new ATOM 2785 N VAL B 136 59.495 13.971 93.055 1.00 34.64 N ATOM 2786 CA VAL B 136 59.374 14.963 91.998 1.00 33.58 C ATOM 2787 C VAL B 136 58.229 14.628 91.044 1.00 33.13 C ATOM 2788 O VAL B 136 58.210 13.572 90.410 1.00 32.51 O ATOM 2789 CB VAL B 136 60.694 15.098 91.205 1.00 35.13 C ATOM 2790 CG1 VAL B 136 60.508 16.048 90.026 1.00 32.32 C ATOM 2791 CG2 VAL B 136 61.794 15.625 92.135 1.00 35.39 C ATOM 0 H VAL B 136 60.007 13.304 92.874 1.00 34.64 H new ATOM 0 HA VAL B 136 59.179 15.811 92.426 1.00 33.58 H new ATOM 0 HB VAL B 136 60.950 14.228 90.862 1.00 35.13 H new ATOM 0 HG11 VAL B 136 61.342 16.124 89.537 1.00 32.32 H new ATOM 0 HG12 VAL B 136 59.819 15.702 89.437 1.00 32.32 H new ATOM 0 HG13 VAL B 136 60.244 16.922 90.353 1.00 32.32 H new ATOM 0 HG21 VAL B 136 62.623 15.711 91.639 1.00 35.39 H new ATOM 0 HG22 VAL B 136 61.535 16.492 92.484 1.00 35.39 H new ATOM 0 HG23 VAL B 136 61.920 15.006 92.871 1.00 35.39 H new ATOM 2792 N HIS B 137 57.267 15.543 90.979 1.00 32.33 N ATOM 2793 CA HIS B 137 56.087 15.432 90.128 1.00 31.03 C ATOM 2794 C HIS B 137 56.527 15.672 88.687 1.00 32.05 C ATOM 2795 O HIS B 137 57.061 16.735 88.367 1.00 33.04 O ATOM 2796 CB HIS B 137 55.065 16.488 90.582 1.00 29.59 C ATOM 2797 CG HIS B 137 53.880 16.644 89.678 1.00 28.53 C ATOM 2798 ND1 HIS B 137 53.232 17.753 89.253 1.00 32.09 N flip ATOM 2799 CD2 HIS B 137 53.169 15.571 89.182 1.00 25.71 C flip ATOM 2800 CE1 HIS B 137 52.147 17.335 88.521 1.00 29.83 C flip ATOM 2801 NE2 HIS B 137 52.132 16.015 88.492 1.00 28.80 N flip ATOM 0 H HIS B 137 57.283 16.267 91.443 1.00 32.33 H new ATOM 0 HA HIS B 137 55.675 14.556 90.191 1.00 31.03 H new ATOM 0 HB2 HIS B 137 54.751 16.255 91.470 1.00 29.59 H new ATOM 0 HB3 HIS B 137 55.515 17.344 90.656 1.00 29.59 H new ATOM 0 HD2 HIS B 137 53.385 14.676 89.312 1.00 25.71 H new ATOM 0 HE1 HIS B 137 51.524 17.892 88.112 1.00 29.83 H new ATOM 0 HE2 HIS B 137 51.547 15.527 88.092 1.00 28.80 H new ATOM 2802 N LEU B 138 56.300 14.688 87.822 1.00 32.24 N ATOM 2803 CA LEU B 138 56.702 14.795 86.423 1.00 32.34 C ATOM 2804 C LEU B 138 55.712 15.589 85.580 1.00 33.64 C ATOM 2805 O LEU B 138 56.037 16.040 84.482 1.00 34.46 O ATOM 2806 CB LEU B 138 56.852 13.404 85.809 1.00 32.55 C ATOM 2807 CG LEU B 138 57.721 12.368 86.524 1.00 34.61 C ATOM 2808 CD1 LEU B 138 57.787 11.106 85.672 1.00 35.03 C ATOM 2809 CD2 LEU B 138 59.120 12.921 86.742 1.00 36.15 C ATOM 0 H LEU B 138 55.913 13.948 88.026 1.00 32.24 H new ATOM 0 HA LEU B 138 57.549 15.268 86.420 1.00 32.34 H new ATOM 0 HB2 LEU B 138 55.963 13.027 85.717 1.00 32.55 H new ATOM 0 HB3 LEU B 138 57.207 13.516 84.913 1.00 32.55 H new ATOM 0 HG LEU B 138 57.334 12.159 87.389 1.00 34.61 H new ATOM 0 HD11 LEU B 138 58.337 10.443 86.118 1.00 35.03 H new ATOM 0 HD12 LEU B 138 56.892 10.753 85.547 1.00 35.03 H new ATOM 0 HD13 LEU B 138 58.174 11.318 84.808 1.00 35.03 H new ATOM 0 HD21 LEU B 138 59.663 12.258 87.196 1.00 36.15 H new ATOM 0 HD22 LEU B 138 59.521 13.135 85.885 1.00 36.15 H new ATOM 0 HD23 LEU B 138 59.070 13.723 87.285 1.00 36.15 H new ATOM 2810 N GLY B 139 54.509 15.770 86.105 1.00 32.33 N ATOM 2811 CA GLY B 139 53.480 16.468 85.358 1.00 31.40 C ATOM 2812 C GLY B 139 52.317 15.500 85.196 1.00 30.86 C ATOM 2813 O GLY B 139 52.331 14.416 85.789 1.00 26.88 O ATOM 0 H GLY B 139 54.271 15.499 86.886 1.00 32.33 H new ATOM 0 HA2 GLY B 139 53.198 17.268 85.828 1.00 31.40 H new ATOM 0 HA3 GLY B 139 53.815 16.750 84.493 1.00 31.40 H new ATOM 2814 N GLY B 140 51.321 15.865 84.394 1.00 31.51 N ATOM 2815 CA GLY B 140 50.174 14.988 84.234 1.00 29.35 C ATOM 2816 C GLY B 140 49.328 15.171 82.993 1.00 29.18 C ATOM 2817 O GLY B 140 49.715 15.855 82.044 1.00 27.57 O ATOM 0 H GLY B 140 51.291 16.598 83.945 1.00 31.51 H new ATOM 0 HA2 GLY B 140 50.492 14.072 84.248 1.00 29.35 H new ATOM 0 HA3 GLY B 140 49.600 15.100 85.008 1.00 29.35 H new ATOM 2818 N TYR B 141 48.149 14.553 83.018 1.00 29.00 N ATOM 2819 CA TYR B 141 47.223 14.583 81.897 1.00 25.97 C ATOM 2820 C TYR B 141 45.797 14.915 82.312 1.00 26.62 C ATOM 2821 O TYR B 141 45.373 14.619 83.421 1.00 26.04 O ATOM 2822 CB TYR B 141 47.207 13.225 81.213 1.00 24.04 C ATOM 2823 CG TYR B 141 48.566 12.680 80.862 1.00 24.04 C ATOM 2824 CD1 TYR B 141 49.230 11.793 81.715 1.00 20.80 C ATOM 2825 CD2 TYR B 141 49.189 13.043 79.662 1.00 24.14 C ATOM 2826 CE1 TYR B 141 50.478 11.275 81.379 1.00 22.60 C ATOM 2827 CE2 TYR B 141 50.438 12.540 79.320 1.00 24.87 C ATOM 2828 CZ TYR B 141 51.075 11.659 80.175 1.00 25.48 C ATOM 2829 OH TYR B 141 52.301 11.161 79.817 1.00 27.24 O ATOM 0 H TYR B 141 47.865 14.102 83.693 1.00 29.00 H new ATOM 0 HA TYR B 141 47.535 15.282 81.301 1.00 25.97 H new ATOM 0 HB2 TYR B 141 46.757 12.590 81.792 1.00 24.04 H new ATOM 0 HB3 TYR B 141 46.679 13.292 80.402 1.00 24.04 H new ATOM 0 HD1 TYR B 141 48.832 11.545 82.518 1.00 20.80 H new ATOM 0 HD2 TYR B 141 48.759 13.631 79.084 1.00 24.14 H new ATOM 0 HE1 TYR B 141 50.909 10.680 81.949 1.00 22.60 H new ATOM 0 HE2 TYR B 141 50.843 12.794 78.522 1.00 24.87 H new ATOM 0 HH TYR B 141 52.349 11.108 78.980 1.00 27.24 H new ATOM 2830 N ILE B 142 45.052 15.518 81.397 1.00 29.15 N ATOM 2831 CA ILE B 142 43.664 15.866 81.662 1.00 29.88 C ATOM 2832 C ILE B 142 42.828 15.408 80.474 1.00 29.92 C ATOM 2833 O ILE B 142 43.241 15.552 79.319 1.00 29.23 O ATOM 2834 CB ILE B 142 43.490 17.388 81.839 1.00 31.72 C ATOM 2835 CG1 ILE B 142 44.304 17.872 83.040 1.00 34.97 C ATOM 2836 CG2 ILE B 142 42.018 17.731 82.051 1.00 33.03 C ATOM 2837 CD1 ILE B 142 44.258 19.380 83.237 1.00 35.53 C ATOM 0 H ILE B 142 45.332 15.735 80.613 1.00 29.15 H new ATOM 0 HA ILE B 142 43.381 15.433 82.483 1.00 29.88 H new ATOM 0 HB ILE B 142 43.807 17.830 81.036 1.00 31.72 H new ATOM 0 HG12 ILE B 142 43.973 17.438 83.842 1.00 34.97 H new ATOM 0 HG13 ILE B 142 45.227 17.596 82.928 1.00 34.97 H new ATOM 0 HG21 ILE B 142 41.922 18.690 82.161 1.00 33.03 H new ATOM 0 HG22 ILE B 142 41.504 17.441 81.281 1.00 33.03 H new ATOM 0 HG23 ILE B 142 41.692 17.280 82.846 1.00 33.03 H new ATOM 0 HD11 ILE B 142 44.791 19.622 84.010 1.00 35.53 H new ATOM 0 HD12 ILE B 142 44.614 19.820 82.449 1.00 35.53 H new ATOM 0 HD13 ILE B 142 43.340 19.660 83.377 1.00 35.53 H new ATOM 2838 N CYS B 143 41.665 14.836 80.759 1.00 31.44 N ATOM 2839 CA CYS B 143 40.766 14.384 79.709 1.00 32.99 C ATOM 2840 C CYS B 143 39.353 14.200 80.252 1.00 31.88 C ATOM 2841 O CYS B 143 39.124 14.253 81.463 1.00 29.53 O ATOM 2842 CB CYS B 143 41.283 13.087 79.062 1.00 35.80 C ATOM 2843 SG CYS B 143 41.481 11.672 80.154 1.00 46.97 S ATOM 0 H CYS B 143 41.378 14.700 81.558 1.00 31.44 H new ATOM 0 HA CYS B 143 40.737 15.067 79.021 1.00 32.99 H new ATOM 0 HB2 CYS B 143 40.673 12.838 78.350 1.00 35.80 H new ATOM 0 HB3 CYS B 143 42.140 13.274 78.649 1.00 35.80 H new ATOM 0 HG CYS B 143 42.599 11.247 80.060 1.00 46.97 H new ATOM 2844 N PRO B 144 38.376 13.997 79.358 1.00 31.09 N ATOM 2845 CA PRO B 144 37.004 13.825 79.841 1.00 31.53 C ATOM 2846 C PRO B 144 36.707 12.512 80.539 1.00 30.48 C ATOM 2847 O PRO B 144 37.294 11.471 80.221 1.00 31.51 O ATOM 2848 CB PRO B 144 36.165 14.007 78.575 1.00 31.54 C ATOM 2849 CG PRO B 144 37.089 13.489 77.492 1.00 31.65 C ATOM 2850 CD PRO B 144 38.420 14.078 77.885 1.00 29.91 C ATOM 0 HA PRO B 144 36.809 14.462 80.546 1.00 31.53 H new ATOM 0 HB2 PRO B 144 35.337 13.503 78.615 1.00 31.54 H new ATOM 0 HB3 PRO B 144 35.925 14.936 78.431 1.00 31.54 H new ATOM 0 HG2 PRO B 144 37.115 12.520 77.473 1.00 31.65 H new ATOM 0 HG3 PRO B 144 36.811 13.782 76.610 1.00 31.65 H new ATOM 0 HD2 PRO B 144 39.162 13.573 77.517 1.00 29.91 H new ATOM 0 HD3 PRO B 144 38.517 14.992 77.575 1.00 29.91 H new ATOM 2851 N GLY B 145 35.796 12.586 81.503 1.00 28.64 N ATOM 2852 CA GLY B 145 35.358 11.411 82.232 1.00 28.42 C ATOM 2853 C GLY B 145 34.046 10.975 81.602 1.00 30.02 C ATOM 2854 O GLY B 145 33.613 11.567 80.601 1.00 32.10 O ATOM 0 H GLY B 145 35.418 13.318 81.750 1.00 28.64 H new ATOM 0 HA2 GLY B 145 36.019 10.704 82.176 1.00 28.42 H new ATOM 0 HA3 GLY B 145 35.238 11.614 83.173 1.00 28.42 H new HETATM 2855 N MSE B 146 33.394 9.966 82.175 1.00 30.98 N HETATM 2856 CA MSE B 146 32.129 9.472 81.624 1.00 32.29 C HETATM 2857 C MSE B 146 31.049 10.539 81.409 1.00 32.90 C HETATM 2858 O MSE B 146 30.552 10.694 80.296 1.00 34.58 O HETATM 2859 CB MSE B 146 31.553 8.343 82.500 1.00 34.39 C HETATM 2860 CG MSE B 146 32.375 7.042 82.509 1.00 38.75 C HETATM 2861 SE MSE B 146 32.596 6.157 80.771 1.00 46.59 SE HETATM 2862 CE MSE B 146 30.910 5.180 80.722 1.00 41.97 C HETATM 0 H MSE B 146 33.664 9.554 82.880 1.00 30.98 H new HETATM 0 HA MSE B 146 32.365 9.143 80.742 1.00 32.29 H new HETATM 0 HB2 MSE B 146 31.475 8.667 83.411 1.00 34.39 H new HETATM 0 HB3 MSE B 146 30.655 8.140 82.193 1.00 34.39 H new HETATM 0 HG2 MSE B 146 33.255 7.238 82.867 1.00 38.75 H new HETATM 0 HG3 MSE B 146 31.953 6.417 83.119 1.00 38.75 H new HETATM 0 HE1 MSE B 146 30.855 4.671 79.898 1.00 41.97 H new HETATM 0 HE2 MSE B 146 30.864 4.576 81.479 1.00 41.97 H new HETATM 0 HE3 MSE B 146 30.171 5.807 80.764 1.00 41.97 H new ATOM 2863 N THR B 147 30.681 11.277 82.453 1.00 33.09 N ATOM 2864 CA THR B 147 29.631 12.278 82.292 1.00 34.96 C ATOM 2865 C THR B 147 29.966 13.348 81.256 1.00 33.47 C ATOM 2866 O THR B 147 29.100 13.774 80.500 1.00 33.82 O ATOM 2867 CB THR B 147 29.269 12.967 83.634 1.00 37.21 C ATOM 2868 OG1 THR B 147 30.347 13.803 84.059 1.00 42.57 O ATOM 2869 CG2 THR B 147 28.987 11.931 84.700 1.00 38.62 C ATOM 0 H THR B 147 31.016 11.217 83.243 1.00 33.09 H new ATOM 0 HA THR B 147 28.864 11.779 81.970 1.00 34.96 H new ATOM 0 HB THR B 147 28.474 13.506 83.498 1.00 37.21 H new ATOM 0 HG1 THR B 147 30.277 13.954 84.882 1.00 42.57 H new ATOM 0 HG21 THR B 147 28.762 12.376 85.532 1.00 38.62 H new ATOM 0 HG22 THR B 147 28.244 11.373 84.421 1.00 38.62 H new ATOM 0 HG23 THR B 147 29.774 11.379 84.831 1.00 38.62 H new ATOM 2870 N LEU B 148 31.221 13.777 81.212 1.00 34.41 N ATOM 2871 CA LEU B 148 31.637 14.789 80.249 1.00 33.63 C ATOM 2872 C LEU B 148 31.565 14.231 78.821 1.00 33.76 C ATOM 2873 O LEU B 148 31.126 14.919 77.898 1.00 32.00 O ATOM 2874 CB LEU B 148 33.058 15.257 80.573 1.00 35.46 C ATOM 2875 CG LEU B 148 33.255 16.767 80.723 1.00 40.32 C ATOM 2876 CD1 LEU B 148 32.214 17.334 81.686 1.00 39.25 C ATOM 2877 CD2 LEU B 148 34.664 17.056 81.223 1.00 41.01 C ATOM 0 H LEU B 148 31.847 13.496 81.730 1.00 34.41 H new ATOM 0 HA LEU B 148 31.036 15.548 80.308 1.00 33.63 H new ATOM 0 HB2 LEU B 148 33.339 14.830 81.397 1.00 35.46 H new ATOM 0 HB3 LEU B 148 33.650 14.940 79.873 1.00 35.46 H new ATOM 0 HG LEU B 148 33.140 17.194 79.860 1.00 40.32 H new ATOM 0 HD11 LEU B 148 32.344 18.291 81.777 1.00 39.25 H new ATOM 0 HD12 LEU B 148 31.325 17.160 81.340 1.00 39.25 H new ATOM 0 HD13 LEU B 148 32.311 16.911 82.554 1.00 39.25 H new ATOM 0 HD21 LEU B 148 34.784 18.014 81.317 1.00 41.01 H new ATOM 0 HD22 LEU B 148 34.796 16.628 82.084 1.00 41.01 H new ATOM 0 HD23 LEU B 148 35.310 16.710 80.588 1.00 41.01 H new HETATM 2878 N MSE B 149 31.994 12.986 78.640 1.00 33.72 N HETATM 2879 CA MSE B 149 31.935 12.365 77.319 1.00 35.15 C HETATM 2880 C MSE B 149 30.483 12.272 76.852 1.00 35.62 C HETATM 2881 O MSE B 149 30.192 12.538 75.687 1.00 33.48 O HETATM 2882 CB MSE B 149 32.548 10.957 77.331 1.00 36.21 C HETATM 2883 CG MSE B 149 34.055 10.915 77.465 1.00 40.89 C HETATM 2884 SE MSE B 149 34.778 9.118 77.196 1.00 46.36 SE HETATM 2885 CE MSE B 149 34.952 8.618 79.053 1.00 43.45 C HETATM 0 H MSE B 149 32.319 12.488 79.261 1.00 33.72 H new HETATM 0 HA MSE B 149 32.448 12.920 76.710 1.00 35.15 H new HETATM 0 HB2 MSE B 149 32.158 10.456 78.064 1.00 36.21 H new HETATM 0 HB3 MSE B 149 32.297 10.503 76.511 1.00 36.21 H new HETATM 0 HG2 MSE B 149 34.452 11.520 76.819 1.00 40.89 H new HETATM 0 HG3 MSE B 149 34.308 11.234 78.345 1.00 40.89 H new HETATM 0 HE1 MSE B 149 35.311 7.719 79.114 1.00 43.45 H new HETATM 0 HE2 MSE B 149 35.551 9.236 79.500 1.00 43.45 H new HETATM 0 HE3 MSE B 149 34.081 8.648 79.479 1.00 43.45 H new ATOM 2886 N ARG B 150 29.576 11.891 77.753 1.00 35.86 N ATOM 2887 CA ARG B 150 28.158 11.784 77.392 1.00 38.37 C ATOM 2888 C ARG B 150 27.648 13.156 77.003 1.00 37.81 C ATOM 2889 O ARG B 150 26.964 13.321 75.992 1.00 38.09 O ATOM 2890 CB ARG B 150 27.301 11.281 78.562 1.00 38.66 C ATOM 2891 CG ARG B 150 27.568 9.867 79.008 1.00 42.38 C ATOM 2892 CD ARG B 150 26.429 9.370 79.895 1.00 42.88 C ATOM 2893 NE ARG B 150 26.777 8.128 80.576 1.00 44.71 N ATOM 2894 CZ ARG B 150 27.488 8.068 81.696 1.00 47.01 C ATOM 2895 NH1 ARG B 150 27.764 6.893 82.242 1.00 47.31 N ATOM 2896 NH2 ARG B 150 27.906 9.185 82.279 1.00 48.37 N ATOM 0 H ARG B 150 29.757 11.692 78.570 1.00 35.86 H new ATOM 0 HA ARG B 150 28.088 11.150 76.661 1.00 38.37 H new ATOM 0 HB2 ARG B 150 27.437 11.872 79.319 1.00 38.66 H new ATOM 0 HB3 ARG B 150 26.367 11.352 78.311 1.00 38.66 H new ATOM 0 HG2 ARG B 150 27.660 9.289 78.235 1.00 42.38 H new ATOM 0 HG3 ARG B 150 28.406 9.827 79.494 1.00 42.38 H new ATOM 0 HD2 ARG B 150 26.210 10.049 80.552 1.00 42.88 H new ATOM 0 HD3 ARG B 150 25.635 9.232 79.355 1.00 42.88 H new ATOM 0 HE ARG B 150 26.505 7.389 80.231 1.00 44.71 H new ATOM 0 HH11 ARG B 150 27.483 6.170 81.871 1.00 47.31 H new ATOM 0 HH12 ARG B 150 28.224 6.853 82.967 1.00 47.31 H new ATOM 0 HH21 ARG B 150 27.716 9.948 81.931 1.00 48.37 H new ATOM 0 HH22 ARG B 150 28.366 9.145 83.004 1.00 48.37 H new ATOM 2897 N SER B 151 27.976 14.133 77.837 1.00 37.16 N ATOM 2898 CA SER B 151 27.576 15.513 77.616 1.00 39.07 C ATOM 2899 C SER B 151 28.024 15.989 76.227 1.00 37.59 C ATOM 2900 O SER B 151 27.245 16.578 75.473 1.00 36.31 O ATOM 2901 CB SER B 151 28.192 16.396 78.706 1.00 40.07 C ATOM 2902 OG SER B 151 27.910 17.764 78.488 1.00 47.67 O ATOM 0 H SER B 151 28.440 14.013 78.551 1.00 37.16 H new ATOM 0 HA SER B 151 26.609 15.576 77.657 1.00 39.07 H new ATOM 0 HB2 SER B 151 27.849 16.128 79.573 1.00 40.07 H new ATOM 0 HB3 SER B 151 29.152 16.262 78.728 1.00 40.07 H new ATOM 0 HG SER B 151 28.258 18.223 79.100 1.00 47.67 H new ATOM 2903 N GLN B 152 29.281 15.724 75.893 1.00 35.99 N ATOM 2904 CA GLN B 152 29.825 16.130 74.601 1.00 34.95 C ATOM 2905 C GLN B 152 29.046 15.510 73.446 1.00 34.81 C ATOM 2906 O GLN B 152 28.679 16.195 72.488 1.00 33.71 O ATOM 2907 CB GLN B 152 31.298 15.729 74.505 1.00 36.29 C ATOM 2908 CG GLN B 152 32.250 16.651 75.250 1.00 39.85 C ATOM 2909 CD GLN B 152 33.510 15.937 75.734 1.00 41.39 C ATOM 2910 OE1 GLN B 152 34.037 16.380 76.864 1.00 40.81 O flip ATOM 2911 NE2 GLN B 152 34.007 15.011 75.091 1.00 40.34 N flip ATOM 0 H GLN B 152 29.838 15.309 76.401 1.00 35.99 H new ATOM 0 HA GLN B 152 29.744 17.094 74.535 1.00 34.95 H new ATOM 0 HB2 GLN B 152 31.400 14.829 74.851 1.00 36.29 H new ATOM 0 HB3 GLN B 152 31.555 15.704 73.570 1.00 36.29 H new ATOM 0 HG2 GLN B 152 32.503 17.386 74.669 1.00 39.85 H new ATOM 0 HG3 GLN B 152 31.790 17.037 76.011 1.00 39.85 H new ATOM 0 HE21 GLN B 152 33.638 14.748 74.360 1.00 40.34 H new ATOM 0 HE22 GLN B 152 34.723 14.627 75.373 1.00 40.34 H new ATOM 2912 N LEU B 153 28.789 14.211 73.539 1.00 34.29 N ATOM 2913 CA LEU B 153 28.061 13.510 72.491 1.00 34.54 C ATOM 2914 C LEU B 153 26.626 14.001 72.376 1.00 37.15 C ATOM 2915 O LEU B 153 26.100 14.171 71.276 1.00 37.75 O ATOM 2916 CB LEU B 153 28.092 12.008 72.761 1.00 31.53 C ATOM 2917 CG LEU B 153 29.488 11.413 72.525 1.00 29.21 C ATOM 2918 CD1 LEU B 153 29.547 9.978 73.022 1.00 28.22 C ATOM 2919 CD2 LEU B 153 29.811 11.488 71.032 1.00 24.71 C ATOM 0 H LEU B 153 29.028 13.717 74.201 1.00 34.29 H new ATOM 0 HA LEU B 153 28.497 13.695 71.645 1.00 34.54 H new ATOM 0 HB2 LEU B 153 27.819 11.838 73.676 1.00 31.53 H new ATOM 0 HB3 LEU B 153 27.450 11.563 72.186 1.00 31.53 H new ATOM 0 HG LEU B 153 30.148 11.922 73.021 1.00 29.21 H new ATOM 0 HD11 LEU B 153 30.434 9.617 72.866 1.00 28.22 H new ATOM 0 HD12 LEU B 153 29.352 9.956 73.972 1.00 28.22 H new ATOM 0 HD13 LEU B 153 28.893 9.443 72.546 1.00 28.22 H new ATOM 0 HD21 LEU B 153 30.692 11.114 70.872 1.00 24.71 H new ATOM 0 HD22 LEU B 153 29.150 10.983 70.532 1.00 24.71 H new ATOM 0 HD23 LEU B 153 29.796 12.414 70.744 1.00 24.71 H new ATOM 2920 N ARG B 154 26.002 14.239 73.522 1.00 38.40 N ATOM 2921 CA ARG B 154 24.627 14.711 73.569 1.00 38.39 C ATOM 2922 C ARG B 154 24.534 16.033 72.819 1.00 38.01 C ATOM 2923 O ARG B 154 23.651 16.235 71.988 1.00 37.60 O ATOM 2924 CB ARG B 154 24.205 14.897 75.027 1.00 37.82 C ATOM 2925 CG ARG B 154 22.774 14.503 75.314 1.00 43.31 C ATOM 2926 CD ARG B 154 22.453 14.686 76.790 1.00 42.74 C ATOM 2927 NE ARG B 154 23.305 13.828 77.597 1.00 45.97 N ATOM 2928 CZ ARG B 154 23.997 14.230 78.656 1.00 43.91 C ATOM 2929 NH1 ARG B 154 23.941 15.496 79.056 1.00 43.33 N ATOM 2930 NH2 ARG B 154 24.758 13.359 79.303 1.00 42.29 N ATOM 0 H ARG B 154 26.364 14.131 74.294 1.00 38.40 H new ATOM 0 HA ARG B 154 24.036 14.064 73.152 1.00 38.39 H new ATOM 0 HB2 ARG B 154 24.794 14.373 75.593 1.00 37.82 H new ATOM 0 HB3 ARG B 154 24.329 15.827 75.273 1.00 37.82 H new ATOM 0 HG2 ARG B 154 22.171 15.042 74.778 1.00 43.31 H new ATOM 0 HG3 ARG B 154 22.631 13.578 75.059 1.00 43.31 H new ATOM 0 HD2 ARG B 154 22.582 15.613 77.044 1.00 42.74 H new ATOM 0 HD3 ARG B 154 21.521 14.474 76.954 1.00 42.74 H new ATOM 0 HE ARG B 154 23.365 13.000 77.372 1.00 45.97 H new ATOM 0 HH11 ARG B 154 23.454 16.061 78.628 1.00 43.33 H new ATOM 0 HH12 ARG B 154 24.392 15.750 79.743 1.00 43.33 H new ATOM 0 HH21 ARG B 154 24.800 12.543 79.036 1.00 42.29 H new ATOM 0 HH22 ARG B 154 25.210 13.610 79.990 1.00 42.29 H new ATOM 2931 N THR B 155 25.473 16.922 73.114 1.00 39.09 N ATOM 2932 CA THR B 155 25.529 18.235 72.491 1.00 40.48 C ATOM 2933 C THR B 155 25.835 18.120 71.004 1.00 41.86 C ATOM 2934 O THR B 155 25.347 18.908 70.192 1.00 42.63 O ATOM 2935 CB THR B 155 26.618 19.094 73.164 1.00 42.41 C ATOM 2936 OG1 THR B 155 26.264 19.320 74.535 1.00 43.86 O ATOM 2937 CG2 THR B 155 26.774 20.425 72.455 1.00 44.06 C ATOM 0 H THR B 155 26.100 16.779 73.685 1.00 39.09 H new ATOM 0 HA THR B 155 24.662 18.655 72.603 1.00 40.48 H new ATOM 0 HB THR B 155 27.462 18.619 73.112 1.00 42.41 H new ATOM 0 HG1 THR B 155 26.462 18.643 74.991 1.00 43.86 H new ATOM 0 HG21 THR B 155 27.463 20.947 72.895 1.00 44.06 H new ATOM 0 HG22 THR B 155 27.025 20.272 71.531 1.00 44.06 H new ATOM 0 HG23 THR B 155 25.934 20.908 72.485 1.00 44.06 H new ATOM 2938 N HIS B 156 26.643 17.130 70.650 1.00 42.07 N ATOM 2939 CA HIS B 156 27.023 16.923 69.265 1.00 42.25 C ATOM 2940 C HIS B 156 25.838 16.508 68.395 1.00 43.33 C ATOM 2941 O HIS B 156 25.724 16.948 67.254 1.00 41.87 O ATOM 2942 CB HIS B 156 28.129 15.866 69.184 1.00 43.54 C ATOM 2943 CG HIS B 156 28.638 15.629 67.798 1.00 43.93 C ATOM 2944 ND1 HIS B 156 29.188 16.630 67.027 1.00 44.27 N ATOM 2945 CD2 HIS B 156 28.688 14.503 67.047 1.00 45.25 C ATOM 2946 CE1 HIS B 156 29.556 16.131 65.861 1.00 46.73 C ATOM 2947 NE2 HIS B 156 29.263 14.842 65.847 1.00 47.07 N ATOM 0 H HIS B 156 26.983 16.565 71.202 1.00 42.07 H new ATOM 0 HA HIS B 156 27.349 17.770 68.922 1.00 42.25 H new ATOM 0 HB2 HIS B 156 28.869 16.140 69.749 1.00 43.54 H new ATOM 0 HB3 HIS B 156 27.793 15.030 69.543 1.00 43.54 H new ATOM 0 HD2 HIS B 156 28.389 13.659 67.297 1.00 45.25 H new ATOM 0 HE1 HIS B 156 29.954 16.606 65.167 1.00 46.73 H new ATOM 0 HE2 HIS B 156 29.409 14.303 65.193 1.00 47.07 H new ATOM 2948 N THR B 157 24.954 15.669 68.928 1.00 44.23 N ATOM 2949 CA THR B 157 23.802 15.218 68.152 1.00 46.82 C ATOM 2950 C THR B 157 22.568 14.873 68.980 1.00 48.39 C ATOM 2951 O THR B 157 22.670 14.304 70.067 1.00 48.59 O ATOM 2952 CB THR B 157 24.162 13.989 67.291 1.00 46.04 C ATOM 2953 OG1 THR B 157 22.980 13.491 66.653 1.00 49.51 O ATOM 2954 CG2 THR B 157 24.764 12.895 68.145 1.00 45.60 C ATOM 0 H THR B 157 25.001 15.353 69.726 1.00 44.23 H new ATOM 0 HA THR B 157 23.574 15.982 67.600 1.00 46.82 H new ATOM 0 HB THR B 157 24.812 14.259 66.624 1.00 46.04 H new ATOM 0 HG1 THR B 157 22.999 13.686 65.836 1.00 49.51 H new ATOM 0 HG21 THR B 157 24.983 12.132 67.587 1.00 45.60 H new ATOM 0 HG22 THR B 157 25.570 13.225 68.573 1.00 45.60 H new ATOM 0 HG23 THR B 157 24.125 12.626 68.824 1.00 45.60 H new ATOM 2955 N ARG B 158 21.399 15.216 68.449 1.00 50.18 N ATOM 2956 CA ARG B 158 20.135 14.947 69.125 1.00 53.29 C ATOM 2957 C ARG B 158 19.793 13.464 69.055 1.00 53.56 C ATOM 2958 O ARG B 158 18.912 12.996 69.770 1.00 54.40 O ATOM 2959 CB ARG B 158 19.001 15.746 68.477 1.00 56.58 C ATOM 2960 CG ARG B 158 19.348 17.185 68.150 1.00 60.86 C ATOM 2961 CD ARG B 158 18.114 17.955 67.714 1.00 64.63 C ATOM 2962 NE ARG B 158 18.451 19.234 67.093 1.00 67.87 N ATOM 2963 CZ ARG B 158 18.846 19.372 65.830 1.00 69.82 C ATOM 2964 NH1 ARG B 158 18.953 18.310 65.040 1.00 70.48 N ATOM 2965 NH2 ARG B 158 19.135 20.575 65.352 1.00 71.64 N ATOM 0 H ARG B 158 21.316 15.610 67.689 1.00 50.18 H new ATOM 0 HA ARG B 158 20.233 15.213 70.053 1.00 53.29 H new ATOM 0 HB2 ARG B 158 18.731 15.297 67.660 1.00 56.58 H new ATOM 0 HB3 ARG B 158 18.235 15.738 69.072 1.00 56.58 H new ATOM 0 HG2 ARG B 158 19.742 17.611 68.927 1.00 60.86 H new ATOM 0 HG3 ARG B 158 20.014 17.209 67.445 1.00 60.86 H new ATOM 0 HD2 ARG B 158 17.604 17.418 67.088 1.00 64.63 H new ATOM 0 HD3 ARG B 158 17.544 18.111 68.483 1.00 64.63 H new ATOM 0 HE ARG B 158 18.390 19.944 67.575 1.00 67.87 H new ATOM 0 HH11 ARG B 158 18.767 17.527 65.344 1.00 70.48 H new ATOM 0 HH12 ARG B 158 19.209 18.405 64.224 1.00 70.48 H new ATOM 0 HH21 ARG B 158 19.067 21.267 65.859 1.00 71.64 H new ATOM 0 HH22 ARG B 158 19.390 20.663 64.536 1.00 71.64 H new ATOM 2966 N ARG B 159 20.486 12.735 68.184 1.00 53.72 N ATOM 2967 CA ARG B 159 20.260 11.301 68.011 1.00 54.28 C ATOM 2968 C ARG B 159 20.725 10.487 69.211 1.00 53.51 C ATOM 2969 O ARG B 159 20.449 9.293 69.302 1.00 52.94 O ATOM 2970 CB ARG B 159 20.991 10.791 66.764 1.00 57.20 C ATOM 2971 CG ARG B 159 20.193 10.852 65.472 1.00 61.25 C ATOM 2972 CD ARG B 159 20.932 11.634 64.388 1.00 65.65 C ATOM 2973 NE ARG B 159 22.348 11.275 64.277 1.00 68.86 N ATOM 2974 CZ ARG B 159 22.803 10.069 63.946 1.00 70.45 C ATOM 2975 NH1 ARG B 159 21.959 9.079 63.689 1.00 71.97 N ATOM 2976 NH2 ARG B 159 24.110 9.856 63.861 1.00 71.07 N ATOM 0 H ARG B 159 21.101 13.057 67.676 1.00 53.72 H new ATOM 0 HA ARG B 159 19.302 11.185 67.916 1.00 54.28 H new ATOM 0 HB2 ARG B 159 21.804 11.308 66.650 1.00 57.20 H new ATOM 0 HB3 ARG B 159 21.259 9.872 66.918 1.00 57.20 H new ATOM 0 HG2 ARG B 159 20.016 9.952 65.158 1.00 61.25 H new ATOM 0 HG3 ARG B 159 19.333 11.267 65.642 1.00 61.25 H new ATOM 0 HD2 ARG B 159 20.498 11.480 63.534 1.00 65.65 H new ATOM 0 HD3 ARG B 159 20.859 12.583 64.576 1.00 65.65 H new ATOM 0 HE ARG B 159 22.928 11.889 64.438 1.00 68.86 H new ATOM 0 HH11 ARG B 159 21.111 9.214 63.736 1.00 71.97 H new ATOM 0 HH12 ARG B 159 22.260 8.302 63.476 1.00 71.97 H new ATOM 0 HH21 ARG B 159 24.661 10.497 64.020 1.00 71.07 H new ATOM 0 HH22 ARG B 159 24.406 9.077 63.647 1.00 71.07 H new ATOM 2977 N ILE B 160 21.443 11.125 70.126 1.00 52.26 N ATOM 2978 CA ILE B 160 21.936 10.423 71.301 1.00 52.86 C ATOM 2979 C ILE B 160 21.186 10.850 72.558 1.00 52.92 C ATOM 2980 O ILE B 160 21.536 11.849 73.192 1.00 51.30 O ATOM 2981 CB ILE B 160 23.453 10.663 71.493 1.00 53.41 C ATOM 2982 CG1 ILE B 160 24.217 10.127 70.276 1.00 52.58 C ATOM 2983 CG2 ILE B 160 23.933 9.977 72.769 1.00 52.16 C ATOM 2984 CD1 ILE B 160 25.715 10.362 70.325 1.00 52.39 C ATOM 0 H ILE B 160 21.654 11.958 70.086 1.00 52.26 H new ATOM 0 HA ILE B 160 21.782 9.476 71.156 1.00 52.86 H new ATOM 0 HB ILE B 160 23.620 11.615 71.574 1.00 53.41 H new ATOM 0 HG12 ILE B 160 24.052 9.174 70.198 1.00 52.58 H new ATOM 0 HG13 ILE B 160 23.861 10.543 69.475 1.00 52.58 H new ATOM 0 HG21 ILE B 160 24.884 10.132 72.882 1.00 52.16 H new ATOM 0 HG22 ILE B 160 23.454 10.339 73.531 1.00 52.16 H new ATOM 0 HG23 ILE B 160 23.767 9.023 72.706 1.00 52.16 H new ATOM 0 HD11 ILE B 160 26.126 9.997 69.526 1.00 52.39 H new ATOM 0 HD12 ILE B 160 25.892 11.315 70.373 1.00 52.39 H new ATOM 0 HD13 ILE B 160 26.086 9.925 71.107 1.00 52.39 H new ATOM 2985 N ARG B 161 20.159 10.076 72.906 1.00 52.60 N ATOM 2986 CA ARG B 161 19.328 10.341 74.078 1.00 53.87 C ATOM 2987 C ARG B 161 18.685 9.056 74.596 1.00 53.82 C ATOM 2988 O ARG B 161 18.022 8.346 73.845 1.00 55.34 O ATOM 2989 CB ARG B 161 18.215 11.335 73.725 1.00 53.42 C ATOM 2990 CG ARG B 161 18.685 12.729 73.331 1.00 53.19 C ATOM 2991 CD ARG B 161 19.305 13.475 74.506 1.00 52.61 C ATOM 2992 NE ARG B 161 19.552 14.880 74.186 1.00 54.22 N ATOM 2993 CZ ARG B 161 20.402 15.304 73.254 1.00 54.55 C ATOM 2994 NH1 ARG B 161 20.551 16.602 73.035 1.00 56.30 N ATOM 2995 NH2 ARG B 161 21.112 14.435 72.546 1.00 55.11 N ATOM 0 H ARG B 161 19.924 9.377 72.464 1.00 52.60 H new ATOM 0 HA ARG B 161 19.902 10.713 74.766 1.00 53.87 H new ATOM 0 HB2 ARG B 161 17.694 10.967 72.994 1.00 53.42 H new ATOM 0 HB3 ARG B 161 17.619 11.414 74.487 1.00 53.42 H new ATOM 0 HG2 ARG B 161 19.334 12.660 72.614 1.00 53.19 H new ATOM 0 HG3 ARG B 161 17.934 13.237 72.986 1.00 53.19 H new ATOM 0 HD2 ARG B 161 18.715 13.417 75.274 1.00 52.61 H new ATOM 0 HD3 ARG B 161 20.139 13.048 74.756 1.00 52.61 H new ATOM 0 HE ARG B 161 19.118 15.474 74.631 1.00 54.22 H new ATOM 0 HH11 ARG B 161 20.098 17.170 73.495 1.00 56.30 H new ATOM 0 HH12 ARG B 161 21.100 16.876 72.433 1.00 56.30 H new ATOM 0 HH21 ARG B 161 21.025 13.591 72.688 1.00 55.11 H new ATOM 0 HH22 ARG B 161 21.660 14.715 71.945 1.00 55.11 H new ATOM 2996 N TYR B 162 18.880 8.760 75.877 1.00 53.68 N ATOM 2997 CA TYR B 162 18.294 7.568 76.486 1.00 53.99 C ATOM 2998 C TYR B 162 18.225 7.670 78.006 1.00 54.86 C ATOM 2999 O TYR B 162 18.845 8.548 78.607 1.00 52.85 O ATOM 3000 CB TYR B 162 19.071 6.305 76.092 1.00 53.16 C ATOM 3001 CG TYR B 162 20.576 6.426 76.180 1.00 52.48 C ATOM 3002 CD1 TYR B 162 21.316 6.919 75.107 1.00 51.46 C ATOM 3003 CD2 TYR B 162 21.263 6.038 77.331 1.00 50.59 C ATOM 3004 CE1 TYR B 162 22.701 7.020 75.172 1.00 50.17 C ATOM 3005 CE2 TYR B 162 22.649 6.137 77.407 1.00 50.41 C ATOM 3006 CZ TYR B 162 23.359 6.629 76.321 1.00 49.79 C ATOM 3007 OH TYR B 162 24.724 6.730 76.380 1.00 49.76 O ATOM 0 H TYR B 162 19.351 9.239 76.414 1.00 53.68 H new ATOM 0 HA TYR B 162 17.388 7.505 76.146 1.00 53.99 H new ATOM 0 HB2 TYR B 162 18.785 5.575 76.663 1.00 53.16 H new ATOM 0 HB3 TYR B 162 18.832 6.065 75.183 1.00 53.16 H new ATOM 0 HD1 TYR B 162 20.875 7.185 74.333 1.00 51.46 H new ATOM 0 HD2 TYR B 162 20.787 5.708 78.059 1.00 50.59 H new ATOM 0 HE1 TYR B 162 23.181 7.349 74.446 1.00 50.17 H new ATOM 0 HE2 TYR B 162 23.096 5.875 78.180 1.00 50.41 H new ATOM 0 HH TYR B 162 24.998 6.411 77.107 1.00 49.76 H new ATOM 3008 N ASP B 163 17.470 6.755 78.613 1.00 56.87 N ATOM 3009 CA ASP B 163 17.274 6.715 80.063 1.00 59.06 C ATOM 3010 C ASP B 163 18.491 6.193 80.813 1.00 58.70 C ATOM 3011 O ASP B 163 19.334 5.491 80.253 1.00 56.30 O ATOM 3012 CB ASP B 163 16.090 5.810 80.432 1.00 62.27 C ATOM 3013 CG ASP B 163 14.895 5.993 79.521 1.00 66.60 C ATOM 3014 OD1 ASP B 163 13.827 5.425 79.841 1.00 68.84 O ATOM 3015 OD2 ASP B 163 15.015 6.686 78.487 1.00 68.40 O ATOM 0 H ASP B 163 17.053 6.133 78.190 1.00 56.87 H new ATOM 0 HA ASP B 163 17.109 7.634 80.325 1.00 59.06 H new ATOM 0 HB2 ASP B 163 16.376 4.884 80.399 1.00 62.27 H new ATOM 0 HB3 ASP B 163 15.823 5.992 81.347 1.00 62.27 H new ATOM 3016 N ASP B 164 18.551 6.527 82.097 1.00 59.11 N ATOM 3017 CA ASP B 164 19.634 6.088 82.965 1.00 60.44 C ATOM 3018 C ASP B 164 19.561 4.574 83.074 1.00 58.81 C ATOM 3019 O ASP B 164 20.583 3.889 83.082 1.00 58.92 O ATOM 3020 CB ASP B 164 19.472 6.704 84.354 1.00 63.26 C ATOM 3021 CG ASP B 164 19.272 8.202 84.301 1.00 67.49 C ATOM 3022 OD1 ASP B 164 20.219 8.914 83.899 1.00 68.97 O ATOM 3023 OD2 ASP B 164 18.165 8.668 84.652 1.00 70.02 O ATOM 0 H ASP B 164 17.963 7.016 82.490 1.00 59.11 H new ATOM 0 HA ASP B 164 20.488 6.365 82.599 1.00 60.44 H new ATOM 0 HB2 ASP B 164 18.714 6.295 84.800 1.00 63.26 H new ATOM 0 HB3 ASP B 164 20.257 6.504 84.887 1.00 63.26 H new ATOM 3024 N ALA B 165 18.337 4.061 83.159 1.00 57.07 N ATOM 3025 CA ALA B 165 18.111 2.627 83.268 1.00 55.68 C ATOM 3026 C ALA B 165 18.693 1.919 82.054 1.00 54.16 C ATOM 3027 O ALA B 165 19.394 0.918 82.184 1.00 53.68 O ATOM 3028 CB ALA B 165 16.619 2.339 83.380 1.00 55.84 C ATOM 0 H ALA B 165 17.618 4.533 83.155 1.00 57.07 H new ATOM 0 HA ALA B 165 18.552 2.297 84.066 1.00 55.68 H new ATOM 0 HB1 ALA B 165 16.478 1.382 83.452 1.00 55.84 H new ATOM 0 HB2 ALA B 165 16.263 2.778 84.168 1.00 55.84 H new ATOM 0 HB3 ALA B 165 16.165 2.674 82.591 1.00 55.84 H new ATOM 3029 N GLU B 166 18.401 2.446 80.870 1.00 52.58 N ATOM 3030 CA GLU B 166 18.918 1.852 79.649 1.00 51.90 C ATOM 3031 C GLU B 166 20.439 1.987 79.633 1.00 49.72 C ATOM 3032 O GLU B 166 21.145 1.098 79.158 1.00 48.42 O ATOM 3033 CB GLU B 166 18.329 2.546 78.423 1.00 52.46 C ATOM 3034 CG GLU B 166 18.405 1.698 77.170 1.00 54.98 C ATOM 3035 CD GLU B 166 17.946 2.436 75.929 1.00 56.93 C ATOM 3036 OE1 GLU B 166 17.054 3.306 76.043 1.00 58.20 O ATOM 3037 OE2 GLU B 166 18.471 2.132 74.838 1.00 57.46 O ATOM 0 H GLU B 166 17.909 3.142 80.754 1.00 52.58 H new ATOM 0 HA GLU B 166 18.668 0.915 79.622 1.00 51.90 H new ATOM 0 HB2 GLU B 166 17.402 2.772 78.599 1.00 52.46 H new ATOM 0 HB3 GLU B 166 18.800 3.380 78.272 1.00 52.46 H new ATOM 0 HG2 GLU B 166 19.319 1.398 77.043 1.00 54.98 H new ATOM 0 HG3 GLU B 166 17.860 0.904 77.289 1.00 54.98 H new ATOM 3038 N ALA B 167 20.936 3.102 80.164 1.00 48.06 N ATOM 3039 CA ALA B 167 22.372 3.353 80.216 1.00 47.58 C ATOM 3040 C ALA B 167 23.068 2.325 81.102 1.00 47.63 C ATOM 3041 O ALA B 167 24.066 1.725 80.703 1.00 47.13 O ATOM 3042 CB ALA B 167 22.642 4.762 80.736 1.00 45.71 C ATOM 0 H ALA B 167 20.454 3.729 80.501 1.00 48.06 H new ATOM 0 HA ALA B 167 22.728 3.275 79.317 1.00 47.58 H new ATOM 0 HB1 ALA B 167 23.599 4.918 80.766 1.00 45.71 H new ATOM 0 HB2 ALA B 167 22.228 5.410 80.145 1.00 45.71 H new ATOM 0 HB3 ALA B 167 22.271 4.855 81.628 1.00 45.71 H new ATOM 3043 N ARG B 168 22.540 2.119 82.304 1.00 48.43 N ATOM 3044 CA ARG B 168 23.133 1.156 83.228 1.00 49.57 C ATOM 3045 C ARG B 168 23.068 -0.249 82.652 1.00 47.46 C ATOM 3046 O ARG B 168 23.985 -1.048 82.816 1.00 48.10 O ATOM 3047 CB ARG B 168 22.416 1.198 84.583 1.00 52.31 C ATOM 3048 CG ARG B 168 22.739 2.430 85.418 1.00 56.60 C ATOM 3049 CD ARG B 168 22.134 2.334 86.818 1.00 61.81 C ATOM 3050 NE ARG B 168 20.695 2.589 86.828 1.00 64.37 N ATOM 3051 CZ ARG B 168 20.147 3.780 86.604 1.00 66.56 C ATOM 3052 NH1 ARG B 168 18.828 3.919 86.630 1.00 66.90 N ATOM 3053 NH2 ARG B 168 20.918 4.835 86.359 1.00 66.98 N ATOM 0 H ARG B 168 21.843 2.523 82.603 1.00 48.43 H new ATOM 0 HA ARG B 168 24.063 1.397 83.358 1.00 49.57 H new ATOM 0 HB2 ARG B 168 21.458 1.163 84.433 1.00 52.31 H new ATOM 0 HB3 ARG B 168 22.653 0.405 85.089 1.00 52.31 H new ATOM 0 HG2 ARG B 168 23.701 2.532 85.487 1.00 56.60 H new ATOM 0 HG3 ARG B 168 22.401 3.222 84.972 1.00 56.60 H new ATOM 0 HD2 ARG B 168 22.305 1.451 87.180 1.00 61.81 H new ATOM 0 HD3 ARG B 168 22.576 2.970 87.402 1.00 61.81 H new ATOM 0 HE ARG B 168 20.170 1.927 86.989 1.00 64.37 H new ATOM 0 HH11 ARG B 168 18.327 3.239 86.792 1.00 66.90 H new ATOM 0 HH12 ARG B 168 18.474 4.689 86.485 1.00 66.90 H new ATOM 0 HH21 ARG B 168 21.774 4.748 86.345 1.00 66.98 H new ATOM 0 HH22 ARG B 168 20.561 5.604 86.214 1.00 66.98 H new ATOM 3054 N ARG B 169 21.973 -0.540 81.970 1.00 45.68 N ATOM 3055 CA ARG B 169 21.771 -1.842 81.359 1.00 46.46 C ATOM 3056 C ARG B 169 22.896 -2.125 80.354 1.00 45.88 C ATOM 3057 O ARG B 169 23.436 -3.232 80.297 1.00 45.52 O ATOM 3058 CB ARG B 169 20.418 -1.841 80.651 1.00 48.19 C ATOM 3059 CG ARG B 169 19.759 -3.196 80.493 1.00 53.97 C ATOM 3060 CD ARG B 169 18.298 -2.994 80.107 1.00 55.09 C ATOM 3061 NE ARG B 169 17.624 -2.121 81.067 1.00 55.90 N ATOM 3062 CZ ARG B 169 16.726 -1.197 80.741 1.00 56.11 C ATOM 3063 NH1 ARG B 169 16.384 -1.018 79.474 1.00 56.21 N ATOM 3064 NH2 ARG B 169 16.178 -0.440 81.682 1.00 57.71 N ATOM 0 H ARG B 169 21.325 0.012 81.848 1.00 45.68 H new ATOM 0 HA ARG B 169 21.785 -2.535 82.037 1.00 46.46 H new ATOM 0 HB2 ARG B 169 19.815 -1.261 81.142 1.00 48.19 H new ATOM 0 HB3 ARG B 169 20.532 -1.451 79.770 1.00 48.19 H new ATOM 0 HG2 ARG B 169 20.217 -3.714 79.813 1.00 53.97 H new ATOM 0 HG3 ARG B 169 19.821 -3.697 81.321 1.00 53.97 H new ATOM 0 HD2 ARG B 169 18.244 -2.608 79.219 1.00 55.09 H new ATOM 0 HD3 ARG B 169 17.847 -3.852 80.071 1.00 55.09 H new ATOM 0 HE ARG B 169 17.822 -2.212 81.899 1.00 55.90 H new ATOM 0 HH11 ARG B 169 16.743 -1.500 78.859 1.00 56.21 H new ATOM 0 HH12 ARG B 169 15.803 -0.419 79.266 1.00 56.21 H new ATOM 0 HH21 ARG B 169 16.404 -0.546 82.505 1.00 57.71 H new ATOM 0 HH22 ARG B 169 15.597 0.157 81.469 1.00 57.71 H new ATOM 3065 N ALA B 170 23.247 -1.103 79.577 1.00 43.08 N ATOM 3066 CA ALA B 170 24.283 -1.195 78.552 1.00 41.28 C ATOM 3067 C ALA B 170 25.660 -1.648 79.035 1.00 40.39 C ATOM 3068 O ALA B 170 26.362 -2.370 78.330 1.00 39.48 O ATOM 3069 CB ALA B 170 24.410 0.151 77.842 1.00 38.86 C ATOM 0 H ALA B 170 22.884 -0.325 79.632 1.00 43.08 H new ATOM 0 HA ALA B 170 23.985 -1.897 77.953 1.00 41.28 H new ATOM 0 HB1 ALA B 170 25.098 0.094 77.160 1.00 38.86 H new ATOM 0 HB2 ALA B 170 23.563 0.380 77.428 1.00 38.86 H new ATOM 0 HB3 ALA B 170 24.650 0.835 78.486 1.00 38.86 H new ATOM 3070 N LEU B 171 26.048 -1.227 80.233 1.00 42.26 N ATOM 3071 CA LEU B 171 27.366 -1.570 80.762 1.00 44.08 C ATOM 3072 C LEU B 171 27.575 -3.004 81.232 1.00 43.68 C ATOM 3073 O LEU B 171 28.661 -3.348 81.685 1.00 45.08 O ATOM 3074 CB LEU B 171 27.739 -0.613 81.899 1.00 46.27 C ATOM 3075 CG LEU B 171 28.191 0.801 81.516 1.00 48.58 C ATOM 3076 CD1 LEU B 171 27.062 1.542 80.832 1.00 51.50 C ATOM 3077 CD2 LEU B 171 28.627 1.548 82.765 1.00 49.60 C ATOM 0 H LEU B 171 25.566 -0.743 80.756 1.00 42.26 H new ATOM 0 HA LEU B 171 27.949 -1.478 79.992 1.00 44.08 H new ATOM 0 HB2 LEU B 171 26.971 -0.533 82.486 1.00 46.27 H new ATOM 0 HB3 LEU B 171 28.450 -1.025 82.415 1.00 46.27 H new ATOM 0 HG LEU B 171 28.939 0.743 80.901 1.00 48.58 H new ATOM 0 HD11 LEU B 171 27.358 2.435 80.594 1.00 51.50 H new ATOM 0 HD12 LEU B 171 26.800 1.064 80.030 1.00 51.50 H new ATOM 0 HD13 LEU B 171 26.303 1.603 81.434 1.00 51.50 H new ATOM 0 HD21 LEU B 171 28.913 2.443 82.524 1.00 49.60 H new ATOM 0 HD22 LEU B 171 27.883 1.603 83.385 1.00 49.60 H new ATOM 0 HD23 LEU B 171 29.363 1.076 83.184 1.00 49.60 H new ATOM 3078 N ALA B 172 26.553 -3.842 81.114 1.00 44.17 N ATOM 3079 CA ALA B 172 26.664 -5.231 81.547 1.00 43.12 C ATOM 3080 C ALA B 172 27.585 -6.036 80.639 1.00 42.90 C ATOM 3081 O ALA B 172 27.903 -7.192 80.924 1.00 42.93 O ATOM 3082 CB ALA B 172 25.289 -5.874 81.593 1.00 43.62 C ATOM 0 H ALA B 172 25.787 -3.628 80.787 1.00 44.17 H new ATOM 0 HA ALA B 172 27.052 -5.231 82.436 1.00 43.12 H new ATOM 0 HB1 ALA B 172 25.372 -6.796 81.882 1.00 43.62 H new ATOM 0 HB2 ALA B 172 24.726 -5.390 82.217 1.00 43.62 H new ATOM 0 HB3 ALA B 172 24.889 -5.847 80.710 1.00 43.62 H new ATOM 3083 N SER B 173 28.002 -5.421 79.540 1.00 41.34 N ATOM 3084 CA SER B 173 28.890 -6.071 78.585 1.00 38.66 C ATOM 3085 C SER B 173 29.666 -5.017 77.811 1.00 37.17 C ATOM 3086 O SER B 173 29.230 -3.874 77.711 1.00 36.48 O ATOM 3087 CB SER B 173 28.092 -6.928 77.606 1.00 37.72 C ATOM 3088 OG SER B 173 28.944 -7.463 76.604 1.00 38.46 O ATOM 0 H SER B 173 27.780 -4.618 79.327 1.00 41.34 H new ATOM 0 HA SER B 173 29.504 -6.641 79.074 1.00 38.66 H new ATOM 0 HB2 SER B 173 27.652 -7.649 78.083 1.00 37.72 H new ATOM 0 HB3 SER B 173 27.395 -6.394 77.194 1.00 37.72 H new ATOM 0 HG SER B 173 28.493 -7.933 76.074 1.00 38.46 H new ATOM 3089 N LEU B 174 30.815 -5.406 77.273 1.00 36.16 N ATOM 3090 CA LEU B 174 31.631 -4.486 76.498 1.00 37.67 C ATOM 3091 C LEU B 174 31.724 -4.920 75.036 1.00 37.84 C ATOM 3092 O LEU B 174 32.528 -4.390 74.271 1.00 37.02 O ATOM 3093 CB LEU B 174 33.035 -4.367 77.106 1.00 38.74 C ATOM 3094 CG LEU B 174 33.121 -3.608 78.437 1.00 39.15 C ATOM 3095 CD1 LEU B 174 34.578 -3.455 78.857 1.00 37.79 C ATOM 3096 CD2 LEU B 174 32.466 -2.242 78.285 1.00 38.47 C ATOM 0 H LEU B 174 31.139 -6.199 77.346 1.00 36.16 H new ATOM 0 HA LEU B 174 31.202 -3.617 76.526 1.00 37.67 H new ATOM 0 HB2 LEU B 174 33.389 -5.260 77.238 1.00 38.74 H new ATOM 0 HB3 LEU B 174 33.612 -3.926 76.463 1.00 38.74 H new ATOM 0 HG LEU B 174 32.654 -4.108 79.125 1.00 39.15 H new ATOM 0 HD11 LEU B 174 34.624 -2.975 79.698 1.00 37.79 H new ATOM 0 HD12 LEU B 174 34.978 -4.332 78.964 1.00 37.79 H new ATOM 0 HD13 LEU B 174 35.061 -2.961 78.176 1.00 37.79 H new ATOM 0 HD21 LEU B 174 32.520 -1.762 79.126 1.00 38.47 H new ATOM 0 HD22 LEU B 174 32.925 -1.738 77.595 1.00 38.47 H new ATOM 0 HD23 LEU B 174 31.535 -2.355 78.037 1.00 38.47 H new ATOM 3097 N GLN B 175 30.898 -5.889 74.657 1.00 37.42 N ATOM 3098 CA GLN B 175 30.873 -6.380 73.282 1.00 36.66 C ATOM 3099 C GLN B 175 30.263 -5.276 72.416 1.00 34.09 C ATOM 3100 O GLN B 175 29.661 -4.336 72.932 1.00 33.74 O ATOM 3101 CB GLN B 175 30.003 -7.643 73.188 1.00 40.14 C ATOM 3102 CG GLN B 175 30.434 -8.783 74.098 1.00 46.09 C ATOM 3103 CD GLN B 175 31.397 -9.745 73.426 1.00 48.27 C ATOM 3104 OE1 GLN B 175 31.023 -10.471 72.500 1.00 50.07 O ATOM 3105 NE2 GLN B 175 32.643 -9.753 73.885 1.00 48.54 N ATOM 0 H GLN B 175 30.340 -6.278 75.184 1.00 37.42 H new ATOM 0 HA GLN B 175 31.769 -6.603 72.985 1.00 36.66 H new ATOM 0 HB2 GLN B 175 29.087 -7.406 73.400 1.00 40.14 H new ATOM 0 HB3 GLN B 175 30.010 -7.958 72.271 1.00 40.14 H new ATOM 0 HG2 GLN B 175 30.853 -8.416 74.892 1.00 46.09 H new ATOM 0 HG3 GLN B 175 29.649 -9.271 74.391 1.00 46.09 H new ATOM 0 HE21 GLN B 175 32.866 -9.232 74.532 1.00 48.54 H new ATOM 0 HE22 GLN B 175 33.227 -10.279 73.535 1.00 48.54 H new ATOM 3106 N PRO B 176 30.408 -5.378 71.088 1.00 32.80 N ATOM 3107 CA PRO B 176 29.859 -4.374 70.169 1.00 30.97 C ATOM 3108 C PRO B 176 28.390 -4.036 70.437 1.00 31.89 C ATOM 3109 O PRO B 176 27.547 -4.924 70.575 1.00 32.01 O ATOM 3110 CB PRO B 176 30.065 -5.018 68.805 1.00 31.06 C ATOM 3111 CG PRO B 176 31.356 -5.752 68.999 1.00 31.29 C ATOM 3112 CD PRO B 176 31.187 -6.392 70.356 1.00 30.71 C ATOM 0 HA PRO B 176 30.296 -3.513 70.261 1.00 30.97 H new ATOM 0 HB2 PRO B 176 29.338 -5.617 68.573 1.00 31.06 H new ATOM 0 HB3 PRO B 176 30.126 -4.358 68.097 1.00 31.06 H new ATOM 0 HG2 PRO B 176 31.499 -6.415 68.305 1.00 31.29 H new ATOM 0 HG3 PRO B 176 32.117 -5.151 68.978 1.00 31.29 H new ATOM 0 HD2 PRO B 176 30.717 -7.239 70.301 1.00 30.71 H new ATOM 0 HD3 PRO B 176 32.041 -6.569 70.781 1.00 30.71 H new ATOM 3113 N GLY B 177 28.092 -2.745 70.507 1.00 30.28 N ATOM 3114 CA GLY B 177 26.733 -2.312 70.756 1.00 30.30 C ATOM 3115 C GLY B 177 25.824 -2.497 69.559 1.00 31.07 C ATOM 3116 O GLY B 177 26.248 -2.327 68.410 1.00 29.26 O ATOM 0 H GLY B 177 28.663 -2.109 70.413 1.00 30.28 H new ATOM 0 HA2 GLY B 177 26.374 -2.808 71.508 1.00 30.30 H new ATOM 0 HA3 GLY B 177 26.739 -1.376 71.010 1.00 30.30 H new ATOM 3117 N GLN B 178 24.568 -2.841 69.826 1.00 31.32 N ATOM 3118 CA GLN B 178 23.596 -3.049 68.760 1.00 33.71 C ATOM 3119 C GLN B 178 22.405 -2.104 68.885 1.00 33.09 C ATOM 3120 O GLN B 178 21.330 -2.352 68.330 1.00 33.46 O ATOM 3121 CB GLN B 178 23.133 -4.499 68.773 1.00 35.69 C ATOM 3122 CG GLN B 178 24.266 -5.477 68.513 1.00 41.46 C ATOM 3123 CD GLN B 178 23.804 -6.915 68.552 1.00 43.96 C ATOM 3124 OE1 GLN B 178 22.650 -7.146 69.161 1.00 47.57 O flip ATOM 3125 NE2 GLN B 178 24.477 -7.811 68.046 1.00 47.17 N flip ATOM 0 H GLN B 178 24.259 -2.959 70.620 1.00 31.32 H new ATOM 0 HA GLN B 178 24.027 -2.853 67.913 1.00 33.71 H new ATOM 0 HB2 GLN B 178 22.729 -4.698 69.632 1.00 35.69 H new ATOM 0 HB3 GLN B 178 22.444 -4.621 68.101 1.00 35.69 H new ATOM 0 HG2 GLN B 178 24.660 -5.290 67.646 1.00 41.46 H new ATOM 0 HG3 GLN B 178 24.962 -5.345 69.175 1.00 41.46 H new ATOM 0 HE21 GLN B 178 25.222 -7.623 67.659 1.00 47.17 H new ATOM 0 HE22 GLN B 178 24.203 -8.626 68.079 1.00 47.17 H new ATOM 3126 N ALA B 179 22.625 -1.021 69.623 1.00 32.00 N ATOM 3127 CA ALA B 179 21.631 0.024 69.866 1.00 32.50 C ATOM 3128 C ALA B 179 22.461 1.226 70.319 1.00 32.85 C ATOM 3129 O ALA B 179 23.586 1.051 70.780 1.00 33.02 O ATOM 3130 CB ALA B 179 20.655 -0.406 70.966 1.00 33.54 C ATOM 0 H ALA B 179 23.378 -0.868 70.008 1.00 32.00 H new ATOM 0 HA ALA B 179 21.091 0.217 69.084 1.00 32.50 H new ATOM 0 HB1 ALA B 179 20.004 0.297 71.114 1.00 33.54 H new ATOM 0 HB2 ALA B 179 20.198 -1.217 70.694 1.00 33.54 H new ATOM 0 HB3 ALA B 179 21.145 -0.571 71.787 1.00 33.54 H new ATOM 3131 N THR B 180 21.909 2.429 70.199 1.00 32.31 N ATOM 3132 CA THR B 180 22.625 3.652 70.549 1.00 33.31 C ATOM 3133 C THR B 180 23.188 3.716 71.971 1.00 34.15 C ATOM 3134 O THR B 180 24.334 4.127 72.167 1.00 36.00 O ATOM 3135 CB THR B 180 21.734 4.902 70.291 1.00 34.02 C ATOM 3136 OG1 THR B 180 21.335 4.921 68.914 1.00 31.79 O ATOM 3137 CG2 THR B 180 22.502 6.195 70.582 1.00 33.20 C ATOM 0 H THR B 180 21.109 2.560 69.912 1.00 32.31 H new ATOM 0 HA THR B 180 23.400 3.644 69.966 1.00 33.31 H new ATOM 0 HB THR B 180 20.963 4.849 70.877 1.00 34.02 H new ATOM 0 HG1 THR B 180 20.853 5.594 68.771 1.00 31.79 H new ATOM 0 HG21 THR B 180 21.927 6.958 70.414 1.00 33.20 H new ATOM 0 HG22 THR B 180 22.785 6.202 71.510 1.00 33.20 H new ATOM 0 HG23 THR B 180 23.281 6.245 70.007 1.00 33.20 H new ATOM 3138 N ALA B 181 22.394 3.315 72.959 1.00 32.49 N ATOM 3139 CA ALA B 181 22.852 3.348 74.346 1.00 30.90 C ATOM 3140 C ALA B 181 24.001 2.370 74.553 1.00 29.61 C ATOM 3141 O ALA B 181 24.918 2.630 75.323 1.00 29.71 O ATOM 3142 CB ALA B 181 21.691 3.016 75.300 1.00 31.36 C ATOM 0 H ALA B 181 21.593 3.022 72.850 1.00 32.49 H new ATOM 0 HA ALA B 181 23.171 4.243 74.543 1.00 30.90 H new ATOM 0 HB1 ALA B 181 22.008 3.041 76.216 1.00 31.36 H new ATOM 0 HB2 ALA B 181 20.981 3.667 75.186 1.00 31.36 H new ATOM 0 HB3 ALA B 181 21.351 2.130 75.100 1.00 31.36 H new ATOM 3143 N GLU B 182 23.955 1.240 73.860 1.00 29.58 N ATOM 3144 CA GLU B 182 25.012 0.245 73.995 1.00 30.42 C ATOM 3145 C GLU B 182 26.328 0.713 73.365 1.00 30.08 C ATOM 3146 O GLU B 182 27.394 0.548 73.956 1.00 29.87 O ATOM 3147 CB GLU B 182 24.571 -1.086 73.369 1.00 31.39 C ATOM 3148 CG GLU B 182 23.412 -1.748 74.121 1.00 35.93 C ATOM 3149 CD GLU B 182 22.979 -3.088 73.526 1.00 37.19 C ATOM 3150 OE1 GLU B 182 22.139 -3.759 74.158 1.00 42.61 O ATOM 3151 OE2 GLU B 182 23.466 -3.476 72.442 1.00 36.31 O ATOM 0 H GLU B 182 23.327 1.030 73.311 1.00 29.58 H new ATOM 0 HA GLU B 182 25.172 0.119 74.943 1.00 30.42 H new ATOM 0 HB2 GLU B 182 24.307 -0.933 72.448 1.00 31.39 H new ATOM 0 HB3 GLU B 182 25.326 -1.694 73.350 1.00 31.39 H new ATOM 0 HG2 GLU B 182 23.672 -1.883 75.046 1.00 35.93 H new ATOM 0 HG3 GLU B 182 22.653 -1.144 74.125 1.00 35.93 H new ATOM 3152 N ALA B 183 26.246 1.302 72.174 1.00 28.23 N ATOM 3153 CA ALA B 183 27.432 1.779 71.472 1.00 28.24 C ATOM 3154 C ALA B 183 28.086 2.931 72.221 1.00 26.53 C ATOM 3155 O ALA B 183 29.301 2.960 72.385 1.00 27.66 O ATOM 3156 CB ALA B 183 27.064 2.225 70.054 1.00 27.27 C ATOM 0 H ALA B 183 25.507 1.435 71.754 1.00 28.23 H new ATOM 0 HA ALA B 183 28.066 1.046 71.424 1.00 28.24 H new ATOM 0 HB1 ALA B 183 27.859 2.540 69.597 1.00 27.27 H new ATOM 0 HB2 ALA B 183 26.687 1.476 69.567 1.00 27.27 H new ATOM 0 HB3 ALA B 183 26.412 2.942 70.099 1.00 27.27 H new ATOM 3157 N VAL B 184 27.268 3.875 72.671 1.00 26.25 N ATOM 3158 CA VAL B 184 27.757 5.037 73.399 1.00 27.36 C ATOM 3159 C VAL B 184 28.348 4.692 74.768 1.00 27.92 C ATOM 3160 O VAL B 184 29.492 5.039 75.055 1.00 28.63 O ATOM 3161 CB VAL B 184 26.623 6.086 73.586 1.00 27.81 C ATOM 3162 CG1 VAL B 184 27.105 7.238 74.459 1.00 25.00 C ATOM 3163 CG2 VAL B 184 26.177 6.608 72.230 1.00 26.39 C ATOM 0 H VAL B 184 26.415 3.860 72.563 1.00 26.25 H new ATOM 0 HA VAL B 184 28.472 5.405 72.857 1.00 27.36 H new ATOM 0 HB VAL B 184 25.871 5.660 74.026 1.00 27.81 H new ATOM 0 HG11 VAL B 184 26.389 7.884 74.567 1.00 25.00 H new ATOM 0 HG12 VAL B 184 27.367 6.898 75.329 1.00 25.00 H new ATOM 0 HG13 VAL B 184 27.866 7.667 74.038 1.00 25.00 H new ATOM 0 HG21 VAL B 184 25.470 7.261 72.351 1.00 26.39 H new ATOM 0 HG22 VAL B 184 26.929 7.025 71.780 1.00 26.39 H new ATOM 0 HG23 VAL B 184 25.847 5.871 71.692 1.00 26.39 H new ATOM 3164 N GLU B 185 27.573 4.018 75.615 1.00 27.83 N ATOM 3165 CA GLU B 185 28.055 3.662 76.952 1.00 28.71 C ATOM 3166 C GLU B 185 29.283 2.750 76.921 1.00 27.55 C ATOM 3167 O GLU B 185 30.224 2.939 77.688 1.00 28.53 O ATOM 3168 CB GLU B 185 26.944 2.987 77.769 1.00 31.50 C ATOM 3169 CG GLU B 185 25.783 3.900 78.146 1.00 34.81 C ATOM 3170 CD GLU B 185 26.212 5.067 79.023 1.00 38.21 C ATOM 3171 OE1 GLU B 185 26.874 4.835 80.059 1.00 40.48 O ATOM 3172 OE2 GLU B 185 25.880 6.220 78.681 1.00 39.29 O ATOM 0 H GLU B 185 26.772 3.759 75.439 1.00 27.83 H new ATOM 0 HA GLU B 185 28.318 4.495 77.373 1.00 28.71 H new ATOM 0 HB2 GLU B 185 26.597 2.237 77.262 1.00 31.50 H new ATOM 0 HB3 GLU B 185 27.332 2.625 78.581 1.00 31.50 H new ATOM 0 HG2 GLU B 185 25.371 4.243 77.338 1.00 34.81 H new ATOM 0 HG3 GLU B 185 25.108 3.382 78.611 1.00 34.81 H new ATOM 3173 N ARG B 186 29.278 1.756 76.043 1.00 27.01 N ATOM 3174 CA ARG B 186 30.416 0.848 75.962 1.00 27.91 C ATOM 3175 C ARG B 186 31.610 1.526 75.277 1.00 28.34 C ATOM 3176 O ARG B 186 32.762 1.266 75.618 1.00 27.05 O ATOM 3177 CB ARG B 186 30.013 -0.420 75.212 1.00 29.44 C ATOM 3178 CG ARG B 186 28.882 -1.182 75.885 1.00 29.50 C ATOM 3179 CD ARG B 186 28.419 -2.357 75.044 1.00 30.85 C ATOM 3180 NE ARG B 186 27.214 -2.974 75.594 1.00 33.40 N ATOM 3181 CZ ARG B 186 26.538 -3.958 75.005 1.00 34.21 C ATOM 3182 NH1 ARG B 186 26.946 -4.443 73.841 1.00 31.24 N ATOM 3183 NH2 ARG B 186 25.447 -4.452 75.578 1.00 33.41 N ATOM 0 H ARG B 186 28.638 1.590 75.493 1.00 27.01 H new ATOM 0 HA ARG B 186 30.688 0.609 76.862 1.00 27.91 H new ATOM 0 HB2 ARG B 186 29.744 -0.184 74.311 1.00 29.44 H new ATOM 0 HB3 ARG B 186 30.785 -1.002 75.134 1.00 29.44 H new ATOM 0 HG2 ARG B 186 29.177 -1.501 76.752 1.00 29.50 H new ATOM 0 HG3 ARG B 186 28.136 -0.582 76.042 1.00 29.50 H new ATOM 0 HD2 ARG B 186 28.245 -2.058 74.138 1.00 30.85 H new ATOM 0 HD3 ARG B 186 29.127 -3.018 74.993 1.00 30.85 H new ATOM 0 HE ARG B 186 26.922 -2.682 76.348 1.00 33.40 H new ATOM 0 HH11 ARG B 186 27.649 -4.122 73.464 1.00 31.24 H new ATOM 0 HH12 ARG B 186 26.508 -5.079 73.463 1.00 31.24 H new ATOM 0 HH21 ARG B 186 25.176 -4.136 76.331 1.00 33.41 H new ATOM 0 HH22 ARG B 186 25.011 -5.088 75.196 1.00 33.41 H new ATOM 3184 N GLY B 187 31.324 2.406 74.323 1.00 27.53 N ATOM 3185 CA GLY B 187 32.387 3.109 73.629 1.00 28.49 C ATOM 3186 C GLY B 187 33.156 3.972 74.608 1.00 27.33 C ATOM 3187 O GLY B 187 34.369 3.842 74.737 1.00 27.84 O ATOM 0 H GLY B 187 30.528 2.607 74.067 1.00 27.53 H new ATOM 0 HA2 GLY B 187 32.985 2.473 73.207 1.00 28.49 H new ATOM 0 HA3 GLY B 187 32.015 3.660 72.923 1.00 28.49 H new ATOM 3188 N CYS B 188 32.435 4.837 75.318 1.00 29.34 N ATOM 3189 CA CYS B 188 33.037 5.729 76.299 1.00 28.06 C ATOM 3190 C CYS B 188 33.768 4.985 77.413 1.00 28.84 C ATOM 3191 O CYS B 188 34.854 5.401 77.823 1.00 28.64 O ATOM 3192 CB CYS B 188 31.973 6.645 76.897 1.00 29.73 C ATOM 3193 SG CYS B 188 31.236 7.772 75.684 1.00 33.34 S ATOM 0 H CYS B 188 31.582 4.921 75.243 1.00 29.34 H new ATOM 0 HA CYS B 188 33.702 6.255 75.827 1.00 28.06 H new ATOM 0 HB2 CYS B 188 31.273 6.102 77.293 1.00 29.73 H new ATOM 0 HB3 CYS B 188 32.368 7.165 77.614 1.00 29.73 H new ATOM 0 HG CYS B 188 30.401 7.188 75.050 1.00 33.34 H new ATOM 3194 N LEU B 189 33.190 3.893 77.909 1.00 27.13 N ATOM 3195 CA LEU B 189 33.849 3.126 78.963 1.00 28.24 C ATOM 3196 C LEU B 189 35.130 2.479 78.435 1.00 29.25 C ATOM 3197 O LEU B 189 36.126 2.400 79.146 1.00 31.14 O ATOM 3198 CB LEU B 189 32.916 2.042 79.532 1.00 29.16 C ATOM 3199 CG LEU B 189 33.527 1.171 80.645 1.00 33.61 C ATOM 3200 CD1 LEU B 189 34.159 2.052 81.719 1.00 33.39 C ATOM 3201 CD2 LEU B 189 32.453 0.280 81.270 1.00 33.25 C ATOM 0 H LEU B 189 32.429 3.583 77.654 1.00 27.13 H new ATOM 0 HA LEU B 189 34.074 3.743 79.677 1.00 28.24 H new ATOM 0 HB2 LEU B 189 32.118 2.471 79.878 1.00 29.16 H new ATOM 0 HB3 LEU B 189 32.635 1.464 78.806 1.00 29.16 H new ATOM 0 HG LEU B 189 34.214 0.609 80.254 1.00 33.61 H new ATOM 0 HD11 LEU B 189 34.540 1.493 82.414 1.00 33.39 H new ATOM 0 HD12 LEU B 189 34.858 2.595 81.322 1.00 33.39 H new ATOM 0 HD13 LEU B 189 33.481 2.629 82.105 1.00 33.39 H new ATOM 0 HD21 LEU B 189 32.850 -0.263 81.969 1.00 33.25 H new ATOM 0 HD22 LEU B 189 31.753 0.834 81.650 1.00 33.25 H new ATOM 0 HD23 LEU B 189 32.074 -0.297 80.588 1.00 33.25 H new ATOM 3202 N LEU B 190 35.113 2.008 77.191 1.00 30.52 N ATOM 3203 CA LEU B 190 36.318 1.403 76.624 1.00 29.66 C ATOM 3204 C LEU B 190 37.381 2.479 76.446 1.00 28.97 C ATOM 3205 O LEU B 190 38.568 2.230 76.629 1.00 28.95 O ATOM 3206 CB LEU B 190 36.021 0.729 75.282 1.00 27.92 C ATOM 3207 CG LEU B 190 35.428 -0.670 75.431 1.00 28.68 C ATOM 3208 CD1 LEU B 190 34.942 -1.171 74.092 1.00 28.80 C ATOM 3209 CD2 LEU B 190 36.490 -1.611 76.020 1.00 30.24 C ATOM 0 H LEU B 190 34.431 2.027 76.668 1.00 30.52 H new ATOM 0 HA LEU B 190 36.639 0.720 77.233 1.00 29.66 H new ATOM 0 HB2 LEU B 190 35.405 1.283 74.778 1.00 27.92 H new ATOM 0 HB3 LEU B 190 36.840 0.674 74.766 1.00 27.92 H new ATOM 0 HG LEU B 190 34.668 -0.642 76.033 1.00 28.68 H new ATOM 0 HD11 LEU B 190 34.567 -2.060 74.195 1.00 28.80 H new ATOM 0 HD12 LEU B 190 34.261 -0.571 73.750 1.00 28.80 H new ATOM 0 HD13 LEU B 190 35.685 -1.205 73.470 1.00 28.80 H new ATOM 0 HD21 LEU B 190 36.116 -2.501 76.116 1.00 30.24 H new ATOM 0 HD22 LEU B 190 37.257 -1.645 75.427 1.00 30.24 H new ATOM 0 HD23 LEU B 190 36.768 -1.282 76.889 1.00 30.24 H new HETATM 3210 N MSE B 191 36.946 3.680 76.096 1.00 29.70 N HETATM 3211 CA MSE B 191 37.874 4.783 75.928 1.00 31.30 C HETATM 3212 C MSE B 191 38.489 5.088 77.304 1.00 32.32 C HETATM 3213 O MSE B 191 39.685 5.345 77.412 1.00 32.57 O HETATM 3214 CB MSE B 191 37.137 6.011 75.387 1.00 33.21 C HETATM 3215 CG MSE B 191 38.061 7.173 75.047 1.00 39.49 C HETATM 3216 SE MSE B 191 37.205 8.679 74.141 1.00 45.13 SE HETATM 3217 CE MSE B 191 37.850 8.314 72.344 1.00 40.36 C HETATM 0 H MSE B 191 36.121 3.876 75.952 1.00 29.70 H new HETATM 0 HA MSE B 191 38.570 4.551 75.293 1.00 31.30 H new HETATM 0 HB2 MSE B 191 36.642 5.758 74.592 1.00 33.21 H new HETATM 0 HB3 MSE B 191 36.487 6.305 76.045 1.00 33.21 H new HETATM 0 HG2 MSE B 191 38.467 7.496 75.867 1.00 39.49 H new HETATM 0 HG3 MSE B 191 38.780 6.843 74.486 1.00 39.49 H new HETATM 0 HE1 MSE B 191 37.511 8.988 71.735 1.00 40.36 H new HETATM 0 HE2 MSE B 191 38.820 8.332 72.338 1.00 40.36 H new HETATM 0 HE3 MSE B 191 37.542 7.439 72.061 1.00 40.36 H new ATOM 3218 N LEU B 192 37.664 5.040 78.349 1.00 29.76 N ATOM 3219 CA LEU B 192 38.125 5.307 79.704 1.00 32.32 C ATOM 3220 C LEU B 192 39.097 4.211 80.136 1.00 32.14 C ATOM 3221 O LEU B 192 40.185 4.492 80.642 1.00 32.15 O ATOM 3222 CB LEU B 192 36.938 5.352 80.675 1.00 33.31 C ATOM 3223 CG LEU B 192 37.210 5.833 82.108 1.00 35.84 C ATOM 3224 CD1 LEU B 192 37.420 7.344 82.090 1.00 37.57 C ATOM 3225 CD2 LEU B 192 36.037 5.491 83.025 1.00 33.15 C ATOM 0 H LEU B 192 36.827 4.853 78.290 1.00 29.76 H new ATOM 0 HA LEU B 192 38.573 6.167 79.719 1.00 32.32 H new ATOM 0 HB2 LEU B 192 36.259 5.928 80.290 1.00 33.31 H new ATOM 0 HB3 LEU B 192 36.559 4.461 80.726 1.00 33.31 H new ATOM 0 HG LEU B 192 38.003 5.388 82.446 1.00 35.84 H new ATOM 0 HD11 LEU B 192 37.593 7.658 82.992 1.00 37.57 H new ATOM 0 HD12 LEU B 192 38.177 7.559 81.523 1.00 37.57 H new ATOM 0 HD13 LEU B 192 36.624 7.777 81.744 1.00 37.57 H new ATOM 0 HD21 LEU B 192 36.227 5.802 83.924 1.00 33.15 H new ATOM 0 HD22 LEU B 192 35.233 5.923 82.697 1.00 33.15 H new ATOM 0 HD23 LEU B 192 35.905 4.530 83.037 1.00 33.15 H new ATOM 3226 N ARG B 193 38.701 2.962 79.931 1.00 29.92 N ATOM 3227 CA ARG B 193 39.545 1.836 80.303 1.00 30.48 C ATOM 3228 C ARG B 193 40.816 1.859 79.464 1.00 30.05 C ATOM 3229 O ARG B 193 41.874 1.432 79.922 1.00 30.73 O ATOM 3230 CB ARG B 193 38.784 0.518 80.105 1.00 27.65 C ATOM 3231 CG ARG B 193 37.568 0.376 81.034 1.00 28.51 C ATOM 3232 CD ARG B 193 36.718 -0.869 80.728 1.00 26.20 C ATOM 3233 NE ARG B 193 37.474 -2.108 80.891 1.00 26.45 N ATOM 3234 CZ ARG B 193 37.763 -2.668 82.062 1.00 27.65 C ATOM 3235 NH1 ARG B 193 38.461 -3.796 82.101 1.00 28.14 N ATOM 3236 NH2 ARG B 193 37.342 -2.118 83.194 1.00 28.15 N ATOM 0 H ARG B 193 37.947 2.745 79.578 1.00 29.92 H new ATOM 0 HA ARG B 193 39.787 1.906 81.240 1.00 30.48 H new ATOM 0 HB2 ARG B 193 38.488 0.457 79.183 1.00 27.65 H new ATOM 0 HB3 ARG B 193 39.389 -0.224 80.258 1.00 27.65 H new ATOM 0 HG2 ARG B 193 37.873 0.335 81.954 1.00 28.51 H new ATOM 0 HG3 ARG B 193 37.013 1.168 80.955 1.00 28.51 H new ATOM 0 HD2 ARG B 193 35.946 -0.884 81.315 1.00 26.20 H new ATOM 0 HD3 ARG B 193 36.382 -0.814 79.820 1.00 26.20 H new ATOM 0 HE ARG B 193 37.752 -2.503 80.180 1.00 26.45 H new ATOM 0 HH11 ARG B 193 38.726 -4.163 81.370 1.00 28.14 H new ATOM 0 HH12 ARG B 193 38.649 -4.160 82.857 1.00 28.14 H new ATOM 0 HH21 ARG B 193 36.878 -1.394 83.174 1.00 28.15 H new ATOM 0 HH22 ARG B 193 37.533 -2.486 83.948 1.00 28.15 H new ATOM 3237 N GLY B 194 40.704 2.380 78.242 1.00 30.33 N ATOM 3238 CA GLY B 194 41.852 2.459 77.353 1.00 27.76 C ATOM 3239 C GLY B 194 42.856 3.487 77.839 1.00 29.54 C ATOM 3240 O GLY B 194 44.069 3.258 77.797 1.00 29.91 O ATOM 0 H GLY B 194 39.973 2.691 77.913 1.00 30.33 H new ATOM 0 HA2 GLY B 194 42.279 1.590 77.294 1.00 27.76 H new ATOM 0 HA3 GLY B 194 41.556 2.691 76.459 1.00 27.76 H new ATOM 3241 N PHE B 195 42.349 4.621 78.313 1.00 27.90 N ATOM 3242 CA PHE B 195 43.206 5.689 78.817 1.00 28.15 C ATOM 3243 C PHE B 195 44.009 5.207 80.016 1.00 28.55 C ATOM 3244 O PHE B 195 45.201 5.497 80.134 1.00 29.13 O ATOM 3245 CB PHE B 195 42.364 6.902 79.215 1.00 26.37 C ATOM 3246 CG PHE B 195 43.154 7.998 79.875 1.00 27.28 C ATOM 3247 CD1 PHE B 195 43.083 8.190 81.255 1.00 25.14 C ATOM 3248 CD2 PHE B 195 43.968 8.842 79.118 1.00 26.91 C ATOM 3249 CE1 PHE B 195 43.808 9.206 81.877 1.00 27.18 C ATOM 3250 CE2 PHE B 195 44.704 9.868 79.728 1.00 28.36 C ATOM 3251 CZ PHE B 195 44.623 10.051 81.113 1.00 29.06 C ATOM 0 H PHE B 195 41.507 4.792 78.352 1.00 27.90 H new ATOM 0 HA PHE B 195 43.819 5.946 78.111 1.00 28.15 H new ATOM 0 HB2 PHE B 195 41.931 7.258 78.424 1.00 26.37 H new ATOM 0 HB3 PHE B 195 41.661 6.614 79.818 1.00 26.37 H new ATOM 0 HD1 PHE B 195 42.544 7.632 81.768 1.00 25.14 H new ATOM 0 HD2 PHE B 195 44.023 8.722 78.197 1.00 26.91 H new ATOM 0 HE1 PHE B 195 43.750 9.322 82.798 1.00 27.18 H new ATOM 0 HE2 PHE B 195 45.244 10.424 79.214 1.00 28.36 H new ATOM 0 HZ PHE B 195 45.108 10.730 81.524 1.00 29.06 H new ATOM 3252 N VAL B 196 43.346 4.468 80.902 1.00 27.99 N ATOM 3253 CA VAL B 196 43.990 3.939 82.092 1.00 25.58 C ATOM 3254 C VAL B 196 45.121 2.968 81.738 1.00 26.15 C ATOM 3255 O VAL B 196 46.167 2.974 82.388 1.00 27.98 O ATOM 3256 CB VAL B 196 42.953 3.248 83.010 1.00 25.24 C ATOM 3257 CG1 VAL B 196 43.646 2.542 84.157 1.00 25.30 C ATOM 3258 CG2 VAL B 196 41.990 4.290 83.561 1.00 25.30 C ATOM 0 H VAL B 196 42.514 4.262 80.828 1.00 27.99 H new ATOM 0 HA VAL B 196 44.382 4.687 82.569 1.00 25.58 H new ATOM 0 HB VAL B 196 42.464 2.591 82.490 1.00 25.24 H new ATOM 0 HG11 VAL B 196 42.983 2.115 84.722 1.00 25.30 H new ATOM 0 HG12 VAL B 196 44.252 1.871 83.806 1.00 25.30 H new ATOM 0 HG13 VAL B 196 44.147 3.188 84.679 1.00 25.30 H new ATOM 0 HG21 VAL B 196 41.340 3.858 84.136 1.00 25.30 H new ATOM 0 HG22 VAL B 196 42.485 4.950 84.071 1.00 25.30 H new ATOM 0 HG23 VAL B 196 41.531 4.727 82.827 1.00 25.30 H new ATOM 3259 N ARG B 197 44.923 2.137 80.719 1.00 26.95 N ATOM 3260 CA ARG B 197 45.978 1.201 80.311 1.00 30.72 C ATOM 3261 C ARG B 197 47.175 1.953 79.721 1.00 29.46 C ATOM 3262 O ARG B 197 48.315 1.519 79.867 1.00 31.10 O ATOM 3263 CB ARG B 197 45.459 0.180 79.286 1.00 32.61 C ATOM 3264 CG ARG B 197 44.550 -0.878 79.896 1.00 39.43 C ATOM 3265 CD ARG B 197 44.187 -1.982 78.907 1.00 40.49 C ATOM 3266 NE ARG B 197 43.574 -3.118 79.599 1.00 44.44 N ATOM 3267 CZ ARG B 197 42.265 -3.329 79.694 1.00 44.56 C ATOM 3268 NH1 ARG B 197 41.408 -2.489 79.135 1.00 46.85 N ATOM 3269 NH2 ARG B 197 41.810 -4.372 80.373 1.00 49.00 N ATOM 0 H ARG B 197 44.200 2.095 80.255 1.00 26.95 H new ATOM 0 HA ARG B 197 46.261 0.724 81.107 1.00 30.72 H new ATOM 0 HB2 ARG B 197 44.976 0.649 78.588 1.00 32.61 H new ATOM 0 HB3 ARG B 197 46.215 -0.257 78.863 1.00 32.61 H new ATOM 0 HG2 ARG B 197 44.989 -1.271 80.667 1.00 39.43 H new ATOM 0 HG3 ARG B 197 43.738 -0.456 80.216 1.00 39.43 H new ATOM 0 HD2 ARG B 197 43.574 -1.636 78.239 1.00 40.49 H new ATOM 0 HD3 ARG B 197 44.983 -2.275 78.437 1.00 40.49 H new ATOM 0 HE ARG B 197 44.098 -3.689 79.970 1.00 44.44 H new ATOM 0 HH11 ARG B 197 41.697 -1.801 78.707 1.00 46.85 H new ATOM 0 HH12 ARG B 197 40.562 -2.631 79.200 1.00 46.85 H new ATOM 0 HH21 ARG B 197 42.362 -4.912 80.752 1.00 49.00 H new ATOM 0 HH22 ARG B 197 40.963 -4.509 80.435 1.00 49.00 H new ATOM 3270 N GLU B 198 46.912 3.072 79.051 1.00 28.70 N ATOM 3271 CA GLU B 198 47.991 3.879 78.477 1.00 28.55 C ATOM 3272 C GLU B 198 48.781 4.491 79.632 1.00 28.99 C ATOM 3273 O GLU B 198 50.011 4.498 79.615 1.00 29.18 O ATOM 3274 CB GLU B 198 47.432 5.010 77.604 1.00 29.23 C ATOM 3275 CG GLU B 198 46.833 4.587 76.271 1.00 32.65 C ATOM 3276 CD GLU B 198 47.874 4.091 75.280 1.00 36.31 C ATOM 3277 OE1 GLU B 198 48.992 4.646 75.252 1.00 38.46 O ATOM 3278 OE2 GLU B 198 47.572 3.154 74.515 1.00 39.01 O ATOM 0 H GLU B 198 46.121 3.382 78.917 1.00 28.70 H new ATOM 0 HA GLU B 198 48.552 3.316 77.921 1.00 28.55 H new ATOM 0 HB2 GLU B 198 46.751 5.479 78.110 1.00 29.23 H new ATOM 0 HB3 GLU B 198 48.145 5.645 77.432 1.00 29.23 H new ATOM 0 HG2 GLU B 198 46.180 3.886 76.424 1.00 32.65 H new ATOM 0 HG3 GLU B 198 46.357 5.338 75.883 1.00 32.65 H new ATOM 3279 N GLN B 199 48.064 5.006 80.632 1.00 28.29 N ATOM 3280 CA GLN B 199 48.708 5.610 81.795 1.00 28.76 C ATOM 3281 C GLN B 199 49.581 4.586 82.504 1.00 28.58 C ATOM 3282 O GLN B 199 50.704 4.881 82.876 1.00 29.43 O ATOM 3283 CB GLN B 199 47.664 6.179 82.774 1.00 29.09 C ATOM 3284 CG GLN B 199 46.954 7.433 82.270 1.00 28.31 C ATOM 3285 CD GLN B 199 47.921 8.569 81.969 1.00 32.03 C ATOM 3286 OE1 GLN B 199 48.683 8.979 82.973 1.00 35.40 O flip ATOM 3287 NE2 GLN B 199 47.982 9.072 80.842 1.00 28.28 N flip ATOM 0 H GLN B 199 47.204 5.015 80.655 1.00 28.29 H new ATOM 0 HA GLN B 199 49.264 6.342 81.484 1.00 28.76 H new ATOM 0 HB2 GLN B 199 47.001 5.495 82.957 1.00 29.09 H new ATOM 0 HB3 GLN B 199 48.101 6.383 83.615 1.00 29.09 H new ATOM 0 HG2 GLN B 199 46.453 7.217 81.468 1.00 28.31 H new ATOM 0 HG3 GLN B 199 46.312 7.727 82.935 1.00 28.31 H new ATOM 0 HE21 GLN B 199 47.472 8.781 80.213 1.00 28.28 H new ATOM 0 HE22 GLN B 199 48.534 9.713 80.686 1.00 28.28 H new ATOM 3288 N TYR B 200 49.073 3.376 82.684 1.00 32.33 N ATOM 3289 CA TYR B 200 49.861 2.339 83.338 1.00 33.69 C ATOM 3290 C TYR B 200 51.139 2.045 82.545 1.00 34.83 C ATOM 3291 O TYR B 200 52.208 1.846 83.130 1.00 33.47 O ATOM 3292 CB TYR B 200 49.044 1.057 83.490 1.00 37.07 C ATOM 3293 CG TYR B 200 49.850 -0.071 84.077 1.00 40.59 C ATOM 3294 CD1 TYR B 200 50.351 -1.093 83.274 1.00 42.35 C ATOM 3295 CD2 TYR B 200 50.157 -0.090 85.433 1.00 43.34 C ATOM 3296 CE1 TYR B 200 51.143 -2.108 83.814 1.00 45.89 C ATOM 3297 CE2 TYR B 200 50.945 -1.092 85.980 1.00 44.95 C ATOM 3298 CZ TYR B 200 51.437 -2.095 85.170 1.00 45.93 C ATOM 3299 OH TYR B 200 52.246 -3.067 85.721 1.00 50.78 O ATOM 0 H TYR B 200 48.285 3.135 82.439 1.00 32.33 H new ATOM 0 HA TYR B 200 50.106 2.664 84.219 1.00 33.69 H new ATOM 0 HB2 TYR B 200 48.276 1.231 84.056 1.00 37.07 H new ATOM 0 HB3 TYR B 200 48.702 0.790 82.623 1.00 37.07 H new ATOM 0 HD1 TYR B 200 50.155 -1.099 82.365 1.00 42.35 H new ATOM 0 HD2 TYR B 200 49.827 0.583 85.984 1.00 43.34 H new ATOM 0 HE1 TYR B 200 51.471 -2.787 83.270 1.00 45.89 H new ATOM 0 HE2 TYR B 200 51.141 -1.088 86.889 1.00 44.95 H new ATOM 0 HH TYR B 200 52.332 -2.926 86.545 1.00 50.78 H new ATOM 3300 N ALA B 201 51.021 2.010 81.217 1.00 34.75 N ATOM 3301 CA ALA B 201 52.178 1.763 80.352 1.00 35.10 C ATOM 3302 C ALA B 201 53.168 2.922 80.478 1.00 34.73 C ATOM 3303 O ALA B 201 54.368 2.706 80.573 1.00 35.64 O ATOM 3304 CB ALA B 201 51.742 1.613 78.879 1.00 33.40 C ATOM 0 H ALA B 201 50.280 2.127 80.796 1.00 34.75 H new ATOM 0 HA ALA B 201 52.601 0.937 80.633 1.00 35.10 H new ATOM 0 HB1 ALA B 201 52.522 1.451 78.325 1.00 33.40 H new ATOM 0 HB2 ALA B 201 51.127 0.867 78.798 1.00 33.40 H new ATOM 0 HB3 ALA B 201 51.303 2.427 78.587 1.00 33.40 H new HETATM 3305 N MSE B 202 52.662 4.151 80.487 1.00 34.76 N HETATM 3306 CA MSE B 202 53.535 5.318 80.599 1.00 34.69 C HETATM 3307 C MSE B 202 54.282 5.323 81.937 1.00 35.16 C HETATM 3308 O MSE B 202 55.442 5.729 82.008 1.00 34.44 O HETATM 3309 CB MSE B 202 52.722 6.613 80.459 1.00 34.30 C HETATM 3310 CG MSE B 202 53.564 7.885 80.464 1.00 38.15 C HETATM 3311 SE MSE B 202 54.596 8.141 78.820 1.00 45.68 SE HETATM 3312 CE MSE B 202 56.044 6.901 79.171 1.00 45.01 C HETATM 0 H MSE B 202 51.823 4.332 80.430 1.00 34.76 H new HETATM 0 HA MSE B 202 54.186 5.269 79.881 1.00 34.69 H new HETATM 0 HB2 MSE B 202 52.215 6.577 79.633 1.00 34.30 H new HETATM 0 HB3 MSE B 202 52.080 6.660 81.185 1.00 34.30 H new HETATM 0 HG2 MSE B 202 52.982 8.650 80.595 1.00 38.15 H new HETATM 0 HG3 MSE B 202 54.172 7.859 81.219 1.00 38.15 H new HETATM 0 HE1 MSE B 202 56.665 6.909 78.426 1.00 45.01 H new HETATM 0 HE2 MSE B 202 56.508 7.166 79.980 1.00 45.01 H new HETATM 0 HE3 MSE B 202 55.685 6.007 79.283 1.00 45.01 H new ATOM 3313 N ALA B 203 53.614 4.859 82.990 1.00 34.02 N ATOM 3314 CA ALA B 203 54.214 4.818 84.316 1.00 34.13 C ATOM 3315 C ALA B 203 55.307 3.759 84.409 1.00 35.16 C ATOM 3316 O ALA B 203 56.371 4.004 84.980 1.00 35.75 O ATOM 3317 CB ALA B 203 53.145 4.563 85.371 1.00 32.72 C ATOM 0 H ALA B 203 52.808 4.562 82.955 1.00 34.02 H new ATOM 0 HA ALA B 203 54.625 5.681 84.479 1.00 34.13 H new ATOM 0 HB1 ALA B 203 53.556 4.538 86.249 1.00 32.72 H new ATOM 0 HB2 ALA B 203 52.486 5.275 85.343 1.00 32.72 H new ATOM 0 HB3 ALA B 203 52.711 3.714 85.193 1.00 32.72 H new ATOM 3318 N CYS B 204 55.047 2.581 83.858 1.00 36.24 N ATOM 3319 CA CYS B 204 56.042 1.516 83.889 1.00 39.72 C ATOM 3320 C CYS B 204 57.298 2.016 83.187 1.00 41.94 C ATOM 3321 O CYS B 204 58.417 1.678 83.568 1.00 42.19 O ATOM 3322 CB CYS B 204 55.526 0.263 83.166 1.00 39.39 C ATOM 3323 SG CYS B 204 54.174 -0.620 84.009 1.00 45.59 S ATOM 0 H CYS B 204 54.309 2.378 83.465 1.00 36.24 H new ATOM 0 HA CYS B 204 56.230 1.281 84.811 1.00 39.72 H new ATOM 0 HB2 CYS B 204 55.223 0.520 82.281 1.00 39.39 H new ATOM 0 HB3 CYS B 204 56.267 -0.351 83.045 1.00 39.39 H new ATOM 0 HG CYS B 204 53.342 -0.940 83.205 1.00 45.59 H new ATOM 3324 N GLU B 205 57.089 2.845 82.170 1.00 42.90 N ATOM 3325 CA GLU B 205 58.168 3.394 81.366 1.00 44.44 C ATOM 3326 C GLU B 205 59.017 4.441 82.080 1.00 43.70 C ATOM 3327 O GLU B 205 60.241 4.336 82.125 1.00 42.49 O ATOM 3328 CB GLU B 205 57.582 4.015 80.097 1.00 47.81 C ATOM 3329 CG GLU B 205 58.541 4.078 78.930 1.00 54.96 C ATOM 3330 CD GLU B 205 58.840 2.703 78.367 1.00 59.96 C ATOM 3331 OE1 GLU B 205 59.480 1.895 79.078 1.00 63.09 O ATOM 3332 OE2 GLU B 205 58.423 2.425 77.219 1.00 61.53 O ATOM 0 H GLU B 205 56.307 3.106 81.926 1.00 42.90 H new ATOM 0 HA GLU B 205 58.759 2.651 81.167 1.00 44.44 H new ATOM 0 HB2 GLU B 205 56.801 3.505 79.832 1.00 47.81 H new ATOM 0 HB3 GLU B 205 57.278 4.914 80.301 1.00 47.81 H new ATOM 0 HG2 GLU B 205 58.164 4.637 78.233 1.00 54.96 H new ATOM 0 HG3 GLU B 205 59.368 4.497 79.214 1.00 54.96 H new ATOM 3333 N LEU B 206 58.361 5.454 82.633 1.00 41.72 N ATOM 3334 CA LEU B 206 59.068 6.539 83.298 1.00 40.12 C ATOM 3335 C LEU B 206 59.356 6.314 84.780 1.00 39.90 C ATOM 3336 O LEU B 206 60.303 6.885 85.320 1.00 40.14 O ATOM 3337 CB LEU B 206 58.275 7.840 83.129 1.00 39.34 C ATOM 3338 CG LEU B 206 57.780 8.153 81.709 1.00 41.24 C ATOM 3339 CD1 LEU B 206 56.922 9.406 81.726 1.00 36.94 C ATOM 3340 CD2 LEU B 206 58.960 8.326 80.767 1.00 39.90 C ATOM 0 H LEU B 206 57.504 5.532 82.634 1.00 41.72 H new ATOM 0 HA LEU B 206 59.936 6.586 82.867 1.00 40.12 H new ATOM 0 HB2 LEU B 206 57.506 7.807 83.720 1.00 39.34 H new ATOM 0 HB3 LEU B 206 58.831 8.577 83.427 1.00 39.34 H new ATOM 0 HG LEU B 206 57.242 7.412 81.390 1.00 41.24 H new ATOM 0 HD11 LEU B 206 56.612 9.599 80.827 1.00 36.94 H new ATOM 0 HD12 LEU B 206 56.158 9.268 82.308 1.00 36.94 H new ATOM 0 HD13 LEU B 206 57.447 10.153 82.054 1.00 36.94 H new ATOM 0 HD21 LEU B 206 58.636 8.523 79.874 1.00 39.90 H new ATOM 0 HD22 LEU B 206 59.517 9.057 81.077 1.00 39.90 H new ATOM 0 HD23 LEU B 206 59.482 7.508 80.748 1.00 39.90 H new ATOM 3341 N LEU B 207 58.549 5.483 85.432 1.00 38.29 N ATOM 3342 CA LEU B 207 58.704 5.229 86.859 1.00 37.78 C ATOM 3343 C LEU B 207 59.230 3.854 87.238 1.00 39.12 C ATOM 3344 O LEU B 207 59.796 3.683 88.314 1.00 38.92 O ATOM 3345 CB LEU B 207 57.363 5.443 87.562 1.00 36.43 C ATOM 3346 CG LEU B 207 56.665 6.771 87.290 1.00 34.33 C ATOM 3347 CD1 LEU B 207 55.387 6.851 88.118 1.00 33.67 C ATOM 3348 CD2 LEU B 207 57.610 7.918 87.637 1.00 36.09 C ATOM 0 H LEU B 207 57.901 5.054 85.063 1.00 38.29 H new ATOM 0 HA LEU B 207 59.384 5.858 87.147 1.00 37.78 H new ATOM 0 HB2 LEU B 207 56.765 4.725 87.302 1.00 36.43 H new ATOM 0 HB3 LEU B 207 57.504 5.363 88.518 1.00 36.43 H new ATOM 0 HG LEU B 207 56.429 6.837 86.352 1.00 34.33 H new ATOM 0 HD11 LEU B 207 54.942 7.696 87.946 1.00 33.67 H new ATOM 0 HD12 LEU B 207 54.798 6.120 87.875 1.00 33.67 H new ATOM 0 HD13 LEU B 207 55.607 6.788 89.061 1.00 33.67 H new ATOM 0 HD21 LEU B 207 57.169 8.764 87.465 1.00 36.09 H new ATOM 0 HD22 LEU B 207 57.853 7.865 88.575 1.00 36.09 H new ATOM 0 HD23 LEU B 207 58.410 7.854 87.092 1.00 36.09 H new ATOM 3349 N GLY B 208 59.033 2.876 86.361 1.00 40.80 N ATOM 3350 CA GLY B 208 59.464 1.520 86.643 1.00 43.06 C ATOM 3351 C GLY B 208 58.217 0.682 86.858 1.00 45.70 C ATOM 3352 O GLY B 208 57.191 1.219 87.260 1.00 44.89 O ATOM 0 H GLY B 208 58.651 2.980 85.597 1.00 40.80 H new ATOM 0 HA2 GLY B 208 59.989 1.169 85.907 1.00 43.06 H new ATOM 0 HA3 GLY B 208 60.030 1.498 87.431 1.00 43.06 H new ATOM 3353 N PRO B 209 58.259 -0.631 86.592 1.00 49.39 N ATOM 3354 CA PRO B 209 57.087 -1.496 86.776 1.00 51.34 C ATOM 3355 C PRO B 209 56.714 -1.651 88.244 1.00 52.69 C ATOM 3356 O PRO B 209 55.673 -2.219 88.576 1.00 52.60 O ATOM 3357 CB PRO B 209 57.536 -2.823 86.164 1.00 51.33 C ATOM 3358 CG PRO B 209 58.563 -2.411 85.154 1.00 51.93 C ATOM 3359 CD PRO B 209 59.340 -1.363 85.912 1.00 51.25 C ATOM 0 HA PRO B 209 56.287 -1.136 86.362 1.00 51.34 H new ATOM 0 HB2 PRO B 209 57.911 -3.417 86.833 1.00 51.33 H new ATOM 0 HB3 PRO B 209 56.796 -3.294 85.750 1.00 51.33 H new ATOM 0 HG2 PRO B 209 59.124 -3.154 84.882 1.00 51.93 H new ATOM 0 HG3 PRO B 209 58.158 -2.052 84.349 1.00 51.93 H new ATOM 0 HD2 PRO B 209 59.966 -1.756 86.540 1.00 51.25 H new ATOM 0 HD3 PRO B 209 59.853 -0.790 85.321 1.00 51.25 H new ATOM 3360 N ASP B 210 57.577 -1.131 89.110 1.00 53.82 N ATOM 3361 CA ASP B 210 57.402 -1.208 90.557 1.00 55.83 C ATOM 3362 C ASP B 210 56.557 -0.082 91.180 1.00 54.10 C ATOM 3363 O ASP B 210 56.192 -0.159 92.354 1.00 54.21 O ATOM 3364 CB ASP B 210 58.794 -1.240 91.206 1.00 59.09 C ATOM 3365 CG ASP B 210 58.746 -1.175 92.720 1.00 63.43 C ATOM 3366 OD1 ASP B 210 58.092 -2.046 93.338 1.00 66.84 O ATOM 3367 OD2 ASP B 210 59.371 -0.253 93.294 1.00 64.74 O ATOM 0 H ASP B 210 58.292 -0.717 88.870 1.00 53.82 H new ATOM 0 HA ASP B 210 56.896 -2.017 90.731 1.00 55.83 H new ATOM 0 HB2 ASP B 210 59.252 -2.052 90.937 1.00 59.09 H new ATOM 0 HB3 ASP B 210 59.318 -0.495 90.872 1.00 59.09 H new ATOM 3368 N CYS B 211 56.231 0.946 90.401 1.00 51.08 N ATOM 3369 CA CYS B 211 55.470 2.084 90.921 1.00 47.87 C ATOM 3370 C CYS B 211 54.117 1.753 91.554 1.00 44.37 C ATOM 3371 O CYS B 211 53.445 0.806 91.160 1.00 42.72 O ATOM 3372 CB CYS B 211 55.258 3.125 89.818 1.00 48.77 C ATOM 3373 SG CYS B 211 53.965 2.697 88.641 1.00 53.20 S ATOM 0 H CYS B 211 56.440 1.006 89.569 1.00 51.08 H new ATOM 0 HA CYS B 211 56.019 2.426 91.643 1.00 47.87 H new ATOM 0 HB2 CYS B 211 55.040 3.976 90.228 1.00 48.77 H new ATOM 0 HB3 CYS B 211 56.092 3.247 89.337 1.00 48.77 H new ATOM 0 HG CYS B 211 53.381 1.721 89.025 1.00 53.20 H new ATOM 3374 N GLU B 212 53.731 2.545 92.548 1.00 42.90 N ATOM 3375 CA GLU B 212 52.451 2.363 93.227 1.00 41.41 C ATOM 3376 C GLU B 212 51.370 3.077 92.426 1.00 39.89 C ATOM 3377 O GLU B 212 51.611 4.141 91.849 1.00 39.02 O ATOM 3378 CB GLU B 212 52.494 2.952 94.642 1.00 41.95 C ATOM 3379 CG GLU B 212 53.361 2.183 95.622 1.00 45.80 C ATOM 3380 CD GLU B 212 52.939 0.735 95.742 1.00 48.65 C ATOM 3381 OE1 GLU B 212 51.743 0.486 96.008 1.00 50.56 O ATOM 3382 OE2 GLU B 212 53.799 -0.154 95.568 1.00 50.98 O ATOM 0 H GLU B 212 54.200 3.200 92.848 1.00 42.90 H new ATOM 0 HA GLU B 212 52.262 1.414 93.293 1.00 41.41 H new ATOM 0 HB2 GLU B 212 52.818 3.865 94.590 1.00 41.95 H new ATOM 0 HB3 GLU B 212 51.590 2.991 94.991 1.00 41.95 H new ATOM 0 HG2 GLU B 212 54.287 2.226 95.335 1.00 45.80 H new ATOM 0 HG3 GLU B 212 53.314 2.605 96.494 1.00 45.80 H new ATOM 3383 N ILE B 213 50.180 2.494 92.395 1.00 36.43 N ATOM 3384 CA ILE B 213 49.076 3.092 91.665 1.00 34.09 C ATOM 3385 C ILE B 213 47.958 3.497 92.620 1.00 32.52 C ATOM 3386 O ILE B 213 47.525 2.708 93.458 1.00 31.60 O ATOM 3387 CB ILE B 213 48.514 2.112 90.625 1.00 34.92 C ATOM 3388 CG1 ILE B 213 49.645 1.639 89.707 1.00 35.06 C ATOM 3389 CG2 ILE B 213 47.407 2.790 89.822 1.00 35.55 C ATOM 3390 CD1 ILE B 213 49.256 0.508 88.796 1.00 36.75 C ATOM 0 H ILE B 213 49.992 1.753 92.790 1.00 36.43 H new ATOM 0 HA ILE B 213 49.416 3.879 91.212 1.00 34.09 H new ATOM 0 HB ILE B 213 48.135 1.339 91.073 1.00 34.92 H new ATOM 0 HG12 ILE B 213 49.947 2.387 89.169 1.00 35.06 H new ATOM 0 HG13 ILE B 213 50.397 1.360 90.252 1.00 35.06 H new ATOM 0 HG21 ILE B 213 47.055 2.168 89.166 1.00 35.55 H new ATOM 0 HG22 ILE B 213 46.695 3.066 90.421 1.00 35.55 H new ATOM 0 HG23 ILE B 213 47.766 3.568 89.368 1.00 35.55 H new ATOM 0 HD11 ILE B 213 50.015 0.260 88.246 1.00 36.75 H new ATOM 0 HD12 ILE B 213 48.979 -0.255 89.327 1.00 36.75 H new ATOM 0 HD13 ILE B 213 48.522 0.788 88.227 1.00 36.75 H new ATOM 3391 N PHE B 214 47.492 4.731 92.482 1.00 31.84 N ATOM 3392 CA PHE B 214 46.417 5.250 93.323 1.00 30.36 C ATOM 3393 C PHE B 214 45.250 5.665 92.439 1.00 28.57 C ATOM 3394 O PHE B 214 45.435 6.362 91.445 1.00 29.82 O ATOM 3395 CB PHE B 214 46.902 6.467 94.124 1.00 30.95 C ATOM 3396 CG PHE B 214 47.919 6.137 95.189 1.00 31.87 C ATOM 3397 CD1 PHE B 214 47.541 6.037 96.525 1.00 33.17 C ATOM 3398 CD2 PHE B 214 49.256 5.931 94.855 1.00 31.99 C ATOM 3399 CE1 PHE B 214 48.484 5.736 97.521 1.00 33.87 C ATOM 3400 CE2 PHE B 214 50.207 5.630 95.841 1.00 32.78 C ATOM 3401 CZ PHE B 214 49.821 5.533 97.175 1.00 33.48 C ATOM 0 H PHE B 214 47.788 5.291 91.901 1.00 31.84 H new ATOM 0 HA PHE B 214 46.139 4.558 93.943 1.00 30.36 H new ATOM 0 HB2 PHE B 214 47.287 7.113 93.511 1.00 30.95 H new ATOM 0 HB3 PHE B 214 46.137 6.893 94.541 1.00 30.95 H new ATOM 0 HD1 PHE B 214 46.652 6.171 96.761 1.00 33.17 H new ATOM 0 HD2 PHE B 214 49.521 5.994 93.966 1.00 31.99 H new ATOM 0 HE1 PHE B 214 48.218 5.672 98.410 1.00 33.87 H new ATOM 0 HE2 PHE B 214 51.096 5.495 95.603 1.00 32.78 H new ATOM 0 HZ PHE B 214 50.449 5.334 97.831 1.00 33.48 H new ATOM 3402 N LEU B 215 44.053 5.213 92.791 1.00 28.35 N ATOM 3403 CA LEU B 215 42.854 5.564 92.046 1.00 27.72 C ATOM 3404 C LEU B 215 41.895 6.274 92.991 1.00 27.05 C ATOM 3405 O LEU B 215 41.711 5.851 94.135 1.00 29.36 O ATOM 3406 CB LEU B 215 42.176 4.313 91.476 1.00 28.17 C ATOM 3407 CG LEU B 215 42.983 3.428 90.528 1.00 29.76 C ATOM 3408 CD1 LEU B 215 42.074 2.342 89.949 1.00 28.05 C ATOM 3409 CD2 LEU B 215 43.589 4.277 89.416 1.00 26.90 C ATOM 0 H LEU B 215 43.914 4.697 93.465 1.00 28.35 H new ATOM 0 HA LEU B 215 43.096 6.140 91.304 1.00 27.72 H new ATOM 0 HB2 LEU B 215 41.889 3.764 92.223 1.00 28.17 H new ATOM 0 HB3 LEU B 215 41.375 4.596 91.008 1.00 28.17 H new ATOM 0 HG LEU B 215 43.706 3.002 91.014 1.00 29.76 H new ATOM 0 HD11 LEU B 215 42.585 1.779 89.347 1.00 28.05 H new ATOM 0 HD12 LEU B 215 41.716 1.801 90.670 1.00 28.05 H new ATOM 0 HD13 LEU B 215 41.344 2.756 89.463 1.00 28.05 H new ATOM 0 HD21 LEU B 215 44.100 3.710 88.818 1.00 26.90 H new ATOM 0 HD22 LEU B 215 42.880 4.714 88.919 1.00 26.90 H new ATOM 0 HD23 LEU B 215 44.173 4.948 89.803 1.00 26.90 H new ATOM 3410 N THR B 216 41.307 7.368 92.525 1.00 25.70 N ATOM 3411 CA THR B 216 40.361 8.126 93.329 1.00 25.68 C ATOM 3412 C THR B 216 39.239 8.548 92.384 1.00 24.80 C ATOM 3413 O THR B 216 39.268 8.205 91.202 1.00 26.53 O ATOM 3414 CB THR B 216 41.049 9.364 94.020 1.00 28.45 C ATOM 3415 OG1 THR B 216 40.156 9.936 94.988 1.00 27.47 O ATOM 3416 CG2 THR B 216 41.437 10.424 93.001 1.00 24.95 C ATOM 0 H THR B 216 41.444 7.690 91.739 1.00 25.70 H new ATOM 0 HA THR B 216 40.012 7.589 94.057 1.00 25.68 H new ATOM 0 HB THR B 216 41.857 9.052 94.457 1.00 28.45 H new ATOM 0 HG1 THR B 216 40.204 9.501 95.705 1.00 27.47 H new ATOM 0 HG21 THR B 216 41.857 11.171 93.455 1.00 24.95 H new ATOM 0 HG22 THR B 216 42.059 10.045 92.360 1.00 24.95 H new ATOM 0 HG23 THR B 216 40.643 10.733 92.537 1.00 24.95 H new ATOM 3417 N GLY B 217 38.243 9.260 92.891 1.00 26.15 N ATOM 3418 CA GLY B 217 37.134 9.656 92.038 1.00 26.96 C ATOM 3419 C GLY B 217 36.012 8.622 92.065 1.00 30.31 C ATOM 3420 O GLY B 217 36.248 7.429 92.319 1.00 28.66 O ATOM 0 H GLY B 217 38.189 9.520 93.709 1.00 26.15 H new ATOM 0 HA2 GLY B 217 36.791 10.515 92.329 1.00 26.96 H new ATOM 0 HA3 GLY B 217 37.449 9.770 91.128 1.00 26.96 H new ATOM 3421 N GLY B 218 34.793 9.076 91.782 1.00 31.19 N ATOM 3422 CA GLY B 218 33.641 8.187 91.805 1.00 32.85 C ATOM 3423 C GLY B 218 33.615 7.058 90.790 1.00 35.14 C ATOM 3424 O GLY B 218 32.969 6.032 91.026 1.00 37.13 O ATOM 0 H GLY B 218 34.615 9.892 91.576 1.00 31.19 H new ATOM 0 HA2 GLY B 218 33.581 7.796 92.691 1.00 32.85 H new ATOM 0 HA3 GLY B 218 32.844 8.725 91.677 1.00 32.85 H new ATOM 3425 N ASP B 219 34.307 7.224 89.666 1.00 32.08 N ATOM 3426 CA ASP B 219 34.314 6.193 88.640 1.00 31.17 C ATOM 3427 C ASP B 219 35.511 5.260 88.718 1.00 30.37 C ATOM 3428 O ASP B 219 35.833 4.579 87.751 1.00 31.17 O ATOM 3429 CB ASP B 219 34.247 6.835 87.250 1.00 36.35 C ATOM 3430 CG ASP B 219 32.844 7.310 86.890 1.00 40.36 C ATOM 3431 OD1 ASP B 219 32.700 8.069 85.906 1.00 42.27 O ATOM 3432 OD2 ASP B 219 31.881 6.920 87.586 1.00 44.96 O ATOM 0 H ASP B 219 34.775 7.922 89.481 1.00 32.08 H new ATOM 0 HA ASP B 219 33.528 5.647 88.800 1.00 31.17 H new ATOM 0 HB2 ASP B 219 34.858 7.587 87.215 1.00 36.35 H new ATOM 0 HB3 ASP B 219 34.548 6.194 86.587 1.00 36.35 H new ATOM 3433 N ALA B 220 36.170 5.214 89.868 1.00 30.36 N ATOM 3434 CA ALA B 220 37.332 4.343 90.024 1.00 31.24 C ATOM 3435 C ALA B 220 36.948 2.870 89.881 1.00 32.84 C ATOM 3436 O ALA B 220 37.718 2.059 89.361 1.00 32.15 O ATOM 3437 CB ALA B 220 37.985 4.579 91.385 1.00 31.08 C ATOM 0 H ALA B 220 35.965 5.673 90.566 1.00 30.36 H new ATOM 0 HA ALA B 220 37.963 4.560 89.320 1.00 31.24 H new ATOM 0 HB1 ALA B 220 38.755 3.997 91.480 1.00 31.08 H new ATOM 0 HB2 ALA B 220 38.269 5.504 91.452 1.00 31.08 H new ATOM 0 HB3 ALA B 220 37.346 4.386 92.089 1.00 31.08 H new ATOM 3438 N GLU B 221 35.749 2.526 90.332 1.00 33.31 N ATOM 3439 CA GLU B 221 35.299 1.144 90.259 1.00 36.17 C ATOM 3440 C GLU B 221 35.204 0.602 88.827 1.00 34.33 C ATOM 3441 O GLU B 221 35.412 -0.591 88.596 1.00 35.44 O ATOM 3442 CB GLU B 221 33.944 0.998 90.963 1.00 39.94 C ATOM 3443 CG GLU B 221 33.763 -0.362 91.614 1.00 47.39 C ATOM 3444 CD GLU B 221 34.807 -0.635 92.688 1.00 50.52 C ATOM 3445 OE1 GLU B 221 35.147 -1.823 92.893 1.00 54.91 O ATOM 3446 OE2 GLU B 221 35.283 0.332 93.333 1.00 53.26 O ATOM 0 H GLU B 221 35.185 3.073 90.681 1.00 33.31 H new ATOM 0 HA GLU B 221 35.974 0.612 90.709 1.00 36.17 H new ATOM 0 HB2 GLU B 221 33.859 1.689 91.638 1.00 39.94 H new ATOM 0 HB3 GLU B 221 33.233 1.141 90.319 1.00 39.94 H new ATOM 0 HG2 GLU B 221 32.878 -0.415 92.006 1.00 47.39 H new ATOM 0 HG3 GLU B 221 33.814 -1.052 90.934 1.00 47.39 H new ATOM 3447 N LEU B 222 34.896 1.474 87.871 1.00 32.23 N ATOM 3448 CA LEU B 222 34.776 1.064 86.469 1.00 31.52 C ATOM 3449 C LEU B 222 36.098 0.615 85.841 1.00 30.92 C ATOM 3450 O LEU B 222 36.103 -0.056 84.799 1.00 29.95 O ATOM 3451 CB LEU B 222 34.219 2.211 85.621 1.00 31.61 C ATOM 3452 CG LEU B 222 32.890 2.872 86.010 1.00 34.78 C ATOM 3453 CD1 LEU B 222 32.631 4.055 85.084 1.00 33.95 C ATOM 3454 CD2 LEU B 222 31.754 1.866 85.918 1.00 34.49 C ATOM 0 H LEU B 222 34.752 2.310 88.011 1.00 32.23 H new ATOM 0 HA LEU B 222 34.174 0.303 86.477 1.00 31.52 H new ATOM 0 HB2 LEU B 222 34.893 2.908 85.599 1.00 31.61 H new ATOM 0 HB3 LEU B 222 34.123 1.880 84.714 1.00 31.61 H new ATOM 0 HG LEU B 222 32.941 3.187 86.926 1.00 34.78 H new ATOM 0 HD11 LEU B 222 31.792 4.477 85.325 1.00 33.95 H new ATOM 0 HD12 LEU B 222 33.352 4.698 85.170 1.00 33.95 H new ATOM 0 HD13 LEU B 222 32.584 3.744 84.166 1.00 33.95 H new ATOM 0 HD21 LEU B 222 30.920 2.295 86.166 1.00 34.49 H new ATOM 0 HD22 LEU B 222 31.688 1.534 85.009 1.00 34.49 H new ATOM 0 HD23 LEU B 222 31.928 1.126 86.520 1.00 34.49 H new ATOM 3455 N VAL B 223 37.218 0.970 86.464 1.00 30.02 N ATOM 3456 CA VAL B 223 38.510 0.624 85.891 1.00 29.68 C ATOM 3457 C VAL B 223 39.484 -0.136 86.781 1.00 30.85 C ATOM 3458 O VAL B 223 40.506 -0.614 86.294 1.00 32.63 O ATOM 3459 CB VAL B 223 39.232 1.901 85.397 1.00 30.20 C ATOM 3460 CG1 VAL B 223 38.319 2.691 84.479 1.00 28.77 C ATOM 3461 CG2 VAL B 223 39.665 2.759 86.595 1.00 24.84 C ATOM 0 H VAL B 223 37.251 1.404 87.206 1.00 30.02 H new ATOM 0 HA VAL B 223 38.273 0.013 85.176 1.00 29.68 H new ATOM 0 HB VAL B 223 40.024 1.645 84.899 1.00 30.20 H new ATOM 0 HG11 VAL B 223 38.778 3.489 84.174 1.00 28.77 H new ATOM 0 HG12 VAL B 223 38.078 2.145 83.714 1.00 28.77 H new ATOM 0 HG13 VAL B 223 37.516 2.945 84.961 1.00 28.77 H new ATOM 0 HG21 VAL B 223 40.116 3.556 86.276 1.00 24.84 H new ATOM 0 HG22 VAL B 223 38.883 3.014 87.110 1.00 24.84 H new ATOM 0 HG23 VAL B 223 40.269 2.249 87.157 1.00 24.84 H new ATOM 3462 N ARG B 224 39.177 -0.257 88.070 1.00 31.03 N ATOM 3463 CA ARG B 224 40.090 -0.916 88.999 1.00 31.32 C ATOM 3464 C ARG B 224 40.457 -2.364 88.685 1.00 32.19 C ATOM 3465 O ARG B 224 41.538 -2.819 89.060 1.00 32.37 O ATOM 3466 CB ARG B 224 39.559 -0.816 90.436 1.00 33.91 C ATOM 3467 CG ARG B 224 38.305 -1.627 90.743 1.00 35.50 C ATOM 3468 CD ARG B 224 37.963 -1.549 92.237 1.00 38.50 C ATOM 3469 NE ARG B 224 39.003 -2.140 93.084 1.00 42.91 N ATOM 3470 CZ ARG B 224 39.045 -2.041 94.415 1.00 43.83 C ATOM 3471 NH1 ARG B 224 40.028 -2.620 95.095 1.00 40.85 N ATOM 3472 NH2 ARG B 224 38.110 -1.357 95.069 1.00 41.48 N ATOM 0 H ARG B 224 38.450 0.034 88.425 1.00 31.03 H new ATOM 0 HA ARG B 224 40.920 -0.425 88.892 1.00 31.32 H new ATOM 0 HB2 ARG B 224 40.262 -1.098 91.042 1.00 33.91 H new ATOM 0 HB3 ARG B 224 39.375 0.116 90.630 1.00 33.91 H new ATOM 0 HG2 ARG B 224 37.561 -1.293 90.218 1.00 35.50 H new ATOM 0 HG3 ARG B 224 38.441 -2.552 90.485 1.00 35.50 H new ATOM 0 HD2 ARG B 224 37.835 -0.621 92.488 1.00 38.50 H new ATOM 0 HD3 ARG B 224 37.122 -2.005 92.397 1.00 38.50 H new ATOM 0 HE ARG B 224 39.631 -2.582 92.696 1.00 42.91 H new ATOM 0 HH11 ARG B 224 40.639 -3.059 94.678 1.00 40.85 H new ATOM 0 HH12 ARG B 224 40.054 -2.556 95.952 1.00 40.85 H new ATOM 0 HH21 ARG B 224 37.474 -0.975 94.635 1.00 41.48 H new ATOM 0 HH22 ARG B 224 38.142 -1.297 95.926 1.00 41.48 H new ATOM 3473 N ASP B 225 39.576 -3.091 88.004 1.00 32.26 N ATOM 3474 CA ASP B 225 39.868 -4.482 87.670 1.00 35.96 C ATOM 3475 C ASP B 225 41.081 -4.560 86.748 1.00 37.45 C ATOM 3476 O ASP B 225 41.759 -5.579 86.688 1.00 40.32 O ATOM 3477 CB ASP B 225 38.671 -5.137 86.980 1.00 35.85 C ATOM 3478 CG ASP B 225 38.339 -4.481 85.665 1.00 35.41 C ATOM 3479 OD1 ASP B 225 37.780 -3.364 85.687 1.00 37.06 O ATOM 3480 OD2 ASP B 225 38.653 -5.073 84.612 1.00 35.23 O ATOM 0 H ASP B 225 38.814 -2.803 87.729 1.00 32.26 H new ATOM 0 HA ASP B 225 40.056 -4.955 88.496 1.00 35.96 H new ATOM 0 HB2 ASP B 225 38.860 -6.077 86.831 1.00 35.85 H new ATOM 0 HB3 ASP B 225 37.899 -5.092 87.565 1.00 35.85 H new ATOM 3481 N GLU B 226 41.349 -3.480 86.024 1.00 40.07 N ATOM 3482 CA GLU B 226 42.490 -3.446 85.117 1.00 42.68 C ATOM 3483 C GLU B 226 43.813 -3.401 85.882 1.00 42.58 C ATOM 3484 O GLU B 226 44.864 -3.733 85.332 1.00 42.70 O ATOM 3485 CB GLU B 226 42.422 -2.214 84.217 1.00 43.61 C ATOM 3486 CG GLU B 226 41.144 -2.040 83.432 1.00 42.70 C ATOM 3487 CD GLU B 226 41.158 -0.749 82.637 1.00 43.48 C ATOM 3488 OE1 GLU B 226 42.070 -0.572 81.797 1.00 42.95 O ATOM 3489 OE2 GLU B 226 40.265 0.092 82.858 1.00 45.23 O ATOM 0 H GLU B 226 40.884 -2.757 86.043 1.00 40.07 H new ATOM 0 HA GLU B 226 42.452 -4.256 84.585 1.00 42.68 H new ATOM 0 HB2 GLU B 226 42.553 -1.426 84.767 1.00 43.61 H new ATOM 0 HB3 GLU B 226 43.163 -2.250 83.592 1.00 43.61 H new ATOM 0 HG2 GLU B 226 41.027 -2.792 82.830 1.00 42.70 H new ATOM 0 HG3 GLU B 226 40.387 -2.041 84.038 1.00 42.70 H new ATOM 3490 N LEU B 227 43.756 -2.982 87.144 1.00 42.51 N ATOM 3491 CA LEU B 227 44.951 -2.864 87.979 1.00 42.37 C ATOM 3492 C LEU B 227 44.708 -3.450 89.364 1.00 41.41 C ATOM 3493 O LEU B 227 44.545 -2.719 90.344 1.00 40.76 O ATOM 3494 CB LEU B 227 45.334 -1.389 88.107 1.00 42.23 C ATOM 3495 CG LEU B 227 45.461 -0.654 86.772 1.00 42.57 C ATOM 3496 CD1 LEU B 227 45.518 0.844 87.004 1.00 43.28 C ATOM 3497 CD2 LEU B 227 46.702 -1.148 86.040 1.00 43.95 C ATOM 0 H LEU B 227 43.026 -2.759 87.540 1.00 42.51 H new ATOM 0 HA LEU B 227 45.672 -3.360 87.560 1.00 42.37 H new ATOM 0 HB2 LEU B 227 44.668 -0.939 88.650 1.00 42.23 H new ATOM 0 HB3 LEU B 227 46.178 -1.325 88.581 1.00 42.23 H new ATOM 0 HG LEU B 227 44.684 -0.838 86.221 1.00 42.57 H new ATOM 0 HD11 LEU B 227 45.598 1.301 86.152 1.00 43.28 H new ATOM 0 HD12 LEU B 227 44.707 1.134 87.450 1.00 43.28 H new ATOM 0 HD13 LEU B 227 46.285 1.057 87.558 1.00 43.28 H new ATOM 0 HD21 LEU B 227 46.785 -0.683 85.193 1.00 43.95 H new ATOM 0 HD22 LEU B 227 47.488 -0.975 86.582 1.00 43.95 H new ATOM 0 HD23 LEU B 227 46.625 -2.101 85.879 1.00 43.95 H new ATOM 3498 N ALA B 228 44.695 -4.774 89.435 1.00 42.98 N ATOM 3499 CA ALA B 228 44.448 -5.490 90.686 1.00 43.04 C ATOM 3500 C ALA B 228 45.192 -4.920 91.887 1.00 41.90 C ATOM 3501 O ALA B 228 44.642 -4.852 92.988 1.00 43.54 O ATOM 3502 CB ALA B 228 44.798 -6.967 90.511 1.00 44.72 C ATOM 0 H ALA B 228 44.829 -5.287 88.758 1.00 42.98 H new ATOM 0 HA ALA B 228 43.504 -5.380 90.879 1.00 43.04 H new ATOM 0 HB1 ALA B 228 44.633 -7.439 91.342 1.00 44.72 H new ATOM 0 HB2 ALA B 228 44.249 -7.349 89.808 1.00 44.72 H new ATOM 0 HB3 ALA B 228 45.734 -7.052 90.271 1.00 44.72 H new ATOM 3503 N GLY B 229 46.438 -4.506 91.681 1.00 40.94 N ATOM 3504 CA GLY B 229 47.215 -3.966 92.785 1.00 40.36 C ATOM 3505 C GLY B 229 46.935 -2.513 93.129 1.00 39.85 C ATOM 3506 O GLY B 229 47.477 -1.985 94.104 1.00 39.87 O ATOM 0 H GLY B 229 46.844 -4.529 90.923 1.00 40.94 H new ATOM 0 HA2 GLY B 229 47.049 -4.507 93.573 1.00 40.36 H new ATOM 0 HA3 GLY B 229 48.157 -4.057 92.572 1.00 40.36 H new ATOM 3507 N ALA B 230 46.085 -1.866 92.339 1.00 38.15 N ATOM 3508 CA ALA B 230 45.759 -0.465 92.560 1.00 37.92 C ATOM 3509 C ALA B 230 45.179 -0.191 93.938 1.00 38.13 C ATOM 3510 O ALA B 230 44.456 -1.010 94.504 1.00 38.41 O ATOM 3511 CB ALA B 230 44.797 0.018 91.500 1.00 37.37 C ATOM 0 H ALA B 230 45.685 -2.223 91.667 1.00 38.15 H new ATOM 0 HA ALA B 230 46.596 0.022 92.504 1.00 37.92 H new ATOM 0 HB1 ALA B 230 44.586 0.952 91.656 1.00 37.37 H new ATOM 0 HB2 ALA B 230 45.204 -0.080 90.625 1.00 37.37 H new ATOM 0 HB3 ALA B 230 43.983 -0.508 91.538 1.00 37.37 H new ATOM 3512 N ARG B 231 45.505 0.979 94.468 1.00 37.08 N ATOM 3513 CA ARG B 231 45.014 1.395 95.766 1.00 37.30 C ATOM 3514 C ARG B 231 43.885 2.400 95.539 1.00 36.10 C ATOM 3515 O ARG B 231 44.113 3.522 95.087 1.00 35.23 O ATOM 3516 CB ARG B 231 46.173 2.004 96.558 1.00 38.38 C ATOM 3517 CG ARG B 231 47.326 1.016 96.672 1.00 45.56 C ATOM 3518 CD ARG B 231 48.657 1.661 96.982 1.00 47.71 C ATOM 3519 NE ARG B 231 48.736 2.154 98.351 1.00 49.45 N ATOM 3520 CZ ARG B 231 49.693 1.810 99.203 1.00 49.10 C ATOM 3521 NH1 ARG B 231 49.698 2.307 100.430 1.00 50.16 N ATOM 3522 NH2 ARG B 231 50.639 0.959 98.828 1.00 51.01 N ATOM 0 H ARG B 231 46.017 1.553 94.083 1.00 37.08 H new ATOM 0 HA ARG B 231 44.666 0.648 96.278 1.00 37.30 H new ATOM 0 HB2 ARG B 231 46.478 2.815 96.122 1.00 38.38 H new ATOM 0 HB3 ARG B 231 45.868 2.256 97.444 1.00 38.38 H new ATOM 0 HG2 ARG B 231 47.120 0.371 97.366 1.00 45.56 H new ATOM 0 HG3 ARG B 231 47.401 0.523 95.840 1.00 45.56 H new ATOM 0 HD2 ARG B 231 49.367 1.017 96.832 1.00 47.71 H new ATOM 0 HD3 ARG B 231 48.807 2.397 96.368 1.00 47.71 H new ATOM 0 HE ARG B 231 48.128 2.699 98.622 1.00 49.45 H new ATOM 0 HH11 ARG B 231 49.081 2.853 100.675 1.00 50.16 H new ATOM 0 HH12 ARG B 231 50.319 2.084 100.982 1.00 50.16 H new ATOM 0 HH21 ARG B 231 50.632 0.631 98.033 1.00 51.01 H new ATOM 0 HH22 ARG B 231 51.260 0.736 99.380 1.00 51.01 H new ATOM 3523 N ILE B 232 42.659 1.978 95.825 1.00 35.98 N ATOM 3524 CA ILE B 232 41.500 2.839 95.648 1.00 35.37 C ATOM 3525 C ILE B 232 41.280 3.671 96.904 1.00 35.37 C ATOM 3526 O ILE B 232 41.068 3.141 97.994 1.00 35.38 O ATOM 3527 CB ILE B 232 40.231 2.007 95.309 1.00 35.36 C ATOM 3528 CG1 ILE B 232 40.319 1.475 93.871 1.00 35.82 C ATOM 3529 CG2 ILE B 232 38.987 2.880 95.393 1.00 35.50 C ATOM 3530 CD1 ILE B 232 41.575 0.674 93.552 1.00 34.07 C ATOM 0 H ILE B 232 42.478 1.192 96.124 1.00 35.98 H new ATOM 0 HA ILE B 232 41.668 3.434 94.901 1.00 35.37 H new ATOM 0 HB ILE B 232 40.177 1.276 95.945 1.00 35.36 H new ATOM 0 HG12 ILE B 232 39.544 0.917 93.700 1.00 35.82 H new ATOM 0 HG13 ILE B 232 40.268 2.226 93.260 1.00 35.82 H new ATOM 0 HG21 ILE B 232 38.204 2.349 95.179 1.00 35.50 H new ATOM 0 HG22 ILE B 232 38.901 3.236 96.291 1.00 35.50 H new ATOM 0 HG23 ILE B 232 39.062 3.613 94.762 1.00 35.50 H new ATOM 0 HD11 ILE B 232 41.545 0.380 92.628 1.00 34.07 H new ATOM 0 HD12 ILE B 232 42.357 1.231 93.689 1.00 34.07 H new ATOM 0 HD13 ILE B 232 41.623 -0.099 94.136 1.00 34.07 H new HETATM 3531 N MSE B 233 41.341 4.986 96.744 1.00 35.39 N HETATM 3532 CA MSE B 233 41.176 5.889 97.868 1.00 36.64 C HETATM 3533 C MSE B 233 40.263 7.071 97.546 1.00 35.57 C HETATM 3534 O MSE B 233 40.702 8.110 97.060 1.00 32.15 O HETATM 3535 CB MSE B 233 42.551 6.372 98.327 1.00 40.21 C HETATM 3536 CG MSE B 233 43.426 5.248 98.893 1.00 45.18 C HETATM 3537 SE MSE B 233 45.080 5.901 99.635 1.00 56.86 SE HETATM 3538 CE MSE B 233 44.327 6.788 101.187 1.00 51.19 C HETATM 0 H MSE B 233 41.478 5.375 95.989 1.00 35.39 H new HETATM 0 HA MSE B 233 40.741 5.400 98.584 1.00 36.64 H new HETATM 0 HB2 MSE B 233 43.009 6.785 97.578 1.00 40.21 H new HETATM 0 HB3 MSE B 233 42.438 7.058 99.004 1.00 40.21 H new HETATM 0 HG2 MSE B 233 42.932 4.773 99.580 1.00 45.18 H new HETATM 0 HG3 MSE B 233 43.621 4.609 98.190 1.00 45.18 H new HETATM 0 HE1 MSE B 233 45.039 7.194 101.705 1.00 51.19 H new HETATM 0 HE2 MSE B 233 43.706 7.475 100.898 1.00 51.19 H new HETATM 0 HE3 MSE B 233 43.858 6.139 101.735 1.00 51.19 H new ATOM 3539 N PRO B 234 38.964 6.915 97.818 1.00 36.96 N ATOM 3540 CA PRO B 234 37.972 7.964 97.560 1.00 36.95 C ATOM 3541 C PRO B 234 38.315 9.297 98.223 1.00 36.11 C ATOM 3542 O PRO B 234 37.971 10.356 97.703 1.00 35.27 O ATOM 3543 CB PRO B 234 36.682 7.363 98.122 1.00 36.13 C ATOM 3544 CG PRO B 234 36.883 5.889 97.911 1.00 37.32 C ATOM 3545 CD PRO B 234 38.319 5.694 98.336 1.00 37.34 C ATOM 0 HA PRO B 234 37.916 8.191 96.619 1.00 36.95 H new ATOM 0 HB2 PRO B 234 36.563 7.579 99.060 1.00 36.13 H new ATOM 0 HB3 PRO B 234 35.898 7.690 97.653 1.00 36.13 H new ATOM 0 HG2 PRO B 234 36.272 5.360 98.448 1.00 37.32 H new ATOM 0 HG3 PRO B 234 36.742 5.634 96.986 1.00 37.32 H new ATOM 0 HD2 PRO B 234 38.405 5.619 99.299 1.00 37.34 H new ATOM 0 HD3 PRO B 234 38.704 4.890 97.954 1.00 37.34 H new ATOM 3546 N ASP B 235 39.002 9.241 99.362 1.00 34.06 N ATOM 3547 CA ASP B 235 39.347 10.451 100.095 1.00 32.60 C ATOM 3548 C ASP B 235 40.797 10.931 99.985 1.00 31.82 C ATOM 3549 O ASP B 235 41.261 11.699 100.831 1.00 29.80 O ATOM 3550 CB ASP B 235 38.978 10.261 101.571 1.00 36.31 C ATOM 3551 CG ASP B 235 37.467 10.262 101.806 1.00 40.58 C ATOM 3552 OD1 ASP B 235 37.047 10.035 102.959 1.00 44.64 O ATOM 3553 OD2 ASP B 235 36.699 10.497 100.846 1.00 41.27 O ATOM 0 H ASP B 235 39.277 8.511 99.725 1.00 34.06 H new ATOM 0 HA ASP B 235 38.832 11.155 99.670 1.00 32.60 H new ATOM 0 HB2 ASP B 235 39.350 9.423 101.888 1.00 36.31 H new ATOM 0 HB3 ASP B 235 39.384 10.969 102.096 1.00 36.31 H new ATOM 3554 N LEU B 236 41.500 10.496 98.945 1.00 28.87 N ATOM 3555 CA LEU B 236 42.901 10.872 98.736 1.00 30.23 C ATOM 3556 C LEU B 236 43.159 12.376 98.896 1.00 29.11 C ATOM 3557 O LEU B 236 44.109 12.780 99.564 1.00 28.99 O ATOM 3558 CB LEU B 236 43.367 10.446 97.337 1.00 29.27 C ATOM 3559 CG LEU B 236 44.728 9.751 97.159 1.00 34.38 C ATOM 3560 CD1 LEU B 236 45.311 10.157 95.809 1.00 25.10 C ATOM 3561 CD2 LEU B 236 45.690 10.082 98.290 1.00 29.80 C ATOM 0 H LEU B 236 41.182 9.975 98.339 1.00 28.87 H new ATOM 0 HA LEU B 236 43.403 10.409 99.425 1.00 30.23 H new ATOM 0 HB2 LEU B 236 42.690 9.852 96.976 1.00 29.27 H new ATOM 0 HB3 LEU B 236 43.374 11.241 96.781 1.00 29.27 H new ATOM 0 HG LEU B 236 44.595 8.791 97.185 1.00 34.38 H new ATOM 0 HD11 LEU B 236 46.170 9.725 95.684 1.00 25.10 H new ATOM 0 HD12 LEU B 236 44.707 9.885 95.100 1.00 25.10 H new ATOM 0 HD13 LEU B 236 45.427 11.120 95.783 1.00 25.10 H new ATOM 0 HD21 LEU B 236 46.533 9.626 98.142 1.00 29.80 H new ATOM 0 HD22 LEU B 236 45.841 11.040 98.317 1.00 29.80 H new ATOM 0 HD23 LEU B 236 45.310 9.791 99.134 1.00 29.80 H new ATOM 3562 N VAL B 237 42.320 13.199 98.275 1.00 27.63 N ATOM 3563 CA VAL B 237 42.498 14.642 98.357 1.00 30.01 C ATOM 3564 C VAL B 237 42.489 15.170 99.794 1.00 31.45 C ATOM 3565 O VAL B 237 43.194 16.134 100.106 1.00 31.82 O ATOM 3566 CB VAL B 237 41.416 15.404 97.531 1.00 31.53 C ATOM 3567 CG1 VAL B 237 40.045 15.220 98.159 1.00 31.16 C ATOM 3568 CG2 VAL B 237 41.765 16.887 97.461 1.00 33.01 C ATOM 0 H VAL B 237 41.647 12.944 97.805 1.00 27.63 H new ATOM 0 HA VAL B 237 43.376 14.810 97.980 1.00 30.01 H new ATOM 0 HB VAL B 237 41.396 15.040 96.632 1.00 31.53 H new ATOM 0 HG11 VAL B 237 39.383 15.698 97.636 1.00 31.16 H new ATOM 0 HG12 VAL B 237 39.822 14.276 98.178 1.00 31.16 H new ATOM 0 HG13 VAL B 237 40.054 15.568 99.064 1.00 31.16 H new ATOM 0 HG21 VAL B 237 41.089 17.355 96.946 1.00 33.01 H new ATOM 0 HG22 VAL B 237 41.800 17.254 98.358 1.00 33.01 H new ATOM 0 HG23 VAL B 237 42.629 16.996 97.034 1.00 33.01 H new ATOM 3569 N PHE B 238 41.711 14.544 100.676 1.00 31.55 N ATOM 3570 CA PHE B 238 41.651 15.008 102.059 1.00 32.22 C ATOM 3571 C PHE B 238 42.905 14.657 102.852 1.00 33.83 C ATOM 3572 O PHE B 238 43.209 15.300 103.865 1.00 35.45 O ATOM 3573 CB PHE B 238 40.392 14.471 102.756 1.00 33.41 C ATOM 3574 CG PHE B 238 39.106 15.064 102.225 1.00 36.02 C ATOM 3575 CD1 PHE B 238 38.910 16.441 102.221 1.00 38.26 C ATOM 3576 CD2 PHE B 238 38.097 14.251 101.725 1.00 36.30 C ATOM 3577 CE1 PHE B 238 37.728 17.003 101.727 1.00 36.36 C ATOM 3578 CE2 PHE B 238 36.912 14.804 101.229 1.00 38.57 C ATOM 3579 CZ PHE B 238 36.729 16.182 101.231 1.00 36.60 C ATOM 0 H PHE B 238 41.219 13.861 100.498 1.00 31.55 H new ATOM 0 HA PHE B 238 41.604 15.976 102.030 1.00 32.22 H new ATOM 0 HB2 PHE B 238 40.361 13.507 102.654 1.00 33.41 H new ATOM 0 HB3 PHE B 238 40.455 14.653 103.707 1.00 33.41 H new ATOM 0 HD1 PHE B 238 39.577 16.998 102.553 1.00 38.26 H new ATOM 0 HD2 PHE B 238 38.211 13.328 101.720 1.00 36.30 H new ATOM 0 HE1 PHE B 238 37.613 17.926 101.732 1.00 36.36 H new ATOM 0 HE2 PHE B 238 36.244 14.248 100.897 1.00 38.57 H new ATOM 0 HZ PHE B 238 35.941 16.550 100.902 1.00 36.60 H new ATOM 3580 N VAL B 239 43.634 13.632 102.415 1.00 31.60 N ATOM 3581 CA VAL B 239 44.871 13.282 103.100 1.00 31.46 C ATOM 3582 C VAL B 239 45.819 14.451 102.836 1.00 31.98 C ATOM 3583 O VAL B 239 46.548 14.897 103.721 1.00 31.84 O ATOM 3584 CB VAL B 239 45.501 11.975 102.540 1.00 30.12 C ATOM 3585 CG1 VAL B 239 46.909 11.774 103.125 1.00 29.61 C ATOM 3586 CG2 VAL B 239 44.620 10.785 102.890 1.00 26.64 C ATOM 0 H VAL B 239 43.435 13.138 101.740 1.00 31.60 H new ATOM 0 HA VAL B 239 44.705 13.127 104.043 1.00 31.46 H new ATOM 0 HB VAL B 239 45.569 12.047 101.575 1.00 30.12 H new ATOM 0 HG11 VAL B 239 47.293 10.957 102.770 1.00 29.61 H new ATOM 0 HG12 VAL B 239 47.471 12.527 102.883 1.00 29.61 H new ATOM 0 HG13 VAL B 239 46.852 11.711 104.091 1.00 29.61 H new ATOM 0 HG21 VAL B 239 45.018 9.973 102.538 1.00 26.64 H new ATOM 0 HG22 VAL B 239 44.540 10.714 103.854 1.00 26.64 H new ATOM 0 HG23 VAL B 239 43.740 10.908 102.501 1.00 26.64 H new ATOM 3587 N GLY B 240 45.783 14.954 101.607 1.00 33.63 N ATOM 3588 CA GLY B 240 46.631 16.073 101.240 1.00 34.91 C ATOM 3589 C GLY B 240 46.203 17.387 101.877 1.00 35.87 C ATOM 3590 O GLY B 240 47.041 18.249 102.162 1.00 35.31 O ATOM 0 H GLY B 240 45.277 14.662 100.976 1.00 33.63 H new ATOM 0 HA2 GLY B 240 47.545 15.877 101.500 1.00 34.91 H new ATOM 0 HA3 GLY B 240 46.626 16.172 100.275 1.00 34.91 H new ATOM 3591 N LEU B 241 44.904 17.555 102.107 1.00 35.40 N ATOM 3592 CA LEU B 241 44.428 18.788 102.712 1.00 37.64 C ATOM 3593 C LEU B 241 44.997 18.936 104.123 1.00 38.34 C ATOM 3594 O LEU B 241 45.353 20.036 104.538 1.00 39.31 O ATOM 3595 CB LEU B 241 42.897 18.822 102.747 1.00 37.96 C ATOM 3596 CG LEU B 241 42.267 20.125 103.261 1.00 41.74 C ATOM 3597 CD1 LEU B 241 42.791 21.311 102.452 1.00 41.41 C ATOM 3598 CD2 LEU B 241 40.742 20.039 103.162 1.00 39.09 C ATOM 0 H LEU B 241 44.294 16.977 101.923 1.00 35.40 H new ATOM 0 HA LEU B 241 44.734 19.533 102.171 1.00 37.64 H new ATOM 0 HB2 LEU B 241 42.566 18.655 101.851 1.00 37.96 H new ATOM 0 HB3 LEU B 241 42.587 18.091 103.305 1.00 37.96 H new ATOM 0 HG LEU B 241 42.511 20.254 104.191 1.00 41.74 H new ATOM 0 HD11 LEU B 241 42.390 22.130 102.781 1.00 41.41 H new ATOM 0 HD12 LEU B 241 43.755 21.364 102.543 1.00 41.41 H new ATOM 0 HD13 LEU B 241 42.561 21.192 101.517 1.00 41.41 H new ATOM 0 HD21 LEU B 241 40.349 20.864 103.488 1.00 39.09 H new ATOM 0 HD22 LEU B 241 40.485 19.902 102.237 1.00 39.09 H new ATOM 0 HD23 LEU B 241 40.424 19.296 103.699 1.00 39.09 H new ATOM 3599 N ALA B 242 45.100 17.825 104.845 1.00 37.48 N ATOM 3600 CA ALA B 242 45.632 17.843 106.206 1.00 37.87 C ATOM 3601 C ALA B 242 47.114 18.212 106.194 1.00 38.58 C ATOM 3602 O ALA B 242 47.626 18.815 107.140 1.00 37.39 O ATOM 3603 CB ALA B 242 45.431 16.482 106.867 1.00 36.62 C ATOM 0 H ALA B 242 44.866 17.046 104.565 1.00 37.48 H new ATOM 0 HA ALA B 242 45.152 18.513 106.718 1.00 37.87 H new ATOM 0 HB1 ALA B 242 45.787 16.504 107.769 1.00 36.62 H new ATOM 0 HB2 ALA B 242 44.484 16.274 106.899 1.00 36.62 H new ATOM 0 HB3 ALA B 242 45.894 15.801 106.354 1.00 36.62 H new ATOM 3604 N LEU B 243 47.804 17.844 105.121 1.00 40.42 N ATOM 3605 CA LEU B 243 49.224 18.164 104.993 1.00 41.04 C ATOM 3606 C LEU B 243 49.384 19.644 104.638 1.00 40.46 C ATOM 3607 O LEU B 243 50.299 20.316 105.120 1.00 41.72 O ATOM 3608 CB LEU B 243 49.876 17.278 103.920 1.00 40.36 C ATOM 3609 CG LEU B 243 50.078 15.806 104.302 1.00 39.79 C ATOM 3610 CD1 LEU B 243 50.435 14.968 103.085 1.00 36.55 C ATOM 3611 CD2 LEU B 243 51.174 15.716 105.351 1.00 40.09 C ATOM 0 H LEU B 243 47.472 17.410 104.457 1.00 40.42 H new ATOM 0 HA LEU B 243 49.668 17.992 105.838 1.00 41.04 H new ATOM 0 HB2 LEU B 243 49.330 17.315 103.119 1.00 40.36 H new ATOM 0 HB3 LEU B 243 50.739 17.657 103.693 1.00 40.36 H new ATOM 0 HG LEU B 243 49.249 15.455 104.663 1.00 39.79 H new ATOM 0 HD11 LEU B 243 50.557 14.044 103.353 1.00 36.55 H new ATOM 0 HD12 LEU B 243 49.719 15.023 102.433 1.00 36.55 H new ATOM 0 HD13 LEU B 243 51.257 15.302 102.692 1.00 36.55 H new ATOM 0 HD21 LEU B 243 51.309 14.788 105.599 1.00 40.09 H new ATOM 0 HD22 LEU B 243 51.999 16.077 104.990 1.00 40.09 H new ATOM 0 HD23 LEU B 243 50.915 16.225 106.135 1.00 40.09 H new ATOM 3612 N ALA B 244 48.476 20.152 103.813 1.00 40.51 N ATOM 3613 CA ALA B 244 48.518 21.554 103.402 1.00 42.17 C ATOM 3614 C ALA B 244 48.033 22.498 104.509 1.00 44.25 C ATOM 3615 O ALA B 244 48.508 23.630 104.613 1.00 44.14 O ATOM 3616 CB ALA B 244 47.681 21.753 102.145 1.00 39.10 C ATOM 0 H ALA B 244 47.825 19.702 103.478 1.00 40.51 H new ATOM 0 HA ALA B 244 49.444 21.775 103.218 1.00 42.17 H new ATOM 0 HB1 ALA B 244 47.714 22.685 101.878 1.00 39.10 H new ATOM 0 HB2 ALA B 244 48.034 21.200 101.430 1.00 39.10 H new ATOM 0 HB3 ALA B 244 46.762 21.501 102.325 1.00 39.10 H new ATOM 3617 N CYS B 245 47.093 22.026 105.329 1.00 45.77 N ATOM 3618 CA CYS B 245 46.538 22.819 106.430 1.00 47.04 C ATOM 3619 C CYS B 245 46.482 22.002 107.721 1.00 48.37 C ATOM 3620 O CYS B 245 45.412 21.564 108.145 1.00 47.93 O ATOM 3621 CB CYS B 245 45.127 23.286 106.080 1.00 45.59 C ATOM 3622 SG CYS B 245 44.975 24.144 104.508 1.00 45.89 S ATOM 0 H CYS B 245 46.758 21.237 105.263 1.00 45.77 H new ATOM 0 HA CYS B 245 47.117 23.585 106.565 1.00 47.04 H new ATOM 0 HB2 CYS B 245 44.539 22.514 106.069 1.00 45.59 H new ATOM 0 HB3 CYS B 245 44.812 23.873 106.785 1.00 45.59 H new ATOM 0 HG CYS B 245 43.831 24.462 104.334 1.00 45.89 H new ATOM 3623 N PRO B 246 47.635 21.791 108.366 1.00 50.23 N ATOM 3624 CA PRO B 246 47.677 21.015 109.609 1.00 51.37 C ATOM 3625 C PRO B 246 46.908 21.627 110.775 1.00 52.49 C ATOM 3626 O PRO B 246 46.876 22.844 110.944 1.00 51.98 O ATOM 3627 CB PRO B 246 49.175 20.897 109.890 1.00 51.30 C ATOM 3628 CG PRO B 246 49.729 22.151 109.287 1.00 51.64 C ATOM 3629 CD PRO B 246 48.984 22.242 107.982 1.00 50.69 C ATOM 0 HA PRO B 246 47.229 20.160 109.508 1.00 51.37 H new ATOM 0 HB2 PRO B 246 49.359 20.844 110.841 1.00 51.30 H new ATOM 0 HB3 PRO B 246 49.556 20.103 109.482 1.00 51.30 H new ATOM 0 HG2 PRO B 246 49.567 22.924 109.850 1.00 51.64 H new ATOM 0 HG3 PRO B 246 50.688 22.094 109.152 1.00 51.64 H new ATOM 0 HD2 PRO B 246 48.978 23.146 107.630 1.00 50.69 H new ATOM 0 HD3 PRO B 246 49.376 21.674 107.300 1.00 50.69 H new ATOM 3630 N ILE B 247 46.286 20.763 111.572 1.00 52.87 N ATOM 3631 CA ILE B 247 45.517 21.187 112.733 1.00 52.73 C ATOM 3632 C ILE B 247 45.789 20.251 113.907 1.00 52.35 C ATOM 3633 O ILE B 247 46.478 20.706 114.846 1.00 52.25 O ATOM 3634 CB ILE B 247 44.007 21.177 112.442 1.00 52.56 C ATOM 3635 CG1 ILE B 247 43.683 22.146 111.305 1.00 51.46 C ATOM 3636 CG2 ILE B 247 43.239 21.566 113.693 1.00 54.10 C ATOM 3637 CD1 ILE B 247 42.215 22.145 110.902 1.00 49.37 C ATOM 0 H ILE B 247 46.299 19.911 111.452 1.00 52.87 H new ATOM 0 HA ILE B 247 45.791 22.092 112.949 1.00 52.73 H new ATOM 0 HB ILE B 247 43.744 20.283 112.174 1.00 52.56 H new ATOM 0 HG12 ILE B 247 43.936 23.043 111.573 1.00 51.46 H new ATOM 0 HG13 ILE B 247 44.223 21.918 110.532 1.00 51.46 H new ATOM 0 HG21 ILE B 247 42.288 21.558 113.504 1.00 54.10 H new ATOM 0 HG22 ILE B 247 43.433 20.933 114.402 1.00 54.10 H new ATOM 0 HG23 ILE B 247 43.505 22.456 113.973 1.00 54.10 H new ATOM 0 HD11 ILE B 247 42.077 22.778 110.180 1.00 49.37 H new ATOM 0 HD12 ILE B 247 41.961 21.257 110.606 1.00 49.37 H new ATOM 0 HD13 ILE B 247 41.670 22.400 111.663 1.00 49.37 H new TER 3638 ILE B 247 HETATM 3639 O HOH A 401 21.238 9.856 53.589 1.00 28.70 O HETATM 3640 O HOH A 402 39.018 12.385 66.790 1.00 31.26 O HETATM 3641 O HOH A 403 32.038 7.127 45.427 1.00 29.56 O HETATM 3642 O HOH A 404 33.079 3.193 62.454 1.00 32.53 O HETATM 3643 O HOH A 406 39.921 6.878 50.706 1.00 30.10 O HETATM 3644 O HOH A 407 36.738 13.736 60.163 1.00 35.07 O HETATM 3645 O HOH A 408 35.118 8.090 55.088 1.00 29.73 O HETATM 3646 O HOH A 416 18.960 -0.748 67.494 1.00 32.20 O HETATM 3647 O HOH A 417 30.943 14.359 58.010 1.00 39.27 O HETATM 3648 O HOH A 420 21.205 0.962 57.587 1.00 36.90 O HETATM 3649 O HOH A 422 41.360 9.120 56.955 1.00 30.30 O HETATM 3650 O HOH A 423 21.353 0.650 53.027 1.00 47.57 O HETATM 3651 O HOH A 425 20.382 2.917 59.656 1.00 35.38 O HETATM 3652 O HOH A 428 50.070 10.888 66.912 1.00 35.34 O HETATM 3653 O HOH A 429 52.795 25.383 83.946 1.00 36.51 O HETATM 3654 O HOH A 430 36.015 9.651 32.306 1.00 61.16 O HETATM 3655 O HOH A 433 49.322 25.999 78.785 1.00 42.16 O HETATM 3656 O HOH A 440 43.817 10.754 56.761 1.00 42.91 O HETATM 3657 O HOH A 441 39.599 -9.165 47.446 1.00 65.33 O HETATM 3658 O HOH A 442 45.059 15.683 62.814 1.00 54.51 O HETATM 3659 O HOH A 443 57.519 7.290 75.345 1.00 57.37 O HETATM 3660 O HOH A 444 47.884 -3.813 61.858 1.00 57.95 O HETATM 3661 O HOH A 446 30.958 5.354 40.893 1.00 56.50 O HETATM 3662 O HOH A 447 36.476 5.332 35.505 1.00 51.67 O HETATM 3663 O HOH A 450 42.079 -6.247 49.065 1.00 71.93 O HETATM 3664 O HOH A 454 30.647 16.216 61.898 1.00 54.91 O HETATM 3665 O HOH A 455 26.340 10.525 34.895 1.00 64.23 O HETATM 3666 O HOH A 457 38.544 -12.748 58.519 1.00 55.08 O HETATM 3667 O HOH A 458 39.781 13.086 56.179 1.00 52.66 O HETATM 3668 O HOH A 460 32.676 1.186 38.936 1.00 51.14 O HETATM 3669 O HOH A 461 34.458 11.585 60.113 1.00 42.08 O HETATM 3670 O HOH A 462 44.242 11.971 59.579 1.00 41.03 O HETATM 3671 O HOH A 464 54.349 22.621 74.516 1.00 54.95 O HETATM 3672 O HOH A 467 43.489 15.997 40.786 1.00 61.01 O HETATM 3673 O HOH A 468 34.531 28.491 52.656 1.00 55.03 O HETATM 3674 O HOH A 470 19.959 3.527 49.894 1.00 50.37 O HETATM 3675 O HOH A 472 37.403 23.074 51.884 1.00 53.40 O HETATM 3676 O HOH A 474 29.347 -11.697 52.288 1.00 53.06 O HETATM 3677 O HOH A 475 47.109 2.833 54.537 1.00 32.54 O HETATM 3678 O HOH A 477 38.662 9.758 35.201 1.00 54.67 O HETATM 3679 O HOH A 478 28.510 -14.463 62.120 1.00 66.80 O HETATM 3680 O HOH A 479 10.227 15.835 51.924 1.00 59.64 O HETATM 3681 O HOH A 480 56.246 18.617 79.009 1.00 44.09 O HETATM 3682 O HOH A 481 22.758 30.875 48.505 1.00 61.85 O HETATM 3683 O HOH A 482 21.505 7.855 60.115 1.00 63.56 O HETATM 3684 O HOH A 483 34.342 -13.793 61.562 1.00 44.50 O HETATM 3685 O HOH A 484 32.941 20.983 68.073 1.00 62.56 O HETATM 3686 O HOH A 485 39.140 21.457 45.670 1.00 51.61 O HETATM 3687 O HOH A 487 22.132 12.038 40.348 1.00 43.73 O HETATM 3688 O HOH A 488 22.834 -4.504 47.616 1.00 49.34 O HETATM 3689 O HOH A 489 38.141 6.277 30.157 1.00 59.68 O HETATM 3690 O HOH A 494 20.572 21.642 55.641 1.00 66.34 O HETATM 3691 O HOH A 495 38.912 3.083 31.775 1.00 63.80 O HETATM 3692 O HOH A 496 44.768 -3.504 74.951 1.00 48.57 O HETATM 3693 O HOH A 500 12.935 -2.101 62.551 1.00 57.17 O HETATM 3694 O HOH A 501 17.173 8.854 46.663 1.00 53.93 O HETATM 3695 O HOH A 502 38.474 -15.957 67.275 1.00 60.55 O HETATM 3696 O HOH A 505 40.091 -12.342 50.324 1.00 64.27 O HETATM 3697 O HOH A 507 28.062 -4.797 44.733 1.00 59.84 O HETATM 3698 O HOH A 508 47.837 8.100 53.964 1.00 51.75 O HETATM 3699 O HOH A 510 28.659 13.319 61.790 1.00 44.97 O HETATM 3700 O HOH A 512 28.216 3.922 40.769 1.00 39.24 O HETATM 3701 O HOH A 513 33.484 5.805 43.370 1.00 37.05 O HETATM 3702 O HOH A 515 43.857 12.088 39.526 1.00 37.53 O HETATM 3703 O HOH A 516 30.395 -7.651 51.005 1.00 38.77 O HETATM 3704 O HOH A 517 38.400 -3.162 78.482 1.00 33.98 O HETATM 3705 O HOH A 518 25.015 5.385 65.032 1.00 38.95 O HETATM 3706 O HOH A 519 37.735 10.850 56.398 1.00 34.68 O HETATM 3707 O HOH A 520 38.360 15.539 66.060 1.00 42.66 O HETATM 3708 O HOH A 522 15.730 -4.083 62.510 1.00 48.98 O HETATM 3709 O HOH A 524 44.683 12.097 52.995 1.00 60.10 O HETATM 3710 O HOH A 525 40.600 16.775 44.489 1.00 56.50 O HETATM 3711 O HOH A 527 58.468 18.212 73.207 1.00 53.99 O HETATM 3712 O HOH A 532 38.280 6.669 38.622 1.00 38.72 O HETATM 3713 O HOH A 535 14.386 1.406 68.280 1.00 55.31 O HETATM 3714 O HOH A 536 17.334 14.344 63.806 1.00 68.94 O HETATM 3715 O HOH A 539 57.047 15.271 81.504 1.00 56.21 O HETATM 3716 O HOH A 541 44.309 -16.653 67.256 1.00 52.34 O HETATM 3717 O HOH A 543 20.356 -8.165 65.733 1.00 67.57 O HETATM 3718 O HOH A 544 31.179 7.149 61.525 1.00 42.66 O HETATM 3719 O HOH A 545 49.255 -3.410 68.270 1.00 63.89 O HETATM 3720 O HOH A 547 63.275 11.040 81.004 1.00 66.40 O HETATM 3721 O HOH A 548 15.893 25.056 50.578 1.00 62.87 O HETATM 3722 O HOH A 549 44.803 -4.311 57.933 1.00 46.44 O HETATM 3723 O HOH A 551 38.287 22.974 39.970 1.00 60.52 O HETATM 3724 O HOH A 552 22.044 2.416 38.187 1.00 54.32 O HETATM 3725 O HOH A 554 61.114 11.609 83.269 1.00 52.73 O HETATM 3726 O HOH A 556 22.169 17.447 62.806 1.00 60.42 O HETATM 3727 O HOH A 558 46.600 -7.305 56.828 1.00 72.50 O HETATM 3728 O HOH A 559 40.328 9.682 45.065 1.00 60.58 O HETATM 3729 O HOH A 561 20.968 13.488 37.859 1.00 43.23 O HETATM 3730 O HOH A 562 42.780 -9.769 72.437 1.00 56.89 O HETATM 3731 O HOH A 563 29.836 -6.877 47.808 1.00 53.32 O HETATM 3732 O HOH A 564 43.590 -13.894 56.000 1.00 67.74 O HETATM 3733 O HOH A 565 38.701 3.530 38.655 1.00 66.26 O HETATM 3734 O HOH A 567 30.298 9.580 35.443 1.00 47.60 O HETATM 3735 O HOH A 568 38.206 13.188 47.868 1.00 45.41 O HETATM 3736 O HOH A 569 15.077 19.708 62.447 1.00 61.84 O HETATM 3737 O HOH A 570 45.823 -6.768 72.047 1.00 65.47 O HETATM 3738 O HOH A 571 49.649 -6.977 68.051 1.00 71.52 O HETATM 3739 O HOH A 572 50.985 -8.196 64.552 1.00 60.43 O HETATM 3740 O HOH A 573 44.960 2.915 52.367 1.00 39.49 O HETATM 3741 O HOH B 405 34.776 9.238 84.538 1.00 32.50 O HETATM 3742 O HOH B 409 53.970 4.411 76.476 1.00 44.92 O HETATM 3743 O HOH B 410 22.093 10.130 77.019 1.00 45.68 O HETATM 3744 O HOH B 411 40.159 12.155 96.370 1.00 35.20 O HETATM 3745 O HOH B 412 50.306 23.825 94.194 1.00 38.31 O HETATM 3746 O HOH B 413 40.044 9.189 106.502 1.00 36.44 O HETATM 3747 O HOH B 414 40.265 7.229 100.955 1.00 31.83 O HETATM 3748 O HOH B 415 48.304 -3.197 89.655 1.00 46.21 O HETATM 3749 O HOH B 418 40.559 25.887 111.997 1.00 58.76 O HETATM 3750 O HOH B 419 59.446 3.789 92.999 1.00 38.75 O HETATM 3751 O HOH B 421 37.236 7.463 107.451 1.00 41.64 O HETATM 3752 O HOH B 424 32.131 10.934 85.321 1.00 35.41 O HETATM 3753 O HOH B 426 48.835 25.051 91.891 1.00 47.25 O HETATM 3754 O HOH B 427 56.092 26.971 97.794 1.00 67.44 O HETATM 3755 O HOH B 431 34.969 17.241 94.169 1.00 57.23 O HETATM 3756 O HOH B 432 36.820 10.493 95.161 1.00 36.19 O HETATM 3757 O HOH B 434 29.387 8.168 85.767 1.00 48.65 O HETATM 3758 O HOH B 435 50.722 23.546 98.566 1.00 37.76 O HETATM 3759 O HOH B 436 23.330 4.383 67.354 1.00 53.77 O HETATM 3760 O HOH B 437 41.984 29.420 96.929 1.00 58.32 O HETATM 3761 O HOH B 438 40.691 -3.881 91.803 1.00 54.16 O HETATM 3762 O HOH B 439 31.335 10.676 88.883 1.00 54.95 O HETATM 3763 O HOH B 445 30.428 3.567 89.227 1.00 53.76 O HETATM 3764 O HOH B 448 29.452 20.001 69.974 1.00 40.41 O HETATM 3765 O HOH B 449 37.578 6.455 94.462 1.00 38.88 O HETATM 3766 O HOH B 451 42.066 8.345 102.970 1.00 53.37 O HETATM 3767 O HOH B 452 43.880 15.557 110.907 1.00 47.22 O HETATM 3768 O HOH B 453 36.925 13.604 91.439 1.00 47.40 O HETATM 3769 O HOH B 456 63.543 12.560 89.250 1.00 57.23 O HETATM 3770 O HOH B 459 18.589 -2.459 73.072 1.00 40.06 O HETATM 3771 O HOH B 463 43.170 -7.995 87.417 1.00 53.52 O HETATM 3772 O HOH B 465 39.003 16.356 93.383 1.00 63.85 O HETATM 3773 O HOH B 466 46.198 1.185 75.761 1.00 34.05 O HETATM 3774 O HOH B 469 31.240 8.906 106.189 1.00 60.36 O HETATM 3775 O HOH B 471 38.472 15.000 88.308 1.00 56.91 O HETATM 3776 O HOH B 473 42.001 15.895 89.878 1.00 39.94 O HETATM 3777 O HOH B 476 49.187 25.093 101.645 1.00 55.04 O HETATM 3778 O HOH B 486 26.130 -10.167 66.941 1.00 69.55 O HETATM 3779 O HOH B 490 53.044 27.303 99.829 1.00 66.02 O HETATM 3780 O HOH B 491 34.364 12.005 91.348 1.00 40.49 O HETATM 3781 O HOH B 492 34.088 8.798 100.692 1.00 50.53 O HETATM 3782 O HOH B 493 52.262 23.008 105.589 1.00 55.55 O HETATM 3783 O HOH B 497 62.711 3.041 85.824 1.00 74.04 O HETATM 3784 O HOH B 498 62.556 1.030 90.026 1.00 60.14 O HETATM 3785 O HOH B 499 49.421 -0.093 93.573 1.00 51.49 O HETATM 3786 O HOH B 503 56.808 4.069 103.658 1.00 63.94 O HETATM 3787 O HOH B 504 26.426 13.791 81.224 1.00 43.40 O HETATM 3788 O HOH B 506 42.157 14.815 106.400 1.00 34.38 O HETATM 3789 O HOH B 509 44.667 29.963 105.854 1.00 63.85 O HETATM 3790 O HOH B 511 39.866 -6.869 92.905 1.00 53.64 O HETATM 3791 O HOH B 514 45.562 13.198 88.973 1.00 31.12 O HETATM 3792 O HOH B 521 50.384 5.765 73.217 1.00 32.48 O HETATM 3793 O HOH B 523 39.619 -9.453 90.906 1.00 55.74 O HETATM 3794 O HOH B 526 56.736 27.339 88.866 1.00 44.14 O HETATM 3795 O HOH B 528 19.436 25.261 100.351 1.00 53.81 O HETATM 3796 O HOH B 529 61.198 7.220 90.310 1.00 49.14 O HETATM 3797 O HOH B 530 45.222 12.081 107.108 1.00 54.92 O HETATM 3798 O HOH B 531 46.378 17.608 111.010 1.00 53.02 O HETATM 3799 O HOH B 533 35.552 4.079 94.581 1.00 49.61 O HETATM 3800 O HOH B 534 55.315 20.340 104.100 1.00 58.33 O HETATM 3801 O HOH B 537 33.389 31.631 113.328 1.00 58.58 O HETATM 3802 O HOH B 538 47.453 13.848 106.049 1.00 46.06 O HETATM 3803 O HOH B 540 15.905 13.465 70.573 1.00 61.76 O HETATM 3804 O HOH B 542 41.943 20.351 117.189 1.00 64.73 O HETATM 3805 O HOH B 546 60.262 12.416 99.809 1.00 61.64 O HETATM 3806 O HOH B 550 43.084 10.173 116.211 1.00 59.84 O HETATM 3807 O HOH B 553 48.086 13.181 112.443 1.00 54.66 O HETATM 3808 O HOH B 555 45.174 22.289 86.107 1.00 43.96 O HETATM 3809 O HOH B 557 47.110 -3.425 82.796 1.00 64.00 O HETATM 3810 O HOH B 560 27.444 -7.794 70.486 1.00 60.81 O HETATM 3811 O HOH B 566 61.366 9.557 98.753 1.00 59.36 O HETATM 3812 O HOH B 574 37.696 9.039 116.324 1.00 50.67 O HETATM 3813 O HOH B 575 30.628 5.919 110.603 1.00 66.98 O HETATM 3814 O HOH B 576 43.665 25.491 91.400 1.00 49.54 O HETATM 3815 O HOH B 577 56.533 12.516 100.366 1.00 43.48 O HETATM 3816 O HOH B 578 24.380 6.894 84.368 1.00 67.15 O HETATM 3817 O HOH B 579 20.174 -0.225 74.502 1.00 48.61 O HETATM 3818 O HOH B 580 42.889 -3.070 94.140 1.00 50.08 O CONECT 8 12 CONECT 12 8 13 CONECT 13 12 14 16 CONECT 14 13 15 20 CONECT 15 14 CONECT 16 13 17 CONECT 17 16 18 CONECT 18 17 19 CONECT 19 18 CONECT 20 14 CONECT 1088 1090 CONECT 1090 1088 1091 CONECT 1091 1090 1092 1094 CONECT 1092 1091 1093 1098 CONECT 1093 1092 CONECT 1094 1091 1095 CONECT 1095 1094 1096 CONECT 1096 1095 1097 CONECT 1097 1096 CONECT 1098 1092 CONECT 1107 1113 CONECT 1113 1107 1114 CONECT 1114 1113 1115 1117 CONECT 1115 1114 1116 1121 CONECT 1116 1115 CONECT 1117 1114 1118 CONECT 1118 1117 1119 CONECT 1119 1118 1120 CONECT 1120 1119 CONECT 1121 1115 CONECT 1339 1345 CONECT 1345 1339 1346 CONECT 1346 1345 1347 1349 CONECT 1347 1346 1348 1353 CONECT 1348 1347 CONECT 1349 1346 1350 CONECT 1350 1349 1351 CONECT 1351 1350 1352 CONECT 1352 1351 CONECT 1353 1347 CONECT 1437 1440 CONECT 1440 1437 1441 CONECT 1441 1440 1442 1444 CONECT 1442 1441 1443 1448 CONECT 1443 1442 CONECT 1444 1441 1445 CONECT 1445 1444 1446 CONECT 1446 1445 1447 CONECT 1447 1446 CONECT 1448 1442 CONECT 1660 1666 CONECT 1666 1660 1667 CONECT 1667 1666 1668 1670 CONECT 1668 1667 1669 1674 CONECT 1669 1668 CONECT 1670 1667 1671 CONECT 1671 1670 1672 CONECT 1672 1671 1673 CONECT 1673 1672 CONECT 1674 1668 CONECT 1785 1789 CONECT 1789 1785 1790 CONECT 1790 1789 1791 1793 CONECT 1791 1790 1792 1797 CONECT 1792 1791 CONECT 1793 1790 1794 CONECT 1794 1793 1795 CONECT 1795 1794 1796 CONECT 1796 1795 CONECT 1797 1791 CONECT 2853 2855 CONECT 2855 2853 2856 CONECT 2856 2855 2857 2859 CONECT 2857 2856 2858 2863 CONECT 2858 2857 CONECT 2859 2856 2860 CONECT 2860 2859 2861 CONECT 2861 2860 2862 CONECT 2862 2861 CONECT 2863 2857 CONECT 2872 2878 CONECT 2878 2872 2879 CONECT 2879 2878 2880 2882 CONECT 2880 2879 2881 2886 CONECT 2881 2880 CONECT 2882 2879 2883 CONECT 2883 2882 2884 CONECT 2884 2883 2885 CONECT 2885 2884 CONECT 2886 2880 CONECT 3204 3210 CONECT 3210 3204 3211 CONECT 3211 3210 3212 3214 CONECT 3212 3211 3213 3218 CONECT 3213 3212 CONECT 3214 3211 3215 CONECT 3215 3214 3216 CONECT 3216 3215 3217 CONECT 3217 3216 CONECT 3218 3212 CONECT 3302 3305 CONECT 3305 3302 3306 CONECT 3306 3305 3307 3309 CONECT 3307 3306 3308 3313 CONECT 3308 3307 CONECT 3309 3306 3310 CONECT 3310 3309 3311 CONECT 3311 3310 3312 CONECT 3312 3311 CONECT 3313 3307 CONECT 3525 3531 CONECT 3531 3525 3532 CONECT 3532 3531 3533 3535 CONECT 3533 3532 3534 3539 CONECT 3534 3533 CONECT 3535 3532 3536 CONECT 3536 3535 3537 CONECT 3537 3536 3538 CONECT 3538 3537 CONECT 3539 3533 END