USER MOD reduce.3.24.130724 H: found=0, std=0, add=2729, rem=0, adj=83 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER TRANSFERASE 04-MAR-20 5RA2 TITLE PANDDA ANALYSIS GROUP DEPOSITION FORM1 MAP KINASE P38-ALPHA -- TITLE 2 FRAGMENT N09036B IN COMPLEX WITH MAP KINASE P38-ALPHA COMPND MOL_ID: 1; COMPND 2 MOLECULE: MITOGEN-ACTIVATED PROTEIN KINASE 14; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: MAPK 14,CRK1,MITOGEN-ACTIVATED PROTEIN KINASE P38 ALPHA,MAP COMPND 5 KINASE P38 ALPHA; COMPND 6 EC: 2.7.11.24; COMPND 7 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; SOURCE 3 ORGANISM_COMMON: MOUSE; SOURCE 4 ORGANISM_TAXID: 10090; SOURCE 5 GENE: MAPK14, CRK1, CSBP1, CSBP2; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS P38, MAPK14, KINASE, TRANSFERASE, SGC - DIAMOND I04-1 FRAGMENT KEYWDS 2 SCREENING, PANDDA, XCHEMEXPLORER EXPDTA X-RAY DIFFRACTION AUTHOR G.F.DE NICOLA,C.E.NICHOLS REVDAT 1 22-JUL-20 5RA2 0 JRNL AUTH C.NICHOLS,J.NG,A.KESHU,G.KELLY,M.R.CONTE,M.S.MARBER, JRNL AUTH 2 F.FRATERNALI,G.F.DE NICOLA JRNL TITL MINING THE PDB FOR TRACTABLE CASES WHERE X-RAY JRNL TITL 2 CRYSTALLOGRAPHY COMBINED WITH FRAGMENT SCREENS CAN BE USED JRNL TITL 3 TO SYSTEMATICALLY DESIGN PROTEIN-PROTEIN INHIBITORS: TWO JRNL TITL 4 TEST CASES ILLUSTRATED BY IL1 BETA-IL1R AND P38 ALPHA-TAB1 JRNL TITL 5 COMPLEXES. JRNL REF J.MED.CHEM. 2020 JRNL REFN ISSN 0022-2623 JRNL PMID 32543856 JRNL DOI 10.1021/ACS.JMEDCHEM.0C00403 REMARK 2 REMARK 2 RESOLUTION. 1.57 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.8.0238 REMARK 3 AUTHORS : MURSHUDOV,SKUBAK,LEBEDEV,PANNU,STEINER, REMARK 3 : NICHOLLS,WINN,LONG,VAGIN REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.57 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 29.31 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.4 REMARK 3 NUMBER OF REFLECTIONS : 67599 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.181 REMARK 3 R VALUE (WORKING SET) : 0.180 REMARK 3 FREE R VALUE : 0.197 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.000 REMARK 3 FREE R VALUE TEST SET COUNT : 3524 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 1.57 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 1.61 REMARK 3 REFLECTION IN BIN (WORKING SET) : 4783 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 96.86 REMARK 3 BIN R VALUE (WORKING SET) : 0.2720 REMARK 3 BIN FREE R VALUE SET COUNT : 247 REMARK 3 BIN FREE R VALUE : 0.2970 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2746 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 29 REMARK 3 SOLVENT ATOMS : 256 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 28.49 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.07000 REMARK 3 B22 (A**2) : 0.07000 REMARK 3 B33 (A**2) : 0.00000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.083 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.079 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.056 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 1.554 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.966 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.961 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 4878 ; 0.011 ; 0.014 REMARK 3 BOND LENGTHS OTHERS (A): 3738 ; 0.015 ; 0.017 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 5570 ; 1.748 ; 1.640 REMARK 3 BOND ANGLES OTHERS (DEGREES): 8667 ; 1.657 ; 1.589 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 544 ; 6.946 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 193 ;32.657 ;22.746 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 666 ;15.147 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 20 ;18.108 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 532 ; 0.084 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 4823 ; 0.010 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): 849 ; 0.003 ; 0.020 REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 2496 ; 2.477 ; 3.131 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): 2473 ; 2.488 ; 3.116 REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2634 ; 4.152 ; 4.453 REMARK 3 MAIN-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B REFINED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 LONG RANGE B OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING REMARK 3 POSITIONS U VALUES : REFINED INDIVIDUALLY REMARK 4 REMARK 4 5RA2 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 11-MAR-20. REMARK 100 THE DEPOSITION ID IS D_1001402959. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 12-FEB-16 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 6.9 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : DIAMOND REMARK 200 BEAMLINE : I04-1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.92819 REMARK 200 MONOCHROMATOR : SI(111) REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : PIXEL REMARK 200 DETECTOR MANUFACTURER : DECTRIS PILATUS 6M REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS REMARK 200 DATA SCALING SOFTWARE : AIMLESS 0.5.17 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 71198 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.570 REMARK 200 RESOLUTION RANGE LOW (A) : 29.290 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.6 REMARK 200 DATA REDUNDANCY : 6.600 REMARK 200 R MERGE (I) : 0.03800 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 24.4000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 1.57 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 1.61 REMARK 200 COMPLETENESS FOR SHELL (%) : 97.1 REMARK 200 DATA REDUNDANCY IN SHELL : 6.00 REMARK 200 R MERGE FOR SHELL (I) : 0.71900 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: FOURIER SYNTHESIS REMARK 200 SOFTWARE USED: REFMAC REMARK 200 STARTING MODEL: PDB ENTRY 6SO1 REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 59.61 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.05 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 27.5% PEG3350, 0.1 M BIS-TRIS PROPANE, REMARK 280 PH 6.9, 50 MM AMMONIUM SULFATE, 0.2 M 1:1 MAGNESIUM CHLORIDE: REMARK 280 MAGNESIUM SULFATE, 10% GLYCEROL, VAPOR DIFFUSION, SITTING DROP, REMARK 280 TEMPERATURE 291K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 21 21 21 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X+1/2,-Y,Z+1/2 REMARK 290 3555 -X,Y+1/2,-Z+1/2 REMARK 290 4555 X+1/2,-Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 22.94200 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 63.60050 REMARK 290 SMTRY1 3 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 43.14100 REMARK 290 SMTRY3 3 0.000000 0.000000 -1.000000 63.60050 REMARK 290 SMTRY1 4 1.000000 0.000000 0.000000 22.94200 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 43.14100 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 1170 ANGSTROM**2 REMARK 350 SURFACE AREA OF THE COMPLEX: 16950 ANGSTROM**2 REMARK 350 CHANGE IN SOLVENT FREE ENERGY: -68.0 KCAL/MOL REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 1 REMARK 465 SER A 2 REMARK 465 GLN A 3 REMARK 465 GLU A 4 REMARK 465 LEU A 353 REMARK 465 ASP A 354 REMARK 465 GLN A 355 REMARK 465 GLU A 356 REMARK 465 GLU A 357 REMARK 465 MET A 358 REMARK 465 GLU A 359 REMARK 465 SER A 360 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 10 CZ NH1 NH2 REMARK 470 LEU A 13 CD1 CD2 REMARK 470 ASN A 14 CG OD1 ND2 REMARK 470 LYS A 15 CG CD CE NZ REMARK 470 TYR A 35 CG CD1 CD2 CE1 CE2 CZ OH REMARK 470 LYS A 45 CE NZ REMARK 470 ARG A 49 CD NE CZ NH1 NH2 REMARK 470 ARG A 57 CG CD NE CZ NH1 NH2 REMARK 470 ARG A 67 NE CZ NH1 NH2 REMARK 470 VAL A 117 CG1 CG2 REMARK 470 LYS A 118 CG CD CE NZ REMARK 470 LYS A 121 CG CD CE NZ REMARK 470 GLU A 160 CG CD OE1 OE2 REMARK 470 ARG A 173 CG CD NE CZ NH1 NH2 REMARK 470 ASP A 177 CG OD1 OD2 REMARK 470 LYS A 248 CD CE NZ REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 NH1 ARG A 149 OH TYR A 200 2.12 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ASN A 100 -32.11 -135.41 REMARK 500 ARG A 149 -5.94 81.07 REMARK 500 ARG A 149 -23.68 84.84 REMARK 500 ASP A 150 43.29 -145.54 REMARK 500 LEU A 289 59.41 -98.42 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 ARG A 186 0.07 SIDE CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: MAIN CHAIN PLANARITY REMARK 500 REMARK 500 THE FOLLOWING RESIDUES HAVE A PSEUDO PLANARITY REMARK 500 TORSION ANGLE, C(I) - CA(I) - N(I+1) - O(I), GREATER REMARK 500 10.0 DEGREES. (M=MODEL NUMBER; RES=RESIDUE NAME; REMARK 500 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 500 I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI ANGLE REMARK 500 ILE A 116 -19.27 REMARK 500 REMARK 500 REMARK: NULL REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 MG A 407 MG REMARK 620 N RES CSSEQI ATOM REMARK 620 1 ASN A 155 OD1 REMARK 620 2 ASP A 168 OD2 95.5 REMARK 620 3 HOH A 628 O 87.8 175.7 REMARK 620 4 HOH A 690 O 92.2 94.5 82.6 REMARK 620 5 HOH A 585 O 85.6 90.0 93.0 175.2 REMARK 620 6 HOH A 669 O 172.0 90.0 87.0 93.1 88.6 REMARK 620 N 1 2 3 4 5 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue SV4 A 401 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL A 402 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL A 403 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL A 404 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL A 405 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue CL A 406 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue MG A 407 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue SO4 A 408 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC9 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: binding site for residue DMS A 409 DBREF 5RA2 A 1 360 UNP P47811 MK14_MOUSE 1 360 SEQRES 1 A 360 MET SER GLN GLU ARG PRO THR PHE TYR ARG GLN GLU LEU SEQRES 2 A 360 ASN LYS THR ILE TRP GLU VAL PRO GLU ARG TYR GLN ASN SEQRES 3 A 360 LEU SER PRO VAL GLY SER GLY ALA TYR GLY SER VAL CYS SEQRES 4 A 360 ALA ALA PHE ASP THR LYS THR GLY HIS ARG VAL ALA VAL SEQRES 5 A 360 LYS LYS LEU SER ARG PRO PHE GLN SER ILE ILE HIS ALA SEQRES 6 A 360 LYS ARG THR TYR ARG GLU LEU ARG LEU LEU LYS HIS MET SEQRES 7 A 360 LYS HIS GLU ASN VAL ILE GLY LEU LEU ASP VAL PHE THR SEQRES 8 A 360 PRO ALA ARG SER LEU GLU GLU PHE ASN ASP VAL TYR LEU SEQRES 9 A 360 VAL THR HIS LEU MET GLY ALA ASP LEU ASN ASN ILE VAL SEQRES 10 A 360 LYS CYS GLN LYS LEU THR ASP ASP HIS VAL GLN PHE LEU SEQRES 11 A 360 ILE TYR GLN ILE LEU ARG GLY LEU LYS TYR ILE HIS SER SEQRES 12 A 360 ALA ASP ILE ILE HIS ARG ASP LEU LYS PRO SER ASN LEU SEQRES 13 A 360 ALA VAL ASN GLU ASP CYS GLU LEU LYS ILE LEU ASP PHE SEQRES 14 A 360 GLY LEU ALA ARG HIS THR ASP ASP GLU MET THR GLY TYR SEQRES 15 A 360 VAL ALA THR ARG TRP TYR ARG ALA PRO GLU ILE MET LEU SEQRES 16 A 360 ASN TRP MET HIS TYR ASN GLN THR VAL ASP ILE TRP SER SEQRES 17 A 360 VAL GLY CYS ILE MET ALA GLU LEU LEU THR GLY ARG THR SEQRES 18 A 360 LEU PHE PRO GLY THR ASP HIS ILE ASP GLN LEU LYS LEU SEQRES 19 A 360 ILE LEU ARG LEU VAL GLY THR PRO GLY ALA GLU LEU LEU SEQRES 20 A 360 LYS LYS ILE SER SER GLU SER ALA ARG ASN TYR ILE GLN SEQRES 21 A 360 SER LEU ALA GLN MET PRO LYS MET ASN PHE ALA ASN VAL SEQRES 22 A 360 PHE ILE GLY ALA ASN PRO LEU ALA VAL ASP LEU LEU GLU SEQRES 23 A 360 LYS MET LEU VAL LEU ASP SER ASP LYS ARG ILE THR ALA SEQRES 24 A 360 ALA GLN ALA LEU ALA HIS ALA TYR PHE ALA GLN TYR HIS SEQRES 25 A 360 ASP PRO ASP ASP GLU PRO VAL ALA ASP PRO TYR ASP GLN SEQRES 26 A 360 SER PHE GLU SER ARG ASP LEU LEU ILE ASP GLU TRP LYS SEQRES 27 A 360 SER LEU THR TYR ASP GLU VAL ILE SER PHE VAL PRO PRO SEQRES 28 A 360 PRO LEU ASP GLN GLU GLU MET GLU SER HET SV4 A 401 14 HET CL A 402 1 HET CL A 403 1 HET CL A 404 1 HET CL A 405 1 HET CL A 406 1 HET MG A 407 1 HET SO4 A 408 5 HET DMS A 409 4 HETNAM SV4 1-(3-METHYLPYRIDIN-2-YL)-1,4-DIAZEPANE HETNAM CL CHLORIDE ION HETNAM MG MAGNESIUM ION HETNAM SO4 SULFATE ION HETNAM DMS DIMETHYL SULFOXIDE FORMUL 2 SV4 C11 H17 N3 FORMUL 3 CL 5(CL 1-) FORMUL 8 MG MG 2+ FORMUL 9 SO4 O4 S 2- FORMUL 10 DMS C2 H6 O S FORMUL 11 HOH *256(H2 O) HELIX 1 AA1 SER A 61 MET A 78 1 18 HELIX 2 AA2 SER A 95 PHE A 99 5 5 HELIX 3 AA3 LEU A 113 LYS A 118 1 6 HELIX 4 AA4 THR A 123 ALA A 144 1 22 HELIX 5 AA5 LYS A 152 SER A 154 5 3 HELIX 6 AA6 VAL A 183 TYR A 188 1 6 HELIX 7 AA7 ALA A 190 LEU A 195 1 6 HELIX 8 AA8 THR A 203 GLY A 219 1 17 HELIX 9 AA9 ASP A 227 GLY A 240 1 14 HELIX 10 AB1 GLY A 243 LYS A 248 1 6 HELIX 11 AB2 SER A 252 SER A 261 1 10 HELIX 12 AB3 ASN A 269 VAL A 273 5 5 HELIX 13 AB4 ASN A 278 LEU A 289 1 12 HELIX 14 AB5 ASP A 292 ARG A 296 5 5 HELIX 15 AB6 THR A 298 ALA A 304 1 7 HELIX 16 AB7 HIS A 305 ALA A 309 5 5 HELIX 17 AB8 GLN A 325 ARG A 330 5 6 HELIX 18 AB9 LEU A 333 SER A 347 1 15 SHEET 1 AA1 2 PHE A 8 LEU A 13 0 SHEET 2 AA1 2 THR A 16 PRO A 21 -1 O TRP A 18 N GLN A 11 SHEET 1 AA2 5 TYR A 24 SER A 32 0 SHEET 2 AA2 5 GLY A 36 ASP A 43 -1 O PHE A 42 N GLN A 25 SHEET 3 AA2 5 ARG A 49 LEU A 55 -1 O LYS A 54 N SER A 37 SHEET 4 AA2 5 TYR A 103 HIS A 107 -1 O THR A 106 N ALA A 51 SHEET 5 AA2 5 ASP A 88 PHE A 90 -1 N PHE A 90 O TYR A 103 SHEET 1 AA3 2 LEU A 156 VAL A 158 0 SHEET 2 AA3 2 LEU A 164 ILE A 166 -1 O LYS A 165 N ALA A 157 LINK OD1 ASN A 155 MG MG A 407 1555 1555 2.14 LINK OD2 ASP A 168 MG MG A 407 1555 1555 2.08 LINK MG MG A 407 O HOH A 628 1555 1555 2.09 LINK MG MG A 407 O HOH A 690 1555 1555 2.14 LINK MG MG A 407 O HOH A 585 1555 1555 2.14 LINK MG MG A 407 O HOH A 669 1555 1555 2.14 SITE *** AC1 7 ALA A 51 LYS A 53 LEU A 75 ILE A 84 SITE *** AC1 7 THR A 106 MET A 109 HOH A 504 SITE *** AC2 5 GLU A 22 ARG A 23 HOH A 651 HOH A 715 SITE *** AC2 5 HOH A 753 SITE *** AC3 3 THR A 91 ASN A 100 ASP A 101 SITE *** AC4 5 GLY A 85 HIS A 107 LYS A 165 HOH A 512 SITE *** AC4 5 HOH A 533 SITE *** AC5 5 ARG A 73 ARG A 220 ASP A 324 HOH A 610 SITE *** AC5 5 HOH A 660 SITE *** AC6 4 ASN A 114 PRO A 153 SER A 154 HOH A 631 SITE *** AC7 6 ASN A 155 ASP A 168 HOH A 585 HOH A 628 SITE *** AC7 6 HOH A 669 HOH A 690 SITE *** AC8 6 ARG A 220 THR A 221 HOH A 503 HOH A 510 SITE *** AC8 6 HOH A 525 HOH A 596 SITE *** AC9 5 LYS A 76 LYS A 79 HOH A 543 HOH A 562 SITE *** AC9 5 HOH A 668 CRYST1 45.884 86.282 127.201 90.00 90.00 90.00 P 21 21 21 4 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.021794 0.000000 0.000000 0.00000 SCALE2 0.000000 0.011590 0.000000 0.00000 SCALE3 0.000000 0.000000 0.007862 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj : A 155 ASNHD21 : A 155 ASN OD1 : A 407 MGMG :(metal ligand) USER MOD NoAdj : A 155 ASNHD22 : A 155 ASN OD1 : A 407 MGMG :(metal ligand) USER MOD Set 1.1: A 252 SER OG : rot 180:sc= 0.786 USER MOD Set 1.2: A 254 SER OG : rot 19:sc= 0.241 USER MOD Set 2.1: A 201 ASN :FLIP amide:sc= 0.458 F(o=-6.2!,f=1.1) USER MOD Set 2.2: A 203 THR OG1 : rot -90:sc= 0.631 USER MOD Set 3.1: A 128 GLN :FLIP amide:sc= 1.21 F(o=-1.8,f=2.5) USER MOD Set 3.2: A 310 GLN :FLIP amide:sc= 1.28 F(o=-1.7,f=2.5) USER MOD Set 4.1: A 123 THR OG1 : rot -63:sc= 0.224 USER MOD Set 4.2: A 126 HIS : no HD1:sc= 0.368 K(o=0.59,f=-2.9!) USER MOD Set 4.3: A 162 CYS SG : rot 180:sc= 0 USER MOD Set 5.1: A 80 HIS : no HD1:sc= 1.17 K(o=1.7,f=-5.2!) USER MOD Set 5.2: A 82 ASN : amide:sc= 0.521 K(o=1.7,f=-4.2!) USER MOD Set 6.1: A 79 LYS NZ :NH3+ 180:sc= 0.216 (180deg=0.216) USER MOD Set 6.2: A 409 DMS C1 :methyl 180:sc= 0 (180deg=0) USER MOD Set 7.1: A 61 SER OG : rot -98:sc= 1.5 USER MOD Set 7.2: A 64 HIS : no HD1:sc= 0.826 K(o=2.3,f=-6.5!) USER MOD Set 8.1: A 46 THR OG1 : rot -100:sc= 0.722 USER MOD Set 8.2: A 48 HIS : no HD1:sc= -0.436 X(o=0.29,f=0.66) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 TYR OH : rot 10:sc= 1.83 USER MOD Single : A 11 GLN : amide:sc= 0.958 X(o=0.96,f=1.1) USER MOD Single : A 16 THR OG1 : rot 79:sc= 0.271 USER MOD Single : A 24 TYR OH : rot -172:sc= 1.29 USER MOD Single : A 25 GLN : amide:sc= 2.85 K(o=2.9,f=-0.21) USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=-0.25) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 39 CYS SG : rot 85:sc= 0.24 USER MOD Single : A 44 THR OG1 : rot -73:sc= 0.448 USER MOD Single : A 53 LYS NZ :NH3+ -135:sc= 0.701 (180deg=0.0405) USER MOD Single : A 54 LYS NZ :NH3+ 167:sc= 0.823 (180deg=0.656) USER MOD Single : A 56 SER OG : rot 129:sc= -0.0601 USER MOD Single : A 60 GLN : amide:sc= -0.523 X(o=-0.52,f=-0.1) USER MOD Single : A 66 LYS NZ :NH3+ -173:sc= 1.56 (180deg=1.51) USER MOD Single : A 68 THR OG1 : rot 137:sc= 1.72 USER MOD Single : A 69 TYR OH : rot 10:sc= 2.34 USER MOD Single : A 76 LYS NZ :NH3+ -169:sc= 2.06 (180deg=1.96) USER MOD Single : A 77 HIS :FLIP no HD1:sc= 0.0923 F(o=-0.83,f=0.092) USER MOD Single : A 78 MET CE A:methyl -179:sc= -0.614 (180deg=-0.62) USER MOD Single : A 78 MET CE B:methyl 144:sc= -9.16! (180deg=-14.1!) USER MOD Single : A 91 THR OG1 : rot 90:sc= 0.528 USER MOD Single : A 95 SER OG : rot 180:sc= -0.0734 USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 TYR OH : rot -144:sc= 1.53 USER MOD Single : A 106 THR OG1 : rot -150:sc= 0 USER MOD Single : A 107 HIS : no HD1:sc= 0.499 K(o=0.5,f=-0.093) USER MOD Single : A 109 MET CE :methyl -160:sc=-0.00176 (180deg=-0.261) USER MOD Single : A 114 ASN : amide:sc= -0.143 K(o=-0.14,f=-1.1!) USER MOD Single : A 115 ASN :FLIP amide:sc= -0.479 F(o=-2.4!,f=-0.48) USER MOD Single : A 119 CYS SG : rot 180:sc= 0 USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 132 TYR OH : rot -10:sc= 2.18 USER MOD Single : A 133 GLN : amide:sc= 0.694 K(o=0.69,f=-4!) USER MOD Single : A 139 LYS NZ :NH3+ 176:sc= 1.9 (180deg=1.88) USER MOD Single : A 140 TYR OH : rot -145:sc= 1.76 USER MOD Single : A 142 HIS : +bothHN:sc= 2 K(o=2,f=-6.7!) USER MOD Single : A 143 SER OG : rot -50:sc= 1.98 USER MOD Single : A 148 HIS : no HD1:sc= 0.735 K(o=0.73,f=-8!) USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 1.3 (180deg=1.3) USER MOD Single : A 154 SER OG : rot -86:sc= 1.66 USER MOD Single : A 159 ASN : amide:sc= -0.398 K(o=-0.4,f=-6.3!) USER MOD Single : A 165 LYS NZ :NH3+ 168:sc= 0.482 (180deg=0.425) USER MOD Single : A 174 HIS :FLIP no HD1:sc= 0.133 F(o=-0.6,f=0.13) USER MOD Single : A 175 THR OG1 : rot 180:sc= 0 USER MOD Single : A 179 MET CE :methyl -167:sc= -0.377 (180deg=-0.793) USER MOD Single : A 180 THR OG1 : rot 66:sc= 0.72 USER MOD Single : A 182 TYR OH : rot 169:sc= 1.1 USER MOD Single : A 185 THR OG1 : rot 170:sc= 1.18 USER MOD Single : A 188 TYR OH : rot -151:sc= 2.85 USER MOD Single : A 194 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 196 ASN : amide:sc= -0.0502 K(o=-0.05,f=-1) USER MOD Single : A 198 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 199 HIS : no HD1:sc= -0.0435 X(o=-0.044,f=-0.17) USER MOD Single : A 200 TYR OH : rot 180:sc= -4.85! USER MOD Single : A 202 GLN : amide:sc= 1.03 X(o=1,f=1.1) USER MOD Single : A 208 SER OG : rot -53:sc= 1.76 USER MOD Single : A 211 CYS SG : rot 105:sc= 0.0447 USER MOD Single : A 213 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 218 THR OG1 : rot -63:sc= 1.14 USER MOD Single : A 221 THR OG1 : rot 77:sc= 1.6 USER MOD Single : A 226 THR OG1 : rot 180:sc= 0 USER MOD Single : A 228 HIS : no HD1:sc= 0.0131 K(o=0.013,f=-0.54) USER MOD Single : A 231 GLN : amide:sc= 0.421 K(o=0.42,f=-2.8!) USER MOD Single : A 233 LYS NZ :NH3+ -176:sc= 0.803 (180deg=0.796) USER MOD Single : A 241 THR OG1 : rot 86:sc= 0.982 USER MOD Single : A 249 LYS NZ :NH3+ 167:sc= 2.39 (180deg=2.1) USER MOD Single : A 251 SER OG : rot 180:sc= 0 USER MOD Single : A 257 ASN : amide:sc= -0.188 X(o=-0.19,f=-0.55) USER MOD Single : A 258 TYR OH : rot 180:sc= 0 USER MOD Single : A 260 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 261 SER OG : rot -68:sc= 1.88 USER MOD Single : A 264 GLN : amide:sc= 1.03 X(o=1,f=0.74) USER MOD Single : A 265 MET CE :methyl -171:sc= -0.0758 (180deg=-0.18) USER MOD Single : A 267 LYS NZ :NH3+ -165:sc= 1.92 (180deg=1.45) USER MOD Single : A 268 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 269 ASN : amide:sc= -1.04! C(o=-1!,f=-7.8!) USER MOD Single : A 272 ASN :FLIP amide:sc= -0.0512 F(o=-1.5!,f=-0.051) USER MOD Single : A 278 ASN : amide:sc= 2.03 K(o=2,f=-4.9!) USER MOD Single : A 287 LYS NZ :NH3+ 172:sc= 0.84 (180deg=0.792) USER MOD Single : A 288 MET CE A:methyl 165:sc= 0 (180deg=-0.0135) USER MOD Single : A 288 MET CE B:methyl 148:sc= -0.0629 (180deg=-1.06) USER MOD Single : A 293 SER OG : rot 170:sc= 1.06 USER MOD Single : A 295 LYS NZ :NH3+ -166:sc= 1.2 (180deg=0.849) USER MOD Single : A 298 THR OG1 : rot 158:sc= 0.706 USER MOD Single : A 301 GLN : amide:sc= 1.36 K(o=1.4,f=-2.5!) USER MOD Single : A 305 HIS : no HD1:sc= 1.54 K(o=1.5,f=-7!) USER MOD Single : A 307 TYR OH : rot -1:sc= 1.01 USER MOD Single : A 311 TYR OH : rot -30:sc= 1.23 USER MOD Single : A 312 HIS : no HE2:sc= 0.65 K(o=0.65,f=-2.5!) USER MOD Single : A 323 TYR OH : rot -144:sc= 1.8 USER MOD Single : A 325 GLN : amide:sc= 1.52 K(o=1.5,f=0.22) USER MOD Single : A 326 SER OG : rot -79:sc= 1.01 USER MOD Single : A 329 SER OG : rot 180:sc= 0 USER MOD Single : A 338 LYS NZ :NH3+ -131:sc= 0.509 (180deg=-0.257) USER MOD Single : A 339 SER OG : rot -84:sc= 1.62 USER MOD Single : A 341 THR OG1 : rot 73:sc= 0.349 USER MOD Single : A 342 TYR OH : rot 180:sc= 1.2 USER MOD Single : A 347 SER OG : rot -86:sc= 0.157 USER MOD Single : A 409 DMS C2 :methyl -134:sc= -0.364 (180deg=-0.377) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 5 71.409 126.435 40.363 1.00 41.32 N ATOM 2 CA ARG A 5 70.299 125.588 40.955 1.00 38.46 C ATOM 3 C ARG A 5 69.373 126.494 41.755 1.00 34.15 C ATOM 4 O ARG A 5 69.797 127.200 42.660 1.00 35.49 O ATOM 5 CB ARG A 5 70.814 124.447 41.838 1.00 37.05 C ATOM 6 CG ARG A 5 69.732 123.571 42.456 1.00 41.00 C ATOM 7 CD ARG A 5 70.326 122.497 43.353 1.00 39.58 C ATOM 8 NE ARG A 5 69.344 121.597 43.951 1.00 38.85 N ATOM 9 CZ ARG A 5 68.675 121.838 45.074 1.00 37.54 C ATOM 10 NH1 ARG A 5 68.855 122.984 45.721 1.00 40.56 N ATOM 11 NH2 ARG A 5 67.843 120.930 45.569 1.00 36.40 N ATOM 0 HA ARG A 5 69.825 125.167 40.221 1.00 38.46 H new ATOM 0 HB2 ARG A 5 71.401 123.886 41.308 1.00 37.05 H new ATOM 0 HB3 ARG A 5 71.351 124.826 42.551 1.00 37.05 H new ATOM 0 HG2 ARG A 5 69.123 124.123 42.971 1.00 41.00 H new ATOM 0 HG3 ARG A 5 69.211 123.154 41.752 1.00 41.00 H new ATOM 0 HD2 ARG A 5 70.957 121.972 42.836 1.00 39.58 H new ATOM 0 HD3 ARG A 5 70.829 122.926 44.063 1.00 39.58 H new ATOM 0 HE ARG A 5 69.187 120.855 43.546 1.00 38.85 H new ATOM 0 HH11 ARG A 5 69.404 123.570 45.413 1.00 40.56 H new ATOM 0 HH12 ARG A 5 68.422 123.140 46.448 1.00 40.56 H new ATOM 0 HH21 ARG A 5 67.734 120.180 45.163 1.00 36.40 H new ATOM 0 HH22 ARG A 5 67.413 121.092 46.296 1.00 36.40 H new ATOM 12 N PRO A 6 68.055 126.491 41.487 1.00 30.97 N ATOM 13 CA PRO A 6 67.128 127.232 42.335 1.00 28.62 C ATOM 14 C PRO A 6 67.055 126.674 43.751 1.00 27.68 C ATOM 15 O PRO A 6 67.495 125.554 43.991 1.00 27.40 O ATOM 16 CB PRO A 6 65.750 127.026 41.682 1.00 31.14 C ATOM 17 CG PRO A 6 65.924 125.891 40.704 1.00 34.26 C ATOM 18 CD PRO A 6 67.394 125.803 40.361 1.00 32.25 C ATOM 0 HA PRO A 6 67.411 128.157 42.405 1.00 28.62 H new ATOM 0 HB2 PRO A 6 65.078 126.812 42.348 1.00 31.14 H new ATOM 0 HB3 PRO A 6 65.455 127.832 41.231 1.00 31.14 H new ATOM 0 HG2 PRO A 6 65.614 125.057 41.091 1.00 34.26 H new ATOM 0 HG3 PRO A 6 65.396 126.046 39.905 1.00 34.26 H new ATOM 0 HD2 PRO A 6 67.688 124.882 40.284 1.00 32.25 H new ATOM 0 HD3 PRO A 6 67.589 126.235 39.515 1.00 32.25 H new ATOM 19 N THR A 7 66.540 127.501 44.692 1.00 25.97 N ATOM 20 CA THR A 7 66.139 127.045 46.006 1.00 25.13 C ATOM 21 C THR A 7 64.808 126.302 45.880 1.00 25.67 C ATOM 22 O THR A 7 63.868 126.810 45.236 1.00 23.79 O ATOM 23 CB THR A 7 66.005 128.202 47.021 1.00 27.14 C ATOM 24 OG1 THR A 7 67.314 128.779 47.142 1.00 29.51 O ATOM 25 CG2 THR A 7 65.451 127.736 48.346 1.00 27.33 C ATOM 0 H THR A 7 66.421 128.343 44.566 1.00 25.97 H new ATOM 0 HA THR A 7 66.831 126.456 46.345 1.00 25.13 H new ATOM 0 HB THR A 7 65.367 128.864 46.713 1.00 27.14 H new ATOM 0 HG1 THR A 7 67.290 129.418 47.687 1.00 29.51 H new ATOM 0 HG21 THR A 7 65.383 128.490 48.952 1.00 27.33 H new ATOM 0 HG22 THR A 7 64.571 127.350 48.211 1.00 27.33 H new ATOM 0 HG23 THR A 7 66.042 127.068 48.727 1.00 27.33 H new ATOM 26 N PHE A 8 64.704 125.164 46.541 1.00 24.94 N ATOM 27 CA PHE A 8 63.495 124.340 46.650 1.00 22.23 C ATOM 28 C PHE A 8 62.878 124.469 48.039 1.00 24.64 C ATOM 29 O PHE A 8 63.630 124.663 49.049 1.00 31.68 O ATOM 30 CB PHE A 8 63.805 122.873 46.358 1.00 23.74 C ATOM 31 CG PHE A 8 64.139 122.502 44.944 1.00 23.04 C ATOM 32 CD1 PHE A 8 65.289 122.931 44.324 1.00 23.99 C ATOM 33 CD2 PHE A 8 63.260 121.687 44.256 1.00 23.96 C ATOM 34 CE1 PHE A 8 65.599 122.521 43.036 1.00 25.68 C ATOM 35 CE2 PHE A 8 63.571 121.279 42.969 1.00 24.64 C ATOM 36 CZ PHE A 8 64.692 121.735 42.343 1.00 24.17 C ATOM 0 H PHE A 8 65.371 124.825 46.965 1.00 24.94 H new ATOM 0 HA PHE A 8 62.859 124.661 45.991 1.00 22.23 H new ATOM 0 HB2 PHE A 8 64.549 122.607 46.921 1.00 23.74 H new ATOM 0 HB3 PHE A 8 63.039 122.345 46.633 1.00 23.74 H new ATOM 0 HD1 PHE A 8 65.867 123.504 44.775 1.00 23.99 H new ATOM 0 HD2 PHE A 8 62.465 121.414 44.654 1.00 23.96 H new ATOM 0 HE1 PHE A 8 66.404 122.770 42.643 1.00 25.68 H new ATOM 0 HE2 PHE A 8 63.007 120.686 42.527 1.00 24.64 H new ATOM 0 HZ PHE A 8 64.848 121.519 41.452 1.00 24.17 H new ATOM 37 N TYR A 9 61.572 124.369 48.116 1.00 22.55 N ATOM 38 CA TYR A 9 60.780 124.234 49.357 1.00 25.27 C ATOM 39 C TYR A 9 59.890 122.991 49.341 1.00 28.66 C ATOM 40 O TYR A 9 59.421 122.523 48.265 1.00 23.21 O ATOM 41 CB TYR A 9 60.003 125.534 49.642 1.00 22.58 C ATOM 42 CG TYR A 9 58.774 125.835 48.835 1.00 21.53 C ATOM 43 CD1 TYR A 9 58.860 126.286 47.511 1.00 19.84 C ATOM 44 CD2 TYR A 9 57.506 125.718 49.376 1.00 21.76 C ATOM 45 CE1 TYR A 9 57.718 126.608 46.793 1.00 19.49 C ATOM 46 CE2 TYR A 9 56.365 125.989 48.650 1.00 23.62 C ATOM 47 CZ TYR A 9 56.461 126.440 47.333 1.00 21.78 C ATOM 48 OH TYR A 9 55.314 126.719 46.642 1.00 24.72 O ATOM 0 H TYR A 9 61.077 124.377 47.413 1.00 22.55 H new ATOM 0 HA TYR A 9 61.393 124.098 50.097 1.00 25.27 H new ATOM 0 HB2 TYR A 9 59.745 125.522 50.577 1.00 22.58 H new ATOM 0 HB3 TYR A 9 60.618 126.275 49.527 1.00 22.58 H new ATOM 0 HD1 TYR A 9 59.694 126.371 47.108 1.00 19.84 H new ATOM 0 HD2 TYR A 9 57.420 125.447 50.261 1.00 21.76 H new ATOM 0 HE1 TYR A 9 57.802 126.944 45.930 1.00 19.49 H new ATOM 0 HE2 TYR A 9 55.529 125.871 49.040 1.00 23.62 H new ATOM 0 HH TYR A 9 55.501 126.866 45.836 1.00 24.72 H new ATOM 49 N ARG A 10 59.557 122.465 50.533 1.00 30.03 N ATOM 50 CA ARG A 10 58.778 121.191 50.729 1.00 31.23 C ATOM 51 C ARG A 10 57.396 121.456 51.301 1.00 37.55 C ATOM 52 O ARG A 10 57.232 122.396 52.158 1.00 38.92 O ATOM 53 CB ARG A 10 59.534 120.201 51.626 1.00 35.31 C ATOM 54 CG ARG A 10 60.980 119.995 51.219 1.00 40.36 C ATOM 55 CD ARG A 10 61.812 119.047 52.068 1.00 47.56 C ATOM 56 NE ARG A 10 61.018 117.938 52.543 1.00 48.27 N ATOM 0 H ARG A 10 59.777 122.838 51.276 1.00 30.03 H new ATOM 0 HA ARG A 10 58.672 120.794 49.850 1.00 31.23 H new ATOM 0 HB2 ARG A 10 59.506 120.520 52.542 1.00 35.31 H new ATOM 0 HB3 ARG A 10 59.076 119.346 51.609 1.00 35.31 H new ATOM 0 HG2 ARG A 10 60.992 119.669 50.305 1.00 40.36 H new ATOM 0 HG3 ARG A 10 61.418 120.860 51.217 1.00 40.36 H new ATOM 0 HD2 ARG A 10 62.559 118.713 51.547 1.00 47.56 H new ATOM 0 HD3 ARG A 10 62.185 119.528 52.823 1.00 47.56 H new ATOM 57 N GLN A 11 56.403 120.702 50.861 1.00 36.85 N ATOM 58 CA GLN A 11 55.067 120.698 51.512 1.00 40.72 C ATOM 59 C GLN A 11 54.372 119.347 51.265 1.00 46.88 C ATOM 60 O GLN A 11 54.689 118.646 50.291 1.00 36.37 O ATOM 61 CB GLN A 11 54.296 121.925 51.048 1.00 47.88 C ATOM 62 CG GLN A 11 53.665 121.819 49.683 1.00 46.57 C ATOM 63 CD GLN A 11 53.173 123.177 49.235 1.00 56.71 C ATOM 64 OE1 GLN A 11 52.101 123.638 49.624 1.00 52.89 O ATOM 65 NE2 GLN A 11 53.942 123.813 48.371 1.00 46.53 N ATOM 0 H GLN A 11 56.467 120.176 50.183 1.00 36.85 H new ATOM 0 HA GLN A 11 55.130 120.771 52.477 1.00 40.72 H new ATOM 0 HB2 GLN A 11 53.599 122.113 51.695 1.00 47.88 H new ATOM 0 HB3 GLN A 11 54.898 122.686 51.050 1.00 47.88 H new ATOM 0 HG2 GLN A 11 54.310 121.474 49.046 1.00 46.57 H new ATOM 0 HG3 GLN A 11 52.926 121.191 49.708 1.00 46.57 H new ATOM 0 HE21 GLN A 11 54.686 123.463 48.119 1.00 46.53 H new ATOM 0 HE22 GLN A 11 53.699 124.577 48.060 1.00 46.53 H new ATOM 66 N GLU A 12 53.471 118.971 52.162 1.00 44.05 N ATOM 67 CA GLU A 12 52.626 117.764 52.039 1.00 42.10 C ATOM 68 C GLU A 12 51.270 118.139 51.424 1.00 42.67 C ATOM 69 O GLU A 12 50.528 118.896 52.047 1.00 54.33 O ATOM 70 CB GLU A 12 52.494 117.120 53.424 1.00 47.78 C ATOM 71 CG GLU A 12 51.480 115.992 53.466 1.00 54.43 C ATOM 72 CD GLU A 12 51.785 114.886 54.464 1.00 63.83 C ATOM 73 OE1 GLU A 12 52.791 115.007 55.219 1.00 67.00 O ATOM 74 OE2 GLU A 12 51.030 113.892 54.466 1.00 67.99 O ATOM 0 H GLU A 12 53.322 119.416 52.883 1.00 44.05 H new ATOM 0 HA GLU A 12 53.030 117.113 51.444 1.00 42.10 H new ATOM 0 HB2 GLU A 12 53.359 116.779 53.699 1.00 47.78 H new ATOM 0 HB3 GLU A 12 52.239 117.800 54.067 1.00 47.78 H new ATOM 0 HG2 GLU A 12 50.610 116.366 53.675 1.00 54.43 H new ATOM 0 HG3 GLU A 12 51.416 115.601 52.581 1.00 54.43 H new ATOM 75 N LEU A 13 50.929 117.578 50.267 1.00 55.24 N ATOM 76 CA LEU A 13 49.624 117.803 49.597 1.00 63.22 C ATOM 77 C LEU A 13 48.951 116.441 49.375 1.00 69.62 C ATOM 78 O LEU A 13 49.491 115.643 48.568 1.00 65.24 O ATOM 79 CB LEU A 13 49.862 118.549 48.274 1.00 67.86 C ATOM 80 CG LEU A 13 50.025 120.068 48.375 1.00 63.68 C ATOM 0 H LEU A 13 51.449 117.047 49.834 1.00 55.24 H new ATOM 0 HA LEU A 13 49.037 118.349 50.143 1.00 63.22 H new ATOM 0 HB2 LEU A 13 50.658 118.184 47.857 1.00 67.86 H new ATOM 0 HB3 LEU A 13 49.119 118.361 47.680 1.00 67.86 H new ATOM 81 N ASN A 14 47.821 116.193 50.058 1.00 73.80 N ATOM 82 CA ASN A 14 47.063 114.911 50.026 1.00 67.13 C ATOM 83 C ASN A 14 48.065 113.748 50.075 1.00 67.83 C ATOM 84 O ASN A 14 48.270 113.084 49.031 1.00 68.31 O ATOM 85 CB ASN A 14 46.126 114.835 48.813 1.00 70.01 C ATOM 0 H ASN A 14 47.458 116.781 50.570 1.00 73.80 H new ATOM 0 HA ASN A 14 46.483 114.854 50.802 1.00 67.13 H new ATOM 86 N LYS A 15 48.740 113.586 51.218 1.00 66.48 N ATOM 87 CA LYS A 15 49.529 112.375 51.595 1.00 69.34 C ATOM 88 C LYS A 15 50.857 112.261 50.816 1.00 65.99 C ATOM 89 O LYS A 15 51.537 111.224 50.967 1.00 55.39 O ATOM 90 CB LYS A 15 48.680 111.119 51.371 1.00 66.80 C ATOM 0 H LYS A 15 48.759 114.194 51.825 1.00 66.48 H new ATOM 0 HA LYS A 15 49.760 112.461 52.533 1.00 69.34 H new ATOM 91 N THR A 16 51.266 113.300 50.081 1.00 59.62 N ATOM 92 CA THR A 16 52.415 113.269 49.133 1.00 50.32 C ATOM 93 C THR A 16 53.382 114.420 49.460 1.00 41.24 C ATOM 94 O THR A 16 52.886 115.539 49.627 1.00 40.21 O ATOM 95 CB THR A 16 51.880 113.426 47.703 1.00 56.28 C ATOM 96 OG1 THR A 16 50.782 112.527 47.544 1.00 62.58 O ATOM 97 CG2 THR A 16 52.924 113.182 46.634 1.00 50.24 C ATOM 0 H THR A 16 50.879 114.067 50.114 1.00 59.62 H new ATOM 0 HA THR A 16 52.890 112.427 49.213 1.00 50.32 H new ATOM 0 HB THR A 16 51.602 114.348 47.585 1.00 56.28 H new ATOM 0 HG1 THR A 16 50.096 112.857 47.899 1.00 62.58 H new ATOM 0 HG21 THR A 16 52.523 113.296 45.758 1.00 50.24 H new ATOM 0 HG22 THR A 16 53.651 113.815 46.741 1.00 50.24 H new ATOM 0 HG23 THR A 16 53.267 112.278 46.717 1.00 50.24 H new ATOM 98 N ILE A 17 54.692 114.188 49.529 1.00 39.92 N ATOM 99 CA ILE A 17 55.674 115.304 49.665 1.00 40.74 C ATOM 100 C ILE A 17 55.928 115.948 48.286 1.00 37.62 C ATOM 101 O ILE A 17 56.232 115.260 47.266 1.00 40.04 O ATOM 102 CB ILE A 17 56.955 114.836 50.365 1.00 43.38 C ATOM 103 CG1 ILE A 17 56.658 114.301 51.771 1.00 47.04 C ATOM 104 CG2 ILE A 17 58.008 115.939 50.371 1.00 46.67 C ATOM 105 CD1 ILE A 17 56.280 115.339 52.786 1.00 48.58 C ATOM 0 H ILE A 17 55.044 113.404 49.500 1.00 39.92 H new ATOM 0 HA ILE A 17 55.303 115.993 50.238 1.00 40.74 H new ATOM 0 HB ILE A 17 57.324 114.095 49.859 1.00 43.38 H new ATOM 0 HG12 ILE A 17 55.938 113.653 51.709 1.00 47.04 H new ATOM 0 HG13 ILE A 17 57.440 113.826 52.092 1.00 47.04 H new ATOM 0 HG21 ILE A 17 58.808 115.621 50.818 1.00 46.67 H new ATOM 0 HG22 ILE A 17 58.225 116.185 49.458 1.00 46.67 H new ATOM 0 HG23 ILE A 17 57.662 116.714 50.841 1.00 46.67 H new ATOM 0 HD11 ILE A 17 56.111 114.911 53.640 1.00 48.58 H new ATOM 0 HD12 ILE A 17 57.004 115.977 52.882 1.00 48.58 H new ATOM 0 HD13 ILE A 17 55.479 115.802 52.493 1.00 48.58 H new ATOM 106 N TRP A 18 55.802 117.256 48.211 1.00 27.59 N ATOM 107 CA TRP A 18 56.145 118.024 46.978 1.00 28.95 C ATOM 108 C TRP A 18 57.336 118.911 47.297 1.00 30.32 C ATOM 109 O TRP A 18 57.261 119.666 48.310 1.00 29.71 O ATOM 110 CB TRP A 18 54.940 118.831 46.501 1.00 30.92 C ATOM 111 CG TRP A 18 53.876 117.977 45.889 1.00 36.09 C ATOM 112 CD1 TRP A 18 53.086 117.044 46.509 1.00 48.24 C ATOM 113 CD2 TRP A 18 53.456 117.994 44.516 1.00 29.73 C ATOM 114 NE1 TRP A 18 52.232 116.461 45.605 1.00 46.64 N ATOM 115 CE2 TRP A 18 52.436 117.024 44.367 1.00 35.28 C ATOM 116 CE3 TRP A 18 53.856 118.699 43.380 1.00 25.97 C ATOM 117 CZ2 TRP A 18 51.813 116.771 43.143 1.00 31.81 C ATOM 118 CZ3 TRP A 18 53.221 118.454 42.179 1.00 25.63 C ATOM 119 CH2 TRP A 18 52.232 117.488 42.044 1.00 25.80 C ATOM 0 H TRP A 18 55.518 117.744 48.860 1.00 27.59 H new ATOM 0 HA TRP A 18 56.381 117.425 46.253 1.00 28.95 H new ATOM 0 HB2 TRP A 18 54.566 119.319 47.251 1.00 30.92 H new ATOM 0 HB3 TRP A 18 55.233 119.490 45.852 1.00 30.92 H new ATOM 0 HD1 TRP A 18 53.123 116.835 47.414 1.00 48.24 H new ATOM 0 HE1 TRP A 18 51.661 115.843 45.784 1.00 46.64 H new ATOM 0 HE3 TRP A 18 54.541 119.326 43.431 1.00 25.97 H new ATOM 0 HZ2 TRP A 18 51.136 116.138 43.072 1.00 31.81 H new ATOM 0 HZ3 TRP A 18 53.464 118.954 41.433 1.00 25.63 H new ATOM 0 HH2 TRP A 18 51.852 117.325 41.211 1.00 25.80 H new ATOM 120 N GLU A 19 58.429 118.790 46.548 1.00 25.17 N ATOM 121 CA GLU A 19 59.623 119.623 46.728 1.00 24.00 C ATOM 122 C GLU A 19 59.857 120.321 45.391 1.00 24.91 C ATOM 123 O GLU A 19 60.232 119.655 44.411 1.00 22.61 O ATOM 124 CB GLU A 19 60.809 118.789 47.209 1.00 25.65 C ATOM 125 CG GLU A 19 62.033 119.594 47.535 1.00 28.67 C ATOM 126 CD GLU A 19 63.091 118.927 48.417 1.00 33.05 C ATOM 127 OE1 GLU A 19 62.954 117.704 48.703 1.00 38.37 O ATOM 128 OE2 GLU A 19 64.081 119.633 48.770 1.00 35.88 O ATOM 0 H GLU A 19 58.502 118.215 45.912 1.00 25.17 H new ATOM 0 HA GLU A 19 59.505 120.290 47.423 1.00 24.00 H new ATOM 0 HB2 GLU A 19 60.543 118.290 47.997 1.00 25.65 H new ATOM 0 HB3 GLU A 19 61.034 118.139 46.525 1.00 25.65 H new ATOM 0 HG2 GLU A 19 62.455 119.851 46.700 1.00 28.67 H new ATOM 0 HG3 GLU A 19 61.748 120.411 47.973 1.00 28.67 H new ATOM 129 N VAL A 20 59.667 121.642 45.342 1.00 20.63 N ATOM 130 CA VAL A 20 59.601 122.370 44.054 1.00 20.71 C ATOM 131 C VAL A 20 60.350 123.682 44.166 1.00 21.92 C ATOM 132 O VAL A 20 60.488 124.223 45.284 1.00 21.68 O ATOM 133 CB VAL A 20 58.166 122.615 43.573 1.00 19.13 C ATOM 134 CG1 VAL A 20 57.328 121.354 43.593 1.00 21.90 C ATOM 135 CG2 VAL A 20 57.422 123.740 44.373 1.00 20.95 C ATOM 0 H VAL A 20 59.573 122.140 46.037 1.00 20.63 H new ATOM 0 HA VAL A 20 60.021 121.804 43.387 1.00 20.71 H new ATOM 0 HB VAL A 20 58.267 122.916 42.656 1.00 19.13 H new ATOM 0 HG11 VAL A 20 56.432 121.556 43.282 1.00 21.90 H new ATOM 0 HG12 VAL A 20 57.729 120.689 43.012 1.00 21.90 H new ATOM 0 HG13 VAL A 20 57.285 121.008 44.498 1.00 21.90 H new ATOM 0 HG21 VAL A 20 56.524 123.846 44.023 1.00 20.95 H new ATOM 0 HG22 VAL A 20 57.376 123.494 45.310 1.00 20.95 H new ATOM 0 HG23 VAL A 20 57.905 124.576 44.282 1.00 20.95 H new ATOM 136 N PRO A 21 60.866 124.239 43.054 1.00 20.06 N ATOM 137 CA PRO A 21 61.489 125.585 43.066 1.00 19.88 C ATOM 138 C PRO A 21 60.552 126.685 43.591 1.00 20.95 C ATOM 139 O PRO A 21 59.347 126.642 43.334 1.00 20.17 O ATOM 140 CB PRO A 21 61.903 125.854 41.652 1.00 19.99 C ATOM 141 CG PRO A 21 62.100 124.403 41.113 1.00 19.14 C ATOM 142 CD PRO A 21 60.981 123.608 41.714 1.00 18.97 C ATOM 0 HA PRO A 21 62.242 125.597 43.677 1.00 19.88 H new ATOM 0 HB2 PRO A 21 61.224 126.339 41.158 1.00 19.99 H new ATOM 0 HB3 PRO A 21 62.718 126.377 41.602 1.00 19.99 H new ATOM 0 HG2 PRO A 21 62.065 124.381 40.144 1.00 19.14 H new ATOM 0 HG3 PRO A 21 62.963 124.046 41.374 1.00 19.14 H new ATOM 0 HD2 PRO A 21 60.161 123.685 41.202 1.00 18.97 H new ATOM 0 HD3 PRO A 21 61.193 122.663 41.771 1.00 18.97 H new ATOM 143 N GLU A 22 61.159 127.666 44.322 1.00 20.94 N ATOM 144 CA GLU A 22 60.361 128.814 44.864 1.00 21.71 C ATOM 145 C GLU A 22 59.524 129.551 43.823 1.00 20.79 C ATOM 146 O GLU A 22 58.473 130.121 44.202 1.00 20.97 O ATOM 147 CB GLU A 22 61.312 129.844 45.487 1.00 21.01 C ATOM 148 CG GLU A 22 62.173 129.309 46.622 1.00 24.21 C ATOM 149 CD GLU A 22 63.023 130.447 47.215 1.00 24.34 C ATOM 150 OE1 GLU A 22 63.888 131.017 46.509 1.00 25.18 O ATOM 151 OE2 GLU A 22 62.743 130.777 48.422 1.00 25.69 O ATOM 0 H GLU A 22 61.998 127.687 44.509 1.00 20.94 H new ATOM 0 HA GLU A 22 59.751 128.421 45.508 1.00 21.71 H new ATOM 0 HB2 GLU A 22 61.893 130.191 44.792 1.00 21.01 H new ATOM 0 HB3 GLU A 22 60.789 130.590 45.818 1.00 21.01 H new ATOM 0 HG2 GLU A 22 61.610 128.922 47.311 1.00 24.21 H new ATOM 0 HG3 GLU A 22 62.749 128.600 46.295 1.00 24.21 H new ATOM 152 N ARG A 23 59.912 129.525 42.544 1.00 20.98 N ATOM 153 CA ARG A 23 59.148 130.178 41.463 1.00 21.84 C ATOM 154 C ARG A 23 57.684 129.695 41.475 1.00 21.62 C ATOM 155 O ARG A 23 56.814 130.468 41.044 1.00 22.62 O ATOM 156 CB ARG A 23 59.822 130.040 40.100 1.00 25.07 C ATOM 157 CG ARG A 23 59.719 128.661 39.470 1.00 25.73 C ATOM 158 CD ARG A 23 60.550 128.529 38.215 1.00 24.19 C ATOM 159 NE ARG A 23 59.843 128.971 37.028 1.00 24.78 N ATOM 160 CZ ARG A 23 60.295 128.786 35.789 1.00 30.70 C ATOM 161 NH1 ARG A 23 61.482 128.223 35.606 1.00 31.86 N ATOM 162 NH2 ARG A 23 59.577 129.155 34.738 1.00 31.08 N ATOM 0 H ARG A 23 60.626 129.129 42.275 1.00 20.98 H new ATOM 0 HA ARG A 23 59.137 131.133 41.635 1.00 21.84 H new ATOM 0 HB2 ARG A 23 59.431 130.688 39.494 1.00 25.07 H new ATOM 0 HB3 ARG A 23 60.760 130.269 40.193 1.00 25.07 H new ATOM 0 HG2 ARG A 23 60.004 127.994 40.114 1.00 25.73 H new ATOM 0 HG3 ARG A 23 58.791 128.474 39.260 1.00 25.73 H new ATOM 0 HD2 ARG A 23 61.364 129.047 38.314 1.00 24.19 H new ATOM 0 HD3 ARG A 23 60.815 127.603 38.103 1.00 24.19 H new ATOM 0 HE ARG A 23 59.091 129.375 37.130 1.00 24.78 H new ATOM 0 HH11 ARG A 23 61.952 127.981 36.284 1.00 31.86 H new ATOM 0 HH12 ARG A 23 61.781 128.100 34.809 1.00 31.86 H new ATOM 0 HH21 ARG A 23 58.807 129.520 34.850 1.00 31.08 H new ATOM 0 HH22 ARG A 23 59.882 129.029 33.944 1.00 31.08 H new ATOM 163 N TYR A 24 57.406 128.441 41.842 1.00 20.15 N ATOM 164 CA TYR A 24 56.026 127.855 41.764 1.00 19.57 C ATOM 165 C TYR A 24 55.329 128.047 43.122 1.00 20.00 C ATOM 166 O TYR A 24 55.819 127.531 44.155 1.00 22.75 O ATOM 167 CB TYR A 24 56.083 126.362 41.362 1.00 21.50 C ATOM 168 CG TYR A 24 56.787 126.141 40.036 1.00 20.88 C ATOM 169 CD1 TYR A 24 56.193 126.566 38.865 1.00 19.30 C ATOM 170 CD2 TYR A 24 58.031 125.518 39.933 1.00 19.97 C ATOM 171 CE1 TYR A 24 56.791 126.402 37.612 1.00 19.35 C ATOM 172 CE2 TYR A 24 58.660 125.369 38.696 1.00 19.44 C ATOM 173 CZ TYR A 24 58.036 125.796 37.538 1.00 19.36 C ATOM 174 OH TYR A 24 58.598 125.712 36.288 1.00 20.92 O ATOM 0 H TYR A 24 57.998 127.895 42.144 1.00 20.15 H new ATOM 0 HA TYR A 24 55.515 128.312 41.078 1.00 19.57 H new ATOM 0 HB2 TYR A 24 56.541 125.861 42.055 1.00 21.50 H new ATOM 0 HB3 TYR A 24 55.181 126.011 41.308 1.00 21.50 H new ATOM 0 HD1 TYR A 24 55.361 126.978 38.911 1.00 19.30 H new ATOM 0 HD2 TYR A 24 58.447 125.197 40.700 1.00 19.97 H new ATOM 0 HE1 TYR A 24 56.361 126.694 36.841 1.00 19.35 H new ATOM 0 HE2 TYR A 24 59.504 124.980 38.650 1.00 19.44 H new ATOM 0 HH TYR A 24 59.291 125.239 36.324 1.00 20.92 H new ATOM 175 N GLN A 25 54.243 128.835 43.080 1.00 21.75 N ATOM 176 CA GLN A 25 53.450 129.243 44.282 1.00 22.51 C ATOM 177 C GLN A 25 51.996 128.756 44.223 1.00 24.51 C ATOM 178 O GLN A 25 51.505 128.459 43.179 1.00 24.66 O ATOM 179 CB GLN A 25 53.536 130.776 44.454 1.00 22.30 C ATOM 180 CG GLN A 25 54.934 131.264 44.856 1.00 21.41 C ATOM 181 CD GLN A 25 55.408 130.827 46.233 1.00 23.12 C ATOM 182 OE1 GLN A 25 54.634 130.886 47.203 1.00 26.38 O ATOM 183 NE2 GLN A 25 56.637 130.322 46.338 1.00 22.77 N ATOM 0 H GLN A 25 53.933 129.158 42.345 1.00 21.75 H new ATOM 0 HA GLN A 25 53.836 128.814 45.061 1.00 22.51 H new ATOM 0 HB2 GLN A 25 53.278 131.203 43.622 1.00 22.30 H new ATOM 0 HB3 GLN A 25 52.896 131.056 45.127 1.00 22.30 H new ATOM 0 HG2 GLN A 25 55.572 130.949 44.196 1.00 21.41 H new ATOM 0 HG3 GLN A 25 54.944 132.233 44.820 1.00 21.41 H new ATOM 0 HE21 GLN A 25 57.151 130.294 45.649 1.00 22.77 H new ATOM 0 HE22 GLN A 25 56.916 130.024 47.095 1.00 22.77 H new ATOM 184 N ASN A 26 51.376 128.716 45.411 1.00 29.98 N ATOM 185 CA ASN A 26 49.919 128.468 45.616 1.00 33.30 C ATOM 186 C ASN A 26 49.525 127.118 44.993 1.00 26.53 C ATOM 187 O ASN A 26 48.530 127.005 44.204 1.00 31.21 O ATOM 188 CB ASN A 26 49.146 129.711 45.167 1.00 38.43 C ATOM 189 CG ASN A 26 49.537 130.980 45.923 1.00 43.10 C ATOM 190 OD1 ASN A 26 50.089 130.962 47.042 1.00 44.00 O ATOM 191 ND2 ASN A 26 49.239 132.118 45.320 1.00 50.19 N ATOM 0 H ASN A 26 51.799 128.836 46.150 1.00 29.98 H new ATOM 0 HA ASN A 26 49.678 128.356 46.549 1.00 33.30 H new ATOM 0 HB2 ASN A 26 49.294 129.850 44.219 1.00 38.43 H new ATOM 0 HB3 ASN A 26 48.196 129.553 45.285 1.00 38.43 H new ATOM 0 HD21 ASN A 26 49.426 132.867 45.699 1.00 50.19 H new ATOM 0 HD22 ASN A 26 48.859 132.109 44.549 1.00 50.19 H new ATOM 192 N LEU A 27 50.312 126.083 45.271 1.00 28.64 N ATOM 193 CA LEU A 27 50.061 124.708 44.763 1.00 26.36 C ATOM 194 C LEU A 27 48.718 124.212 45.301 1.00 28.99 C ATOM 195 O LEU A 27 48.461 124.421 46.483 1.00 33.79 O ATOM 196 CB LEU A 27 51.200 123.786 45.197 1.00 26.59 C ATOM 197 CG LEU A 27 52.339 123.730 44.182 1.00 31.26 C ATOM 198 CD1 LEU A 27 53.202 124.990 44.254 1.00 33.35 C ATOM 199 CD2 LEU A 27 53.152 122.469 44.388 1.00 36.18 C ATOM 0 H LEU A 27 51.015 126.146 45.762 1.00 28.64 H new ATOM 0 HA LEU A 27 50.025 124.711 43.794 1.00 26.36 H new ATOM 0 HB2 LEU A 27 51.548 124.089 46.050 1.00 26.59 H new ATOM 0 HB3 LEU A 27 50.851 122.891 45.334 1.00 26.59 H new ATOM 0 HG LEU A 27 51.964 123.700 43.288 1.00 31.26 H new ATOM 0 HD11 LEU A 27 53.917 124.930 43.601 1.00 33.35 H new ATOM 0 HD12 LEU A 27 52.655 125.768 44.064 1.00 33.35 H new ATOM 0 HD13 LEU A 27 53.582 125.072 45.143 1.00 33.35 H new ATOM 0 HD21 LEU A 27 53.874 122.440 43.740 1.00 36.18 H new ATOM 0 HD22 LEU A 27 53.522 122.465 45.285 1.00 36.18 H new ATOM 0 HD23 LEU A 27 52.582 121.693 44.271 1.00 36.18 H new ATOM 200 N SER A 28 47.881 123.673 44.439 1.00 29.57 N ATOM 201 CA SER A 28 46.579 123.064 44.861 1.00 33.63 C ATOM 202 C SER A 28 46.245 121.832 44.016 1.00 30.26 C ATOM 203 O SER A 28 46.221 121.875 42.778 1.00 31.82 O ATOM 204 CB SER A 28 45.458 124.067 44.886 1.00 41.58 C ATOM 205 OG SER A 28 45.239 124.622 43.624 1.00 48.17 O ATOM 0 H SER A 28 48.027 123.637 43.592 1.00 29.57 H new ATOM 0 HA SER A 28 46.685 122.763 45.777 1.00 33.63 H new ATOM 0 HB2 SER A 28 44.646 123.638 45.197 1.00 41.58 H new ATOM 0 HB3 SER A 28 45.667 124.772 45.519 1.00 41.58 H new ATOM 0 HG SER A 28 44.609 125.176 43.667 1.00 48.17 H new ATOM 206 N PRO A 29 46.005 120.680 44.675 1.00 36.64 N ATOM 207 CA PRO A 29 45.706 119.424 43.983 1.00 39.10 C ATOM 208 C PRO A 29 44.563 119.518 42.972 1.00 45.51 C ATOM 209 O PRO A 29 43.582 120.223 43.203 1.00 47.75 O ATOM 210 CB PRO A 29 45.359 118.482 45.136 1.00 42.84 C ATOM 211 CG PRO A 29 46.237 118.970 46.251 1.00 40.54 C ATOM 212 CD PRO A 29 46.167 120.478 46.122 1.00 41.24 C ATOM 0 HA PRO A 29 46.452 119.131 43.436 1.00 39.10 H new ATOM 0 HB2 PRO A 29 44.419 118.533 45.371 1.00 42.84 H new ATOM 0 HB3 PRO A 29 45.545 117.557 44.912 1.00 42.84 H new ATOM 0 HG2 PRO A 29 45.916 118.670 47.116 1.00 40.54 H new ATOM 0 HG3 PRO A 29 47.146 118.645 46.158 1.00 40.54 H new ATOM 0 HD2 PRO A 29 45.422 120.847 46.622 1.00 41.24 H new ATOM 0 HD3 PRO A 29 46.971 120.905 46.456 1.00 41.24 H new ATOM 213 N VAL A 30 44.715 118.790 41.865 0.44 45.43 N ATOM 214 CA VAL A 30 43.773 118.795 40.709 0.44 49.27 C ATOM 215 C VAL A 30 43.401 117.346 40.349 0.44 50.93 C ATOM 216 O VAL A 30 42.191 117.080 40.215 0.44 54.10 O ATOM 217 CB VAL A 30 44.379 119.592 39.535 0.44 51.47 C ATOM 218 CG1 VAL A 30 43.957 119.067 38.171 0.44 53.19 C ATOM 219 CG2 VAL A 30 44.052 121.075 39.664 0.44 52.63 C ATOM 0 H VAL A 30 45.383 118.261 41.750 0.44 45.43 H new ATOM 0 HA VAL A 30 42.947 119.247 40.941 0.44 49.27 H new ATOM 0 HB VAL A 30 45.340 119.471 39.591 0.44 51.47 H new ATOM 0 HG11 VAL A 30 44.367 119.605 37.476 0.44 53.19 H new ATOM 0 HG12 VAL A 30 44.243 118.145 38.076 0.44 53.19 H new ATOM 0 HG13 VAL A 30 42.992 119.116 38.090 0.44 53.19 H new ATOM 0 HG21 VAL A 30 44.441 121.558 38.918 0.44 52.63 H new ATOM 0 HG22 VAL A 30 43.090 121.196 39.661 0.44 52.63 H new ATOM 0 HG23 VAL A 30 44.417 121.416 40.495 0.44 52.63 H new ATOM 220 N GLY A 31 44.378 116.437 40.231 0.44 51.94 N ATOM 221 CA GLY A 31 44.141 115.044 39.794 0.44 53.81 C ATOM 222 C GLY A 31 45.073 114.034 40.449 0.44 54.90 C ATOM 223 O GLY A 31 46.181 114.424 40.875 0.44 51.31 O ATOM 0 H GLY A 31 45.203 116.609 40.403 0.44 51.94 H new ATOM 0 HA2 GLY A 31 43.223 114.802 39.993 0.44 53.81 H new ATOM 0 HA3 GLY A 31 44.246 114.993 38.831 0.44 53.81 H new ATOM 224 N SER A 32 44.627 112.774 40.521 0.44 56.26 N ATOM 225 CA SER A 32 45.406 111.594 40.987 0.44 59.32 C ATOM 226 C SER A 32 45.244 110.445 39.983 0.44 62.11 C ATOM 227 O SER A 32 44.151 110.325 39.387 0.44 60.04 O ATOM 228 CB SER A 32 44.999 111.176 42.383 0.44 61.28 C ATOM 229 OG SER A 32 43.602 111.342 42.590 0.44 60.52 O ATOM 0 H SER A 32 43.825 112.565 40.290 0.44 56.26 H new ATOM 0 HA SER A 32 46.344 111.837 41.034 0.44 59.32 H new ATOM 0 HB2 SER A 32 45.241 110.248 42.527 0.44 61.28 H new ATOM 0 HB3 SER A 32 45.489 111.701 43.035 0.44 61.28 H new ATOM 0 HG SER A 32 43.404 111.102 43.370 0.44 60.52 H new ATOM 230 N GLY A 33 46.305 109.651 39.799 0.44 63.39 N ATOM 231 CA GLY A 33 46.346 108.490 38.887 0.44 65.21 C ATOM 232 C GLY A 33 47.433 107.508 39.291 0.44 65.02 C ATOM 233 O GLY A 33 48.193 107.822 40.230 0.44 66.26 O ATOM 0 H GLY A 33 47.048 109.775 40.214 0.44 63.39 H new ATOM 0 HA2 GLY A 33 45.485 108.043 38.891 0.44 65.21 H new ATOM 0 HA3 GLY A 33 46.503 108.794 37.980 0.44 65.21 H new ATOM 234 N ALA A 34 47.510 106.360 38.610 0.44 65.91 N ATOM 235 CA ALA A 34 48.509 105.294 38.866 0.44 62.49 C ATOM 236 C ALA A 34 49.914 105.766 38.461 0.44 60.34 C ATOM 237 O ALA A 34 50.886 105.223 39.028 0.44 60.57 O ATOM 238 CB ALA A 34 48.121 104.030 38.135 0.44 62.46 C ATOM 0 H ALA A 34 46.971 106.168 37.968 0.44 65.91 H new ATOM 0 HA ALA A 34 48.525 105.099 39.816 0.44 62.49 H new ATOM 0 HB1 ALA A 34 48.780 103.340 38.309 0.44 62.46 H new ATOM 0 HB2 ALA A 34 47.251 103.731 38.444 0.44 62.46 H new ATOM 0 HB3 ALA A 34 48.082 104.206 37.182 0.44 62.46 H new ATOM 239 N TYR A 35 50.017 106.735 37.537 0.44 57.33 N ATOM 240 CA TYR A 35 51.288 107.187 36.901 0.44 55.97 C ATOM 241 C TYR A 35 51.740 108.568 37.412 0.44 54.56 C ATOM 242 O TYR A 35 52.910 108.931 37.148 0.44 51.97 O ATOM 243 CB TYR A 35 51.139 107.219 35.378 0.44 57.53 C ATOM 0 H TYR A 35 49.331 107.166 37.249 0.44 57.33 H new ATOM 0 HA TYR A 35 51.973 106.546 37.148 0.44 55.97 H new ATOM 244 N GLY A 36 50.879 109.310 38.121 1.00 54.49 N ATOM 245 CA GLY A 36 51.288 110.582 38.750 1.00 51.04 C ATOM 246 C GLY A 36 50.190 111.325 39.491 1.00 49.93 C ATOM 247 O GLY A 36 48.983 110.960 39.388 1.00 52.45 O ATOM 0 H GLY A 36 50.056 109.098 38.251 1.00 54.49 H new ATOM 0 HA2 GLY A 36 52.011 110.400 39.371 1.00 51.04 H new ATOM 0 HA3 GLY A 36 51.645 111.165 38.062 1.00 51.04 H new ATOM 248 N SER A 37 50.616 112.361 40.218 0.44 45.24 N ATOM 249 CA SER A 37 49.787 113.343 40.960 0.44 40.76 C ATOM 250 C SER A 37 49.954 114.709 40.285 0.44 35.72 C ATOM 251 O SER A 37 51.091 115.003 39.879 0.44 33.38 O ATOM 252 CB SER A 37 50.219 113.394 42.401 0.44 41.12 C ATOM 253 OG SER A 37 50.603 112.102 42.862 0.44 45.95 O ATOM 0 H SER A 37 51.456 112.527 40.302 0.44 45.24 H new ATOM 0 HA SER A 37 48.852 113.085 40.943 0.44 40.76 H new ATOM 0 HB2 SER A 37 50.962 114.010 42.498 0.44 41.12 H new ATOM 0 HB3 SER A 37 49.494 113.735 42.948 0.44 41.12 H new ATOM 0 HG SER A 37 50.842 112.151 43.666 0.44 45.95 H new ATOM 254 N VAL A 38 48.885 115.505 40.179 1.00 33.79 N ATOM 255 CA VAL A 38 48.933 116.837 39.484 1.00 31.45 C ATOM 256 C VAL A 38 48.450 117.938 40.439 1.00 35.52 C ATOM 257 O VAL A 38 47.374 117.770 41.048 1.00 35.58 O ATOM 258 CB VAL A 38 48.126 116.875 38.180 1.00 32.80 C ATOM 259 CG1 VAL A 38 48.218 118.239 37.482 1.00 33.47 C ATOM 260 CG2 VAL A 38 48.551 115.770 37.224 1.00 35.81 C ATOM 0 H VAL A 38 48.112 115.306 40.499 1.00 33.79 H new ATOM 0 HA VAL A 38 49.858 116.990 39.236 1.00 31.45 H new ATOM 0 HB VAL A 38 47.200 116.728 38.429 1.00 32.80 H new ATOM 0 HG11 VAL A 38 47.696 118.220 36.665 1.00 33.47 H new ATOM 0 HG12 VAL A 38 47.872 118.928 38.071 1.00 33.47 H new ATOM 0 HG13 VAL A 38 49.144 118.432 37.269 1.00 33.47 H new ATOM 0 HG21 VAL A 38 48.022 115.823 36.412 1.00 35.81 H new ATOM 0 HG22 VAL A 38 49.490 115.875 37.005 1.00 35.81 H new ATOM 0 HG23 VAL A 38 48.412 114.907 37.644 1.00 35.81 H new ATOM 261 N CYS A 39 49.181 119.053 40.494 1.00 29.95 N ATOM 262 CA CYS A 39 48.755 120.316 41.168 1.00 29.69 C ATOM 263 C CYS A 39 48.707 121.470 40.171 1.00 29.64 C ATOM 264 O CYS A 39 49.581 121.589 39.311 1.00 27.63 O ATOM 265 CB CYS A 39 49.730 120.739 42.253 1.00 32.10 C ATOM 266 SG CYS A 39 49.616 119.743 43.761 1.00 36.45 S ATOM 0 H CYS A 39 49.960 119.111 40.135 1.00 29.95 H new ATOM 0 HA CYS A 39 47.882 120.132 41.548 1.00 29.69 H new ATOM 0 HB2 CYS A 39 50.634 120.682 41.905 1.00 32.10 H new ATOM 0 HB3 CYS A 39 49.570 121.669 42.476 1.00 32.10 H new ATOM 0 HG CYS A 39 50.293 118.759 43.643 1.00 36.45 H new ATOM 267 N ALA A 40 47.758 122.391 40.337 1.00 27.03 N ATOM 268 CA ALA A 40 47.785 123.734 39.706 1.00 26.20 C ATOM 269 C ALA A 40 48.735 124.623 40.527 1.00 24.27 C ATOM 270 O ALA A 40 48.774 124.500 41.743 1.00 27.58 O ATOM 271 CB ALA A 40 46.382 124.332 39.724 1.00 30.59 C ATOM 0 H ALA A 40 47.063 122.260 40.827 1.00 27.03 H new ATOM 0 HA ALA A 40 48.089 123.672 38.787 1.00 26.20 H new ATOM 0 HB1 ALA A 40 46.399 125.210 39.312 1.00 30.59 H new ATOM 0 HB2 ALA A 40 45.778 123.755 39.231 1.00 30.59 H new ATOM 0 HB3 ALA A 40 46.076 124.412 40.641 1.00 30.59 H new ATOM 272 N ALA A 41 49.425 125.535 39.879 1.00 24.30 N ATOM 273 CA ALA A 41 50.295 126.511 40.542 1.00 23.93 C ATOM 274 C ALA A 41 50.346 127.791 39.728 1.00 23.00 C ATOM 275 O ALA A 41 49.994 127.808 38.536 1.00 25.92 O ATOM 276 CB ALA A 41 51.671 125.936 40.765 1.00 26.10 C ATOM 0 H ALA A 41 49.408 125.615 39.023 1.00 24.30 H new ATOM 0 HA ALA A 41 49.929 126.723 41.415 1.00 23.93 H new ATOM 0 HB1 ALA A 41 52.230 126.596 41.204 1.00 26.10 H new ATOM 0 HB2 ALA A 41 51.605 125.146 41.324 1.00 26.10 H new ATOM 0 HB3 ALA A 41 52.064 125.696 39.911 1.00 26.10 H new ATOM 277 N PHE A 42 50.867 128.823 40.337 1.00 22.49 N ATOM 278 CA PHE A 42 51.223 130.086 39.651 1.00 24.35 C ATOM 279 C PHE A 42 52.748 130.110 39.492 1.00 23.37 C ATOM 280 O PHE A 42 53.515 130.007 40.499 1.00 21.94 O ATOM 281 CB PHE A 42 50.799 131.341 40.430 1.00 28.46 C ATOM 282 CG PHE A 42 51.140 132.653 39.746 1.00 28.28 C ATOM 283 CD1 PHE A 42 50.446 133.084 38.636 1.00 39.62 C ATOM 284 CD2 PHE A 42 52.157 133.464 40.242 1.00 36.08 C ATOM 285 CE1 PHE A 42 50.750 134.297 38.022 1.00 34.88 C ATOM 286 CE2 PHE A 42 52.470 134.670 39.614 1.00 37.79 C ATOM 287 CZ PHE A 42 51.758 135.080 38.512 1.00 33.87 C ATOM 0 H PHE A 42 51.036 128.832 41.180 1.00 22.49 H new ATOM 0 HA PHE A 42 50.754 130.106 38.802 1.00 24.35 H new ATOM 0 HB2 PHE A 42 49.841 131.307 40.579 1.00 28.46 H new ATOM 0 HB3 PHE A 42 51.223 131.325 41.302 1.00 28.46 H new ATOM 0 HD1 PHE A 42 49.763 132.556 38.291 1.00 39.62 H new ATOM 0 HD2 PHE A 42 52.631 133.200 40.997 1.00 36.08 H new ATOM 0 HE1 PHE A 42 50.267 134.575 37.278 1.00 34.88 H new ATOM 0 HE2 PHE A 42 53.162 135.198 39.942 1.00 37.79 H new ATOM 0 HZ PHE A 42 51.962 135.889 38.100 1.00 33.87 H new ATOM 288 N ASP A 43 53.204 130.259 38.243 1.00 21.93 N ATOM 289 CA ASP A 43 54.640 130.390 37.923 1.00 21.23 C ATOM 290 C ASP A 43 55.058 131.863 37.937 1.00 22.98 C ATOM 291 O ASP A 43 54.773 132.614 36.979 1.00 23.30 O ATOM 292 CB ASP A 43 54.969 129.829 36.533 1.00 22.22 C ATOM 293 CG ASP A 43 56.419 129.971 36.188 1.00 24.96 C ATOM 294 OD1 ASP A 43 57.246 130.316 37.100 1.00 25.50 O ATOM 295 OD2 ASP A 43 56.772 129.615 35.066 1.00 27.64 O ATOM 0 H ASP A 43 52.691 130.287 37.553 1.00 21.93 H new ATOM 0 HA ASP A 43 55.121 129.886 38.598 1.00 21.23 H new ATOM 0 HB2 ASP A 43 54.721 128.892 36.498 1.00 22.22 H new ATOM 0 HB3 ASP A 43 54.434 130.288 35.867 1.00 22.22 H new ATOM 296 N THR A 44 55.767 132.285 38.995 1.00 25.37 N ATOM 297 CA THR A 44 56.220 133.710 39.120 1.00 27.78 C ATOM 298 C THR A 44 57.248 134.168 38.074 1.00 29.85 C ATOM 299 O THR A 44 57.387 135.401 37.842 1.00 31.77 O ATOM 300 CB THR A 44 56.651 133.947 40.586 1.00 26.81 C ATOM 301 OG1 THR A 44 57.783 133.142 40.831 1.00 31.02 O ATOM 302 CG2 THR A 44 55.539 133.666 41.557 1.00 30.49 C ATOM 0 H THR A 44 56.000 131.779 39.650 1.00 25.37 H new ATOM 0 HA THR A 44 55.471 134.288 38.907 1.00 27.78 H new ATOM 0 HB THR A 44 56.873 134.882 40.718 1.00 26.81 H new ATOM 0 HG1 THR A 44 57.548 132.338 40.889 1.00 31.02 H new ATOM 0 HG21 THR A 44 55.851 133.827 42.461 1.00 30.49 H new ATOM 0 HG22 THR A 44 54.787 134.249 41.366 1.00 30.49 H new ATOM 0 HG23 THR A 44 55.260 132.741 41.471 1.00 30.49 H new ATOM 303 N LYS A 45 57.970 133.246 37.432 0.34 27.12 N ATOM 304 CA LYS A 45 58.975 133.610 36.395 0.34 28.29 C ATOM 305 C LYS A 45 58.251 134.027 35.108 0.34 28.35 C ATOM 306 O LYS A 45 58.689 135.016 34.489 0.34 28.48 O ATOM 307 CB LYS A 45 59.952 132.457 36.147 0.34 29.57 C ATOM 308 CG LYS A 45 61.057 132.725 35.132 0.34 30.51 C ATOM 309 CD LYS A 45 62.017 131.542 34.996 0.34 30.92 C ATOM 0 H LYS A 45 57.901 132.401 37.575 0.34 27.12 H new ATOM 0 HA LYS A 45 59.502 134.361 36.710 0.34 28.29 H new ATOM 0 HB2 LYS A 45 60.364 132.218 36.992 0.34 29.57 H new ATOM 0 HB3 LYS A 45 59.445 131.685 35.851 0.34 29.57 H new ATOM 0 HG2 LYS A 45 60.660 132.918 34.268 0.34 30.51 H new ATOM 0 HG3 LYS A 45 61.554 133.514 35.399 0.34 30.51 H new ATOM 310 N THR A 46 57.199 133.302 34.711 1.00 29.03 N ATOM 311 CA THR A 46 56.530 133.498 33.392 1.00 29.71 C ATOM 312 C THR A 46 55.201 134.227 33.493 1.00 28.14 C ATOM 313 O THR A 46 54.739 134.753 32.432 1.00 27.13 O ATOM 314 CB THR A 46 56.283 132.178 32.649 1.00 31.08 C ATOM 315 OG1 THR A 46 55.384 131.387 33.417 1.00 29.16 O ATOM 316 CG2 THR A 46 57.562 131.423 32.400 1.00 34.11 C ATOM 0 H THR A 46 56.846 132.681 35.190 1.00 29.03 H new ATOM 0 HA THR A 46 57.158 134.045 32.894 1.00 29.71 H new ATOM 0 HB THR A 46 55.900 132.378 31.780 1.00 31.08 H new ATOM 0 HG1 THR A 46 55.816 130.806 33.843 1.00 29.16 H new ATOM 0 HG21 THR A 46 57.365 130.598 31.930 1.00 34.11 H new ATOM 0 HG22 THR A 46 58.159 131.966 31.862 1.00 34.11 H new ATOM 0 HG23 THR A 46 57.987 131.218 33.247 1.00 34.11 H new ATOM 317 N GLY A 47 54.569 134.250 34.650 1.00 26.54 N ATOM 318 CA GLY A 47 53.191 134.734 34.825 1.00 28.44 C ATOM 319 C GLY A 47 52.118 133.735 34.388 1.00 30.38 C ATOM 320 O GLY A 47 50.952 134.120 34.323 1.00 38.42 O ATOM 0 H GLY A 47 54.930 133.979 35.382 1.00 26.54 H new ATOM 0 HA2 GLY A 47 53.052 134.955 35.759 1.00 28.44 H new ATOM 0 HA3 GLY A 47 53.080 135.555 34.320 1.00 28.44 H new ATOM 321 N HIS A 48 52.476 132.515 33.985 1.00 31.60 N ATOM 322 CA HIS A 48 51.456 131.539 33.519 1.00 32.44 C ATOM 323 C HIS A 48 50.878 130.799 34.729 1.00 29.76 C ATOM 324 O HIS A 48 51.607 130.547 35.731 1.00 27.48 O ATOM 325 CB HIS A 48 52.032 130.503 32.541 1.00 36.23 C ATOM 326 CG HIS A 48 52.739 131.055 31.343 1.00 39.31 C ATOM 327 ND1 HIS A 48 52.146 131.977 30.485 1.00 44.13 N ATOM 328 CD2 HIS A 48 53.944 130.736 30.801 1.00 40.91 C ATOM 329 CE1 HIS A 48 52.984 132.249 29.493 1.00 43.33 C ATOM 330 NE2 HIS A 48 54.101 131.513 29.669 1.00 43.08 N ATOM 0 H HIS A 48 53.286 132.226 33.969 1.00 31.60 H new ATOM 0 HA HIS A 48 50.771 132.041 33.051 1.00 32.44 H new ATOM 0 HB2 HIS A 48 52.651 129.935 33.026 1.00 36.23 H new ATOM 0 HB3 HIS A 48 51.307 129.936 32.234 1.00 36.23 H new ATOM 0 HD2 HIS A 48 54.550 130.112 31.130 1.00 40.91 H new ATOM 0 HE1 HIS A 48 52.828 132.845 28.796 1.00 43.33 H new ATOM 0 HE2 HIS A 48 54.795 131.525 29.161 1.00 43.08 H new ATOM 331 N ARG A 49 49.566 130.552 34.697 0.44 32.14 N ATOM 332 CA ARG A 49 48.899 129.530 35.539 0.44 31.75 C ATOM 333 C ARG A 49 49.269 128.177 34.934 0.44 31.37 C ATOM 334 O ARG A 49 48.804 127.871 33.817 0.44 36.22 O ATOM 335 CB ARG A 49 47.387 129.765 35.611 0.44 34.77 C ATOM 336 CG ARG A 49 47.009 130.835 36.632 0.44 36.08 C ATOM 0 H ARG A 49 49.024 130.976 34.181 0.44 32.14 H new ATOM 0 HA ARG A 49 49.196 129.573 36.461 0.44 31.75 H new ATOM 0 HB2 ARG A 49 47.062 130.028 34.736 0.44 34.77 H new ATOM 0 HB3 ARG A 49 46.944 128.933 35.840 0.44 34.77 H new ATOM 337 N VAL A 50 50.122 127.423 35.619 0.44 29.15 N ATOM 338 CA VAL A 50 50.795 126.232 35.030 0.44 26.57 C ATOM 339 C VAL A 50 50.154 124.991 35.631 0.44 24.53 C ATOM 340 O VAL A 50 49.486 125.112 36.674 0.44 25.45 O ATOM 341 CB VAL A 50 52.323 126.263 35.239 0.44 25.50 C ATOM 342 CG1 VAL A 50 52.942 127.434 34.497 0.44 27.04 C ATOM 343 CG2 VAL A 50 52.724 126.276 36.706 0.44 27.01 C ATOM 0 H VAL A 50 50.336 127.575 36.438 0.44 29.15 H new ATOM 0 HA VAL A 50 50.673 126.228 34.068 0.44 26.57 H new ATOM 0 HB VAL A 50 52.670 125.436 34.869 0.44 25.50 H new ATOM 0 HG11 VAL A 50 53.901 127.437 34.640 0.44 27.04 H new ATOM 0 HG12 VAL A 50 52.757 127.351 33.548 0.44 27.04 H new ATOM 0 HG13 VAL A 50 52.564 128.264 34.828 0.44 27.04 H new ATOM 0 HG21 VAL A 50 53.691 126.295 36.777 0.44 27.01 H new ATOM 0 HG22 VAL A 50 52.353 127.062 37.136 0.44 27.01 H new ATOM 0 HG23 VAL A 50 52.384 125.479 37.142 0.44 27.01 H new ATOM 344 N ALA A 51 50.289 123.863 34.942 0.44 25.15 N ATOM 345 CA ALA A 51 50.006 122.517 35.481 0.44 24.61 C ATOM 346 C ALA A 51 51.342 121.835 35.785 0.44 24.25 C ATOM 347 O ALA A 51 52.262 121.889 34.921 0.44 24.67 O ATOM 348 CB ALA A 51 49.170 121.731 34.500 0.44 25.26 C ATOM 0 H ALA A 51 50.555 123.850 34.124 0.44 25.15 H new ATOM 0 HA ALA A 51 49.492 122.572 36.302 0.44 24.61 H new ATOM 0 HB1 ALA A 51 48.989 120.849 34.862 0.44 25.26 H new ATOM 0 HB2 ALA A 51 48.332 122.194 34.345 0.44 25.26 H new ATOM 0 HB3 ALA A 51 49.651 121.644 33.662 0.44 25.26 H new ATOM 349 N VAL A 52 51.455 121.247 36.975 0.44 23.44 N ATOM 350 CA VAL A 52 52.671 120.516 37.442 0.44 23.02 C ATOM 351 C VAL A 52 52.278 119.064 37.727 0.44 23.15 C ATOM 352 O VAL A 52 51.347 118.844 38.544 0.44 24.61 O ATOM 353 CB VAL A 52 53.312 121.194 38.669 0.44 22.59 C ATOM 354 CG1 VAL A 52 54.601 120.493 39.071 0.44 23.84 C ATOM 355 CG2 VAL A 52 53.548 122.680 38.431 0.44 23.25 C ATOM 0 H VAL A 52 50.821 121.254 37.556 0.44 23.44 H new ATOM 0 HA VAL A 52 53.349 120.536 36.749 0.44 23.02 H new ATOM 0 HB VAL A 52 52.685 121.114 39.405 0.44 22.59 H new ATOM 0 HG11 VAL A 52 54.984 120.937 39.843 0.44 23.84 H new ATOM 0 HG12 VAL A 52 54.411 119.568 39.292 0.44 23.84 H new ATOM 0 HG13 VAL A 52 55.231 120.526 38.334 0.44 23.84 H new ATOM 0 HG21 VAL A 52 53.951 123.074 39.220 0.44 23.25 H new ATOM 0 HG22 VAL A 52 54.142 122.796 37.673 0.44 23.25 H new ATOM 0 HG23 VAL A 52 52.702 123.117 38.248 0.44 23.25 H new ATOM 356 N LYS A 53 52.931 118.116 37.050 0.44 23.02 N ATOM 357 CA LYS A 53 52.697 116.661 37.221 0.44 23.07 C ATOM 358 C LYS A 53 53.943 116.053 37.856 0.44 21.61 C ATOM 359 O LYS A 53 55.041 116.187 37.239 0.44 22.49 O ATOM 360 CB LYS A 53 52.388 115.981 35.886 0.44 23.41 C ATOM 361 CG LYS A 53 52.439 114.459 35.930 0.44 25.15 C ATOM 362 CD LYS A 53 51.938 113.816 34.662 0.44 26.84 C ATOM 363 CE LYS A 53 52.673 112.538 34.316 0.44 25.38 C ATOM 364 NZ LYS A 53 52.143 111.925 33.081 0.44 26.97 N ATOM 0 H LYS A 53 53.536 118.296 36.465 0.44 23.02 H new ATOM 0 HA LYS A 53 51.925 116.524 37.792 0.44 23.07 H new ATOM 0 HB2 LYS A 53 51.506 116.256 35.592 0.44 23.41 H new ATOM 0 HB3 LYS A 53 53.020 116.296 35.221 0.44 23.41 H new ATOM 0 HG2 LYS A 53 53.353 114.176 36.091 0.44 25.15 H new ATOM 0 HG3 LYS A 53 51.908 114.144 36.678 0.44 25.15 H new ATOM 0 HD2 LYS A 53 50.992 113.624 34.755 0.44 26.84 H new ATOM 0 HD3 LYS A 53 52.029 114.444 33.929 0.44 26.84 H new ATOM 0 HE2 LYS A 53 53.618 112.727 34.205 0.44 25.38 H new ATOM 0 HE3 LYS A 53 52.594 111.909 35.050 0.44 25.38 H new ATOM 0 HZ1 LYS A 53 52.040 111.050 33.204 0.44 26.97 H new ATOM 0 HZ2 LYS A 53 51.356 112.290 32.882 0.44 26.97 H new ATOM 0 HZ3 LYS A 53 52.713 112.065 32.412 0.44 26.97 H new ATOM 365 N LYS A 54 53.779 115.436 39.033 0.44 22.76 N ATOM 366 CA LYS A 54 54.815 114.647 39.753 0.44 22.63 C ATOM 367 C LYS A 54 54.661 113.168 39.382 0.44 23.98 C ATOM 368 O LYS A 54 53.533 112.648 39.551 0.44 24.35 O ATOM 369 CB LYS A 54 54.654 114.788 41.269 0.44 23.60 C ATOM 370 CG LYS A 54 55.728 114.085 42.082 0.44 23.56 C ATOM 371 CD LYS A 54 55.393 113.905 43.551 0.44 24.56 C ATOM 372 CE LYS A 54 56.527 113.258 44.320 0.44 25.14 C ATOM 373 NZ LYS A 54 56.139 112.893 45.700 0.44 25.73 N ATOM 0 H LYS A 54 53.032 115.462 39.458 0.44 22.76 H new ATOM 0 HA LYS A 54 55.690 114.979 39.497 0.44 22.63 H new ATOM 0 HB2 LYS A 54 54.656 115.731 41.497 0.44 23.60 H new ATOM 0 HB3 LYS A 54 53.787 114.436 41.525 0.44 23.60 H new ATOM 0 HG2 LYS A 54 55.894 113.213 41.691 0.44 23.56 H new ATOM 0 HG3 LYS A 54 56.553 114.590 42.010 0.44 23.56 H new ATOM 0 HD2 LYS A 54 55.189 114.769 43.943 0.44 24.56 H new ATOM 0 HD3 LYS A 54 54.595 113.360 43.635 0.44 24.56 H new ATOM 0 HE2 LYS A 54 56.821 112.463 43.849 0.44 25.14 H new ATOM 0 HE3 LYS A 54 57.282 113.866 44.350 0.44 25.14 H new ATOM 0 HZ1 LYS A 54 56.756 112.356 46.050 0.44 25.73 H new ATOM 0 HZ2 LYS A 54 56.073 113.630 46.195 0.44 25.73 H new ATOM 0 HZ3 LYS A 54 55.354 112.474 45.687 0.44 25.73 H new ATOM 374 N LEU A 55 55.731 112.514 38.904 1.00 25.87 N ATOM 375 CA LEU A 55 55.609 111.084 38.470 1.00 24.97 C ATOM 376 C LEU A 55 55.554 110.149 39.688 1.00 25.99 C ATOM 377 O LEU A 55 56.261 110.350 40.646 1.00 27.03 O ATOM 378 CB LEU A 55 56.767 110.768 37.524 1.00 24.42 C ATOM 379 CG LEU A 55 56.732 111.450 36.166 1.00 27.25 C ATOM 380 CD1 LEU A 55 57.860 110.882 35.295 1.00 27.57 C ATOM 381 CD2 LEU A 55 55.429 111.292 35.459 1.00 32.96 C ATOM 0 H LEU A 55 56.516 112.855 38.820 1.00 25.87 H new ATOM 0 HA LEU A 55 54.778 110.941 37.991 1.00 24.97 H new ATOM 0 HB2 LEU A 55 57.596 111.011 37.965 1.00 24.42 H new ATOM 0 HB3 LEU A 55 56.792 109.809 37.382 1.00 24.42 H new ATOM 0 HG LEU A 55 56.851 112.400 36.319 1.00 27.25 H new ATOM 0 HD11 LEU A 55 57.845 111.312 34.426 1.00 27.57 H new ATOM 0 HD12 LEU A 55 58.714 111.048 35.723 1.00 27.57 H new ATOM 0 HD13 LEU A 55 57.734 109.926 35.185 1.00 27.57 H new ATOM 0 HD21 LEU A 55 55.468 111.746 34.603 1.00 32.96 H new ATOM 0 HD22 LEU A 55 55.250 110.349 35.316 1.00 32.96 H new ATOM 0 HD23 LEU A 55 54.720 111.677 35.997 1.00 32.96 H new ATOM 382 N SER A 56 54.723 109.094 39.639 1.00 31.15 N ATOM 383 CA SER A 56 54.732 108.055 40.711 1.00 35.71 C ATOM 384 C SER A 56 55.595 106.870 40.270 1.00 30.90 C ATOM 385 O SER A 56 55.367 106.394 39.141 1.00 35.79 O ATOM 386 CB SER A 56 53.359 107.612 41.129 1.00 43.55 C ATOM 387 OG SER A 56 52.528 107.444 40.007 1.00 50.22 O ATOM 0 H SER A 56 54.154 108.955 39.010 1.00 31.15 H new ATOM 0 HA SER A 56 55.119 108.461 41.502 1.00 35.71 H new ATOM 0 HB2 SER A 56 53.419 106.778 41.621 1.00 43.55 H new ATOM 0 HB3 SER A 56 52.971 108.268 41.729 1.00 43.55 H new ATOM 0 HG SER A 56 52.164 106.688 40.039 1.00 50.22 H new ATOM 388 N ARG A 57 56.531 106.493 41.139 1.00 36.38 N ATOM 389 CA ARG A 57 57.339 105.250 41.027 1.00 37.89 C ATOM 390 C ARG A 57 57.993 105.238 39.649 1.00 34.63 C ATOM 391 O ARG A 57 57.807 104.271 38.896 1.00 32.79 O ATOM 392 CB ARG A 57 56.426 104.032 41.220 1.00 40.73 C ATOM 0 H ARG A 57 56.728 106.959 41.834 1.00 36.38 H new ATOM 0 HA ARG A 57 58.028 105.217 41.709 1.00 37.89 H new ATOM 393 N PRO A 58 58.646 106.351 39.218 1.00 31.81 N ATOM 394 CA PRO A 58 59.122 106.422 37.832 1.00 28.39 C ATOM 395 C PRO A 58 60.163 105.367 37.425 1.00 28.86 C ATOM 396 O PRO A 58 60.259 105.118 36.226 1.00 25.45 O ATOM 397 CB PRO A 58 59.800 107.810 37.752 1.00 28.34 C ATOM 398 CG PRO A 58 60.100 108.179 39.200 1.00 32.01 C ATOM 399 CD PRO A 58 58.928 107.585 39.962 1.00 31.02 C ATOM 0 HA PRO A 58 58.372 106.268 37.237 1.00 28.39 H new ATOM 0 HB2 PRO A 58 60.612 107.776 37.222 1.00 28.34 H new ATOM 0 HB3 PRO A 58 59.217 108.464 37.336 1.00 28.34 H new ATOM 0 HG2 PRO A 58 60.945 107.807 39.496 1.00 32.01 H new ATOM 0 HG3 PRO A 58 60.155 109.140 39.320 1.00 32.01 H new ATOM 0 HD2 PRO A 58 59.156 107.403 40.887 1.00 31.02 H new ATOM 0 HD3 PRO A 58 58.164 108.183 39.970 1.00 31.02 H new ATOM 400 N PHE A 59 60.905 104.793 38.372 1.00 28.35 N ATOM 401 CA PHE A 59 62.028 103.844 38.099 1.00 27.42 C ATOM 402 C PHE A 59 61.782 102.517 38.838 1.00 31.75 C ATOM 403 O PHE A 59 62.777 101.862 39.124 1.00 31.04 O ATOM 404 CB PHE A 59 63.353 104.468 38.491 1.00 26.24 C ATOM 405 CG PHE A 59 63.573 105.805 37.810 1.00 28.81 C ATOM 406 CD1 PHE A 59 63.651 105.898 36.428 1.00 27.18 C ATOM 407 CD2 PHE A 59 63.660 106.975 38.547 1.00 29.96 C ATOM 408 CE1 PHE A 59 63.828 107.138 35.818 1.00 27.21 C ATOM 409 CE2 PHE A 59 63.845 108.205 37.940 1.00 27.40 C ATOM 410 CZ PHE A 59 63.922 108.289 36.568 1.00 27.02 C ATOM 0 H PHE A 59 60.779 104.937 39.211 1.00 28.35 H new ATOM 0 HA PHE A 59 62.066 103.654 37.148 1.00 27.42 H new ATOM 0 HB2 PHE A 59 63.382 104.587 39.453 1.00 26.24 H new ATOM 0 HB3 PHE A 59 64.076 103.864 38.258 1.00 26.24 H new ATOM 0 HD1 PHE A 59 63.585 105.130 35.907 1.00 27.18 H new ATOM 0 HD2 PHE A 59 63.592 106.933 39.474 1.00 29.96 H new ATOM 0 HE1 PHE A 59 63.883 107.189 34.891 1.00 27.21 H new ATOM 0 HE2 PHE A 59 63.917 108.974 38.458 1.00 27.40 H new ATOM 0 HZ PHE A 59 64.036 109.113 36.153 1.00 27.02 H new ATOM 411 N GLN A 60 60.525 102.110 38.965 1.00 32.14 N ATOM 412 CA GLN A 60 60.188 100.937 39.838 1.00 37.22 C ATOM 413 C GLN A 60 60.467 99.598 39.135 1.00 39.38 C ATOM 414 O GLN A 60 60.608 98.594 39.850 1.00 37.94 O ATOM 415 CB GLN A 60 58.743 101.052 40.324 1.00 36.23 C ATOM 416 CG GLN A 60 57.695 100.876 39.243 1.00 41.51 C ATOM 417 CD GLN A 60 56.323 100.766 39.852 1.00 50.54 C ATOM 418 OE1 GLN A 60 55.394 101.461 39.451 1.00 61.88 O ATOM 419 NE2 GLN A 60 56.207 99.898 40.847 1.00 48.58 N ATOM 0 H GLN A 60 59.852 102.475 38.573 1.00 32.14 H new ATOM 0 HA GLN A 60 60.769 100.952 40.615 1.00 37.22 H new ATOM 0 HB2 GLN A 60 58.593 100.387 41.014 1.00 36.23 H new ATOM 0 HB3 GLN A 60 58.622 101.921 40.737 1.00 36.23 H new ATOM 0 HG2 GLN A 60 57.724 101.628 38.631 1.00 41.51 H new ATOM 0 HG3 GLN A 60 57.889 100.080 38.723 1.00 41.51 H new ATOM 0 HE21 GLN A 60 56.887 99.433 41.093 1.00 48.58 H new ATOM 0 HE22 GLN A 60 55.452 99.800 41.246 1.00 48.58 H new ATOM 420 N SER A 61 60.541 99.559 37.804 1.00 33.06 N ATOM 421 CA SER A 61 60.785 98.367 36.955 1.00 37.37 C ATOM 422 C SER A 61 61.451 98.802 35.641 1.00 36.15 C ATOM 423 O SER A 61 61.422 100.014 35.318 1.00 30.47 O ATOM 424 CB SER A 61 59.537 97.608 36.663 1.00 36.30 C ATOM 425 OG SER A 61 58.758 98.232 35.667 1.00 39.15 O ATOM 0 H SER A 61 60.445 100.272 37.333 1.00 33.06 H new ATOM 0 HA SER A 61 61.371 97.772 37.449 1.00 37.37 H new ATOM 0 HB2 SER A 61 59.766 96.710 36.378 1.00 36.30 H new ATOM 0 HB3 SER A 61 59.014 97.523 37.475 1.00 36.30 H new ATOM 0 HG SER A 61 58.151 98.686 36.029 1.00 39.15 H new ATOM 426 N ILE A 62 61.997 97.864 34.881 1.00 37.64 N ATOM 427 CA ILE A 62 62.581 98.236 33.566 1.00 32.86 C ATOM 428 C ILE A 62 61.484 98.891 32.724 1.00 34.71 C ATOM 429 O ILE A 62 61.752 99.956 32.089 1.00 32.27 O ATOM 430 CB ILE A 62 63.211 97.024 32.849 1.00 33.53 C ATOM 431 CG1 ILE A 62 64.441 96.512 33.599 1.00 37.83 C ATOM 432 CG2 ILE A 62 63.566 97.448 31.428 1.00 36.13 C ATOM 433 CD1 ILE A 62 64.973 95.166 33.105 1.00 41.88 C ATOM 0 H ILE A 62 62.047 97.030 35.085 1.00 37.64 H new ATOM 0 HA ILE A 62 63.307 98.865 33.701 1.00 32.86 H new ATOM 0 HB ILE A 62 62.577 96.290 32.825 1.00 33.53 H new ATOM 0 HG12 ILE A 62 65.148 97.172 33.526 1.00 37.83 H new ATOM 0 HG13 ILE A 62 64.222 96.434 34.541 1.00 37.83 H new ATOM 0 HG21 ILE A 62 63.965 96.700 30.957 1.00 36.13 H new ATOM 0 HG22 ILE A 62 62.762 97.730 30.964 1.00 36.13 H new ATOM 0 HG23 ILE A 62 64.197 98.184 31.458 1.00 36.13 H new ATOM 0 HD11 ILE A 62 65.749 94.913 33.629 1.00 41.88 H new ATOM 0 HD12 ILE A 62 64.284 94.490 33.201 1.00 41.88 H new ATOM 0 HD13 ILE A 62 65.224 95.240 32.171 1.00 41.88 H new ATOM 434 N ILE A 63 60.274 98.322 32.702 1.00 31.69 N ATOM 435 CA ILE A 63 59.137 98.805 31.877 1.00 35.90 C ATOM 436 C ILE A 63 58.821 100.256 32.307 1.00 33.67 C ATOM 437 O ILE A 63 58.613 101.131 31.425 1.00 30.16 O ATOM 438 CB ILE A 63 57.913 97.868 32.045 1.00 43.12 C ATOM 439 CG1 ILE A 63 58.230 96.422 31.637 1.00 51.27 C ATOM 440 CG2 ILE A 63 56.708 98.441 31.320 1.00 44.38 C ATOM 441 CD1 ILE A 63 57.451 95.864 30.449 1.00 51.94 C ATOM 0 H ILE A 63 60.079 97.630 33.173 1.00 31.69 H new ATOM 0 HA ILE A 63 59.366 98.796 30.934 1.00 35.90 H new ATOM 0 HB ILE A 63 57.689 97.824 32.988 1.00 43.12 H new ATOM 0 HG12 ILE A 63 59.177 96.364 31.433 1.00 51.27 H new ATOM 0 HG13 ILE A 63 58.069 95.848 32.402 1.00 51.27 H new ATOM 0 HG21 ILE A 63 55.950 97.847 31.432 1.00 44.38 H new ATOM 0 HG22 ILE A 63 56.493 99.312 31.688 1.00 44.38 H new ATOM 0 HG23 ILE A 63 56.911 98.531 30.376 1.00 44.38 H new ATOM 0 HD11 ILE A 63 57.729 94.950 30.280 1.00 51.94 H new ATOM 0 HD12 ILE A 63 56.502 95.881 30.647 1.00 51.94 H new ATOM 0 HD13 ILE A 63 57.627 96.405 29.664 1.00 51.94 H new ATOM 442 N HIS A 64 58.783 100.522 33.613 1.00 33.19 N ATOM 443 CA HIS A 64 58.408 101.853 34.169 1.00 34.26 C ATOM 444 C HIS A 64 59.522 102.877 33.881 1.00 32.07 C ATOM 445 O HIS A 64 59.183 104.024 33.521 1.00 25.61 O ATOM 446 CB HIS A 64 58.039 101.761 35.663 1.00 38.75 C ATOM 447 CG HIS A 64 56.750 101.034 35.899 1.00 46.84 C ATOM 448 ND1 HIS A 64 56.703 99.735 36.423 1.00 55.18 N ATOM 449 CD2 HIS A 64 55.469 101.376 35.634 1.00 52.02 C ATOM 450 CE1 HIS A 64 55.448 99.334 36.487 1.00 55.06 C ATOM 451 NE2 HIS A 64 54.669 100.326 36.019 1.00 55.35 N ATOM 0 H HIS A 64 58.973 99.939 34.216 1.00 33.19 H new ATOM 0 HA HIS A 64 57.606 102.167 33.723 1.00 34.26 H new ATOM 0 HB2 HIS A 64 58.752 101.310 36.141 1.00 38.75 H new ATOM 0 HB3 HIS A 64 57.973 102.656 36.031 1.00 38.75 H new ATOM 0 HD2 HIS A 64 55.181 102.177 35.259 1.00 52.02 H new ATOM 0 HE1 HIS A 64 55.153 98.510 36.801 1.00 55.06 H new ATOM 0 HE2 HIS A 64 53.811 100.307 35.969 1.00 55.35 H new ATOM 452 N ALA A 65 60.786 102.500 34.027 1.00 26.33 N ATOM 453 CA ALA A 65 61.956 103.390 33.789 1.00 27.12 C ATOM 454 C ALA A 65 61.960 103.777 32.305 1.00 26.17 C ATOM 455 O ALA A 65 62.170 104.974 31.989 1.00 22.14 O ATOM 456 CB ALA A 65 63.259 102.733 34.234 1.00 25.05 C ATOM 0 H ALA A 65 61.008 101.706 34.272 1.00 26.33 H new ATOM 0 HA ALA A 65 61.882 104.195 34.325 1.00 27.12 H new ATOM 0 HB1 ALA A 65 64.000 103.336 34.066 1.00 25.05 H new ATOM 0 HB2 ALA A 65 63.214 102.533 35.182 1.00 25.05 H new ATOM 0 HB3 ALA A 65 63.393 101.911 33.737 1.00 25.05 H new ATOM 457 N LYS A 66 61.717 102.827 31.399 1.00 22.64 N ATOM 458 CA LYS A 66 61.690 103.123 29.951 1.00 21.82 C ATOM 459 C LYS A 66 60.522 104.028 29.595 1.00 23.35 C ATOM 460 O LYS A 66 60.689 104.946 28.757 1.00 21.30 O ATOM 461 CB LYS A 66 61.647 101.821 29.142 1.00 22.90 C ATOM 462 CG LYS A 66 61.841 101.977 27.637 1.00 21.96 C ATOM 463 CD LYS A 66 61.873 100.627 26.861 1.00 24.22 C ATOM 464 CE LYS A 66 62.024 100.832 25.374 1.00 26.48 C ATOM 465 NZ LYS A 66 61.689 99.595 24.607 1.00 31.95 N ATOM 0 H LYS A 66 61.565 102.004 31.596 1.00 22.64 H new ATOM 0 HA LYS A 66 62.504 103.598 29.723 1.00 21.82 H new ATOM 0 HB2 LYS A 66 62.333 101.225 29.481 1.00 22.90 H new ATOM 0 HB3 LYS A 66 60.793 101.389 29.299 1.00 22.90 H new ATOM 0 HG2 LYS A 66 61.124 102.526 27.283 1.00 21.96 H new ATOM 0 HG3 LYS A 66 62.670 102.453 27.474 1.00 21.96 H new ATOM 0 HD2 LYS A 66 62.608 100.085 27.188 1.00 24.22 H new ATOM 0 HD3 LYS A 66 61.056 100.134 27.037 1.00 24.22 H new ATOM 0 HE2 LYS A 66 61.447 101.557 25.087 1.00 26.48 H new ATOM 0 HE3 LYS A 66 62.935 101.099 25.175 1.00 26.48 H new ATOM 0 HZ1 LYS A 66 61.884 99.716 23.747 1.00 31.95 H new ATOM 0 HZ2 LYS A 66 62.162 98.911 24.925 1.00 31.95 H new ATOM 0 HZ3 LYS A 66 60.821 99.419 24.691 1.00 31.95 H new ATOM 466 N ARG A 67 59.358 103.815 30.235 1.00 23.58 N ATOM 467 CA ARG A 67 58.159 104.666 29.981 1.00 24.28 C ATOM 468 C ARG A 67 58.479 106.110 30.446 1.00 21.59 C ATOM 469 O ARG A 67 58.031 107.072 29.752 1.00 21.41 O ATOM 470 CB ARG A 67 56.928 104.147 30.743 1.00 27.10 C ATOM 471 CG ARG A 67 55.640 104.880 30.383 1.00 33.87 C ATOM 472 CD ARG A 67 54.827 105.256 31.632 1.00 42.51 C ATOM 0 H ARG A 67 59.235 103.192 30.815 1.00 23.58 H new ATOM 0 HA ARG A 67 57.953 104.643 29.033 1.00 24.28 H new ATOM 0 HB2 ARG A 67 56.817 103.201 30.558 1.00 27.10 H new ATOM 0 HB3 ARG A 67 57.086 104.233 31.696 1.00 27.10 H new ATOM 0 HG2 ARG A 67 55.854 105.683 29.883 1.00 33.87 H new ATOM 0 HG3 ARG A 67 55.101 104.320 29.803 1.00 33.87 H new ATOM 473 N THR A 68 59.115 106.294 31.593 1.00 20.47 N ATOM 474 CA THR A 68 59.537 107.638 32.090 1.00 20.87 C ATOM 475 C THR A 68 60.404 108.301 31.013 1.00 19.82 C ATOM 476 O THR A 68 60.174 109.503 30.648 1.00 19.06 O ATOM 477 CB THR A 68 60.210 107.559 33.452 1.00 22.39 C ATOM 478 OG1 THR A 68 59.240 107.031 34.383 1.00 25.15 O ATOM 479 CG2 THR A 68 60.701 108.890 33.940 1.00 23.38 C ATOM 0 H THR A 68 59.324 105.649 32.123 1.00 20.47 H new ATOM 0 HA THR A 68 58.758 108.196 32.240 1.00 20.87 H new ATOM 0 HB THR A 68 60.991 106.989 33.378 1.00 22.39 H new ATOM 0 HG1 THR A 68 59.609 106.465 34.882 1.00 25.15 H new ATOM 0 HG21 THR A 68 61.120 108.782 34.808 1.00 23.38 H new ATOM 0 HG22 THR A 68 61.348 109.247 33.312 1.00 23.38 H new ATOM 0 HG23 THR A 68 59.953 109.503 34.016 1.00 23.38 H new ATOM 480 N TYR A 69 61.429 107.587 30.547 1.00 19.95 N ATOM 481 CA TYR A 69 62.345 108.159 29.516 1.00 19.74 C ATOM 482 C TYR A 69 61.598 108.522 28.234 1.00 20.21 C ATOM 483 O TYR A 69 61.792 109.631 27.638 1.00 18.89 O ATOM 484 CB TYR A 69 63.484 107.164 29.207 1.00 18.72 C ATOM 485 CG TYR A 69 64.463 107.673 28.154 1.00 18.93 C ATOM 486 CD1 TYR A 69 65.368 108.670 28.458 1.00 19.51 C ATOM 487 CD2 TYR A 69 64.486 107.141 26.869 1.00 19.97 C ATOM 488 CE1 TYR A 69 66.259 109.164 27.502 1.00 20.97 C ATOM 489 CE2 TYR A 69 65.400 107.594 25.937 1.00 19.55 C ATOM 490 CZ TYR A 69 66.299 108.575 26.250 1.00 19.83 C ATOM 491 OH TYR A 69 67.200 109.000 25.263 1.00 21.79 O ATOM 0 H TYR A 69 61.620 106.787 30.799 1.00 19.95 H new ATOM 0 HA TYR A 69 62.722 108.976 29.877 1.00 19.74 H new ATOM 0 HB2 TYR A 69 63.969 106.974 30.025 1.00 18.72 H new ATOM 0 HB3 TYR A 69 63.100 106.327 28.904 1.00 18.72 H new ATOM 0 HD1 TYR A 69 65.385 109.021 29.319 1.00 19.51 H new ATOM 0 HD2 TYR A 69 63.881 106.475 26.635 1.00 19.97 H new ATOM 0 HE1 TYR A 69 66.818 109.879 27.704 1.00 20.97 H new ATOM 0 HE2 TYR A 69 65.404 107.226 25.083 1.00 19.55 H new ATOM 0 HH TYR A 69 67.753 109.535 25.600 1.00 21.79 H new ATOM 492 N ARG A 70 60.711 107.625 27.777 1.00 19.00 N ATOM 493 CA ARG A 70 59.876 107.836 26.558 1.00 20.05 C ATOM 494 C ARG A 70 59.043 109.123 26.690 1.00 19.76 C ATOM 495 O ARG A 70 59.002 109.941 25.758 1.00 19.34 O ATOM 496 CB ARG A 70 58.943 106.645 26.330 1.00 21.29 C ATOM 497 CG ARG A 70 58.015 106.750 25.126 1.00 21.25 C ATOM 498 CD ARG A 70 56.962 105.619 25.114 1.00 22.97 C ATOM 499 NE ARG A 70 57.643 104.348 24.889 1.00 25.61 N ATOM 500 CZ ARG A 70 57.600 103.279 25.692 1.00 28.20 C ATOM 501 NH1 ARG A 70 56.769 103.207 26.729 1.00 30.00 N ATOM 502 NH2 ARG A 70 58.369 102.225 25.403 1.00 29.14 N ATOM 0 H ARG A 70 60.570 106.869 28.162 1.00 19.00 H new ATOM 0 HA ARG A 70 60.473 107.920 25.798 1.00 20.05 H new ATOM 0 HB2 ARG A 70 59.484 105.846 26.231 1.00 21.29 H new ATOM 0 HB3 ARG A 70 58.401 106.524 27.125 1.00 21.29 H new ATOM 0 HG2 ARG A 70 57.566 107.610 25.137 1.00 21.25 H new ATOM 0 HG3 ARG A 70 58.538 106.714 24.310 1.00 21.25 H new ATOM 0 HD2 ARG A 70 56.481 105.598 25.956 1.00 22.97 H new ATOM 0 HD3 ARG A 70 56.306 105.777 24.417 1.00 22.97 H new ATOM 0 HE ARG A 70 58.116 104.280 24.174 1.00 25.61 H new ATOM 0 HH11 ARG A 70 56.237 103.861 26.900 1.00 30.00 H new ATOM 0 HH12 ARG A 70 56.764 102.507 27.228 1.00 30.00 H new ATOM 0 HH21 ARG A 70 58.880 102.242 24.711 1.00 29.14 H new ATOM 0 HH22 ARG A 70 58.353 101.530 25.909 1.00 29.14 H new ATOM 503 N GLU A 71 58.326 109.275 27.808 1.00 19.12 N ATOM 504 CA GLU A 71 57.464 110.467 28.022 1.00 20.71 C ATOM 505 C GLU A 71 58.324 111.749 28.007 1.00 18.96 C ATOM 506 O GLU A 71 57.963 112.736 27.331 1.00 20.03 O ATOM 507 CB GLU A 71 56.722 110.394 29.368 1.00 21.00 C ATOM 508 CG GLU A 71 55.776 111.560 29.599 1.00 22.93 C ATOM 509 CD GLU A 71 54.826 111.470 30.792 1.00 28.76 C ATOM 510 OE1 GLU A 71 55.099 110.696 31.700 1.00 32.68 O ATOM 511 OE2 GLU A 71 53.890 112.277 30.804 1.00 32.34 O ATOM 0 H GLU A 71 58.318 108.709 28.455 1.00 19.12 H new ATOM 0 HA GLU A 71 56.812 110.486 27.304 1.00 20.71 H new ATOM 0 HB2 GLU A 71 56.219 109.565 29.408 1.00 21.00 H new ATOM 0 HB3 GLU A 71 57.372 110.366 30.087 1.00 21.00 H new ATOM 0 HG2 GLU A 71 56.310 112.363 29.701 1.00 22.93 H new ATOM 0 HG3 GLU A 71 55.241 111.675 28.798 1.00 22.93 H new ATOM 512 N LEU A 72 59.460 111.759 28.675 1.00 19.15 N ATOM 513 CA LEU A 72 60.292 112.972 28.763 1.00 19.74 C ATOM 514 C LEU A 72 60.872 113.295 27.368 1.00 19.06 C ATOM 515 O LEU A 72 60.859 114.490 26.918 1.00 18.21 O ATOM 516 CB LEU A 72 61.372 112.866 29.835 1.00 19.67 C ATOM 517 CG LEU A 72 62.279 114.063 29.992 1.00 20.95 C ATOM 518 CD1 LEU A 72 61.523 115.373 30.273 1.00 21.97 C ATOM 519 CD2 LEU A 72 63.290 113.815 31.106 1.00 24.17 C ATOM 0 H LEU A 72 59.779 111.077 29.091 1.00 19.15 H new ATOM 0 HA LEU A 72 59.731 113.711 29.044 1.00 19.74 H new ATOM 0 HB2 LEU A 72 60.940 112.698 30.687 1.00 19.67 H new ATOM 0 HB3 LEU A 72 61.922 112.091 29.638 1.00 19.67 H new ATOM 0 HG LEU A 72 62.730 114.172 29.140 1.00 20.95 H new ATOM 0 HD11 LEU A 72 62.158 116.100 30.363 1.00 21.97 H new ATOM 0 HD12 LEU A 72 60.918 115.562 29.539 1.00 21.97 H new ATOM 0 HD13 LEU A 72 61.015 115.284 31.095 1.00 21.97 H new ATOM 0 HD21 LEU A 72 63.867 114.589 31.198 1.00 24.17 H new ATOM 0 HD22 LEU A 72 62.821 113.661 31.941 1.00 24.17 H new ATOM 0 HD23 LEU A 72 63.827 113.037 30.889 1.00 24.17 H new ATOM 520 N ARG A 73 61.346 112.293 26.637 1.00 18.74 N ATOM 521 CA ARG A 73 61.846 112.549 25.255 1.00 18.37 C ATOM 522 C ARG A 73 60.762 113.164 24.348 1.00 18.42 C ATOM 523 O ARG A 73 61.025 114.149 23.583 1.00 18.62 O ATOM 524 CB ARG A 73 62.383 111.253 24.631 1.00 17.57 C ATOM 525 CG ARG A 73 63.750 110.773 25.128 1.00 18.81 C ATOM 526 CD ARG A 73 64.926 111.644 24.673 1.00 20.36 C ATOM 527 NE ARG A 73 64.878 111.881 23.241 1.00 20.19 N ATOM 528 CZ ARG A 73 65.279 111.008 22.291 1.00 22.06 C ATOM 529 NH1 ARG A 73 65.854 109.876 22.616 1.00 20.70 N ATOM 530 NH2 ARG A 73 65.058 111.260 21.029 1.00 23.09 N ATOM 0 H ARG A 73 61.393 111.475 26.898 1.00 18.74 H new ATOM 0 HA ARG A 73 62.567 113.194 25.327 1.00 18.37 H new ATOM 0 HB2 ARG A 73 61.737 110.548 24.791 1.00 17.57 H new ATOM 0 HB3 ARG A 73 62.435 111.377 23.670 1.00 17.57 H new ATOM 0 HG2 ARG A 73 63.738 110.744 26.097 1.00 18.81 H new ATOM 0 HG3 ARG A 73 63.895 109.865 24.819 1.00 18.81 H new ATOM 0 HD2 ARG A 73 64.906 112.491 25.145 1.00 20.36 H new ATOM 0 HD3 ARG A 73 65.762 111.210 24.904 1.00 20.36 H new ATOM 0 HE ARG A 73 64.569 112.639 22.976 1.00 20.19 H new ATOM 0 HH11 ARG A 73 65.981 109.680 23.444 1.00 20.70 H new ATOM 0 HH12 ARG A 73 66.105 109.329 22.001 1.00 20.70 H new ATOM 0 HH21 ARG A 73 64.656 111.984 20.799 1.00 23.09 H new ATOM 0 HH22 ARG A 73 65.315 110.702 20.428 1.00 23.09 H new ATOM 531 N LEU A 74 59.574 112.550 24.363 0.44 20.16 N ATOM 532 CA LEU A 74 58.476 112.916 23.443 0.44 21.00 C ATOM 533 C LEU A 74 58.057 114.354 23.761 0.44 20.75 C ATOM 534 O LEU A 74 57.972 115.190 22.846 0.44 22.77 O ATOM 535 CB LEU A 74 57.313 111.930 23.590 0.44 22.86 C ATOM 536 CG LEU A 74 56.499 111.672 22.330 0.44 26.78 C ATOM 537 CD1 LEU A 74 55.235 110.905 22.670 0.44 26.35 C ATOM 538 CD2 LEU A 74 56.149 112.989 21.640 0.44 24.61 C ATOM 0 H LEU A 74 59.378 111.911 24.904 0.44 20.16 H new ATOM 0 HA LEU A 74 58.766 112.868 22.519 0.44 21.00 H new ATOM 0 HB2 LEU A 74 57.667 111.084 23.905 0.44 22.86 H new ATOM 0 HB3 LEU A 74 56.715 112.261 24.278 0.44 22.86 H new ATOM 0 HG LEU A 74 57.034 111.139 21.721 0.44 26.78 H new ATOM 0 HD11 LEU A 74 54.725 110.746 21.860 0.44 26.35 H new ATOM 0 HD12 LEU A 74 55.471 110.056 23.075 0.44 26.35 H new ATOM 0 HD13 LEU A 74 54.700 111.422 23.293 0.44 26.35 H new ATOM 0 HD21 LEU A 74 55.631 112.808 20.840 0.44 24.61 H new ATOM 0 HD22 LEU A 74 55.629 113.542 22.243 0.44 24.61 H new ATOM 0 HD23 LEU A 74 56.965 113.454 21.398 0.44 24.61 H new ATOM 539 N LEU A 75 57.830 114.649 25.041 0.44 22.13 N ATOM 540 CA LEU A 75 57.291 115.963 25.460 0.44 23.06 C ATOM 541 C LEU A 75 58.319 117.085 25.249 0.44 22.05 C ATOM 542 O LEU A 75 57.895 118.189 24.861 0.44 24.04 O ATOM 543 CB LEU A 75 56.803 115.851 26.904 0.44 24.63 C ATOM 544 CG LEU A 75 55.562 114.972 27.085 0.44 26.00 C ATOM 545 CD1 LEU A 75 55.077 115.033 28.515 0.44 27.66 C ATOM 546 CD2 LEU A 75 54.448 115.375 26.137 0.44 26.92 C ATOM 0 H LEU A 75 57.979 114.105 25.690 0.44 22.13 H new ATOM 0 HA LEU A 75 56.534 116.207 24.904 0.44 23.06 H new ATOM 0 HB2 LEU A 75 57.521 115.494 27.450 0.44 24.63 H new ATOM 0 HB3 LEU A 75 56.608 116.740 27.238 0.44 24.63 H new ATOM 0 HG LEU A 75 55.816 114.060 26.874 0.44 26.00 H new ATOM 0 HD11 LEU A 75 54.292 114.472 28.615 0.44 27.66 H new ATOM 0 HD12 LEU A 75 55.777 114.717 29.108 0.44 27.66 H new ATOM 0 HD13 LEU A 75 54.851 115.949 28.741 0.44 27.66 H new ATOM 0 HD21 LEU A 75 53.679 114.800 26.278 0.44 26.92 H new ATOM 0 HD22 LEU A 75 54.197 116.297 26.306 0.44 26.92 H new ATOM 0 HD23 LEU A 75 54.754 115.286 25.221 0.44 26.92 H new ATOM 547 N LYS A 76 59.622 116.830 25.407 0.44 22.58 N ATOM 548 CA LYS A 76 60.675 117.848 25.132 0.44 22.07 C ATOM 549 C LYS A 76 60.756 118.186 23.633 0.44 21.61 C ATOM 550 O LYS A 76 61.142 119.332 23.282 0.44 25.12 O ATOM 551 CB LYS A 76 62.038 117.369 25.642 0.44 21.99 C ATOM 552 CG LYS A 76 62.232 117.421 27.151 0.44 22.24 C ATOM 553 CD LYS A 76 63.553 116.866 27.631 0.44 22.77 C ATOM 554 CE LYS A 76 64.746 117.497 26.953 0.44 22.62 C ATOM 555 NZ LYS A 76 66.030 116.934 27.424 0.44 24.72 N ATOM 0 H LYS A 76 59.929 116.072 25.674 0.44 22.58 H new ATOM 0 HA LYS A 76 60.429 118.657 25.608 0.44 22.07 H new ATOM 0 HB2 LYS A 76 62.173 116.455 25.346 0.44 21.99 H new ATOM 0 HB3 LYS A 76 62.729 117.907 25.225 0.44 21.99 H new ATOM 0 HG2 LYS A 76 62.155 118.342 27.444 0.44 22.24 H new ATOM 0 HG3 LYS A 76 61.513 116.927 27.576 0.44 22.24 H new ATOM 0 HD2 LYS A 76 63.624 117.000 28.589 0.44 22.77 H new ATOM 0 HD3 LYS A 76 63.570 115.908 27.477 0.44 22.77 H new ATOM 0 HE2 LYS A 76 64.673 117.370 25.994 0.44 22.62 H new ATOM 0 HE3 LYS A 76 64.737 118.453 27.114 0.44 22.62 H new ATOM 0 HZ1 LYS A 76 66.702 117.435 27.124 0.44 24.72 H new ATOM 0 HZ2 LYS A 76 66.042 116.924 28.314 0.44 24.72 H new ATOM 0 HZ3 LYS A 76 66.120 116.103 27.118 0.44 24.72 H new ATOM 556 N HIS A 77 60.449 117.233 22.754 0.44 22.09 N ATOM 557 CA HIS A 77 60.543 117.426 21.287 0.44 21.73 C ATOM 558 C HIS A 77 59.392 118.280 20.747 0.44 20.44 C ATOM 559 O HIS A 77 59.600 118.972 19.737 0.44 23.03 O ATOM 560 CB HIS A 77 60.633 116.072 20.579 0.44 22.63 C ATOM 561 CG HIS A 77 61.222 116.171 19.212 0.44 24.11 C ATOM 562 ND1 HIS A 77 62.507 116.283 18.811 0.44 27.29 N flip ATOM 563 CD2 HIS A 77 60.456 116.237 18.078 0.44 24.00 C flip ATOM 564 CE1 HIS A 77 62.505 116.356 17.442 0.44 23.45 C flip ATOM 565 NE2 HIS A 77 61.252 116.334 17.019 0.44 28.29 N flip ATOM 0 H HIS A 77 60.178 116.450 22.984 0.44 22.09 H new ATOM 0 HA HIS A 77 61.357 117.918 21.099 0.44 21.73 H new ATOM 0 HB2 HIS A 77 61.170 115.467 21.115 0.44 22.63 H new ATOM 0 HB3 HIS A 77 59.746 115.685 20.517 0.44 22.63 H new ATOM 0 HD2 HIS A 77 59.527 116.217 18.054 0.44 24.00 H new ATOM 0 HE1 HIS A 77 63.259 116.412 16.901 0.44 23.45 H new ATOM 0 HE2 HIS A 77 60.996 116.375 16.199 0.44 28.29 H new ATOM 566 N AMET A 78 58.203 118.217 21.354 0.22 19.74 N ATOM 567 N BMET A 78 58.224 118.277 21.435 0.22 21.08 N ATOM 568 CA AMET A 78 56.969 118.767 20.731 0.22 19.76 C ATOM 569 CA BMET A 78 56.978 118.907 20.915 0.22 21.71 C ATOM 570 C AMET A 78 56.918 120.297 20.902 0.22 20.47 C ATOM 571 C BMET A 78 57.078 120.426 20.966 0.22 22.13 C ATOM 572 O AMET A 78 56.638 120.745 22.069 0.22 22.81 O ATOM 573 O BMET A 78 57.017 121.022 22.079 0.22 24.44 O ATOM 574 CB AMET A 78 55.735 118.092 21.346 0.22 19.23 C ATOM 575 CB BMET A 78 55.737 118.494 21.708 0.22 23.04 C ATOM 576 CG AMET A 78 55.616 116.604 21.036 0.22 19.85 C ATOM 577 CG BMET A 78 55.341 117.081 21.496 0.22 24.01 C ATOM 578 SD AMET A 78 55.191 116.176 19.327 0.22 19.47 S ATOM 579 SD BMET A 78 55.292 116.622 19.761 0.22 27.46 S ATOM 580 CE AMET A 78 56.827 115.811 18.703 0.22 17.90 C ATOM 581 CE BMET A 78 55.051 114.864 19.949 0.22 25.76 C ATOM 0 H AMET A 78 58.080 117.862 22.127 0.22 21.08 H new ATOM 0 H BMET A 78 58.133 117.913 22.209 0.22 21.08 H new ATOM 0 HA AMET A 78 56.977 118.579 19.779 0.22 21.71 H new ATOM 0 HA BMET A 78 56.886 118.598 20.000 0.22 21.71 H new ATOM 0 HB2AMET A 78 55.760 118.210 22.308 0.22 23.04 H new ATOM 0 HB2BMET A 78 55.904 118.637 22.653 0.22 23.04 H new ATOM 0 HB3AMET A 78 54.939 118.543 21.025 0.22 23.04 H new ATOM 0 HB3BMET A 78 54.997 119.070 21.460 0.22 23.04 H new ATOM 0 HG2AMET A 78 56.459 116.178 21.257 0.22 24.01 H new ATOM 0 HG2BMET A 78 55.964 116.502 21.962 0.22 24.01 H new ATOM 0 HG3AMET A 78 54.944 116.223 21.622 0.22 24.01 H new ATOM 0 HG3BMET A 78 54.467 116.932 21.890 0.22 24.01 H new ATOM 0 HE1AMET A 78 56.770 115.572 17.765 0.22 25.76 H new ATOM 0 HE1BMET A 78 54.470 114.540 19.243 0.22 25.76 H new ATOM 0 HE2AMET A 78 57.394 116.592 18.804 0.22 25.76 H new ATOM 0 HE2BMET A 78 55.908 114.412 19.895 0.22 25.76 H new ATOM 0 HE3AMET A 78 57.206 115.071 19.202 0.22 25.76 H new ATOM 0 HE3BMET A 78 54.644 114.683 20.811 0.22 25.76 H new ATOM 582 N LYS A 79 57.174 121.045 19.805 1.00 19.19 N ATOM 583 CA LYS A 79 57.187 122.525 19.719 1.00 19.32 C ATOM 584 C LYS A 79 56.281 123.010 18.580 1.00 19.70 C ATOM 585 O LYS A 79 56.775 123.363 17.504 1.00 21.35 O ATOM 586 CB LYS A 79 58.647 122.993 19.612 1.00 21.98 C ATOM 587 CG LYS A 79 59.478 122.556 20.791 1.00 24.36 C ATOM 588 CD LYS A 79 60.911 122.999 20.748 1.00 27.74 C ATOM 589 CE LYS A 79 61.643 122.632 22.017 1.00 32.34 C ATOM 590 NZ LYS A 79 62.991 123.273 22.033 1.00 35.16 N ATOM 0 H ALYS A 79 57.355 120.679 19.048 0.22 19.19 H new ATOM 0 H BLYS A 79 57.233 120.642 19.047 0.22 19.19 H new ATOM 0 HA LYS A 79 56.815 122.926 20.520 1.00 19.32 H new ATOM 0 HB2 LYS A 79 59.038 122.642 18.796 1.00 21.98 H new ATOM 0 HB3 LYS A 79 58.670 123.960 19.544 1.00 21.98 H new ATOM 0 HG2 LYS A 79 59.071 122.898 21.602 1.00 24.36 H new ATOM 0 HG3 LYS A 79 59.453 121.588 20.847 1.00 24.36 H new ATOM 0 HD2 LYS A 79 61.354 122.591 19.988 1.00 27.74 H new ATOM 0 HD3 LYS A 79 60.950 123.959 20.617 1.00 27.74 H new ATOM 0 HE2 LYS A 79 61.131 122.919 22.789 1.00 32.34 H new ATOM 0 HE3 LYS A 79 61.734 121.668 22.079 1.00 32.34 H new ATOM 0 HZ1 LYS A 79 63.416 123.052 22.783 1.00 35.16 H new ATOM 0 HZ2 LYS A 79 63.462 122.992 21.332 1.00 35.16 H new ATOM 0 HZ3 LYS A 79 62.900 124.157 21.993 1.00 35.16 H new ATOM 591 N HIS A 80 54.967 123.045 18.841 0.44 20.15 N ATOM 592 CA HIS A 80 53.908 123.417 17.870 0.44 19.30 C ATOM 593 C HIS A 80 52.721 124.055 18.609 0.44 18.96 C ATOM 594 O HIS A 80 52.361 123.559 19.704 0.44 21.65 O ATOM 595 CB HIS A 80 53.488 122.184 17.051 0.44 18.78 C ATOM 596 CG HIS A 80 52.595 122.471 15.889 0.44 18.31 C ATOM 597 ND1 HIS A 80 51.226 122.683 16.029 0.44 17.46 N ATOM 598 CD2 HIS A 80 52.850 122.521 14.563 0.44 20.50 C ATOM 599 CE1 HIS A 80 50.688 122.883 14.845 0.44 19.74 C ATOM 600 NE2 HIS A 80 51.667 122.791 13.913 0.44 17.77 N ATOM 0 H HIS A 80 54.651 122.846 19.616 0.44 20.15 H new ATOM 0 HA HIS A 80 54.251 124.076 17.246 0.44 19.30 H new ATOM 0 HB2 HIS A 80 54.287 121.741 16.725 0.44 18.78 H new ATOM 0 HB3 HIS A 80 53.038 121.559 17.641 0.44 18.78 H new ATOM 0 HD2 HIS A 80 53.679 122.395 14.160 0.44 20.50 H new ATOM 0 HE1 HIS A 80 49.790 123.058 14.677 0.44 19.74 H new ATOM 0 HE2 HIS A 80 51.567 122.885 13.064 0.44 17.77 H new ATOM 601 N GLU A 81 52.104 125.067 17.992 1.00 19.74 N ATOM 602 CA GLU A 81 50.939 125.805 18.563 1.00 21.72 C ATOM 603 C GLU A 81 49.738 124.899 18.886 1.00 19.76 C ATOM 604 O GLU A 81 48.982 125.221 19.833 1.00 21.51 O ATOM 605 CB GLU A 81 50.443 126.871 17.580 1.00 24.99 C ATOM 606 CG GLU A 81 51.414 128.009 17.302 1.00 27.46 C ATOM 607 CD GLU A 81 50.821 129.070 16.374 1.00 37.04 C ATOM 608 OE1 GLU A 81 49.830 128.794 15.598 1.00 31.88 O ATOM 609 OE2 GLU A 81 51.319 130.240 16.475 1.00 41.08 O ATOM 0 H GLU A 81 52.345 125.357 17.219 1.00 19.74 H new ATOM 0 HA GLU A 81 51.267 126.198 19.387 1.00 21.72 H new ATOM 0 HB2 GLU A 81 50.228 126.438 16.739 1.00 24.99 H new ATOM 0 HB3 GLU A 81 49.618 127.247 17.925 1.00 24.99 H new ATOM 0 HG2 GLU A 81 51.670 128.424 18.141 1.00 27.46 H new ATOM 0 HG3 GLU A 81 52.223 127.651 16.904 1.00 27.46 H new ATOM 610 N ASN A 82 49.550 123.776 18.170 1.00 18.32 N ATOM 611 CA ASN A 82 48.378 122.884 18.412 1.00 17.26 C ATOM 612 C ASN A 82 48.789 121.600 19.139 1.00 16.78 C ATOM 613 O ASN A 82 47.984 120.620 19.137 1.00 17.59 O ATOM 614 CB ASN A 82 47.633 122.601 17.112 1.00 16.75 C ATOM 615 CG ASN A 82 47.204 123.834 16.366 1.00 18.64 C ATOM 616 OD1 ASN A 82 47.666 124.092 15.225 1.00 19.31 O ATOM 617 ND2 ASN A 82 46.331 124.626 17.035 1.00 19.53 N ATOM 0 H ASN A 82 50.078 123.509 17.546 1.00 18.32 H new ATOM 0 HA ASN A 82 47.762 123.348 19.000 1.00 17.26 H new ATOM 0 HB2 ASN A 82 48.202 122.068 16.535 1.00 16.75 H new ATOM 0 HB3 ASN A 82 46.849 122.066 17.310 1.00 16.75 H new ATOM 0 HD21 ASN A 82 46.057 125.360 16.680 1.00 19.53 H new ATOM 0 HD22 ASN A 82 46.051 124.395 17.814 1.00 19.53 H new ATOM 618 N VAL A 83 49.928 121.560 19.859 1.00 17.90 N ATOM 619 CA VAL A 83 50.381 120.388 20.627 1.00 18.52 C ATOM 620 C VAL A 83 50.886 120.839 21.985 1.00 18.81 C ATOM 621 O VAL A 83 51.561 121.930 22.061 1.00 19.91 O ATOM 622 CB VAL A 83 51.478 119.591 19.876 1.00 18.13 C ATOM 623 CG1 VAL A 83 51.914 118.349 20.637 1.00 18.41 C ATOM 624 CG2 VAL A 83 51.051 119.262 18.451 1.00 17.66 C ATOM 0 H VAL A 83 50.466 122.229 19.913 1.00 17.90 H new ATOM 0 HA VAL A 83 49.625 119.791 20.742 1.00 18.52 H new ATOM 0 HB VAL A 83 52.257 120.167 19.821 1.00 18.13 H new ATOM 0 HG11 VAL A 83 52.599 117.883 20.132 1.00 18.41 H new ATOM 0 HG12 VAL A 83 52.270 118.607 21.501 1.00 18.41 H new ATOM 0 HG13 VAL A 83 51.152 117.763 20.764 1.00 18.41 H new ATOM 0 HG21 VAL A 83 51.756 118.765 18.008 1.00 17.66 H new ATOM 0 HG22 VAL A 83 50.242 118.727 18.471 1.00 17.66 H new ATOM 0 HG23 VAL A 83 50.882 120.085 17.965 1.00 17.66 H new ATOM 625 N ILE A 84 50.614 120.030 23.012 0.44 21.11 N ATOM 626 CA ILE A 84 51.201 120.184 24.382 0.44 23.43 C ATOM 627 C ILE A 84 52.692 120.505 24.235 0.44 23.45 C ATOM 628 O ILE A 84 53.349 119.918 23.356 0.44 24.74 O ATOM 629 CB ILE A 84 50.955 118.930 25.255 0.44 26.16 C ATOM 630 CG1 ILE A 84 51.467 119.161 26.682 0.44 28.99 C ATOM 631 CG2 ILE A 84 51.534 117.654 24.636 0.44 26.49 C ATOM 632 CD1 ILE A 84 50.927 118.185 27.692 0.44 29.58 C ATOM 0 H ILE A 84 50.077 119.362 22.947 0.44 21.11 H new ATOM 0 HA ILE A 84 50.762 120.915 24.845 0.44 23.43 H new ATOM 0 HB ILE A 84 49.996 118.789 25.296 0.44 26.16 H new ATOM 0 HG12 ILE A 84 52.436 119.108 26.681 0.44 28.99 H new ATOM 0 HG13 ILE A 84 51.232 120.061 26.958 0.44 28.99 H new ATOM 0 HG21 ILE A 84 51.354 116.900 25.220 0.44 26.49 H new ATOM 0 HG22 ILE A 84 51.123 117.498 23.771 0.44 26.49 H new ATOM 0 HG23 ILE A 84 52.492 117.754 24.525 0.44 26.49 H new ATOM 0 HD11 ILE A 84 51.291 118.390 28.567 0.44 29.58 H new ATOM 0 HD12 ILE A 84 49.960 118.251 27.721 0.44 29.58 H new ATOM 0 HD13 ILE A 84 51.181 117.284 27.439 0.44 29.58 H new ATOM 633 N GLY A 85 53.199 121.461 25.012 1.00 22.93 N ATOM 634 CA GLY A 85 54.656 121.662 25.100 1.00 25.55 C ATOM 635 C GLY A 85 55.103 121.604 26.552 1.00 22.60 C ATOM 636 O GLY A 85 54.286 121.741 27.457 1.00 24.52 O ATOM 0 H GLY A 85 52.730 121.999 25.491 1.00 22.93 H new ATOM 0 HA2 GLY A 85 55.116 120.981 24.585 1.00 25.55 H new ATOM 0 HA3 GLY A 85 54.896 122.519 24.714 1.00 25.55 H new ATOM 637 N LEU A 86 56.409 121.498 26.759 0.44 22.44 N ATOM 638 CA LEU A 86 57.014 121.542 28.108 0.44 22.36 C ATOM 639 C LEU A 86 57.464 122.984 28.397 0.44 20.68 C ATOM 640 O LEU A 86 58.207 123.576 27.582 0.44 20.26 O ATOM 641 CB LEU A 86 58.174 120.547 28.148 0.44 23.27 C ATOM 642 CG LEU A 86 58.286 119.631 29.369 0.44 24.67 C ATOM 643 CD1 LEU A 86 56.936 119.116 29.856 0.44 24.88 C ATOM 644 CD2 LEU A 86 59.208 118.465 29.047 0.44 24.59 C ATOM 0 H LEU A 86 56.981 121.398 26.125 0.44 22.44 H new ATOM 0 HA LEU A 86 56.380 121.288 28.797 0.44 22.36 H new ATOM 0 HB2 LEU A 86 58.113 119.986 27.359 0.44 23.27 H new ATOM 0 HB3 LEU A 86 59.000 121.050 28.075 0.44 23.27 H new ATOM 0 HG LEU A 86 58.655 120.161 30.092 0.44 24.67 H new ATOM 0 HD11 LEU A 86 57.067 118.543 30.628 0.44 24.88 H new ATOM 0 HD12 LEU A 86 56.373 119.866 30.103 0.44 24.88 H new ATOM 0 HD13 LEU A 86 56.508 118.610 29.148 0.44 24.88 H new ATOM 0 HD21 LEU A 86 59.279 117.885 29.821 0.44 24.59 H new ATOM 0 HD22 LEU A 86 58.847 117.963 28.299 0.44 24.59 H new ATOM 0 HD23 LEU A 86 60.087 118.802 28.815 0.44 24.59 H new ATOM 645 N LEU A 87 56.957 123.571 29.477 0.44 22.19 N ATOM 646 CA LEU A 87 57.466 124.866 30.003 0.44 22.09 C ATOM 647 C LEU A 87 58.726 124.618 30.844 0.44 21.05 C ATOM 648 O LEU A 87 59.612 125.505 30.845 0.44 22.83 O ATOM 649 CB LEU A 87 56.385 125.568 30.829 0.44 23.46 C ATOM 650 CG LEU A 87 55.487 126.553 30.081 0.44 24.40 C ATOM 651 CD1 LEU A 87 54.431 127.119 31.016 0.44 24.10 C ATOM 652 CD2 LEU A 87 56.302 127.683 29.457 0.44 25.49 C ATOM 0 H LEU A 87 56.308 123.240 29.935 0.44 22.19 H new ATOM 0 HA LEU A 87 57.696 125.446 29.261 0.44 22.09 H new ATOM 0 HB2 LEU A 87 55.821 124.889 31.231 0.44 23.46 H new ATOM 0 HB3 LEU A 87 56.818 126.043 31.555 0.44 23.46 H new ATOM 0 HG LEU A 87 55.047 126.070 29.364 0.44 24.40 H new ATOM 0 HD11 LEU A 87 53.868 127.742 30.530 0.44 24.10 H new ATOM 0 HD12 LEU A 87 53.886 126.396 31.365 0.44 24.10 H new ATOM 0 HD13 LEU A 87 54.864 127.581 31.751 0.44 24.10 H new ATOM 0 HD21 LEU A 87 55.708 128.291 28.990 0.44 25.49 H new ATOM 0 HD22 LEU A 87 56.774 128.165 30.154 0.44 25.49 H new ATOM 0 HD23 LEU A 87 56.942 127.312 28.830 0.44 25.49 H new ATOM 653 N ASP A 88 58.794 123.502 31.570 0.44 19.88 N ATOM 654 CA ASP A 88 59.878 123.226 32.547 0.44 19.79 C ATOM 655 C ASP A 88 59.903 121.742 32.910 0.44 19.00 C ATOM 656 O ASP A 88 58.876 121.064 32.685 0.44 19.08 O ATOM 657 CB ASP A 88 59.700 124.068 33.820 0.44 19.34 C ATOM 658 CG ASP A 88 60.994 124.341 34.569 0.44 19.60 C ATOM 659 OD1 ASP A 88 62.061 124.102 33.986 0.44 19.36 O ATOM 660 OD2 ASP A 88 60.929 124.812 35.743 0.44 21.48 O ATOM 0 H ASP A 88 58.211 122.872 31.516 0.44 19.88 H new ATOM 0 HA ASP A 88 60.721 123.467 32.132 0.44 19.79 H new ATOM 0 HB2 ASP A 88 59.291 124.915 33.582 0.44 19.34 H new ATOM 0 HB3 ASP A 88 59.084 123.612 34.414 0.44 19.34 H new ATOM 661 N VAL A 89 61.050 121.269 33.414 0.44 19.17 N ATOM 662 CA VAL A 89 61.268 119.911 34.002 0.44 19.68 C ATOM 663 C VAL A 89 62.350 120.049 35.071 0.44 19.41 C ATOM 664 O VAL A 89 63.346 120.793 34.808 0.44 21.23 O ATOM 665 CB VAL A 89 61.669 118.859 32.941 0.44 20.37 C ATOM 666 CG1 VAL A 89 62.627 119.420 31.908 0.44 20.00 C ATOM 667 CG2 VAL A 89 62.275 117.625 33.579 0.44 19.94 C ATOM 0 H VAL A 89 61.765 121.747 33.428 0.44 19.17 H new ATOM 0 HA VAL A 89 60.437 119.589 34.385 0.44 19.68 H new ATOM 0 HB VAL A 89 60.848 118.608 32.489 0.44 20.37 H new ATOM 0 HG11 VAL A 89 62.851 118.729 31.265 0.44 20.00 H new ATOM 0 HG12 VAL A 89 62.208 120.165 31.449 0.44 20.00 H new ATOM 0 HG13 VAL A 89 63.436 119.725 32.348 0.44 20.00 H new ATOM 0 HG21 VAL A 89 62.514 116.988 32.888 0.44 19.94 H new ATOM 0 HG22 VAL A 89 63.069 117.875 34.077 0.44 19.94 H new ATOM 0 HG23 VAL A 89 61.630 117.222 34.181 0.44 19.94 H new ATOM 668 N PHE A 90 62.204 119.360 36.205 0.44 20.02 N ATOM 669 CA PHE A 90 63.179 119.441 37.328 0.44 19.61 C ATOM 670 C PHE A 90 63.091 118.256 38.305 0.44 20.29 C ATOM 671 O PHE A 90 62.117 117.466 38.290 0.44 21.52 O ATOM 672 CB PHE A 90 63.032 120.792 38.045 0.44 19.54 C ATOM 673 CG PHE A 90 61.687 121.017 38.688 0.44 18.30 C ATOM 674 CD1 PHE A 90 61.391 120.428 39.907 0.44 19.99 C ATOM 675 CD2 PHE A 90 60.699 121.766 38.057 0.44 18.19 C ATOM 676 CE1 PHE A 90 60.150 120.609 40.495 0.44 18.53 C ATOM 677 CE2 PHE A 90 59.451 121.929 38.638 0.44 18.78 C ATOM 678 CZ PHE A 90 59.181 121.344 39.857 0.44 18.85 C ATOM 0 H PHE A 90 61.543 118.831 36.355 0.44 20.02 H new ATOM 0 HA PHE A 90 64.068 119.381 36.945 0.44 19.61 H new ATOM 0 HB2 PHE A 90 63.719 120.860 38.727 0.44 19.54 H new ATOM 0 HB3 PHE A 90 63.195 121.503 37.406 0.44 19.54 H new ATOM 0 HD1 PHE A 90 62.032 119.906 40.334 0.44 19.99 H new ATOM 0 HD2 PHE A 90 60.878 122.162 37.235 0.44 18.19 H new ATOM 0 HE1 PHE A 90 59.972 120.231 41.326 0.44 18.53 H new ATOM 0 HE2 PHE A 90 58.798 122.431 38.207 0.44 18.78 H new ATOM 0 HZ PHE A 90 58.343 121.447 40.247 0.44 18.85 H new ATOM 679 N THR A 91 64.135 118.146 39.137 1.00 19.71 N ATOM 680 CA THR A 91 64.302 117.161 40.231 1.00 21.08 C ATOM 681 C THR A 91 64.970 117.902 41.390 1.00 21.16 C ATOM 682 O THR A 91 65.855 118.715 41.157 1.00 21.39 O ATOM 683 CB THR A 91 65.180 115.959 39.823 1.00 23.88 C ATOM 684 OG1 THR A 91 65.284 115.088 40.952 1.00 25.22 O ATOM 685 CG2 THR A 91 66.584 116.273 39.358 1.00 26.17 C ATOM 0 H THR A 91 64.810 118.676 39.078 1.00 19.71 H new ATOM 0 HA THR A 91 63.434 116.801 40.469 1.00 21.08 H new ATOM 0 HB THR A 91 64.734 115.570 39.054 1.00 23.88 H new ATOM 0 HG1 THR A 91 64.655 114.532 40.936 1.00 25.22 H new ATOM 0 HG21 THR A 91 67.041 115.449 39.129 1.00 26.17 H new ATOM 0 HG22 THR A 91 66.546 116.848 38.578 1.00 26.17 H new ATOM 0 HG23 THR A 91 67.067 116.724 40.068 1.00 26.17 H new ATOM 686 N PRO A 92 64.574 117.627 42.636 1.00 22.77 N ATOM 687 CA PRO A 92 65.336 118.204 43.760 1.00 25.83 C ATOM 688 C PRO A 92 66.712 117.552 43.975 1.00 30.51 C ATOM 689 O PRO A 92 67.547 118.098 44.721 1.00 29.03 O ATOM 690 CB PRO A 92 64.463 117.945 44.974 1.00 27.07 C ATOM 691 CG PRO A 92 63.390 116.984 44.553 1.00 27.45 C ATOM 692 CD PRO A 92 63.378 116.889 43.034 1.00 24.67 C ATOM 0 HA PRO A 92 65.523 119.141 43.591 1.00 25.83 H new ATOM 0 HB2 PRO A 92 64.988 117.575 45.701 1.00 27.07 H new ATOM 0 HB3 PRO A 92 64.074 118.772 45.298 1.00 27.07 H new ATOM 0 HG2 PRO A 92 63.551 116.110 44.942 1.00 27.45 H new ATOM 0 HG3 PRO A 92 62.526 117.284 44.877 1.00 27.45 H new ATOM 0 HD2 PRO A 92 63.411 115.967 42.734 1.00 24.67 H new ATOM 0 HD3 PRO A 92 62.575 117.282 42.658 1.00 24.67 H new ATOM 693 N ALA A 93 66.971 116.383 43.357 1.00 26.27 N ATOM 694 CA ALA A 93 68.309 115.737 43.485 1.00 28.23 C ATOM 695 C ALA A 93 69.479 116.629 43.039 1.00 26.18 C ATOM 696 O ALA A 93 69.441 117.361 42.012 1.00 26.83 O ATOM 697 CB ALA A 93 68.312 114.428 42.711 1.00 27.15 C ATOM 0 H ALA A 93 66.406 115.954 42.871 1.00 26.27 H new ATOM 0 HA ALA A 93 68.452 115.574 44.430 1.00 28.23 H new ATOM 0 HB1 ALA A 93 69.181 114.006 42.793 1.00 27.15 H new ATOM 0 HB2 ALA A 93 67.631 113.838 43.070 1.00 27.15 H new ATOM 0 HB3 ALA A 93 68.125 114.604 41.776 1.00 27.15 H new ATOM 698 N ARG A 94 70.611 116.565 43.781 1.00 31.03 N ATOM 699 CA ARG A 94 71.853 117.320 43.436 1.00 32.54 C ATOM 700 C ARG A 94 72.863 116.429 42.679 1.00 32.95 C ATOM 701 O ARG A 94 73.885 116.945 42.226 1.00 37.81 O ATOM 702 CB ARG A 94 72.487 117.896 44.704 1.00 38.59 C ATOM 703 CG ARG A 94 71.532 118.701 45.583 1.00 40.51 C ATOM 704 CD ARG A 94 72.105 119.011 46.956 1.00 45.47 C ATOM 705 NE ARG A 94 72.076 120.450 47.166 1.00 58.64 N ATOM 706 CZ ARG A 94 71.221 121.094 47.950 1.00 59.79 C ATOM 707 NH1 ARG A 94 70.303 120.430 48.636 1.00 67.02 N ATOM 708 NH2 ARG A 94 71.302 122.409 48.052 1.00 60.32 N ATOM 0 H ARG A 94 70.682 116.087 44.493 1.00 31.03 H new ATOM 0 HA ARG A 94 71.608 118.050 42.846 1.00 32.54 H new ATOM 0 HB2 ARG A 94 72.853 117.167 45.228 1.00 38.59 H new ATOM 0 HB3 ARG A 94 73.231 118.464 44.450 1.00 38.59 H new ATOM 0 HG2 ARG A 94 71.312 119.533 45.135 1.00 40.51 H new ATOM 0 HG3 ARG A 94 70.704 118.207 45.688 1.00 40.51 H new ATOM 0 HD2 ARG A 94 71.589 118.561 47.644 1.00 45.47 H new ATOM 0 HD3 ARG A 94 73.015 118.681 47.022 1.00 45.47 H new ATOM 0 HE ARG A 94 72.661 120.922 46.748 1.00 58.64 H new ATOM 0 HH11 ARG A 94 70.257 119.573 48.576 1.00 67.02 H new ATOM 0 HH12 ARG A 94 69.753 120.856 49.142 1.00 67.02 H new ATOM 0 HH21 ARG A 94 71.904 122.838 47.613 1.00 60.32 H new ATOM 0 HH22 ARG A 94 70.752 122.836 48.558 1.00 60.32 H new ATOM 709 N SER A 95 72.557 115.155 42.480 1.00 34.01 N ATOM 710 CA SER A 95 73.444 114.185 41.787 1.00 33.70 C ATOM 711 C SER A 95 72.637 112.988 41.267 1.00 29.38 C ATOM 712 O SER A 95 71.569 112.687 41.821 1.00 29.58 O ATOM 713 CB SER A 95 74.530 113.710 42.747 1.00 34.00 C ATOM 714 OG SER A 95 73.977 112.786 43.686 1.00 35.86 O ATOM 0 H SER A 95 71.816 114.809 42.744 1.00 34.01 H new ATOM 0 HA SER A 95 73.856 114.625 41.027 1.00 33.70 H new ATOM 0 HB2 SER A 95 75.249 113.288 42.251 1.00 34.00 H new ATOM 0 HB3 SER A 95 74.914 114.468 43.215 1.00 34.00 H new ATOM 0 HG SER A 95 74.579 112.526 44.211 1.00 35.86 H new ATOM 715 N LEU A 96 73.177 112.244 40.284 1.00 30.77 N ATOM 716 CA LEU A 96 72.571 110.971 39.833 1.00 30.11 C ATOM 717 C LEU A 96 72.353 110.019 41.010 1.00 30.49 C ATOM 718 O LEU A 96 71.339 109.368 41.115 1.00 30.79 O ATOM 719 CB LEU A 96 73.502 110.351 38.775 1.00 30.01 C ATOM 720 CG LEU A 96 73.042 109.016 38.209 1.00 33.06 C ATOM 721 CD1 LEU A 96 71.645 109.115 37.587 1.00 32.81 C ATOM 722 CD2 LEU A 96 74.056 108.500 37.191 1.00 37.62 C ATOM 0 H LEU A 96 73.896 112.459 39.864 1.00 30.77 H new ATOM 0 HA LEU A 96 71.698 111.137 39.445 1.00 30.11 H new ATOM 0 HB2 LEU A 96 73.600 110.980 38.043 1.00 30.01 H new ATOM 0 HB3 LEU A 96 74.381 110.234 39.168 1.00 30.01 H new ATOM 0 HG LEU A 96 72.985 108.384 38.942 1.00 33.06 H new ATOM 0 HD11 LEU A 96 71.384 108.249 37.237 1.00 32.81 H new ATOM 0 HD12 LEU A 96 71.009 109.395 38.263 1.00 32.81 H new ATOM 0 HD13 LEU A 96 71.657 109.764 36.866 1.00 32.81 H new ATOM 0 HD21 LEU A 96 73.754 107.649 36.836 1.00 37.62 H new ATOM 0 HD22 LEU A 96 74.142 109.140 36.467 1.00 37.62 H new ATOM 0 HD23 LEU A 96 74.917 108.383 37.622 1.00 37.62 H new ATOM 723 N GLU A 97 73.286 109.998 41.963 1.00 38.54 N ATOM 724 CA GLU A 97 73.258 109.027 43.082 1.00 40.53 C ATOM 725 C GLU A 97 72.029 109.252 43.969 1.00 39.79 C ATOM 726 O GLU A 97 71.473 108.253 44.460 1.00 42.57 O ATOM 727 CB GLU A 97 74.553 109.164 43.890 1.00 47.84 C ATOM 728 CG GLU A 97 75.799 108.704 43.126 1.00 56.88 C ATOM 729 CD GLU A 97 76.163 109.422 41.821 1.00 63.44 C ATOM 730 OE1 GLU A 97 76.150 110.693 41.780 1.00 46.75 O ATOM 731 OE2 GLU A 97 76.474 108.700 40.819 1.00 70.59 O ATOM 0 H GLU A 97 73.953 110.540 41.987 1.00 38.54 H new ATOM 0 HA GLU A 97 73.196 108.126 42.727 1.00 40.53 H new ATOM 0 HB2 GLU A 97 74.666 110.091 44.152 1.00 47.84 H new ATOM 0 HB3 GLU A 97 74.473 108.646 44.706 1.00 47.84 H new ATOM 0 HG2 GLU A 97 76.558 108.780 43.726 1.00 56.88 H new ATOM 0 HG3 GLU A 97 75.690 107.762 42.924 1.00 56.88 H new ATOM 732 N GLU A 98 71.555 110.487 44.129 1.00 36.84 N ATOM 733 CA GLU A 98 70.341 110.731 44.977 1.00 38.39 C ATOM 734 C GLU A 98 69.081 110.973 44.131 1.00 36.02 C ATOM 735 O GLU A 98 68.019 111.296 44.714 1.00 37.47 O ATOM 736 CB GLU A 98 70.582 111.866 45.976 1.00 45.58 C ATOM 737 CG GLU A 98 70.939 113.186 45.358 1.00 48.14 C ATOM 738 CD GLU A 98 71.238 114.260 46.393 1.00 60.10 C ATOM 739 OE1 GLU A 98 72.186 114.052 47.202 1.00 63.71 O ATOM 740 OE2 GLU A 98 70.519 115.298 46.396 1.00 43.35 O ATOM 0 H GLU A 98 71.898 111.191 43.774 1.00 36.84 H new ATOM 0 HA GLU A 98 70.180 109.921 45.486 1.00 38.39 H new ATOM 0 HB2 GLU A 98 69.783 111.981 46.514 1.00 45.58 H new ATOM 0 HB3 GLU A 98 71.295 111.603 46.579 1.00 45.58 H new ATOM 0 HG2 GLU A 98 71.713 113.071 44.784 1.00 48.14 H new ATOM 0 HG3 GLU A 98 70.208 113.482 44.793 1.00 48.14 H new ATOM 741 N PHE A 99 69.142 110.742 42.815 1.00 31.95 N ATOM 742 CA PHE A 99 68.005 110.975 41.872 1.00 27.94 C ATOM 743 C PHE A 99 66.902 109.929 42.035 1.00 31.84 C ATOM 744 O PHE A 99 67.109 108.708 41.757 1.00 34.75 O ATOM 745 CB PHE A 99 68.533 111.006 40.438 1.00 28.69 C ATOM 746 CG PHE A 99 67.513 111.238 39.344 1.00 26.64 C ATOM 747 CD1 PHE A 99 66.587 112.273 39.384 1.00 25.12 C ATOM 748 CD2 PHE A 99 67.498 110.401 38.235 1.00 26.98 C ATOM 749 CE1 PHE A 99 65.665 112.427 38.368 1.00 23.99 C ATOM 750 CE2 PHE A 99 66.635 110.622 37.164 1.00 26.90 C ATOM 751 CZ PHE A 99 65.718 111.630 37.226 1.00 28.63 C ATOM 0 H PHE A 99 69.849 110.442 42.428 1.00 31.95 H new ATOM 0 HA PHE A 99 67.603 111.832 42.082 1.00 27.94 H new ATOM 0 HB2 PHE A 99 69.206 111.702 40.378 1.00 28.69 H new ATOM 0 HB3 PHE A 99 68.980 110.164 40.262 1.00 28.69 H new ATOM 0 HD1 PHE A 99 66.588 112.866 40.100 1.00 25.12 H new ATOM 0 HD2 PHE A 99 68.079 109.675 38.207 1.00 26.98 H new ATOM 0 HE1 PHE A 99 64.999 113.072 38.447 1.00 23.99 H new ATOM 0 HE2 PHE A 99 66.684 110.083 36.408 1.00 26.90 H new ATOM 0 HZ PHE A 99 65.137 111.783 36.516 1.00 28.63 H new ATOM 752 N ASN A 100 65.694 110.367 42.393 1.00 28.38 N ATOM 753 CA ASN A 100 64.496 109.491 42.504 1.00 29.94 C ATOM 754 C ASN A 100 63.247 110.112 41.872 1.00 30.75 C ATOM 755 O ASN A 100 62.373 109.387 41.431 1.00 33.82 O ATOM 756 CB ASN A 100 64.178 109.187 43.977 1.00 36.86 C ATOM 757 CG ASN A 100 65.184 108.247 44.606 1.00 47.68 C ATOM 758 OD1 ASN A 100 65.186 107.058 44.299 1.00 57.96 O ATOM 759 ND2 ASN A 100 66.056 108.771 45.458 1.00 47.83 N ATOM 0 H ASN A 100 65.534 111.190 42.583 1.00 28.38 H new ATOM 0 HA ASN A 100 64.718 108.678 42.023 1.00 29.94 H new ATOM 0 HB2 ASN A 100 64.158 110.017 44.478 1.00 36.86 H new ATOM 0 HB3 ASN A 100 63.292 108.797 44.040 1.00 36.86 H new ATOM 0 HD21 ASN A 100 66.655 108.272 45.821 1.00 47.83 H new ATOM 0 HD22 ASN A 100 66.022 109.609 45.647 1.00 47.83 H new ATOM 760 N ASP A 101 63.107 111.428 41.899 1.00 28.58 N ATOM 761 CA ASP A 101 61.807 112.061 41.605 1.00 29.23 C ATOM 762 C ASP A 101 61.932 112.943 40.372 1.00 23.99 C ATOM 763 O ASP A 101 62.955 113.632 40.177 1.00 25.45 O ATOM 764 CB ASP A 101 61.329 112.854 42.826 1.00 28.16 C ATOM 765 CG ASP A 101 60.688 112.009 43.915 1.00 36.95 C ATOM 766 OD1 ASP A 101 60.090 110.962 43.611 1.00 44.68 O ATOM 767 OD2 ASP A 101 60.708 112.467 45.050 1.00 35.74 O ATOM 0 H ASP A 101 63.741 111.979 42.083 1.00 28.58 H new ATOM 0 HA ASP A 101 61.143 111.380 41.416 1.00 29.23 H new ATOM 0 HB2 ASP A 101 62.085 113.330 43.204 1.00 28.16 H new ATOM 0 HB3 ASP A 101 60.690 113.523 42.533 1.00 28.16 H new ATOM 768 N VAL A 102 60.912 112.896 39.538 1.00 22.89 N ATOM 769 CA VAL A 102 60.793 113.736 38.298 1.00 23.47 C ATOM 770 C VAL A 102 59.483 114.532 38.294 1.00 21.26 C ATOM 771 O VAL A 102 58.353 113.924 38.497 1.00 21.98 O ATOM 772 CB VAL A 102 60.794 112.849 37.040 1.00 23.67 C ATOM 773 CG1 VAL A 102 60.528 113.623 35.779 1.00 25.55 C ATOM 774 CG2 VAL A 102 62.079 112.036 36.939 1.00 26.58 C ATOM 0 H VAL A 102 60.241 112.371 39.656 1.00 22.89 H new ATOM 0 HA VAL A 102 61.552 114.340 38.293 1.00 23.47 H new ATOM 0 HB VAL A 102 60.054 112.229 37.138 1.00 23.67 H new ATOM 0 HG11 VAL A 102 60.540 113.019 35.020 1.00 25.55 H new ATOM 0 HG12 VAL A 102 59.659 114.050 35.839 1.00 25.55 H new ATOM 0 HG13 VAL A 102 61.213 114.300 35.664 1.00 25.55 H new ATOM 0 HG21 VAL A 102 62.053 111.487 36.139 1.00 26.58 H new ATOM 0 HG22 VAL A 102 62.839 112.637 36.894 1.00 26.58 H new ATOM 0 HG23 VAL A 102 62.164 111.466 37.719 1.00 26.58 H new ATOM 775 N TYR A 103 59.563 115.852 38.044 1.00 19.77 N ATOM 776 CA TYR A 103 58.379 116.732 37.938 1.00 18.84 C ATOM 777 C TYR A 103 58.306 117.388 36.571 1.00 18.71 C ATOM 778 O TYR A 103 59.322 117.899 36.092 1.00 19.26 O ATOM 779 CB TYR A 103 58.453 117.839 39.030 1.00 20.02 C ATOM 780 CG TYR A 103 58.410 117.419 40.485 1.00 19.98 C ATOM 781 CD1 TYR A 103 59.517 116.898 41.138 1.00 20.05 C ATOM 782 CD2 TYR A 103 57.279 117.667 41.278 1.00 21.40 C ATOM 783 CE1 TYR A 103 59.509 116.557 42.489 1.00 20.88 C ATOM 784 CE2 TYR A 103 57.249 117.308 42.618 1.00 23.16 C ATOM 785 CZ TYR A 103 58.375 116.817 43.235 1.00 20.60 C ATOM 786 OH TYR A 103 58.426 116.497 44.581 1.00 24.04 O ATOM 0 H TYR A 103 60.309 116.264 37.931 1.00 19.77 H new ATOM 0 HA TYR A 103 57.586 116.188 38.064 1.00 18.84 H new ATOM 0 HB2 TYR A 103 59.273 118.337 38.890 1.00 20.02 H new ATOM 0 HB3 TYR A 103 57.718 118.454 38.878 1.00 20.02 H new ATOM 0 HD1 TYR A 103 60.300 116.770 40.652 1.00 20.05 H new ATOM 0 HD2 TYR A 103 56.537 118.079 40.899 1.00 21.40 H new ATOM 0 HE1 TYR A 103 60.253 116.161 42.882 1.00 20.88 H new ATOM 0 HE2 TYR A 103 56.461 117.400 43.103 1.00 23.16 H new ATOM 0 HH TYR A 103 57.676 116.214 44.830 1.00 24.04 H new ATOM 787 N LEU A 104 57.134 117.363 35.922 1.00 18.72 N ATOM 788 CA LEU A 104 56.914 117.930 34.575 1.00 19.19 C ATOM 789 C LEU A 104 55.947 119.107 34.660 1.00 20.67 C ATOM 790 O LEU A 104 54.899 118.953 35.331 1.00 21.97 O ATOM 791 CB LEU A 104 56.301 116.845 33.667 1.00 21.03 C ATOM 792 CG LEU A 104 57.133 115.574 33.516 1.00 19.72 C ATOM 793 CD1 LEU A 104 56.274 114.518 32.768 1.00 23.44 C ATOM 794 CD2 LEU A 104 58.415 115.824 32.777 1.00 22.75 C ATOM 0 H LEU A 104 56.427 117.008 36.258 1.00 18.72 H new ATOM 0 HA LEU A 104 57.761 118.233 34.212 1.00 19.19 H new ATOM 0 HB2 LEU A 104 55.430 116.604 34.019 1.00 21.03 H new ATOM 0 HB3 LEU A 104 56.156 117.225 32.787 1.00 21.03 H new ATOM 0 HG LEU A 104 57.379 115.252 34.398 1.00 19.72 H new ATOM 0 HD11 LEU A 104 56.786 113.701 32.662 1.00 23.44 H new ATOM 0 HD12 LEU A 104 55.471 114.332 33.280 1.00 23.44 H new ATOM 0 HD13 LEU A 104 56.028 114.861 31.895 1.00 23.44 H new ATOM 0 HD21 LEU A 104 58.913 114.995 32.702 1.00 22.75 H new ATOM 0 HD22 LEU A 104 58.217 116.162 31.890 1.00 22.75 H new ATOM 0 HD23 LEU A 104 58.945 116.477 33.260 1.00 22.75 H new ATOM 795 N VAL A 105 56.220 120.207 33.989 1.00 18.46 N ATOM 796 CA VAL A 105 55.401 121.447 34.073 1.00 19.34 C ATOM 797 C VAL A 105 54.893 121.825 32.686 1.00 18.87 C ATOM 798 O VAL A 105 55.723 121.909 31.739 1.00 20.39 O ATOM 799 CB VAL A 105 56.239 122.603 34.692 1.00 19.58 C ATOM 800 CG1 VAL A 105 55.377 123.840 34.898 1.00 20.82 C ATOM 801 CG2 VAL A 105 56.847 122.216 35.997 1.00 19.59 C ATOM 0 H VAL A 105 56.893 120.276 33.458 1.00 18.46 H new ATOM 0 HA VAL A 105 54.636 121.287 34.648 1.00 19.34 H new ATOM 0 HB VAL A 105 56.953 122.797 34.064 1.00 19.58 H new ATOM 0 HG11 VAL A 105 55.915 124.549 35.284 1.00 20.82 H new ATOM 0 HG12 VAL A 105 55.021 124.133 34.044 1.00 20.82 H new ATOM 0 HG13 VAL A 105 54.644 123.628 35.497 1.00 20.82 H new ATOM 0 HG21 VAL A 105 57.359 122.961 36.349 1.00 19.59 H new ATOM 0 HG22 VAL A 105 56.145 121.982 36.624 1.00 19.59 H new ATOM 0 HG23 VAL A 105 57.433 121.454 35.868 1.00 19.59 H new ATOM 802 N THR A 106 53.553 122.007 32.523 1.00 22.28 N ATOM 803 CA THR A 106 52.908 122.511 31.287 1.00 21.67 C ATOM 804 C THR A 106 51.961 123.695 31.593 1.00 24.02 C ATOM 805 O THR A 106 51.568 123.883 32.782 1.00 24.27 O ATOM 806 CB THR A 106 52.130 121.369 30.597 1.00 27.62 C ATOM 807 OG1 THR A 106 51.055 121.015 31.464 1.00 29.52 O ATOM 808 CG2 THR A 106 52.924 120.114 30.355 1.00 25.56 C ATOM 0 H THR A 106 52.988 121.834 33.148 1.00 22.28 H new ATOM 0 HA THR A 106 53.603 122.831 30.690 1.00 21.67 H new ATOM 0 HB THR A 106 51.860 121.703 29.727 1.00 27.62 H new ATOM 0 HG1 THR A 106 50.871 120.201 31.365 1.00 29.52 H new ATOM 0 HG21 THR A 106 52.362 119.454 29.921 1.00 25.56 H new ATOM 0 HG22 THR A 106 53.683 120.316 29.786 1.00 25.56 H new ATOM 0 HG23 THR A 106 53.240 119.762 31.202 1.00 25.56 H new ATOM 809 N HIS A 107 51.462 124.381 30.561 1.00 26.99 N ATOM 810 CA HIS A 107 50.292 125.311 30.724 1.00 27.47 C ATOM 811 C HIS A 107 49.094 124.581 31.321 1.00 30.52 C ATOM 812 O HIS A 107 48.835 123.437 30.974 1.00 30.91 O ATOM 813 CB HIS A 107 49.903 125.933 29.396 1.00 30.61 C ATOM 814 CG HIS A 107 50.839 126.982 28.940 1.00 33.30 C ATOM 815 ND1 HIS A 107 51.680 126.816 27.869 1.00 41.68 N ATOM 816 CD2 HIS A 107 51.051 128.224 29.413 1.00 34.16 C ATOM 817 CE1 HIS A 107 52.361 127.933 27.680 1.00 37.38 C ATOM 818 NE2 HIS A 107 52.005 128.793 28.611 1.00 37.41 N ATOM 0 H HIS A 107 51.771 124.335 29.760 1.00 26.99 H new ATOM 0 HA HIS A 107 50.563 126.017 31.332 1.00 27.47 H new ATOM 0 HB2 HIS A 107 49.856 125.237 28.722 1.00 30.61 H new ATOM 0 HB3 HIS A 107 49.014 126.314 29.473 1.00 30.61 H new ATOM 0 HD2 HIS A 107 50.631 128.619 30.143 1.00 34.16 H new ATOM 0 HE1 HIS A 107 52.984 128.085 27.006 1.00 37.38 H new ATOM 0 HE2 HIS A 107 52.322 129.587 28.702 1.00 37.41 H new ATOM 819 N LEU A 108 48.368 125.239 32.245 1.00 28.83 N ATOM 820 CA LEU A 108 47.190 124.656 32.895 1.00 31.00 C ATOM 821 C LEU A 108 46.059 124.707 31.875 1.00 31.46 C ATOM 822 O LEU A 108 45.833 125.797 31.321 1.00 35.11 O ATOM 823 CB LEU A 108 46.812 125.472 34.142 1.00 30.86 C ATOM 824 CG LEU A 108 45.658 124.927 34.961 1.00 32.46 C ATOM 825 CD1 LEU A 108 45.985 123.594 35.571 1.00 32.85 C ATOM 826 CD2 LEU A 108 45.259 125.923 36.049 1.00 34.49 C ATOM 0 H LEU A 108 48.551 126.037 32.508 1.00 28.83 H new ATOM 0 HA LEU A 108 47.365 123.746 33.180 1.00 31.00 H new ATOM 0 HB2 LEU A 108 47.592 125.535 34.715 1.00 30.86 H new ATOM 0 HB3 LEU A 108 46.591 126.374 33.863 1.00 30.86 H new ATOM 0 HG LEU A 108 44.909 124.798 34.358 1.00 32.46 H new ATOM 0 HD11 LEU A 108 45.226 123.278 36.086 1.00 32.85 H new ATOM 0 HD12 LEU A 108 46.186 122.957 34.868 1.00 32.85 H new ATOM 0 HD13 LEU A 108 46.755 123.685 36.154 1.00 32.85 H new ATOM 0 HD21 LEU A 108 44.521 125.561 36.564 1.00 34.49 H new ATOM 0 HD22 LEU A 108 46.015 126.082 36.636 1.00 34.49 H new ATOM 0 HD23 LEU A 108 44.988 126.759 35.639 1.00 34.49 H new ATOM 827 N MET A 109 45.463 123.559 31.565 1.00 35.16 N ATOM 828 CA MET A 109 44.331 123.498 30.593 1.00 37.38 C ATOM 829 C MET A 109 42.999 123.621 31.355 1.00 37.66 C ATOM 830 O MET A 109 42.840 123.002 32.420 1.00 50.38 O ATOM 831 CB MET A 109 44.392 122.198 29.785 1.00 44.06 C ATOM 832 CG MET A 109 45.737 122.016 29.077 1.00 49.90 C ATOM 833 SD MET A 109 46.114 123.270 27.809 1.00 57.09 S ATOM 834 CE MET A 109 47.832 122.862 27.521 1.00 53.26 C ATOM 0 H MET A 109 45.687 122.798 31.897 1.00 35.16 H new ATOM 0 HA MET A 109 44.399 124.235 29.967 1.00 37.38 H new ATOM 0 HB2 MET A 109 44.235 121.445 30.376 1.00 44.06 H new ATOM 0 HB3 MET A 109 43.679 122.195 29.127 1.00 44.06 H new ATOM 0 HG2 MET A 109 46.442 122.027 29.743 1.00 49.90 H new ATOM 0 HG3 MET A 109 45.753 121.140 28.661 1.00 49.90 H new ATOM 0 HE1 MET A 109 48.280 123.618 27.110 1.00 53.26 H new ATOM 0 HE2 MET A 109 48.261 122.653 28.365 1.00 53.26 H new ATOM 0 HE3 MET A 109 47.888 122.094 26.932 1.00 53.26 H new ATOM 835 N GLY A 110 42.061 124.399 30.819 1.00 45.37 N ATOM 836 CA GLY A 110 40.676 124.433 31.336 1.00 45.97 C ATOM 837 C GLY A 110 39.829 123.374 30.654 1.00 44.75 C ATOM 838 O GLY A 110 39.952 122.174 30.963 1.00 47.32 O ATOM 0 H GLY A 110 42.200 124.921 30.150 1.00 45.37 H new ATOM 0 HA2 GLY A 110 40.679 124.285 32.295 1.00 45.97 H new ATOM 0 HA3 GLY A 110 40.290 125.310 31.186 1.00 45.97 H new ATOM 839 N ALA A 111 39.015 123.789 29.700 1.00 40.48 N ATOM 840 CA ALA A 111 38.007 122.911 29.118 1.00 35.17 C ATOM 841 C ALA A 111 38.664 121.931 28.126 1.00 30.61 C ATOM 842 O ALA A 111 39.668 122.264 27.491 1.00 31.21 O ATOM 843 CB ALA A 111 36.955 123.743 28.458 1.00 38.42 C ATOM 0 H ALA A 111 39.028 124.583 29.370 1.00 40.48 H new ATOM 0 HA ALA A 111 37.587 122.381 29.813 1.00 35.17 H new ATOM 0 HB1 ALA A 111 36.281 123.164 28.069 1.00 38.42 H new ATOM 0 HB2 ALA A 111 36.541 124.323 29.116 1.00 38.42 H new ATOM 0 HB3 ALA A 111 37.359 124.282 27.760 1.00 38.42 H new ATOM 844 N ASP A 112 38.115 120.732 28.058 1.00 31.88 N ATOM 845 CA ASP A 112 38.396 119.800 26.939 1.00 29.52 C ATOM 846 C ASP A 112 37.222 119.877 25.961 1.00 31.49 C ATOM 847 O ASP A 112 36.205 120.568 26.230 1.00 32.21 O ATOM 848 CB ASP A 112 38.735 118.423 27.477 1.00 29.45 C ATOM 849 CG ASP A 112 37.545 117.676 28.076 1.00 31.57 C ATOM 850 OD1 ASP A 112 36.405 118.029 27.747 1.00 37.43 O ATOM 851 OD2 ASP A 112 37.798 116.844 28.943 1.00 34.21 O ATOM 0 H ASP A 112 37.570 120.422 28.647 1.00 31.88 H new ATOM 0 HA ASP A 112 39.186 120.047 26.433 1.00 29.52 H new ATOM 0 HB2 ASP A 112 39.111 117.890 26.759 1.00 29.45 H new ATOM 0 HB3 ASP A 112 39.423 118.512 28.155 1.00 29.45 H new ATOM 852 N LEU A 113 37.364 119.198 24.826 0.50 28.75 N ATOM 853 CA LEU A 113 36.358 119.213 23.742 0.50 31.68 C ATOM 854 C LEU A 113 35.021 118.747 24.336 0.50 36.37 C ATOM 855 O LEU A 113 34.006 119.430 24.089 0.50 37.44 O ATOM 856 CB LEU A 113 36.842 118.321 22.598 0.50 33.01 C ATOM 857 CG LEU A 113 36.753 118.908 21.191 0.50 37.32 C ATOM 858 CD1 LEU A 113 36.515 117.815 20.173 0.50 35.83 C ATOM 859 CD2 LEU A 113 35.689 119.988 21.078 0.50 37.04 C ATOM 0 H LEU A 113 38.050 118.709 24.654 0.50 28.75 H new ATOM 0 HA LEU A 113 36.233 120.102 23.374 0.50 31.68 H new ATOM 0 HB2 LEU A 113 37.766 118.082 22.769 0.50 33.01 H new ATOM 0 HB3 LEU A 113 36.329 117.498 22.617 0.50 33.01 H new ATOM 0 HG LEU A 113 37.606 119.331 21.005 0.50 37.32 H new ATOM 0 HD11 LEU A 113 36.461 118.205 19.286 0.50 35.83 H new ATOM 0 HD12 LEU A 113 37.247 117.180 20.203 0.50 35.83 H new ATOM 0 HD13 LEU A 113 35.684 117.359 20.376 0.50 35.83 H new ATOM 0 HD21 LEU A 113 35.670 120.330 20.170 0.50 37.04 H new ATOM 0 HD22 LEU A 113 34.822 119.613 21.301 0.50 37.04 H new ATOM 0 HD23 LEU A 113 35.895 120.711 21.691 0.50 37.04 H new ATOM 860 N ASN A 114 35.037 117.685 25.151 0.50 36.75 N ATOM 861 CA ASN A 114 33.820 117.151 25.824 0.50 46.17 C ATOM 862 C ASN A 114 33.023 118.300 26.449 0.50 48.74 C ATOM 863 O ASN A 114 31.782 118.276 26.338 0.50 54.92 O ATOM 864 CB ASN A 114 34.150 116.104 26.889 0.50 46.89 C ATOM 865 CG ASN A 114 34.182 114.700 26.332 0.50 47.34 C ATOM 866 OD1 ASN A 114 33.409 114.370 25.438 0.50 51.00 O ATOM 867 ND2 ASN A 114 35.074 113.874 26.848 0.50 46.48 N ATOM 0 H ASN A 114 35.753 117.246 25.336 0.50 36.75 H new ATOM 0 HA ASN A 114 33.287 116.710 25.145 0.50 46.17 H new ATOM 0 HB2 ASN A 114 35.011 116.311 27.285 0.50 46.89 H new ATOM 0 HB3 ASN A 114 33.492 116.152 27.600 0.50 46.89 H new ATOM 0 HD21 ASN A 114 35.131 113.066 26.558 0.50 46.48 H new ATOM 0 HD22 ASN A 114 35.598 114.144 27.474 0.50 46.48 H new ATOM 868 N ASN A 115 33.712 119.259 27.078 0.50 53.16 N ATOM 869 CA ASN A 115 33.112 120.384 27.848 0.50 54.67 C ATOM 870 C ASN A 115 32.493 121.413 26.889 0.50 59.20 C ATOM 871 O ASN A 115 31.811 122.338 27.384 0.50 59.26 O ATOM 872 CB ASN A 115 34.136 121.038 28.779 0.50 54.92 C ATOM 873 CG ASN A 115 34.704 120.079 29.804 0.50 55.98 C ATOM 874 OD1 ASN A 115 35.936 120.317 30.225 0.50 58.40 O flip ATOM 875 ND2 ASN A 115 34.032 119.137 30.221 0.50 55.43 N flip ATOM 0 H ASN A 115 34.572 119.281 27.074 0.50 53.16 H new ATOM 0 HA ASN A 115 32.407 120.024 28.409 0.50 54.67 H new ATOM 0 HB2 ASN A 115 34.861 121.402 28.248 0.50 54.92 H new ATOM 0 HB3 ASN A 115 33.718 121.783 29.238 0.50 54.92 H new ATOM 0 HD21 ASN A 115 33.234 119.013 29.924 0.50 55.43 H new ATOM 0 HD22 ASN A 115 34.360 118.602 30.809 0.50 55.43 H new ATOM 876 N ILE A 116 32.706 121.258 25.577 0.50 60.77 N ATOM 877 CA ILE A 116 32.115 122.139 24.521 0.50 59.58 C ATOM 878 C ILE A 116 31.327 121.262 23.540 0.50 55.58 C ATOM 879 O ILE A 116 30.178 121.631 23.223 0.50 47.95 O ATOM 880 CB ILE A 116 33.196 122.971 23.793 0.50 62.40 C ATOM 881 CG1 ILE A 116 33.707 122.264 22.536 0.50 62.29 C ATOM 882 CG2 ILE A 116 34.337 123.357 24.724 0.50 60.67 C ATOM 883 CD1 ILE A 116 32.983 122.666 21.272 0.50 62.96 C ATOM 0 H ILE A 116 33.203 120.633 25.258 0.50 60.77 H new ATOM 0 HA ILE A 116 31.518 122.780 24.938 0.50 59.58 H new ATOM 0 HB ILE A 116 32.772 123.795 23.505 0.50 62.40 H new ATOM 0 HG12 ILE A 116 34.653 122.453 22.431 0.50 62.29 H new ATOM 0 HG13 ILE A 116 33.621 121.305 22.657 0.50 62.29 H new ATOM 0 HG21 ILE A 116 34.993 123.876 24.234 0.50 60.67 H new ATOM 0 HG22 ILE A 116 33.990 123.886 25.459 0.50 60.67 H new ATOM 0 HG23 ILE A 116 34.755 122.555 25.073 0.50 60.67 H new ATOM 0 HD11 ILE A 116 33.355 122.183 20.518 0.50 62.96 H new ATOM 0 HD12 ILE A 116 32.040 122.454 21.358 0.50 62.96 H new ATOM 0 HD13 ILE A 116 33.088 123.619 21.128 0.50 62.96 H new ATOM 884 N VAL A 117 31.486 119.893 23.598 0.50 27.40 N ATOM 885 CA VAL A 117 30.611 119.308 22.535 0.50 28.19 C ATOM 886 C VAL A 117 29.310 118.880 23.207 0.50 35.70 C ATOM 887 O VAL A 117 28.268 118.872 22.503 0.50 43.17 O ATOM 888 CB VAL A 117 31.325 118.152 21.793 0.50 26.72 C ATOM 0 H VAL A 117 31.967 119.395 24.108 0.50 27.40 H new ATOM 0 HA VAL A 117 30.413 119.961 21.846 0.50 28.19 H new ATOM 889 N LYS A 118 29.386 118.519 24.499 0.50 45.61 N ATOM 890 CA LYS A 118 28.233 118.106 25.350 0.50 53.18 C ATOM 891 C LYS A 118 27.243 119.272 25.471 0.50 60.30 C ATOM 892 O LYS A 118 26.036 119.058 25.206 0.50 58.44 O ATOM 893 CB LYS A 118 28.683 117.706 26.764 0.50 54.54 C ATOM 0 H LYS A 118 30.133 118.505 24.925 0.50 45.61 H new ATOM 0 HA LYS A 118 27.817 117.339 24.927 0.50 53.18 H new ATOM 894 N CYS A 119 27.734 120.449 25.879 0.50 65.45 N ATOM 895 CA CYS A 119 26.907 121.633 26.239 0.50 71.74 C ATOM 896 C CYS A 119 27.444 122.893 25.554 0.50 75.30 C ATOM 897 O CYS A 119 28.106 123.705 26.239 0.50 77.56 O ATOM 898 CB CYS A 119 26.857 121.842 27.748 0.50 73.98 C ATOM 899 SG CYS A 119 28.307 121.192 28.619 0.50 79.23 S ATOM 0 H CYS A 119 28.578 120.593 25.959 0.50 65.45 H new ATOM 0 HA CYS A 119 26.004 121.463 25.928 0.50 71.74 H new ATOM 0 HB2 CYS A 119 26.776 122.791 27.933 0.50 73.98 H new ATOM 0 HB3 CYS A 119 26.060 121.416 28.100 0.50 73.98 H new ATOM 0 HG CYS A 119 28.192 121.397 29.796 0.50 79.23 H new ATOM 900 N GLN A 120 27.164 123.025 24.253 0.50 75.33 N ATOM 901 CA GLN A 120 27.316 124.271 23.454 0.50 72.82 C ATOM 902 C GLN A 120 26.810 124.008 22.034 0.50 70.33 C ATOM 903 O GLN A 120 26.895 122.850 21.583 0.50 74.96 O ATOM 904 CB GLN A 120 28.767 124.754 23.424 0.50 72.76 C ATOM 905 CG GLN A 120 28.886 126.246 23.157 0.50 73.25 C ATOM 906 CD GLN A 120 29.711 126.926 24.220 0.50 74.13 C ATOM 907 OE1 GLN A 120 29.186 127.602 25.103 0.50 74.81 O ATOM 908 NE2 GLN A 120 31.017 126.720 24.160 0.50 75.09 N ATOM 0 H GLN A 120 26.867 122.368 23.784 0.50 75.33 H new ATOM 0 HA GLN A 120 26.793 124.974 23.870 0.50 72.82 H new ATOM 0 HB2 GLN A 120 29.190 124.547 24.272 0.50 72.76 H new ATOM 0 HB3 GLN A 120 29.251 124.267 22.739 0.50 72.76 H new ATOM 0 HG2 GLN A 120 29.292 126.390 22.288 0.50 73.25 H new ATOM 0 HG3 GLN A 120 28.002 126.643 23.127 0.50 73.25 H new ATOM 0 HE21 GLN A 120 31.348 126.241 23.527 0.50 75.09 H new ATOM 0 HE22 GLN A 120 31.534 127.065 24.754 0.50 75.09 H new ATOM 909 N LYS A 121 26.302 125.046 21.368 0.50 66.29 N ATOM 910 CA LYS A 121 25.807 124.985 19.968 0.50 63.13 C ATOM 911 C LYS A 121 26.970 125.343 19.031 0.50 60.56 C ATOM 912 O LYS A 121 27.473 126.484 19.110 0.50 60.21 O ATOM 913 CB LYS A 121 24.567 125.883 19.828 0.50 62.30 C ATOM 0 H LYS A 121 26.230 125.829 21.717 0.50 66.29 H new ATOM 0 HA LYS A 121 25.513 124.095 19.718 0.50 63.13 H new ATOM 914 N LEU A 122 27.398 124.378 18.207 0.50 56.28 N ATOM 915 CA LEU A 122 28.548 124.500 17.270 0.50 50.90 C ATOM 916 C LEU A 122 28.035 124.776 15.854 0.50 44.16 C ATOM 917 O LEU A 122 27.294 123.938 15.321 0.50 47.62 O ATOM 918 CB LEU A 122 29.357 123.198 17.297 0.50 50.27 C ATOM 919 CG LEU A 122 30.079 122.894 18.608 0.50 51.62 C ATOM 920 CD1 LEU A 122 30.975 121.675 18.460 0.50 51.67 C ATOM 921 CD2 LEU A 122 30.885 124.096 19.073 0.50 51.24 C ATOM 0 H LEU A 122 27.020 123.606 18.171 0.50 56.28 H new ATOM 0 HA LEU A 122 29.117 125.237 17.542 0.50 50.90 H new ATOM 0 HB2 LEU A 122 28.759 122.461 17.098 0.50 50.27 H new ATOM 0 HB3 LEU A 122 30.015 123.230 16.585 0.50 50.27 H new ATOM 0 HG LEU A 122 29.409 122.699 19.281 0.50 51.62 H new ATOM 0 HD11 LEU A 122 31.424 121.499 19.302 0.50 51.67 H new ATOM 0 HD12 LEU A 122 30.437 120.906 18.214 0.50 51.67 H new ATOM 0 HD13 LEU A 122 31.636 121.841 17.770 0.50 51.67 H new ATOM 0 HD21 LEU A 122 31.335 123.882 19.905 0.50 51.24 H new ATOM 0 HD22 LEU A 122 31.544 124.324 18.399 0.50 51.24 H new ATOM 0 HD23 LEU A 122 30.291 124.850 19.212 0.50 51.24 H new ATOM 922 N THR A 123 28.441 125.896 15.257 0.50 40.57 N ATOM 923 CA THR A 123 28.217 126.190 13.822 0.50 38.03 C ATOM 924 C THR A 123 29.158 125.306 12.990 0.50 35.97 C ATOM 925 O THR A 123 30.130 124.731 13.564 0.50 30.93 O ATOM 926 CB THR A 123 28.379 127.685 13.516 0.50 39.80 C ATOM 927 OG1 THR A 123 29.755 128.066 13.574 0.50 37.36 O ATOM 928 CG2 THR A 123 27.583 128.556 14.466 0.50 41.55 C ATOM 0 H THR A 123 28.861 126.521 15.673 0.50 40.57 H new ATOM 0 HA THR A 123 27.301 125.979 13.583 0.50 38.03 H new ATOM 0 HB THR A 123 28.036 127.822 12.619 0.50 39.80 H new ATOM 0 HG1 THR A 123 30.044 127.955 14.355 0.50 37.36 H new ATOM 0 HG21 THR A 123 27.714 129.489 14.237 0.50 41.55 H new ATOM 0 HG22 THR A 123 26.641 128.336 14.395 0.50 41.55 H new ATOM 0 HG23 THR A 123 27.883 128.402 15.375 0.50 41.55 H new ATOM 929 N ASP A 124 28.872 125.196 11.693 1.00 33.29 N ATOM 930 CA ASP A 124 29.797 124.541 10.726 1.00 32.25 C ATOM 931 C ASP A 124 31.154 125.254 10.799 1.00 30.88 C ATOM 932 O ASP A 124 32.164 124.603 10.653 1.00 26.65 O ATOM 933 CB ASP A 124 29.197 124.486 9.329 1.00 30.48 C ATOM 934 CG ASP A 124 30.025 123.726 8.323 1.00 27.67 C ATOM 935 OD1 ASP A 124 30.249 122.509 8.562 1.00 29.08 O ATOM 936 OD2 ASP A 124 30.431 124.337 7.367 1.00 28.32 O ATOM 0 H ASP A 124 28.146 125.492 11.339 1.00 33.29 H new ATOM 0 HA ASP A 124 29.937 123.611 10.963 1.00 32.25 H new ATOM 0 HB2 ASP A 124 28.319 124.078 9.382 1.00 30.48 H new ATOM 0 HB3 ASP A 124 29.070 125.392 9.008 1.00 30.48 H new ATOM 937 N AASP A 125 31.177 126.578 11.016 0.25 29.35 N ATOM 938 N BASP A 125 31.174 126.576 11.025 0.25 30.40 N ATOM 939 CA AASP A 125 32.447 127.352 11.066 0.25 27.82 C ATOM 940 CA BASP A 125 32.442 127.352 11.072 0.25 29.49 C ATOM 941 C AASP A 125 33.273 126.916 12.287 0.25 25.95 C ATOM 942 C BASP A 125 33.274 126.922 12.290 0.25 26.95 C ATOM 943 O AASP A 125 34.527 126.941 12.190 0.25 26.26 O ATOM 944 O BASP A 125 34.532 126.967 12.195 0.25 27.59 O ATOM 945 CB AASP A 125 32.215 128.867 11.114 0.25 30.20 C ATOM 946 CB BASP A 125 32.206 128.864 11.132 0.25 33.07 C ATOM 947 CG AASP A 125 31.689 129.463 9.818 0.25 31.63 C ATOM 948 CG BASP A 125 33.495 129.667 11.151 0.25 35.50 C ATOM 949 OD1AASP A 125 32.244 129.146 8.744 0.25 31.44 O ATOM 950 OD1BASP A 125 34.367 129.411 10.292 0.25 37.97 O ATOM 951 OD2AASP A 125 30.734 130.255 9.896 0.25 34.61 O ATOM 952 OD2BASP A 125 33.627 130.530 12.042 0.25 40.56 O ATOM 0 H AASP A 125 30.471 127.053 11.138 0.25 30.40 H new ATOM 0 H BASP A 125 30.467 127.048 11.154 0.25 30.40 H new ATOM 0 HA AASP A 125 32.930 127.161 10.247 0.25 29.49 H new ATOM 0 HA BASP A 125 32.920 127.161 10.250 0.25 29.49 H new ATOM 0 HB2AASP A 125 31.587 129.065 11.826 0.25 33.07 H new ATOM 0 HB2BASP A 125 31.674 129.134 10.367 0.25 33.07 H new ATOM 0 HB3AASP A 125 33.050 129.304 11.343 0.25 33.07 H new ATOM 0 HB3BASP A 125 31.689 129.074 11.925 0.25 33.07 H new ATOM 953 N HIS A 126 32.620 126.577 13.405 1.00 27.02 N ATOM 954 CA HIS A 126 33.337 126.057 14.620 1.00 26.19 C ATOM 955 C HIS A 126 33.916 124.674 14.287 1.00 23.67 C ATOM 956 O HIS A 126 35.090 124.404 14.682 1.00 23.31 O ATOM 957 CB HIS A 126 32.439 125.940 15.847 1.00 28.00 C ATOM 958 CG HIS A 126 32.059 127.252 16.471 1.00 36.70 C ATOM 959 ND1 HIS A 126 30.739 127.652 16.589 1.00 43.71 N ATOM 960 CD2 HIS A 126 32.797 128.225 17.049 1.00 41.04 C ATOM 961 CE1 HIS A 126 30.688 128.827 17.189 1.00 42.65 C ATOM 962 NE2 HIS A 126 31.936 129.203 17.489 1.00 44.46 N ATOM 0 H AHIS A 126 31.767 126.634 13.496 0.25 27.02 H new ATOM 0 H BHIS A 126 31.766 126.630 13.494 0.25 27.02 H new ATOM 0 HA HIS A 126 34.033 126.695 14.843 1.00 26.19 H new ATOM 0 HB2 HIS A 126 31.629 125.468 15.597 1.00 28.00 H new ATOM 0 HB3 HIS A 126 32.890 125.397 16.513 1.00 28.00 H new ATOM 0 HD2 HIS A 126 33.723 128.232 17.134 1.00 41.04 H new ATOM 0 HE1 HIS A 126 29.915 129.311 17.372 1.00 42.65 H new ATOM 0 HE2 HIS A 126 32.161 129.931 17.888 1.00 44.46 H new ATOM 963 N VAL A 127 33.131 123.837 13.632 1.00 22.75 N ATOM 964 CA VAL A 127 33.643 122.461 13.272 1.00 21.89 C ATOM 965 C VAL A 127 34.848 122.638 12.337 1.00 21.12 C ATOM 966 O VAL A 127 35.927 121.960 12.548 1.00 20.31 O ATOM 967 CB VAL A 127 32.584 121.543 12.656 1.00 23.54 C ATOM 968 CG1 VAL A 127 33.154 120.160 12.304 1.00 22.34 C ATOM 969 CG2 VAL A 127 31.379 121.385 13.569 1.00 27.09 C ATOM 0 H VAL A 127 32.326 124.008 13.382 1.00 22.75 H new ATOM 0 HA VAL A 127 33.903 122.010 14.091 1.00 21.89 H new ATOM 0 HB VAL A 127 32.298 121.972 11.835 1.00 23.54 H new ATOM 0 HG11 VAL A 127 32.454 119.610 11.918 1.00 22.34 H new ATOM 0 HG12 VAL A 127 33.876 120.261 11.664 1.00 22.34 H new ATOM 0 HG13 VAL A 127 33.492 119.735 13.108 1.00 22.34 H new ATOM 0 HG21 VAL A 127 30.730 120.799 13.150 1.00 27.09 H new ATOM 0 HG22 VAL A 127 31.661 121.002 14.414 1.00 27.09 H new ATOM 0 HG23 VAL A 127 30.976 122.253 13.727 1.00 27.09 H new ATOM 970 N GLN A 128 34.771 123.453 11.274 1.00 19.70 N ATOM 971 CA GLN A 128 35.905 123.699 10.353 1.00 20.41 C ATOM 972 C GLN A 128 37.135 124.074 11.221 1.00 20.33 C ATOM 973 O GLN A 128 38.259 123.497 11.013 1.00 19.30 O ATOM 974 CB GLN A 128 35.593 124.814 9.347 1.00 21.56 C ATOM 975 CG GLN A 128 34.599 124.436 8.267 1.00 23.43 C ATOM 976 CD GLN A 128 34.195 125.669 7.476 1.00 34.33 C ATOM 977 OE1 GLN A 128 35.127 126.586 7.330 1.00 39.69 O flip ATOM 978 NE2 GLN A 128 33.070 125.791 6.985 1.00 30.19 N flip ATOM 0 H GLN A 128 34.057 123.883 11.063 1.00 19.70 H new ATOM 0 HA GLN A 128 36.080 122.901 9.831 1.00 20.41 H new ATOM 0 HB2 GLN A 128 35.250 125.582 9.830 1.00 21.56 H new ATOM 0 HB3 GLN A 128 36.421 125.092 8.924 1.00 21.56 H new ATOM 0 HG2 GLN A 128 34.990 123.776 7.674 1.00 23.43 H new ATOM 0 HG3 GLN A 128 33.815 124.028 8.667 1.00 23.43 H new ATOM 0 HE21 GLN A 128 32.482 125.174 7.098 1.00 30.19 H new ATOM 0 HE22 GLN A 128 32.874 126.493 6.529 1.00 30.19 H new ATOM 979 N PHE A 129 37.031 125.063 12.109 1.00 21.60 N ATOM 980 CA PHE A 129 38.226 125.577 12.822 1.00 20.89 C ATOM 981 C PHE A 129 38.783 124.516 13.780 1.00 20.28 C ATOM 982 O PHE A 129 40.056 124.390 13.890 1.00 19.55 O ATOM 983 CB PHE A 129 37.917 126.890 13.570 1.00 23.32 C ATOM 984 CG PHE A 129 39.097 127.575 14.220 1.00 23.92 C ATOM 985 CD1 PHE A 129 40.260 127.811 13.512 1.00 28.40 C ATOM 986 CD2 PHE A 129 39.023 128.070 15.501 1.00 25.76 C ATOM 987 CE1 PHE A 129 41.338 128.470 14.093 1.00 28.73 C ATOM 988 CE2 PHE A 129 40.095 128.758 16.076 1.00 26.18 C ATOM 989 CZ PHE A 129 41.237 128.962 15.355 1.00 25.99 C ATOM 0 H PHE A 129 36.293 125.452 12.317 1.00 21.60 H new ATOM 0 HA PHE A 129 38.905 125.774 12.158 1.00 20.89 H new ATOM 0 HB2 PHE A 129 37.510 127.510 12.945 1.00 23.32 H new ATOM 0 HB3 PHE A 129 37.256 126.703 14.255 1.00 23.32 H new ATOM 0 HD1 PHE A 129 40.323 127.524 12.630 1.00 28.40 H new ATOM 0 HD2 PHE A 129 38.245 127.944 15.994 1.00 25.76 H new ATOM 0 HE1 PHE A 129 42.130 128.574 13.616 1.00 28.73 H new ATOM 0 HE2 PHE A 129 40.031 129.076 16.948 1.00 26.18 H new ATOM 0 HZ PHE A 129 41.944 129.437 15.728 1.00 25.99 H new ATOM 990 N LEU A 130 37.937 123.828 14.524 1.00 19.60 N ATOM 991 CA LEU A 130 38.400 122.793 15.486 1.00 18.68 C ATOM 992 C LEU A 130 39.099 121.656 14.722 1.00 17.39 C ATOM 993 O LEU A 130 40.244 121.261 15.136 1.00 18.33 O ATOM 994 CB LEU A 130 37.242 122.255 16.333 1.00 19.99 C ATOM 995 CG LEU A 130 36.730 123.263 17.373 1.00 21.07 C ATOM 996 CD1 LEU A 130 35.364 122.867 17.901 1.00 23.82 C ATOM 997 CD2 LEU A 130 37.708 123.448 18.522 1.00 20.98 C ATOM 0 H LEU A 130 37.084 123.932 14.500 1.00 19.60 H new ATOM 0 HA LEU A 130 39.033 123.201 16.097 1.00 18.68 H new ATOM 0 HB2 LEU A 130 36.510 122.004 15.747 1.00 19.99 H new ATOM 0 HB3 LEU A 130 37.530 121.448 16.788 1.00 19.99 H new ATOM 0 HG LEU A 130 36.648 124.115 16.916 1.00 21.07 H new ATOM 0 HD11 LEU A 130 35.067 123.520 18.554 1.00 23.82 H new ATOM 0 HD12 LEU A 130 34.731 122.833 17.167 1.00 23.82 H new ATOM 0 HD13 LEU A 130 35.419 121.994 18.320 1.00 23.82 H new ATOM 0 HD21 LEU A 130 37.348 124.090 19.154 1.00 20.98 H new ATOM 0 HD22 LEU A 130 37.847 122.598 18.969 1.00 20.98 H new ATOM 0 HD23 LEU A 130 38.554 123.774 18.178 1.00 20.98 H new ATOM 998 N ILE A 131 38.496 121.113 13.681 1.00 17.59 N ATOM 999 CA ILE A 131 39.147 119.955 12.980 1.00 17.84 C ATOM 1000 C ILE A 131 40.403 120.443 12.253 1.00 17.33 C ATOM 1001 O ILE A 131 41.390 119.669 12.204 1.00 17.17 O ATOM 1002 CB ILE A 131 38.144 119.220 12.054 1.00 17.01 C ATOM 1003 CG1 ILE A 131 36.907 118.722 12.825 1.00 18.60 C ATOM 1004 CG2 ILE A 131 38.823 118.063 11.317 1.00 18.15 C ATOM 1005 CD1 ILE A 131 37.197 117.792 13.990 1.00 18.79 C ATOM 0 H ILE A 131 37.742 121.368 13.356 1.00 17.59 H new ATOM 0 HA ILE A 131 39.427 119.293 13.631 1.00 17.84 H new ATOM 0 HB ILE A 131 37.838 119.865 11.397 1.00 17.01 H new ATOM 0 HG12 ILE A 131 36.421 119.492 13.159 1.00 18.60 H new ATOM 0 HG13 ILE A 131 36.320 118.264 12.203 1.00 18.60 H new ATOM 0 HG21 ILE A 131 38.177 117.620 10.745 1.00 18.15 H new ATOM 0 HG22 ILE A 131 39.551 118.407 10.776 1.00 18.15 H new ATOM 0 HG23 ILE A 131 39.172 117.428 11.962 1.00 18.15 H new ATOM 0 HD11 ILE A 131 36.363 117.532 14.412 1.00 18.79 H new ATOM 0 HD12 ILE A 131 37.655 117.001 13.666 1.00 18.79 H new ATOM 0 HD13 ILE A 131 37.758 118.248 14.637 1.00 18.79 H new ATOM 1006 N TYR A 132 40.415 121.654 11.674 1.00 17.95 N ATOM 1007 CA TYR A 132 41.623 122.236 11.017 1.00 17.70 C ATOM 1008 C TYR A 132 42.805 122.170 12.004 1.00 17.61 C ATOM 1009 O TYR A 132 43.924 121.744 11.596 1.00 17.25 O ATOM 1010 CB TYR A 132 41.363 123.693 10.565 1.00 18.74 C ATOM 1011 CG TYR A 132 42.606 124.383 10.056 1.00 19.03 C ATOM 1012 CD1 TYR A 132 43.133 124.035 8.844 1.00 19.82 C ATOM 1013 CD2 TYR A 132 43.317 125.268 10.859 1.00 19.67 C ATOM 1014 CE1 TYR A 132 44.316 124.595 8.369 1.00 20.16 C ATOM 1015 CE2 TYR A 132 44.509 125.817 10.401 1.00 18.97 C ATOM 1016 CZ TYR A 132 45.005 125.482 9.171 1.00 20.21 C ATOM 1017 OH TYR A 132 46.219 126.060 8.789 1.00 23.20 O ATOM 0 H TYR A 132 39.726 122.168 11.647 1.00 17.95 H new ATOM 0 HA TYR A 132 41.835 121.723 10.222 1.00 17.70 H new ATOM 0 HB2 TYR A 132 40.689 123.695 9.867 1.00 18.74 H new ATOM 0 HB3 TYR A 132 41.001 124.198 11.310 1.00 18.74 H new ATOM 0 HD1 TYR A 132 42.689 123.406 8.322 1.00 19.82 H new ATOM 0 HD2 TYR A 132 42.995 125.492 11.702 1.00 19.67 H new ATOM 0 HE1 TYR A 132 44.637 124.375 7.524 1.00 20.16 H new ATOM 0 HE2 TYR A 132 44.974 126.418 10.936 1.00 18.97 H new ATOM 0 HH TYR A 132 46.502 125.683 8.094 1.00 23.20 H new ATOM 1018 N GLN A 133 42.583 122.625 13.238 1.00 17.28 N ATOM 1019 CA GLN A 133 43.675 122.712 14.245 1.00 17.86 C ATOM 1020 C GLN A 133 44.154 121.290 14.588 1.00 17.46 C ATOM 1021 O GLN A 133 45.381 121.111 14.770 1.00 17.02 O ATOM 1022 CB GLN A 133 43.229 123.518 15.458 1.00 18.84 C ATOM 1023 CG GLN A 133 43.038 124.997 15.172 1.00 18.90 C ATOM 1024 CD GLN A 133 42.482 125.682 16.395 1.00 21.50 C ATOM 1025 OE1 GLN A 133 43.265 126.091 17.277 1.00 21.65 O ATOM 1026 NE2 GLN A 133 41.155 125.585 16.579 1.00 21.52 N ATOM 0 H GLN A 133 41.816 122.890 13.522 1.00 17.28 H new ATOM 0 HA GLN A 133 44.435 123.193 13.881 1.00 17.86 H new ATOM 0 HB2 GLN A 133 42.395 123.151 15.791 1.00 18.84 H new ATOM 0 HB3 GLN A 133 43.886 123.416 16.164 1.00 18.84 H new ATOM 0 HG2 GLN A 133 43.884 125.399 14.922 1.00 18.90 H new ATOM 0 HG3 GLN A 133 42.435 125.115 14.422 1.00 18.90 H new ATOM 0 HE21 GLN A 133 40.653 125.298 15.943 1.00 21.52 H new ATOM 0 HE22 GLN A 133 40.808 125.810 17.333 1.00 21.52 H new ATOM 1027 N ILE A 134 43.237 120.327 14.784 1.00 16.11 N ATOM 1028 CA ILE A 134 43.667 118.914 15.053 1.00 16.66 C ATOM 1029 C ILE A 134 44.580 118.464 13.905 1.00 17.27 C ATOM 1030 O ILE A 134 45.643 117.867 14.159 1.00 17.64 O ATOM 1031 CB ILE A 134 42.461 117.953 15.224 1.00 17.42 C ATOM 1032 CG1 ILE A 134 41.563 118.361 16.402 1.00 16.98 C ATOM 1033 CG2 ILE A 134 42.941 116.505 15.403 1.00 19.35 C ATOM 1034 CD1 ILE A 134 40.274 117.572 16.500 1.00 18.55 C ATOM 0 H ILE A 134 42.386 120.452 14.769 1.00 16.11 H new ATOM 0 HA ILE A 134 44.149 118.885 15.894 1.00 16.66 H new ATOM 0 HB ILE A 134 41.931 118.014 14.414 1.00 17.42 H new ATOM 0 HG12 ILE A 134 42.060 118.253 17.228 1.00 16.98 H new ATOM 0 HG13 ILE A 134 41.349 119.304 16.321 1.00 16.98 H new ATOM 0 HG21 ILE A 134 42.174 115.920 15.508 1.00 19.35 H new ATOM 0 HG22 ILE A 134 43.449 116.234 14.623 1.00 19.35 H new ATOM 0 HG23 ILE A 134 43.503 116.445 16.191 1.00 19.35 H new ATOM 0 HD11 ILE A 134 39.761 117.883 17.263 1.00 18.55 H new ATOM 0 HD12 ILE A 134 39.755 117.697 15.690 1.00 18.55 H new ATOM 0 HD13 ILE A 134 40.478 116.630 16.610 1.00 18.55 H new ATOM 1035 N LEU A 135 44.153 118.617 12.648 1.00 15.85 N ATOM 1036 CA LEU A 135 44.960 118.160 11.477 1.00 16.92 C ATOM 1037 C LEU A 135 46.305 118.906 11.378 1.00 16.35 C ATOM 1038 O LEU A 135 47.296 118.293 10.937 1.00 17.10 O ATOM 1039 CB LEU A 135 44.107 118.293 10.203 1.00 18.15 C ATOM 1040 CG LEU A 135 42.929 117.336 10.136 1.00 18.87 C ATOM 1041 CD1 LEU A 135 42.010 117.807 8.976 1.00 19.78 C ATOM 1042 CD2 LEU A 135 43.383 115.871 9.889 1.00 19.02 C ATOM 0 H LEU A 135 43.402 118.981 12.439 1.00 15.85 H new ATOM 0 HA LEU A 135 45.196 117.226 11.592 1.00 16.92 H new ATOM 0 HB2 LEU A 135 43.775 119.202 10.142 1.00 18.15 H new ATOM 0 HB3 LEU A 135 44.674 118.146 9.430 1.00 18.15 H new ATOM 0 HG LEU A 135 42.460 117.346 10.985 1.00 18.87 H new ATOM 0 HD11 LEU A 135 41.246 117.214 8.907 1.00 19.78 H new ATOM 0 HD12 LEU A 135 41.703 118.710 9.152 1.00 19.78 H new ATOM 0 HD13 LEU A 135 42.507 117.792 8.143 1.00 19.78 H new ATOM 0 HD21 LEU A 135 42.605 115.293 9.853 1.00 19.02 H new ATOM 0 HD22 LEU A 135 43.864 115.818 9.048 1.00 19.02 H new ATOM 0 HD23 LEU A 135 43.964 115.586 10.612 1.00 19.02 H new ATOM 1043 N ARG A 136 46.338 120.221 11.653 1.00 16.60 N ATOM 1044 CA ARG A 136 47.597 121.024 11.674 1.00 17.27 C ATOM 1045 C ARG A 136 48.552 120.392 12.688 1.00 16.75 C ATOM 1046 O ARG A 136 49.758 120.185 12.365 1.00 17.33 O ATOM 1047 CB ARG A 136 47.254 122.489 11.944 1.00 18.02 C ATOM 1048 CG ARG A 136 48.433 123.438 11.793 1.00 18.98 C ATOM 1049 CD ARG A 136 47.996 124.896 11.835 1.00 22.23 C ATOM 1050 NE ARG A 136 49.107 125.845 11.812 1.00 22.02 N ATOM 1051 CZ ARG A 136 49.518 126.585 12.836 1.00 27.39 C ATOM 1052 NH1 ARG A 136 49.041 126.405 14.059 1.00 28.43 N ATOM 1053 NH2 ARG A 136 50.526 127.438 12.657 1.00 31.40 N ATOM 0 H ARG A 136 45.634 120.680 11.834 1.00 16.60 H new ATOM 0 HA ARG A 136 48.056 121.016 10.819 1.00 17.27 H new ATOM 0 HB2 ARG A 136 46.549 122.764 11.337 1.00 18.02 H new ATOM 0 HB3 ARG A 136 46.900 122.568 12.844 1.00 18.02 H new ATOM 0 HG2 ARG A 136 49.074 123.272 12.502 1.00 18.98 H new ATOM 0 HG3 ARG A 136 48.886 123.260 10.954 1.00 18.98 H new ATOM 0 HD2 ARG A 136 47.415 125.073 11.079 1.00 22.23 H new ATOM 0 HD3 ARG A 136 47.471 125.045 12.637 1.00 22.23 H new ATOM 0 HE ARG A 136 49.533 125.932 11.070 1.00 22.02 H new ATOM 0 HH11 ARG A 136 48.451 125.797 14.205 1.00 28.43 H new ATOM 0 HH12 ARG A 136 49.322 126.896 14.707 1.00 28.43 H new ATOM 0 HH21 ARG A 136 50.902 127.504 11.886 1.00 31.40 H new ATOM 0 HH22 ARG A 136 50.801 127.922 13.312 1.00 31.40 H new ATOM 1054 N GLY A 137 48.101 120.152 13.920 1.00 17.50 N ATOM 1055 CA GLY A 137 48.933 119.452 14.916 1.00 16.80 C ATOM 1056 C GLY A 137 49.353 118.036 14.496 1.00 17.72 C ATOM 1057 O GLY A 137 50.523 117.638 14.677 1.00 16.90 O ATOM 0 H GLY A 137 47.322 120.383 14.203 1.00 17.50 H new ATOM 0 HA2 GLY A 137 49.730 119.979 15.085 1.00 16.80 H new ATOM 0 HA3 GLY A 137 48.444 119.400 15.752 1.00 16.80 H new ATOM 1058 N LEU A 138 48.455 117.276 13.843 1.00 16.32 N ATOM 1059 CA LEU A 138 48.787 115.888 13.399 1.00 18.77 C ATOM 1060 C LEU A 138 49.780 115.927 12.246 1.00 17.46 C ATOM 1061 O LEU A 138 50.617 114.994 12.190 1.00 18.43 O ATOM 1062 CB LEU A 138 47.529 115.135 12.954 1.00 19.44 C ATOM 1063 CG LEU A 138 46.724 114.417 14.005 1.00 27.81 C ATOM 1064 CD1 LEU A 138 45.743 113.477 13.238 1.00 25.73 C ATOM 1065 CD2 LEU A 138 47.581 113.526 14.926 1.00 26.50 C ATOM 0 H LEU A 138 47.658 117.533 13.646 1.00 16.32 H new ATOM 0 HA LEU A 138 49.180 115.423 14.154 1.00 18.77 H new ATOM 0 HB2 LEU A 138 46.943 115.770 12.514 1.00 19.44 H new ATOM 0 HB3 LEU A 138 47.794 114.483 12.286 1.00 19.44 H new ATOM 0 HG LEU A 138 46.289 115.080 14.563 1.00 27.81 H new ATOM 0 HD11 LEU A 138 45.198 112.989 13.875 1.00 25.73 H new ATOM 0 HD12 LEU A 138 45.170 114.007 12.662 1.00 25.73 H new ATOM 0 HD13 LEU A 138 46.250 112.850 12.699 1.00 25.73 H new ATOM 0 HD21 LEU A 138 47.010 113.092 15.579 1.00 26.50 H new ATOM 0 HD22 LEU A 138 48.034 112.853 14.395 1.00 26.50 H new ATOM 0 HD23 LEU A 138 48.239 114.072 15.384 1.00 26.50 H new ATOM 1066 N LYS A 139 49.716 116.875 11.321 1.00 16.58 N ATOM 1067 CA LYS A 139 50.732 116.964 10.255 1.00 18.14 C ATOM 1068 C LYS A 139 52.107 117.058 10.933 1.00 19.45 C ATOM 1069 O LYS A 139 53.039 116.325 10.504 1.00 18.87 O ATOM 1070 CB LYS A 139 50.478 118.122 9.289 1.00 18.96 C ATOM 1071 CG LYS A 139 51.521 118.303 8.191 1.00 20.42 C ATOM 1072 CD LYS A 139 51.501 119.662 7.493 1.00 21.98 C ATOM 1073 CE LYS A 139 52.573 119.737 6.427 1.00 25.37 C ATOM 1074 NZ LYS A 139 52.725 121.086 5.832 1.00 25.35 N ATOM 0 H LYS A 139 49.102 117.476 11.284 1.00 16.58 H new ATOM 0 HA LYS A 139 50.690 116.171 9.698 1.00 18.14 H new ATOM 0 HB2 LYS A 139 49.612 117.991 8.872 1.00 18.96 H new ATOM 0 HB3 LYS A 139 50.425 118.944 9.801 1.00 18.96 H new ATOM 0 HG2 LYS A 139 52.401 118.165 8.575 1.00 20.42 H new ATOM 0 HG3 LYS A 139 51.391 117.611 7.524 1.00 20.42 H new ATOM 0 HD2 LYS A 139 50.630 119.811 7.093 1.00 21.98 H new ATOM 0 HD3 LYS A 139 51.638 120.367 8.145 1.00 21.98 H new ATOM 0 HE2 LYS A 139 53.421 119.464 6.812 1.00 25.37 H new ATOM 0 HE3 LYS A 139 52.364 119.103 5.723 1.00 25.37 H new ATOM 0 HZ1 LYS A 139 53.404 121.082 5.257 1.00 25.35 H new ATOM 0 HZ2 LYS A 139 51.977 121.308 5.405 1.00 25.35 H new ATOM 0 HZ3 LYS A 139 52.885 121.679 6.476 1.00 25.35 H new ATOM 1075 N TYR A 140 52.237 117.921 11.923 1.00 18.00 N ATOM 1076 CA TYR A 140 53.519 118.108 12.677 1.00 17.77 C ATOM 1077 C TYR A 140 53.907 116.792 13.354 1.00 17.84 C ATOM 1078 O TYR A 140 55.067 116.316 13.159 1.00 19.36 O ATOM 1079 CB TYR A 140 53.358 119.266 13.670 1.00 16.95 C ATOM 1080 CG TYR A 140 54.515 119.450 14.617 1.00 17.11 C ATOM 1081 CD1 TYR A 140 55.551 120.283 14.239 1.00 17.70 C ATOM 1082 CD2 TYR A 140 54.575 118.821 15.840 1.00 16.56 C ATOM 1083 CE1 TYR A 140 56.653 120.460 15.088 1.00 18.60 C ATOM 1084 CE2 TYR A 140 55.671 118.977 16.690 1.00 19.42 C ATOM 1085 CZ TYR A 140 56.692 119.827 16.314 1.00 18.22 C ATOM 1086 OH TYR A 140 57.786 119.921 17.167 1.00 20.21 O ATOM 0 H TYR A 140 51.597 118.427 12.195 1.00 18.00 H new ATOM 0 HA TYR A 140 54.243 118.344 12.076 1.00 17.77 H new ATOM 0 HB2 TYR A 140 53.231 120.088 13.171 1.00 16.95 H new ATOM 0 HB3 TYR A 140 52.551 119.121 14.189 1.00 16.95 H new ATOM 0 HD1 TYR A 140 55.517 120.726 13.422 1.00 17.70 H new ATOM 0 HD2 TYR A 140 53.868 118.279 16.106 1.00 16.56 H new ATOM 0 HE1 TYR A 140 57.359 121.005 14.824 1.00 18.60 H new ATOM 0 HE2 TYR A 140 55.713 118.516 17.497 1.00 19.42 H new ATOM 0 HH TYR A 140 57.889 119.192 17.572 1.00 20.21 H new ATOM 1087 N ILE A 141 53.030 116.171 14.154 1.00 16.92 N ATOM 1088 CA ILE A 141 53.328 114.915 14.908 1.00 18.13 C ATOM 1089 C ILE A 141 53.761 113.814 13.910 1.00 17.40 C ATOM 1090 O ILE A 141 54.846 113.161 14.075 1.00 19.79 O ATOM 1091 CB ILE A 141 52.109 114.492 15.757 1.00 19.76 C ATOM 1092 CG1 ILE A 141 51.831 115.507 16.892 1.00 20.61 C ATOM 1093 CG2 ILE A 141 52.262 113.111 16.347 1.00 24.57 C ATOM 1094 CD1 ILE A 141 50.445 115.406 17.492 1.00 22.73 C ATOM 0 H ILE A 141 52.231 116.463 14.283 1.00 16.92 H new ATOM 0 HA ILE A 141 54.060 115.065 15.527 1.00 18.13 H new ATOM 0 HB ILE A 141 51.355 114.476 15.147 1.00 19.76 H new ATOM 0 HG12 ILE A 141 52.487 115.378 17.595 1.00 20.61 H new ATOM 0 HG13 ILE A 141 51.958 116.405 16.547 1.00 20.61 H new ATOM 0 HG21 ILE A 141 51.474 112.893 16.869 1.00 24.57 H new ATOM 0 HG22 ILE A 141 52.366 112.463 15.632 1.00 24.57 H new ATOM 0 HG23 ILE A 141 53.045 113.088 16.919 1.00 24.57 H new ATOM 0 HD11 ILE A 141 50.346 116.070 18.192 1.00 22.73 H new ATOM 0 HD12 ILE A 141 49.781 115.563 16.802 1.00 22.73 H new ATOM 0 HD13 ILE A 141 50.318 114.520 17.866 1.00 22.73 H new ATOM 1095 N HIS A 142 53.009 113.615 12.832 1.00 16.99 N ATOM 1096 CA HIS A 142 53.317 112.501 11.893 1.00 17.05 C ATOM 1097 C HIS A 142 54.631 112.763 11.104 1.00 20.13 C ATOM 1098 O HIS A 142 55.269 111.760 10.728 1.00 20.33 O ATOM 1099 CB HIS A 142 52.096 112.332 10.938 1.00 17.32 C ATOM 1100 CG HIS A 142 50.918 111.722 11.618 1.00 15.28 C ATOM 1101 ND1 HIS A 142 49.694 111.555 10.892 1.00 17.67 N ATOM 1102 CD2 HIS A 142 50.737 111.184 12.827 1.00 16.20 C ATOM 1103 CE1 HIS A 142 48.834 110.948 11.718 1.00 18.06 C ATOM 1104 NE2 HIS A 142 49.410 110.719 12.950 1.00 17.91 N ATOM 0 H HIS A 142 52.328 114.094 12.617 1.00 16.99 H new ATOM 0 HA HIS A 142 53.464 111.681 12.390 1.00 17.05 H new ATOM 0 HB2 HIS A 142 51.846 113.199 10.581 1.00 17.32 H new ATOM 0 HB3 HIS A 142 52.353 111.778 10.184 1.00 17.32 H new ATOM 0 HD1 HIS A 142 49.541 111.798 10.081 1.00 17.67 H new ATOM 0 HD2 HIS A 142 51.388 111.125 13.489 1.00 16.20 H new ATOM 0 HE1 HIS A 142 47.963 110.712 11.491 1.00 18.06 H new ATOM 0 HE2 HIS A 142 49.041 110.369 13.643 1.00 17.91 H new ATOM 1105 N SER A 143 55.013 114.013 10.866 1.00 19.42 N ATOM 1106 CA SER A 143 56.258 114.395 10.160 1.00 19.69 C ATOM 1107 C SER A 143 57.448 113.905 10.997 1.00 22.22 C ATOM 1108 O SER A 143 58.532 113.771 10.335 1.00 27.70 O ATOM 1109 CB SER A 143 56.299 115.870 9.856 1.00 21.40 C ATOM 1110 OG SER A 143 56.612 116.637 11.023 1.00 19.73 O ATOM 0 H SER A 143 54.547 114.692 11.115 1.00 19.42 H new ATOM 0 HA SER A 143 56.298 113.968 9.290 1.00 19.69 H new ATOM 0 HB2 SER A 143 56.960 116.041 9.168 1.00 21.40 H new ATOM 0 HB3 SER A 143 55.441 116.153 9.502 1.00 21.40 H new ATOM 0 HG SER A 143 56.115 116.399 11.657 1.00 19.73 H new ATOM 1111 N ALA A 144 57.322 113.695 12.297 1.00 21.61 N ATOM 1112 CA ALA A 144 58.400 113.194 13.207 1.00 22.14 C ATOM 1113 C ALA A 144 58.317 111.651 13.319 1.00 21.66 C ATOM 1114 O ALA A 144 58.943 111.039 14.223 1.00 23.40 O ATOM 1115 CB ALA A 144 58.288 113.844 14.555 1.00 26.47 C ATOM 0 H ALA A 144 56.582 113.840 12.711 1.00 21.61 H new ATOM 0 HA ALA A 144 59.266 113.427 12.837 1.00 22.14 H new ATOM 0 HB1 ALA A 144 58.991 113.511 15.134 1.00 26.47 H new ATOM 0 HB2 ALA A 144 58.376 114.805 14.459 1.00 26.47 H new ATOM 0 HB3 ALA A 144 57.424 113.636 14.944 1.00 26.47 H new ATOM 1116 N ASP A 145 57.440 110.993 12.520 1.00 21.14 N ATOM 1117 CA ASP A 145 57.140 109.546 12.679 1.00 21.46 C ATOM 1118 C ASP A 145 56.721 109.159 14.097 1.00 21.30 C ATOM 1119 O ASP A 145 57.020 108.041 14.629 1.00 21.88 O ATOM 1120 CB ASP A 145 58.280 108.642 12.164 1.00 24.56 C ATOM 1121 CG ASP A 145 58.471 108.733 10.653 1.00 33.02 C ATOM 1122 OD1 ASP A 145 57.517 109.136 9.926 1.00 37.36 O ATOM 1123 OD2 ASP A 145 59.564 108.309 10.157 1.00 36.37 O ATOM 0 H ASP A 145 57.008 111.370 11.879 1.00 21.14 H new ATOM 0 HA ASP A 145 56.367 109.390 12.114 1.00 21.46 H new ATOM 0 HB2 ASP A 145 59.108 108.889 12.606 1.00 24.56 H new ATOM 0 HB3 ASP A 145 58.092 107.722 12.407 1.00 24.56 H new ATOM 1124 N ILE A 146 55.874 110.025 14.725 1.00 19.90 N ATOM 1125 CA ILE A 146 55.193 109.759 16.010 1.00 22.89 C ATOM 1126 C ILE A 146 53.722 109.407 15.699 1.00 21.07 C ATOM 1127 O ILE A 146 53.168 110.107 14.796 1.00 22.33 O ATOM 1128 CB ILE A 146 55.320 110.980 16.947 1.00 22.72 C ATOM 1129 CG1 ILE A 146 56.806 111.230 17.314 1.00 23.59 C ATOM 1130 CG2 ILE A 146 54.482 110.742 18.183 1.00 23.79 C ATOM 1131 CD1 ILE A 146 57.149 112.599 17.910 1.00 25.18 C ATOM 0 H ILE A 146 55.683 110.798 14.399 1.00 19.90 H new ATOM 0 HA ILE A 146 55.604 109.014 16.475 1.00 22.89 H new ATOM 0 HB ILE A 146 54.995 111.775 16.495 1.00 22.72 H new ATOM 0 HG12 ILE A 146 57.080 110.548 17.946 1.00 23.59 H new ATOM 0 HG13 ILE A 146 57.340 111.106 16.514 1.00 23.59 H new ATOM 0 HG21 ILE A 146 54.557 111.505 18.777 1.00 23.79 H new ATOM 0 HG22 ILE A 146 53.554 110.622 17.927 1.00 23.79 H new ATOM 0 HG23 ILE A 146 54.797 109.946 18.639 1.00 23.79 H new ATOM 0 HD11 ILE A 146 58.100 112.641 18.099 1.00 25.18 H new ATOM 0 HD12 ILE A 146 56.914 113.296 17.277 1.00 25.18 H new ATOM 0 HD13 ILE A 146 56.651 112.728 18.732 1.00 25.18 H new ATOM 1132 N ILE A 147 53.208 108.379 16.334 1.00 22.07 N ATOM 1133 CA ILE A 147 51.745 107.999 16.271 1.00 19.37 C ATOM 1134 C ILE A 147 51.148 108.437 17.613 1.00 22.38 C ATOM 1135 O ILE A 147 51.669 108.018 18.656 1.00 20.90 O ATOM 1136 CB ILE A 147 51.535 106.509 15.961 1.00 23.58 C ATOM 1137 CG1 ILE A 147 52.348 106.125 14.718 1.00 27.80 C ATOM 1138 CG2 ILE A 147 50.026 106.256 15.800 1.00 24.05 C ATOM 1139 CD1 ILE A 147 52.434 104.663 14.462 1.00 30.64 C ATOM 0 H ILE A 147 53.676 107.854 16.829 1.00 22.07 H new ATOM 0 HA ILE A 147 51.293 108.443 15.537 1.00 19.37 H new ATOM 0 HB ILE A 147 51.854 105.946 16.684 1.00 23.58 H new ATOM 0 HG12 ILE A 147 51.954 106.554 13.943 1.00 27.80 H new ATOM 0 HG13 ILE A 147 53.246 106.478 14.812 1.00 27.80 H new ATOM 0 HG21 ILE A 147 49.874 105.318 15.603 1.00 24.05 H new ATOM 0 HG22 ILE A 147 49.569 106.492 16.622 1.00 24.05 H new ATOM 0 HG23 ILE A 147 49.683 106.798 15.073 1.00 24.05 H new ATOM 0 HD11 ILE A 147 52.961 104.505 13.663 1.00 30.64 H new ATOM 0 HD12 ILE A 147 52.855 104.226 15.219 1.00 30.64 H new ATOM 0 HD13 ILE A 147 51.542 104.303 14.336 1.00 30.64 H new ATOM 1140 N HIS A 148 50.060 109.219 17.634 1.00 18.59 N ATOM 1141 CA HIS A 148 49.451 109.598 18.947 1.00 18.45 C ATOM 1142 C HIS A 148 48.790 108.378 19.603 1.00 19.16 C ATOM 1143 O HIS A 148 49.084 108.123 20.810 1.00 21.17 O ATOM 1144 CB HIS A 148 48.456 110.759 18.754 1.00 18.35 C ATOM 1145 CG HIS A 148 47.903 111.250 20.063 1.00 18.83 C ATOM 1146 ND1 HIS A 148 46.995 110.534 20.812 1.00 19.52 N ATOM 1147 CD2 HIS A 148 48.167 112.405 20.739 1.00 18.50 C ATOM 1148 CE1 HIS A 148 46.692 111.245 21.888 1.00 18.79 C ATOM 1149 NE2 HIS A 148 47.420 112.391 21.882 1.00 19.59 N ATOM 0 H HIS A 148 49.665 109.535 16.938 1.00 18.59 H new ATOM 0 HA HIS A 148 50.149 109.905 19.547 1.00 18.45 H new ATOM 0 HB2 HIS A 148 48.899 111.491 18.296 1.00 18.35 H new ATOM 0 HB3 HIS A 148 47.727 110.468 18.185 1.00 18.35 H new ATOM 0 HD2 HIS A 148 48.749 113.079 20.471 1.00 18.50 H new ATOM 0 HE1 HIS A 148 46.079 110.999 22.542 1.00 18.79 H new ATOM 0 HE2 HIS A 148 47.412 113.000 22.490 1.00 19.59 H new ATOM 1150 N AARG A 149 47.906 107.658 18.891 0.22 19.95 N ATOM 1151 N BARG A 149 47.897 107.691 18.859 0.22 20.79 N ATOM 1152 CA AARG A 149 47.320 106.344 19.288 0.22 21.13 C ATOM 1153 CA BARG A 149 47.211 106.399 19.167 0.22 22.38 C ATOM 1154 C AARG A 149 46.142 106.492 20.277 0.22 20.98 C ATOM 1155 C BARG A 149 45.940 106.596 20.019 0.22 21.88 C ATOM 1156 O AARG A 149 45.585 105.428 20.674 0.22 22.24 O ATOM 1157 O BARG A 149 45.047 105.690 19.955 0.22 25.45 O ATOM 1158 CB AARG A 149 48.361 105.419 19.952 0.22 23.78 C ATOM 1159 CB BARG A 149 48.149 105.397 19.860 0.22 26.40 C ATOM 1160 CG AARG A 149 49.736 105.361 19.297 0.22 24.64 C ATOM 1161 CG BARG A 149 49.005 104.552 18.927 0.22 28.99 C ATOM 1162 CD AARG A 149 50.923 105.268 20.253 0.22 28.57 C ATOM 1163 CD BARG A 149 50.358 104.176 19.542 0.22 31.65 C ATOM 1164 NE AARG A 149 52.172 105.052 19.514 0.22 29.26 N ATOM 1165 NE BARG A 149 50.287 104.151 20.998 0.22 34.88 N ATOM 1166 CZ AARG A 149 52.557 103.868 19.050 0.22 30.77 C ATOM 1167 CZ BARG A 149 49.763 103.170 21.726 0.22 35.57 C ATOM 1168 NH1AARG A 149 51.823 102.794 19.288 0.22 33.18 N ATOM 1169 NH1BARG A 149 49.303 102.077 21.144 0.22 41.23 N ATOM 1170 NH2AARG A 149 53.678 103.746 18.360 0.22 29.86 N ATOM 1171 NH2BARG A 149 49.715 103.282 23.042 0.22 37.32 N ATOM 0 H AARG A 149 47.614 107.928 18.128 0.22 20.79 H new ATOM 0 H BARG A 149 47.652 107.992 18.092 0.22 20.79 H new ATOM 0 HA AARG A 149 47.005 105.955 18.457 0.22 22.38 H new ATOM 0 HA BARG A 149 46.947 106.032 18.309 0.22 22.38 H new ATOM 0 HB2AARG A 149 48.475 105.702 20.873 0.22 26.40 H new ATOM 0 HB2BARG A 149 48.735 105.886 20.458 0.22 26.40 H new ATOM 0 HB3AARG A 149 47.997 104.520 19.975 0.22 26.40 H new ATOM 0 HB3BARG A 149 47.614 104.803 20.410 0.22 26.40 H new ATOM 0 HG2AARG A 149 49.760 104.595 18.702 0.22 28.99 H new ATOM 0 HG2BARG A 149 48.523 103.743 18.696 0.22 28.99 H new ATOM 0 HG3AARG A 149 49.847 106.152 18.746 0.22 28.99 H new ATOM 0 HG3BARG A 149 49.154 105.039 18.101 0.22 28.99 H new ATOM 0 HD2AARG A 149 50.988 106.083 20.775 0.22 31.65 H new ATOM 0 HD2BARG A 149 50.634 103.306 19.214 0.22 31.65 H new ATOM 0 HD3AARG A 149 50.783 104.541 20.879 0.22 31.65 H new ATOM 0 HD3BARG A 149 51.033 104.813 19.259 0.22 31.65 H new ATOM 0 HE AARG A 149 52.683 105.729 19.373 0.22 34.88 H new ATOM 0 HE BARG A 149 50.611 104.826 21.421 0.22 34.88 H new ATOM 0 HH11AARG A 149 51.096 102.862 19.743 0.22 41.23 H new ATOM 0 HH11BARG A 149 49.341 101.997 20.289 0.22 41.23 H new ATOM 0 HH12AARG A 149 52.072 102.028 18.988 0.22 41.23 H new ATOM 0 HH12BARG A 149 48.965 101.446 21.620 0.22 41.23 H new ATOM 0 HH21AARG A 149 54.166 104.437 18.207 0.22 37.32 H new ATOM 0 HH21BARG A 149 50.022 103.988 23.425 0.22 37.32 H new ATOM 0 HH22AARG A 149 53.919 102.975 18.064 0.22 37.32 H new ATOM 0 HH22BARG A 149 49.376 102.649 23.515 0.22 37.32 H new ATOM 1172 N ASP A 150 45.832 107.695 20.773 1.00 19.98 N ATOM 1173 CA ASP A 150 44.754 107.856 21.794 1.00 20.91 C ATOM 1174 C ASP A 150 44.028 109.182 21.582 1.00 21.59 C ATOM 1175 O ASP A 150 43.651 109.874 22.573 1.00 20.81 O ATOM 1176 CB ASP A 150 45.305 107.721 23.227 1.00 21.83 C ATOM 1177 CG ASP A 150 44.241 107.446 24.277 1.00 27.07 C ATOM 1178 OD1 ASP A 150 43.173 106.868 23.922 1.00 28.22 O ATOM 1179 OD2 ASP A 150 44.470 107.886 25.431 1.00 25.63 O ATOM 0 H AASP A 150 46.220 108.427 20.543 0.22 19.98 H new ATOM 0 H BASP A 150 46.367 108.366 20.718 0.22 19.98 H new ATOM 0 HA ASP A 150 44.111 107.139 21.680 1.00 20.91 H new ATOM 0 HB2 ASP A 150 45.958 107.004 23.246 1.00 21.83 H new ATOM 0 HB3 ASP A 150 45.774 108.537 23.461 1.00 21.83 H new ATOM 1180 N LEU A 151 43.704 109.561 20.351 1.00 18.34 N ATOM 1181 CA LEU A 151 42.972 110.810 20.115 1.00 17.42 C ATOM 1182 C LEU A 151 41.492 110.550 20.443 1.00 17.60 C ATOM 1183 O LEU A 151 40.941 109.555 19.935 1.00 18.60 O ATOM 1184 CB LEU A 151 43.108 111.300 18.657 1.00 20.44 C ATOM 1185 CG LEU A 151 44.454 111.824 18.210 1.00 23.79 C ATOM 1186 CD1 LEU A 151 44.387 112.091 16.706 1.00 25.33 C ATOM 1187 CD2 LEU A 151 44.824 113.120 18.971 1.00 23.94 C ATOM 0 H LEU A 151 43.895 109.116 19.640 1.00 18.34 H new ATOM 0 HA LEU A 151 43.343 111.506 20.679 1.00 17.42 H new ATOM 0 HB2 LEU A 151 42.865 110.565 18.072 1.00 20.44 H new ATOM 0 HB3 LEU A 151 42.454 112.002 18.517 1.00 20.44 H new ATOM 0 HG LEU A 151 45.141 111.167 18.404 1.00 23.79 H new ATOM 0 HD11 LEU A 151 45.243 112.429 16.399 1.00 25.33 H new ATOM 0 HD12 LEU A 151 44.179 111.266 16.240 1.00 25.33 H new ATOM 0 HD13 LEU A 151 43.697 112.748 16.524 1.00 25.33 H new ATOM 0 HD21 LEU A 151 45.689 113.437 18.669 1.00 23.94 H new ATOM 0 HD22 LEU A 151 44.153 113.799 18.799 1.00 23.94 H new ATOM 0 HD23 LEU A 151 44.862 112.937 19.923 1.00 23.94 H new ATOM 1188 N LYS A 152 40.877 111.430 21.220 1.00 17.42 N ATOM 1189 CA LYS A 152 39.484 111.368 21.695 1.00 18.41 C ATOM 1190 C LYS A 152 39.197 112.735 22.326 1.00 19.30 C ATOM 1191 O LYS A 152 40.158 113.486 22.628 1.00 18.78 O ATOM 1192 CB LYS A 152 39.282 110.206 22.664 1.00 19.48 C ATOM 1193 CG LYS A 152 40.167 110.214 23.899 1.00 19.83 C ATOM 1194 CD LYS A 152 39.983 108.973 24.775 1.00 22.53 C ATOM 1195 CE LYS A 152 40.993 109.005 25.898 1.00 26.89 C ATOM 1196 NZ LYS A 152 40.840 107.835 26.799 1.00 29.12 N ATOM 0 H LYS A 152 41.283 112.131 21.508 1.00 17.42 H new ATOM 0 HA LYS A 152 38.860 111.196 20.973 1.00 18.41 H new ATOM 0 HB2 LYS A 152 38.355 110.203 22.951 1.00 19.48 H new ATOM 0 HB3 LYS A 152 39.433 109.377 22.184 1.00 19.48 H new ATOM 0 HG2 LYS A 152 41.095 110.275 23.625 1.00 19.83 H new ATOM 0 HG3 LYS A 152 39.973 111.006 24.424 1.00 19.83 H new ATOM 0 HD2 LYS A 152 39.083 108.949 25.135 1.00 22.53 H new ATOM 0 HD3 LYS A 152 40.098 108.169 24.245 1.00 22.53 H new ATOM 0 HE2 LYS A 152 41.890 109.015 25.528 1.00 26.89 H new ATOM 0 HE3 LYS A 152 40.887 109.824 26.407 1.00 26.89 H new ATOM 0 HZ1 LYS A 152 41.446 107.880 27.449 1.00 29.12 H new ATOM 0 HZ2 LYS A 152 40.024 107.838 27.154 1.00 29.12 H new ATOM 0 HZ3 LYS A 152 40.958 107.085 26.335 1.00 29.12 H new ATOM 1197 N PRO A 153 37.918 113.153 22.481 1.00 17.67 N ATOM 1198 CA PRO A 153 37.594 114.497 22.983 1.00 17.98 C ATOM 1199 C PRO A 153 38.265 114.903 24.315 1.00 19.01 C ATOM 1200 O PRO A 153 38.702 116.076 24.448 1.00 19.88 O ATOM 1201 CB PRO A 153 36.041 114.493 22.989 1.00 20.67 C ATOM 1202 CG PRO A 153 35.661 113.511 21.918 1.00 19.62 C ATOM 1203 CD PRO A 153 36.715 112.421 22.018 1.00 19.50 C ATOM 0 HA PRO A 153 37.964 115.197 22.422 1.00 17.98 H new ATOM 0 HB2 PRO A 153 35.692 114.225 23.853 1.00 20.67 H new ATOM 0 HB3 PRO A 153 35.685 115.376 22.801 1.00 20.67 H new ATOM 0 HG2 PRO A 153 34.770 113.156 22.063 1.00 19.62 H new ATOM 0 HG3 PRO A 153 35.662 113.925 21.041 1.00 19.62 H new ATOM 0 HD2 PRO A 153 36.455 111.727 22.644 1.00 19.50 H new ATOM 0 HD3 PRO A 153 36.866 111.989 21.163 1.00 19.50 H new ATOM 1204 N SER A 154 38.423 113.990 25.243 1.00 20.28 N ATOM 1205 CA SER A 154 39.050 114.306 26.581 1.00 22.20 C ATOM 1206 C SER A 154 40.536 114.602 26.445 1.00 21.02 C ATOM 1207 O SER A 154 41.131 115.141 27.404 1.00 21.87 O ATOM 1208 CB SER A 154 38.794 113.192 27.588 1.00 21.20 C ATOM 1209 OG SER A 154 39.378 111.940 27.203 1.00 21.28 O ATOM 0 H SER A 154 38.184 113.169 25.151 1.00 20.28 H new ATOM 0 HA SER A 154 38.626 115.110 26.919 1.00 22.20 H new ATOM 0 HB2 SER A 154 39.149 113.456 28.451 1.00 21.20 H new ATOM 0 HB3 SER A 154 37.837 113.076 27.698 1.00 21.20 H new ATOM 0 HG SER A 154 38.850 111.528 26.696 1.00 21.28 H new ATOM 1210 N ASN A 155 41.170 114.241 25.321 1.00 18.95 N ATOM 1211 CA ASN A 155 42.615 114.513 25.055 1.00 18.74 C ATOM 1212 C ASN A 155 42.814 115.739 24.150 1.00 19.70 C ATOM 1213 O ASN A 155 43.910 115.913 23.548 1.00 19.60 O ATOM 1214 CB ASN A 155 43.293 113.245 24.521 1.00 20.74 C ATOM 1215 CG ASN A 155 43.494 112.236 25.625 1.00 25.35 C ATOM 1216 OD1 ASN A 155 43.392 112.601 26.828 1.00 24.67 O ATOM 1217 ND2 ASN A 155 43.804 110.994 25.284 1.00 22.73 N ATOM 0 H ASN A 155 40.778 113.826 24.678 1.00 18.95 H new ATOM 0 HA ASN A 155 43.050 114.745 25.890 1.00 18.74 H new ATOM 0 HB2 ASN A 155 42.751 112.856 23.817 1.00 20.74 H new ATOM 0 HB3 ASN A 155 44.149 113.473 24.126 1.00 20.74 H new ATOM 0 HD21 ASN A 155 43.944 110.403 25.893 1.00 22.73 H new ATOM 0 HD22 ASN A 155 43.865 110.779 24.454 1.00 22.73 H new ATOM 1218 N LEU A 156 41.848 116.641 24.052 1.00 18.35 N ATOM 1219 CA LEU A 156 41.906 117.879 23.233 1.00 18.52 C ATOM 1220 C LEU A 156 41.452 119.052 24.116 1.00 21.40 C ATOM 1221 O LEU A 156 40.296 119.039 24.636 1.00 24.21 O ATOM 1222 CB LEU A 156 41.022 117.726 21.990 1.00 20.00 C ATOM 1223 CG LEU A 156 41.348 116.548 21.071 1.00 19.96 C ATOM 1224 CD1 LEU A 156 40.245 116.370 20.021 1.00 23.27 C ATOM 1225 CD2 LEU A 156 42.666 116.793 20.372 1.00 19.08 C ATOM 0 H LEU A 156 41.103 116.558 24.473 1.00 18.35 H new ATOM 0 HA LEU A 156 42.809 118.047 22.921 1.00 18.52 H new ATOM 0 HB2 LEU A 156 40.100 117.641 22.280 1.00 20.00 H new ATOM 0 HB3 LEU A 156 41.082 118.543 21.471 1.00 20.00 H new ATOM 0 HG LEU A 156 41.408 115.743 21.609 1.00 19.96 H new ATOM 0 HD11 LEU A 156 40.464 115.621 19.445 1.00 23.27 H new ATOM 0 HD12 LEU A 156 39.400 116.200 20.465 1.00 23.27 H new ATOM 0 HD13 LEU A 156 40.173 117.177 19.487 1.00 23.27 H new ATOM 0 HD21 LEU A 156 42.868 116.043 19.791 1.00 19.08 H new ATOM 0 HD22 LEU A 156 42.607 117.604 19.844 1.00 19.08 H new ATOM 0 HD23 LEU A 156 43.370 116.888 21.032 1.00 19.08 H new ATOM 1226 N ALA A 157 42.388 119.934 24.420 1.00 19.42 N ATOM 1227 CA ALA A 157 42.108 121.126 25.272 1.00 19.77 C ATOM 1228 C ALA A 157 41.650 122.264 24.378 1.00 22.42 C ATOM 1229 O ALA A 157 42.247 122.457 23.303 1.00 22.86 O ATOM 1230 CB ALA A 157 43.363 121.538 25.968 1.00 22.40 C ATOM 0 H ALA A 157 43.203 119.877 24.151 1.00 19.42 H new ATOM 0 HA ALA A 157 41.424 120.913 25.926 1.00 19.77 H new ATOM 0 HB1 ALA A 157 43.186 122.313 26.523 1.00 22.40 H new ATOM 0 HB2 ALA A 157 43.680 120.808 26.523 1.00 22.40 H new ATOM 0 HB3 ALA A 157 44.040 121.760 25.310 1.00 22.40 H new ATOM 1231 N VAL A 158 40.625 123.054 24.793 1.00 22.59 N ATOM 1232 CA VAL A 158 40.043 124.131 23.949 1.00 25.29 C ATOM 1233 C VAL A 158 39.804 125.356 24.863 1.00 27.69 C ATOM 1234 O VAL A 158 39.262 125.146 25.946 1.00 30.32 O ATOM 1235 CB VAL A 158 38.758 123.671 23.242 1.00 28.14 C ATOM 1236 CG1 VAL A 158 38.164 124.739 22.348 1.00 30.61 C ATOM 1237 CG2 VAL A 158 39.013 122.398 22.418 1.00 29.01 C ATOM 0 H VAL A 158 40.253 122.979 25.565 1.00 22.59 H new ATOM 0 HA VAL A 158 40.655 124.368 23.235 1.00 25.29 H new ATOM 0 HB VAL A 158 38.115 123.485 23.944 1.00 28.14 H new ATOM 0 HG11 VAL A 158 37.359 124.399 21.928 1.00 30.61 H new ATOM 0 HG12 VAL A 158 37.946 125.521 22.879 1.00 30.61 H new ATOM 0 HG13 VAL A 158 38.807 124.983 21.664 1.00 30.61 H new ATOM 0 HG21 VAL A 158 38.191 122.125 21.981 1.00 29.01 H new ATOM 0 HG22 VAL A 158 39.691 122.576 21.748 1.00 29.01 H new ATOM 0 HG23 VAL A 158 39.318 121.688 23.005 1.00 29.01 H new ATOM 1238 N ASN A 159 40.229 126.532 24.433 1.00 31.30 N ATOM 1239 CA ASN A 159 40.085 127.786 25.258 1.00 33.69 C ATOM 1240 C ASN A 159 38.830 128.554 24.802 1.00 39.35 C ATOM 1241 O ASN A 159 38.057 128.083 23.927 1.00 33.10 O ATOM 1242 CB ASN A 159 41.394 128.567 25.283 1.00 32.70 C ATOM 1243 CG ASN A 159 41.724 129.313 24.012 1.00 30.32 C ATOM 1244 OD1 ASN A 159 40.896 129.421 23.090 1.00 33.74 O ATOM 1245 ND2 ASN A 159 42.951 129.777 23.943 1.00 35.64 N ATOM 0 H ASN A 159 40.607 126.653 23.670 1.00 31.30 H new ATOM 0 HA ASN A 159 39.927 127.583 26.193 1.00 33.69 H new ATOM 0 HB2 ASN A 159 41.360 129.203 26.015 1.00 32.70 H new ATOM 0 HB3 ASN A 159 42.118 127.951 25.476 1.00 32.70 H new ATOM 0 HD21 ASN A 159 43.219 130.181 23.232 1.00 35.64 H new ATOM 0 HD22 ASN A 159 43.487 129.677 24.608 1.00 35.64 H new ATOM 1246 N GLU A 160 38.574 129.702 25.454 1.00 45.50 N ATOM 1247 CA GLU A 160 37.418 130.588 25.183 1.00 43.32 C ATOM 1248 C GLU A 160 37.423 131.052 23.722 1.00 42.66 C ATOM 1249 O GLU A 160 36.338 131.361 23.200 1.00 47.82 O ATOM 1250 CB GLU A 160 37.473 131.789 26.152 1.00 43.64 C ATOM 0 H GLU A 160 39.081 129.996 26.083 1.00 45.50 H new ATOM 0 HA GLU A 160 36.591 130.101 25.327 1.00 43.32 H new ATOM 1251 N ASP A 161 38.591 131.133 23.077 1.00 40.97 N ATOM 1252 CA ASP A 161 38.698 131.588 21.664 1.00 37.44 C ATOM 1253 C ASP A 161 38.680 130.402 20.661 1.00 33.97 C ATOM 1254 O ASP A 161 39.072 130.634 19.499 1.00 34.42 O ATOM 1255 CB ASP A 161 39.957 132.428 21.533 1.00 37.82 C ATOM 1256 CG ASP A 161 39.947 133.669 22.435 1.00 48.61 C ATOM 1257 OD1 ASP A 161 38.879 133.985 23.015 1.00 50.18 O ATOM 1258 OD2 ASP A 161 41.006 134.291 22.564 1.00 54.46 O ATOM 0 H ASP A 161 39.345 130.929 23.436 1.00 40.97 H new ATOM 0 HA ASP A 161 37.923 132.125 21.438 1.00 37.44 H new ATOM 0 HB2 ASP A 161 40.728 131.882 21.752 1.00 37.82 H new ATOM 0 HB3 ASP A 161 40.059 132.707 20.609 1.00 37.82 H new ATOM 1259 N CYS A 162 38.292 129.199 21.087 1.00 34.95 N ATOM 1260 CA CYS A 162 38.135 128.007 20.188 1.00 33.06 C ATOM 1261 C CYS A 162 39.525 127.519 19.722 1.00 30.85 C ATOM 1262 O CYS A 162 39.557 126.733 18.729 1.00 28.33 O ATOM 1263 CB CYS A 162 37.338 128.353 18.942 1.00 34.30 C ATOM 1264 SG CYS A 162 36.386 126.986 18.247 1.00 44.94 S ATOM 0 H CYS A 162 38.107 129.033 21.910 1.00 34.95 H new ATOM 0 HA CYS A 162 37.670 127.323 20.695 1.00 33.06 H new ATOM 0 HB2 CYS A 162 36.730 129.079 19.154 1.00 34.30 H new ATOM 0 HB3 CYS A 162 37.949 128.683 18.264 1.00 34.30 H new ATOM 0 HG CYS A 162 35.796 127.364 17.273 1.00 44.94 H new ATOM 1265 N GLU A 163 40.586 127.938 20.394 1.00 27.13 N ATOM 1266 CA GLU A 163 41.971 127.511 20.111 1.00 26.37 C ATOM 1267 C GLU A 163 42.246 126.165 20.801 1.00 23.84 C ATOM 1268 O GLU A 163 41.878 126.002 21.972 1.00 27.18 O ATOM 1269 CB GLU A 163 42.948 128.583 20.590 1.00 31.33 C ATOM 1270 CG GLU A 163 42.767 129.911 19.862 1.00 35.11 C ATOM 1271 CD GLU A 163 43.758 131.004 20.276 1.00 38.93 C ATOM 1272 OE1 GLU A 163 44.090 131.812 19.423 1.00 48.38 O ATOM 1273 OE2 GLU A 163 44.196 131.019 21.459 1.00 44.30 O ATOM 0 H GLU A 163 40.530 128.494 21.048 1.00 27.13 H new ATOM 0 HA GLU A 163 42.091 127.395 19.155 1.00 26.37 H new ATOM 0 HB2 GLU A 163 42.829 128.722 21.543 1.00 31.33 H new ATOM 0 HB3 GLU A 163 43.856 128.269 20.461 1.00 31.33 H new ATOM 0 HG2 GLU A 163 42.852 129.758 18.908 1.00 35.11 H new ATOM 0 HG3 GLU A 163 41.865 130.232 20.018 1.00 35.11 H new ATOM 1274 N LEU A 164 42.897 125.211 20.087 1.00 23.02 N ATOM 1275 CA LEU A 164 42.945 123.777 20.482 1.00 20.13 C ATOM 1276 C LEU A 164 44.396 123.279 20.588 1.00 17.54 C ATOM 1277 O LEU A 164 45.239 123.649 19.727 1.00 20.05 O ATOM 1278 CB LEU A 164 42.168 122.972 19.417 1.00 19.50 C ATOM 1279 CG LEU A 164 42.157 121.439 19.569 1.00 19.85 C ATOM 1280 CD1 LEU A 164 40.845 120.868 19.023 1.00 21.19 C ATOM 1281 CD2 LEU A 164 43.327 120.782 18.860 1.00 21.13 C ATOM 0 H LEU A 164 43.323 125.381 19.359 1.00 23.02 H new ATOM 0 HA LEU A 164 42.542 123.660 21.357 1.00 20.13 H new ATOM 0 HB2 LEU A 164 41.249 123.281 19.417 1.00 19.50 H new ATOM 0 HB3 LEU A 164 42.540 123.186 18.547 1.00 19.50 H new ATOM 0 HG LEU A 164 42.238 121.245 20.516 1.00 19.85 H new ATOM 0 HD11 LEU A 164 40.846 119.903 19.122 1.00 21.19 H new ATOM 0 HD12 LEU A 164 40.099 121.243 19.516 1.00 21.19 H new ATOM 0 HD13 LEU A 164 40.759 121.096 18.084 1.00 21.19 H new ATOM 0 HD21 LEU A 164 43.281 119.821 18.981 1.00 21.13 H new ATOM 0 HD22 LEU A 164 43.290 120.990 17.913 1.00 21.13 H new ATOM 0 HD23 LEU A 164 44.159 121.115 19.232 1.00 21.13 H new ATOM 1282 N LYS A 165 44.662 122.464 21.577 1.00 18.92 N ATOM 1283 CA LYS A 165 45.935 121.698 21.730 1.00 18.51 C ATOM 1284 C LYS A 165 45.670 120.204 21.921 1.00 19.42 C ATOM 1285 O LYS A 165 44.802 119.763 22.725 1.00 19.59 O ATOM 1286 CB LYS A 165 46.742 122.233 22.923 1.00 23.28 C ATOM 1287 CG LYS A 165 47.357 123.593 22.633 1.00 28.23 C ATOM 1288 CD LYS A 165 48.353 124.011 23.732 1.00 32.20 C ATOM 1289 CE LYS A 165 48.572 125.509 23.773 1.00 36.96 C ATOM 1290 NZ LYS A 165 49.392 125.970 22.633 1.00 42.52 N ATOM 0 H LYS A 165 44.104 122.317 22.215 1.00 18.92 H new ATOM 0 HA LYS A 165 46.446 121.816 20.914 1.00 18.51 H new ATOM 0 HB2 LYS A 165 46.164 122.300 23.699 1.00 23.28 H new ATOM 0 HB3 LYS A 165 47.445 121.602 23.146 1.00 23.28 H new ATOM 0 HG2 LYS A 165 47.811 123.567 21.776 1.00 28.23 H new ATOM 0 HG3 LYS A 165 46.655 124.258 22.562 1.00 28.23 H new ATOM 0 HD2 LYS A 165 48.024 123.711 24.594 1.00 32.20 H new ATOM 0 HD3 LYS A 165 49.202 123.567 23.582 1.00 32.20 H new ATOM 0 HE2 LYS A 165 47.715 125.963 23.760 1.00 36.96 H new ATOM 0 HE3 LYS A 165 49.008 125.750 24.605 1.00 36.96 H new ATOM 0 HZ1 LYS A 165 49.360 126.858 22.584 1.00 42.52 H new ATOM 0 HZ2 LYS A 165 50.235 125.710 22.749 1.00 42.52 H new ATOM 0 HZ3 LYS A 165 49.076 125.620 21.879 1.00 42.52 H new ATOM 1291 N ILE A 166 46.471 119.378 21.235 1.00 17.54 N ATOM 1292 CA ILE A 166 46.496 117.920 21.449 1.00 17.51 C ATOM 1293 C ILE A 166 47.313 117.589 22.712 1.00 18.29 C ATOM 1294 O ILE A 166 48.484 118.016 22.799 1.00 19.68 O ATOM 1295 CB ILE A 166 47.077 117.256 20.176 1.00 17.43 C ATOM 1296 CG1 ILE A 166 46.197 117.489 18.934 1.00 17.91 C ATOM 1297 CG2 ILE A 166 47.316 115.780 20.429 1.00 18.51 C ATOM 1298 CD1 ILE A 166 46.880 117.062 17.572 1.00 17.95 C ATOM 0 H ILE A 166 47.018 119.648 20.629 1.00 17.54 H new ATOM 0 HA ILE A 166 45.603 117.572 21.597 1.00 17.51 H new ATOM 0 HB ILE A 166 47.927 117.680 19.980 1.00 17.43 H new ATOM 0 HG12 ILE A 166 45.369 116.995 19.039 1.00 17.91 H new ATOM 0 HG13 ILE A 166 45.963 118.429 18.887 1.00 17.91 H new ATOM 0 HG21 ILE A 166 47.680 115.369 19.629 1.00 18.51 H new ATOM 0 HG22 ILE A 166 47.944 115.674 21.160 1.00 18.51 H new ATOM 0 HG23 ILE A 166 46.477 115.351 20.660 1.00 18.51 H new ATOM 0 HD11 ILE A 166 46.272 117.236 16.836 1.00 17.95 H new ATOM 0 HD12 ILE A 166 47.695 117.572 17.445 1.00 17.95 H new ATOM 0 HD13 ILE A 166 47.092 116.116 17.599 1.00 17.95 H new ATOM 1299 N LEU A 167 46.799 116.742 23.594 1.00 18.74 N ATOM 1300 CA LEU A 167 47.631 116.238 24.713 1.00 21.08 C ATOM 1301 C LEU A 167 47.524 114.739 24.922 1.00 20.17 C ATOM 1302 O LEU A 167 46.847 114.040 24.132 1.00 20.89 O ATOM 1303 CB LEU A 167 47.259 116.996 25.968 1.00 28.85 C ATOM 1304 CG LEU A 167 45.817 116.761 26.318 1.00 27.08 C ATOM 1305 CD1 LEU A 167 45.574 116.352 27.748 1.00 41.13 C ATOM 1306 CD2 LEU A 167 45.092 118.024 25.974 1.00 32.94 C ATOM 0 H LEU A 167 45.992 116.445 23.576 1.00 18.74 H new ATOM 0 HA LEU A 167 48.561 116.394 24.487 1.00 21.08 H new ATOM 0 HB2 LEU A 167 47.826 116.714 26.703 1.00 28.85 H new ATOM 0 HB3 LEU A 167 47.415 117.944 25.838 1.00 28.85 H new ATOM 0 HG LEU A 167 45.490 116.001 25.812 1.00 27.08 H new ATOM 0 HD11 LEU A 167 44.623 116.221 27.890 1.00 41.13 H new ATOM 0 HD12 LEU A 167 46.045 115.525 27.933 1.00 41.13 H new ATOM 0 HD13 LEU A 167 45.897 117.047 28.343 1.00 41.13 H new ATOM 0 HD21 LEU A 167 44.150 117.924 26.183 1.00 32.94 H new ATOM 0 HD22 LEU A 167 45.460 118.759 26.489 1.00 32.94 H new ATOM 0 HD23 LEU A 167 45.195 118.209 25.027 1.00 32.94 H new ATOM 1307 N ASP A 168 48.182 114.230 25.974 1.00 22.67 N ATOM 1308 CA ASP A 168 48.047 112.840 26.500 1.00 21.35 C ATOM 1309 C ASP A 168 48.346 111.822 25.393 1.00 23.46 C ATOM 1310 O ASP A 168 47.501 110.977 25.087 1.00 23.21 O ATOM 1311 CB ASP A 168 46.685 112.574 27.124 1.00 24.99 C ATOM 1312 CG ASP A 168 46.521 113.097 28.542 1.00 31.81 C ATOM 1313 OD1 ASP A 168 47.473 113.745 29.070 1.00 30.79 O ATOM 1314 OD2 ASP A 168 45.483 112.765 29.144 1.00 32.29 O ATOM 0 H ASP A 168 48.745 114.698 26.425 1.00 22.67 H new ATOM 0 HA ASP A 168 48.699 112.741 27.211 1.00 21.35 H new ATOM 0 HB2 ASP A 168 46.002 112.975 26.564 1.00 24.99 H new ATOM 0 HB3 ASP A 168 46.525 111.617 27.125 1.00 24.99 H new ATOM 1315 N PHE A 169 49.523 111.924 24.814 1.00 22.23 N ATOM 1316 CA PHE A 169 50.014 110.984 23.792 1.00 23.34 C ATOM 1317 C PHE A 169 49.922 109.572 24.382 1.00 27.02 C ATOM 1318 O PHE A 169 50.151 109.376 25.618 1.00 25.68 O ATOM 1319 CB PHE A 169 51.479 111.308 23.465 1.00 22.83 C ATOM 1320 CG PHE A 169 51.628 112.492 22.551 1.00 24.44 C ATOM 1321 CD1 PHE A 169 51.432 113.792 22.992 1.00 26.06 C ATOM 1322 CD2 PHE A 169 51.902 112.284 21.216 1.00 20.85 C ATOM 1323 CE1 PHE A 169 51.463 114.842 22.084 1.00 27.27 C ATOM 1324 CE2 PHE A 169 51.998 113.309 20.328 1.00 23.44 C ATOM 1325 CZ PHE A 169 51.791 114.607 20.767 1.00 26.42 C ATOM 0 H PHE A 169 50.082 112.551 24.999 1.00 22.23 H new ATOM 0 HA PHE A 169 49.488 111.051 22.980 1.00 23.34 H new ATOM 0 HB2 PHE A 169 51.959 111.480 24.290 1.00 22.83 H new ATOM 0 HB3 PHE A 169 51.892 110.533 23.053 1.00 22.83 H new ATOM 0 HD1 PHE A 169 51.280 113.960 23.894 1.00 26.06 H new ATOM 0 HD2 PHE A 169 52.025 111.414 20.913 1.00 20.85 H new ATOM 0 HE1 PHE A 169 51.262 115.705 22.365 1.00 27.27 H new ATOM 0 HE2 PHE A 169 52.200 113.141 19.436 1.00 23.44 H new ATOM 0 HZ PHE A 169 51.873 115.318 20.173 1.00 26.42 H new ATOM 1326 N GLY A 170 49.664 108.577 23.537 1.00 23.80 N ATOM 1327 CA GLY A 170 49.708 107.166 23.982 1.00 30.43 C ATOM 1328 C GLY A 170 51.142 106.735 24.234 1.00 33.70 C ATOM 1329 O GLY A 170 51.987 106.748 23.283 1.00 36.86 O ATOM 0 H GLY A 170 49.462 108.686 22.708 1.00 23.80 H new ATOM 0 HA2 GLY A 170 49.185 107.060 24.792 1.00 30.43 H new ATOM 0 HA3 GLY A 170 49.306 106.596 23.308 1.00 30.43 H new ATOM 1330 N LEU A 171 51.450 106.386 25.483 0.44 36.25 N ATOM 1331 CA LEU A 171 52.796 105.903 25.893 0.44 42.53 C ATOM 1332 C LEU A 171 52.752 104.376 26.034 0.44 48.94 C ATOM 1333 O LEU A 171 53.604 103.830 26.770 0.44 56.30 O ATOM 1334 CB LEU A 171 53.190 106.601 27.196 0.44 45.05 C ATOM 1335 CG LEU A 171 52.993 108.116 27.198 0.44 45.03 C ATOM 1336 CD1 LEU A 171 53.238 108.696 28.582 0.44 46.11 C ATOM 1337 CD2 LEU A 171 53.886 108.791 26.167 0.44 44.69 C ATOM 0 H LEU A 171 50.885 106.419 26.131 0.44 36.25 H new ATOM 0 HA LEU A 171 53.469 106.116 25.228 0.44 42.53 H new ATOM 0 HB2 LEU A 171 52.672 106.219 27.922 0.44 45.05 H new ATOM 0 HB3 LEU A 171 54.122 106.409 27.382 0.44 45.05 H new ATOM 0 HG LEU A 171 52.071 108.291 26.955 0.44 45.03 H new ATOM 0 HD11 LEU A 171 53.107 109.657 28.558 0.44 46.11 H new ATOM 0 HD12 LEU A 171 52.616 108.301 29.213 0.44 46.11 H new ATOM 0 HD13 LEU A 171 54.147 108.501 28.859 0.44 46.11 H new ATOM 0 HD21 LEU A 171 53.740 109.750 26.190 0.44 44.69 H new ATOM 0 HD22 LEU A 171 54.815 108.601 26.369 0.44 44.69 H new ATOM 0 HD23 LEU A 171 53.672 108.453 25.283 0.44 44.69 H new ATOM 1338 N ALA A 172 51.830 103.736 25.294 0.44 53.08 N ATOM 1339 CA ALA A 172 51.567 102.276 25.240 0.44 56.34 C ATOM 1340 C ALA A 172 51.171 101.784 26.637 0.44 57.09 C ATOM 1341 O ALA A 172 51.790 100.824 27.129 0.44 59.16 O ATOM 1342 CB ALA A 172 52.767 101.543 24.683 0.44 55.83 C ATOM 0 H ALA A 172 51.303 104.172 24.772 0.44 53.08 H new ATOM 0 HA ALA A 172 50.828 102.091 24.639 0.44 56.34 H new ATOM 0 HB1 ALA A 172 52.580 100.592 24.654 0.44 55.83 H new ATOM 0 HB2 ALA A 172 52.954 101.863 23.787 0.44 55.83 H new ATOM 0 HB3 ALA A 172 53.537 101.704 25.251 0.44 55.83 H new ATOM 1343 N ARG A 173 50.147 102.412 27.226 0.44 59.76 N ATOM 1344 CA ARG A 173 49.821 102.350 28.680 0.44 60.64 C ATOM 1345 C ARG A 173 48.474 101.655 28.950 0.44 60.94 C ATOM 1346 O ARG A 173 48.253 101.280 30.120 0.44 58.06 O ATOM 1347 CB ARG A 173 49.766 103.789 29.220 0.44 59.48 C ATOM 0 H ARG A 173 49.598 102.905 26.784 0.44 59.76 H new ATOM 0 HA ARG A 173 50.507 101.829 29.125 0.44 60.64 H new ATOM 1348 N HIS A 174 47.592 101.515 27.948 0.44 63.19 N ATOM 1349 CA HIS A 174 46.176 101.092 28.149 0.44 61.73 C ATOM 1350 C HIS A 174 46.081 99.574 28.343 0.44 59.13 C ATOM 1351 O HIS A 174 46.669 98.820 27.542 0.44 62.29 O ATOM 1352 CB HIS A 174 45.262 101.605 27.024 0.44 62.04 C ATOM 1353 CG HIS A 174 44.856 103.027 27.219 0.44 61.55 C ATOM 1354 ND1 HIS A 174 44.046 103.606 28.134 0.44 59.43 N flip ATOM 1355 CD2 HIS A 174 45.341 104.048 26.428 0.44 61.98 C flip ATOM 1356 CE1 HIS A 174 44.034 104.951 27.882 0.44 59.01 C flip ATOM 1357 NE2 HIS A 174 44.834 105.193 26.837 0.44 60.29 N flip ATOM 0 H HIS A 174 47.792 101.662 27.125 0.44 63.19 H new ATOM 0 HA HIS A 174 45.853 101.503 28.966 0.44 61.73 H new ATOM 0 HB2 HIS A 174 45.720 101.517 26.174 0.44 62.04 H new ATOM 0 HB3 HIS A 174 44.469 101.049 26.978 0.44 62.04 H new ATOM 0 HD2 HIS A 174 45.933 103.944 25.718 0.44 61.98 H new ATOM 0 HE1 HIS A 174 43.552 105.589 28.357 0.44 59.01 H new ATOM 0 HE2 HIS A 174 44.991 105.965 26.491 0.44 60.29 H new ATOM 1358 N THR A 175 45.337 99.163 29.374 0.44 56.07 N ATOM 1359 CA THR A 175 45.155 97.751 29.805 0.44 54.60 C ATOM 1360 C THR A 175 43.909 97.170 29.121 0.44 52.35 C ATOM 1361 O THR A 175 43.128 97.954 28.539 0.44 50.96 O ATOM 1362 CB THR A 175 45.109 97.675 31.337 0.44 55.01 C ATOM 1363 OG1 THR A 175 45.431 96.340 31.726 0.44 63.06 O ATOM 1364 CG2 THR A 175 43.773 98.071 31.928 0.44 54.05 C ATOM 0 H THR A 175 44.902 99.716 29.869 0.44 56.07 H new ATOM 0 HA THR A 175 45.908 97.205 29.529 0.44 54.60 H new ATOM 0 HB THR A 175 45.752 98.315 31.681 0.44 55.01 H new ATOM 0 HG1 THR A 175 45.412 96.280 32.564 0.44 63.06 H new ATOM 0 HG21 THR A 175 43.813 98.001 32.895 0.44 54.05 H new ATOM 0 HG22 THR A 175 43.567 98.986 31.679 0.44 54.05 H new ATOM 0 HG23 THR A 175 43.082 97.481 31.590 0.44 54.05 H new ATOM 1365 N ASP A 176 43.741 95.843 29.188 0.44 53.22 N ATOM 1366 CA ASP A 176 42.589 95.103 28.601 0.44 51.60 C ATOM 1367 C ASP A 176 41.294 95.550 29.291 0.44 50.26 C ATOM 1368 O ASP A 176 40.294 95.774 28.568 0.44 49.13 O ATOM 1369 CB ASP A 176 42.785 93.583 28.695 0.44 52.89 C ATOM 1370 CG ASP A 176 43.820 93.014 27.731 0.44 55.50 C ATOM 1371 OD1 ASP A 176 44.072 93.651 26.684 0.44 55.48 O ATOM 1372 OD2 ASP A 176 44.360 91.922 28.025 0.44 57.03 O ATOM 0 H ASP A 176 44.304 95.327 29.584 0.44 53.22 H new ATOM 0 HA ASP A 176 42.530 95.314 27.656 0.44 51.60 H new ATOM 0 HB2 ASP A 176 43.047 93.358 29.601 0.44 52.89 H new ATOM 0 HB3 ASP A 176 41.934 93.148 28.530 0.44 52.89 H new ATOM 1373 N ASP A 177 41.317 95.686 30.623 0.44 45.34 N ATOM 1374 CA ASP A 177 40.156 96.106 31.459 0.44 45.61 C ATOM 1375 C ASP A 177 39.694 97.512 31.051 0.44 44.18 C ATOM 1376 O ASP A 177 38.465 97.735 30.994 0.44 45.02 O ATOM 1377 CB ASP A 177 40.486 96.080 32.955 0.44 46.97 C ATOM 0 H ASP A 177 42.025 95.534 31.087 0.44 45.34 H new ATOM 0 HA ASP A 177 39.441 95.469 31.304 0.44 45.61 H new ATOM 1378 N GLU A 178 40.635 98.420 30.761 0.44 39.48 N ATOM 1379 CA GLU A 178 40.340 99.832 30.386 0.44 37.78 C ATOM 1380 C GLU A 178 39.570 99.863 29.057 0.44 33.96 C ATOM 1381 O GLU A 178 38.734 100.780 28.897 0.44 35.61 O ATOM 1382 CB GLU A 178 41.627 100.660 30.296 0.44 40.52 C ATOM 1383 CG GLU A 178 42.098 101.187 31.641 0.44 44.87 C ATOM 1384 CD GLU A 178 43.523 101.721 31.671 0.44 47.41 C ATOM 1385 OE1 GLU A 178 44.307 101.394 30.745 0.44 47.42 O ATOM 1386 OE2 GLU A 178 43.846 102.471 32.623 0.44 50.35 O ATOM 0 H GLU A 178 41.476 98.240 30.774 0.44 39.48 H new ATOM 0 HA GLU A 178 39.788 100.230 31.077 0.44 37.78 H new ATOM 0 HB2 GLU A 178 42.328 100.115 29.906 0.44 40.52 H new ATOM 0 HB3 GLU A 178 41.482 101.408 29.696 0.44 40.52 H new ATOM 0 HG2 GLU A 178 41.498 101.895 31.922 0.44 44.87 H new ATOM 0 HG3 GLU A 178 42.022 100.475 32.295 0.44 44.87 H new ATOM 1387 N MET A 179 39.830 98.905 28.158 1.00 29.43 N ATOM 1388 CA MET A 179 39.197 98.860 26.802 1.00 27.22 C ATOM 1389 C MET A 179 37.913 98.018 26.771 1.00 24.77 C ATOM 1390 O MET A 179 37.381 97.741 25.653 1.00 23.56 O ATOM 1391 CB MET A 179 40.187 98.292 25.791 1.00 31.95 C ATOM 1392 CG MET A 179 41.338 99.211 25.519 1.00 36.84 C ATOM 1393 SD MET A 179 40.765 100.669 24.584 1.00 40.26 S ATOM 1394 CE MET A 179 42.329 101.561 24.596 1.00 40.64 C ATOM 0 H MET A 179 40.377 98.258 28.306 1.00 29.43 H new ATOM 0 HA MET A 179 38.955 99.771 26.574 1.00 27.22 H new ATOM 0 HB2 MET A 179 40.527 97.445 26.119 1.00 31.95 H new ATOM 0 HB3 MET A 179 39.723 98.108 24.959 1.00 31.95 H new ATOM 0 HG2 MET A 179 41.742 99.492 26.355 1.00 36.84 H new ATOM 0 HG3 MET A 179 42.023 98.743 25.016 1.00 36.84 H new ATOM 0 HE1 MET A 179 42.181 102.477 24.314 1.00 40.64 H new ATOM 0 HE2 MET A 179 42.698 101.555 25.493 1.00 40.64 H new ATOM 0 HE3 MET A 179 42.951 101.132 23.988 1.00 40.64 H new ATOM 1395 N THR A 180 37.456 97.464 27.896 1.00 22.81 N ATOM 1396 CA THR A 180 36.322 96.505 27.958 1.00 21.80 C ATOM 1397 C THR A 180 34.976 97.218 28.103 1.00 20.50 C ATOM 1398 O THR A 180 34.810 98.029 29.055 1.00 21.26 O ATOM 1399 CB THR A 180 36.525 95.501 29.131 1.00 26.04 C ATOM 1400 OG1 THR A 180 37.746 94.794 28.892 1.00 28.97 O ATOM 1401 CG2 THR A 180 35.397 94.511 29.256 1.00 24.56 C ATOM 0 H THR A 180 37.798 97.633 28.667 1.00 22.81 H new ATOM 0 HA THR A 180 36.308 96.019 27.118 1.00 21.80 H new ATOM 0 HB THR A 180 36.551 96.003 29.961 1.00 26.04 H new ATOM 0 HG1 THR A 180 38.393 95.328 28.940 1.00 28.97 H new ATOM 0 HG21 THR A 180 35.573 93.912 29.998 1.00 24.56 H new ATOM 0 HG22 THR A 180 34.566 94.985 29.414 1.00 24.56 H new ATOM 0 HG23 THR A 180 35.325 93.997 28.436 1.00 24.56 H new ATOM 1402 N GLY A 181 33.973 96.817 27.305 1.00 20.40 N ATOM 1403 CA GLY A 181 32.565 97.193 27.494 1.00 20.01 C ATOM 1404 C GLY A 181 32.152 98.540 26.922 1.00 20.56 C ATOM 1405 O GLY A 181 32.681 98.953 25.870 1.00 19.68 O ATOM 0 H GLY A 181 34.098 96.307 26.624 1.00 20.40 H new ATOM 0 HA2 GLY A 181 32.009 96.507 27.093 1.00 20.01 H new ATOM 0 HA3 GLY A 181 32.374 97.193 28.445 1.00 20.01 H new ATOM 1406 N TYR A 182 31.184 99.232 27.558 1.00 20.21 N ATOM 1407 CA TYR A 182 30.594 100.491 27.017 1.00 20.41 C ATOM 1408 C TYR A 182 31.465 101.649 27.489 1.00 21.05 C ATOM 1409 O TYR A 182 31.139 102.325 28.489 1.00 22.42 O ATOM 1410 CB TYR A 182 29.120 100.568 27.421 1.00 21.47 C ATOM 1411 CG TYR A 182 28.330 101.685 26.777 1.00 21.37 C ATOM 1412 CD1 TYR A 182 27.981 101.687 25.434 1.00 19.78 C ATOM 1413 CD2 TYR A 182 27.898 102.753 27.545 1.00 21.51 C ATOM 1414 CE1 TYR A 182 27.290 102.758 24.850 1.00 20.42 C ATOM 1415 CE2 TYR A 182 27.167 103.798 26.990 1.00 23.59 C ATOM 1416 CZ TYR A 182 26.819 103.773 25.650 1.00 22.90 C ATOM 1417 OH TYR A 182 26.082 104.778 25.060 1.00 24.35 O ATOM 0 H TYR A 182 30.850 98.989 28.312 1.00 20.21 H new ATOM 0 HA TYR A 182 30.590 100.526 26.048 1.00 20.41 H new ATOM 0 HB2 TYR A 182 28.696 99.724 27.202 1.00 21.47 H new ATOM 0 HB3 TYR A 182 29.069 100.670 28.384 1.00 21.47 H new ATOM 0 HD1 TYR A 182 28.212 100.957 24.906 1.00 19.78 H new ATOM 0 HD2 TYR A 182 28.101 102.772 28.452 1.00 21.51 H new ATOM 0 HE1 TYR A 182 27.151 102.782 23.931 1.00 20.42 H new ATOM 0 HE2 TYR A 182 26.911 104.517 27.521 1.00 23.59 H new ATOM 0 HH TYR A 182 25.727 105.252 25.656 1.00 24.35 H new ATOM 1418 N VAL A 183 32.582 101.884 26.795 1.00 19.09 N ATOM 1419 CA VAL A 183 33.657 102.792 27.263 1.00 20.29 C ATOM 1420 C VAL A 183 34.199 103.701 26.152 1.00 21.21 C ATOM 1421 O VAL A 183 34.607 103.228 25.058 1.00 20.98 O ATOM 1422 CB VAL A 183 34.786 102.039 27.976 1.00 23.84 C ATOM 1423 CG1 VAL A 183 34.302 101.517 29.320 1.00 26.16 C ATOM 1424 CG2 VAL A 183 35.452 100.943 27.120 1.00 23.13 C ATOM 0 H VAL A 183 32.745 101.522 26.032 1.00 19.09 H new ATOM 0 HA VAL A 183 33.241 103.374 27.918 1.00 20.29 H new ATOM 0 HB VAL A 183 35.496 102.681 28.132 1.00 23.84 H new ATOM 0 HG11 VAL A 183 35.024 101.043 29.762 1.00 26.16 H new ATOM 0 HG12 VAL A 183 34.018 102.261 29.873 1.00 26.16 H new ATOM 0 HG13 VAL A 183 33.555 100.913 29.183 1.00 26.16 H new ATOM 0 HG21 VAL A 183 36.153 100.512 27.634 1.00 23.13 H new ATOM 0 HG22 VAL A 183 34.788 100.284 26.864 1.00 23.13 H new ATOM 0 HG23 VAL A 183 35.835 101.342 26.323 1.00 23.13 H new ATOM 1425 N ALA A 184 34.248 105.017 26.460 1.00 22.75 N ATOM 1426 CA ALA A 184 34.813 106.018 25.518 1.00 21.62 C ATOM 1427 C ALA A 184 36.263 105.764 25.178 1.00 24.47 C ATOM 1428 O ALA A 184 36.692 106.246 24.103 1.00 28.32 O ATOM 1429 CB ALA A 184 34.605 107.428 26.066 1.00 22.82 C ATOM 0 H ALA A 184 33.963 105.348 27.201 1.00 22.75 H new ATOM 0 HA ALA A 184 34.330 105.929 24.682 1.00 21.62 H new ATOM 0 HB1 ALA A 184 34.976 108.075 25.446 1.00 22.82 H new ATOM 0 HB2 ALA A 184 33.656 107.595 26.177 1.00 22.82 H new ATOM 0 HB3 ALA A 184 35.050 107.511 26.924 1.00 22.82 H new ATOM 1430 N THR A 185 37.020 105.049 26.030 1.00 22.48 N ATOM 1431 CA THR A 185 38.432 104.666 25.785 1.00 26.43 C ATOM 1432 C THR A 185 38.573 103.840 24.498 1.00 28.20 C ATOM 1433 O THR A 185 39.722 103.756 24.038 1.00 34.17 O ATOM 1434 CB THR A 185 38.993 103.850 26.965 1.00 32.35 C ATOM 1435 OG1 THR A 185 38.081 102.779 27.247 1.00 34.43 O ATOM 1436 CG2 THR A 185 39.181 104.711 28.207 1.00 38.18 C ATOM 0 H THR A 185 36.721 104.766 26.785 1.00 22.48 H new ATOM 0 HA THR A 185 38.936 105.489 25.690 1.00 26.43 H new ATOM 0 HB THR A 185 39.865 103.503 26.720 1.00 32.35 H new ATOM 0 HG1 THR A 185 38.435 102.245 27.790 1.00 34.43 H new ATOM 0 HG21 THR A 185 39.534 104.167 28.928 1.00 38.18 H new ATOM 0 HG22 THR A 185 39.802 105.430 28.011 1.00 38.18 H new ATOM 0 HG23 THR A 185 38.327 105.085 28.474 1.00 38.18 H new ATOM 1437 N ARG A 186 37.499 103.202 23.952 1.00 18.81 N ATOM 1438 CA ARG A 186 37.590 102.375 22.728 1.00 16.68 C ATOM 1439 C ARG A 186 36.798 102.958 21.542 1.00 17.93 C ATOM 1440 O ARG A 186 37.126 102.601 20.384 1.00 17.06 O ATOM 1441 CB ARG A 186 37.092 100.934 22.970 1.00 16.50 C ATOM 1442 CG ARG A 186 37.494 99.869 21.966 1.00 18.39 C ATOM 1443 CD ARG A 186 36.870 98.491 22.218 1.00 18.22 C ATOM 1444 NE ARG A 186 35.430 98.610 22.106 1.00 17.86 N ATOM 1445 CZ ARG A 186 34.525 98.655 23.090 1.00 17.11 C ATOM 1446 NH1 ARG A 186 34.828 98.172 24.291 1.00 18.48 N ATOM 1447 NH2 ARG A 186 33.288 99.057 22.817 1.00 17.11 N ATOM 0 H ARG A 186 36.707 103.242 24.285 1.00 18.81 H new ATOM 0 HA ARG A 186 38.534 102.371 22.503 1.00 16.68 H new ATOM 0 HB2 ARG A 186 37.405 100.653 23.844 1.00 16.50 H new ATOM 0 HB3 ARG A 186 36.123 100.956 23.009 1.00 16.50 H new ATOM 0 HG2 ARG A 186 37.244 100.167 21.077 1.00 18.39 H new ATOM 0 HG3 ARG A 186 38.460 99.781 21.974 1.00 18.39 H new ATOM 0 HD2 ARG A 186 37.206 97.846 21.576 1.00 18.22 H new ATOM 0 HD3 ARG A 186 37.114 98.167 23.099 1.00 18.22 H new ATOM 0 HE ARG A 186 35.118 98.658 21.306 1.00 17.86 H new ATOM 0 HH11 ARG A 186 35.605 97.831 24.434 1.00 18.48 H new ATOM 0 HH12 ARG A 186 34.247 98.200 24.925 1.00 18.48 H new ATOM 0 HH21 ARG A 186 33.077 99.285 22.015 1.00 17.11 H new ATOM 0 HH22 ARG A 186 32.699 99.090 23.442 1.00 17.11 H new ATOM 1448 N TRP A 187 35.832 103.853 21.776 1.00 18.01 N ATOM 1449 CA TRP A 187 34.923 104.292 20.688 1.00 15.33 C ATOM 1450 C TRP A 187 35.609 105.062 19.554 1.00 15.73 C ATOM 1451 O TRP A 187 35.010 105.095 18.446 1.00 16.33 O ATOM 1452 CB TRP A 187 33.797 105.174 21.262 1.00 16.47 C ATOM 1453 CG TRP A 187 32.863 104.520 22.234 1.00 15.81 C ATOM 1454 CD1 TRP A 187 32.620 103.178 22.348 1.00 16.48 C ATOM 1455 CD2 TRP A 187 32.080 105.171 23.274 1.00 16.11 C ATOM 1456 NE1 TRP A 187 31.698 102.946 23.355 1.00 16.58 N ATOM 1457 CE2 TRP A 187 31.366 104.139 23.928 1.00 16.59 C ATOM 1458 CE3 TRP A 187 31.879 106.489 23.651 1.00 17.78 C ATOM 1459 CZ2 TRP A 187 30.440 104.409 24.965 1.00 18.86 C ATOM 1460 CZ3 TRP A 187 31.014 106.766 24.693 1.00 19.98 C ATOM 1461 CH2 TRP A 187 30.319 105.728 25.333 1.00 20.75 C ATOM 0 H TRP A 187 35.682 104.217 22.541 1.00 18.01 H new ATOM 0 HA TRP A 187 34.576 103.472 20.303 1.00 15.33 H new ATOM 0 HB2 TRP A 187 34.204 105.938 21.699 1.00 16.47 H new ATOM 0 HB3 TRP A 187 33.273 105.517 20.521 1.00 16.47 H new ATOM 0 HD1 TRP A 187 33.016 102.518 21.826 1.00 16.48 H new ATOM 0 HE1 TRP A 187 31.386 102.177 23.582 1.00 16.58 H new ATOM 0 HE3 TRP A 187 32.320 107.178 23.209 1.00 17.78 H new ATOM 0 HZ2 TRP A 187 29.944 103.735 25.372 1.00 18.86 H new ATOM 0 HZ3 TRP A 187 30.892 107.645 24.972 1.00 19.98 H new ATOM 0 HH2 TRP A 187 29.751 105.942 26.038 1.00 20.75 H new ATOM 1462 N TYR A 188 36.808 105.600 19.750 1.00 15.54 N ATOM 1463 CA TYR A 188 37.518 106.401 18.727 1.00 16.15 C ATOM 1464 C TYR A 188 38.660 105.589 18.073 1.00 18.36 C ATOM 1465 O TYR A 188 39.356 106.161 17.200 1.00 17.12 O ATOM 1466 CB TYR A 188 38.026 107.705 19.398 1.00 16.28 C ATOM 1467 CG TYR A 188 36.920 108.506 20.053 1.00 14.83 C ATOM 1468 CD1 TYR A 188 36.529 108.259 21.360 1.00 16.09 C ATOM 1469 CD2 TYR A 188 36.196 109.469 19.383 1.00 15.43 C ATOM 1470 CE1 TYR A 188 35.422 108.845 21.959 1.00 15.51 C ATOM 1471 CE2 TYR A 188 35.075 110.077 19.949 1.00 16.65 C ATOM 1472 CZ TYR A 188 34.674 109.757 21.239 1.00 15.58 C ATOM 1473 OH TYR A 188 33.603 110.383 21.866 1.00 19.08 O ATOM 0 H TYR A 188 37.246 105.515 20.485 1.00 15.54 H new ATOM 0 HA TYR A 188 36.914 106.634 18.005 1.00 16.15 H new ATOM 0 HB2 TYR A 188 38.694 107.480 20.065 1.00 16.28 H new ATOM 0 HB3 TYR A 188 38.465 108.256 18.731 1.00 16.28 H new ATOM 0 HD1 TYR A 188 37.038 107.666 21.865 1.00 16.09 H new ATOM 0 HD2 TYR A 188 36.463 109.721 18.528 1.00 15.43 H new ATOM 0 HE1 TYR A 188 35.187 108.627 22.832 1.00 15.51 H new ATOM 0 HE2 TYR A 188 34.592 110.702 19.458 1.00 16.65 H new ATOM 0 HH TYR A 188 33.019 110.578 21.295 1.00 19.08 H new ATOM 1474 N ARG A 189 38.850 104.317 18.443 0.44 19.33 N ATOM 1475 CA ARG A 189 40.011 103.514 17.955 0.44 19.77 C ATOM 1476 C ARG A 189 39.706 102.895 16.580 0.44 18.82 C ATOM 1477 O ARG A 189 38.581 102.390 16.364 0.44 20.15 O ATOM 1478 CB ARG A 189 40.383 102.452 18.998 0.44 23.26 C ATOM 1479 CG ARG A 189 40.817 103.069 20.319 0.44 26.60 C ATOM 1480 CD ARG A 189 41.291 102.071 21.346 0.44 32.53 C ATOM 1481 NE ARG A 189 42.675 101.653 21.135 0.44 37.30 N ATOM 1482 CZ ARG A 189 43.755 102.364 21.471 0.44 37.36 C ATOM 1483 NH1 ARG A 189 43.640 103.558 22.037 0.44 39.30 N ATOM 1484 NH2 ARG A 189 44.952 101.874 21.228 0.44 37.96 N ATOM 0 H ARG A 189 38.325 103.891 18.975 0.44 19.33 H new ATOM 0 HA ARG A 189 40.778 104.096 17.837 0.44 19.77 H new ATOM 0 HB2 ARG A 189 39.622 101.870 19.150 0.44 23.26 H new ATOM 0 HB3 ARG A 189 41.100 101.898 18.651 0.44 23.26 H new ATOM 0 HG2 ARG A 189 41.530 103.704 20.148 0.44 26.60 H new ATOM 0 HG3 ARG A 189 40.073 103.570 20.689 0.44 26.60 H new ATOM 0 HD2 ARG A 189 41.206 102.459 22.231 0.44 32.53 H new ATOM 0 HD3 ARG A 189 40.715 101.291 21.322 0.44 32.53 H new ATOM 0 HE ARG A 189 42.805 100.888 20.765 0.44 37.30 H new ATOM 0 HH11 ARG A 189 42.861 103.886 22.193 0.44 39.30 H new ATOM 0 HH12 ARG A 189 44.345 104.004 22.248 0.44 39.30 H new ATOM 0 HH21 ARG A 189 45.034 101.103 20.856 0.44 37.96 H new ATOM 0 HH22 ARG A 189 45.653 102.325 21.441 0.44 37.96 H new ATOM 1485 N ALA A 190 40.705 102.889 15.680 1.00 18.60 N ATOM 1486 CA ALA A 190 40.574 102.243 14.358 1.00 20.07 C ATOM 1487 C ALA A 190 40.373 100.735 14.517 1.00 20.11 C ATOM 1488 O ALA A 190 40.933 100.150 15.476 1.00 22.09 O ATOM 1489 CB ALA A 190 41.817 102.534 13.515 1.00 22.61 C ATOM 0 H ALA A 190 41.471 103.256 15.817 1.00 18.60 H new ATOM 0 HA ALA A 190 39.796 102.605 13.905 1.00 20.07 H new ATOM 0 HB1 ALA A 190 41.727 102.108 12.648 1.00 22.61 H new ATOM 0 HB2 ALA A 190 41.911 103.492 13.396 1.00 22.61 H new ATOM 0 HB3 ALA A 190 42.602 102.186 13.966 1.00 22.61 H new ATOM 1490 N PRO A 191 39.601 100.079 13.653 1.00 21.38 N ATOM 1491 CA PRO A 191 39.264 98.667 13.825 1.00 21.90 C ATOM 1492 C PRO A 191 40.533 97.780 13.775 1.00 22.28 C ATOM 1493 O PRO A 191 40.620 96.793 14.569 1.00 23.54 O ATOM 1494 CB PRO A 191 38.285 98.335 12.689 1.00 24.91 C ATOM 1495 CG PRO A 191 38.337 99.521 11.754 1.00 25.21 C ATOM 1496 CD PRO A 191 38.854 100.693 12.521 1.00 22.28 C ATOM 0 HA PRO A 191 38.863 98.495 14.691 1.00 21.90 H new ATOM 0 HB2 PRO A 191 38.543 97.519 12.233 1.00 24.91 H new ATOM 0 HB3 PRO A 191 37.387 98.198 13.030 1.00 24.91 H new ATOM 0 HG2 PRO A 191 38.913 99.331 10.997 1.00 25.21 H new ATOM 0 HG3 PRO A 191 37.455 99.711 11.398 1.00 25.21 H new ATOM 0 HD2 PRO A 191 39.431 101.249 11.974 1.00 22.28 H new ATOM 0 HD3 PRO A 191 38.132 101.258 12.837 1.00 22.28 H new ATOM 1497 N GLU A 192 41.521 98.141 12.971 1.00 21.90 N ATOM 1498 CA GLU A 192 42.757 97.299 12.872 1.00 23.91 C ATOM 1499 C GLU A 192 43.523 97.305 14.201 1.00 27.39 C ATOM 1500 O GLU A 192 44.254 96.279 14.479 1.00 25.91 O ATOM 1501 CB GLU A 192 43.662 97.708 11.688 1.00 23.53 C ATOM 1502 CG GLU A 192 44.295 99.093 11.793 1.00 24.01 C ATOM 1503 CD GLU A 192 43.484 100.268 11.216 1.00 20.88 C ATOM 1504 OE1 GLU A 192 42.246 100.086 11.024 1.00 22.37 O ATOM 1505 OE2 GLU A 192 44.130 101.316 10.985 1.00 22.27 O ATOM 0 H GLU A 192 41.519 98.846 12.478 1.00 21.90 H new ATOM 0 HA GLU A 192 42.472 96.390 12.690 1.00 23.91 H new ATOM 0 HB2 GLU A 192 44.371 97.051 11.601 1.00 23.53 H new ATOM 0 HB3 GLU A 192 43.138 97.670 10.873 1.00 23.53 H new ATOM 0 HG2 GLU A 192 44.470 99.276 12.729 1.00 24.01 H new ATOM 0 HG3 GLU A 192 45.154 99.068 11.344 1.00 24.01 H new ATOM 1506 N ILE A 193 43.484 98.350 15.029 1.00 22.65 N ATOM 1507 CA ILE A 193 44.187 98.309 16.341 1.00 24.71 C ATOM 1508 C ILE A 193 43.231 97.700 17.377 1.00 26.07 C ATOM 1509 O ILE A 193 43.679 96.933 18.263 1.00 26.57 O ATOM 1510 CB ILE A 193 44.845 99.654 16.719 1.00 30.63 C ATOM 1511 CG1 ILE A 193 45.712 99.536 17.975 1.00 37.64 C ATOM 1512 CG2 ILE A 193 43.865 100.797 16.816 1.00 35.00 C ATOM 1513 CD1 ILE A 193 46.603 100.775 18.202 1.00 46.26 C ATOM 0 H ILE A 193 43.068 99.084 14.865 1.00 22.65 H new ATOM 0 HA ILE A 193 44.962 97.727 16.297 1.00 24.71 H new ATOM 0 HB ILE A 193 45.433 99.874 15.980 1.00 30.63 H new ATOM 0 HG12 ILE A 193 45.140 99.408 18.748 1.00 37.64 H new ATOM 0 HG13 ILE A 193 46.273 98.748 17.904 1.00 37.64 H new ATOM 0 HG21 ILE A 193 44.338 101.609 17.055 1.00 35.00 H new ATOM 0 HG22 ILE A 193 43.425 100.920 15.960 1.00 35.00 H new ATOM 0 HG23 ILE A 193 43.201 100.598 17.495 1.00 35.00 H new ATOM 0 HD11 ILE A 193 47.130 100.651 19.007 1.00 46.26 H new ATOM 0 HD12 ILE A 193 47.195 100.892 17.443 1.00 46.26 H new ATOM 0 HD13 ILE A 193 46.044 101.562 18.300 1.00 46.26 H new ATOM 1514 N MET A 194 41.937 97.969 17.313 1.00 23.81 N ATOM 1515 CA MET A 194 40.975 97.458 18.325 1.00 23.63 C ATOM 1516 C MET A 194 41.033 95.905 18.340 1.00 24.75 C ATOM 1517 O MET A 194 40.930 95.291 19.434 1.00 24.60 O ATOM 1518 CB MET A 194 39.553 97.923 17.925 1.00 26.83 C ATOM 1519 CG MET A 194 38.496 97.444 18.830 1.00 25.40 C ATOM 1520 SD MET A 194 36.862 98.210 18.509 1.00 25.31 S ATOM 1521 CE MET A 194 36.308 97.267 17.077 1.00 26.24 C ATOM 0 H MET A 194 41.578 98.447 16.694 1.00 23.81 H new ATOM 0 HA MET A 194 41.197 97.795 19.207 1.00 23.63 H new ATOM 0 HB2 MET A 194 39.533 98.893 17.902 1.00 26.83 H new ATOM 0 HB3 MET A 194 39.362 97.614 17.026 1.00 26.83 H new ATOM 0 HG2 MET A 194 38.417 96.481 18.743 1.00 25.40 H new ATOM 0 HG3 MET A 194 38.757 97.626 19.746 1.00 25.40 H new ATOM 0 HE1 MET A 194 35.433 97.582 16.801 1.00 26.24 H new ATOM 0 HE2 MET A 194 36.938 97.384 16.349 1.00 26.24 H new ATOM 0 HE3 MET A 194 36.254 96.327 17.310 1.00 26.24 H new ATOM 1522 N LEU A 195 41.220 95.288 17.171 1.00 23.90 N ATOM 1523 CA LEU A 195 41.125 93.827 17.009 1.00 24.16 C ATOM 1524 C LEU A 195 42.484 93.239 16.619 1.00 25.19 C ATOM 1525 O LEU A 195 42.487 92.028 16.311 1.00 26.54 O ATOM 1526 CB LEU A 195 40.088 93.499 15.927 1.00 26.80 C ATOM 1527 CG LEU A 195 38.665 93.953 16.243 1.00 32.64 C ATOM 1528 CD1 LEU A 195 37.708 93.725 15.074 1.00 36.06 C ATOM 1529 CD2 LEU A 195 38.184 93.214 17.447 1.00 30.37 C ATOM 0 H LEU A 195 41.407 95.705 16.443 1.00 23.90 H new ATOM 0 HA LEU A 195 40.851 93.436 17.853 1.00 24.16 H new ATOM 0 HB2 LEU A 195 40.367 93.910 15.094 1.00 26.80 H new ATOM 0 HB3 LEU A 195 40.083 92.540 15.782 1.00 26.80 H new ATOM 0 HG LEU A 195 38.682 94.908 16.411 1.00 32.64 H new ATOM 0 HD11 LEU A 195 36.819 94.027 15.319 1.00 36.06 H new ATOM 0 HD12 LEU A 195 38.016 94.223 14.301 1.00 36.06 H new ATOM 0 HD13 LEU A 195 37.680 92.780 14.858 1.00 36.06 H new ATOM 0 HD21 LEU A 195 37.280 93.494 17.659 1.00 30.37 H new ATOM 0 HD22 LEU A 195 38.193 92.261 17.267 1.00 30.37 H new ATOM 0 HD23 LEU A 195 38.766 93.406 18.199 1.00 30.37 H new ATOM 1530 N ASN A 196 43.566 94.010 16.681 1.00 25.32 N ATOM 1531 CA ASN A 196 44.938 93.471 16.404 1.00 27.22 C ATOM 1532 C ASN A 196 44.934 92.744 15.030 1.00 29.28 C ATOM 1533 O ASN A 196 45.466 91.620 14.912 1.00 30.53 O ATOM 1534 CB ASN A 196 45.354 92.571 17.579 1.00 32.42 C ATOM 1535 CG ASN A 196 46.839 92.274 17.626 1.00 45.75 C ATOM 1536 OD1 ASN A 196 47.652 93.061 17.148 1.00 51.64 O ATOM 1537 ND2 ASN A 196 47.200 91.120 18.172 1.00 47.27 N ATOM 0 H ASN A 196 43.547 94.847 16.879 1.00 25.32 H new ATOM 0 HA ASN A 196 45.598 94.179 16.338 1.00 27.22 H new ATOM 0 HB2 ASN A 196 45.091 92.997 18.410 1.00 32.42 H new ATOM 0 HB3 ASN A 196 44.867 91.734 17.523 1.00 32.42 H new ATOM 0 HD21 ASN A 196 48.031 90.899 18.201 1.00 47.27 H new ATOM 0 HD22 ASN A 196 46.603 90.593 18.497 1.00 47.27 H new ATOM 1538 N TRP A 197 44.438 93.362 13.957 1.00 26.21 N ATOM 1539 CA TRP A 197 44.417 92.793 12.591 1.00 26.24 C ATOM 1540 C TRP A 197 45.835 92.700 11.990 1.00 27.06 C ATOM 1541 O TRP A 197 46.044 91.781 11.173 1.00 30.09 O ATOM 1542 CB TRP A 197 43.491 93.608 11.674 1.00 29.40 C ATOM 1543 CG TRP A 197 42.015 93.417 11.860 1.00 27.42 C ATOM 1544 CD1 TRP A 197 41.403 92.467 12.612 1.00 26.09 C ATOM 1545 CD2 TRP A 197 40.948 94.163 11.189 1.00 25.25 C ATOM 1546 NE1 TRP A 197 40.034 92.571 12.453 1.00 26.76 N ATOM 1547 CE2 TRP A 197 39.742 93.602 11.614 1.00 29.26 C ATOM 1548 CE3 TRP A 197 40.920 95.236 10.291 1.00 30.37 C ATOM 1549 CZ2 TRP A 197 38.504 94.072 11.167 1.00 29.12 C ATOM 1550 CZ3 TRP A 197 39.691 95.731 9.879 1.00 29.90 C ATOM 1551 CH2 TRP A 197 38.514 95.140 10.304 1.00 29.26 C ATOM 0 H TRP A 197 44.092 94.148 13.998 1.00 26.21 H new ATOM 0 HA TRP A 197 44.068 91.891 12.658 1.00 26.24 H new ATOM 0 HB2 TRP A 197 43.692 94.548 11.800 1.00 29.40 H new ATOM 0 HB3 TRP A 197 43.710 93.392 10.754 1.00 29.40 H new ATOM 0 HD1 TRP A 197 41.837 91.844 13.150 1.00 26.09 H new ATOM 0 HE1 TRP A 197 39.453 92.060 12.828 1.00 26.76 H new ATOM 0 HE3 TRP A 197 41.711 95.611 9.976 1.00 30.37 H new ATOM 0 HZ2 TRP A 197 37.708 93.678 11.442 1.00 29.12 H new ATOM 0 HZ3 TRP A 197 39.658 96.467 9.312 1.00 29.90 H new ATOM 0 HH2 TRP A 197 37.704 95.477 9.995 1.00 29.26 H new ATOM 1552 N MET A 198 46.668 93.715 12.215 1.00 30.07 N ATOM 1553 CA MET A 198 47.920 93.874 11.433 1.00 32.64 C ATOM 1554 C MET A 198 48.815 94.880 12.151 1.00 36.38 C ATOM 1555 O MET A 198 48.324 95.556 13.058 1.00 34.21 O ATOM 1556 CB MET A 198 47.580 94.378 10.030 1.00 33.26 C ATOM 1557 CG MET A 198 46.775 95.684 10.091 1.00 35.43 C ATOM 1558 SD MET A 198 46.205 96.247 8.461 1.00 39.65 S ATOM 1559 CE MET A 198 44.820 95.169 8.150 1.00 36.57 C ATOM 0 H MET A 198 46.538 94.323 12.809 1.00 30.07 H new ATOM 0 HA MET A 198 48.382 93.024 11.356 1.00 32.64 H new ATOM 0 HB2 MET A 198 48.397 94.522 9.528 1.00 33.26 H new ATOM 0 HB3 MET A 198 47.071 93.703 9.555 1.00 33.26 H new ATOM 0 HG2 MET A 198 46.007 95.557 10.670 1.00 35.43 H new ATOM 0 HG3 MET A 198 47.322 96.376 10.493 1.00 35.43 H new ATOM 0 HE1 MET A 198 44.430 95.384 7.288 1.00 36.57 H new ATOM 0 HE2 MET A 198 45.122 94.247 8.147 1.00 36.57 H new ATOM 0 HE3 MET A 198 44.154 95.289 8.845 1.00 36.57 H new ATOM 1560 N HIS A 199 50.086 94.973 11.740 1.00 43.08 N ATOM 1561 CA HIS A 199 50.969 96.100 12.132 1.00 45.25 C ATOM 1562 C HIS A 199 50.237 97.380 11.744 1.00 42.44 C ATOM 1563 O HIS A 199 49.882 97.519 10.559 1.00 43.08 O ATOM 1564 CB HIS A 199 52.348 95.995 11.464 1.00 50.76 C ATOM 1565 CG HIS A 199 53.145 94.832 11.959 1.00 62.30 C ATOM 1566 ND1 HIS A 199 53.306 94.570 13.316 1.00 64.71 N ATOM 1567 CD2 HIS A 199 53.805 93.853 11.299 1.00 64.00 C ATOM 1568 CE1 HIS A 199 54.028 93.478 13.468 1.00 63.85 C ATOM 1569 NE2 HIS A 199 54.350 93.025 12.244 1.00 67.83 N ATOM 0 H HIS A 199 50.464 94.393 11.230 1.00 43.08 H new ATOM 0 HA HIS A 199 51.146 96.088 13.086 1.00 45.25 H new ATOM 0 HB2 HIS A 199 52.233 95.917 10.504 1.00 50.76 H new ATOM 0 HB3 HIS A 199 52.844 96.813 11.625 1.00 50.76 H new ATOM 0 HD2 HIS A 199 53.875 93.760 10.376 1.00 64.00 H new ATOM 0 HE1 HIS A 199 54.271 93.090 14.277 1.00 63.85 H new ATOM 0 HE2 HIS A 199 54.823 92.326 12.080 1.00 67.83 H new ATOM 1570 N TYR A 200 49.935 98.230 12.722 1.00 36.95 N ATOM 1571 CA TYR A 200 49.260 99.516 12.457 1.00 42.06 C ATOM 1572 C TYR A 200 50.350 100.572 12.261 1.00 41.63 C ATOM 1573 O TYR A 200 51.543 100.317 12.631 1.00 39.06 O ATOM 1574 CB TYR A 200 48.304 99.834 13.603 1.00 44.24 C ATOM 1575 CG TYR A 200 49.006 100.115 14.897 1.00 44.43 C ATOM 1576 CD1 TYR A 200 49.727 101.285 15.044 1.00 43.33 C ATOM 1577 CD2 TYR A 200 48.961 99.227 15.966 1.00 50.35 C ATOM 1578 CE1 TYR A 200 50.377 101.585 16.224 1.00 45.76 C ATOM 1579 CE2 TYR A 200 49.606 99.514 17.161 1.00 52.68 C ATOM 1580 CZ TYR A 200 50.337 100.691 17.276 1.00 57.31 C ATOM 1581 OH TYR A 200 51.017 101.040 18.408 1.00 62.02 O ATOM 0 H TYR A 200 50.110 98.087 13.552 1.00 36.95 H new ATOM 0 HA TYR A 200 48.717 99.489 11.654 1.00 42.06 H new ATOM 0 HB2 TYR A 200 47.763 100.602 13.362 1.00 44.24 H new ATOM 0 HB3 TYR A 200 47.697 99.088 13.727 1.00 44.24 H new ATOM 0 HD1 TYR A 200 49.775 101.883 14.333 1.00 43.33 H new ATOM 0 HD2 TYR A 200 48.492 98.429 15.879 1.00 50.35 H new ATOM 0 HE1 TYR A 200 50.840 102.387 16.310 1.00 45.76 H new ATOM 0 HE2 TYR A 200 49.550 98.924 17.878 1.00 52.68 H new ATOM 0 HH TYR A 200 50.931 100.435 18.985 1.00 62.02 H new ATOM 1582 N ASN A 201 49.961 101.713 11.704 1.00 33.54 N ATOM 1583 CA ASN A 201 50.847 102.888 11.521 1.00 35.07 C ATOM 1584 C ASN A 201 50.044 104.193 11.765 1.00 27.76 C ATOM 1585 O ASN A 201 48.905 104.155 12.323 1.00 26.14 O ATOM 1586 CB ASN A 201 51.525 102.803 10.147 1.00 37.17 C ATOM 1587 CG ASN A 201 50.497 102.687 9.047 1.00 38.25 C ATOM 1588 OD1 ASN A 201 49.390 103.367 9.202 1.00 50.27 O flip ATOM 1589 ND2 ASN A 201 50.680 101.943 8.086 1.00 33.55 N flip ATOM 0 H ASN A 201 49.162 101.840 11.412 1.00 33.54 H new ATOM 0 HA ASN A 201 51.563 102.895 12.175 1.00 35.07 H new ATOM 0 HB2 ASN A 201 52.072 103.591 10.002 1.00 37.17 H new ATOM 0 HB3 ASN A 201 52.119 102.037 10.122 1.00 37.17 H new ATOM 0 HD21 ASN A 201 51.419 101.509 8.013 1.00 33.55 H new ATOM 0 HD22 ASN A 201 50.069 101.856 7.487 1.00 33.55 H new ATOM 1590 N GLN A 202 50.560 105.332 11.325 1.00 28.10 N ATOM 1591 CA GLN A 202 49.984 106.666 11.672 1.00 23.81 C ATOM 1592 C GLN A 202 48.536 106.875 11.162 1.00 23.26 C ATOM 1593 O GLN A 202 47.854 107.763 11.703 1.00 18.94 O ATOM 1594 CB GLN A 202 50.872 107.799 11.155 1.00 24.90 C ATOM 1595 CG GLN A 202 50.946 107.921 9.663 1.00 24.26 C ATOM 1596 CD GLN A 202 52.006 108.910 9.179 1.00 29.54 C ATOM 1597 OE1 GLN A 202 53.061 109.040 9.799 1.00 27.11 O ATOM 1598 NE2 GLN A 202 51.708 109.598 8.090 1.00 34.05 N ATOM 0 H GLN A 202 51.253 105.373 10.817 1.00 28.10 H new ATOM 0 HA GLN A 202 49.950 106.685 12.641 1.00 23.81 H new ATOM 0 HB2 GLN A 202 50.546 108.637 11.518 1.00 24.90 H new ATOM 0 HB3 GLN A 202 51.770 107.670 11.500 1.00 24.90 H new ATOM 0 HG2 GLN A 202 51.133 107.048 9.284 1.00 24.26 H new ATOM 0 HG3 GLN A 202 50.079 108.197 9.326 1.00 24.26 H new ATOM 0 HE21 GLN A 202 50.956 109.470 7.693 1.00 34.05 H new ATOM 0 HE22 GLN A 202 52.266 110.174 7.779 1.00 34.05 H new ATOM 1599 N THR A 203 48.064 106.117 10.160 1.00 23.05 N ATOM 1600 CA THR A 203 46.692 106.202 9.631 1.00 23.11 C ATOM 1601 C THR A 203 45.643 105.973 10.747 1.00 20.21 C ATOM 1602 O THR A 203 44.445 106.391 10.580 1.00 19.29 O ATOM 1603 CB THR A 203 46.540 105.218 8.432 1.00 23.83 C ATOM 1604 OG1 THR A 203 46.835 103.866 8.841 1.00 29.62 O ATOM 1605 CG2 THR A 203 47.609 105.418 7.373 1.00 24.17 C ATOM 0 H THR A 203 48.544 105.526 9.761 1.00 23.05 H new ATOM 0 HA THR A 203 46.524 107.098 9.299 1.00 23.11 H new ATOM 0 HB THR A 203 45.637 105.374 8.113 1.00 23.83 H new ATOM 0 HG1 THR A 203 47.653 103.711 8.727 1.00 29.62 H new ATOM 0 HG21 THR A 203 47.472 104.785 6.651 1.00 24.17 H new ATOM 0 HG22 THR A 203 47.555 106.322 7.025 1.00 24.17 H new ATOM 0 HG23 THR A 203 48.484 105.275 7.766 1.00 24.17 H new ATOM 1606 N VAL A 204 46.017 105.286 11.843 1.00 18.90 N ATOM 1607 CA VAL A 204 45.037 105.025 12.941 1.00 18.67 C ATOM 1608 C VAL A 204 44.529 106.378 13.454 1.00 18.09 C ATOM 1609 O VAL A 204 43.342 106.487 13.904 1.00 18.48 O ATOM 1610 CB VAL A 204 45.582 104.151 14.101 1.00 18.62 C ATOM 1611 CG1 VAL A 204 45.996 102.758 13.606 1.00 19.97 C ATOM 1612 CG2 VAL A 204 46.711 104.801 14.837 1.00 20.91 C ATOM 0 H VAL A 204 46.805 104.969 11.976 1.00 18.90 H new ATOM 0 HA VAL A 204 44.314 104.497 12.569 1.00 18.67 H new ATOM 0 HB VAL A 204 44.850 104.053 14.730 1.00 18.62 H new ATOM 0 HG11 VAL A 204 46.332 102.236 14.351 1.00 19.97 H new ATOM 0 HG12 VAL A 204 45.228 102.310 13.219 1.00 19.97 H new ATOM 0 HG13 VAL A 204 46.691 102.846 12.935 1.00 19.97 H new ATOM 0 HG21 VAL A 204 47.013 104.215 15.549 1.00 20.91 H new ATOM 0 HG22 VAL A 204 47.444 104.969 14.224 1.00 20.91 H new ATOM 0 HG23 VAL A 204 46.409 105.641 15.216 1.00 20.91 H new ATOM 1613 N ASP A 205 45.350 107.406 13.485 1.00 17.28 N ATOM 1614 CA ASP A 205 44.972 108.729 14.070 1.00 17.13 C ATOM 1615 C ASP A 205 43.902 109.414 13.186 1.00 16.00 C ATOM 1616 O ASP A 205 43.073 110.141 13.734 1.00 16.52 O ATOM 1617 CB ASP A 205 46.185 109.644 14.298 1.00 16.57 C ATOM 1618 CG ASP A 205 47.138 109.197 15.429 1.00 18.34 C ATOM 1619 OD1 ASP A 205 46.686 108.509 16.363 1.00 17.59 O ATOM 1620 OD2 ASP A 205 48.351 109.596 15.297 1.00 18.39 O ATOM 0 H ASP A 205 46.151 107.381 13.172 1.00 17.28 H new ATOM 0 HA ASP A 205 44.594 108.564 14.948 1.00 17.13 H new ATOM 0 HB2 ASP A 205 46.690 109.701 13.472 1.00 16.57 H new ATOM 0 HB3 ASP A 205 45.866 110.538 14.497 1.00 16.57 H new ATOM 1621 N ILE A 206 43.952 109.199 11.851 1.00 16.05 N ATOM 1622 CA ILE A 206 42.975 109.831 10.925 1.00 17.05 C ATOM 1623 C ILE A 206 41.604 109.184 11.192 1.00 16.80 C ATOM 1624 O ILE A 206 40.593 109.907 11.114 1.00 16.09 O ATOM 1625 CB ILE A 206 43.450 109.756 9.465 1.00 15.58 C ATOM 1626 CG1 ILE A 206 44.733 110.586 9.251 1.00 18.09 C ATOM 1627 CG2 ILE A 206 42.310 110.162 8.521 1.00 17.20 C ATOM 1628 CD1 ILE A 206 44.456 112.071 9.334 1.00 23.10 C ATOM 0 H ILE A 206 44.535 108.698 11.466 1.00 16.05 H new ATOM 0 HA ILE A 206 42.895 110.784 11.089 1.00 17.05 H new ATOM 0 HB ILE A 206 43.687 108.839 9.254 1.00 15.58 H new ATOM 0 HG12 ILE A 206 45.393 110.341 9.919 1.00 18.09 H new ATOM 0 HG13 ILE A 206 45.115 110.375 8.385 1.00 18.09 H new ATOM 0 HG21 ILE A 206 42.617 110.112 7.602 1.00 17.20 H new ATOM 0 HG22 ILE A 206 41.559 109.561 8.643 1.00 17.20 H new ATOM 0 HG23 ILE A 206 42.033 111.070 8.720 1.00 17.20 H new ATOM 0 HD11 ILE A 206 45.281 112.562 9.196 1.00 23.10 H new ATOM 0 HD12 ILE A 206 43.814 112.319 8.651 1.00 23.10 H new ATOM 0 HD13 ILE A 206 44.096 112.285 10.209 1.00 23.10 H new ATOM 1629 N TRP A 207 41.497 107.872 11.392 1.00 16.37 N ATOM 1630 CA TRP A 207 40.205 107.235 11.821 1.00 15.15 C ATOM 1631 C TRP A 207 39.656 107.979 13.030 1.00 15.02 C ATOM 1632 O TRP A 207 38.428 108.354 13.034 1.00 14.38 O ATOM 1633 CB TRP A 207 40.392 105.737 12.107 1.00 15.51 C ATOM 1634 CG TRP A 207 39.095 105.050 12.459 1.00 15.23 C ATOM 1635 CD1 TRP A 207 38.497 104.971 13.680 1.00 15.51 C ATOM 1636 CD2 TRP A 207 38.205 104.408 11.524 1.00 14.55 C ATOM 1637 NE1 TRP A 207 37.331 104.265 13.566 1.00 15.42 N ATOM 1638 CE2 TRP A 207 37.104 103.918 12.254 1.00 14.15 C ATOM 1639 CE3 TRP A 207 38.227 104.169 10.141 1.00 14.02 C ATOM 1640 CZ2 TRP A 207 36.052 103.247 11.648 1.00 16.43 C ATOM 1641 CZ3 TRP A 207 37.223 103.423 9.552 1.00 15.06 C ATOM 1642 CH2 TRP A 207 36.101 103.035 10.303 1.00 15.83 C ATOM 0 H TRP A 207 42.147 107.318 11.290 1.00 16.37 H new ATOM 0 HA TRP A 207 39.560 107.300 11.099 1.00 15.15 H new ATOM 0 HB2 TRP A 207 40.781 105.308 11.329 1.00 15.51 H new ATOM 0 HB3 TRP A 207 41.022 105.626 12.836 1.00 15.51 H new ATOM 0 HD1 TRP A 207 38.829 105.339 14.467 1.00 15.51 H new ATOM 0 HE1 TRP A 207 36.812 104.066 14.222 1.00 15.42 H new ATOM 0 HE3 TRP A 207 38.917 104.513 9.621 1.00 14.02 H new ATOM 0 HZ2 TRP A 207 35.328 102.948 12.149 1.00 16.43 H new ATOM 0 HZ3 TRP A 207 37.291 103.178 8.657 1.00 15.06 H new ATOM 0 HH2 TRP A 207 35.382 102.628 9.876 1.00 15.83 H new ATOM 1643 N SER A 208 40.460 108.220 14.062 1.00 14.78 N ATOM 1644 CA SER A 208 39.994 108.906 15.281 1.00 14.18 C ATOM 1645 C SER A 208 39.489 110.316 14.947 1.00 14.51 C ATOM 1646 O SER A 208 38.421 110.711 15.482 1.00 15.36 O ATOM 1647 CB SER A 208 41.123 108.951 16.320 1.00 15.48 C ATOM 1648 OG SER A 208 41.642 107.657 16.574 1.00 16.83 O ATOM 0 H SER A 208 41.290 107.994 14.082 1.00 14.78 H new ATOM 0 HA SER A 208 39.251 108.410 15.659 1.00 14.18 H new ATOM 0 HB2 SER A 208 41.834 109.530 16.003 1.00 15.48 H new ATOM 0 HB3 SER A 208 40.790 109.336 17.146 1.00 15.48 H new ATOM 0 HG SER A 208 41.013 107.137 16.774 1.00 16.83 H new ATOM 1649 N VAL A 209 40.221 111.073 14.096 1.00 15.83 N ATOM 1650 CA VAL A 209 39.725 112.407 13.666 1.00 15.39 C ATOM 1651 C VAL A 209 38.343 112.305 12.989 1.00 14.32 C ATOM 1652 O VAL A 209 37.463 113.141 13.297 1.00 16.57 O ATOM 1653 CB VAL A 209 40.726 113.166 12.771 1.00 16.45 C ATOM 1654 CG1 VAL A 209 40.141 114.488 12.335 1.00 19.17 C ATOM 1655 CG2 VAL A 209 42.036 113.369 13.505 1.00 18.38 C ATOM 0 H VAL A 209 40.981 110.843 13.766 1.00 15.83 H new ATOM 0 HA VAL A 209 39.629 112.931 14.477 1.00 15.39 H new ATOM 0 HB VAL A 209 40.902 112.637 11.977 1.00 16.45 H new ATOM 0 HG11 VAL A 209 40.779 114.955 11.773 1.00 19.17 H new ATOM 0 HG12 VAL A 209 39.325 114.332 11.835 1.00 19.17 H new ATOM 0 HG13 VAL A 209 39.943 115.028 13.116 1.00 19.17 H new ATOM 0 HG21 VAL A 209 42.657 113.847 12.933 1.00 18.38 H new ATOM 0 HG22 VAL A 209 41.879 113.884 14.312 1.00 18.38 H new ATOM 0 HG23 VAL A 209 42.412 112.507 13.741 1.00 18.38 H new ATOM 1656 N GLY A 210 38.111 111.309 12.133 1.00 14.93 N ATOM 1657 CA GLY A 210 36.788 111.086 11.529 1.00 14.81 C ATOM 1658 C GLY A 210 35.715 110.900 12.592 1.00 15.66 C ATOM 1659 O GLY A 210 34.609 111.478 12.505 1.00 15.95 O ATOM 0 H GLY A 210 38.710 110.744 11.885 1.00 14.93 H new ATOM 0 HA2 GLY A 210 36.558 111.840 10.963 1.00 14.81 H new ATOM 0 HA3 GLY A 210 36.819 110.302 10.958 1.00 14.81 H new ATOM 1660 N CYS A 211 35.961 110.045 13.583 1.00 14.01 N ATOM 1661 CA CYS A 211 34.992 109.809 14.687 1.00 15.21 C ATOM 1662 C CYS A 211 34.694 111.116 15.438 1.00 16.00 C ATOM 1663 O CYS A 211 33.540 111.353 15.844 1.00 15.32 O ATOM 1664 CB CYS A 211 35.526 108.737 15.640 1.00 14.31 C ATOM 1665 SG CYS A 211 35.699 107.080 14.903 1.00 15.87 S ATOM 0 H CYS A 211 36.684 109.583 13.645 1.00 14.01 H new ATOM 0 HA CYS A 211 34.159 109.490 14.305 1.00 15.21 H new ATOM 0 HB2 CYS A 211 36.391 109.021 15.974 1.00 14.31 H new ATOM 0 HB3 CYS A 211 34.932 108.677 16.405 1.00 14.31 H new ATOM 0 HG CYS A 211 36.858 106.857 14.687 1.00 15.87 H new ATOM 1666 N ILE A 212 35.719 111.940 15.728 1.00 15.52 N ATOM 1667 CA ILE A 212 35.566 113.212 16.477 1.00 15.08 C ATOM 1668 C ILE A 212 34.724 114.176 15.618 1.00 15.97 C ATOM 1669 O ILE A 212 33.785 114.810 16.155 1.00 17.31 O ATOM 1670 CB ILE A 212 36.947 113.760 16.886 1.00 16.89 C ATOM 1671 CG1 ILE A 212 37.614 112.822 17.891 1.00 16.95 C ATOM 1672 CG2 ILE A 212 36.819 115.170 17.449 1.00 17.15 C ATOM 1673 CD1 ILE A 212 39.095 113.054 18.033 1.00 17.47 C ATOM 0 H ILE A 212 36.530 111.776 15.494 1.00 15.52 H new ATOM 0 HA ILE A 212 35.091 113.082 17.313 1.00 15.08 H new ATOM 0 HB ILE A 212 37.510 113.806 16.097 1.00 16.89 H new ATOM 0 HG12 ILE A 212 37.191 112.933 18.757 1.00 16.95 H new ATOM 0 HG13 ILE A 212 37.462 111.904 17.617 1.00 16.95 H new ATOM 0 HG21 ILE A 212 37.696 115.499 17.701 1.00 17.15 H new ATOM 0 HG22 ILE A 212 36.436 115.754 16.776 1.00 17.15 H new ATOM 0 HG23 ILE A 212 36.243 115.156 18.229 1.00 17.15 H new ATOM 0 HD11 ILE A 212 39.460 112.432 18.681 1.00 17.47 H new ATOM 0 HD12 ILE A 212 39.528 112.918 17.176 1.00 17.47 H new ATOM 0 HD13 ILE A 212 39.253 113.963 18.333 1.00 17.47 H new ATOM 1674 N MET A 213 35.088 114.342 14.355 1.00 16.49 N ATOM 1675 CA MET A 213 34.408 115.287 13.417 1.00 17.22 C ATOM 1676 C MET A 213 32.901 114.906 13.344 1.00 18.51 C ATOM 1677 O MET A 213 32.010 115.803 13.425 1.00 17.47 O ATOM 1678 CB MET A 213 35.089 115.328 12.042 1.00 16.96 C ATOM 1679 CG MET A 213 34.344 116.223 11.029 1.00 17.67 C ATOM 1680 SD MET A 213 35.347 116.407 9.585 1.00 19.76 S ATOM 1681 CE MET A 213 34.101 117.150 8.500 1.00 18.84 C ATOM 0 H MET A 213 35.742 113.913 13.996 1.00 16.49 H new ATOM 0 HA MET A 213 34.483 116.194 13.753 1.00 17.22 H new ATOM 0 HB2 MET A 213 35.997 115.652 12.146 1.00 16.96 H new ATOM 0 HB3 MET A 213 35.148 114.427 11.688 1.00 16.96 H new ATOM 0 HG2 MET A 213 33.490 115.827 10.796 1.00 17.67 H new ATOM 0 HG3 MET A 213 34.157 117.090 11.421 1.00 17.67 H new ATOM 0 HE1 MET A 213 34.492 117.325 7.630 1.00 18.84 H new ATOM 0 HE2 MET A 213 33.353 116.540 8.401 1.00 18.84 H new ATOM 0 HE3 MET A 213 33.789 117.983 8.888 1.00 18.84 H new ATOM 1682 N ALA A 214 32.592 113.628 13.193 1.00 16.13 N ATOM 1683 CA ALA A 214 31.179 113.138 13.078 1.00 16.35 C ATOM 1684 C ALA A 214 30.425 113.587 14.350 1.00 19.61 C ATOM 1685 O ALA A 214 29.285 114.101 14.277 1.00 18.49 O ATOM 1686 CB ALA A 214 31.113 111.648 12.917 1.00 15.73 C ATOM 0 H ALA A 214 33.180 113.002 13.152 1.00 16.13 H new ATOM 0 HA ALA A 214 30.768 113.515 12.284 1.00 16.35 H new ATOM 0 HB1 ALA A 214 30.186 111.371 12.846 1.00 15.73 H new ATOM 0 HB2 ALA A 214 31.590 111.388 12.114 1.00 15.73 H new ATOM 0 HB3 ALA A 214 31.520 111.221 13.687 1.00 15.73 H new ATOM 1687 N GLU A 215 30.995 113.407 15.523 1.00 16.27 N ATOM 1688 CA GLU A 215 30.376 113.711 16.833 1.00 18.01 C ATOM 1689 C GLU A 215 30.216 115.241 16.981 1.00 18.00 C ATOM 1690 O GLU A 215 29.146 115.657 17.537 1.00 19.37 O ATOM 1691 CB GLU A 215 31.241 113.086 17.948 1.00 18.93 C ATOM 1692 CG GLU A 215 30.727 113.314 19.336 1.00 21.31 C ATOM 1693 CD GLU A 215 31.452 112.522 20.410 1.00 22.63 C ATOM 1694 OE1 GLU A 215 32.067 111.542 20.064 1.00 20.34 O ATOM 1695 OE2 GLU A 215 31.189 112.794 21.667 1.00 25.96 O ATOM 0 H GLU A 215 31.791 113.090 15.599 1.00 16.27 H new ATOM 0 HA GLU A 215 29.488 113.326 16.901 1.00 18.01 H new ATOM 0 HB2 GLU A 215 31.307 112.131 17.793 1.00 18.93 H new ATOM 0 HB3 GLU A 215 32.139 113.447 17.885 1.00 18.93 H new ATOM 0 HG2 GLU A 215 30.796 114.259 19.544 1.00 21.31 H new ATOM 0 HG3 GLU A 215 29.785 113.086 19.362 1.00 21.31 H new ATOM 1696 N LEU A 216 31.121 116.069 16.468 1.00 18.89 N ATOM 1697 CA LEU A 216 30.894 117.563 16.505 1.00 20.06 C ATOM 1698 C LEU A 216 29.717 117.914 15.580 1.00 21.86 C ATOM 1699 O LEU A 216 28.938 118.861 15.994 1.00 23.80 O ATOM 1700 CB LEU A 216 32.143 118.329 16.080 1.00 20.92 C ATOM 1701 CG LEU A 216 33.367 118.104 16.971 1.00 22.33 C ATOM 1702 CD1 LEU A 216 34.482 119.023 16.551 1.00 23.21 C ATOM 1703 CD2 LEU A 216 33.056 118.326 18.438 1.00 28.90 C ATOM 0 H LEU A 216 31.858 115.821 16.100 1.00 18.89 H new ATOM 0 HA LEU A 216 30.689 117.823 17.417 1.00 20.06 H new ATOM 0 HB2 LEU A 216 32.369 118.076 15.171 1.00 20.92 H new ATOM 0 HB3 LEU A 216 31.937 119.277 16.068 1.00 20.92 H new ATOM 0 HG LEU A 216 33.637 117.179 16.862 1.00 22.33 H new ATOM 0 HD11 LEU A 216 35.254 118.876 17.119 1.00 23.21 H new ATOM 0 HD12 LEU A 216 34.721 118.842 15.628 1.00 23.21 H new ATOM 0 HD13 LEU A 216 34.191 119.945 16.634 1.00 23.21 H new ATOM 0 HD21 LEU A 216 33.856 118.174 18.965 1.00 28.90 H new ATOM 0 HD22 LEU A 216 32.751 119.237 18.570 1.00 28.90 H new ATOM 0 HD23 LEU A 216 32.362 117.709 18.719 1.00 28.90 H new ATOM 1704 N LEU A 217 29.538 117.226 14.462 1.00 19.63 N ATOM 1705 CA LEU A 217 28.440 117.566 13.502 1.00 19.71 C ATOM 1706 C LEU A 217 27.085 117.126 14.080 1.00 23.31 C ATOM 1707 O LEU A 217 26.076 117.849 13.764 1.00 24.18 O ATOM 1708 CB LEU A 217 28.696 116.949 12.154 1.00 19.92 C ATOM 1709 CG LEU A 217 29.858 117.558 11.380 1.00 23.66 C ATOM 1710 CD1 LEU A 217 30.255 116.685 10.251 1.00 26.40 C ATOM 1711 CD2 LEU A 217 29.482 118.931 10.852 1.00 25.76 C ATOM 0 H LEU A 217 30.027 116.560 14.223 1.00 19.63 H new ATOM 0 HA LEU A 217 28.417 118.528 13.376 1.00 19.71 H new ATOM 0 HB2 LEU A 217 28.865 116.001 12.273 1.00 19.92 H new ATOM 0 HB3 LEU A 217 27.891 117.028 11.619 1.00 19.92 H new ATOM 0 HG LEU A 217 30.609 117.644 11.988 1.00 23.66 H new ATOM 0 HD11 LEU A 217 30.995 117.091 9.773 1.00 26.40 H new ATOM 0 HD12 LEU A 217 30.527 115.819 10.592 1.00 26.40 H new ATOM 0 HD13 LEU A 217 29.503 116.573 9.648 1.00 26.40 H new ATOM 0 HD21 LEU A 217 30.231 119.306 10.362 1.00 25.76 H new ATOM 0 HD22 LEU A 217 28.717 118.852 10.261 1.00 25.76 H new ATOM 0 HD23 LEU A 217 29.258 119.513 11.595 1.00 25.76 H new ATOM 1712 N THR A 218 26.980 115.989 14.760 1.00 18.47 N ATOM 1713 CA THR A 218 25.666 115.383 15.179 1.00 19.55 C ATOM 1714 C THR A 218 25.353 115.598 16.658 1.00 20.18 C ATOM 1715 O THR A 218 24.158 115.415 17.047 1.00 21.07 O ATOM 1716 CB THR A 218 25.586 113.877 14.881 1.00 18.43 C ATOM 1717 OG1 THR A 218 26.565 113.254 15.733 1.00 19.50 O ATOM 1718 CG2 THR A 218 25.876 113.549 13.427 1.00 19.55 C ATOM 0 H THR A 218 27.663 115.526 15.004 1.00 18.47 H new ATOM 0 HA THR A 218 25.005 115.852 14.646 1.00 19.55 H new ATOM 0 HB THR A 218 24.687 113.555 15.048 1.00 18.43 H new ATOM 0 HG1 THR A 218 27.332 113.523 15.522 1.00 19.50 H new ATOM 0 HG21 THR A 218 25.813 112.590 13.293 1.00 19.55 H new ATOM 0 HG22 THR A 218 25.231 113.998 12.859 1.00 19.55 H new ATOM 0 HG23 THR A 218 26.770 113.849 13.200 1.00 19.55 H new ATOM 1719 N GLY A 219 26.369 115.843 17.480 1.00 18.95 N ATOM 1720 CA GLY A 219 26.268 115.860 18.947 1.00 21.80 C ATOM 1721 C GLY A 219 26.172 114.463 19.559 1.00 23.52 C ATOM 1722 O GLY A 219 25.861 114.355 20.744 1.00 25.19 O ATOM 0 H GLY A 219 27.163 116.010 17.195 1.00 18.95 H new ATOM 0 HA2 GLY A 219 27.042 116.315 19.314 1.00 21.80 H new ATOM 0 HA3 GLY A 219 25.488 116.375 19.206 1.00 21.80 H new ATOM 1723 N ARG A 220 26.469 113.400 18.808 1.00 18.50 N ATOM 1724 CA ARG A 220 26.298 112.011 19.256 1.00 18.87 C ATOM 1725 C ARG A 220 27.553 111.198 18.929 1.00 17.97 C ATOM 1726 O ARG A 220 28.179 111.432 17.869 1.00 18.10 O ATOM 1727 CB ARG A 220 25.118 111.326 18.549 1.00 20.21 C ATOM 1728 CG ARG A 220 23.784 112.027 18.808 1.00 22.22 C ATOM 1729 CD ARG A 220 23.327 111.912 20.284 1.00 26.88 C ATOM 1730 NE ARG A 220 22.279 112.927 20.474 1.00 30.59 N ATOM 1731 CZ ARG A 220 21.920 113.413 21.646 1.00 24.22 C ATOM 1732 NH1 ARG A 220 22.510 112.987 22.753 1.00 30.89 N ATOM 1733 NH2 ARG A 220 20.968 114.350 21.677 1.00 30.35 N ATOM 0 H ARG A 220 26.781 113.465 18.009 1.00 18.50 H new ATOM 0 HA ARG A 220 26.134 112.042 20.211 1.00 18.87 H new ATOM 0 HB2 ARG A 220 25.287 111.304 17.594 1.00 20.21 H new ATOM 0 HB3 ARG A 220 25.058 110.405 18.848 1.00 20.21 H new ATOM 0 HG2 ARG A 220 23.863 112.964 18.570 1.00 22.22 H new ATOM 0 HG3 ARG A 220 23.104 111.644 18.232 1.00 22.22 H new ATOM 0 HD2 ARG A 220 22.986 111.024 20.472 1.00 26.88 H new ATOM 0 HD3 ARG A 220 24.070 112.065 20.889 1.00 26.88 H new ATOM 0 HE ARG A 220 21.874 113.223 19.775 1.00 30.59 H new ATOM 0 HH11 ARG A 220 23.129 112.392 22.709 1.00 30.89 H new ATOM 0 HH12 ARG A 220 22.274 113.306 23.516 1.00 30.89 H new ATOM 0 HH21 ARG A 220 20.607 114.620 20.945 1.00 30.35 H new ATOM 0 HH22 ARG A 220 20.716 114.683 22.429 1.00 30.35 H new ATOM 1734 N THR A 221 27.934 110.279 19.795 1.00 17.16 N ATOM 1735 CA THR A 221 29.041 109.329 19.511 1.00 17.48 C ATOM 1736 C THR A 221 28.764 108.570 18.203 1.00 16.75 C ATOM 1737 O THR A 221 27.637 108.045 18.023 1.00 16.82 O ATOM 1738 CB THR A 221 29.196 108.292 20.643 1.00 19.04 C ATOM 1739 OG1 THR A 221 29.189 108.942 21.935 1.00 22.29 O ATOM 1740 CG2 THR A 221 30.476 107.506 20.475 1.00 19.58 C ATOM 0 H THR A 221 27.571 110.174 20.567 1.00 17.16 H new ATOM 0 HA THR A 221 29.856 109.850 19.438 1.00 17.48 H new ATOM 0 HB THR A 221 28.444 107.682 20.594 1.00 19.04 H new ATOM 0 HG1 THR A 221 28.401 109.147 22.141 1.00 22.29 H new ATOM 0 HG21 THR A 221 30.556 106.860 21.194 1.00 19.58 H new ATOM 0 HG22 THR A 221 30.461 107.041 19.624 1.00 19.58 H new ATOM 0 HG23 THR A 221 31.233 108.112 20.499 1.00 19.58 H new ATOM 1741 N LEU A 222 29.785 108.465 17.305 1.00 15.67 N ATOM 1742 CA LEU A 222 29.586 107.748 16.026 1.00 15.24 C ATOM 1743 C LEU A 222 29.451 106.228 16.198 1.00 14.40 C ATOM 1744 O LEU A 222 28.489 105.630 15.647 1.00 15.43 O ATOM 1745 CB LEU A 222 30.724 108.066 15.048 1.00 15.08 C ATOM 1746 CG LEU A 222 30.611 107.451 13.653 1.00 15.71 C ATOM 1747 CD1 LEU A 222 29.294 107.837 12.999 1.00 17.44 C ATOM 1748 CD2 LEU A 222 31.786 107.845 12.757 1.00 16.80 C ATOM 0 H LEU A 222 30.572 108.793 17.419 1.00 15.67 H new ATOM 0 HA LEU A 222 28.744 108.066 15.664 1.00 15.24 H new ATOM 0 HB2 LEU A 222 30.782 109.029 14.952 1.00 15.08 H new ATOM 0 HB3 LEU A 222 31.558 107.769 15.445 1.00 15.08 H new ATOM 0 HG LEU A 222 30.636 106.487 13.762 1.00 15.71 H new ATOM 0 HD11 LEU A 222 29.241 107.438 12.116 1.00 17.44 H new ATOM 0 HD12 LEU A 222 28.557 107.517 13.542 1.00 17.44 H new ATOM 0 HD13 LEU A 222 29.242 108.802 12.920 1.00 17.44 H new ATOM 0 HD21 LEU A 222 31.678 107.437 11.884 1.00 16.80 H new ATOM 0 HD22 LEU A 222 31.811 108.810 12.661 1.00 16.80 H new ATOM 0 HD23 LEU A 222 32.615 107.539 13.157 1.00 16.80 H new ATOM 1749 N PHE A 223 30.356 105.601 16.959 1.00 15.04 N ATOM 1750 CA PHE A 223 30.346 104.140 17.148 1.00 15.83 C ATOM 1751 C PHE A 223 30.382 103.787 18.651 1.00 16.89 C ATOM 1752 O PHE A 223 31.369 103.201 19.160 1.00 16.62 O ATOM 1753 CB PHE A 223 31.569 103.536 16.437 1.00 15.81 C ATOM 1754 CG PHE A 223 31.761 103.843 14.956 1.00 14.84 C ATOM 1755 CD1 PHE A 223 30.776 103.504 14.028 1.00 15.42 C ATOM 1756 CD2 PHE A 223 32.904 104.478 14.528 1.00 15.40 C ATOM 1757 CE1 PHE A 223 30.970 103.758 12.671 1.00 16.59 C ATOM 1758 CE2 PHE A 223 33.105 104.757 13.172 1.00 16.38 C ATOM 1759 CZ PHE A 223 32.150 104.348 12.236 1.00 15.94 C ATOM 0 H PHE A 223 30.989 106.005 17.378 1.00 15.04 H new ATOM 0 HA PHE A 223 29.531 103.774 16.770 1.00 15.83 H new ATOM 0 HB2 PHE A 223 32.363 103.834 16.907 1.00 15.81 H new ATOM 0 HB3 PHE A 223 31.525 102.572 16.537 1.00 15.81 H new ATOM 0 HD1 PHE A 223 29.986 103.107 14.316 1.00 15.42 H new ATOM 0 HD2 PHE A 223 33.551 104.725 15.148 1.00 15.40 H new ATOM 0 HE1 PHE A 223 30.309 103.532 12.057 1.00 16.59 H new ATOM 0 HE2 PHE A 223 33.868 105.211 12.895 1.00 16.38 H new ATOM 0 HZ PHE A 223 32.304 104.470 11.327 1.00 15.94 H new ATOM 1760 N PRO A 224 29.262 104.018 19.391 1.00 16.84 N ATOM 1761 CA PRO A 224 29.234 103.741 20.823 1.00 17.67 C ATOM 1762 C PRO A 224 28.985 102.255 21.150 1.00 17.48 C ATOM 1763 O PRO A 224 27.937 101.859 21.691 1.00 18.43 O ATOM 1764 CB PRO A 224 28.057 104.626 21.305 1.00 18.31 C ATOM 1765 CG PRO A 224 27.136 104.617 20.171 1.00 17.80 C ATOM 1766 CD PRO A 224 28.036 104.666 18.897 1.00 17.49 C ATOM 0 HA PRO A 224 30.082 103.932 21.254 1.00 17.67 H new ATOM 0 HB2 PRO A 224 27.643 104.265 22.104 1.00 18.31 H new ATOM 0 HB3 PRO A 224 28.351 105.525 21.519 1.00 18.31 H new ATOM 0 HG2 PRO A 224 26.583 103.820 20.177 1.00 17.80 H new ATOM 0 HG3 PRO A 224 26.536 105.378 20.203 1.00 17.80 H new ATOM 0 HD2 PRO A 224 27.643 104.186 18.152 1.00 17.49 H new ATOM 0 HD3 PRO A 224 28.197 105.574 18.597 1.00 17.49 H new ATOM 1767 N GLY A 225 29.913 101.390 20.772 1.00 18.25 N ATOM 1768 CA GLY A 225 29.763 99.955 20.987 1.00 17.50 C ATOM 1769 C GLY A 225 29.702 99.552 22.490 1.00 16.94 C ATOM 1770 O GLY A 225 30.484 100.115 23.328 1.00 16.36 O ATOM 0 H GLY A 225 30.647 101.615 20.384 1.00 18.25 H new ATOM 0 HA2 GLY A 225 28.954 99.652 20.546 1.00 17.50 H new ATOM 0 HA3 GLY A 225 30.505 99.493 20.566 1.00 17.50 H new ATOM 1771 N THR A 226 28.883 98.521 22.740 1.00 18.22 N ATOM 1772 CA THR A 226 28.795 97.959 24.131 1.00 19.05 C ATOM 1773 C THR A 226 29.957 96.985 24.394 1.00 20.42 C ATOM 1774 O THR A 226 30.161 96.596 25.588 1.00 20.20 O ATOM 1775 CB THR A 226 27.416 97.343 24.332 1.00 21.44 C ATOM 1776 OG1 THR A 226 27.267 96.286 23.385 1.00 23.10 O ATOM 1777 CG2 THR A 226 26.282 98.342 24.227 1.00 23.91 C ATOM 0 H THR A 226 28.383 98.136 22.155 1.00 18.22 H new ATOM 0 HA THR A 226 28.892 98.663 24.792 1.00 19.05 H new ATOM 0 HB THR A 226 27.361 97.004 25.239 1.00 21.44 H new ATOM 0 HG1 THR A 226 26.512 95.930 23.479 1.00 23.10 H new ATOM 0 HG21 THR A 226 25.436 97.887 24.364 1.00 23.91 H new ATOM 0 HG22 THR A 226 26.392 99.029 24.903 1.00 23.91 H new ATOM 0 HG23 THR A 226 26.290 98.750 23.347 1.00 23.91 H new ATOM 1778 N ASP A 227 30.732 96.565 23.371 1.00 19.37 N ATOM 1779 CA ASP A 227 31.923 95.710 23.477 1.00 17.84 C ATOM 1780 C ASP A 227 32.622 95.729 22.109 1.00 19.47 C ATOM 1781 O ASP A 227 32.067 96.392 21.197 1.00 18.52 O ATOM 1782 CB ASP A 227 31.555 94.279 23.933 1.00 18.77 C ATOM 1783 CG ASP A 227 30.551 93.674 22.989 1.00 24.43 C ATOM 1784 OD1 ASP A 227 30.934 93.360 21.852 1.00 25.84 O ATOM 1785 OD2 ASP A 227 29.405 93.556 23.371 1.00 36.85 O ATOM 0 H ASP A 227 30.562 96.786 22.558 1.00 19.37 H new ATOM 0 HA ASP A 227 32.527 96.047 24.157 1.00 17.84 H new ATOM 0 HB2 ASP A 227 32.352 93.727 23.965 1.00 18.77 H new ATOM 0 HB3 ASP A 227 31.191 94.302 24.832 1.00 18.77 H new ATOM 1786 N HIS A 228 33.802 95.130 22.007 1.00 19.49 N ATOM 1787 CA HIS A 228 34.575 95.102 20.727 1.00 18.28 C ATOM 1788 C HIS A 228 33.682 94.626 19.586 1.00 19.50 C ATOM 1789 O HIS A 228 33.818 95.209 18.438 1.00 21.11 O ATOM 1790 CB HIS A 228 35.805 94.204 20.872 1.00 17.46 C ATOM 1791 CG HIS A 228 36.879 94.666 21.791 1.00 19.54 C ATOM 1792 ND1 HIS A 228 36.677 94.824 23.171 1.00 21.10 N ATOM 1793 CD2 HIS A 228 38.195 94.948 21.606 1.00 19.91 C ATOM 1794 CE1 HIS A 228 37.784 95.231 23.731 1.00 21.25 C ATOM 1795 NE2 HIS A 228 38.756 95.255 22.795 1.00 20.43 N ATOM 0 H HIS A 228 34.190 94.727 22.660 1.00 19.49 H new ATOM 0 HA HIS A 228 34.879 96.000 20.521 1.00 18.28 H new ATOM 0 HB2 HIS A 228 35.506 93.332 21.173 1.00 17.46 H new ATOM 0 HB3 HIS A 228 36.194 94.083 19.992 1.00 17.46 H new ATOM 0 HD2 HIS A 228 38.639 94.932 20.789 1.00 19.91 H new ATOM 0 HE1 HIS A 228 37.886 95.465 24.625 1.00 21.25 H new ATOM 0 HE2 HIS A 228 39.586 95.434 22.932 1.00 20.43 H new ATOM 1796 N ILE A 229 32.935 93.536 19.742 1.00 19.41 N ATOM 1797 CA ILE A 229 32.166 92.922 18.605 1.00 20.09 C ATOM 1798 C ILE A 229 30.999 93.816 18.214 1.00 20.60 C ATOM 1799 O ILE A 229 30.797 94.064 16.984 1.00 20.41 O ATOM 1800 CB ILE A 229 31.687 91.511 18.991 1.00 27.15 C ATOM 1801 CG1 ILE A 229 32.880 90.600 19.222 1.00 28.43 C ATOM 1802 CG2 ILE A 229 30.703 90.966 17.941 1.00 27.38 C ATOM 1803 CD1 ILE A 229 33.937 90.652 18.160 1.00 29.15 C ATOM 0 H ILE A 229 32.847 93.122 20.490 1.00 19.41 H new ATOM 0 HA ILE A 229 32.749 92.840 17.834 1.00 20.09 H new ATOM 0 HB ILE A 229 31.197 91.551 19.827 1.00 27.15 H new ATOM 0 HG12 ILE A 229 33.285 90.830 20.073 1.00 28.43 H new ATOM 0 HG13 ILE A 229 32.562 89.687 19.297 1.00 28.43 H new ATOM 0 HG21 ILE A 229 30.412 90.078 18.200 1.00 27.38 H new ATOM 0 HG22 ILE A 229 29.933 91.554 17.883 1.00 27.38 H new ATOM 0 HG23 ILE A 229 31.142 90.923 17.077 1.00 27.38 H new ATOM 0 HD11 ILE A 229 34.656 90.042 18.389 1.00 29.15 H new ATOM 0 HD12 ILE A 229 33.553 90.393 17.308 1.00 29.15 H new ATOM 0 HD13 ILE A 229 34.287 91.554 18.095 1.00 29.15 H new ATOM 1804 N ASP A 230 30.209 94.318 19.170 1.00 17.84 N ATOM 1805 CA ASP A 230 29.129 95.289 18.894 1.00 19.23 C ATOM 1806 C ASP A 230 29.757 96.458 18.117 1.00 17.27 C ATOM 1807 O ASP A 230 29.111 96.945 17.110 1.00 18.17 O ATOM 1808 CB ASP A 230 28.420 95.729 20.171 1.00 20.75 C ATOM 1809 CG ASP A 230 27.249 96.653 19.958 1.00 22.27 C ATOM 1810 OD1 ASP A 230 26.250 96.222 19.270 1.00 24.93 O ATOM 1811 OD2 ASP A 230 27.292 97.798 20.434 1.00 22.58 O ATOM 0 H ASP A 230 30.281 94.107 20.001 1.00 17.84 H new ATOM 0 HA ASP A 230 28.431 94.883 18.357 1.00 19.23 H new ATOM 0 HB2 ASP A 230 28.111 94.940 20.643 1.00 20.75 H new ATOM 0 HB3 ASP A 230 29.063 96.170 20.747 1.00 20.75 H new ATOM 1812 N GLN A 231 30.871 96.987 18.586 1.00 15.97 N ATOM 1813 CA GLN A 231 31.455 98.192 17.915 1.00 16.38 C ATOM 1814 C GLN A 231 31.845 97.838 16.477 1.00 17.51 C ATOM 1815 O GLN A 231 31.607 98.648 15.563 1.00 15.09 O ATOM 1816 CB GLN A 231 32.673 98.737 18.668 1.00 15.42 C ATOM 1817 CG GLN A 231 33.119 100.133 18.211 1.00 15.72 C ATOM 1818 CD GLN A 231 34.164 100.742 19.092 1.00 17.35 C ATOM 1819 OE1 GLN A 231 34.123 100.535 20.333 1.00 16.53 O ATOM 1820 NE2 GLN A 231 35.121 101.434 18.508 1.00 18.27 N ATOM 0 H GLN A 231 31.309 96.694 19.266 1.00 15.97 H new ATOM 0 HA GLN A 231 30.780 98.888 17.915 1.00 16.38 H new ATOM 0 HB2 GLN A 231 32.468 98.768 19.616 1.00 15.42 H new ATOM 0 HB3 GLN A 231 33.413 98.119 18.557 1.00 15.42 H new ATOM 0 HG2 GLN A 231 33.463 100.075 17.306 1.00 15.72 H new ATOM 0 HG3 GLN A 231 32.347 100.719 18.184 1.00 15.72 H new ATOM 0 HE21 GLN A 231 35.109 101.551 17.656 1.00 18.27 H new ATOM 0 HE22 GLN A 231 35.758 101.769 18.979 1.00 18.27 H new ATOM 1821 N LEU A 232 32.455 96.666 16.238 1.00 17.25 N ATOM 1822 CA LEU A 232 32.809 96.297 14.836 1.00 15.39 C ATOM 1823 C LEU A 232 31.541 96.245 13.983 1.00 16.59 C ATOM 1824 O LEU A 232 31.594 96.731 12.803 1.00 17.41 O ATOM 1825 CB LEU A 232 33.536 94.938 14.805 1.00 16.68 C ATOM 1826 CG LEU A 232 33.897 94.425 13.409 1.00 17.96 C ATOM 1827 CD1 LEU A 232 34.885 95.282 12.639 1.00 17.72 C ATOM 1828 CD2 LEU A 232 34.390 92.968 13.471 1.00 20.80 C ATOM 0 H LEU A 232 32.668 96.088 16.838 1.00 17.25 H new ATOM 0 HA LEU A 232 33.407 96.969 14.473 1.00 15.39 H new ATOM 0 HB2 LEU A 232 34.350 95.011 15.328 1.00 16.68 H new ATOM 0 HB3 LEU A 232 32.976 94.278 15.242 1.00 16.68 H new ATOM 0 HG LEU A 232 33.068 94.478 12.907 1.00 17.96 H new ATOM 0 HD11 LEU A 232 35.053 94.882 11.771 1.00 17.72 H new ATOM 0 HD12 LEU A 232 34.517 96.171 12.519 1.00 17.72 H new ATOM 0 HD13 LEU A 232 35.717 95.341 13.134 1.00 17.72 H new ATOM 0 HD21 LEU A 232 34.613 92.663 12.577 1.00 20.80 H new ATOM 0 HD22 LEU A 232 35.177 92.916 14.036 1.00 20.80 H new ATOM 0 HD23 LEU A 232 33.691 92.405 13.839 1.00 20.80 H new ATOM 1829 N LYS A 233 30.430 95.703 14.494 1.00 16.32 N ATOM 1830 CA LYS A 233 29.169 95.594 13.696 1.00 16.70 C ATOM 1831 C LYS A 233 28.699 97.023 13.339 1.00 17.98 C ATOM 1832 O LYS A 233 28.243 97.246 12.207 1.00 17.95 O ATOM 1833 CB LYS A 233 28.141 94.775 14.490 1.00 19.00 C ATOM 1834 CG LYS A 233 28.490 93.268 14.534 1.00 19.89 C ATOM 1835 CD LYS A 233 27.533 92.528 15.419 1.00 22.20 C ATOM 1836 CE LYS A 233 27.789 91.026 15.457 1.00 23.73 C ATOM 1837 NZ LYS A 233 26.842 90.415 16.434 1.00 25.40 N ATOM 0 H LYS A 233 30.372 95.391 15.293 1.00 16.32 H new ATOM 0 HA LYS A 233 29.302 95.121 12.860 1.00 16.70 H new ATOM 0 HB2 LYS A 233 28.088 95.118 15.396 1.00 19.00 H new ATOM 0 HB3 LYS A 233 27.264 94.889 14.092 1.00 19.00 H new ATOM 0 HG2 LYS A 233 28.461 92.898 13.638 1.00 19.89 H new ATOM 0 HG3 LYS A 233 29.396 93.151 14.860 1.00 19.89 H new ATOM 0 HD2 LYS A 233 27.594 92.883 16.320 1.00 22.20 H new ATOM 0 HD3 LYS A 233 26.627 92.688 15.111 1.00 22.20 H new ATOM 0 HE2 LYS A 233 27.663 90.639 14.577 1.00 23.73 H new ATOM 0 HE3 LYS A 233 28.706 90.846 15.717 1.00 23.73 H new ATOM 0 HZ1 LYS A 233 27.016 89.546 16.513 1.00 25.40 H new ATOM 0 HZ2 LYS A 233 26.937 90.809 17.226 1.00 25.40 H new ATOM 0 HZ3 LYS A 233 26.007 90.525 16.147 1.00 25.40 H new ATOM 1838 N LEU A 234 28.740 97.967 14.285 1.00 16.27 N ATOM 1839 CA LEU A 234 28.355 99.381 14.002 1.00 15.91 C ATOM 1840 C LEU A 234 29.261 99.937 12.905 1.00 16.70 C ATOM 1841 O LEU A 234 28.749 100.679 11.960 1.00 16.08 O ATOM 1842 CB LEU A 234 28.463 100.243 15.278 1.00 16.31 C ATOM 1843 CG LEU A 234 27.570 99.938 16.464 1.00 18.43 C ATOM 1844 CD1 LEU A 234 27.913 100.849 17.619 1.00 18.10 C ATOM 1845 CD2 LEU A 234 26.091 99.999 16.063 1.00 21.17 C ATOM 0 H LEU A 234 28.985 97.822 15.097 1.00 16.27 H new ATOM 0 HA LEU A 234 27.432 99.406 13.703 1.00 15.91 H new ATOM 0 HB2 LEU A 234 29.382 100.193 15.586 1.00 16.31 H new ATOM 0 HB3 LEU A 234 28.300 101.164 15.021 1.00 16.31 H new ATOM 0 HG LEU A 234 27.729 99.030 16.765 1.00 18.43 H new ATOM 0 HD11 LEU A 234 27.337 100.647 18.373 1.00 18.10 H new ATOM 0 HD12 LEU A 234 28.839 100.713 17.874 1.00 18.10 H new ATOM 0 HD13 LEU A 234 27.784 101.773 17.352 1.00 18.10 H new ATOM 0 HD21 LEU A 234 25.538 99.801 16.835 1.00 21.17 H new ATOM 0 HD22 LEU A 234 25.881 100.887 15.734 1.00 21.17 H new ATOM 0 HD23 LEU A 234 25.917 99.347 15.366 1.00 21.17 H new ATOM 1846 N ILE A 235 30.574 99.697 12.957 1.00 14.34 N ATOM 1847 CA ILE A 235 31.538 100.214 11.951 1.00 13.95 C ATOM 1848 C ILE A 235 31.205 99.610 10.571 1.00 16.05 C ATOM 1849 O ILE A 235 31.083 100.400 9.556 1.00 15.66 O ATOM 1850 CB ILE A 235 32.983 99.939 12.416 1.00 14.34 C ATOM 1851 CG1 ILE A 235 33.351 100.809 13.616 1.00 14.69 C ATOM 1852 CG2 ILE A 235 33.924 100.146 11.208 1.00 15.33 C ATOM 1853 CD1 ILE A 235 34.617 100.374 14.277 1.00 15.88 C ATOM 0 H ILE A 235 30.941 99.228 13.577 1.00 14.34 H new ATOM 0 HA ILE A 235 31.462 101.177 11.863 1.00 13.95 H new ATOM 0 HB ILE A 235 33.073 99.024 12.725 1.00 14.34 H new ATOM 0 HG12 ILE A 235 33.442 101.730 13.327 1.00 14.69 H new ATOM 0 HG13 ILE A 235 32.628 100.784 14.262 1.00 14.69 H new ATOM 0 HG21 ILE A 235 34.840 99.978 11.479 1.00 15.33 H new ATOM 0 HG22 ILE A 235 33.679 99.532 10.498 1.00 15.33 H new ATOM 0 HG23 ILE A 235 33.844 101.058 10.888 1.00 15.33 H new ATOM 0 HD11 ILE A 235 34.806 100.956 15.030 1.00 15.88 H new ATOM 0 HD12 ILE A 235 34.521 99.461 14.591 1.00 15.88 H new ATOM 0 HD13 ILE A 235 35.348 100.422 13.641 1.00 15.88 H new ATOM 1854 N LEU A 236 31.045 98.302 10.447 1.00 15.73 N ATOM 1855 CA LEU A 236 30.864 97.649 9.125 1.00 16.16 C ATOM 1856 C LEU A 236 29.502 98.032 8.548 1.00 17.66 C ATOM 1857 O LEU A 236 29.397 98.085 7.280 1.00 18.40 O ATOM 1858 CB LEU A 236 31.064 96.120 9.261 1.00 16.99 C ATOM 1859 CG LEU A 236 32.443 95.672 9.758 1.00 17.60 C ATOM 1860 CD1 LEU A 236 32.544 94.142 9.794 1.00 19.42 C ATOM 1861 CD2 LEU A 236 33.599 96.264 8.935 1.00 18.85 C ATOM 0 H LEU A 236 31.036 97.758 11.113 1.00 15.73 H new ATOM 0 HA LEU A 236 31.534 97.960 8.497 1.00 16.16 H new ATOM 0 HB2 LEU A 236 30.392 95.775 9.869 1.00 16.99 H new ATOM 0 HB3 LEU A 236 30.901 95.711 8.397 1.00 16.99 H new ATOM 0 HG LEU A 236 32.531 96.018 10.660 1.00 17.60 H new ATOM 0 HD11 LEU A 236 33.423 93.883 10.111 1.00 19.42 H new ATOM 0 HD12 LEU A 236 31.868 93.787 10.392 1.00 19.42 H new ATOM 0 HD13 LEU A 236 32.405 93.787 8.902 1.00 19.42 H new ATOM 0 HD21 LEU A 236 34.445 95.949 9.291 1.00 18.85 H new ATOM 0 HD22 LEU A 236 33.514 95.985 8.010 1.00 18.85 H new ATOM 0 HD23 LEU A 236 33.569 97.232 8.984 1.00 18.85 H new ATOM 1862 N ARG A 237 28.483 98.308 9.359 1.00 17.25 N ATOM 1863 CA ARG A 237 27.170 98.734 8.799 1.00 17.12 C ATOM 1864 C ARG A 237 27.370 100.082 8.092 1.00 18.97 C ATOM 1865 O ARG A 237 26.764 100.285 7.027 1.00 19.57 O ATOM 1866 CB ARG A 237 26.123 98.818 9.907 1.00 20.45 C ATOM 1867 CG ARG A 237 24.731 99.103 9.345 1.00 30.57 C ATOM 1868 CD ARG A 237 23.650 98.865 10.392 1.00 43.68 C ATOM 1869 NE ARG A 237 23.276 100.168 10.892 1.00 53.77 N ATOM 1870 CZ ARG A 237 22.273 100.916 10.431 1.00 55.16 C ATOM 1871 NH1 ARG A 237 21.441 100.471 9.494 1.00 59.23 N ATOM 1872 NH2 ARG A 237 22.112 102.124 10.928 1.00 46.29 N ATOM 0 H ARG A 237 28.515 98.261 10.217 1.00 17.25 H new ATOM 0 HA ARG A 237 26.843 98.085 8.156 1.00 17.12 H new ATOM 0 HB2 ARG A 237 26.108 97.985 10.403 1.00 20.45 H new ATOM 0 HB3 ARG A 237 26.369 99.516 10.533 1.00 20.45 H new ATOM 0 HG2 ARG A 237 24.687 100.021 9.035 1.00 30.57 H new ATOM 0 HG3 ARG A 237 24.569 98.536 8.575 1.00 30.57 H new ATOM 0 HD2 ARG A 237 22.886 98.411 10.003 1.00 43.68 H new ATOM 0 HD3 ARG A 237 23.981 98.301 11.109 1.00 43.68 H new ATOM 0 HE ARG A 237 23.739 100.488 11.542 1.00 53.77 H new ATOM 0 HH11 ARG A 237 21.542 99.681 9.169 1.00 59.23 H new ATOM 0 HH12 ARG A 237 20.802 100.973 9.213 1.00 59.23 H new ATOM 0 HH21 ARG A 237 22.647 102.414 11.536 1.00 46.29 H new ATOM 0 HH22 ARG A 237 21.472 102.624 10.645 1.00 46.29 H new ATOM 1873 N LEU A 238 28.169 101.006 8.592 1.00 17.08 N ATOM 1874 CA LEU A 238 28.383 102.322 7.927 1.00 16.50 C ATOM 1875 C LEU A 238 29.306 102.175 6.714 1.00 18.37 C ATOM 1876 O LEU A 238 28.988 102.736 5.639 1.00 18.18 O ATOM 1877 CB LEU A 238 28.949 103.349 8.933 1.00 17.24 C ATOM 1878 CG LEU A 238 29.272 104.728 8.337 1.00 17.74 C ATOM 1879 CD1 LEU A 238 27.945 105.432 8.001 1.00 19.52 C ATOM 1880 CD2 LEU A 238 30.053 105.600 9.287 1.00 20.52 C ATOM 0 H LEU A 238 28.610 100.907 9.324 1.00 17.08 H new ATOM 0 HA LEU A 238 27.526 102.648 7.610 1.00 16.50 H new ATOM 0 HB2 LEU A 238 28.309 103.464 9.653 1.00 17.24 H new ATOM 0 HB3 LEU A 238 29.757 102.984 9.328 1.00 17.24 H new ATOM 0 HG LEU A 238 29.819 104.591 7.548 1.00 17.74 H new ATOM 0 HD11 LEU A 238 28.129 106.306 7.623 1.00 19.52 H new ATOM 0 HD12 LEU A 238 27.450 104.900 7.359 1.00 19.52 H new ATOM 0 HD13 LEU A 238 27.419 105.534 8.810 1.00 19.52 H new ATOM 0 HD21 LEU A 238 30.232 106.456 8.868 1.00 20.52 H new ATOM 0 HD22 LEU A 238 29.538 105.739 10.097 1.00 20.52 H new ATOM 0 HD23 LEU A 238 30.892 105.167 9.508 1.00 20.52 H new ATOM 1881 N VAL A 239 30.507 101.586 6.862 1.00 16.68 N ATOM 1882 CA VAL A 239 31.591 101.628 5.829 1.00 16.80 C ATOM 1883 C VAL A 239 31.560 100.425 4.879 1.00 17.03 C ATOM 1884 O VAL A 239 32.321 100.462 3.883 1.00 20.84 O ATOM 1885 CB VAL A 239 32.975 101.886 6.456 1.00 16.94 C ATOM 1886 CG1 VAL A 239 32.937 103.125 7.340 1.00 17.51 C ATOM 1887 CG2 VAL A 239 33.520 100.633 7.180 1.00 19.32 C ATOM 0 H VAL A 239 30.726 101.145 7.567 1.00 16.68 H new ATOM 0 HA VAL A 239 31.408 102.394 5.263 1.00 16.80 H new ATOM 0 HB VAL A 239 33.608 102.068 5.744 1.00 16.94 H new ATOM 0 HG11 VAL A 239 33.814 103.274 7.727 1.00 17.51 H new ATOM 0 HG12 VAL A 239 32.684 103.895 6.807 1.00 17.51 H new ATOM 0 HG13 VAL A 239 32.289 102.996 8.050 1.00 17.51 H new ATOM 0 HG21 VAL A 239 34.390 100.832 7.561 1.00 19.32 H new ATOM 0 HG22 VAL A 239 32.908 100.376 7.888 1.00 19.32 H new ATOM 0 HG23 VAL A 239 33.604 99.904 6.546 1.00 19.32 H new ATOM 1888 N GLY A 240 30.828 99.384 5.214 1.00 16.40 N ATOM 1889 CA GLY A 240 30.713 98.142 4.448 1.00 16.77 C ATOM 1890 C GLY A 240 31.687 97.076 4.943 1.00 18.35 C ATOM 1891 O GLY A 240 32.698 97.395 5.630 1.00 19.82 O ATOM 0 H GLY A 240 30.355 99.373 5.932 1.00 16.40 H new ATOM 0 HA2 GLY A 240 29.806 97.805 4.512 1.00 16.77 H new ATOM 0 HA3 GLY A 240 30.882 98.324 3.510 1.00 16.77 H new ATOM 1892 N THR A 241 31.374 95.807 4.629 1.00 19.77 N ATOM 1893 CA THR A 241 32.306 94.703 4.952 1.00 19.08 C ATOM 1894 C THR A 241 33.526 94.760 4.033 1.00 20.33 C ATOM 1895 O THR A 241 33.478 95.252 2.915 1.00 24.34 O ATOM 1896 CB THR A 241 31.554 93.371 4.862 1.00 19.82 C ATOM 1897 OG1 THR A 241 30.751 93.285 3.689 1.00 20.13 O ATOM 1898 CG2 THR A 241 30.585 93.214 6.019 1.00 19.86 C ATOM 0 H THR A 241 30.647 95.566 4.239 1.00 19.77 H new ATOM 0 HA THR A 241 32.639 94.792 5.859 1.00 19.08 H new ATOM 0 HB THR A 241 32.243 92.688 4.864 1.00 19.82 H new ATOM 0 HG1 THR A 241 31.219 93.009 3.049 1.00 20.13 H new ATOM 0 HG21 THR A 241 30.122 92.365 5.941 1.00 19.86 H new ATOM 0 HG22 THR A 241 31.074 93.239 6.856 1.00 19.86 H new ATOM 0 HG23 THR A 241 29.939 93.937 6.001 1.00 19.86 H new ATOM 1899 N PRO A 242 34.653 94.190 4.479 1.00 20.01 N ATOM 1900 CA PRO A 242 35.874 94.189 3.679 1.00 22.21 C ATOM 1901 C PRO A 242 35.760 93.323 2.434 1.00 24.23 C ATOM 1902 O PRO A 242 35.091 92.312 2.446 1.00 23.79 O ATOM 1903 CB PRO A 242 36.938 93.600 4.562 1.00 23.90 C ATOM 1904 CG PRO A 242 36.266 92.993 5.632 1.00 25.26 C ATOM 1905 CD PRO A 242 34.872 93.586 5.785 1.00 21.74 C ATOM 0 HA PRO A 242 36.065 95.092 3.381 1.00 22.21 H new ATOM 0 HB2 PRO A 242 37.472 92.952 4.076 1.00 23.90 H new ATOM 0 HB3 PRO A 242 37.545 94.287 4.879 1.00 23.90 H new ATOM 0 HG2 PRO A 242 36.203 92.037 5.482 1.00 25.26 H new ATOM 0 HG3 PRO A 242 36.770 93.119 6.451 1.00 25.26 H new ATOM 0 HD2 PRO A 242 34.209 92.907 5.986 1.00 21.74 H new ATOM 0 HD3 PRO A 242 34.833 94.241 6.499 1.00 21.74 H new ATOM 1906 N GLY A 243 36.442 93.814 1.380 1.00 30.49 N ATOM 1907 CA GLY A 243 36.689 93.071 0.140 1.00 33.95 C ATOM 1908 C GLY A 243 37.975 92.253 0.209 1.00 37.48 C ATOM 1909 O GLY A 243 38.672 92.308 1.226 1.00 28.38 O ATOM 0 H GLY A 243 36.778 94.606 1.373 1.00 30.49 H new ATOM 0 HA2 GLY A 243 35.940 92.480 -0.036 1.00 33.95 H new ATOM 0 HA3 GLY A 243 36.741 93.692 -0.603 1.00 33.95 H new ATOM 1910 N ALA A 244 38.268 91.467 -0.836 1.00 37.76 N ATOM 1911 CA ALA A 244 39.320 90.424 -0.840 1.00 35.59 C ATOM 1912 C ALA A 244 40.676 91.086 -0.579 1.00 27.98 C ATOM 1913 O ALA A 244 41.564 90.563 0.114 1.00 29.23 O ATOM 1914 CB ALA A 244 39.314 89.720 -2.194 1.00 41.20 C ATOM 0 H ALA A 244 37.851 91.524 -1.586 1.00 37.76 H new ATOM 0 HA ALA A 244 39.153 89.768 -0.146 1.00 35.59 H new ATOM 0 HB1 ALA A 244 40.000 89.035 -2.206 1.00 41.20 H new ATOM 0 HB2 ALA A 244 38.447 89.311 -2.343 1.00 41.20 H new ATOM 0 HB3 ALA A 244 39.491 90.366 -2.896 1.00 41.20 H new ATOM 1915 N GLU A 245 40.809 92.280 -1.113 1.00 30.98 N ATOM 1916 CA GLU A 245 42.056 93.043 -1.012 1.00 32.45 C ATOM 1917 C GLU A 245 42.413 93.399 0.428 1.00 28.63 C ATOM 1918 O GLU A 245 43.546 93.226 0.819 1.00 28.57 O ATOM 1919 CB GLU A 245 41.808 94.282 -1.846 1.00 36.47 C ATOM 1920 CG GLU A 245 43.051 95.025 -2.177 1.00 37.97 C ATOM 1921 CD GLU A 245 42.712 96.278 -2.973 1.00 43.67 C ATOM 1922 OE1 GLU A 245 41.662 96.281 -3.676 1.00 45.22 O ATOM 1923 OE2 GLU A 245 43.440 97.275 -2.830 1.00 39.30 O ATOM 0 H GLU A 245 40.184 92.681 -1.547 1.00 30.98 H new ATOM 0 HA GLU A 245 42.815 92.527 -1.327 1.00 32.45 H new ATOM 0 HB2 GLU A 245 41.362 94.027 -2.669 1.00 36.47 H new ATOM 0 HB3 GLU A 245 41.204 94.871 -1.367 1.00 36.47 H new ATOM 0 HG2 GLU A 245 43.519 95.267 -1.362 1.00 37.97 H new ATOM 0 HG3 GLU A 245 43.649 94.459 -2.690 1.00 37.97 H new ATOM 1924 N LEU A 246 41.457 93.915 1.235 1.00 25.34 N ATOM 1925 CA LEU A 246 41.773 94.149 2.641 1.00 23.11 C ATOM 1926 C LEU A 246 41.950 92.806 3.405 1.00 23.37 C ATOM 1927 O LEU A 246 42.781 92.761 4.272 1.00 25.31 O ATOM 1928 CB LEU A 246 40.665 95.032 3.277 1.00 24.02 C ATOM 1929 CG LEU A 246 40.834 95.302 4.758 1.00 25.46 C ATOM 1930 CD1 LEU A 246 42.176 95.921 5.137 1.00 24.70 C ATOM 1931 CD2 LEU A 246 39.713 96.200 5.221 1.00 27.95 C ATOM 0 H LEU A 246 40.659 94.124 0.992 1.00 25.34 H new ATOM 0 HA LEU A 246 42.618 94.621 2.705 1.00 23.11 H new ATOM 0 HB2 LEU A 246 40.638 95.881 2.808 1.00 24.02 H new ATOM 0 HB3 LEU A 246 39.807 94.602 3.136 1.00 24.02 H new ATOM 0 HG LEU A 246 40.808 94.439 5.201 1.00 25.46 H new ATOM 0 HD11 LEU A 246 42.208 96.063 6.096 1.00 24.70 H new ATOM 0 HD12 LEU A 246 42.894 95.323 4.875 1.00 24.70 H new ATOM 0 HD13 LEU A 246 42.281 96.771 4.681 1.00 24.70 H new ATOM 0 HD21 LEU A 246 39.812 96.379 6.169 1.00 27.95 H new ATOM 0 HD22 LEU A 246 39.744 97.036 4.730 1.00 27.95 H new ATOM 0 HD23 LEU A 246 38.862 95.763 5.062 1.00 27.95 H new ATOM 1932 N LEU A 247 41.125 91.783 3.163 1.00 24.58 N ATOM 1933 CA LEU A 247 41.162 90.492 3.902 1.00 28.56 C ATOM 1934 C LEU A 247 42.567 89.882 3.824 1.00 28.16 C ATOM 1935 O LEU A 247 43.027 89.389 4.850 1.00 31.12 O ATOM 1936 CB LEU A 247 40.121 89.548 3.320 1.00 30.84 C ATOM 1937 CG LEU A 247 38.712 89.803 3.827 1.00 32.14 C ATOM 1938 CD1 LEU A 247 37.700 89.081 2.946 1.00 34.40 C ATOM 1939 CD2 LEU A 247 38.592 89.365 5.288 1.00 35.69 C ATOM 0 H LEU A 247 40.515 91.811 2.557 1.00 24.58 H new ATOM 0 HA LEU A 247 40.954 90.644 4.837 1.00 28.56 H new ATOM 0 HB2 LEU A 247 40.128 89.629 2.353 1.00 30.84 H new ATOM 0 HB3 LEU A 247 40.371 88.635 3.530 1.00 30.84 H new ATOM 0 HG LEU A 247 38.523 90.753 3.783 1.00 32.14 H new ATOM 0 HD11 LEU A 247 36.804 89.249 3.277 1.00 34.40 H new ATOM 0 HD12 LEU A 247 37.774 89.406 2.035 1.00 34.40 H new ATOM 0 HD13 LEU A 247 37.877 88.127 2.964 1.00 34.40 H new ATOM 0 HD21 LEU A 247 37.690 89.531 5.603 1.00 35.69 H new ATOM 0 HD22 LEU A 247 38.789 88.418 5.359 1.00 35.69 H new ATOM 0 HD23 LEU A 247 39.221 89.867 5.829 1.00 35.69 H new ATOM 1940 N LYS A 248 43.219 90.037 2.689 1.00 28.34 N ATOM 1941 CA LYS A 248 44.627 89.554 2.465 1.00 33.67 C ATOM 1942 C LYS A 248 45.619 90.249 3.421 1.00 37.41 C ATOM 1943 O LYS A 248 46.659 89.637 3.767 1.00 35.93 O ATOM 1944 CB LYS A 248 45.018 89.803 1.005 1.00 36.32 C ATOM 1945 CG LYS A 248 44.524 88.751 0.017 1.00 46.78 C ATOM 0 H LYS A 248 42.877 90.426 2.003 1.00 28.34 H new ATOM 0 HA LYS A 248 44.665 88.603 2.653 1.00 33.67 H new ATOM 0 HB2 LYS A 248 44.673 90.668 0.735 1.00 36.32 H new ATOM 0 HB3 LYS A 248 45.985 89.853 0.947 1.00 36.32 H new ATOM 1946 N LYS A 249 45.352 91.487 3.867 1.00 31.13 N ATOM 1947 CA LYS A 249 46.247 92.274 4.757 1.00 31.28 C ATOM 1948 C LYS A 249 46.075 91.980 6.244 1.00 31.12 C ATOM 1949 O LYS A 249 46.924 92.453 7.044 1.00 33.37 O ATOM 1950 CB LYS A 249 45.986 93.757 4.503 1.00 31.13 C ATOM 1951 CG LYS A 249 46.205 94.184 3.093 1.00 29.54 C ATOM 1952 CD LYS A 249 45.929 95.673 2.853 1.00 33.47 C ATOM 1953 CE LYS A 249 45.771 95.923 1.374 1.00 32.42 C ATOM 1954 NZ LYS A 249 45.724 97.358 0.993 1.00 27.14 N ATOM 0 H LYS A 249 44.631 91.907 3.659 1.00 31.13 H new ATOM 0 HA LYS A 249 47.157 92.018 4.541 1.00 31.28 H new ATOM 0 HB2 LYS A 249 45.072 93.961 4.754 1.00 31.13 H new ATOM 0 HB3 LYS A 249 46.562 94.280 5.082 1.00 31.13 H new ATOM 0 HG2 LYS A 249 47.121 93.988 2.842 1.00 29.54 H new ATOM 0 HG3 LYS A 249 45.633 93.659 2.511 1.00 29.54 H new ATOM 0 HD2 LYS A 249 45.125 95.943 3.324 1.00 33.47 H new ATOM 0 HD3 LYS A 249 46.658 96.208 3.205 1.00 33.47 H new ATOM 0 HE2 LYS A 249 46.507 95.500 0.906 1.00 32.42 H new ATOM 0 HE3 LYS A 249 44.957 95.493 1.070 1.00 32.42 H new ATOM 0 HZ1 LYS A 249 45.820 97.435 0.112 1.00 27.14 H new ATOM 0 HZ2 LYS A 249 44.942 97.705 1.237 1.00 27.14 H new ATOM 0 HZ3 LYS A 249 46.382 97.796 1.402 1.00 27.14 H new ATOM 1955 N ILE A 250 45.007 91.269 6.626 1.00 31.89 N ATOM 1956 CA ILE A 250 44.742 90.815 8.018 1.00 33.63 C ATOM 1957 C ILE A 250 45.563 89.542 8.292 1.00 39.72 C ATOM 1958 O ILE A 250 45.232 88.490 7.705 1.00 35.14 O ATOM 1959 CB ILE A 250 43.230 90.618 8.199 1.00 31.49 C ATOM 1960 CG1 ILE A 250 42.508 91.952 7.926 1.00 34.60 C ATOM 1961 CG2 ILE A 250 42.926 90.046 9.567 1.00 34.61 C ATOM 1962 CD1 ILE A 250 41.020 91.921 8.165 1.00 33.05 C ATOM 0 H ILE A 250 44.395 91.027 6.073 1.00 31.89 H new ATOM 0 HA ILE A 250 45.020 91.477 8.670 1.00 33.63 H new ATOM 0 HB ILE A 250 42.898 89.970 7.558 1.00 31.49 H new ATOM 0 HG12 ILE A 250 42.900 92.639 8.488 1.00 34.60 H new ATOM 0 HG13 ILE A 250 42.670 92.212 7.006 1.00 34.60 H new ATOM 0 HG21 ILE A 250 41.968 89.929 9.663 1.00 34.61 H new ATOM 0 HG22 ILE A 250 43.368 89.188 9.665 1.00 34.61 H new ATOM 0 HG23 ILE A 250 43.247 90.654 10.251 1.00 34.61 H new ATOM 0 HD11 ILE A 250 40.643 92.794 7.972 1.00 33.05 H new ATOM 0 HD12 ILE A 250 40.613 91.258 7.586 1.00 33.05 H new ATOM 0 HD13 ILE A 250 40.846 91.692 9.091 1.00 33.05 H new ATOM 1963 N SER A 251 46.515 89.624 9.230 1.00 50.23 N ATOM 1964 CA SER A 251 47.581 88.624 9.522 1.00 51.12 C ATOM 1965 C SER A 251 47.041 87.464 10.350 1.00 55.00 C ATOM 1966 O SER A 251 47.471 86.344 10.086 1.00 51.55 O ATOM 1967 CB SER A 251 48.755 89.257 10.222 1.00 55.30 C ATOM 1968 OG SER A 251 49.157 90.440 9.544 1.00 49.63 O ATOM 0 H SER A 251 46.567 90.306 9.751 1.00 50.23 H new ATOM 0 HA SER A 251 47.886 88.277 8.669 1.00 51.12 H new ATOM 0 HB2 SER A 251 48.518 89.467 11.139 1.00 55.30 H new ATOM 0 HB3 SER A 251 49.494 88.630 10.257 1.00 55.30 H new ATOM 0 HG SER A 251 49.811 90.784 9.944 1.00 49.63 H new ATOM 1969 N SER A 252 46.157 87.717 11.320 1.00 45.68 N ATOM 1970 CA SER A 252 45.481 86.657 12.106 1.00 49.85 C ATOM 1971 C SER A 252 44.510 85.952 11.171 1.00 52.25 C ATOM 1972 O SER A 252 43.615 86.659 10.656 1.00 40.89 O ATOM 1973 CB SER A 252 44.779 87.212 13.343 1.00 47.17 C ATOM 1974 OG SER A 252 43.825 86.286 13.828 1.00 57.36 O ATOM 0 H SER A 252 45.926 88.514 11.548 1.00 45.68 H new ATOM 0 HA SER A 252 46.137 86.029 12.448 1.00 49.85 H new ATOM 0 HB2 SER A 252 45.432 87.403 14.034 1.00 47.17 H new ATOM 0 HB3 SER A 252 44.342 88.050 13.125 1.00 47.17 H new ATOM 0 HG SER A 252 43.448 86.603 14.508 1.00 57.36 H new ATOM 1975 N GLU A 253 44.731 84.654 10.927 1.00 42.26 N ATOM 1976 CA GLU A 253 43.780 83.705 10.285 1.00 49.32 C ATOM 1977 C GLU A 253 42.443 83.695 11.032 1.00 43.01 C ATOM 1978 O GLU A 253 41.379 83.540 10.374 1.00 43.43 O ATOM 1979 CB GLU A 253 44.332 82.269 10.245 1.00 56.17 C ATOM 1980 CG GLU A 253 43.434 81.289 9.481 1.00 62.07 C ATOM 1981 CD GLU A 253 43.904 79.844 9.341 1.00 72.75 C ATOM 1982 OE1 GLU A 253 44.929 79.489 9.964 1.00 69.26 O ATOM 1983 OE2 GLU A 253 43.234 79.066 8.600 1.00 70.73 O ATOM 0 H GLU A 253 45.474 84.276 11.139 1.00 42.26 H new ATOM 0 HA GLU A 253 43.653 84.013 9.374 1.00 49.32 H new ATOM 0 HB2 GLU A 253 45.210 82.279 9.834 1.00 56.17 H new ATOM 0 HB3 GLU A 253 44.448 81.949 11.153 1.00 56.17 H new ATOM 0 HG2 GLU A 253 42.568 81.278 9.917 1.00 62.07 H new ATOM 0 HG3 GLU A 253 43.298 81.645 8.589 1.00 62.07 H new ATOM 1984 N SER A 254 42.442 83.683 12.369 1.00 43.98 N ATOM 1985 CA SER A 254 41.155 83.601 13.107 1.00 43.72 C ATOM 1986 C SER A 254 40.385 84.920 12.905 1.00 30.47 C ATOM 1987 O SER A 254 39.184 84.797 12.687 1.00 38.79 O ATOM 1988 CB SER A 254 41.353 83.272 14.559 1.00 42.79 C ATOM 1989 OG SER A 254 42.408 84.054 15.082 1.00 46.67 O ATOM 0 H SER A 254 43.146 83.720 12.862 1.00 43.98 H new ATOM 0 HA SER A 254 40.628 82.869 12.749 1.00 43.72 H new ATOM 0 HB2 SER A 254 40.536 83.442 15.053 1.00 42.79 H new ATOM 0 HB3 SER A 254 41.555 82.329 14.662 1.00 42.79 H new ATOM 0 HG SER A 254 42.545 84.713 14.579 1.00 46.67 H new ATOM 1990 N ALA A 255 41.065 86.064 12.954 1.00 38.95 N ATOM 1991 CA ALA A 255 40.426 87.385 12.650 1.00 32.84 C ATOM 1992 C ALA A 255 39.859 87.350 11.222 1.00 33.78 C ATOM 1993 O ALA A 255 38.664 87.696 11.040 1.00 33.02 O ATOM 1994 CB ALA A 255 41.370 88.508 12.901 1.00 35.57 C ATOM 0 H ALA A 255 41.899 86.115 13.160 1.00 38.95 H new ATOM 0 HA ALA A 255 39.681 87.546 13.250 1.00 32.84 H new ATOM 0 HB1 ALA A 255 40.933 89.350 12.697 1.00 35.57 H new ATOM 0 HB2 ALA A 255 41.640 88.502 13.833 1.00 35.57 H new ATOM 0 HB3 ALA A 255 42.153 88.405 12.337 1.00 35.57 H new ATOM 1995 N ARG A 256 40.601 86.851 10.224 1.00 36.75 N ATOM 1996 CA ARG A 256 40.043 86.693 8.840 1.00 36.33 C ATOM 1997 C ARG A 256 38.844 85.750 8.788 1.00 37.28 C ATOM 1998 O ARG A 256 37.795 86.093 8.190 1.00 32.63 O ATOM 1999 CB ARG A 256 41.051 86.098 7.855 1.00 40.85 C ATOM 2000 CG ARG A 256 42.027 87.096 7.264 1.00 39.42 C ATOM 2001 CD ARG A 256 42.878 86.519 6.103 1.00 36.78 C ATOM 2002 NE ARG A 256 43.283 85.113 6.295 1.00 43.20 N ATOM 2003 CZ ARG A 256 44.453 84.696 6.808 1.00 50.99 C ATOM 2004 NH1 ARG A 256 45.365 85.558 7.221 1.00 48.93 N ATOM 2005 NH2 ARG A 256 44.706 83.402 6.942 1.00 54.89 N ATOM 0 H ARG A 256 41.418 86.598 10.311 1.00 36.75 H new ATOM 0 HA ARG A 256 39.797 87.599 8.595 1.00 36.33 H new ATOM 0 HB2 ARG A 256 41.553 85.402 8.307 1.00 40.85 H new ATOM 0 HB3 ARG A 256 40.565 85.673 7.131 1.00 40.85 H new ATOM 0 HG2 ARG A 256 41.534 87.867 6.942 1.00 39.42 H new ATOM 0 HG3 ARG A 256 42.620 87.411 7.964 1.00 39.42 H new ATOM 0 HD2 ARG A 256 42.373 86.590 5.278 1.00 36.78 H new ATOM 0 HD3 ARG A 256 43.674 87.063 5.996 1.00 36.78 H new ATOM 0 HE ARG A 256 42.721 84.507 6.058 1.00 43.20 H new ATOM 0 HH11 ARG A 256 45.215 86.403 7.164 1.00 48.93 H new ATOM 0 HH12 ARG A 256 46.109 85.274 7.547 1.00 48.93 H new ATOM 0 HH21 ARG A 256 44.119 82.822 6.700 1.00 54.89 H new ATOM 0 HH22 ARG A 256 45.457 83.143 7.271 1.00 54.89 H new ATOM 2006 N ASN A 257 38.917 84.572 9.432 1.00 33.92 N ATOM 2007 CA ASN A 257 37.760 83.648 9.498 1.00 37.81 C ATOM 2008 C ASN A 257 36.550 84.331 10.134 1.00 30.94 C ATOM 2009 O ASN A 257 35.392 84.042 9.712 1.00 35.48 O ATOM 2010 CB ASN A 257 38.039 82.366 10.309 1.00 40.89 C ATOM 2011 CG ASN A 257 38.445 81.207 9.442 1.00 45.28 C ATOM 2012 OD1 ASN A 257 37.908 81.035 8.357 1.00 53.67 O ATOM 2013 ND2 ASN A 257 39.426 80.447 9.893 1.00 45.59 N ATOM 0 H ASN A 257 39.622 84.288 9.835 1.00 33.92 H new ATOM 0 HA ASN A 257 37.586 83.402 8.576 1.00 37.81 H new ATOM 0 HB2 ASN A 257 38.741 82.543 10.955 1.00 40.89 H new ATOM 0 HB3 ASN A 257 37.245 82.126 10.811 1.00 40.89 H new ATOM 0 HD21 ASN A 257 39.717 79.793 9.416 1.00 45.59 H new ATOM 0 HD22 ASN A 257 39.774 80.606 10.663 1.00 45.59 H new ATOM 2014 N TYR A 258 36.781 85.090 11.218 1.00 29.13 N ATOM 2015 CA TYR A 258 35.639 85.710 11.894 1.00 26.59 C ATOM 2016 C TYR A 258 34.983 86.709 10.904 1.00 24.18 C ATOM 2017 O TYR A 258 33.813 86.708 10.759 1.00 25.57 O ATOM 2018 CB TYR A 258 35.996 86.313 13.255 1.00 24.85 C ATOM 2019 CG TYR A 258 34.813 87.060 13.782 1.00 24.06 C ATOM 2020 CD1 TYR A 258 33.627 86.429 14.138 1.00 22.49 C ATOM 2021 CD2 TYR A 258 34.795 88.447 13.841 1.00 23.47 C ATOM 2022 CE1 TYR A 258 32.493 87.079 14.545 1.00 24.10 C ATOM 2023 CE2 TYR A 258 33.657 89.124 14.244 1.00 22.82 C ATOM 2024 CZ TYR A 258 32.494 88.478 14.584 1.00 21.27 C ATOM 2025 OH TYR A 258 31.363 89.113 14.944 1.00 22.89 O ATOM 0 H TYR A 258 37.553 85.250 11.561 1.00 29.13 H new ATOM 0 HA TYR A 258 34.987 85.031 12.127 1.00 26.59 H new ATOM 0 HB2 TYR A 258 36.253 85.612 13.875 1.00 24.85 H new ATOM 0 HB3 TYR A 258 36.757 86.908 13.168 1.00 24.85 H new ATOM 0 HD1 TYR A 258 33.602 85.500 14.097 1.00 22.49 H new ATOM 0 HD2 TYR A 258 35.557 88.927 13.607 1.00 23.47 H new ATOM 0 HE1 TYR A 258 31.735 86.599 14.791 1.00 24.10 H new ATOM 0 HE2 TYR A 258 33.681 90.053 14.286 1.00 22.82 H new ATOM 0 HH TYR A 258 31.491 89.943 14.930 1.00 22.89 H new ATOM 2026 N ILE A 259 35.781 87.589 10.303 1.00 28.93 N ATOM 2027 CA ILE A 259 35.148 88.604 9.374 1.00 30.51 C ATOM 2028 C ILE A 259 34.302 87.934 8.303 1.00 29.63 C ATOM 2029 O ILE A 259 33.209 88.447 7.956 1.00 29.55 O ATOM 2030 CB ILE A 259 36.226 89.432 8.690 1.00 34.09 C ATOM 2031 CG1 ILE A 259 36.895 90.339 9.695 1.00 37.24 C ATOM 2032 CG2 ILE A 259 35.641 90.238 7.513 1.00 36.83 C ATOM 2033 CD1 ILE A 259 38.236 90.749 9.199 1.00 36.97 C ATOM 0 H ILE A 259 36.635 87.638 10.393 1.00 28.93 H new ATOM 0 HA ILE A 259 34.577 89.172 9.915 1.00 30.51 H new ATOM 0 HB ILE A 259 36.895 88.831 8.325 1.00 34.09 H new ATOM 0 HG12 ILE A 259 36.346 91.123 9.850 1.00 37.24 H new ATOM 0 HG13 ILE A 259 36.983 89.882 10.546 1.00 37.24 H new ATOM 0 HG21 ILE A 259 36.345 90.757 7.094 1.00 36.83 H new ATOM 0 HG22 ILE A 259 35.257 89.629 6.863 1.00 36.83 H new ATOM 0 HG23 ILE A 259 34.951 90.836 7.841 1.00 36.83 H new ATOM 0 HD11 ILE A 259 38.658 91.331 9.850 1.00 36.97 H new ATOM 0 HD12 ILE A 259 38.786 89.962 9.065 1.00 36.97 H new ATOM 0 HD13 ILE A 259 38.139 91.222 8.358 1.00 36.97 H new ATOM 2034 N GLN A 260 34.810 86.835 7.741 1.00 33.62 N ATOM 2035 CA GLN A 260 34.134 86.065 6.667 1.00 35.52 C ATOM 2036 C GLN A 260 32.870 85.373 7.155 1.00 36.31 C ATOM 2037 O GLN A 260 32.011 85.054 6.319 1.00 35.12 O ATOM 2038 CB GLN A 260 35.157 85.116 6.051 1.00 40.37 C ATOM 2039 CG GLN A 260 36.282 85.908 5.402 1.00 44.55 C ATOM 2040 CD GLN A 260 37.154 85.026 4.554 1.00 53.68 C ATOM 2041 OE1 GLN A 260 38.137 84.443 5.023 1.00 59.91 O ATOM 2042 NE2 GLN A 260 36.742 84.883 3.306 1.00 55.52 N ATOM 0 H GLN A 260 35.569 86.503 7.971 1.00 33.62 H new ATOM 0 HA GLN A 260 33.816 86.667 5.976 1.00 35.52 H new ATOM 0 HB2 GLN A 260 35.517 84.530 6.735 1.00 40.37 H new ATOM 0 HB3 GLN A 260 34.727 84.551 5.390 1.00 40.37 H new ATOM 0 HG2 GLN A 260 35.908 86.617 4.856 1.00 44.55 H new ATOM 0 HG3 GLN A 260 36.819 86.333 6.089 1.00 44.55 H new ATOM 0 HE21 GLN A 260 36.050 85.313 3.030 1.00 55.52 H new ATOM 0 HE22 GLN A 260 37.166 84.360 2.771 1.00 55.52 H new ATOM 2043 N SER A 261 32.663 85.231 8.464 1.00 30.59 N ATOM 2044 CA SER A 261 31.394 84.684 8.992 1.00 30.86 C ATOM 2045 C SER A 261 30.265 85.724 8.936 1.00 29.35 C ATOM 2046 O SER A 261 29.098 85.339 9.141 1.00 32.17 O ATOM 2047 CB SER A 261 31.602 84.166 10.421 1.00 28.88 C ATOM 2048 OG SER A 261 31.538 85.221 11.368 1.00 28.71 O ATOM 0 H SER A 261 33.238 85.442 9.068 1.00 30.59 H new ATOM 0 HA SER A 261 31.124 83.942 8.429 1.00 30.86 H new ATOM 0 HB2 SER A 261 30.926 83.502 10.628 1.00 28.88 H new ATOM 0 HB3 SER A 261 32.463 83.724 10.485 1.00 28.88 H new ATOM 0 HG SER A 261 32.203 85.725 11.272 1.00 28.71 H new ATOM 2049 N LEU A 262 30.568 87.026 8.708 1.00 25.63 N ATOM 2050 CA LEU A 262 29.510 88.063 8.707 1.00 26.41 C ATOM 2051 C LEU A 262 28.897 88.199 7.284 1.00 23.86 C ATOM 2052 O LEU A 262 29.688 88.237 6.338 1.00 26.09 O ATOM 2053 CB LEU A 262 30.134 89.384 9.189 1.00 24.64 C ATOM 2054 CG LEU A 262 30.847 89.362 10.557 1.00 27.42 C ATOM 2055 CD1 LEU A 262 31.390 90.741 10.892 1.00 27.19 C ATOM 2056 CD2 LEU A 262 29.847 88.946 11.618 1.00 28.87 C ATOM 0 H LEU A 262 31.362 87.320 8.556 1.00 25.63 H new ATOM 0 HA LEU A 262 28.787 87.818 9.306 1.00 26.41 H new ATOM 0 HB2 LEU A 262 30.773 89.678 8.521 1.00 24.64 H new ATOM 0 HB3 LEU A 262 29.433 90.053 9.225 1.00 24.64 H new ATOM 0 HG LEU A 262 31.587 88.735 10.525 1.00 27.42 H new ATOM 0 HD11 LEU A 262 31.835 90.713 11.753 1.00 27.19 H new ATOM 0 HD12 LEU A 262 32.023 91.014 10.210 1.00 27.19 H new ATOM 0 HD13 LEU A 262 30.659 91.377 10.927 1.00 27.19 H new ATOM 0 HD21 LEU A 262 30.283 88.928 12.484 1.00 28.87 H new ATOM 0 HD22 LEU A 262 29.114 89.581 11.638 1.00 28.87 H new ATOM 0 HD23 LEU A 262 29.504 88.063 11.411 1.00 28.87 H new ATOM 2057 N ALA A 263 27.604 88.378 7.202 1.00 24.97 N ATOM 2058 CA ALA A 263 26.887 88.662 5.943 1.00 26.56 C ATOM 2059 C ALA A 263 27.499 89.928 5.324 1.00 27.31 C ATOM 2060 O ALA A 263 27.718 90.889 6.056 1.00 26.44 O ATOM 2061 CB ALA A 263 25.421 88.839 6.183 1.00 30.74 C ATOM 0 H ALA A 263 27.085 88.340 7.887 1.00 24.97 H new ATOM 0 HA ALA A 263 26.983 87.913 5.334 1.00 26.56 H new ATOM 0 HB1 ALA A 263 24.975 89.024 5.342 1.00 30.74 H new ATOM 0 HB2 ALA A 263 25.056 88.028 6.570 1.00 30.74 H new ATOM 0 HB3 ALA A 263 25.280 89.580 6.793 1.00 30.74 H new ATOM 2062 N GLN A 264 27.691 89.952 4.015 1.00 27.26 N ATOM 2063 CA GLN A 264 28.252 91.140 3.328 1.00 25.87 C ATOM 2064 C GLN A 264 27.236 92.305 3.380 1.00 24.24 C ATOM 2065 O GLN A 264 25.984 92.119 3.403 1.00 25.88 O ATOM 2066 CB GLN A 264 28.734 90.701 1.942 1.00 29.54 C ATOM 2067 CG GLN A 264 29.886 89.685 2.029 1.00 30.65 C ATOM 2068 CD GLN A 264 30.614 89.373 0.742 1.00 37.92 C ATOM 2069 OE1 GLN A 264 31.331 90.211 0.166 1.00 37.43 O ATOM 2070 NE2 GLN A 264 30.425 88.142 0.268 1.00 32.80 N ATOM 0 H GLN A 264 27.507 89.295 3.492 1.00 27.26 H new ATOM 0 HA GLN A 264 29.035 91.504 3.771 1.00 25.87 H new ATOM 0 HB2 GLN A 264 27.994 90.309 1.452 1.00 29.54 H new ATOM 0 HB3 GLN A 264 29.026 91.478 1.441 1.00 29.54 H new ATOM 0 HG2 GLN A 264 30.534 90.016 2.671 1.00 30.65 H new ATOM 0 HG3 GLN A 264 29.532 88.855 2.385 1.00 30.65 H new ATOM 0 HE21 GLN A 264 29.922 87.590 0.694 1.00 32.80 H new ATOM 0 HE22 GLN A 264 30.806 87.900 -0.464 1.00 32.80 H new ATOM 2071 N MET A 265 27.759 93.524 3.491 1.00 20.72 N ATOM 2072 CA MET A 265 26.957 94.778 3.569 1.00 21.84 C ATOM 2073 C MET A 265 27.685 95.832 2.733 1.00 18.42 C ATOM 2074 O MET A 265 28.933 95.916 2.759 1.00 18.81 O ATOM 2075 CB MET A 265 26.869 95.320 4.999 1.00 24.04 C ATOM 2076 CG MET A 265 26.137 94.373 5.997 1.00 27.26 C ATOM 2077 SD MET A 265 26.092 95.040 7.702 1.00 28.13 S ATOM 2078 CE MET A 265 27.812 94.878 8.163 1.00 23.89 C ATOM 0 H MET A 265 28.607 93.663 3.525 1.00 20.72 H new ATOM 0 HA MET A 265 26.059 94.589 3.255 1.00 21.84 H new ATOM 0 HB2 MET A 265 27.767 95.487 5.327 1.00 24.04 H new ATOM 0 HB3 MET A 265 26.409 96.174 4.983 1.00 24.04 H new ATOM 0 HG2 MET A 265 25.230 94.223 5.688 1.00 27.26 H new ATOM 0 HG3 MET A 265 26.581 93.510 6.003 1.00 27.26 H new ATOM 0 HE1 MET A 265 27.913 95.067 9.109 1.00 23.89 H new ATOM 0 HE2 MET A 265 28.112 93.974 7.981 1.00 23.89 H new ATOM 0 HE3 MET A 265 28.345 95.505 7.650 1.00 23.89 H new ATOM 2079 N PRO A 266 26.927 96.646 1.964 1.00 20.86 N ATOM 2080 CA PRO A 266 27.540 97.751 1.219 1.00 20.17 C ATOM 2081 C PRO A 266 27.800 98.980 2.114 1.00 18.39 C ATOM 2082 O PRO A 266 27.085 99.208 3.117 1.00 21.95 O ATOM 2083 CB PRO A 266 26.402 98.103 0.205 1.00 20.87 C ATOM 2084 CG PRO A 266 25.152 97.826 0.953 1.00 24.63 C ATOM 2085 CD PRO A 266 25.452 96.591 1.816 1.00 24.43 C ATOM 0 HA PRO A 266 28.398 97.515 0.833 1.00 20.17 H new ATOM 0 HB2 PRO A 266 26.450 99.031 -0.074 1.00 20.87 H new ATOM 0 HB3 PRO A 266 26.462 97.562 -0.598 1.00 20.87 H new ATOM 0 HG2 PRO A 266 24.900 98.584 1.504 1.00 24.63 H new ATOM 0 HG3 PRO A 266 24.413 97.657 0.347 1.00 24.63 H new ATOM 0 HD2 PRO A 266 25.002 96.633 2.674 1.00 24.43 H new ATOM 0 HD3 PRO A 266 25.164 95.771 1.385 1.00 24.43 H new ATOM 2086 N LYS A 267 28.712 99.856 1.692 1.00 19.48 N ATOM 2087 CA LYS A 267 28.929 101.205 2.298 1.00 17.30 C ATOM 2088 C LYS A 267 27.608 101.973 2.249 1.00 18.82 C ATOM 2089 O LYS A 267 26.968 101.962 1.139 1.00 19.23 O ATOM 2090 CB LYS A 267 30.024 101.963 1.542 1.00 20.98 C ATOM 2091 CG LYS A 267 30.311 103.384 2.052 1.00 23.01 C ATOM 2092 CD LYS A 267 31.192 104.242 1.151 1.00 24.64 C ATOM 2093 CE LYS A 267 31.057 105.717 1.461 1.00 28.56 C ATOM 2094 NZ LYS A 267 29.668 106.170 1.143 1.00 27.15 N ATOM 0 H LYS A 267 29.240 99.693 1.033 1.00 19.48 H new ATOM 0 HA LYS A 267 29.220 101.111 3.219 1.00 17.30 H new ATOM 0 HB2 LYS A 267 30.844 101.447 1.587 1.00 20.98 H new ATOM 0 HB3 LYS A 267 29.773 102.016 0.606 1.00 20.98 H new ATOM 0 HG2 LYS A 267 29.465 103.841 2.180 1.00 23.01 H new ATOM 0 HG3 LYS A 267 30.733 103.319 2.923 1.00 23.01 H new ATOM 0 HD2 LYS A 267 32.118 103.974 1.256 1.00 24.64 H new ATOM 0 HD3 LYS A 267 30.955 104.085 0.224 1.00 24.64 H new ATOM 0 HE2 LYS A 267 31.254 105.880 2.397 1.00 28.56 H new ATOM 0 HE3 LYS A 267 31.700 106.226 0.943 1.00 28.56 H new ATOM 0 HZ1 LYS A 267 29.645 107.059 1.115 1.00 27.15 H new ATOM 0 HZ2 LYS A 267 29.422 105.842 0.353 1.00 27.15 H new ATOM 0 HZ3 LYS A 267 29.109 105.879 1.772 1.00 27.15 H new ATOM 2095 N MET A 268 27.228 102.643 3.333 1.00 17.82 N ATOM 2096 CA MET A 268 26.026 103.498 3.341 1.00 17.62 C ATOM 2097 C MET A 268 26.260 104.840 2.647 1.00 17.12 C ATOM 2098 O MET A 268 27.398 105.270 2.398 1.00 18.98 O ATOM 2099 CB MET A 268 25.509 103.763 4.757 1.00 20.06 C ATOM 2100 CG MET A 268 25.025 102.539 5.374 1.00 20.13 C ATOM 2101 SD MET A 268 24.420 102.671 7.120 1.00 26.48 S ATOM 2102 CE MET A 268 22.899 103.590 6.894 1.00 28.53 C ATOM 0 H MET A 268 27.650 102.620 4.082 1.00 17.82 H new ATOM 0 HA MET A 268 25.358 102.998 2.847 1.00 17.62 H new ATOM 0 HB2 MET A 268 26.219 104.143 5.298 1.00 20.06 H new ATOM 0 HB3 MET A 268 24.794 104.418 4.726 1.00 20.06 H new ATOM 0 HG2 MET A 268 24.303 102.190 4.829 1.00 20.13 H new ATOM 0 HG3 MET A 268 25.740 101.884 5.350 1.00 20.13 H new ATOM 0 HE1 MET A 268 22.474 103.729 7.755 1.00 28.53 H new ATOM 0 HE2 MET A 268 23.097 104.449 6.489 1.00 28.53 H new ATOM 0 HE3 MET A 268 22.302 103.090 6.316 1.00 28.53 H new ATOM 2103 N ASN A 269 25.138 105.527 2.319 1.00 18.88 N ATOM 2104 CA ASN A 269 25.138 106.899 1.775 1.00 18.17 C ATOM 2105 C ASN A 269 25.345 107.924 2.889 1.00 17.89 C ATOM 2106 O ASN A 269 24.473 108.023 3.751 1.00 18.93 O ATOM 2107 CB ASN A 269 23.825 107.200 1.031 1.00 15.93 C ATOM 2108 CG ASN A 269 23.778 108.643 0.470 1.00 20.70 C ATOM 2109 OD1 ASN A 269 24.348 109.535 0.993 1.00 27.52 O ATOM 2110 ND2 ASN A 269 23.285 108.703 -0.825 1.00 16.24 N ATOM 0 H ASN A 269 24.349 105.198 2.410 1.00 18.88 H new ATOM 0 HA ASN A 269 25.873 106.964 1.146 1.00 18.17 H new ATOM 0 HB2 ASN A 269 23.718 106.569 0.302 1.00 15.93 H new ATOM 0 HB3 ASN A 269 23.077 107.066 1.634 1.00 15.93 H new ATOM 0 HD21 ASN A 269 23.388 109.418 -1.292 1.00 16.24 H new ATOM 0 HD22 ASN A 269 22.876 108.025 -1.161 1.00 16.24 H new ATOM 2111 N PHE A 270 26.552 108.504 2.991 1.00 18.16 N ATOM 2112 CA PHE A 270 26.869 109.402 4.145 1.00 16.53 C ATOM 2113 C PHE A 270 25.995 110.648 4.190 1.00 17.96 C ATOM 2114 O PHE A 270 25.788 111.249 5.243 1.00 17.65 O ATOM 2115 CB PHE A 270 28.357 109.749 4.182 1.00 17.98 C ATOM 2116 CG PHE A 270 29.317 108.717 4.767 1.00 18.14 C ATOM 2117 CD1 PHE A 270 29.151 107.342 4.580 1.00 18.03 C ATOM 2118 CD2 PHE A 270 30.451 109.169 5.439 1.00 17.64 C ATOM 2119 CE1 PHE A 270 30.099 106.426 5.047 1.00 19.91 C ATOM 2120 CE2 PHE A 270 31.391 108.235 5.913 1.00 18.16 C ATOM 2121 CZ PHE A 270 31.212 106.882 5.702 1.00 18.66 C ATOM 0 H PHE A 270 27.191 108.401 2.425 1.00 18.16 H new ATOM 0 HA PHE A 270 26.659 108.903 4.950 1.00 16.53 H new ATOM 0 HB2 PHE A 270 28.641 109.938 3.274 1.00 17.98 H new ATOM 0 HB3 PHE A 270 28.458 110.570 4.688 1.00 17.98 H new ATOM 0 HD1 PHE A 270 28.395 107.030 4.136 1.00 18.03 H new ATOM 0 HD2 PHE A 270 30.585 110.079 5.573 1.00 17.64 H new ATOM 0 HE1 PHE A 270 29.975 105.514 4.914 1.00 19.91 H new ATOM 0 HE2 PHE A 270 32.142 108.533 6.374 1.00 18.16 H new ATOM 0 HZ PHE A 270 31.850 106.278 6.006 1.00 18.66 H new ATOM 2122 N ALA A 271 25.470 111.109 3.041 1.00 17.48 N ATOM 2123 CA ALA A 271 24.548 112.288 3.050 1.00 19.47 C ATOM 2124 C ALA A 271 23.245 111.909 3.735 1.00 19.37 C ATOM 2125 O ALA A 271 22.544 112.843 4.279 1.00 21.96 O ATOM 2126 CB ALA A 271 24.253 112.750 1.629 1.00 20.30 C ATOM 0 H ALA A 271 25.623 110.772 2.264 1.00 17.48 H new ATOM 0 HA ALA A 271 24.977 113.012 3.532 1.00 19.47 H new ATOM 0 HB1 ALA A 271 23.655 113.513 1.654 1.00 20.30 H new ATOM 0 HB2 ALA A 271 25.081 113.003 1.192 1.00 20.30 H new ATOM 0 HB3 ALA A 271 23.834 112.028 1.134 1.00 20.30 H new ATOM 2127 N ASN A 272 22.837 110.632 3.768 1.00 17.25 N ATOM 2128 CA ASN A 272 21.605 110.179 4.456 1.00 18.25 C ATOM 2129 C ASN A 272 21.897 109.849 5.942 1.00 22.37 C ATOM 2130 O ASN A 272 20.922 109.497 6.693 1.00 27.47 O ATOM 2131 CB ASN A 272 20.946 109.032 3.690 1.00 19.62 C ATOM 2132 CG ASN A 272 20.374 109.391 2.334 1.00 19.34 C ATOM 2133 OD1 ASN A 272 19.943 110.630 2.256 1.00 23.61 O flip ATOM 2134 ND2 ASN A 272 20.282 108.494 1.411 1.00 17.78 N flip ATOM 0 H ASN A 272 23.270 109.994 3.388 1.00 17.25 H new ATOM 0 HA ASN A 272 20.958 110.902 4.463 1.00 18.25 H new ATOM 0 HB2 ASN A 272 21.601 108.327 3.570 1.00 19.62 H new ATOM 0 HB3 ASN A 272 20.233 108.667 4.237 1.00 19.62 H new ATOM 0 HD21 ASN A 272 20.593 107.704 1.547 1.00 17.78 H new ATOM 0 HD22 ASN A 272 19.910 108.687 0.660 1.00 17.78 H new ATOM 2135 N VAL A 273 23.169 109.762 6.347 1.00 19.28 N ATOM 2136 CA VAL A 273 23.552 109.525 7.773 1.00 19.17 C ATOM 2137 C VAL A 273 23.761 110.882 8.446 1.00 20.18 C ATOM 2138 O VAL A 273 23.167 111.121 9.528 1.00 21.48 O ATOM 2139 CB VAL A 273 24.834 108.668 7.815 1.00 18.16 C ATOM 2140 CG1 VAL A 273 25.360 108.559 9.254 1.00 22.09 C ATOM 2141 CG2 VAL A 273 24.589 107.289 7.243 1.00 20.81 C ATOM 0 H VAL A 273 23.840 109.837 5.815 1.00 19.28 H new ATOM 0 HA VAL A 273 22.856 109.045 8.249 1.00 19.17 H new ATOM 0 HB VAL A 273 25.504 109.107 7.268 1.00 18.16 H new ATOM 0 HG11 VAL A 273 26.165 108.018 9.264 1.00 22.09 H new ATOM 0 HG12 VAL A 273 25.562 109.445 9.593 1.00 22.09 H new ATOM 0 HG13 VAL A 273 24.686 108.145 9.815 1.00 22.09 H new ATOM 0 HG21 VAL A 273 25.409 106.772 7.281 1.00 20.81 H new ATOM 0 HG22 VAL A 273 23.901 106.842 7.760 1.00 20.81 H new ATOM 0 HG23 VAL A 273 24.300 107.368 6.320 1.00 20.81 H new ATOM 2142 N PHE A 274 24.499 111.815 7.845 1.00 18.16 N ATOM 2143 CA PHE A 274 24.878 113.175 8.342 1.00 18.81 C ATOM 2144 C PHE A 274 23.910 114.179 7.697 1.00 18.42 C ATOM 2145 O PHE A 274 24.337 115.072 6.940 1.00 19.12 O ATOM 2146 CB PHE A 274 26.381 113.414 8.097 1.00 18.45 C ATOM 2147 CG PHE A 274 27.239 112.357 8.766 1.00 19.94 C ATOM 2148 CD1 PHE A 274 27.405 112.376 10.142 1.00 22.35 C ATOM 2149 CD2 PHE A 274 27.860 111.358 8.065 1.00 20.08 C ATOM 2150 CE1 PHE A 274 28.126 111.362 10.768 1.00 22.40 C ATOM 2151 CE2 PHE A 274 28.636 110.386 8.674 1.00 22.91 C ATOM 2152 CZ PHE A 274 28.706 110.369 10.042 1.00 21.49 C ATOM 0 H PHE A 274 24.828 111.670 7.064 1.00 18.16 H new ATOM 0 HA PHE A 274 24.781 113.281 9.301 1.00 18.81 H new ATOM 0 HB2 PHE A 274 26.556 113.416 7.143 1.00 18.45 H new ATOM 0 HB3 PHE A 274 26.628 114.290 8.433 1.00 18.45 H new ATOM 0 HD1 PHE A 274 27.036 113.065 10.646 1.00 22.35 H new ATOM 0 HD2 PHE A 274 27.756 111.331 7.141 1.00 20.08 H new ATOM 0 HE1 PHE A 274 28.212 111.364 11.694 1.00 22.40 H new ATOM 0 HE2 PHE A 274 29.099 109.759 8.166 1.00 22.91 H new ATOM 0 HZ PHE A 274 29.151 109.677 10.475 1.00 21.49 H new ATOM 2153 N ILE A 275 22.624 114.013 7.999 1.00 19.66 N ATOM 2154 CA ILE A 275 21.508 114.766 7.383 1.00 23.46 C ATOM 2155 C ILE A 275 21.688 116.268 7.631 1.00 22.52 C ATOM 2156 O ILE A 275 21.910 116.701 8.796 1.00 23.92 O ATOM 2157 CB ILE A 275 20.161 114.255 7.930 1.00 29.31 C ATOM 2158 CG1 ILE A 275 19.902 112.787 7.587 1.00 32.94 C ATOM 2159 CG2 ILE A 275 19.021 115.167 7.505 1.00 32.44 C ATOM 2160 CD1 ILE A 275 18.895 112.137 8.519 1.00 38.74 C ATOM 0 H ILE A 275 22.359 113.443 8.586 1.00 19.66 H new ATOM 0 HA ILE A 275 21.511 114.622 6.424 1.00 23.46 H new ATOM 0 HB ILE A 275 20.212 114.287 8.898 1.00 29.31 H new ATOM 0 HG12 ILE A 275 19.580 112.724 6.674 1.00 32.94 H new ATOM 0 HG13 ILE A 275 20.738 112.297 7.627 1.00 32.94 H new ATOM 0 HG21 ILE A 275 18.185 114.827 7.860 1.00 32.44 H new ATOM 0 HG22 ILE A 275 19.177 116.061 7.847 1.00 32.44 H new ATOM 0 HG23 ILE A 275 18.973 115.196 6.537 1.00 32.44 H new ATOM 0 HD11 ILE A 275 18.766 111.211 8.261 1.00 38.74 H new ATOM 0 HD12 ILE A 275 19.225 112.175 9.430 1.00 38.74 H new ATOM 0 HD13 ILE A 275 18.049 112.609 8.462 1.00 38.74 H new ATOM 2161 N GLY A 276 21.786 117.000 6.515 1.00 26.88 N ATOM 2162 CA GLY A 276 21.900 118.465 6.459 1.00 26.86 C ATOM 2163 C GLY A 276 23.295 119.013 6.638 1.00 29.59 C ATOM 2164 O GLY A 276 23.457 120.234 6.690 1.00 30.01 O ATOM 0 H GLY A 276 21.788 116.640 5.734 1.00 26.88 H new ATOM 0 HA2 GLY A 276 21.557 118.768 5.604 1.00 26.86 H new ATOM 0 HA3 GLY A 276 21.329 118.845 7.145 1.00 26.86 H new ATOM 2165 N ALA A 277 24.307 118.171 6.844 1.00 23.22 N ATOM 2166 CA ALA A 277 25.678 118.688 6.992 1.00 23.31 C ATOM 2167 C ALA A 277 26.167 119.311 5.693 1.00 20.66 C ATOM 2168 O ALA A 277 25.732 118.893 4.584 1.00 23.36 O ATOM 2169 CB ALA A 277 26.606 117.542 7.434 1.00 24.29 C ATOM 0 H ALA A 277 24.230 117.316 6.901 1.00 23.22 H new ATOM 0 HA ALA A 277 25.685 119.383 7.668 1.00 23.31 H new ATOM 0 HB1 ALA A 277 27.511 117.878 7.533 1.00 24.29 H new ATOM 0 HB2 ALA A 277 26.299 117.186 8.282 1.00 24.29 H new ATOM 0 HB3 ALA A 277 26.594 116.839 6.765 1.00 24.29 H new ATOM 2170 N ASN A 278 27.137 120.215 5.810 1.00 21.99 N ATOM 2171 CA ASN A 278 27.878 120.770 4.660 1.00 22.59 C ATOM 2172 C ASN A 278 28.290 119.634 3.737 1.00 24.25 C ATOM 2173 O ASN A 278 29.004 118.692 4.157 1.00 20.09 O ATOM 2174 CB ASN A 278 29.092 121.586 5.155 1.00 21.21 C ATOM 2175 CG ASN A 278 29.863 122.351 4.084 1.00 21.12 C ATOM 2176 OD1 ASN A 278 29.935 121.951 2.908 1.00 23.88 O ATOM 2177 ND2 ASN A 278 30.553 123.405 4.551 1.00 23.71 N ATOM 0 H ASN A 278 27.392 120.532 6.568 1.00 21.99 H new ATOM 0 HA ASN A 278 27.312 121.377 4.158 1.00 22.59 H new ATOM 0 HB2 ASN A 278 28.784 122.220 5.821 1.00 21.21 H new ATOM 0 HB3 ASN A 278 29.706 120.982 5.601 1.00 21.21 H new ATOM 0 HD21 ASN A 278 31.078 123.841 4.028 1.00 23.71 H new ATOM 0 HD22 ASN A 278 30.470 123.643 5.373 1.00 23.71 H new ATOM 2178 N PRO A 279 27.968 119.633 2.429 1.00 21.62 N ATOM 2179 CA PRO A 279 28.427 118.583 1.530 1.00 21.70 C ATOM 2180 C PRO A 279 29.968 118.370 1.555 1.00 20.76 C ATOM 2181 O PRO A 279 30.381 117.243 1.286 1.00 20.14 O ATOM 2182 CB PRO A 279 27.934 118.975 0.125 1.00 24.26 C ATOM 2183 CG PRO A 279 26.744 119.824 0.464 1.00 23.93 C ATOM 2184 CD PRO A 279 27.020 120.577 1.748 1.00 22.21 C ATOM 0 HA PRO A 279 28.065 117.729 1.814 1.00 21.70 H new ATOM 0 HB2 PRO A 279 28.604 119.466 -0.375 1.00 24.26 H new ATOM 0 HB3 PRO A 279 27.693 118.201 -0.408 1.00 24.26 H new ATOM 0 HG2 PRO A 279 26.562 120.447 -0.257 1.00 23.93 H new ATOM 0 HG3 PRO A 279 25.955 119.269 0.565 1.00 23.93 H new ATOM 0 HD2 PRO A 279 27.419 121.446 1.586 1.00 22.21 H new ATOM 0 HD3 PRO A 279 26.214 120.727 2.267 1.00 22.21 H new ATOM 2185 N LEU A 280 30.730 119.444 1.790 1.00 21.05 N ATOM 2186 CA LEU A 280 32.223 119.317 1.837 1.00 21.93 C ATOM 2187 C LEU A 280 32.614 118.572 3.121 1.00 20.09 C ATOM 2188 O LEU A 280 33.637 117.809 3.043 1.00 19.31 O ATOM 2189 CB LEU A 280 32.922 120.678 1.748 1.00 22.00 C ATOM 2190 CG LEU A 280 32.747 121.413 0.413 1.00 23.72 C ATOM 2191 CD1 LEU A 280 33.270 122.809 0.538 1.00 24.24 C ATOM 2192 CD2 LEU A 280 33.440 120.668 -0.677 1.00 25.97 C ATOM 0 H LEU A 280 30.428 120.238 1.923 1.00 21.05 H new ATOM 0 HA LEU A 280 32.518 118.812 1.063 1.00 21.93 H new ATOM 0 HB2 LEU A 280 32.587 121.245 2.460 1.00 22.00 H new ATOM 0 HB3 LEU A 280 33.870 120.550 1.909 1.00 22.00 H new ATOM 0 HG LEU A 280 31.805 121.459 0.187 1.00 23.72 H new ATOM 0 HD11 LEU A 280 33.159 123.273 -0.306 1.00 24.24 H new ATOM 0 HD12 LEU A 280 32.779 123.278 1.231 1.00 24.24 H new ATOM 0 HD13 LEU A 280 34.211 122.782 0.771 1.00 24.24 H new ATOM 0 HD21 LEU A 280 33.324 121.140 -1.516 1.00 25.97 H new ATOM 0 HD22 LEU A 280 34.386 120.601 -0.473 1.00 25.97 H new ATOM 0 HD23 LEU A 280 33.062 119.778 -0.752 1.00 25.97 H new ATOM 2193 N ALA A 281 31.854 118.717 4.185 1.00 20.24 N ATOM 2194 CA ALA A 281 32.130 117.911 5.434 1.00 20.41 C ATOM 2195 C ALA A 281 31.839 116.437 5.169 1.00 21.28 C ATOM 2196 O ALA A 281 32.644 115.526 5.605 1.00 19.57 O ATOM 2197 CB ALA A 281 31.320 118.435 6.573 1.00 19.26 C ATOM 0 H ALA A 281 31.184 119.253 4.238 1.00 20.24 H new ATOM 0 HA ALA A 281 33.066 117.995 5.676 1.00 20.41 H new ATOM 0 HB1 ALA A 281 31.504 117.912 7.369 1.00 19.26 H new ATOM 0 HB2 ALA A 281 31.552 119.363 6.736 1.00 19.26 H new ATOM 0 HB3 ALA A 281 30.377 118.372 6.356 1.00 19.26 H new ATOM 2198 N VAL A 282 30.707 116.109 4.515 1.00 19.12 N ATOM 2199 CA VAL A 282 30.348 114.726 4.162 1.00 18.76 C ATOM 2200 C VAL A 282 31.490 114.120 3.322 1.00 19.42 C ATOM 2201 O VAL A 282 31.892 112.957 3.559 1.00 19.03 O ATOM 2202 CB VAL A 282 28.965 114.683 3.458 1.00 19.13 C ATOM 2203 CG1 VAL A 282 28.632 113.268 2.983 1.00 21.20 C ATOM 2204 CG2 VAL A 282 27.902 115.285 4.356 1.00 23.42 C ATOM 0 H VAL A 282 30.125 116.690 4.264 1.00 19.12 H new ATOM 0 HA VAL A 282 30.250 114.181 4.958 1.00 18.76 H new ATOM 0 HB VAL A 282 28.996 115.229 2.657 1.00 19.13 H new ATOM 0 HG11 VAL A 282 27.765 113.268 2.548 1.00 21.20 H new ATOM 0 HG12 VAL A 282 29.309 112.970 2.355 1.00 21.20 H new ATOM 0 HG13 VAL A 282 28.611 112.667 3.744 1.00 21.20 H new ATOM 0 HG21 VAL A 282 27.043 115.253 3.907 1.00 23.42 H new ATOM 0 HG22 VAL A 282 27.853 114.780 5.183 1.00 23.42 H new ATOM 0 HG23 VAL A 282 28.129 116.207 4.553 1.00 23.42 H new ATOM 2205 N ASP A 283 31.992 114.847 2.303 1.00 17.95 N ATOM 2206 CA ASP A 283 33.052 114.344 1.417 1.00 19.04 C ATOM 2207 C ASP A 283 34.310 114.019 2.251 1.00 17.48 C ATOM 2208 O ASP A 283 34.931 112.961 2.015 1.00 18.92 O ATOM 2209 CB ASP A 283 33.361 115.367 0.300 1.00 20.81 C ATOM 2210 CG ASP A 283 34.364 114.839 -0.711 1.00 24.58 C ATOM 2211 OD1 ASP A 283 34.025 113.939 -1.536 1.00 25.78 O ATOM 2212 OD2 ASP A 283 35.540 115.256 -0.648 1.00 23.54 O ATOM 0 H ASP A 283 31.725 115.642 2.111 1.00 17.95 H new ATOM 0 HA ASP A 283 32.750 113.529 0.985 1.00 19.04 H new ATOM 0 HB2 ASP A 283 32.538 115.601 -0.157 1.00 20.81 H new ATOM 0 HB3 ASP A 283 33.706 116.182 0.698 1.00 20.81 H new ATOM 2213 N LEU A 284 34.685 114.929 3.142 1.00 18.49 N ATOM 2214 CA LEU A 284 35.914 114.695 3.940 1.00 18.38 C ATOM 2215 C LEU A 284 35.729 113.486 4.880 1.00 19.35 C ATOM 2216 O LEU A 284 36.646 112.645 4.994 1.00 18.16 O ATOM 2217 CB LEU A 284 36.301 115.943 4.709 1.00 18.37 C ATOM 2218 CG LEU A 284 37.574 115.780 5.559 1.00 18.20 C ATOM 2219 CD1 LEU A 284 38.805 115.525 4.684 1.00 20.17 C ATOM 2220 CD2 LEU A 284 37.748 117.035 6.393 1.00 20.51 C ATOM 0 H LEU A 284 34.270 115.664 3.305 1.00 18.49 H new ATOM 0 HA LEU A 284 36.641 114.488 3.332 1.00 18.38 H new ATOM 0 HB2 LEU A 284 36.432 116.671 4.082 1.00 18.37 H new ATOM 0 HB3 LEU A 284 35.566 116.197 5.289 1.00 18.37 H new ATOM 0 HG LEU A 284 37.482 115.007 6.137 1.00 18.20 H new ATOM 0 HD11 LEU A 284 39.588 115.427 5.248 1.00 20.17 H new ATOM 0 HD12 LEU A 284 38.674 114.713 4.169 1.00 20.17 H new ATOM 0 HD13 LEU A 284 38.933 116.273 4.080 1.00 20.17 H new ATOM 0 HD21 LEU A 284 38.546 116.954 6.938 1.00 20.51 H new ATOM 0 HD22 LEU A 284 37.834 117.804 5.807 1.00 20.51 H new ATOM 0 HD23 LEU A 284 36.975 117.151 6.968 1.00 20.51 H new ATOM 2221 N LEU A 285 34.566 113.336 5.503 1.00 17.69 N ATOM 2222 CA LEU A 285 34.318 112.127 6.339 1.00 17.90 C ATOM 2223 C LEU A 285 34.428 110.829 5.528 1.00 17.58 C ATOM 2224 O LEU A 285 34.971 109.820 6.035 1.00 18.19 O ATOM 2225 CB LEU A 285 32.933 112.212 6.996 1.00 18.76 C ATOM 2226 CG LEU A 285 32.780 113.175 8.158 1.00 20.51 C ATOM 2227 CD1 LEU A 285 31.311 113.361 8.517 1.00 23.25 C ATOM 2228 CD2 LEU A 285 33.546 112.678 9.392 1.00 21.59 C ATOM 0 H LEU A 285 33.914 113.896 5.467 1.00 17.69 H new ATOM 0 HA LEU A 285 35.005 112.106 7.023 1.00 17.90 H new ATOM 0 HB2 LEU A 285 32.290 112.459 6.313 1.00 18.76 H new ATOM 0 HB3 LEU A 285 32.691 111.325 7.306 1.00 18.76 H new ATOM 0 HG LEU A 285 33.151 114.027 7.880 1.00 20.51 H new ATOM 0 HD11 LEU A 285 31.235 113.979 9.261 1.00 23.25 H new ATOM 0 HD12 LEU A 285 30.833 113.717 7.751 1.00 23.25 H new ATOM 0 HD13 LEU A 285 30.928 112.506 8.768 1.00 23.25 H new ATOM 0 HD21 LEU A 285 33.433 113.310 10.119 1.00 21.59 H new ATOM 0 HD22 LEU A 285 33.201 111.812 9.660 1.00 21.59 H new ATOM 0 HD23 LEU A 285 34.489 112.598 9.178 1.00 21.59 H new ATOM 2229 N GLU A 286 33.952 110.767 4.271 1.00 17.54 N ATOM 2230 CA GLU A 286 34.044 109.582 3.406 1.00 18.60 C ATOM 2231 C GLU A 286 35.542 109.282 3.130 1.00 19.36 C ATOM 2232 O GLU A 286 35.837 108.101 2.929 1.00 23.13 O ATOM 2233 CB GLU A 286 33.305 109.794 2.075 1.00 19.94 C ATOM 2234 CG GLU A 286 31.795 109.746 2.267 1.00 21.03 C ATOM 2235 CD GLU A 286 30.970 109.888 1.014 1.00 30.68 C ATOM 2236 OE1 GLU A 286 31.405 110.668 0.122 1.00 28.32 O ATOM 2237 OE2 GLU A 286 29.852 109.226 1.003 1.00 35.36 O ATOM 0 H GLU A 286 33.558 111.431 3.893 1.00 17.54 H new ATOM 0 HA GLU A 286 33.624 108.834 3.859 1.00 18.60 H new ATOM 0 HB2 GLU A 286 33.558 110.650 1.695 1.00 19.94 H new ATOM 0 HB3 GLU A 286 33.574 109.111 1.441 1.00 19.94 H new ATOM 0 HG2 GLU A 286 31.566 108.904 2.691 1.00 21.03 H new ATOM 0 HG3 GLU A 286 31.542 110.451 2.883 1.00 21.03 H new ATOM 2238 N LYS A 287 36.428 110.312 3.128 1.00 17.65 N ATOM 2239 CA LYS A 287 37.874 110.097 2.871 1.00 17.22 C ATOM 2240 C LYS A 287 38.654 109.672 4.126 1.00 17.04 C ATOM 2241 O LYS A 287 39.739 109.067 3.996 1.00 17.40 O ATOM 2242 CB LYS A 287 38.446 111.316 2.150 1.00 17.53 C ATOM 2243 CG LYS A 287 37.843 111.464 0.714 1.00 22.34 C ATOM 2244 CD LYS A 287 38.204 112.724 0.003 1.00 27.60 C ATOM 2245 CE LYS A 287 37.704 112.668 -1.443 1.00 30.94 C ATOM 2246 NZ LYS A 287 37.652 114.005 -2.070 1.00 41.08 N ATOM 0 H LYS A 287 36.211 111.132 3.272 1.00 17.65 H new ATOM 0 HA LYS A 287 37.980 109.335 2.280 1.00 17.22 H new ATOM 0 HB2 LYS A 287 38.259 112.116 2.665 1.00 17.53 H new ATOM 0 HB3 LYS A 287 39.411 111.236 2.091 1.00 17.53 H new ATOM 0 HG2 LYS A 287 38.135 110.711 0.177 1.00 22.34 H new ATOM 0 HG3 LYS A 287 36.877 111.410 0.777 1.00 22.34 H new ATOM 0 HD2 LYS A 287 37.813 113.486 0.459 1.00 27.60 H new ATOM 0 HD3 LYS A 287 39.166 112.848 0.016 1.00 27.60 H new ATOM 0 HE2 LYS A 287 38.286 112.092 -1.962 1.00 30.94 H new ATOM 0 HE3 LYS A 287 36.820 112.269 -1.462 1.00 30.94 H new ATOM 0 HZ1 LYS A 287 37.470 113.920 -2.937 1.00 41.08 H new ATOM 0 HZ2 LYS A 287 37.017 114.491 -1.680 1.00 41.08 H new ATOM 0 HZ3 LYS A 287 38.438 114.410 -1.971 1.00 41.08 H new ATOM 2247 N AMET A 288 38.152 109.992 5.319 0.25 15.66 N ATOM 2248 N BMET A 288 38.130 109.980 5.320 0.25 17.02 N ATOM 2249 CA AMET A 288 38.810 109.582 6.597 0.25 15.58 C ATOM 2250 CA BMET A 288 38.793 109.657 6.625 0.25 17.78 C ATOM 2251 C AMET A 288 38.352 108.162 6.983 0.25 15.50 C ATOM 2252 C BMET A 288 38.325 108.281 7.151 0.25 17.17 C ATOM 2253 O AMET A 288 39.215 107.306 7.314 0.25 15.04 O ATOM 2254 O BMET A 288 39.177 107.582 7.783 0.25 16.90 O ATOM 2255 CB AMET A 288 38.485 110.562 7.726 0.25 14.86 C ATOM 2256 CB BMET A 288 38.532 110.737 7.683 0.25 18.81 C ATOM 2257 CG AMET A 288 39.001 111.988 7.476 0.25 16.06 C ATOM 2258 CG BMET A 288 39.176 112.107 7.363 0.25 20.93 C ATOM 2259 SD AMET A 288 38.370 113.158 8.699 0.25 16.50 S ATOM 2260 SD BMET A 288 39.301 113.214 8.805 0.25 25.48 S ATOM 2261 CE AMET A 288 39.551 114.492 8.488 0.25 15.68 C ATOM 2262 CE BMET A 288 37.587 113.692 9.004 0.25 24.21 C ATOM 0 H AMET A 288 37.430 110.447 5.426 0.25 17.02 H new ATOM 0 H BMET A 288 37.376 110.384 5.410 0.25 17.02 H new ATOM 0 HA AMET A 288 39.771 109.589 6.462 0.25 17.78 H new ATOM 0 HA BMET A 288 39.748 109.627 6.459 0.25 17.78 H new ATOM 0 HB2AMET A 288 37.523 110.592 7.850 0.25 18.81 H new ATOM 0 HB2BMET A 288 37.574 110.856 7.780 0.25 18.81 H new ATOM 0 HB3AMET A 288 38.868 110.229 8.553 0.25 18.81 H new ATOM 0 HB3BMET A 288 38.867 110.425 8.538 0.25 18.81 H new ATOM 0 HG2AMET A 288 39.971 111.989 7.498 0.25 20.93 H new ATOM 0 HG2BMET A 288 40.063 111.961 7.000 0.25 20.93 H new ATOM 0 HG3AMET A 288 38.738 112.276 6.588 0.25 20.93 H new ATOM 0 HG3BMET A 288 38.656 112.546 6.672 0.25 20.93 H new ATOM 0 HE1AMET A 288 39.210 115.296 8.910 0.25 24.21 H new ATOM 0 HE1BMET A 288 37.400 113.842 9.944 0.25 24.21 H new ATOM 0 HE2AMET A 288 40.395 114.245 8.897 0.25 24.21 H new ATOM 0 HE2BMET A 288 37.419 114.508 8.507 0.25 24.21 H new ATOM 0 HE3AMET A 288 39.687 114.657 7.542 0.25 24.21 H new ATOM 0 HE3BMET A 288 37.013 112.986 8.669 0.25 24.21 H new ATOM 2263 N LEU A 289 37.042 107.912 6.959 1.00 16.29 N ATOM 2264 CA LEU A 289 36.429 106.683 7.535 1.00 15.34 C ATOM 2265 C LEU A 289 36.408 105.558 6.500 1.00 16.39 C ATOM 2266 O LEU A 289 35.361 105.129 6.013 1.00 19.87 O ATOM 2267 CB LEU A 289 35.035 107.016 8.052 1.00 15.47 C ATOM 2268 CG LEU A 289 35.034 107.955 9.242 1.00 17.01 C ATOM 2269 CD1 LEU A 289 33.595 108.365 9.557 1.00 18.38 C ATOM 2270 CD2 LEU A 289 35.668 107.308 10.479 1.00 18.89 C ATOM 0 H ALEU A 289 36.469 108.449 6.607 0.25 16.29 H new ATOM 0 H BLEU A 289 36.493 108.373 6.484 0.25 16.29 H new ATOM 0 HA LEU A 289 36.962 106.366 8.281 1.00 15.34 H new ATOM 0 HB2 LEU A 289 34.520 107.416 7.334 1.00 15.47 H new ATOM 0 HB3 LEU A 289 34.585 106.193 8.299 1.00 15.47 H new ATOM 0 HG LEU A 289 35.565 108.734 9.013 1.00 17.01 H new ATOM 0 HD11 LEU A 289 33.589 108.966 10.318 1.00 18.38 H new ATOM 0 HD12 LEU A 289 33.210 108.814 8.788 1.00 18.38 H new ATOM 0 HD13 LEU A 289 33.072 107.575 9.765 1.00 18.38 H new ATOM 0 HD21 LEU A 289 35.650 107.936 11.218 1.00 18.89 H new ATOM 0 HD22 LEU A 289 35.169 106.512 10.720 1.00 18.89 H new ATOM 0 HD23 LEU A 289 36.587 107.066 10.283 1.00 18.89 H new ATOM 2271 N VAL A 290 37.606 105.211 6.042 1.00 18.21 N ATOM 2272 CA VAL A 290 37.884 104.136 5.057 1.00 19.28 C ATOM 2273 C VAL A 290 38.438 102.946 5.820 1.00 18.33 C ATOM 2274 O VAL A 290 39.385 103.106 6.597 1.00 18.02 O ATOM 2275 CB VAL A 290 38.852 104.638 3.933 1.00 19.84 C ATOM 2276 CG1 VAL A 290 39.083 103.526 2.929 1.00 22.61 C ATOM 2277 CG2 VAL A 290 38.313 105.866 3.204 1.00 21.13 C ATOM 0 H VAL A 290 38.322 105.609 6.303 1.00 18.21 H new ATOM 0 HA VAL A 290 37.071 103.869 4.599 1.00 19.28 H new ATOM 0 HB VAL A 290 39.684 104.892 4.362 1.00 19.84 H new ATOM 0 HG11 VAL A 290 39.683 103.838 2.233 1.00 22.61 H new ATOM 0 HG12 VAL A 290 39.478 102.762 3.377 1.00 22.61 H new ATOM 0 HG13 VAL A 290 38.236 103.266 2.533 1.00 22.61 H new ATOM 0 HG21 VAL A 290 38.944 106.139 2.520 1.00 21.13 H new ATOM 0 HG22 VAL A 290 37.462 105.650 2.791 1.00 21.13 H new ATOM 0 HG23 VAL A 290 38.190 106.590 3.837 1.00 21.13 H new ATOM 2278 N LEU A 291 37.857 101.741 5.650 1.00 19.05 N ATOM 2279 CA LEU A 291 38.250 100.560 6.408 1.00 20.43 C ATOM 2280 C LEU A 291 39.740 100.231 6.165 1.00 18.95 C ATOM 2281 O LEU A 291 40.487 100.033 7.094 1.00 21.96 O ATOM 2282 CB LEU A 291 37.271 99.418 6.084 1.00 23.24 C ATOM 2283 CG LEU A 291 37.301 98.292 7.089 1.00 25.90 C ATOM 2284 CD1 LEU A 291 36.778 98.750 8.462 1.00 24.97 C ATOM 2285 CD2 LEU A 291 36.454 97.118 6.592 1.00 27.15 C ATOM 0 H LEU A 291 37.223 101.597 5.087 1.00 19.05 H new ATOM 0 HA LEU A 291 38.187 100.716 7.363 1.00 20.43 H new ATOM 0 HB2 LEU A 291 36.371 99.777 6.039 1.00 23.24 H new ATOM 0 HB3 LEU A 291 37.479 99.063 5.206 1.00 23.24 H new ATOM 0 HG LEU A 291 38.224 98.012 7.188 1.00 25.90 H new ATOM 0 HD11 LEU A 291 36.809 98.007 9.085 1.00 24.97 H new ATOM 0 HD12 LEU A 291 37.332 99.474 8.795 1.00 24.97 H new ATOM 0 HD13 LEU A 291 35.863 99.059 8.373 1.00 24.97 H new ATOM 0 HD21 LEU A 291 36.480 96.401 7.245 1.00 27.15 H new ATOM 0 HD22 LEU A 291 35.537 97.409 6.469 1.00 27.15 H new ATOM 0 HD23 LEU A 291 36.807 96.799 5.747 1.00 27.15 H new ATOM 2286 N ASP A 292 40.184 100.197 4.895 1.00 19.23 N ATOM 2287 CA ASP A 292 41.595 99.882 4.544 1.00 21.07 C ATOM 2288 C ASP A 292 42.464 101.108 4.821 1.00 19.64 C ATOM 2289 O ASP A 292 42.320 102.151 4.136 1.00 19.97 O ATOM 2290 CB ASP A 292 41.674 99.476 3.069 1.00 23.00 C ATOM 2291 CG ASP A 292 43.065 99.004 2.635 1.00 24.14 C ATOM 2292 OD1 ASP A 292 44.063 99.227 3.345 1.00 22.27 O ATOM 2293 OD2 ASP A 292 43.095 98.295 1.564 1.00 27.90 O ATOM 0 H ASP A 292 39.683 100.354 4.214 1.00 19.23 H new ATOM 0 HA ASP A 292 41.919 99.143 5.082 1.00 21.07 H new ATOM 0 HB2 ASP A 292 41.034 98.767 2.902 1.00 23.00 H new ATOM 0 HB3 ASP A 292 41.411 100.231 2.519 1.00 23.00 H new ATOM 2294 N SER A 293 43.300 101.030 5.842 1.00 19.39 N ATOM 2295 CA SER A 293 44.127 102.141 6.331 1.00 19.10 C ATOM 2296 C SER A 293 45.069 102.668 5.204 1.00 19.94 C ATOM 2297 O SER A 293 45.319 103.888 5.240 1.00 22.64 O ATOM 2298 CB SER A 293 44.850 101.750 7.569 1.00 24.98 C ATOM 2299 OG SER A 293 45.887 100.842 7.288 1.00 24.12 O ATOM 0 H SER A 293 43.412 100.305 6.292 1.00 19.39 H new ATOM 0 HA SER A 293 43.552 102.884 6.573 1.00 19.10 H new ATOM 0 HB2 SER A 293 45.216 102.540 7.996 1.00 24.98 H new ATOM 0 HB3 SER A 293 44.228 101.350 8.197 1.00 24.98 H new ATOM 0 HG SER A 293 46.369 100.747 7.970 1.00 24.12 H new ATOM 2300 N ASP A 294 45.458 101.836 4.230 1.00 19.67 N ATOM 2301 CA ASP A 294 46.336 102.297 3.130 1.00 19.95 C ATOM 2302 C ASP A 294 45.625 103.369 2.291 1.00 20.65 C ATOM 2303 O ASP A 294 46.335 104.128 1.578 1.00 20.53 O ATOM 2304 CB ASP A 294 46.749 101.122 2.217 1.00 20.33 C ATOM 2305 CG ASP A 294 47.701 100.064 2.744 1.00 25.38 C ATOM 2306 OD1 ASP A 294 48.395 100.361 3.716 1.00 26.90 O ATOM 2307 OD2 ASP A 294 47.784 98.985 2.079 1.00 29.22 O ATOM 0 H ASP A 294 45.230 101.008 4.183 1.00 19.67 H new ATOM 0 HA ASP A 294 47.134 102.676 3.530 1.00 19.95 H new ATOM 0 HB2 ASP A 294 45.937 100.670 1.940 1.00 20.33 H new ATOM 0 HB3 ASP A 294 47.149 101.501 1.419 1.00 20.33 H new ATOM 2308 N LYS A 295 44.309 103.401 2.294 1.00 18.65 N ATOM 2309 CA LYS A 295 43.492 104.230 1.395 1.00 17.84 C ATOM 2310 C LYS A 295 42.921 105.491 2.074 1.00 18.06 C ATOM 2311 O LYS A 295 42.293 106.303 1.385 1.00 18.38 O ATOM 2312 CB LYS A 295 42.392 103.418 0.709 1.00 20.41 C ATOM 2313 CG LYS A 295 42.991 102.276 -0.132 1.00 27.68 C ATOM 2314 CD LYS A 295 42.050 101.503 -1.029 1.00 33.13 C ATOM 2315 CE LYS A 295 42.833 100.454 -1.815 1.00 36.62 C ATOM 2316 NZ LYS A 295 41.966 99.529 -2.579 1.00 43.30 N ATOM 0 H LYS A 295 43.838 102.927 2.835 1.00 18.65 H new ATOM 0 HA LYS A 295 44.100 104.545 0.708 1.00 17.84 H new ATOM 0 HB2 LYS A 295 41.792 103.052 1.377 1.00 20.41 H new ATOM 0 HB3 LYS A 295 41.863 103.999 0.141 1.00 20.41 H new ATOM 0 HG2 LYS A 295 43.694 102.649 -0.686 1.00 27.68 H new ATOM 0 HG3 LYS A 295 43.412 101.646 0.474 1.00 27.68 H new ATOM 0 HD2 LYS A 295 41.362 101.074 -0.497 1.00 33.13 H new ATOM 0 HD3 LYS A 295 41.601 102.108 -1.639 1.00 33.13 H new ATOM 0 HE2 LYS A 295 43.437 100.902 -2.428 1.00 36.62 H new ATOM 0 HE3 LYS A 295 43.381 99.941 -1.201 1.00 36.62 H new ATOM 0 HZ1 LYS A 295 42.444 98.828 -2.848 1.00 43.30 H new ATOM 0 HZ2 LYS A 295 41.298 99.251 -2.060 1.00 43.30 H new ATOM 0 HZ3 LYS A 295 41.634 99.951 -3.289 1.00 43.30 H new ATOM 2317 N ARG A 296 43.121 105.663 3.371 1.00 16.48 N ATOM 2318 CA ARG A 296 42.687 106.862 4.115 1.00 16.23 C ATOM 2319 C ARG A 296 43.450 108.110 3.644 1.00 17.41 C ATOM 2320 O ARG A 296 44.627 108.006 3.304 1.00 18.30 O ATOM 2321 CB ARG A 296 42.822 106.691 5.636 1.00 17.78 C ATOM 2322 CG ARG A 296 41.957 105.623 6.246 1.00 18.12 C ATOM 2323 CD ARG A 296 42.182 105.440 7.757 1.00 18.23 C ATOM 2324 NE ARG A 296 41.538 104.207 8.133 1.00 18.15 N ATOM 2325 CZ ARG A 296 41.943 103.345 9.035 1.00 17.99 C ATOM 2326 NH1 ARG A 296 42.906 103.670 9.879 1.00 19.33 N ATOM 2327 NH2 ARG A 296 41.332 102.170 9.145 1.00 19.74 N ATOM 0 H ARG A 296 43.520 105.081 3.863 1.00 16.48 H new ATOM 0 HA ARG A 296 41.744 106.982 3.922 1.00 16.23 H new ATOM 0 HB2 ARG A 296 43.749 106.492 5.843 1.00 17.78 H new ATOM 0 HB3 ARG A 296 42.612 107.537 6.061 1.00 17.78 H new ATOM 0 HG2 ARG A 296 41.025 105.843 6.089 1.00 18.12 H new ATOM 0 HG3 ARG A 296 42.129 104.781 5.796 1.00 18.12 H new ATOM 0 HD2 ARG A 296 43.130 105.408 7.961 1.00 18.23 H new ATOM 0 HD3 ARG A 296 41.810 106.186 8.252 1.00 18.23 H new ATOM 0 HE ARG A 296 40.808 104.015 7.721 1.00 18.15 H new ATOM 0 HH11 ARG A 296 43.269 104.448 9.838 1.00 19.33 H new ATOM 0 HH12 ARG A 296 43.170 103.103 10.469 1.00 19.33 H new ATOM 0 HH21 ARG A 296 40.674 101.977 8.626 1.00 19.74 H new ATOM 0 HH22 ARG A 296 41.595 101.602 9.735 1.00 19.74 H new ATOM 2328 N ILE A 297 42.808 109.243 3.691 1.00 18.23 N ATOM 2329 CA ILE A 297 43.454 110.568 3.490 1.00 16.66 C ATOM 2330 C ILE A 297 44.513 110.774 4.588 1.00 16.70 C ATOM 2331 O ILE A 297 44.305 110.317 5.747 1.00 17.93 O ATOM 2332 CB ILE A 297 42.385 111.668 3.394 1.00 17.32 C ATOM 2333 CG1 ILE A 297 42.954 112.962 2.802 1.00 18.84 C ATOM 2334 CG2 ILE A 297 41.700 111.926 4.748 1.00 17.96 C ATOM 2335 CD1 ILE A 297 41.914 113.996 2.381 1.00 18.89 C ATOM 0 H ILE A 297 41.963 109.294 3.843 1.00 18.23 H new ATOM 0 HA ILE A 297 43.929 110.612 2.645 1.00 16.66 H new ATOM 0 HB ILE A 297 41.704 111.343 2.785 1.00 17.32 H new ATOM 0 HG12 ILE A 297 43.546 113.367 3.455 1.00 18.84 H new ATOM 0 HG13 ILE A 297 43.496 112.737 2.030 1.00 18.84 H new ATOM 0 HG21 ILE A 297 41.034 112.624 4.646 1.00 17.96 H new ATOM 0 HG22 ILE A 297 41.270 111.112 5.054 1.00 17.96 H new ATOM 0 HG23 ILE A 297 42.363 112.205 5.399 1.00 17.96 H new ATOM 0 HD11 ILE A 297 42.362 114.777 2.020 1.00 18.89 H new ATOM 0 HD12 ILE A 297 41.334 113.614 1.704 1.00 18.89 H new ATOM 0 HD13 ILE A 297 41.384 114.255 3.151 1.00 18.89 H new ATOM 2336 N THR A 298 45.628 111.422 4.256 1.00 16.55 N ATOM 2337 CA THR A 298 46.628 111.790 5.284 1.00 15.51 C ATOM 2338 C THR A 298 46.343 113.174 5.879 1.00 16.69 C ATOM 2339 O THR A 298 45.524 113.953 5.322 1.00 16.88 O ATOM 2340 CB THR A 298 48.088 111.763 4.755 1.00 17.33 C ATOM 2341 OG1 THR A 298 48.207 112.868 3.839 1.00 18.83 O ATOM 2342 CG2 THR A 298 48.457 110.420 4.146 1.00 20.40 C ATOM 0 H THR A 298 45.831 111.659 3.455 1.00 16.55 H new ATOM 0 HA THR A 298 46.544 111.112 5.973 1.00 15.51 H new ATOM 0 HB THR A 298 48.726 111.866 5.478 1.00 17.33 H new ATOM 0 HG1 THR A 298 49.016 113.082 3.761 1.00 18.83 H new ATOM 0 HG21 THR A 298 49.374 110.449 3.830 1.00 20.40 H new ATOM 0 HG22 THR A 298 48.368 109.725 4.817 1.00 20.40 H new ATOM 0 HG23 THR A 298 47.865 110.228 3.402 1.00 20.40 H new ATOM 2343 N ALA A 299 46.987 113.537 6.993 1.00 16.39 N ATOM 2344 CA ALA A 299 46.812 114.881 7.584 1.00 16.83 C ATOM 2345 C ALA A 299 47.205 115.983 6.576 1.00 15.23 C ATOM 2346 O ALA A 299 46.476 116.967 6.381 1.00 17.34 O ATOM 2347 CB ALA A 299 47.562 115.016 8.906 1.00 17.97 C ATOM 0 H ALA A 299 47.528 113.026 7.424 1.00 16.39 H new ATOM 0 HA ALA A 299 45.871 114.997 7.787 1.00 16.83 H new ATOM 0 HB1 ALA A 299 47.427 115.907 9.266 1.00 17.97 H new ATOM 0 HB2 ALA A 299 47.228 114.359 9.536 1.00 17.97 H new ATOM 0 HB3 ALA A 299 48.509 114.868 8.757 1.00 17.97 H new ATOM 2348 N ALA A 300 48.377 115.832 5.922 1.00 17.15 N ATOM 2349 CA ALA A 300 48.821 116.837 4.949 1.00 19.71 C ATOM 2350 C ALA A 300 47.852 116.969 3.771 1.00 19.93 C ATOM 2351 O ALA A 300 47.563 118.107 3.319 1.00 21.61 O ATOM 2352 CB ALA A 300 50.204 116.469 4.503 1.00 19.85 C ATOM 0 H ALA A 300 48.913 115.168 6.029 1.00 17.15 H new ATOM 0 HA ALA A 300 48.834 117.712 5.368 1.00 19.71 H new ATOM 0 HB1 ALA A 300 50.520 117.120 3.858 1.00 19.85 H new ATOM 0 HB2 ALA A 300 50.799 116.458 5.269 1.00 19.85 H new ATOM 0 HB3 ALA A 300 50.189 115.590 4.093 1.00 19.85 H new ATOM 2353 N GLN A 301 47.342 115.842 3.222 1.00 17.93 N ATOM 2354 CA GLN A 301 46.299 115.906 2.156 1.00 18.34 C ATOM 2355 C GLN A 301 45.017 116.575 2.689 1.00 18.28 C ATOM 2356 O GLN A 301 44.360 117.365 1.958 1.00 20.73 O ATOM 2357 CB GLN A 301 46.038 114.508 1.615 1.00 17.90 C ATOM 2358 CG GLN A 301 47.225 113.835 0.890 1.00 19.99 C ATOM 2359 CD GLN A 301 47.253 112.311 0.952 1.00 23.07 C ATOM 2360 OE1 GLN A 301 46.263 111.648 1.382 1.00 21.62 O ATOM 2361 NE2 GLN A 301 48.366 111.662 0.524 1.00 22.27 N ATOM 0 H GLN A 301 47.579 115.046 3.445 1.00 17.93 H new ATOM 0 HA GLN A 301 46.616 116.455 1.422 1.00 18.34 H new ATOM 0 HB2 GLN A 301 45.767 113.939 2.353 1.00 17.90 H new ATOM 0 HB3 GLN A 301 45.289 114.552 1.001 1.00 17.90 H new ATOM 0 HG2 GLN A 301 47.210 114.105 -0.042 1.00 19.99 H new ATOM 0 HG3 GLN A 301 48.050 114.174 1.270 1.00 19.99 H new ATOM 0 HE21 GLN A 301 49.039 112.110 0.232 1.00 22.27 H new ATOM 0 HE22 GLN A 301 48.398 110.803 0.545 1.00 22.27 H new ATOM 2362 N ALA A 302 44.537 116.262 3.919 1.00 16.61 N ATOM 2363 CA ALA A 302 43.265 116.784 4.432 1.00 17.48 C ATOM 2364 C ALA A 302 43.310 118.315 4.599 1.00 18.34 C ATOM 2365 O ALA A 302 42.268 118.950 4.440 1.00 18.22 O ATOM 2366 CB ALA A 302 42.857 116.089 5.716 1.00 17.78 C ATOM 0 H ALA A 302 44.947 115.742 4.468 1.00 16.61 H new ATOM 0 HA ALA A 302 42.582 116.588 3.772 1.00 17.48 H new ATOM 0 HB1 ALA A 302 42.015 116.455 6.029 1.00 17.78 H new ATOM 0 HB2 ALA A 302 42.755 115.139 5.551 1.00 17.78 H new ATOM 0 HB3 ALA A 302 43.540 116.228 6.391 1.00 17.78 H new ATOM 2367 N LEU A 303 44.469 118.888 4.980 1.00 18.16 N ATOM 2368 CA LEU A 303 44.600 120.345 5.180 1.00 18.10 C ATOM 2369 C LEU A 303 44.271 121.097 3.866 1.00 18.09 C ATOM 2370 O LEU A 303 43.797 122.230 3.941 1.00 22.07 O ATOM 2371 CB LEU A 303 45.989 120.661 5.711 1.00 19.40 C ATOM 2372 CG LEU A 303 46.251 120.298 7.183 1.00 18.79 C ATOM 2373 CD1 LEU A 303 47.746 120.374 7.488 1.00 20.59 C ATOM 2374 CD2 LEU A 303 45.493 121.185 8.156 1.00 20.01 C ATOM 0 H LEU A 303 45.192 118.447 5.128 1.00 18.16 H new ATOM 0 HA LEU A 303 43.961 120.651 5.842 1.00 18.10 H new ATOM 0 HB2 LEU A 303 46.639 120.195 5.162 1.00 19.40 H new ATOM 0 HB3 LEU A 303 46.150 121.611 5.598 1.00 19.40 H new ATOM 0 HG LEU A 303 45.928 119.391 7.305 1.00 18.79 H new ATOM 0 HD11 LEU A 303 47.899 120.143 8.418 1.00 20.59 H new ATOM 0 HD12 LEU A 303 48.225 119.752 6.918 1.00 20.59 H new ATOM 0 HD13 LEU A 303 48.065 121.275 7.322 1.00 20.59 H new ATOM 0 HD21 LEU A 303 45.694 120.914 9.065 1.00 20.01 H new ATOM 0 HD22 LEU A 303 45.761 122.109 8.028 1.00 20.01 H new ATOM 0 HD23 LEU A 303 44.540 121.100 7.997 1.00 20.01 H new ATOM 2375 N ALA A 304 44.519 120.464 2.720 1.00 18.16 N ATOM 2376 CA ALA A 304 44.319 121.052 1.368 1.00 20.68 C ATOM 2377 C ALA A 304 42.879 120.780 0.886 1.00 22.27 C ATOM 2378 O ALA A 304 42.511 121.256 -0.245 1.00 22.05 O ATOM 2379 CB ALA A 304 45.342 120.491 0.380 1.00 21.02 C ATOM 0 H ALA A 304 44.817 119.658 2.694 1.00 18.16 H new ATOM 0 HA ALA A 304 44.452 122.012 1.419 1.00 20.68 H new ATOM 0 HB1 ALA A 304 45.197 120.885 -0.495 1.00 21.02 H new ATOM 0 HB2 ALA A 304 46.238 120.704 0.685 1.00 21.02 H new ATOM 0 HB3 ALA A 304 45.241 119.528 0.321 1.00 21.02 H new ATOM 2380 N HIS A 305 42.044 120.056 1.632 1.00 18.68 N ATOM 2381 CA HIS A 305 40.636 119.805 1.218 1.00 20.36 C ATOM 2382 C HIS A 305 39.832 121.121 1.244 1.00 19.06 C ATOM 2383 O HIS A 305 39.998 121.954 2.131 1.00 20.84 O ATOM 2384 CB HIS A 305 40.017 118.727 2.125 1.00 20.09 C ATOM 2385 CG HIS A 305 38.681 118.201 1.695 1.00 20.40 C ATOM 2386 ND1 HIS A 305 37.522 118.911 1.957 1.00 20.40 N ATOM 2387 CD2 HIS A 305 38.334 117.078 1.052 1.00 21.00 C ATOM 2388 CE1 HIS A 305 36.479 118.183 1.507 1.00 19.96 C ATOM 2389 NE2 HIS A 305 36.933 117.083 0.915 1.00 21.01 N ATOM 0 H HIS A 305 42.262 119.697 2.382 1.00 18.68 H new ATOM 0 HA HIS A 305 40.613 119.474 0.307 1.00 20.36 H new ATOM 0 HB2 HIS A 305 40.636 117.982 2.182 1.00 20.09 H new ATOM 0 HB3 HIS A 305 39.929 119.092 3.019 1.00 20.09 H new ATOM 0 HD2 HIS A 305 38.913 116.416 0.751 1.00 21.00 H new ATOM 0 HE1 HIS A 305 35.583 118.415 1.597 1.00 19.96 H new ATOM 0 HE2 HIS A 305 36.458 116.484 0.521 1.00 21.01 H new ATOM 2390 N ALA A 306 38.866 121.269 0.305 1.00 21.72 N ATOM 2391 CA ALA A 306 38.086 122.509 0.195 1.00 23.70 C ATOM 2392 C ALA A 306 37.301 122.833 1.449 1.00 21.69 C ATOM 2393 O ALA A 306 36.955 123.973 1.699 1.00 22.10 O ATOM 2394 CB ALA A 306 37.187 122.436 -1.028 1.00 25.37 C ATOM 0 H ALA A 306 38.656 120.664 -0.268 1.00 21.72 H new ATOM 0 HA ALA A 306 38.712 123.242 0.089 1.00 23.70 H new ATOM 0 HB1 ALA A 306 36.672 123.255 -1.101 1.00 25.37 H new ATOM 0 HB2 ALA A 306 37.731 122.325 -1.823 1.00 25.37 H new ATOM 0 HB3 ALA A 306 36.583 121.682 -0.942 1.00 25.37 H new ATOM 2395 N TYR A 307 36.974 121.861 2.323 1.00 21.13 N ATOM 2396 CA TYR A 307 36.272 122.167 3.577 1.00 21.11 C ATOM 2397 C TYR A 307 36.995 123.225 4.432 1.00 20.18 C ATOM 2398 O TYR A 307 36.355 123.987 5.228 1.00 22.47 O ATOM 2399 CB TYR A 307 36.044 120.884 4.393 1.00 20.33 C ATOM 2400 CG TYR A 307 35.163 121.047 5.614 1.00 19.96 C ATOM 2401 CD1 TYR A 307 33.874 121.605 5.564 1.00 21.93 C ATOM 2402 CD2 TYR A 307 35.560 120.576 6.878 1.00 21.30 C ATOM 2403 CE1 TYR A 307 33.063 121.686 6.684 1.00 22.22 C ATOM 2404 CE2 TYR A 307 34.760 120.703 7.995 1.00 21.48 C ATOM 2405 CZ TYR A 307 33.478 121.231 7.927 1.00 23.42 C ATOM 2406 OH TYR A 307 32.670 121.315 9.035 1.00 24.21 O ATOM 0 H TYR A 307 37.150 121.027 2.206 1.00 21.13 H new ATOM 0 HA TYR A 307 35.416 122.549 3.328 1.00 21.11 H new ATOM 0 HB2 TYR A 307 35.648 120.215 3.813 1.00 20.33 H new ATOM 0 HB3 TYR A 307 36.906 120.540 4.677 1.00 20.33 H new ATOM 0 HD1 TYR A 307 33.555 121.930 4.753 1.00 21.93 H new ATOM 0 HD2 TYR A 307 36.390 120.165 6.964 1.00 21.30 H new ATOM 0 HE1 TYR A 307 32.214 122.057 6.600 1.00 22.22 H new ATOM 0 HE2 TYR A 307 35.090 120.426 8.819 1.00 21.48 H new ATOM 0 HH TYR A 307 31.944 121.681 8.825 1.00 24.21 H new ATOM 2407 N PHE A 308 38.352 123.277 4.375 1.00 20.75 N ATOM 2408 CA PHE A 308 39.165 124.189 5.206 1.00 20.21 C ATOM 2409 C PHE A 308 39.630 125.443 4.431 1.00 25.32 C ATOM 2410 O PHE A 308 40.587 126.100 4.892 1.00 23.79 O ATOM 2411 CB PHE A 308 40.410 123.471 5.775 1.00 19.44 C ATOM 2412 CG PHE A 308 40.045 122.243 6.579 1.00 18.10 C ATOM 2413 CD1 PHE A 308 39.252 122.353 7.699 1.00 20.02 C ATOM 2414 CD2 PHE A 308 40.406 120.959 6.155 1.00 20.26 C ATOM 2415 CE1 PHE A 308 38.860 121.229 8.446 1.00 18.81 C ATOM 2416 CE2 PHE A 308 40.035 119.852 6.914 1.00 18.54 C ATOM 2417 CZ PHE A 308 39.218 119.975 8.018 1.00 18.71 C ATOM 0 H PHE A 308 38.819 122.781 3.850 1.00 20.75 H new ATOM 0 HA PHE A 308 38.586 124.471 5.931 1.00 20.21 H new ATOM 0 HB2 PHE A 308 40.995 123.215 5.045 1.00 19.44 H new ATOM 0 HB3 PHE A 308 40.908 124.086 6.336 1.00 19.44 H new ATOM 0 HD1 PHE A 308 38.967 123.196 7.969 1.00 20.02 H new ATOM 0 HD2 PHE A 308 40.891 120.846 5.370 1.00 20.26 H new ATOM 0 HE1 PHE A 308 38.362 121.334 9.224 1.00 18.81 H new ATOM 0 HE2 PHE A 308 40.346 119.010 6.671 1.00 18.54 H new ATOM 0 HZ PHE A 308 38.914 119.219 8.466 1.00 18.71 H new ATOM 2418 N ALA A 309 38.976 125.766 3.318 1.00 24.90 N ATOM 2419 CA ALA A 309 39.460 126.883 2.455 1.00 27.74 C ATOM 2420 C ALA A 309 39.660 128.204 3.222 1.00 27.73 C ATOM 2421 O ALA A 309 40.623 128.952 2.876 1.00 29.98 O ATOM 2422 CB ALA A 309 38.544 127.038 1.263 1.00 29.98 C ATOM 0 H ALA A 309 38.266 125.371 3.037 1.00 24.90 H new ATOM 0 HA ALA A 309 40.346 126.649 2.137 1.00 27.74 H new ATOM 0 HB1 ALA A 309 38.861 127.765 0.704 1.00 29.98 H new ATOM 0 HB2 ALA A 309 38.538 126.215 0.750 1.00 29.98 H new ATOM 0 HB3 ALA A 309 37.645 127.234 1.569 1.00 29.98 H new ATOM 2423 N GLN A 310 38.834 128.531 4.217 0.50 27.13 N ATOM 2424 CA GLN A 310 38.965 129.846 4.907 0.50 28.25 C ATOM 2425 C GLN A 310 40.137 129.826 5.904 0.50 28.21 C ATOM 2426 O GLN A 310 40.536 130.924 6.365 0.50 26.91 O ATOM 2427 CB GLN A 310 37.657 130.288 5.565 0.50 29.54 C ATOM 2428 CG GLN A 310 37.199 129.448 6.742 0.50 30.83 C ATOM 2429 CD GLN A 310 35.852 129.925 7.236 0.50 34.26 C ATOM 2430 OE1 GLN A 310 35.685 131.240 7.288 0.50 35.98 O flip ATOM 2431 NE2 GLN A 310 34.954 129.135 7.539 0.50 32.33 N flip ATOM 0 H GLN A 310 38.202 128.028 4.511 0.50 27.13 H new ATOM 0 HA GLN A 310 39.164 130.512 4.231 0.50 28.25 H new ATOM 0 HB2 GLN A 310 37.757 131.206 5.863 0.50 29.54 H new ATOM 0 HB3 GLN A 310 36.958 130.283 4.893 0.50 29.54 H new ATOM 0 HG2 GLN A 310 37.142 128.516 6.479 0.50 30.83 H new ATOM 0 HG3 GLN A 310 37.851 129.502 7.459 0.50 30.83 H new ATOM 0 HE21 GLN A 310 35.094 128.288 7.495 0.50 32.33 H new ATOM 0 HE22 GLN A 310 34.188 129.432 7.794 0.50 32.33 H new ATOM 2432 N TYR A 311 40.698 128.656 6.239 1.00 26.47 N ATOM 2433 CA TYR A 311 41.799 128.579 7.240 1.00 25.30 C ATOM 2434 C TYR A 311 43.156 128.105 6.695 1.00 23.74 C ATOM 2435 O TYR A 311 44.190 128.486 7.246 1.00 25.70 O ATOM 2436 CB TYR A 311 41.407 127.669 8.419 1.00 26.25 C ATOM 2437 CG TYR A 311 40.219 128.176 9.192 1.00 26.48 C ATOM 2438 CD1 TYR A 311 38.995 127.576 9.066 1.00 28.36 C ATOM 2439 CD2 TYR A 311 40.314 129.320 9.965 1.00 30.35 C ATOM 2440 CE1 TYR A 311 37.886 128.057 9.735 1.00 28.85 C ATOM 2441 CE2 TYR A 311 39.212 129.827 10.643 1.00 34.91 C ATOM 2442 CZ TYR A 311 37.985 129.204 10.504 1.00 34.34 C ATOM 2443 OH TYR A 311 36.849 129.658 11.124 1.00 35.13 O ATOM 0 H TYR A 311 40.465 127.898 5.907 1.00 26.47 H new ATOM 0 HA TYR A 311 41.919 129.499 7.523 1.00 25.30 H new ATOM 0 HB2 TYR A 311 41.211 126.781 8.083 1.00 26.25 H new ATOM 0 HB3 TYR A 311 42.164 127.584 9.020 1.00 26.25 H new ATOM 0 HD1 TYR A 311 38.908 126.829 8.519 1.00 28.36 H new ATOM 0 HD2 TYR A 311 41.132 129.758 10.032 1.00 30.35 H new ATOM 0 HE1 TYR A 311 37.073 127.610 9.669 1.00 28.85 H new ATOM 0 HE2 TYR A 311 39.299 130.578 11.185 1.00 34.91 H new ATOM 0 HH TYR A 311 36.177 129.449 10.665 1.00 35.13 H new ATOM 2444 N HIS A 312 43.153 127.299 5.632 0.50 22.47 N ATOM 2445 CA HIS A 312 44.368 126.653 5.059 0.50 21.77 C ATOM 2446 C HIS A 312 45.387 127.713 4.607 0.50 23.83 C ATOM 2447 O HIS A 312 45.007 128.626 3.837 0.50 25.30 O ATOM 2448 CB HIS A 312 43.983 125.688 3.920 0.50 21.72 C ATOM 2449 CG HIS A 312 45.121 125.050 3.189 0.50 22.84 C ATOM 2450 ND1 HIS A 312 46.204 124.467 3.834 0.50 20.46 N ATOM 2451 CD2 HIS A 312 45.325 124.853 1.865 0.50 23.14 C ATOM 2452 CE1 HIS A 312 47.037 123.973 2.938 0.50 22.88 C ATOM 2453 NE2 HIS A 312 46.516 124.189 1.712 0.50 22.27 N ATOM 0 H HIS A 312 42.433 127.100 5.205 0.50 22.47 H new ATOM 0 HA HIS A 312 44.797 126.124 5.750 0.50 21.77 H new ATOM 0 HB2 HIS A 312 43.425 124.986 4.290 0.50 21.72 H new ATOM 0 HB3 HIS A 312 43.441 126.173 3.278 0.50 21.72 H new ATOM 0 HD1 HIS A 312 46.315 124.433 4.686 0.50 20.46 H new ATOM 0 HD2 HIS A 312 44.757 125.121 1.179 0.50 23.14 H new ATOM 0 HE1 HIS A 312 47.844 123.549 3.120 0.50 22.88 H new ATOM 2454 N ASP A 313 46.634 127.566 5.060 1.00 23.96 N ATOM 2455 CA ASP A 313 47.784 128.436 4.657 1.00 24.53 C ATOM 2456 C ASP A 313 49.000 127.550 4.601 1.00 23.77 C ATOM 2457 O ASP A 313 49.552 127.206 5.651 1.00 23.25 O ATOM 2458 CB ASP A 313 48.012 129.598 5.631 1.00 27.30 C ATOM 2459 CG ASP A 313 49.151 130.491 5.193 1.00 29.92 C ATOM 2460 OD1 ASP A 313 49.818 130.129 4.221 1.00 28.18 O ATOM 2461 OD2 ASP A 313 49.346 131.509 5.872 1.00 36.52 O ATOM 0 H ASP A 313 46.854 126.952 5.620 1.00 23.96 H new ATOM 0 HA ASP A 313 47.597 128.844 3.797 1.00 24.53 H new ATOM 0 HB2 ASP A 313 47.200 130.123 5.702 1.00 27.30 H new ATOM 0 HB3 ASP A 313 48.200 129.246 6.515 1.00 27.30 H new ATOM 2462 N PRO A 314 49.407 127.074 3.407 1.00 24.40 N ATOM 2463 CA PRO A 314 50.487 126.102 3.310 1.00 25.22 C ATOM 2464 C PRO A 314 51.850 126.678 3.736 1.00 25.48 C ATOM 2465 O PRO A 314 52.773 125.897 3.895 1.00 28.04 O ATOM 2466 CB PRO A 314 50.454 125.672 1.817 1.00 27.89 C ATOM 2467 CG PRO A 314 49.848 126.875 1.121 1.00 30.02 C ATOM 2468 CD PRO A 314 48.867 127.481 2.104 1.00 29.00 C ATOM 0 HA PRO A 314 50.367 125.353 3.915 1.00 25.22 H new ATOM 0 HB2 PRO A 314 51.342 125.474 1.482 1.00 27.89 H new ATOM 0 HB3 PRO A 314 49.917 124.875 1.686 1.00 27.89 H new ATOM 0 HG2 PRO A 314 50.534 127.516 0.876 1.00 30.02 H new ATOM 0 HG3 PRO A 314 49.400 126.612 0.302 1.00 30.02 H new ATOM 0 HD2 PRO A 314 48.824 128.446 2.019 1.00 29.00 H new ATOM 0 HD3 PRO A 314 47.968 127.144 1.967 1.00 29.00 H new ATOM 2469 N ASP A 315 51.938 127.998 3.967 1.00 25.08 N ATOM 2470 CA ASP A 315 53.181 128.626 4.514 1.00 26.38 C ATOM 2471 C ASP A 315 53.119 128.748 6.046 1.00 27.31 C ATOM 2472 O ASP A 315 54.100 129.188 6.644 1.00 28.84 O ATOM 2473 CB ASP A 315 53.452 129.982 3.856 1.00 28.81 C ATOM 2474 CG ASP A 315 53.855 129.869 2.398 1.00 32.80 C ATOM 2475 OD1 ASP A 315 54.592 128.902 2.037 1.00 35.38 O ATOM 2476 OD2 ASP A 315 53.448 130.734 1.648 1.00 43.11 O ATOM 0 H ASP A 315 51.298 128.553 3.818 1.00 25.08 H new ATOM 0 HA ASP A 315 53.925 128.042 4.299 1.00 26.38 H new ATOM 0 HB2 ASP A 315 52.656 130.533 3.924 1.00 28.81 H new ATOM 0 HB3 ASP A 315 54.155 130.438 4.345 1.00 28.81 H new ATOM 2477 N ASP A 316 52.042 128.293 6.698 1.00 23.51 N ATOM 2478 CA ASP A 316 51.876 128.369 8.176 1.00 24.89 C ATOM 2479 C ASP A 316 51.331 127.023 8.696 1.00 20.77 C ATOM 2480 O ASP A 316 50.475 127.056 9.633 1.00 23.29 O ATOM 2481 CB ASP A 316 50.984 129.551 8.551 1.00 28.38 C ATOM 2482 CG ASP A 316 50.960 129.945 10.030 1.00 33.81 C ATOM 2483 OD1 ASP A 316 51.890 129.607 10.734 1.00 35.90 O ATOM 2484 OD2 ASP A 316 49.914 130.488 10.443 1.00 42.57 O ATOM 0 H ASP A 316 51.375 127.926 6.298 1.00 23.51 H new ATOM 0 HA ASP A 316 52.734 128.525 8.602 1.00 24.89 H new ATOM 0 HB2 ASP A 316 51.269 130.322 8.036 1.00 28.38 H new ATOM 0 HB3 ASP A 316 50.077 129.346 8.276 1.00 28.38 H new ATOM 2485 N GLU A 317 51.864 125.927 8.161 1.00 21.96 N ATOM 2486 CA GLU A 317 51.537 124.528 8.574 1.00 21.16 C ATOM 2487 C GLU A 317 52.847 123.773 8.746 1.00 20.59 C ATOM 2488 O GLU A 317 53.180 122.905 7.948 1.00 21.07 O ATOM 2489 CB GLU A 317 50.560 123.922 7.549 1.00 22.21 C ATOM 2490 CG GLU A 317 49.165 124.566 7.605 1.00 22.31 C ATOM 2491 CD GLU A 317 48.198 124.272 6.455 1.00 21.04 C ATOM 2492 OE1 GLU A 317 48.596 123.604 5.502 1.00 23.61 O ATOM 2493 OE2 GLU A 317 47.094 124.823 6.467 1.00 21.82 O ATOM 0 H GLU A 317 52.445 125.961 7.528 1.00 21.96 H new ATOM 0 HA GLU A 317 51.078 124.480 9.427 1.00 21.16 H new ATOM 0 HB2 GLU A 317 50.926 124.029 6.657 1.00 22.21 H new ATOM 0 HB3 GLU A 317 50.479 122.969 7.710 1.00 22.21 H new ATOM 0 HG2 GLU A 317 48.740 124.286 8.431 1.00 22.31 H new ATOM 0 HG3 GLU A 317 49.282 125.527 7.658 1.00 22.31 H new ATOM 2494 N PRO A 318 53.611 124.079 9.817 1.00 20.11 N ATOM 2495 CA PRO A 318 54.976 123.579 9.945 1.00 22.02 C ATOM 2496 C PRO A 318 55.132 122.081 10.250 1.00 22.49 C ATOM 2497 O PRO A 318 54.214 121.429 10.780 1.00 21.81 O ATOM 2498 CB PRO A 318 55.552 124.449 11.065 1.00 23.72 C ATOM 2499 CG PRO A 318 54.419 125.028 11.838 1.00 24.70 C ATOM 2500 CD PRO A 318 53.223 124.996 10.904 1.00 21.83 C ATOM 0 HA PRO A 318 55.438 123.643 9.094 1.00 22.02 H new ATOM 0 HB2 PRO A 318 56.121 123.919 11.645 1.00 23.72 H new ATOM 0 HB3 PRO A 318 56.104 125.155 10.694 1.00 23.72 H new ATOM 0 HG2 PRO A 318 54.247 124.513 12.642 1.00 24.70 H new ATOM 0 HG3 PRO A 318 54.617 125.935 12.119 1.00 24.70 H new ATOM 0 HD2 PRO A 318 52.428 124.681 11.362 1.00 21.83 H new ATOM 0 HD3 PRO A 318 53.021 125.881 10.562 1.00 21.83 H new ATOM 2501 N VAL A 319 56.257 121.518 9.806 1.00 22.76 N ATOM 2502 CA VAL A 319 56.710 120.154 10.132 1.00 22.32 C ATOM 2503 C VAL A 319 57.700 120.173 11.298 1.00 18.61 C ATOM 2504 O VAL A 319 58.198 121.275 11.721 1.00 22.16 O ATOM 2505 CB VAL A 319 57.239 119.402 8.912 1.00 24.18 C ATOM 2506 CG1 VAL A 319 56.133 119.241 7.856 1.00 30.49 C ATOM 2507 CG2 VAL A 319 58.466 120.101 8.345 1.00 29.70 C ATOM 0 H VAL A 319 56.802 121.933 9.286 1.00 22.76 H new ATOM 0 HA VAL A 319 55.934 119.650 10.423 1.00 22.32 H new ATOM 0 HB VAL A 319 57.511 118.512 9.186 1.00 24.18 H new ATOM 0 HG11 VAL A 319 56.485 118.762 7.089 1.00 30.49 H new ATOM 0 HG12 VAL A 319 55.393 118.743 8.236 1.00 30.49 H new ATOM 0 HG13 VAL A 319 55.823 120.116 7.576 1.00 30.49 H new ATOM 0 HG21 VAL A 319 58.789 119.612 7.572 1.00 29.70 H new ATOM 0 HG22 VAL A 319 58.231 121.004 8.080 1.00 29.70 H new ATOM 0 HG23 VAL A 319 59.161 120.133 9.021 1.00 29.70 H new ATOM 2508 N ALA A 320 57.961 118.993 11.843 1.00 19.42 N ATOM 2509 CA ALA A 320 58.834 118.830 13.025 1.00 19.61 C ATOM 2510 C ALA A 320 60.298 118.642 12.594 1.00 18.69 C ATOM 2511 O ALA A 320 60.549 118.086 11.491 1.00 19.65 O ATOM 2512 CB ALA A 320 58.393 117.681 13.902 1.00 20.70 C ATOM 0 H ALA A 320 57.640 118.253 11.544 1.00 19.42 H new ATOM 0 HA ALA A 320 58.761 119.642 13.550 1.00 19.61 H new ATOM 0 HB1 ALA A 320 58.989 117.608 14.664 1.00 20.70 H new ATOM 0 HB2 ALA A 320 57.489 117.840 14.214 1.00 20.70 H new ATOM 0 HB3 ALA A 320 58.418 116.856 13.392 1.00 20.70 H new ATOM 2513 N ASP A 321 61.172 118.956 13.552 1.00 19.11 N ATOM 2514 CA ASP A 321 62.573 118.476 13.465 1.00 19.06 C ATOM 2515 C ASP A 321 62.565 116.949 13.507 1.00 19.65 C ATOM 2516 O ASP A 321 61.704 116.284 14.101 1.00 18.08 O ATOM 2517 CB ASP A 321 63.408 119.028 14.610 1.00 21.17 C ATOM 2518 CG ASP A 321 63.795 120.482 14.464 1.00 28.01 C ATOM 2519 OD1 ASP A 321 63.786 120.975 13.314 1.00 30.86 O ATOM 2520 OD2 ASP A 321 64.139 121.060 15.493 1.00 28.44 O ATOM 0 H ASP A 321 60.990 119.431 14.245 1.00 19.11 H new ATOM 0 HA ASP A 321 62.969 118.786 12.635 1.00 19.06 H new ATOM 0 HB2 ASP A 321 62.913 118.919 15.437 1.00 21.17 H new ATOM 0 HB3 ASP A 321 64.216 118.497 14.691 1.00 21.17 H new ATOM 2521 N PRO A 322 63.585 116.265 12.911 1.00 20.81 N ATOM 2522 CA PRO A 322 63.715 114.831 13.021 1.00 20.88 C ATOM 2523 C PRO A 322 63.772 114.320 14.482 1.00 19.01 C ATOM 2524 O PRO A 322 64.318 115.025 15.341 1.00 21.04 O ATOM 2525 CB PRO A 322 65.058 114.577 12.234 1.00 23.95 C ATOM 2526 CG PRO A 322 65.223 115.756 11.345 1.00 28.32 C ATOM 2527 CD PRO A 322 64.646 116.913 12.110 1.00 25.47 C ATOM 0 HA PRO A 322 62.950 114.350 12.668 1.00 20.88 H new ATOM 0 HB2 PRO A 322 65.809 114.490 12.842 1.00 23.95 H new ATOM 0 HB3 PRO A 322 65.012 113.755 11.720 1.00 23.95 H new ATOM 0 HG2 PRO A 322 66.158 115.907 11.134 1.00 28.32 H new ATOM 0 HG3 PRO A 322 64.759 115.627 10.503 1.00 28.32 H new ATOM 0 HD2 PRO A 322 65.310 117.343 12.670 1.00 25.47 H new ATOM 0 HD3 PRO A 322 64.288 117.595 11.520 1.00 25.47 H new ATOM 2528 N TYR A 323 63.125 113.171 14.727 1.00 20.61 N ATOM 2529 CA TYR A 323 62.969 112.540 16.068 1.00 19.05 C ATOM 2530 C TYR A 323 63.612 111.148 16.078 1.00 22.31 C ATOM 2531 O TYR A 323 63.031 110.257 15.436 1.00 22.58 O ATOM 2532 CB TYR A 323 61.478 112.558 16.495 1.00 20.51 C ATOM 2533 CG TYR A 323 61.242 112.047 17.878 1.00 20.22 C ATOM 2534 CD1 TYR A 323 61.819 112.729 18.937 1.00 22.57 C ATOM 2535 CD2 TYR A 323 60.488 110.934 18.145 1.00 22.29 C ATOM 2536 CE1 TYR A 323 61.665 112.278 20.231 1.00 25.47 C ATOM 2537 CE2 TYR A 323 60.258 110.523 19.451 1.00 27.29 C ATOM 2538 CZ TYR A 323 60.837 111.228 20.490 1.00 23.73 C ATOM 2539 OH TYR A 323 60.623 110.804 21.775 1.00 31.38 O ATOM 0 H TYR A 323 62.749 112.716 14.101 1.00 20.61 H new ATOM 0 HA TYR A 323 63.444 113.054 16.740 1.00 19.05 H new ATOM 0 HB2 TYR A 323 61.143 113.466 16.433 1.00 20.51 H new ATOM 0 HB3 TYR A 323 60.964 112.023 15.869 1.00 20.51 H new ATOM 0 HD1 TYR A 323 62.315 113.499 18.774 1.00 22.57 H new ATOM 0 HD2 TYR A 323 60.125 110.447 17.441 1.00 22.29 H new ATOM 0 HE1 TYR A 323 62.126 112.690 20.926 1.00 25.47 H new ATOM 0 HE2 TYR A 323 59.722 109.783 19.625 1.00 27.29 H new ATOM 0 HH TYR A 323 60.540 109.968 21.784 1.00 31.38 H new ATOM 2540 N ASP A 324 64.709 110.952 16.824 1.00 19.84 N ATOM 2541 CA ASP A 324 65.384 109.638 16.941 1.00 19.73 C ATOM 2542 C ASP A 324 64.717 108.775 18.011 1.00 21.01 C ATOM 2543 O ASP A 324 64.840 109.135 19.184 1.00 22.88 O ATOM 2544 CB ASP A 324 66.857 109.885 17.155 1.00 21.83 C ATOM 2545 CG ASP A 324 67.729 108.624 17.214 1.00 25.78 C ATOM 2546 OD1 ASP A 324 67.225 107.597 17.635 1.00 24.67 O ATOM 2547 OD2 ASP A 324 68.944 108.759 16.849 1.00 29.06 O ATOM 0 H ASP A 324 65.087 111.576 17.279 1.00 19.84 H new ATOM 0 HA ASP A 324 65.294 109.120 16.126 1.00 19.73 H new ATOM 0 HB2 ASP A 324 67.182 110.453 16.439 1.00 21.83 H new ATOM 0 HB3 ASP A 324 66.971 110.379 17.982 1.00 21.83 H new ATOM 2548 N GLN A 325 63.993 107.745 17.594 1.00 21.57 N ATOM 2549 CA GLN A 325 63.309 106.753 18.440 1.00 23.77 C ATOM 2550 C GLN A 325 64.040 105.396 18.464 1.00 23.87 C ATOM 2551 O GLN A 325 63.460 104.368 18.894 1.00 23.82 O ATOM 2552 CB GLN A 325 61.893 106.451 17.924 1.00 29.90 C ATOM 2553 CG GLN A 325 60.995 107.630 17.986 1.00 36.74 C ATOM 2554 CD GLN A 325 59.557 107.180 17.842 1.00 31.35 C ATOM 2555 OE1 GLN A 325 59.051 106.486 18.707 1.00 34.68 O ATOM 2556 NE2 GLN A 325 58.948 107.581 16.735 1.00 29.12 N ATOM 0 H GLN A 325 63.876 107.590 16.756 1.00 21.57 H new ATOM 0 HA GLN A 325 63.292 107.151 19.324 1.00 23.77 H new ATOM 0 HB2 GLN A 325 61.947 106.139 17.007 1.00 29.90 H new ATOM 0 HB3 GLN A 325 61.510 105.730 18.447 1.00 29.90 H new ATOM 0 HG2 GLN A 325 61.115 108.096 18.828 1.00 36.74 H new ATOM 0 HG3 GLN A 325 61.220 108.257 17.281 1.00 36.74 H new ATOM 0 HE21 GLN A 325 59.368 108.071 16.167 1.00 29.12 H new ATOM 0 HE22 GLN A 325 58.133 107.351 16.585 1.00 29.12 H new ATOM 2557 N SER A 326 65.332 105.397 18.165 1.00 22.03 N ATOM 2558 CA SER A 326 66.120 104.140 18.172 1.00 23.70 C ATOM 2559 C SER A 326 66.165 103.554 19.581 1.00 24.41 C ATOM 2560 O SER A 326 66.298 102.329 19.693 1.00 23.25 O ATOM 2561 CB SER A 326 67.495 104.347 17.615 1.00 23.92 C ATOM 2562 OG SER A 326 68.285 105.170 18.410 1.00 22.41 O ATOM 0 H SER A 326 65.780 106.101 17.955 1.00 22.03 H new ATOM 0 HA SER A 326 65.678 103.501 17.592 1.00 23.70 H new ATOM 0 HB2 SER A 326 67.931 103.486 17.516 1.00 23.92 H new ATOM 0 HB3 SER A 326 67.424 104.733 16.728 1.00 23.92 H new ATOM 0 HG SER A 326 68.083 105.973 18.270 1.00 22.41 H new ATOM 2563 N PHE A 327 65.971 104.335 20.659 1.00 20.49 N ATOM 2564 CA PHE A 327 65.955 103.765 22.022 1.00 20.88 C ATOM 2565 C PHE A 327 64.813 102.729 22.174 1.00 20.92 C ATOM 2566 O PHE A 327 64.936 101.898 23.052 1.00 22.87 O ATOM 2567 CB PHE A 327 65.793 104.873 23.091 1.00 19.56 C ATOM 2568 CG PHE A 327 64.421 105.526 23.147 1.00 20.89 C ATOM 2569 CD1 PHE A 327 63.404 104.972 23.916 1.00 21.70 C ATOM 2570 CD2 PHE A 327 64.096 106.594 22.337 1.00 22.08 C ATOM 2571 CE1 PHE A 327 62.155 105.566 23.996 1.00 21.77 C ATOM 2572 CE2 PHE A 327 62.835 107.174 22.398 1.00 22.30 C ATOM 2573 CZ PHE A 327 61.862 106.643 23.215 1.00 21.48 C ATOM 0 H PHE A 327 65.848 105.185 20.624 1.00 20.49 H new ATOM 0 HA PHE A 327 66.807 103.321 22.159 1.00 20.88 H new ATOM 0 HB2 PHE A 327 65.990 104.493 23.962 1.00 19.56 H new ATOM 0 HB3 PHE A 327 66.456 105.561 22.925 1.00 19.56 H new ATOM 0 HD1 PHE A 327 63.565 104.186 24.387 1.00 21.70 H new ATOM 0 HD2 PHE A 327 64.728 106.930 21.743 1.00 22.08 H new ATOM 0 HE1 PHE A 327 61.517 105.230 24.583 1.00 21.77 H new ATOM 0 HE2 PHE A 327 62.647 107.926 21.884 1.00 22.30 H new ATOM 0 HZ PHE A 327 61.011 107.017 23.233 1.00 21.48 H new ATOM 2574 N GLU A 328 63.796 102.765 21.337 1.00 23.06 N ATOM 2575 CA GLU A 328 62.601 101.890 21.522 1.00 23.49 C ATOM 2576 C GLU A 328 62.990 100.417 21.336 1.00 26.72 C ATOM 2577 O GLU A 328 62.274 99.556 21.872 1.00 27.71 O ATOM 2578 CB GLU A 328 61.489 102.270 20.567 1.00 24.23 C ATOM 2579 CG GLU A 328 60.754 103.526 20.996 1.00 23.96 C ATOM 2580 CD GLU A 328 59.850 103.397 22.206 1.00 25.53 C ATOM 2581 OE1 GLU A 328 59.882 102.359 22.923 1.00 27.18 O ATOM 2582 OE2 GLU A 328 59.162 104.433 22.465 1.00 26.75 O ATOM 0 H GLU A 328 63.757 103.281 20.650 1.00 23.06 H new ATOM 0 HA GLU A 328 62.271 102.016 22.425 1.00 23.49 H new ATOM 0 HB2 GLU A 328 61.860 102.403 19.681 1.00 24.23 H new ATOM 0 HB3 GLU A 328 60.858 101.536 20.503 1.00 24.23 H new ATOM 0 HG2 GLU A 328 61.411 104.215 21.180 1.00 23.96 H new ATOM 0 HG3 GLU A 328 60.219 103.836 20.248 1.00 23.96 H new ATOM 2583 N SER A 329 64.041 100.136 20.570 1.00 27.40 N ATOM 2584 CA SER A 329 64.474 98.733 20.295 1.00 29.20 C ATOM 2585 C SER A 329 65.673 98.357 21.154 1.00 33.64 C ATOM 2586 O SER A 329 66.249 97.275 20.938 1.00 37.66 O ATOM 2587 CB SER A 329 64.732 98.508 18.822 1.00 33.84 C ATOM 2588 OG SER A 329 65.680 99.426 18.342 1.00 38.58 O ATOM 0 H SER A 329 64.529 100.735 20.192 1.00 27.40 H new ATOM 0 HA SER A 329 63.746 98.141 20.541 1.00 29.20 H new ATOM 0 HB2 SER A 329 65.049 97.603 18.678 1.00 33.84 H new ATOM 0 HB3 SER A 329 63.904 98.601 18.325 1.00 33.84 H new ATOM 0 HG SER A 329 65.814 99.289 17.524 1.00 38.58 H new ATOM 2589 N ARG A 330 66.054 99.189 22.120 1.00 30.14 N ATOM 2590 CA ARG A 330 67.258 99.008 22.936 1.00 29.34 C ATOM 2591 C ARG A 330 66.921 98.292 24.240 1.00 30.81 C ATOM 2592 O ARG A 330 65.837 98.579 24.860 1.00 32.18 O ATOM 2593 CB ARG A 330 67.900 100.381 23.122 1.00 34.17 C ATOM 2594 CG ARG A 330 69.306 100.380 23.654 1.00 33.56 C ATOM 2595 CD ARG A 330 69.825 101.812 23.783 1.00 30.58 C ATOM 2596 NE ARG A 330 69.834 102.519 22.531 1.00 27.09 N ATOM 2597 CZ ARG A 330 69.640 103.832 22.332 1.00 27.52 C ATOM 2598 NH1 ARG A 330 69.461 104.685 23.341 1.00 27.03 N ATOM 2599 NH2 ARG A 330 69.572 104.292 21.116 1.00 30.52 N ATOM 0 H ARG A 330 65.608 99.895 22.326 1.00 30.14 H new ATOM 0 HA ARG A 330 67.905 98.432 22.499 1.00 29.34 H new ATOM 0 HB2 ARG A 330 67.896 100.839 22.267 1.00 34.17 H new ATOM 0 HB3 ARG A 330 67.345 100.900 23.725 1.00 34.17 H new ATOM 0 HG2 ARG A 330 69.331 99.941 24.519 1.00 33.56 H new ATOM 0 HG3 ARG A 330 69.882 99.872 23.061 1.00 33.56 H new ATOM 0 HD2 ARG A 330 69.273 102.295 24.418 1.00 30.58 H new ATOM 0 HD3 ARG A 330 70.725 101.794 24.145 1.00 30.58 H new ATOM 0 HE ARG A 330 69.981 102.046 21.828 1.00 27.09 H new ATOM 0 HH11 ARG A 330 69.468 104.399 24.152 1.00 27.03 H new ATOM 0 HH12 ARG A 330 69.339 105.521 23.181 1.00 27.03 H new ATOM 0 HH21 ARG A 330 69.651 103.756 20.448 1.00 30.52 H new ATOM 0 HH22 ARG A 330 69.448 105.132 20.980 1.00 30.52 H new ATOM 2600 N ASP A 331 67.812 97.377 24.614 1.00 32.55 N ATOM 2601 CA ASP A 331 67.682 96.544 25.833 1.00 36.91 C ATOM 2602 C ASP A 331 68.611 97.116 26.906 1.00 31.45 C ATOM 2603 O ASP A 331 69.865 96.936 26.808 1.00 32.68 O ATOM 2604 CB ASP A 331 67.904 95.068 25.490 1.00 41.74 C ATOM 2605 CG ASP A 331 66.622 94.408 24.987 1.00 51.73 C ATOM 2606 OD1 ASP A 331 65.542 94.651 25.583 1.00 56.31 O ATOM 2607 OD2 ASP A 331 66.692 93.675 23.988 1.00 65.17 O ATOM 0 H ASP A 331 68.526 97.212 24.164 1.00 32.55 H new ATOM 0 HA ASP A 331 66.785 96.574 26.202 1.00 36.91 H new ATOM 0 HB2 ASP A 331 68.594 94.993 24.813 1.00 41.74 H new ATOM 0 HB3 ASP A 331 68.224 94.597 26.275 1.00 41.74 H new ATOM 2608 N LEU A 332 68.060 97.795 27.929 1.00 26.40 N ATOM 2609 CA LEU A 332 68.912 98.360 29.009 1.00 25.07 C ATOM 2610 C LEU A 332 68.450 97.950 30.418 1.00 25.44 C ATOM 2611 O LEU A 332 67.262 97.601 30.566 1.00 28.84 O ATOM 2612 CB LEU A 332 68.918 99.909 28.917 1.00 25.79 C ATOM 2613 CG LEU A 332 69.485 100.525 27.620 1.00 23.78 C ATOM 2614 CD1 LEU A 332 69.217 102.022 27.619 1.00 23.54 C ATOM 2615 CD2 LEU A 332 70.968 100.217 27.477 1.00 25.63 C ATOM 0 H LEU A 332 67.217 97.939 28.020 1.00 26.40 H new ATOM 0 HA LEU A 332 69.803 98.000 28.875 1.00 25.07 H new ATOM 0 HB2 LEU A 332 68.007 100.222 29.028 1.00 25.79 H new ATOM 0 HB3 LEU A 332 69.430 100.255 29.665 1.00 25.79 H new ATOM 0 HG LEU A 332 69.041 100.131 26.853 1.00 23.78 H new ATOM 0 HD11 LEU A 332 69.572 102.414 26.806 1.00 23.54 H new ATOM 0 HD12 LEU A 332 68.261 102.180 27.663 1.00 23.54 H new ATOM 0 HD13 LEU A 332 69.647 102.428 28.387 1.00 23.54 H new ATOM 0 HD21 LEU A 332 71.303 100.612 26.657 1.00 25.63 H new ATOM 0 HD22 LEU A 332 71.450 100.586 28.234 1.00 25.63 H new ATOM 0 HD23 LEU A 332 71.098 99.256 27.449 1.00 25.63 H new ATOM 2616 N LEU A 333 69.324 98.131 31.392 1.00 26.66 N ATOM 2617 CA LEU A 333 69.008 97.902 32.850 1.00 30.98 C ATOM 2618 C LEU A 333 68.248 99.116 33.423 1.00 31.24 C ATOM 2619 O LEU A 333 68.436 100.255 32.913 1.00 27.26 O ATOM 2620 CB LEU A 333 70.305 97.678 33.642 1.00 32.27 C ATOM 2621 CG LEU A 333 71.149 96.470 33.225 1.00 38.00 C ATOM 2622 CD1 LEU A 333 72.418 96.367 34.065 1.00 38.85 C ATOM 2623 CD2 LEU A 333 70.348 95.181 33.295 1.00 40.65 C ATOM 0 H LEU A 333 70.132 98.392 31.253 1.00 26.66 H new ATOM 0 HA LEU A 333 68.450 97.113 32.929 1.00 30.98 H new ATOM 0 HB2 LEU A 333 70.852 98.475 33.563 1.00 32.27 H new ATOM 0 HB3 LEU A 333 70.077 97.582 34.580 1.00 32.27 H new ATOM 0 HG LEU A 333 71.411 96.605 32.301 1.00 38.00 H new ATOM 0 HD11 LEU A 333 72.933 95.595 33.781 1.00 38.85 H new ATOM 0 HD12 LEU A 333 72.949 97.170 33.949 1.00 38.85 H new ATOM 0 HD13 LEU A 333 72.180 96.270 35.000 1.00 38.85 H new ATOM 0 HD21 LEU A 333 70.908 94.436 33.026 1.00 40.65 H new ATOM 0 HD22 LEU A 333 70.039 95.041 34.204 1.00 40.65 H new ATOM 0 HD23 LEU A 333 69.584 95.242 32.700 1.00 40.65 H new ATOM 2624 N ILE A 334 67.516 98.965 34.546 1.00 30.33 N ATOM 2625 CA ILE A 334 66.820 100.119 35.221 1.00 30.21 C ATOM 2626 C ILE A 334 67.780 101.296 35.416 1.00 29.05 C ATOM 2627 O ILE A 334 67.455 102.469 35.052 1.00 28.85 O ATOM 2628 CB ILE A 334 66.185 99.682 36.585 1.00 33.11 C ATOM 2629 CG1 ILE A 334 64.993 98.758 36.376 1.00 37.06 C ATOM 2630 CG2 ILE A 334 65.793 100.906 37.419 1.00 34.75 C ATOM 2631 CD1 ILE A 334 64.205 98.438 37.654 1.00 46.02 C ATOM 0 H ILE A 334 67.403 98.209 34.941 1.00 30.33 H new ATOM 0 HA ILE A 334 66.099 100.410 34.641 1.00 30.21 H new ATOM 0 HB ILE A 334 66.856 99.183 37.076 1.00 33.11 H new ATOM 0 HG12 ILE A 334 64.392 99.164 35.732 1.00 37.06 H new ATOM 0 HG13 ILE A 334 65.307 97.927 35.986 1.00 37.06 H new ATOM 0 HG21 ILE A 334 65.403 100.615 38.258 1.00 34.75 H new ATOM 0 HG22 ILE A 334 66.582 101.441 37.599 1.00 34.75 H new ATOM 0 HG23 ILE A 334 65.146 101.438 36.929 1.00 34.75 H new ATOM 0 HD11 ILE A 334 63.466 97.848 37.439 1.00 46.02 H new ATOM 0 HD12 ILE A 334 64.790 98.004 38.295 1.00 46.02 H new ATOM 0 HD13 ILE A 334 63.861 99.260 38.037 1.00 46.02 H new ATOM 2632 N ASP A 335 68.976 101.085 35.959 1.00 26.06 N ATOM 2633 CA ASP A 335 69.900 102.191 36.255 1.00 29.08 C ATOM 2634 C ASP A 335 70.365 102.907 34.962 1.00 24.69 C ATOM 2635 O ASP A 335 70.746 104.085 35.036 1.00 26.51 O ATOM 2636 CB ASP A 335 71.032 101.727 37.151 1.00 34.45 C ATOM 2637 CG ASP A 335 70.750 101.887 38.640 1.00 46.01 C ATOM 2638 OD1 ASP A 335 69.649 102.427 39.020 1.00 46.23 O ATOM 2639 OD2 ASP A 335 71.635 101.468 39.414 1.00 53.92 O ATOM 0 H ASP A 335 69.277 100.307 36.166 1.00 26.06 H new ATOM 0 HA ASP A 335 69.424 102.868 36.761 1.00 29.08 H new ATOM 0 HB2 ASP A 335 71.217 100.793 36.965 1.00 34.45 H new ATOM 0 HB3 ASP A 335 71.834 102.225 36.928 1.00 34.45 H new ATOM 2640 N GLU A 336 70.434 102.197 33.826 1.00 25.34 N ATOM 2641 CA GLU A 336 70.837 102.807 32.520 1.00 23.56 C ATOM 2642 C GLU A 336 69.704 103.733 32.016 1.00 20.72 C ATOM 2643 O GLU A 336 70.020 104.849 31.557 1.00 23.02 O ATOM 2644 CB GLU A 336 71.259 101.670 31.553 1.00 24.65 C ATOM 2645 CG GLU A 336 72.562 101.009 32.012 1.00 28.96 C ATOM 2646 CD GLU A 336 72.965 99.764 31.232 1.00 25.82 C ATOM 2647 OE1 GLU A 336 72.059 99.031 30.764 1.00 28.37 O ATOM 2648 OE2 GLU A 336 74.188 99.585 31.087 1.00 27.28 O ATOM 0 H GLU A 336 70.253 101.358 33.779 1.00 25.34 H new ATOM 0 HA GLU A 336 71.613 103.384 32.601 1.00 23.56 H new ATOM 0 HB2 GLU A 336 70.555 101.004 31.505 1.00 24.65 H new ATOM 0 HB3 GLU A 336 71.372 102.028 30.659 1.00 24.65 H new ATOM 0 HG2 GLU A 336 73.278 101.660 31.948 1.00 28.96 H new ATOM 0 HG3 GLU A 336 72.476 100.773 32.949 1.00 28.96 H new ATOM 2649 N TRP A 337 68.471 103.282 32.079 1.00 22.67 N ATOM 2650 CA TRP A 337 67.280 104.120 31.718 1.00 23.43 C ATOM 2651 C TRP A 337 67.226 105.342 32.655 1.00 24.07 C ATOM 2652 O TRP A 337 66.946 106.506 32.214 1.00 22.68 O ATOM 2653 CB TRP A 337 65.978 103.310 31.783 1.00 24.33 C ATOM 2654 CG TRP A 337 65.761 102.336 30.673 1.00 23.63 C ATOM 2655 CD1 TRP A 337 65.642 100.981 30.790 1.00 24.08 C ATOM 2656 CD2 TRP A 337 65.670 102.625 29.258 1.00 23.39 C ATOM 2657 NE1 TRP A 337 65.436 100.420 29.562 1.00 24.88 N ATOM 2658 CE2 TRP A 337 65.517 101.393 28.590 1.00 25.05 C ATOM 2659 CE3 TRP A 337 65.810 103.782 28.482 1.00 25.21 C ATOM 2660 CZ2 TRP A 337 65.431 101.279 27.206 1.00 25.36 C ATOM 2661 CZ3 TRP A 337 65.722 103.694 27.103 1.00 23.01 C ATOM 2662 CH2 TRP A 337 65.533 102.444 26.466 1.00 24.05 C ATOM 0 H TRP A 337 68.272 102.484 32.329 1.00 22.67 H new ATOM 0 HA TRP A 337 67.372 104.422 30.801 1.00 23.43 H new ATOM 0 HB2 TRP A 337 65.960 102.826 32.623 1.00 24.33 H new ATOM 0 HB3 TRP A 337 65.232 103.930 31.797 1.00 24.33 H new ATOM 0 HD1 TRP A 337 65.694 100.509 31.590 1.00 24.08 H new ATOM 0 HE1 TRP A 337 65.280 99.587 29.418 1.00 24.88 H new ATOM 0 HE3 TRP A 337 65.961 104.604 28.890 1.00 25.21 H new ATOM 0 HZ2 TRP A 337 65.310 100.454 26.795 1.00 25.36 H new ATOM 0 HZ3 TRP A 337 65.788 104.466 26.589 1.00 23.01 H new ATOM 0 HH2 TRP A 337 65.477 102.405 25.539 1.00 24.05 H new ATOM 2663 N LYS A 338 67.508 105.111 33.943 1.00 25.59 N ATOM 2664 CA LYS A 338 67.510 106.216 34.947 1.00 27.78 C ATOM 2665 C LYS A 338 68.587 107.254 34.626 1.00 26.06 C ATOM 2666 O LYS A 338 68.338 108.475 34.630 1.00 24.54 O ATOM 2667 CB LYS A 338 67.669 105.596 36.346 1.00 31.14 C ATOM 2668 CG LYS A 338 67.560 106.596 37.484 1.00 34.17 C ATOM 2669 CD LYS A 338 67.351 105.866 38.827 1.00 36.14 C ATOM 2670 CE LYS A 338 67.990 106.588 39.981 1.00 42.69 C ATOM 2671 NZ LYS A 338 67.576 106.003 41.294 1.00 40.76 N ATOM 0 H LYS A 338 67.700 104.336 34.263 1.00 25.59 H new ATOM 0 HA LYS A 338 66.670 106.700 34.919 1.00 27.78 H new ATOM 0 HB2 LYS A 338 66.992 104.911 36.464 1.00 31.14 H new ATOM 0 HB3 LYS A 338 68.531 105.155 36.398 1.00 31.14 H new ATOM 0 HG2 LYS A 338 68.365 107.136 37.525 1.00 34.17 H new ATOM 0 HG3 LYS A 338 66.820 107.201 37.320 1.00 34.17 H new ATOM 0 HD2 LYS A 338 66.400 105.771 38.995 1.00 36.14 H new ATOM 0 HD3 LYS A 338 67.719 104.971 38.766 1.00 36.14 H new ATOM 0 HE2 LYS A 338 68.955 106.544 39.896 1.00 42.69 H new ATOM 0 HE3 LYS A 338 67.745 107.526 39.952 1.00 42.69 H new ATOM 0 HZ1 LYS A 338 67.314 106.655 41.840 1.00 40.76 H new ATOM 0 HZ2 LYS A 338 66.903 105.435 41.167 1.00 40.76 H new ATOM 0 HZ3 LYS A 338 68.264 105.571 41.657 1.00 40.76 H new ATOM 2672 N SER A 339 69.820 106.857 34.250 1.00 22.09 N ATOM 2673 CA SER A 339 70.894 107.798 33.890 1.00 23.14 C ATOM 2674 C SER A 339 70.500 108.598 32.614 1.00 21.78 C ATOM 2675 O SER A 339 70.767 109.811 32.522 1.00 25.61 O ATOM 2676 CB SER A 339 72.195 106.997 33.756 1.00 24.68 C ATOM 2677 OG SER A 339 73.273 107.836 33.456 1.00 27.85 O ATOM 0 H SER A 339 70.053 106.031 34.198 1.00 22.09 H new ATOM 0 HA SER A 339 71.033 108.469 34.577 1.00 23.14 H new ATOM 0 HB2 SER A 339 72.372 106.521 34.582 1.00 24.68 H new ATOM 0 HB3 SER A 339 72.097 106.329 33.059 1.00 24.68 H new ATOM 0 HG SER A 339 73.300 107.972 32.628 1.00 27.85 H new ATOM 2678 N LEU A 340 69.937 107.919 31.610 1.00 22.26 N ATOM 2679 CA LEU A 340 69.483 108.574 30.367 1.00 20.55 C ATOM 2680 C LEU A 340 68.457 109.666 30.740 1.00 20.59 C ATOM 2681 O LEU A 340 68.542 110.786 30.160 1.00 20.98 O ATOM 2682 CB LEU A 340 68.913 107.592 29.336 1.00 22.51 C ATOM 2683 CG LEU A 340 69.919 106.710 28.578 1.00 23.72 C ATOM 2684 CD1 LEU A 340 69.206 105.731 27.693 1.00 25.71 C ATOM 2685 CD2 LEU A 340 70.860 107.538 27.717 1.00 27.54 C ATOM 0 H LEU A 340 69.806 107.069 31.626 1.00 22.26 H new ATOM 0 HA LEU A 340 70.253 108.972 29.932 1.00 20.55 H new ATOM 0 HB2 LEU A 340 68.285 107.009 29.791 1.00 22.51 H new ATOM 0 HB3 LEU A 340 68.407 108.101 28.683 1.00 22.51 H new ATOM 0 HG LEU A 340 70.436 106.239 29.250 1.00 23.72 H new ATOM 0 HD11 LEU A 340 69.856 105.185 27.224 1.00 25.71 H new ATOM 0 HD12 LEU A 340 68.636 105.162 28.233 1.00 25.71 H new ATOM 0 HD13 LEU A 340 68.664 106.212 27.048 1.00 25.71 H new ATOM 0 HD21 LEU A 340 71.478 106.950 27.255 1.00 27.54 H new ATOM 0 HD22 LEU A 340 70.345 108.041 27.066 1.00 27.54 H new ATOM 0 HD23 LEU A 340 71.357 108.152 28.279 1.00 27.54 H new ATOM 2686 N THR A 341 67.521 109.320 31.606 1.00 21.72 N ATOM 2687 CA THR A 341 66.473 110.291 32.045 1.00 20.71 C ATOM 2688 C THR A 341 67.147 111.476 32.733 1.00 21.07 C ATOM 2689 O THR A 341 66.799 112.628 32.482 1.00 20.57 O ATOM 2690 CB THR A 341 65.413 109.580 32.890 1.00 19.86 C ATOM 2691 OG1 THR A 341 64.765 108.502 32.182 1.00 23.54 O ATOM 2692 CG2 THR A 341 64.309 110.528 33.300 1.00 21.35 C ATOM 0 H THR A 341 67.457 108.539 31.961 1.00 21.72 H new ATOM 0 HA THR A 341 65.991 110.653 31.285 1.00 20.71 H new ATOM 0 HB THR A 341 65.897 109.237 33.657 1.00 19.86 H new ATOM 0 HG1 THR A 341 65.297 107.857 32.106 1.00 23.54 H new ATOM 0 HG21 THR A 341 63.654 110.051 33.833 1.00 21.35 H new ATOM 0 HG22 THR A 341 64.683 111.254 33.823 1.00 21.35 H new ATOM 0 HG23 THR A 341 63.881 110.888 32.508 1.00 21.35 H new ATOM 2693 N TYR A 342 68.030 111.197 33.683 1.00 22.07 N ATOM 2694 CA TYR A 342 68.746 112.272 34.410 1.00 21.99 C ATOM 2695 C TYR A 342 69.407 113.245 33.450 1.00 21.96 C ATOM 2696 O TYR A 342 69.286 114.457 33.611 1.00 23.14 O ATOM 2697 CB TYR A 342 69.726 111.666 35.415 1.00 23.84 C ATOM 2698 CG TYR A 342 70.413 112.662 36.319 1.00 25.88 C ATOM 2699 CD1 TYR A 342 69.708 113.300 37.342 1.00 28.21 C ATOM 2700 CD2 TYR A 342 71.762 112.965 36.180 1.00 25.67 C ATOM 2701 CE1 TYR A 342 70.317 114.239 38.165 1.00 28.61 C ATOM 2702 CE2 TYR A 342 72.389 113.886 37.011 1.00 28.87 C ATOM 2703 CZ TYR A 342 71.664 114.501 38.027 1.00 28.64 C ATOM 2704 OH TYR A 342 72.257 115.426 38.864 1.00 29.89 O ATOM 0 H TYR A 342 68.237 110.400 33.930 1.00 22.07 H new ATOM 0 HA TYR A 342 68.103 112.793 34.915 1.00 21.99 H new ATOM 0 HB2 TYR A 342 69.249 111.026 35.966 1.00 23.84 H new ATOM 0 HB3 TYR A 342 70.403 111.172 34.928 1.00 23.84 H new ATOM 0 HD1 TYR A 342 68.811 113.092 37.475 1.00 28.21 H new ATOM 0 HD2 TYR A 342 72.257 112.542 35.516 1.00 25.67 H new ATOM 0 HE1 TYR A 342 69.818 114.690 38.807 1.00 28.61 H new ATOM 0 HE2 TYR A 342 73.288 114.090 36.889 1.00 28.87 H new ATOM 0 HH TYR A 342 73.073 115.490 38.677 1.00 29.89 H new ATOM 2705 N ASP A 343 70.181 112.752 32.433 1.00 22.35 N ATOM 2706 CA ASP A 343 70.818 113.616 31.433 1.00 22.26 C ATOM 2707 C ASP A 343 69.772 114.512 30.746 1.00 22.41 C ATOM 2708 O ASP A 343 70.084 115.677 30.489 1.00 22.67 O ATOM 2709 CB ASP A 343 71.570 112.831 30.341 1.00 25.73 C ATOM 2710 CG ASP A 343 72.764 112.003 30.817 1.00 34.45 C ATOM 2711 OD1 ASP A 343 73.241 112.279 31.921 1.00 33.44 O ATOM 2712 OD2 ASP A 343 73.089 111.000 30.087 1.00 43.20 O ATOM 0 H ASP A 343 70.338 111.914 32.321 1.00 22.35 H new ATOM 0 HA ASP A 343 71.464 114.149 31.922 1.00 22.26 H new ATOM 0 HB2 ASP A 343 70.941 112.237 29.902 1.00 25.73 H new ATOM 0 HB3 ASP A 343 71.881 113.460 29.671 1.00 25.73 H new ATOM 2713 N GLU A 344 68.587 113.980 30.393 1.00 20.85 N ATOM 2714 CA GLU A 344 67.524 114.754 29.698 1.00 18.73 C ATOM 2715 C GLU A 344 66.914 115.835 30.634 1.00 18.98 C ATOM 2716 O GLU A 344 66.591 116.925 30.119 1.00 21.08 O ATOM 2717 CB GLU A 344 66.428 113.863 29.124 1.00 19.74 C ATOM 2718 CG GLU A 344 66.907 112.985 27.953 1.00 21.30 C ATOM 2719 CD GLU A 344 67.194 113.739 26.695 1.00 23.16 C ATOM 2720 OE1 GLU A 344 66.578 114.797 26.432 1.00 22.81 O ATOM 2721 OE2 GLU A 344 68.031 113.209 25.883 1.00 26.75 O ATOM 0 H GLU A 344 68.374 113.161 30.548 1.00 20.85 H new ATOM 0 HA GLU A 344 67.953 115.197 28.949 1.00 18.73 H new ATOM 0 HB2 GLU A 344 66.083 113.292 29.828 1.00 19.74 H new ATOM 0 HB3 GLU A 344 65.692 114.419 28.823 1.00 19.74 H new ATOM 0 HG2 GLU A 344 67.709 112.512 28.224 1.00 21.30 H new ATOM 0 HG3 GLU A 344 66.231 112.314 27.768 1.00 21.30 H new ATOM 2722 N VAL A 345 66.823 115.580 31.931 1.00 21.64 N ATOM 2723 CA VAL A 345 66.342 116.613 32.915 1.00 21.56 C ATOM 2724 C VAL A 345 67.378 117.744 32.985 1.00 23.38 C ATOM 2725 O VAL A 345 67.004 118.942 32.855 1.00 23.49 O ATOM 2726 CB VAL A 345 66.116 115.966 34.291 1.00 21.45 C ATOM 2727 CG1 VAL A 345 65.853 117.045 35.379 1.00 22.90 C ATOM 2728 CG2 VAL A 345 65.054 114.875 34.316 1.00 22.13 C ATOM 0 H VAL A 345 67.029 114.824 32.285 1.00 21.64 H new ATOM 0 HA VAL A 345 65.493 116.984 32.627 1.00 21.56 H new ATOM 0 HB VAL A 345 66.945 115.507 34.497 1.00 21.45 H new ATOM 0 HG11 VAL A 345 65.714 116.613 36.236 1.00 22.90 H new ATOM 0 HG12 VAL A 345 66.617 117.639 35.437 1.00 22.90 H new ATOM 0 HG13 VAL A 345 65.063 117.557 35.143 1.00 22.90 H new ATOM 0 HG21 VAL A 345 64.974 114.521 35.216 1.00 22.13 H new ATOM 0 HG22 VAL A 345 64.202 115.246 34.038 1.00 22.13 H new ATOM 0 HG23 VAL A 345 65.308 114.162 33.710 1.00 22.13 H new ATOM 2729 N ILE A 346 68.652 117.404 33.145 1.00 24.92 N ATOM 2730 CA ILE A 346 69.676 118.460 33.348 1.00 26.16 C ATOM 2731 C ILE A 346 69.970 119.256 32.075 1.00 27.81 C ATOM 2732 O ILE A 346 70.352 120.448 32.211 1.00 30.78 O ATOM 2733 CB ILE A 346 70.948 117.906 34.035 1.00 32.19 C ATOM 2734 CG1 ILE A 346 71.774 117.031 33.115 1.00 35.36 C ATOM 2735 CG2 ILE A 346 70.600 117.221 35.335 1.00 35.01 C ATOM 2736 CD1 ILE A 346 73.112 116.628 33.712 1.00 44.61 C ATOM 0 H ILE A 346 68.951 116.598 33.142 1.00 24.92 H new ATOM 0 HA ILE A 346 69.295 119.105 33.965 1.00 26.16 H new ATOM 0 HB ILE A 346 71.517 118.662 34.249 1.00 32.19 H new ATOM 0 HG12 ILE A 346 71.269 116.231 32.899 1.00 35.36 H new ATOM 0 HG13 ILE A 346 71.928 117.503 32.282 1.00 35.36 H new ATOM 0 HG21 ILE A 346 71.409 116.882 35.749 1.00 35.01 H new ATOM 0 HG22 ILE A 346 70.174 117.856 35.932 1.00 35.01 H new ATOM 0 HG23 ILE A 346 69.993 116.485 35.161 1.00 35.01 H new ATOM 0 HD11 ILE A 346 73.594 116.071 33.080 1.00 44.61 H new ATOM 0 HD12 ILE A 346 73.633 117.423 33.905 1.00 44.61 H new ATOM 0 HD13 ILE A 346 72.964 116.132 34.532 1.00 44.61 H new ATOM 2737 N SER A 347 69.720 118.736 30.859 1.00 22.56 N ATOM 2738 CA SER A 347 70.011 119.426 29.588 1.00 24.67 C ATOM 2739 C SER A 347 68.809 120.249 29.106 1.00 24.65 C ATOM 2740 O SER A 347 68.920 120.911 28.066 1.00 25.67 O ATOM 2741 CB SER A 347 70.466 118.426 28.541 1.00 25.40 C ATOM 2742 OG SER A 347 69.388 117.532 28.211 1.00 26.50 O ATOM 0 H SER A 347 69.370 117.958 30.750 1.00 22.56 H new ATOM 0 HA SER A 347 70.735 120.054 29.739 1.00 24.67 H new ATOM 0 HB2 SER A 347 70.764 118.893 27.745 1.00 25.40 H new ATOM 0 HB3 SER A 347 71.224 117.921 28.874 1.00 25.40 H new ATOM 0 HG SER A 347 69.383 116.888 28.750 1.00 26.50 H new ATOM 2743 N PHE A 348 67.674 120.218 29.832 1.00 23.79 N ATOM 2744 CA PHE A 348 66.470 120.958 29.391 1.00 22.44 C ATOM 2745 C PHE A 348 66.762 122.442 29.258 1.00 24.39 C ATOM 2746 O PHE A 348 67.316 123.051 30.229 1.00 25.45 O ATOM 2747 CB PHE A 348 65.303 120.756 30.377 1.00 22.31 C ATOM 2748 CG PHE A 348 64.082 121.548 29.994 1.00 20.16 C ATOM 2749 CD1 PHE A 348 63.217 121.106 28.993 1.00 20.54 C ATOM 2750 CD2 PHE A 348 63.683 122.669 30.699 1.00 20.05 C ATOM 2751 CE1 PHE A 348 62.106 121.836 28.612 1.00 22.41 C ATOM 2752 CE2 PHE A 348 62.589 123.395 30.291 1.00 21.18 C ATOM 2753 CZ PHE A 348 61.793 122.984 29.276 1.00 20.08 C ATOM 0 H PHE A 348 67.581 119.784 30.568 1.00 23.79 H new ATOM 0 HA PHE A 348 66.217 120.605 28.524 1.00 22.44 H new ATOM 0 HB2 PHE A 348 65.075 119.814 30.415 1.00 22.31 H new ATOM 0 HB3 PHE A 348 65.587 121.015 31.267 1.00 22.31 H new ATOM 0 HD1 PHE A 348 63.393 120.297 28.570 1.00 20.54 H new ATOM 0 HD2 PHE A 348 64.158 122.933 31.454 1.00 20.05 H new ATOM 0 HE1 PHE A 348 61.575 121.545 27.906 1.00 22.41 H new ATOM 0 HE2 PHE A 348 62.390 124.193 30.726 1.00 21.18 H new ATOM 0 HZ PHE A 348 61.043 123.478 29.035 1.00 20.08 H new ATOM 2754 N VAL A 349 66.309 123.037 28.146 1.00 24.41 N ATOM 2755 CA VAL A 349 66.354 124.514 27.922 1.00 27.91 C ATOM 2756 C VAL A 349 64.930 125.010 27.755 1.00 25.54 C ATOM 2757 O VAL A 349 64.201 124.543 26.872 1.00 25.75 O ATOM 2758 CB VAL A 349 67.202 124.836 26.687 1.00 31.45 C ATOM 2759 CG1 VAL A 349 67.288 126.337 26.466 1.00 32.82 C ATOM 2760 CG2 VAL A 349 68.591 124.218 26.767 1.00 38.50 C ATOM 0 H VAL A 349 65.963 122.601 27.490 1.00 24.41 H new ATOM 0 HA VAL A 349 66.765 124.960 28.679 1.00 27.91 H new ATOM 0 HB VAL A 349 66.757 124.438 25.923 1.00 31.45 H new ATOM 0 HG11 VAL A 349 67.828 126.518 25.681 1.00 32.82 H new ATOM 0 HG12 VAL A 349 66.397 126.697 26.335 1.00 32.82 H new ATOM 0 HG13 VAL A 349 67.694 126.756 27.241 1.00 32.82 H new ATOM 0 HG21 VAL A 349 69.093 124.445 25.969 1.00 38.50 H new ATOM 0 HG22 VAL A 349 69.053 124.561 27.548 1.00 38.50 H new ATOM 0 HG23 VAL A 349 68.513 123.254 26.836 1.00 38.50 H new ATOM 2761 N PRO A 350 64.484 125.994 28.555 1.00 29.57 N ATOM 2762 CA PRO A 350 63.117 126.471 28.442 1.00 28.17 C ATOM 2763 C PRO A 350 62.856 127.222 27.151 1.00 30.35 C ATOM 2764 O PRO A 350 63.778 127.701 26.476 1.00 29.08 O ATOM 2765 CB PRO A 350 62.928 127.394 29.653 1.00 34.14 C ATOM 2766 CG PRO A 350 64.303 127.868 29.944 1.00 31.19 C ATOM 2767 CD PRO A 350 65.201 126.672 29.644 1.00 30.20 C ATOM 0 HA PRO A 350 62.493 125.729 28.427 1.00 28.17 H new ATOM 0 HB2 PRO A 350 62.331 128.131 29.451 1.00 34.14 H new ATOM 0 HB3 PRO A 350 62.546 126.919 30.408 1.00 34.14 H new ATOM 0 HG2 PRO A 350 64.536 128.630 29.392 1.00 31.19 H new ATOM 0 HG3 PRO A 350 64.390 128.150 30.868 1.00 31.19 H new ATOM 0 HD2 PRO A 350 66.090 126.948 29.373 1.00 30.20 H new ATOM 0 HD3 PRO A 350 65.306 126.097 30.418 1.00 30.20 H new ATOM 2768 N PRO A 351 61.570 127.285 26.768 1.00 32.28 N ATOM 2769 CA PRO A 351 61.166 128.029 25.583 1.00 33.29 C ATOM 2770 C PRO A 351 61.450 129.515 25.807 1.00 40.61 C ATOM 2771 O PRO A 351 61.471 129.960 26.955 1.00 37.81 O ATOM 2772 CB PRO A 351 59.659 127.732 25.438 1.00 38.79 C ATOM 2773 CG PRO A 351 59.209 127.136 26.757 1.00 35.78 C ATOM 2774 CD PRO A 351 60.439 126.659 27.497 1.00 33.53 C ATOM 0 HA PRO A 351 61.644 127.779 24.777 1.00 33.29 H new ATOM 0 HB2 PRO A 351 59.165 128.543 25.239 1.00 38.79 H new ATOM 0 HB3 PRO A 351 59.497 127.115 24.707 1.00 38.79 H new ATOM 0 HG2 PRO A 351 58.732 127.797 27.283 1.00 35.78 H new ATOM 0 HG3 PRO A 351 58.597 126.399 26.605 1.00 35.78 H new ATOM 0 HD2 PRO A 351 60.422 126.934 28.427 1.00 33.53 H new ATOM 0 HD3 PRO A 351 60.504 125.691 27.488 1.00 33.53 H new ATOM 2775 N PRO A 352 61.738 130.291 24.738 1.00 48.92 N ATOM 2776 CA PRO A 352 61.803 131.759 24.806 1.00 57.35 C ATOM 2777 C PRO A 352 60.798 132.464 25.736 1.00 56.66 C ATOM 2778 O PRO A 352 59.586 132.211 25.599 1.00 56.72 O ATOM 2779 CB PRO A 352 61.447 132.186 23.373 1.00 59.10 C ATOM 2780 CG PRO A 352 61.599 130.929 22.498 1.00 61.38 C ATOM 2781 CD PRO A 352 62.063 129.796 23.390 1.00 55.02 C ATOM 0 HA PRO A 352 62.673 132.005 25.157 1.00 57.35 H new ATOM 0 HB2 PRO A 352 60.541 132.531 23.329 1.00 59.10 H new ATOM 0 HB3 PRO A 352 62.035 132.894 23.067 1.00 59.10 H new ATOM 0 HG2 PRO A 352 60.755 130.705 22.076 1.00 61.38 H new ATOM 0 HG3 PRO A 352 62.240 131.086 21.787 1.00 61.38 H new ATOM 0 HD2 PRO A 352 61.601 128.967 23.189 1.00 55.02 H new ATOM 0 HD3 PRO A 352 63.012 129.623 23.289 1.00 55.02 H new TER 2782 PRO A 352 HETATM 2783 N1 SV4 A 401 49.165 117.673 31.634 0.44 32.31 N HETATM 2784 C4 SV4 A 401 52.203 116.037 30.585 0.44 26.54 C HETATM 2785 C5 SV4 A 401 50.531 117.226 31.596 0.44 27.92 C HETATM 2786 C6 SV4 A 401 48.777 118.623 30.590 0.44 34.84 C HETATM 2787 C7 SV4 A 401 47.341 119.170 30.552 0.44 35.89 C HETATM 2788 C8 SV4 A 401 46.708 119.307 31.933 0.44 36.32 C HETATM 2789 C10 SV4 A 401 48.263 116.607 31.954 0.44 32.90 C HETATM 2790 N SV4 A 401 50.905 116.382 30.617 0.44 28.32 N HETATM 2791 C SV4 A 401 50.914 118.603 33.689 0.44 25.96 C HETATM 2792 C1 SV4 A 401 51.406 117.753 32.576 0.44 25.99 C HETATM 2793 C2 SV4 A 401 52.736 117.398 32.490 0.44 26.99 C HETATM 2794 C3 SV4 A 401 53.166 116.510 31.489 0.44 26.31 C HETATM 2795 C9 SV4 A 401 47.090 116.958 32.864 0.44 34.19 C HETATM 2796 N2 SV4 A 401 46.204 118.021 32.393 0.44 36.78 N HETATM 2797 CL CL A 402 62.866 129.487 41.914 1.00 43.44 CL HETATM 2798 CL CL A 403 64.948 113.172 43.735 1.00 39.16 CL HETATM 2799 CL CL A 404 51.581 124.274 25.269 1.00 55.38 CL HETATM 2800 CL CL A 405 66.039 113.246 18.175 1.00 37.62 CL HETATM 2801 CL CL A 406 36.778 111.194 25.479 1.00 33.53 CL HETATM 2802 MG MG A 407 43.556 112.035 28.889 1.00 30.19 MG HETATM 2803 S SO4 A 408 25.559 109.605 22.759 1.00 51.59 S HETATM 2804 O1 SO4 A 408 26.851 110.251 22.899 1.00 51.32 O HETATM 2805 O2 SO4 A 408 25.306 109.300 21.384 1.00 52.40 O HETATM 2806 O3 SO4 A 408 25.484 108.372 23.501 1.00 64.25 O HETATM 2807 O4 SO4 A 408 24.515 110.577 23.280 1.00 45.60 O HETATM 2808 S DMS A 409 65.198 118.598 21.891 1.00 88.55 S HETATM 2809 O DMS A 409 64.375 117.396 22.258 1.00 86.66 O HETATM 2810 C1 DMS A 409 64.075 119.957 21.719 1.00 73.40 C HETATM 2811 C2 DMS A 409 66.001 119.115 23.382 1.00 76.66 C HETATM 0 H23 DMS A 409 65.917 120.077 23.478 1.00 76.66 H new HETATM 0 H22 DMS A 409 65.586 118.677 24.142 1.00 76.66 H new HETATM 0 H21 DMS A 409 66.940 118.875 23.344 1.00 76.66 H new HETATM 0 H13 DMS A 409 64.569 120.757 21.481 1.00 73.40 H new HETATM 0 H12 DMS A 409 63.429 119.757 21.023 1.00 73.40 H new HETATM 0 H11 DMS A 409 63.611 120.102 22.558 1.00 73.40 H new HETATM 2812 O HOH A 501 24.051 101.019 12.890 1.00 31.21 O HETATM 2813 O HOH A 502 59.207 109.215 22.672 1.00 32.07 O HETATM 2814 O HOH A 503 27.382 107.223 24.306 1.00 36.01 O HETATM 2815 O HOH A 504 49.363 115.080 28.453 0.44 47.33 O HETATM 2816 O HOH A 505 27.425 109.173 0.405 1.00 27.39 O HETATM 2817 O HOH A 506 63.703 125.718 33.004 1.00 40.33 O HETATM 2818 O HOH A 507 55.361 109.940 8.904 1.00 33.98 O HETATM 2819 O HOH A 508 38.042 102.809 30.247 1.00 48.47 O HETATM 2820 O HOH A 509 61.899 115.560 47.827 1.00 37.75 O HETATM 2821 O HOH A 510 23.874 107.327 20.638 1.00 30.16 O HETATM 2822 O HOH A 511 59.031 127.930 31.417 1.00 36.02 O HETATM 2823 O HOH A 512 51.645 124.730 22.418 1.00 40.05 O HETATM 2824 O HOH A 513 41.151 97.764 -0.061 1.00 39.02 O HETATM 2825 O HOH A 514 33.853 102.268 2.806 1.00 31.13 O HETATM 2826 O HOH A 515 45.843 97.073 -1.841 1.00 33.40 O HETATM 2827 O HOH A 516 25.367 93.769 19.214 1.00 35.61 O HETATM 2828 O HOH A 517 57.121 137.933 38.435 1.00 20.55 O HETATM 2829 O HOH A 518 49.103 93.864 6.718 1.00 40.06 O HETATM 2830 O HOH A 519 66.282 116.765 15.324 1.00 28.14 O HETATM 2831 O HOH A 520 67.300 131.064 48.446 1.00 45.12 O HETATM 2832 O HOH A 521 60.390 115.050 45.573 1.00 29.05 O HETATM 2833 O HOH A 522 58.220 121.040 24.423 1.00 20.96 O HETATM 2834 O HOH A 523 72.364 110.677 27.572 1.00 36.45 O HETATM 2835 O HOH A 524 68.036 100.594 18.122 1.00 40.85 O HETATM 2836 O HOH A 525 69.091 110.728 25.898 1.00 26.03 O HETATM 2837 O HOH A 526 41.473 124.222 28.245 1.00 47.65 O HETATM 2838 O HOH A 527 63.529 97.653 25.772 1.00 39.85 O HETATM 2839 O HOH A 528 24.673 98.189 20.537 1.00 44.55 O HETATM 2840 O HOH A 529 39.846 132.428 17.705 1.00 55.96 O HETATM 2841 O HOH A 530 63.762 126.311 51.128 1.00 36.45 O HETATM 2842 O HOH A 531 41.429 105.595 25.471 1.00 38.01 O HETATM 2843 O HOH A 532 50.122 110.423 28.061 1.00 37.65 O HETATM 2844 O HOH A 533 52.655 123.765 28.027 1.00 39.85 O HETATM 2845 O HOH A 534 62.299 123.563 25.288 1.00 33.76 O HETATM 2846 O HOH A 535 64.828 131.329 49.983 1.00 30.01 O HETATM 2847 O HOH A 536 22.463 115.479 3.851 1.00 30.67 O HETATM 2848 O HOH A 537 61.626 119.830 18.221 1.00 24.27 O HETATM 2849 O HOH A 538 52.743 108.441 21.348 1.00 32.45 O HETATM 2850 O HOH A 539 58.795 106.858 21.355 1.00 33.01 O HETATM 2851 O HOH A 540 59.838 122.856 25.571 1.00 31.25 O HETATM 2852 O HOH A 541 29.565 123.574 0.798 1.00 32.19 O HETATM 2853 O HOH A 542 21.204 118.871 10.223 1.00 49.16 O HETATM 2854 O HOH A 543 65.678 115.560 24.012 1.00 33.69 O HETATM 2855 O HOH A 544 73.600 108.417 30.649 1.00 35.11 O HETATM 2856 O HOH A 545 72.530 96.525 29.896 1.00 42.63 O HETATM 2857 O HOH A 546 52.153 112.709 28.791 1.00 38.69 O HETATM 2858 O HOH A 547 60.646 109.043 14.854 1.00 27.67 O HETATM 2859 O HOH A 548 59.977 137.075 35.675 1.00 33.99 O HETATM 2860 O HOH A 549 55.472 108.018 31.723 1.00 50.68 O HETATM 2861 O HOH A 550 46.463 106.339 4.382 1.00 22.15 O HETATM 2862 O HOH A 551 49.076 111.825 8.273 1.00 18.02 O HETATM 2863 O HOH A 552 59.199 99.814 22.311 1.00 47.21 O HETATM 2864 O HOH A 553 26.986 103.467 15.011 1.00 26.61 O HETATM 2865 O HOH A 554 58.773 111.359 40.766 1.00 30.87 O HETATM 2866 O HOH A 555 70.706 117.670 39.635 1.00 34.06 O HETATM 2867 O HOH A 556 23.652 91.637 4.704 1.00 39.44 O HETATM 2868 O HOH A 557 50.397 121.849 4.480 1.00 27.08 O HETATM 2869 O HOH A 558 52.924 132.799 48.093 1.00 29.20 O HETATM 2870 O HOH A 559 34.888 125.679 2.168 1.00 36.33 O HETATM 2871 O HOH A 560 25.400 98.735 5.202 1.00 23.99 O HETATM 2872 O HOH A 561 42.014 123.783 2.317 1.00 23.08 O HETATM 2873 O HOH A 562 63.606 114.449 22.738 1.00 20.74 O HETATM 2874 O HOH A 563 59.090 111.743 47.130 1.00 46.60 O HETATM 2875 O HOH A 564 41.383 98.279 8.990 1.00 36.60 O HETATM 2876 O HOH A 565 60.181 120.436 15.950 1.00 20.41 O HETATM 2877 O HOH A 566 43.329 117.091 -0.562 1.00 35.12 O HETATM 2878 O HOH A 567 28.729 96.124 27.872 1.00 33.82 O HETATM 2879 O HOH A 568 75.839 97.795 29.835 1.00 28.29 O HETATM 2880 O HOH A 569 56.290 105.408 14.824 1.00 42.31 O HETATM 2881 O HOH A 570 30.119 101.868 30.992 1.00 32.29 O HETATM 2882 O HOH A 571 46.974 108.591 26.333 1.00 29.62 O HETATM 2883 O HOH A 572 75.414 106.223 34.039 1.00 47.50 O HETATM 2884 O HOH A 573 30.882 110.551 23.377 1.00 34.29 O HETATM 2885 O HOH A 574 55.086 107.288 36.560 1.00 45.70 O HETATM 2886 O HOH A 575 25.007 107.242 18.117 1.00 25.52 O HETATM 2887 O HOH A 576 58.235 123.502 13.338 1.00 27.17 O HETATM 2888 O HOH A 577 36.016 103.388 16.217 1.00 16.77 O HETATM 2889 O HOH A 578 48.330 101.815 6.057 1.00 33.09 O HETATM 2890 O HOH A 579 27.880 121.097 8.482 1.00 27.17 O HETATM 2891 O HOH A 580 54.280 122.234 21.676 1.00 20.80 O HETATM 2892 O HOH A 581 32.277 90.082 5.930 1.00 31.75 O HETATM 2893 O HOH A 582 25.675 100.567 20.763 1.00 26.60 O HETATM 2894 O HOH A 583 32.340 92.367 1.616 1.00 26.51 O HETATM 2895 O HOH A 584 26.702 91.493 8.561 1.00 32.97 O HETATM 2896 O HOH A 585 42.764 113.976 29.315 1.00 30.49 O HETATM 2897 O HOH A 586 40.484 108.395 1.201 1.00 21.37 O HETATM 2898 O HOH A 587 50.772 112.560 2.827 1.00 30.46 O HETATM 2899 O HOH A 588 40.257 116.125 30.012 1.00 40.50 O HETATM 2900 O HOH A 589 52.782 128.938 47.899 1.00 34.36 O HETATM 2901 O HOH A 590 71.667 105.514 37.235 1.00 39.50 O HETATM 2902 O HOH A 591 43.773 123.413 -1.464 1.00 40.52 O HETATM 2903 O HOH A 592 56.459 107.112 34.365 1.00 34.51 O HETATM 2904 O HOH A 593 25.463 96.478 16.610 1.00 41.38 O HETATM 2905 O HOH A 594 33.874 111.094 -1.096 1.00 42.81 O HETATM 2906 O HOH A 595 22.324 116.283 18.957 1.00 40.70 O HETATM 2907 O HOH A 596 68.687 107.362 23.437 1.00 29.72 O HETATM 2908 O HOH A 597 75.485 113.157 39.012 1.00 45.88 O HETATM 2909 O HOH A 598 27.771 100.973 -1.343 1.00 28.52 O HETATM 2910 O HOH A 599 68.281 119.962 41.760 1.00 33.65 O HETATM 2911 O HOH A 600 26.179 88.551 9.601 1.00 41.43 O HETATM 2912 O HOH A 601 45.392 97.859 5.392 1.00 31.77 O HETATM 2913 O HOH A 602 64.801 123.174 35.029 1.00 36.98 O HETATM 2914 O HOH A 603 49.374 120.157 2.725 1.00 26.40 O HETATM 2915 O HOH A 604 24.734 116.923 2.863 1.00 31.67 O HETATM 2916 O HOH A 605 47.273 128.408 9.919 1.00 38.03 O HETATM 2917 O HOH A 606 35.888 101.095 3.749 1.00 25.94 O HETATM 2918 O HOH A 607 26.509 102.307 12.451 1.00 23.15 O HETATM 2919 O HOH A 608 28.642 105.449 -1.375 1.00 26.14 O HETATM 2920 O HOH A 609 66.426 121.084 48.212 1.00 43.02 O HETATM 2921 O HOH A 610 21.772 114.276 16.079 1.00 24.06 O HETATM 2922 O HOH A 611 44.298 108.100 17.800 1.00 18.56 O HETATM 2923 O HOH A 612 31.213 95.879 1.105 1.00 38.10 O HETATM 2924 O HOH A 613 51.493 122.103 11.082 1.00 20.32 O HETATM 2925 O HOH A 614 46.916 101.352 10.540 1.00 24.76 O HETATM 2926 O HOH A 615 52.509 123.197 3.107 1.00 34.49 O HETATM 2927 O HOH A 616 29.317 85.421 13.105 1.00 30.69 O HETATM 2928 O HOH A 617 63.702 121.878 50.447 1.00 46.40 O HETATM 2929 O HOH A 618 52.893 114.852 8.094 1.00 22.55 O HETATM 2930 O HOH A 619 73.608 110.545 34.206 1.00 36.12 O HETATM 2931 O HOH A 620 28.134 111.002 15.040 1.00 19.25 O HETATM 2932 O HOH A 621 52.482 126.104 47.568 1.00 35.14 O HETATM 2933 O HOH A 622 60.546 123.520 52.972 1.00 37.94 O HETATM 2934 O HOH A 623 46.043 92.878 -0.482 1.00 41.01 O HETATM 2935 O HOH A 624 41.480 96.015 23.051 1.00 43.87 O HETATM 2936 O HOH A 625 64.399 119.669 17.955 1.00 35.08 O HETATM 2937 O HOH A 626 32.355 109.704 17.917 1.00 16.16 O HETATM 2938 O HOH A 627 23.247 115.490 10.991 1.00 32.45 O HETATM 2939 O HOH A 628 41.657 111.176 28.719 1.00 31.02 O HETATM 2940 O HOH A 629 32.902 106.861 17.709 1.00 16.15 O HETATM 2941 O HOH A 630 56.635 122.474 47.675 1.00 32.12 O HETATM 2942 O HOH A 631 33.993 111.221 24.561 1.00 33.54 O HETATM 2943 O HOH A 632 55.935 124.124 14.888 1.00 23.28 O HETATM 2944 O HOH A 633 57.925 100.863 28.667 1.00 40.05 O HETATM 2945 O HOH A 634 46.053 108.258 6.675 1.00 24.37 O HETATM 2946 O HOH A 635 62.981 125.039 37.720 1.00 27.61 O HETATM 2947 O HOH A 636 27.267 91.725 18.940 1.00 32.26 O HETATM 2948 O HOH A 637 22.537 113.061 11.534 1.00 24.75 O HETATM 2949 O HOH A 638 44.117 110.655 -0.230 1.00 34.37 O HETATM 2950 O HOH A 639 46.452 126.493 20.252 1.00 35.42 O HETATM 2951 O HOH A 640 26.083 106.813 14.636 1.00 33.72 O HETATM 2952 O HOH A 641 62.697 120.735 25.239 1.00 26.84 O HETATM 2953 O HOH A 642 42.837 104.716 16.315 1.00 23.43 O HETATM 2954 O HOH A 643 66.225 120.665 35.026 1.00 39.14 O HETATM 2955 O HOH A 644 38.777 105.527 21.974 1.00 26.58 O HETATM 2956 O HOH A 645 35.750 114.806 29.493 1.00 43.70 O HETATM 2957 O HOH A 646 26.539 95.116 11.244 1.00 33.43 O HETATM 2958 O HOH A 647 72.734 105.061 30.570 1.00 29.43 O HETATM 2959 O HOH A 648 63.900 106.804 14.857 1.00 31.73 O HETATM 2960 O HOH A 649 49.473 96.943 3.259 1.00 34.15 O HETATM 2961 O HOH A 650 21.190 109.415 10.804 1.00 48.33 O HETATM 2962 O HOH A 651 64.858 129.970 43.977 1.00 28.71 O HETATM 2963 O HOH A 652 49.043 129.064 31.171 1.00 41.39 O HETATM 2964 O HOH A 653 49.170 104.154 0.905 1.00 31.44 O HETATM 2965 O HOH A 654 70.030 98.711 37.297 1.00 38.87 O HETATM 2966 O HOH A 655 33.296 99.005 1.543 1.00 42.95 O HETATM 2967 O HOH A 656 24.115 90.893 15.482 1.00 43.89 O HETATM 2968 O HOH A 657 60.655 104.749 41.300 1.00 33.90 O HETATM 2969 O HOH A 658 61.010 129.309 32.166 1.00 38.39 O HETATM 2970 O HOH A 659 28.230 91.708 21.390 1.00 32.11 O HETATM 2971 O HOH A 660 18.687 114.890 19.878 1.00 34.69 O HETATM 2972 O HOH A 661 45.580 127.489 16.070 1.00 41.09 O HETATM 2973 O HOH A 662 65.311 123.319 23.876 1.00 34.19 O HETATM 2974 O HOH A 663 38.669 119.375 -1.967 1.00 27.39 O HETATM 2975 O HOH A 664 29.265 116.861 20.246 1.00 41.91 O HETATM 2976 O HOH A 665 67.077 124.092 47.970 1.00 33.80 O HETATM 2977 O HOH A 666 43.576 98.657 7.617 1.00 28.28 O HETATM 2978 O HOH A 667 65.385 121.336 25.883 1.00 26.09 O HETATM 2979 O HOH A 668 67.624 119.517 25.774 1.00 34.69 O HETATM 2980 O HOH A 669 43.448 111.591 30.978 1.00 31.68 O HETATM 2981 O HOH A 670 66.912 107.616 20.717 1.00 22.02 O HETATM 2982 O HOH A 671 55.304 106.741 17.704 1.00 32.37 O HETATM 2983 O HOH A 672 60.129 95.479 33.648 1.00 42.89 O HETATM 2984 O HOH A 673 32.143 127.582 4.763 1.00 50.31 O HETATM 2985 O HOH A 674 30.198 109.662 -2.444 1.00 37.32 O HETATM 2986 O HOH A 675 32.832 98.477 31.278 1.00 49.48 O HETATM 2987 O HOH A 676 48.850 99.597 -0.674 1.00 29.80 O HETATM 2988 O HOH A 677 53.471 105.081 10.546 1.00 37.83 O HETATM 2989 O HOH A 678 38.276 100.094 2.551 1.00 23.55 O HETATM 2990 O HOH A 679 67.522 96.176 35.731 1.00 40.07 O HETATM 2991 O HOH A 680 50.914 92.912 9.563 1.00 42.20 O HETATM 2992 O HOH A 681 63.747 127.663 37.552 1.00 31.04 O HETATM 2993 O HOH A 682 70.151 102.165 19.023 1.00 26.78 O HETATM 2994 O HOH A 683 32.178 125.394 2.924 1.00 33.29 O HETATM 2995 O HOH A 684 34.938 98.351 3.804 1.00 34.38 O HETATM 2996 O HOH A 685 28.301 112.979 22.618 1.00 45.21 O HETATM 2997 O HOH A 686 49.124 106.372 27.454 1.00 41.46 O HETATM 2998 O HOH A 687 62.362 95.176 36.280 1.00 35.49 O HETATM 2999 O HOH A 688 53.428 125.972 15.390 1.00 32.46 O HETATM 3000 O HOH A 689 54.420 125.646 6.463 1.00 34.67 O HETATM 3001 O HOH A 690 44.190 110.060 28.382 1.00 30.25 O HETATM 3002 O HOH A 691 50.555 113.860 6.858 1.00 18.96 O HETATM 3003 O HOH A 692 29.383 92.805 26.362 1.00 47.22 O HETATM 3004 O HOH A 693 26.041 125.996 10.758 1.00 44.90 O HETATM 3005 O HOH A 694 51.408 113.681 26.521 1.00 33.74 O HETATM 3006 O HOH A 695 64.919 97.676 28.219 1.00 28.89 O HETATM 3007 O HOH A 696 66.379 119.985 38.041 1.00 28.19 O HETATM 3008 O HOH A 697 63.681 101.542 17.233 1.00 47.99 O HETATM 3009 O HOH A 698 58.242 123.640 8.675 1.00 33.28 O HETATM 3010 O HOH A 699 70.007 96.412 22.589 1.00 34.80 O HETATM 3011 O HOH A 700 58.768 98.922 25.559 1.00 47.34 O HETATM 3012 O HOH A 701 50.376 107.724 5.942 1.00 27.40 O HETATM 3013 O HOH A 702 70.807 103.760 16.972 1.00 31.18 O HETATM 3014 O HOH A 703 53.896 111.994 7.810 1.00 31.26 O HETATM 3015 O HOH A 704 38.853 95.617 0.200 1.00 30.30 O HETATM 3016 O HOH A 705 41.247 98.873 22.033 1.00 42.67 O HETATM 3017 O HOH A 706 48.531 109.149 7.506 1.00 27.23 O HETATM 3018 O HOH A 707 29.634 99.252 -1.409 1.00 28.99 O HETATM 3019 O HOH A 708 47.502 115.702 43.616 1.00 48.49 O HETATM 3020 O HOH A 709 61.925 115.892 9.415 1.00 48.89 O HETATM 3021 O HOH A 710 26.838 86.241 11.481 1.00 45.05 O HETATM 3022 O HOH A 711 49.487 108.495 1.240 1.00 23.23 O HETATM 3023 O HOH A 712 40.658 115.509 -0.948 1.00 38.17 O HETATM 3024 O HOH A 713 55.226 106.390 12.021 1.00 36.29 O HETATM 3025 O HOH A 714 64.179 103.603 15.266 1.00 48.88 O HETATM 3026 O HOH A 715 62.187 132.313 42.077 1.00 34.24 O HETATM 3027 O HOH A 716 37.618 97.155 2.428 1.00 23.74 O HETATM 3028 O HOH A 717 66.108 110.250 13.264 1.00 37.79 O HETATM 3029 O HOH A 718 51.457 105.520 6.892 1.00 38.65 O HETATM 3030 O HOH A 719 24.923 97.120 14.015 1.00 55.96 O HETATM 3031 O HOH A 720 61.187 106.675 13.811 1.00 34.21 O HETATM 3032 O HOH A 721 59.951 123.059 15.409 1.00 39.94 O HETATM 3033 O HOH A 722 51.936 112.713 4.864 1.00 36.95 O HETATM 3034 O HOH A 723 47.990 96.987 5.600 1.00 39.46 O HETATM 3035 O HOH A 724 66.191 117.667 17.843 1.00 37.62 O HETATM 3036 O HOH A 725 52.081 119.204 2.436 1.00 30.71 O HETATM 3037 O HOH A 726 26.118 108.746 -3.653 1.00 25.28 O HETATM 3038 O HOH A 727 18.567 105.103 0.146 1.00 30.54 O HETATM 3039 O HOH A 728 60.744 94.936 38.162 1.00 66.18 O HETATM 3040 O HOH A 729 30.584 106.858 -2.771 1.00 43.58 O HETATM 3041 O HOH A 730 28.149 108.628 26.598 1.00 32.56 O HETATM 3042 O HOH A 731 74.721 104.110 32.319 1.00 33.35 O HETATM 3043 O HOH A 732 27.012 124.448 1.252 1.00 43.93 O HETATM 3044 O HOH A 733 42.204 125.418 0.238 1.00 34.65 O HETATM 3045 O HOH A 734 55.498 107.579 20.718 1.00 41.62 O HETATM 3046 O HOH A 735 26.374 90.540 12.202 1.00 38.87 O HETATM 3047 O HOH A 736 59.555 102.591 43.102 1.00 54.03 O HETATM 3048 O HOH A 737 23.877 92.019 7.568 1.00 44.29 O HETATM 3049 O HOH A 738 39.953 125.062 -1.407 1.00 39.15 O HETATM 3050 O HOH A 739 67.906 112.286 14.214 1.00 26.01 O HETATM 3051 O HOH A 740 48.464 92.198 0.757 1.00 38.38 O HETATM 3052 O HOH A 741 38.679 100.712 0.010 1.00 41.48 O HETATM 3053 O HOH A 742 22.902 99.509 4.306 1.00 38.40 O HETATM 3054 O HOH A 743 29.753 121.950 -1.651 1.00 45.04 O HETATM 3055 O HOH A 744 34.101 101.796 0.107 1.00 42.35 O HETATM 3056 O HOH A 745 30.244 110.288 26.008 1.00 45.36 O HETATM 3057 O HOH A 746 65.279 123.779 37.482 1.00 40.40 O HETATM 3058 O HOH A 747 74.372 106.712 28.959 1.00 35.51 O HETATM 3059 O HOH A 748 54.206 116.472 6.038 1.00 36.18 O HETATM 3060 O HOH A 749 31.053 125.796 0.472 1.00 39.29 O HETATM 3061 O HOH A 750 50.763 104.691 3.104 1.00 35.92 O HETATM 3062 O HOH A 751 65.270 94.932 36.696 1.00 46.89 O HETATM 3063 O HOH A 752 58.713 125.992 12.438 1.00 39.75 O HETATM 3064 O HOH A 753 64.068 129.603 39.423 1.00 31.67 O HETATM 3065 O HOH A 754 27.431 92.588 11.042 1.00 35.52 O HETATM 3066 O HOH A 755 23.377 96.787 5.819 1.00 38.03 O HETATM 3067 O HOH A 756 50.109 93.875 2.537 1.00 37.13 O CONECT 1216 2802 CONECT 1314 2802 CONECT 2783 2785 2786 2789 CONECT 2784 2790 2794 CONECT 2785 2783 2790 2792 CONECT 2786 2783 2787 CONECT 2787 2786 2788 CONECT 2788 2787 2796 CONECT 2789 2783 2795 CONECT 2790 2784 2785 CONECT 2791 2792 CONECT 2792 2785 2791 2793 CONECT 2793 2792 2794 CONECT 2794 2784 2793 CONECT 2795 2789 2796 CONECT 2796 2788 2795 CONECT 2802 1216 1314 2896 2939 CONECT 2802 2980 3001 CONECT 2803 2804 2805 2806 2807 CONECT 2804 2803 CONECT 2805 2803 CONECT 2806 2803 CONECT 2807 2803 CONECT 2808 2809 2810 2811 CONECT 2809 2808 CONECT 2810 2808 CONECT 2811 2808 CONECT 2896 2802 CONECT 2939 2802 CONECT 2980 2802 CONECT 3001 2802 END