USER MOD reduce.3.24.130724 H: found=0, std=0, add=1465, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER TRANSCRIPTION 14-SEP-07 2RAE TITLE CRYSTAL STRUCTURE OF A TETR/ACRR FAMILY TRANSCRIPTIONAL REGULATOR FROM TITLE 2 RHODOCOCCUS SP. RHA1 COMPND MOL_ID: 1; COMPND 2 MOLECULE: TRANSCRIPTIONAL REGULATOR, ACRR FAMILY PROTEIN; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: RHODOCOCCUS SP.; SOURCE 3 ORGANISM_TAXID: 101510; SOURCE 4 STRAIN: RHA1; SOURCE 5 GENE: RHA08332, RHA1_RO06070; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 511693; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21; SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 0 EXPRESSION_SYSTEM_PLASMID: PDM68 KEYWDS TETR/ACRR FAMILY TRANSCRIPTIONAL REGULATOR, STRUCTURAL GENOMICS, PSI- KEYWDS 2 2, RHA08332, MCSG, PROTEIN STRUCTURE INITIATIVE, MIDWEST CENTER FOR KEYWDS 3 STRUCTURAL GENOMICS, DNA-BINDING, TRANSCRIPTION REGULATION, KEYWDS 4 TRANSCRIPTION EXPDTA X-RAY DIFFRACTION AUTHOR R.ZHANG,T.SKARINA,O.KAGAN,A.SAVCHENKO,A.M.EDWARDS,A.JOACHIMIAK, AUTHOR 2 MIDWEST CENTER FOR STRUCTURAL GENOMICS (MCSG) REVDAT 3 13-JUL-11 2RAE 1 VERSN REVDAT 2 24-FEB-09 2RAE 1 VERSN REVDAT 1 25-SEP-07 2RAE 0 JRNL AUTH R.ZHANG,T.SKARINA,O.KAGAN,A.SAVCHENKO,A.M.EDWARDS, JRNL AUTH 2 A.JOACHIMIAK JRNL TITL THE CRYSTAL STRUCTURE OF A TETR/ACRR FAMILY TRANSCRIPTIONAL JRNL TITL 2 REGULATOR FROM RHODOCOCCUS SP. RHA1 JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. 2.20 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.2.0019 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD WITH PHASES REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.20 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 55.56 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.2 REMARK 3 NUMBER OF REFLECTIONS : 11548 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) : 0.234 REMARK 3 R VALUE (WORKING SET) : 0.233 REMARK 3 FREE R VALUE : 0.253 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.800 REMARK 3 FREE R VALUE TEST SET COUNT : 580 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.20 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.26 REMARK 3 REFLECTION IN BIN (WORKING SET) : 815 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 97.60 REMARK 3 BIN R VALUE (WORKING SET) : 0.3080 REMARK 3 BIN FREE R VALUE SET COUNT : 39 REMARK 3 BIN FREE R VALUE : 0.3220 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1498 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 39 REMARK 3 REMARK 3 B VALUES. REMARK 3 B VALUE TYPE : LIKELY RESIDUAL REMARK 3 FROM WILSON PLOT (A**2) : 46.70 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 46.77 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.49000 REMARK 3 B22 (A**2) : -0.49000 REMARK 3 B33 (A**2) : 0.98000 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): 0.279 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.207 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.192 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 15.941 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.942 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.938 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 1530 ; 0.014 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): 1023 ; 0.001 ; 0.020 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 2082 ; 1.370 ; 1.965 REMARK 3 BOND ANGLES OTHERS (DEGREES): 2481 ; 0.984 ; 3.000 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 192 ; 5.343 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 72 ;34.526 ;23.611 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 243 ;16.780 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 13 ;16.165 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 233 ; 0.078 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1728 ; 0.005 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): 318 ; 0.001 ; 0.020 REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 360 ; 0.208 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): 978 ; 0.184 ; 0.200 REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 765 ; 0.180 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): 761 ; 0.086 ; 0.200 REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 35 ; 0.181 ; 0.200 REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): 6 ; 0.231 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): 33 ; 0.270 ; 0.200 REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 3 ; 0.225 ; 0.200 REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 1251 ; 0.865 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): 389 ; 0.147 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 1540 ; 1.032 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 661 ; 1.969 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 542 ; 2.700 ; 4.500 REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : 1 REMARK 3 REMARK 3 TLS GROUP : 1 REMARK 3 NUMBER OF COMPONENTS GROUP : 6 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 11 A 43 REMARK 3 RESIDUE RANGE : A 44 A 80 REMARK 3 RESIDUE RANGE : A 81 A 110 REMARK 3 RESIDUE RANGE : A 111 A 150 REMARK 3 RESIDUE RANGE : A 151 A 180 REMARK 3 RESIDUE RANGE : A 181 A 203 REMARK 3 ORIGIN FOR THE GROUP (A): 14.8270 30.3560 46.6190 REMARK 3 T TENSOR REMARK 3 T11: 0.0698 T22: -0.0907 REMARK 3 T33: -0.3572 T12: 0.0329 REMARK 3 T13: 0.0316 T23: 0.0419 REMARK 3 L TENSOR REMARK 3 L11: 5.0117 L22: 1.4383 REMARK 3 L33: 1.9481 L12: 0.3814 REMARK 3 L13: -0.5669 L23: 0.2240 REMARK 3 S TENSOR REMARK 3 S11: -0.1133 S12: 0.1640 S13: 0.3452 REMARK 3 S21: -0.1629 S22: 0.0377 S23: -0.0464 REMARK 3 S31: -0.2801 S32: -0.0907 S33: 0.0756 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING REMARK 3 POSITIONS REMARK 4 REMARK 4 2RAE COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 20-SEP-07. REMARK 100 THE RCSB ID CODE IS RCSB044624. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 05-JUN-07 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 19-ID REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.97940 REMARK 200 MONOCHROMATOR : SI 111 CHANNEL REMARK 200 OPTICS : MIRRORS REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 315 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-3000 REMARK 200 DATA SCALING SOFTWARE : HKL-3000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 11548 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.200 REMARK 200 RESOLUTION RANGE LOW (A) : 55.560 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 2.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.2 REMARK 200 DATA REDUNDANCY : 16.800 REMARK 200 R MERGE (I) : 0.08400 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 49.3000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.20 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.26 REMARK 200 COMPLETENESS FOR SHELL (%) : 97.6 REMARK 200 DATA REDUNDANCY IN SHELL : 10.30 REMARK 200 R MERGE FOR SHELL (I) : 0.58000 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 1.850 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: SAD REMARK 200 SOFTWARE USED: HKL-3000 REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 49.96 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.46 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 20% PEG 3350, 0.2M K CITRATE, VAPOR REMARK 280 DIFFUSION, HANGING DROP, TEMPERATURE 295K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 43 21 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -Y+1/2,X+1/2,Z+3/4 REMARK 290 4555 Y+1/2,-X+1/2,Z+1/4 REMARK 290 5555 -X+1/2,Y+1/2,-Z+3/4 REMARK 290 6555 X+1/2,-Y+1/2,-Z+1/4 REMARK 290 7555 Y,X,-Z REMARK 290 8555 -Y,-X,-Z+1/2 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 53.31350 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 32.55350 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 32.55350 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 79.97025 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 32.55350 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 32.55350 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 26.65675 REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 32.55350 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 32.55350 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 79.97025 REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 32.55350 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 32.55350 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 26.65675 REMARK 290 SMTRY1 7 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 7 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 53.31350 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 300 REMARK: THE SECOND PART OF THE BIOLOGICAL ASSEMBLY IS GENERATED REMARK 300 BY THE OPERATION: Y,X,1-Z REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: DIMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 3310 ANGSTROM**2 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 350 BIOMT1 2 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT2 2 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT3 2 0.000000 0.000000 -1.000000 106.62700 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 LEU A 1 REMARK 465 ARG A 2 REMARK 465 SER A 3 REMARK 465 ARG A 4 REMARK 465 ARG A 5 REMARK 465 LYS A 6 REMARK 465 PRO A 7 REMARK 465 SER A 8 REMARK 465 SER A 9 REMARK 465 ARG A 10 REMARK 465 ASP A 204 REMARK 465 THR A 205 REMARK 465 ARG A 206 REMARK 465 THR A 207 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ASP A 178 -36.59 -38.71 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: APC7479 RELATED DB: TARGETDB DBREF 2RAE A 2 207 UNP Q0S3N9 Q0S3N9_RHOSR 2 207 SEQADV 2RAE LEU A 1 UNP Q0S3N9 EXPRESSION TAG SEQRES 1 A 207 LEU ARG SER ARG ARG LYS PRO SER SER ARG ILE GLY ARG SEQRES 2 A 207 ARG PRO SER THR THR GLN ASP ARG ILE SER THR VAL GLY SEQRES 3 A 207 ILE GLU LEU PHE THR GLU GLN GLY PHE ASP ALA THR SER SEQRES 4 A 207 VAL ASP GLU VAL ALA GLU ALA SER GLY ILE ALA ARG ARG SEQRES 5 A 207 THR LEU PHE ARG TYR PHE PRO SER LYS ASN ALA ILE PRO SEQRES 6 A 207 TRP GLY ASP PHE ASP ALA HIS LEU ALA GLU MET ARG ALA SEQRES 7 A 207 GLN LEU ALA ALA GLN PRO ASP ASP ILE PRO ILE VAL ASP SEQRES 8 A 207 GLY LEU THR ALA ALA LEU LEU GLN PHE ASN ALA PHE PRO SEQRES 9 A 207 ALA SER GLU GLU ILE ASN HIS ARG LYS ARG MET GLY LEU SEQRES 10 A 207 ILE LEU ARG VAL PRO ALA LEU GLN ALA TYR SER VAL VAL SEQRES 11 A 207 MET TYR GLU GLY TRP ARG ASN VAL ILE ALA GLU TYR VAL SEQRES 12 A 207 ALA SER ARG LEU GLY THR SER PRO THR ASP HIS VAL PRO SEQRES 13 A 207 ARG THR VAL GLY TYR LEU LEU LEU GLY VAL ALA MET SER SEQRES 14 A 207 ALA TYR GLU GLN TRP LEU ASP ASP ASP SER LEU GLU LEU SEQRES 15 A 207 ASN GLU LEU LEU ALA SER GLY MET GLN SER LEU TYR ASP SEQRES 16 A 207 GLY LEU SER SER LEU GLY GLU PRO ASP THR ARG THR FORMUL 2 HOH *39(H2 O) HELIX 1 1 THR A 17 GLY A 34 1 18 HELIX 2 2 SER A 39 SER A 47 1 9 HELIX 3 3 ALA A 50 PHE A 58 1 9 HELIX 4 4 ALA A 63 GLY A 67 5 5 HELIX 5 5 ASP A 68 GLN A 83 1 16 HELIX 6 6 PRO A 88 PHE A 100 1 13 HELIX 7 7 PRO A 104 SER A 106 5 3 HELIX 8 8 GLU A 107 VAL A 121 1 15 HELIX 9 9 VAL A 121 GLY A 148 1 28 HELIX 10 10 ASP A 153 ASP A 177 1 25 HELIX 11 11 GLU A 181 GLY A 196 1 16 CRYST1 65.107 65.107 106.627 90.00 90.00 90.00 P 43 21 2 8 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 0.015359 0.000000 0.000000 0.00000 SCALE2 0.000000 0.015359 0.000000 0.00000 SCALE3 0.000000 0.000000 0.009378 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 94 THR OG1 : rot 81:sc= 0.651 USER MOD Set 1.2: A 190 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 150 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 152 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 128 SER OG : rot 118:sc= 0.801 USER MOD Set 3.2: A 132 TYR OH : rot 180:sc= -0.0135 USER MOD Set 3.3: A 168 MET CE :methyl -178:sc= -0.0898 (180deg=-0.107) USER MOD Set 4.1: A 101 ASN : amide:sc= 0.193 K(o=-2.5,f=-0.58) USER MOD Set 4.2: A 111 HIS : no HE2:sc= -1.77 K(o=-2.5,f=-0.58) USER MOD Set 4.3: A 115 MET CE :methyl 155:sc= -2.29 (180deg=0) USER MOD Set 4.4: A 171 TYR OH : rot 163:sc= 1.4 USER MOD Set 5.1: A 79 GLN : amide:sc= -0.669 X(o=-2.3,f=-1.9) USER MOD Set 5.2: A 99 GLN : amide:sc= -1.65! K(o=-2.3!,f=-1.3) USER MOD Set 6.1: A 33 GLN : amide:sc= -0.383 K(o=0.09,f=-0.82!) USER MOD Set 6.2: A 38 THR OG1 : rot -70:sc= 0.473 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 101:sc= 0.213 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 23 SER OG : rot 67:sc= 1.06 USER MOD Single : A 24 THR OG1 : rot 75:sc= 0.575 USER MOD Single : A 31 THR OG1 : rot 77:sc= 1.22 USER MOD Single : A 39 SER OG : rot 180:sc= -1.54! USER MOD Single : A 47 SER OG : rot 81:sc= 1.02 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ -174:sc= 1.01 (180deg=0.855) USER MOD Single : A 62 ASN : amide:sc=-0.00166 K(o=-0.0017,f=-0.73) USER MOD Single : A 72 HIS : no HD1:sc= 0.0778 X(o=0.078,f=-0.38) USER MOD Single : A 76 MET CE :methyl 163:sc= -0.103 (180deg=-0.856) USER MOD Single : A 83 GLN : amide:sc= -1.52 X(o=-1.5,f=-1.3) USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 110 ASN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 113 LYS NZ :NH3+ -175:sc= 0.891 (180deg=0.838) USER MOD Single : A 125 GLN : amide:sc= -0.0309 K(o=-0.031,f=-1.5!) USER MOD Single : A 127 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 MET CE :methyl -127:sc= -0.173 (180deg=-0.651) USER MOD Single : A 137 ASN : amide:sc= -0.0215 K(o=-0.022,f=-0.91) USER MOD Single : A 142 TYR OH : rot 30:sc= 0 USER MOD Single : A 145 SER OG : rot 71:sc= 0.039 USER MOD Single : A 149 THR OG1 : rot -75:sc= 0.00352 USER MOD Single : A 154 HIS : no HD1:sc=-0.00474 X(o=-0.0047,f=-0.08) USER MOD Single : A 158 THR OG1 : rot 77:sc= 0.348 USER MOD Single : A 161 TYR OH : rot 180:sc= 0 USER MOD Single : A 169 SER OG : rot 180:sc= 0 USER MOD Single : A 173 GLN : amide:sc= -0.857 K(o=-0.86,f=-0.24) USER MOD Single : A 179 SER OG : rot -63:sc= 1.27 USER MOD Single : A 183 ASN : amide:sc= -0.603 K(o=-0.6,f=-3.6!) USER MOD Single : A 188 SER OG : rot 180:sc= 0 USER MOD Single : A 191 GLN : amide:sc= -0.0731 X(o=-0.073,f=-0.1) USER MOD Single : A 192 SER OG : rot 180:sc= 0 USER MOD Single : A 194 TYR OH : rot 180:sc= 0 USER MOD Single : A 198 SER OG : rot 180:sc= 0 USER MOD Single : A 199 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 11 10.410 36.597 43.544 1.00 77.98 N ATOM 2 CA ILE A 11 10.318 37.868 42.768 1.00 77.88 C ATOM 3 C ILE A 11 8.856 38.405 42.715 1.00 77.85 C ATOM 4 O ILE A 11 8.603 39.522 43.160 1.00 78.02 O ATOM 5 CB ILE A 11 11.014 37.740 41.339 1.00 77.99 C ATOM 6 CG1 ILE A 11 12.482 38.200 41.406 1.00 78.39 C ATOM 7 CG2 ILE A 11 10.315 38.573 40.289 1.00 77.68 C ATOM 8 CD1 ILE A 11 13.253 38.125 40.082 1.00 77.83 C ATOM 0 HA ILE A 11 10.826 38.546 43.241 1.00 77.88 H new ATOM 0 HB ILE A 11 10.959 36.804 41.092 1.00 77.99 H new ATOM 0 HG12 ILE A 11 12.504 39.116 41.725 1.00 78.39 H new ATOM 0 HG13 ILE A 11 12.945 37.659 42.064 1.00 78.39 H new ATOM 0 HG21 ILE A 11 10.768 38.468 39.438 1.00 77.68 H new ATOM 0 HG22 ILE A 11 9.394 38.280 40.203 1.00 77.68 H new ATOM 0 HG23 ILE A 11 10.334 39.507 40.551 1.00 77.68 H new ATOM 0 HD11 ILE A 11 14.163 38.432 40.219 1.00 77.83 H new ATOM 0 HD12 ILE A 11 13.266 37.208 39.766 1.00 77.83 H new ATOM 0 HD13 ILE A 11 12.818 38.687 39.422 1.00 77.83 H new ATOM 9 N GLY A 12 7.902 37.619 42.210 1.00 77.73 N ATOM 10 CA GLY A 12 6.515 38.091 42.034 1.00 77.69 C ATOM 11 C GLY A 12 6.287 39.149 40.939 1.00 77.64 C ATOM 12 O GLY A 12 5.292 39.877 40.981 1.00 77.17 O ATOM 0 H GLY A 12 8.033 36.806 41.961 1.00 77.73 H new ATOM 0 HA2 GLY A 12 5.955 37.324 41.837 1.00 77.69 H new ATOM 0 HA3 GLY A 12 6.208 38.456 42.879 1.00 77.69 H new ATOM 13 N ARG A 13 7.176 39.213 39.945 1.00 77.71 N ATOM 14 CA ARG A 13 7.186 40.322 38.959 1.00 78.00 C ATOM 15 C ARG A 13 6.191 40.156 37.813 1.00 77.96 C ATOM 16 O ARG A 13 5.474 41.097 37.461 1.00 78.17 O ATOM 17 CB ARG A 13 8.591 40.512 38.354 1.00 78.01 C ATOM 18 CG ARG A 13 8.618 41.321 37.052 1.00 78.05 C ATOM 19 CD ARG A 13 9.988 41.941 36.785 1.00 78.15 C ATOM 20 NE ARG A 13 9.961 42.896 35.668 1.00 78.19 N ATOM 21 CZ ARG A 13 9.412 44.109 35.718 1.00 78.12 C ATOM 22 NH1 ARG A 13 8.828 44.547 36.831 1.00 78.76 N ATOM 23 NH2 ARG A 13 9.445 44.895 34.648 1.00 77.11 N ATOM 0 H ARG A 13 7.789 38.624 39.816 1.00 77.71 H new ATOM 0 HA ARG A 13 6.917 41.102 39.469 1.00 78.00 H new ATOM 0 HB2 ARG A 13 9.155 40.954 39.008 1.00 78.01 H new ATOM 0 HB3 ARG A 13 8.980 39.639 38.187 1.00 78.01 H new ATOM 0 HG2 ARG A 13 8.376 40.745 36.310 1.00 78.05 H new ATOM 0 HG3 ARG A 13 7.950 42.023 37.096 1.00 78.05 H new ATOM 0 HD2 ARG A 13 10.298 42.392 37.586 1.00 78.15 H new ATOM 0 HD3 ARG A 13 10.627 41.237 36.591 1.00 78.15 H new ATOM 0 HE ARG A 13 10.326 42.654 34.928 1.00 78.19 H new ATOM 0 HH11 ARG A 13 8.802 44.045 37.529 1.00 78.76 H new ATOM 0 HH12 ARG A 13 8.477 45.332 36.852 1.00 78.76 H new ATOM 0 HH21 ARG A 13 9.820 44.621 33.924 1.00 77.11 H new ATOM 0 HH22 ARG A 13 9.091 45.678 34.679 1.00 77.11 H new ATOM 24 N ARG A 14 6.180 38.963 37.226 1.00 77.96 N ATOM 25 CA ARG A 14 5.488 38.723 35.970 1.00 77.89 C ATOM 26 C ARG A 14 4.026 38.305 36.169 1.00 77.49 C ATOM 27 O ARG A 14 3.634 37.942 37.276 1.00 77.06 O ATOM 28 CB ARG A 14 6.259 37.676 35.160 1.00 78.48 C ATOM 29 CG ARG A 14 7.621 38.169 34.664 1.00 80.14 C ATOM 30 CD ARG A 14 8.376 37.098 33.879 1.00 82.36 C ATOM 31 NE ARG A 14 9.699 37.537 33.410 1.00 83.71 N ATOM 32 CZ ARG A 14 10.599 36.780 32.761 1.00 84.35 C ATOM 33 NH1 ARG A 14 11.763 37.330 32.393 1.00 84.12 N ATOM 34 NH2 ARG A 14 10.364 35.491 32.473 1.00 82.91 N ATOM 0 H ARG A 14 6.575 38.270 37.548 1.00 77.96 H new ATOM 0 HA ARG A 14 5.461 39.559 35.479 1.00 77.89 H new ATOM 0 HB2 ARG A 14 6.389 36.886 35.707 1.00 78.48 H new ATOM 0 HB3 ARG A 14 5.723 37.408 34.397 1.00 78.48 H new ATOM 0 HG2 ARG A 14 7.495 38.950 34.102 1.00 80.14 H new ATOM 0 HG3 ARG A 14 8.157 38.449 35.423 1.00 80.14 H new ATOM 0 HD2 ARG A 14 8.483 36.313 34.438 1.00 82.36 H new ATOM 0 HD3 ARG A 14 7.842 36.831 33.114 1.00 82.36 H new ATOM 0 HE ARG A 14 9.917 38.354 33.566 1.00 83.71 H new ATOM 0 HH11 ARG A 14 11.925 38.155 32.573 1.00 84.12 H new ATOM 0 HH12 ARG A 14 12.349 36.858 31.977 1.00 84.12 H new ATOM 0 HH21 ARG A 14 9.620 35.127 32.705 1.00 82.91 H new ATOM 0 HH22 ARG A 14 10.957 35.028 32.056 1.00 82.91 H new ATOM 35 N PRO A 15 3.203 38.384 35.097 1.00 77.02 N ATOM 36 CA PRO A 15 1.801 37.946 35.201 1.00 76.65 C ATOM 37 C PRO A 15 1.676 36.485 35.624 1.00 76.20 C ATOM 38 O PRO A 15 2.499 35.658 35.219 1.00 76.07 O ATOM 39 CB PRO A 15 1.262 38.166 33.777 1.00 76.73 C ATOM 40 CG PRO A 15 2.150 39.217 33.194 1.00 76.48 C ATOM 41 CD PRO A 15 3.505 38.907 33.749 1.00 76.81 C ATOM 0 HA PRO A 15 1.310 38.434 35.880 1.00 76.65 H new ATOM 0 HB2 PRO A 15 1.296 37.348 33.257 1.00 76.73 H new ATOM 0 HB3 PRO A 15 0.336 38.455 33.791 1.00 76.73 H new ATOM 0 HG2 PRO A 15 2.149 39.184 32.225 1.00 76.48 H new ATOM 0 HG3 PRO A 15 1.859 40.107 33.448 1.00 76.48 H new ATOM 0 HD2 PRO A 15 3.974 38.253 33.207 1.00 76.81 H new ATOM 0 HD3 PRO A 15 4.066 39.697 33.788 1.00 76.81 H new ATOM 42 N SER A 16 0.679 36.170 36.452 1.00 75.86 N ATOM 43 CA SER A 16 0.614 34.834 37.070 1.00 75.60 C ATOM 44 C SER A 16 0.212 33.766 36.047 1.00 75.14 C ATOM 45 O SER A 16 -0.641 33.994 35.187 1.00 75.07 O ATOM 46 CB SER A 16 -0.311 34.791 38.301 1.00 75.76 C ATOM 47 OG SER A 16 -1.673 34.606 37.946 1.00 76.37 O ATOM 0 H SER A 16 0.039 36.702 36.669 1.00 75.86 H new ATOM 0 HA SER A 16 1.510 34.635 37.385 1.00 75.60 H new ATOM 0 HB2 SER A 16 -0.031 34.071 38.888 1.00 75.76 H new ATOM 0 HB3 SER A 16 -0.219 35.617 38.801 1.00 75.76 H new ATOM 0 HG SER A 16 -2.144 34.586 38.641 1.00 76.37 H new ATOM 48 N THR A 17 0.868 32.613 36.150 1.00 74.58 N ATOM 49 CA THR A 17 0.621 31.464 35.287 1.00 73.68 C ATOM 50 C THR A 17 -0.328 30.522 36.036 1.00 73.31 C ATOM 51 O THR A 17 -0.626 30.747 37.228 1.00 73.10 O ATOM 52 CB THR A 17 1.961 30.737 34.931 1.00 73.91 C ATOM 53 OG1 THR A 17 2.492 30.072 36.089 1.00 72.23 O ATOM 54 CG2 THR A 17 2.992 31.740 34.425 1.00 72.76 C ATOM 0 H THR A 17 1.482 32.475 36.736 1.00 74.58 H new ATOM 0 HA THR A 17 0.223 31.749 34.450 1.00 73.68 H new ATOM 0 HB THR A 17 1.773 30.085 34.238 1.00 73.91 H new ATOM 0 HG1 THR A 17 2.314 29.252 36.048 1.00 72.23 H new ATOM 0 HG21 THR A 17 3.816 31.276 34.209 1.00 72.76 H new ATOM 0 HG22 THR A 17 2.652 32.181 33.631 1.00 72.76 H new ATOM 0 HG23 THR A 17 3.165 32.401 35.113 1.00 72.76 H new ATOM 55 N THR A 18 -0.817 29.482 35.359 1.00 72.21 N ATOM 56 CA THR A 18 -1.606 28.464 36.055 1.00 71.55 C ATOM 57 C THR A 18 -0.771 27.824 37.188 1.00 70.69 C ATOM 58 O THR A 18 -1.267 27.686 38.310 1.00 70.92 O ATOM 59 CB THR A 18 -2.154 27.392 35.088 1.00 71.89 C ATOM 60 OG1 THR A 18 -2.776 28.032 33.962 1.00 71.33 O ATOM 61 CG2 THR A 18 -3.180 26.496 35.794 1.00 71.90 C ATOM 0 H THR A 18 -0.707 29.348 34.517 1.00 72.21 H new ATOM 0 HA THR A 18 -2.377 28.903 36.448 1.00 71.55 H new ATOM 0 HB THR A 18 -1.414 26.841 34.788 1.00 71.89 H new ATOM 0 HG1 THR A 18 -3.072 27.448 33.436 1.00 71.33 H new ATOM 0 HG21 THR A 18 -3.512 25.831 35.171 1.00 71.90 H new ATOM 0 HG22 THR A 18 -2.759 26.052 36.547 1.00 71.90 H new ATOM 0 HG23 THR A 18 -3.919 27.038 36.111 1.00 71.90 H new ATOM 62 N GLN A 19 0.493 27.492 36.901 1.00 69.31 N ATOM 63 CA GLN A 19 1.378 26.788 37.845 1.00 68.74 C ATOM 64 C GLN A 19 1.729 27.642 39.083 1.00 68.09 C ATOM 65 O GLN A 19 1.767 27.153 40.232 1.00 67.39 O ATOM 66 CB GLN A 19 2.661 26.304 37.130 1.00 68.04 C ATOM 67 CG GLN A 19 3.848 26.039 38.052 1.00 69.22 C ATOM 68 CD GLN A 19 4.840 24.982 37.562 1.00 68.79 C ATOM 69 OE1 GLN A 19 4.918 24.680 36.387 1.00 73.42 O ATOM 70 NE2 GLN A 19 5.601 24.419 38.486 1.00 70.13 N ATOM 0 H GLN A 19 0.866 27.670 36.147 1.00 69.31 H new ATOM 0 HA GLN A 19 0.888 26.016 38.169 1.00 68.74 H new ATOM 0 HB2 GLN A 19 2.457 25.490 36.644 1.00 68.04 H new ATOM 0 HB3 GLN A 19 2.920 26.969 36.473 1.00 68.04 H new ATOM 0 HG2 GLN A 19 4.327 26.872 38.185 1.00 69.22 H new ATOM 0 HG3 GLN A 19 3.509 25.765 38.919 1.00 69.22 H new ATOM 0 HE21 GLN A 19 5.522 24.654 39.310 1.00 70.13 H new ATOM 0 HE22 GLN A 19 6.174 23.818 38.263 1.00 70.13 H new ATOM 71 N ASP A 20 2.001 28.915 38.837 1.00 67.19 N ATOM 72 CA ASP A 20 2.425 29.782 39.901 1.00 66.87 C ATOM 73 C ASP A 20 1.177 30.248 40.669 1.00 66.16 C ATOM 74 O ASP A 20 1.251 30.493 41.884 1.00 65.93 O ATOM 75 CB ASP A 20 3.335 30.911 39.372 1.00 67.47 C ATOM 76 CG ASP A 20 4.877 30.617 39.573 1.00 69.08 C ATOM 77 OD1 ASP A 20 5.295 29.839 40.496 1.00 69.82 O ATOM 78 OD2 ASP A 20 5.687 31.221 38.824 1.00 71.51 O ATOM 0 H ASP A 20 1.945 29.287 38.064 1.00 67.19 H new ATOM 0 HA ASP A 20 2.988 29.313 40.537 1.00 66.87 H new ATOM 0 HB2 ASP A 20 3.158 31.045 38.428 1.00 67.47 H new ATOM 0 HB3 ASP A 20 3.108 31.739 39.823 1.00 67.47 H new ATOM 79 N ARG A 21 0.023 30.279 40.000 1.00 64.31 N ATOM 80 CA ARG A 21 -1.257 30.457 40.710 1.00 63.21 C ATOM 81 C ARG A 21 -1.714 29.230 41.556 1.00 61.52 C ATOM 82 O ARG A 21 -2.397 29.399 42.577 1.00 61.29 O ATOM 83 CB ARG A 21 -2.363 30.876 39.737 1.00 63.62 C ATOM 84 CG ARG A 21 -3.650 31.358 40.400 1.00 64.57 C ATOM 85 CD ARG A 21 -4.665 31.864 39.387 1.00 66.19 C ATOM 86 NE ARG A 21 -5.001 30.852 38.376 1.00 69.62 N ATOM 87 CZ ARG A 21 -5.716 29.745 38.610 1.00 70.18 C ATOM 88 NH1 ARG A 21 -5.949 28.900 37.606 1.00 70.32 N ATOM 89 NH2 ARG A 21 -6.194 29.467 39.834 1.00 69.42 N ATOM 0 H ARG A 21 -0.046 30.200 39.146 1.00 64.31 H new ATOM 0 HA ARG A 21 -1.092 31.166 41.352 1.00 63.21 H new ATOM 0 HB2 ARG A 21 -2.024 31.583 39.166 1.00 63.62 H new ATOM 0 HB3 ARG A 21 -2.573 30.124 39.162 1.00 63.62 H new ATOM 0 HG2 ARG A 21 -4.040 30.632 40.911 1.00 64.57 H new ATOM 0 HG3 ARG A 21 -3.442 32.067 41.028 1.00 64.57 H new ATOM 0 HD2 ARG A 21 -5.473 32.135 39.850 1.00 66.19 H new ATOM 0 HD3 ARG A 21 -4.312 32.653 38.946 1.00 66.19 H new ATOM 0 HE ARG A 21 -4.717 30.981 37.574 1.00 69.62 H new ATOM 0 HH11 ARG A 21 -5.641 29.070 36.821 1.00 70.32 H new ATOM 0 HH12 ARG A 21 -6.407 28.185 37.743 1.00 70.32 H new ATOM 0 HH21 ARG A 21 -6.043 30.005 40.487 1.00 69.42 H new ATOM 0 HH22 ARG A 21 -6.651 28.751 39.964 1.00 69.42 H new ATOM 90 N ILE A 22 -1.350 28.014 41.155 1.00 59.15 N ATOM 91 CA ILE A 22 -1.643 26.827 41.974 1.00 57.80 C ATOM 92 C ILE A 22 -0.774 26.867 43.233 1.00 56.05 C ATOM 93 O ILE A 22 -1.239 26.609 44.349 1.00 54.90 O ATOM 94 CB ILE A 22 -1.369 25.503 41.215 1.00 57.86 C ATOM 95 CG1 ILE A 22 -2.304 25.355 39.985 1.00 58.47 C ATOM 96 CG2 ILE A 22 -1.511 24.310 42.163 1.00 57.63 C ATOM 97 CD1 ILE A 22 -1.796 24.407 38.924 1.00 57.05 C ATOM 0 H ILE A 22 -0.936 27.850 40.419 1.00 59.15 H new ATOM 0 HA ILE A 22 -2.587 26.848 42.197 1.00 57.80 H new ATOM 0 HB ILE A 22 -0.457 25.525 40.884 1.00 57.86 H new ATOM 0 HG12 ILE A 22 -3.173 25.048 40.288 1.00 58.47 H new ATOM 0 HG13 ILE A 22 -2.436 26.229 39.586 1.00 58.47 H new ATOM 0 HG21 ILE A 22 -1.338 23.488 41.678 1.00 57.63 H new ATOM 0 HG22 ILE A 22 -0.874 24.396 42.890 1.00 57.63 H new ATOM 0 HG23 ILE A 22 -2.411 24.288 42.523 1.00 57.63 H new ATOM 0 HD11 ILE A 22 -2.432 24.369 38.193 1.00 57.05 H new ATOM 0 HD12 ILE A 22 -0.940 24.721 38.592 1.00 57.05 H new ATOM 0 HD13 ILE A 22 -1.689 23.522 39.305 1.00 57.05 H new ATOM 98 N SER A 23 0.494 27.186 43.025 1.00 54.30 N ATOM 99 CA SER A 23 1.438 27.308 44.093 1.00 53.91 C ATOM 100 C SER A 23 0.946 28.299 45.153 1.00 53.17 C ATOM 101 O SER A 23 0.906 27.966 46.345 1.00 51.62 O ATOM 102 CB SER A 23 2.781 27.707 43.533 1.00 53.20 C ATOM 103 OG SER A 23 3.757 27.757 44.514 1.00 54.71 O ATOM 0 H SER A 23 0.825 27.338 42.246 1.00 54.30 H new ATOM 0 HA SER A 23 1.532 26.450 44.535 1.00 53.91 H new ATOM 0 HB2 SER A 23 3.045 27.075 42.847 1.00 53.20 H new ATOM 0 HB3 SER A 23 2.708 28.575 43.106 1.00 53.20 H new ATOM 0 HG SER A 23 3.905 26.982 44.803 1.00 54.71 H new ATOM 104 N THR A 24 0.524 29.481 44.702 1.00 52.23 N ATOM 105 CA THR A 24 0.056 30.528 45.588 1.00 52.35 C ATOM 106 C THR A 24 -1.197 30.118 46.377 1.00 51.96 C ATOM 107 O THR A 24 -1.220 30.281 47.596 1.00 51.29 O ATOM 108 CB THR A 24 -0.166 31.862 44.826 1.00 53.11 C ATOM 109 OG1 THR A 24 1.050 32.239 44.166 1.00 52.99 O ATOM 110 CG2 THR A 24 -0.617 32.978 45.776 1.00 53.03 C ATOM 0 H THR A 24 0.504 29.692 43.869 1.00 52.23 H new ATOM 0 HA THR A 24 0.760 30.672 46.240 1.00 52.35 H new ATOM 0 HB THR A 24 -0.869 31.730 44.170 1.00 53.11 H new ATOM 0 HG1 THR A 24 1.162 31.757 43.487 1.00 52.99 H new ATOM 0 HG21 THR A 24 -0.748 33.798 45.274 1.00 53.03 H new ATOM 0 HG22 THR A 24 -1.451 32.724 46.202 1.00 53.03 H new ATOM 0 HG23 THR A 24 0.062 33.120 46.454 1.00 53.03 H new ATOM 111 N VAL A 25 -2.206 29.528 45.732 1.00 51.43 N ATOM 112 CA VAL A 25 -3.395 29.114 46.505 1.00 51.60 C ATOM 113 C VAL A 25 -3.026 27.970 47.483 1.00 50.95 C ATOM 114 O VAL A 25 -3.536 27.915 48.584 1.00 49.77 O ATOM 115 CB VAL A 25 -4.681 28.770 45.641 1.00 51.71 C ATOM 116 CG1 VAL A 25 -4.667 29.466 44.236 1.00 52.45 C ATOM 117 CG2 VAL A 25 -4.921 27.261 45.528 1.00 52.25 C ATOM 0 H VAL A 25 -2.231 29.362 44.889 1.00 51.43 H new ATOM 0 HA VAL A 25 -3.665 29.896 47.011 1.00 51.60 H new ATOM 0 HB VAL A 25 -5.436 29.139 46.126 1.00 51.71 H new ATOM 0 HG11 VAL A 25 -5.470 29.226 43.748 1.00 52.45 H new ATOM 0 HG12 VAL A 25 -4.635 30.429 44.352 1.00 52.45 H new ATOM 0 HG13 VAL A 25 -3.887 29.175 43.738 1.00 52.45 H new ATOM 0 HG21 VAL A 25 -5.714 27.098 44.994 1.00 52.25 H new ATOM 0 HG22 VAL A 25 -4.155 26.842 45.105 1.00 52.25 H new ATOM 0 HG23 VAL A 25 -5.046 26.886 46.414 1.00 52.25 H new ATOM 118 N GLY A 26 -2.128 27.084 47.044 1.00 51.08 N ATOM 119 CA GLY A 26 -1.583 26.003 47.862 1.00 50.81 C ATOM 120 C GLY A 26 -0.940 26.526 49.121 1.00 50.72 C ATOM 121 O GLY A 26 -1.282 26.098 50.223 1.00 50.65 O ATOM 0 H GLY A 26 -1.813 27.097 46.244 1.00 51.08 H new ATOM 0 HA2 GLY A 26 -2.292 25.383 48.094 1.00 50.81 H new ATOM 0 HA3 GLY A 26 -0.929 25.505 47.347 1.00 50.81 H new ATOM 122 N ILE A 27 -0.017 27.463 48.957 1.00 50.86 N ATOM 123 CA ILE A 27 0.671 28.084 50.101 1.00 51.07 C ATOM 124 C ILE A 27 -0.291 28.742 51.085 1.00 51.72 C ATOM 125 O ILE A 27 -0.117 28.599 52.335 1.00 51.50 O ATOM 126 CB ILE A 27 1.721 29.086 49.637 1.00 50.84 C ATOM 127 CG1 ILE A 27 2.886 28.361 48.940 1.00 50.56 C ATOM 128 CG2 ILE A 27 2.233 29.898 50.770 1.00 49.82 C ATOM 129 CD1 ILE A 27 3.771 29.317 48.160 1.00 49.88 C ATOM 0 H ILE A 27 0.233 27.761 48.190 1.00 50.86 H new ATOM 0 HA ILE A 27 1.114 27.362 50.573 1.00 51.07 H new ATOM 0 HB ILE A 27 1.296 29.685 49.004 1.00 50.84 H new ATOM 0 HG12 ILE A 27 3.420 27.897 49.604 1.00 50.56 H new ATOM 0 HG13 ILE A 27 2.532 27.687 48.339 1.00 50.56 H new ATOM 0 HG21 ILE A 27 2.898 30.525 50.445 1.00 49.82 H new ATOM 0 HG22 ILE A 27 1.500 30.387 51.176 1.00 49.82 H new ATOM 0 HG23 ILE A 27 2.636 29.314 51.431 1.00 49.82 H new ATOM 0 HD11 ILE A 27 4.490 28.821 47.738 1.00 49.88 H new ATOM 0 HD12 ILE A 27 3.244 29.764 47.479 1.00 49.88 H new ATOM 0 HD13 ILE A 27 4.145 29.977 48.764 1.00 49.88 H new ATOM 130 N GLU A 28 -1.300 29.436 50.545 1.00 52.24 N ATOM 131 CA GLU A 28 -2.313 30.070 51.376 1.00 52.76 C ATOM 132 C GLU A 28 -3.112 28.997 52.133 1.00 53.22 C ATOM 133 O GLU A 28 -3.344 29.130 53.348 1.00 52.78 O ATOM 134 CB GLU A 28 -3.204 31.022 50.564 1.00 53.54 C ATOM 135 CG GLU A 28 -4.439 31.617 51.319 1.00 53.99 C ATOM 136 CD GLU A 28 -4.103 32.484 52.583 1.00 61.13 C ATOM 137 OE1 GLU A 28 -2.894 32.806 52.798 1.00 63.47 O ATOM 138 OE2 GLU A 28 -5.066 32.831 53.366 1.00 58.76 O ATOM 0 H GLU A 28 -1.410 29.548 49.699 1.00 52.24 H new ATOM 0 HA GLU A 28 -1.874 30.629 52.036 1.00 52.76 H new ATOM 0 HB2 GLU A 28 -2.656 31.757 50.247 1.00 53.54 H new ATOM 0 HB3 GLU A 28 -3.524 30.548 49.781 1.00 53.54 H new ATOM 0 HG2 GLU A 28 -4.947 32.162 50.698 1.00 53.99 H new ATOM 0 HG3 GLU A 28 -5.015 30.886 51.591 1.00 53.99 H new ATOM 139 N LEU A 29 -3.475 27.911 51.442 1.00 53.52 N ATOM 140 CA LEU A 29 -4.141 26.773 52.113 1.00 53.78 C ATOM 141 C LEU A 29 -3.301 26.177 53.218 1.00 53.88 C ATOM 142 O LEU A 29 -3.768 26.051 54.355 1.00 54.63 O ATOM 143 CB LEU A 29 -4.530 25.662 51.142 1.00 54.03 C ATOM 144 CG LEU A 29 -5.986 25.638 50.704 1.00 54.82 C ATOM 145 CD1 LEU A 29 -6.236 24.356 49.945 1.00 55.78 C ATOM 146 CD2 LEU A 29 -6.948 25.765 51.904 1.00 54.99 C ATOM 0 H LEU A 29 -3.350 27.809 50.597 1.00 53.52 H new ATOM 0 HA LEU A 29 -4.947 27.152 52.497 1.00 53.78 H new ATOM 0 HB2 LEU A 29 -3.974 25.739 50.351 1.00 54.03 H new ATOM 0 HB3 LEU A 29 -4.321 24.809 51.554 1.00 54.03 H new ATOM 0 HG LEU A 29 -6.158 26.402 50.131 1.00 54.82 H new ATOM 0 HD11 LEU A 29 -7.162 24.325 49.658 1.00 55.78 H new ATOM 0 HD12 LEU A 29 -5.656 24.321 49.168 1.00 55.78 H new ATOM 0 HD13 LEU A 29 -6.051 23.598 50.521 1.00 55.78 H new ATOM 0 HD21 LEU A 29 -7.865 25.746 51.588 1.00 54.99 H new ATOM 0 HD22 LEU A 29 -6.802 25.026 52.516 1.00 54.99 H new ATOM 0 HD23 LEU A 29 -6.783 26.603 52.364 1.00 54.99 H new ATOM 147 N PHE A 30 -2.067 25.827 52.882 1.00 53.64 N ATOM 148 CA PHE A 30 -1.150 25.191 53.827 1.00 53.69 C ATOM 149 C PHE A 30 -0.906 26.052 55.060 1.00 53.93 C ATOM 150 O PHE A 30 -0.709 25.541 56.172 1.00 53.23 O ATOM 151 CB PHE A 30 0.226 24.949 53.182 1.00 53.76 C ATOM 152 CG PHE A 30 0.217 24.047 51.992 1.00 53.47 C ATOM 153 CD1 PHE A 30 -0.631 22.953 51.912 1.00 53.60 C ATOM 154 CD2 PHE A 30 1.119 24.265 50.956 1.00 54.64 C ATOM 155 CE1 PHE A 30 -0.594 22.107 50.800 1.00 54.72 C ATOM 156 CE2 PHE A 30 1.167 23.432 49.843 1.00 53.22 C ATOM 157 CZ PHE A 30 0.316 22.345 49.764 1.00 54.65 C ATOM 0 H PHE A 30 -1.734 25.950 52.099 1.00 53.64 H new ATOM 0 HA PHE A 30 -1.573 24.356 54.081 1.00 53.69 H new ATOM 0 HB2 PHE A 30 0.600 25.805 52.919 1.00 53.76 H new ATOM 0 HB3 PHE A 30 0.820 24.574 53.851 1.00 53.76 H new ATOM 0 HD1 PHE A 30 -1.229 22.781 52.603 1.00 53.60 H new ATOM 0 HD2 PHE A 30 1.705 24.986 51.009 1.00 54.64 H new ATOM 0 HE1 PHE A 30 -1.176 21.384 50.748 1.00 54.72 H new ATOM 0 HE2 PHE A 30 1.769 23.605 49.155 1.00 53.22 H new ATOM 0 HZ PHE A 30 0.348 21.777 49.028 1.00 54.65 H new ATOM 158 N THR A 31 -0.858 27.362 54.846 1.00 54.31 N ATOM 159 CA THR A 31 -0.639 28.307 55.923 1.00 54.26 C ATOM 160 C THR A 31 -1.857 28.376 56.857 1.00 54.68 C ATOM 161 O THR A 31 -1.692 28.309 58.088 1.00 54.46 O ATOM 162 CB THR A 31 -0.334 29.722 55.387 1.00 54.92 C ATOM 163 OG1 THR A 31 0.855 29.686 54.582 1.00 53.75 O ATOM 164 CG2 THR A 31 -0.153 30.690 56.572 1.00 54.24 C ATOM 0 H THR A 31 -0.952 27.724 54.072 1.00 54.31 H new ATOM 0 HA THR A 31 0.130 27.988 56.420 1.00 54.26 H new ATOM 0 HB THR A 31 -1.072 30.031 54.838 1.00 54.92 H new ATOM 0 HG1 THR A 31 0.675 29.355 53.831 1.00 53.75 H new ATOM 0 HG21 THR A 31 0.039 31.580 56.237 1.00 54.24 H new ATOM 0 HG22 THR A 31 -0.967 30.712 57.099 1.00 54.24 H new ATOM 0 HG23 THR A 31 0.583 30.388 57.127 1.00 54.24 H new ATOM 165 N GLU A 32 -3.055 28.497 56.271 1.00 54.10 N ATOM 166 CA GLU A 32 -4.297 28.577 57.039 1.00 54.01 C ATOM 167 C GLU A 32 -4.666 27.269 57.740 1.00 53.32 C ATOM 168 O GLU A 32 -5.073 27.297 58.896 1.00 51.34 O ATOM 169 CB GLU A 32 -5.474 29.033 56.154 1.00 54.64 C ATOM 170 CG GLU A 32 -5.657 30.566 56.087 1.00 57.68 C ATOM 171 CD GLU A 32 -6.431 31.144 57.268 1.00 61.79 C ATOM 172 OE1 GLU A 32 -7.673 30.933 57.361 1.00 64.04 O ATOM 173 OE2 GLU A 32 -5.797 31.828 58.111 1.00 65.87 O ATOM 0 H GLU A 32 -3.166 28.535 55.419 1.00 54.10 H new ATOM 0 HA GLU A 32 -4.130 29.238 57.729 1.00 54.01 H new ATOM 0 HB2 GLU A 32 -5.341 28.693 55.255 1.00 54.64 H new ATOM 0 HB3 GLU A 32 -6.292 28.634 56.490 1.00 54.64 H new ATOM 0 HG2 GLU A 32 -4.784 30.986 56.046 1.00 57.68 H new ATOM 0 HG3 GLU A 32 -6.120 30.793 55.265 1.00 57.68 H new ATOM 174 N GLN A 33 -4.541 26.132 57.042 1.00 52.70 N ATOM 175 CA GLN A 33 -4.986 24.831 57.604 1.00 52.62 C ATOM 176 C GLN A 33 -3.858 23.950 58.129 1.00 51.18 C ATOM 177 O GLN A 33 -4.098 22.942 58.809 1.00 49.85 O ATOM 178 CB GLN A 33 -5.696 24.011 56.540 1.00 53.16 C ATOM 179 CG GLN A 33 -6.826 24.692 55.794 1.00 55.26 C ATOM 180 CD GLN A 33 -7.392 23.762 54.752 1.00 55.44 C ATOM 181 OE1 GLN A 33 -6.689 22.878 54.278 1.00 59.91 O ATOM 182 NE2 GLN A 33 -8.663 23.939 54.399 1.00 60.05 N ATOM 0 H GLN A 33 -4.207 26.085 56.251 1.00 52.70 H new ATOM 0 HA GLN A 33 -5.563 25.075 58.345 1.00 52.62 H new ATOM 0 HB2 GLN A 33 -5.036 23.722 55.891 1.00 53.16 H new ATOM 0 HB3 GLN A 33 -6.050 23.212 56.960 1.00 53.16 H new ATOM 0 HG2 GLN A 33 -7.522 24.954 56.416 1.00 55.26 H new ATOM 0 HG3 GLN A 33 -6.502 25.503 55.372 1.00 55.26 H new ATOM 0 HE21 GLN A 33 -9.124 24.572 54.755 1.00 60.05 H new ATOM 0 HE22 GLN A 33 -9.023 23.421 53.815 1.00 60.05 H new ATOM 183 N GLY A 34 -2.634 24.297 57.752 1.00 50.45 N ATOM 184 CA GLY A 34 -1.470 23.480 58.052 1.00 50.25 C ATOM 185 C GLY A 34 -1.133 22.606 56.868 1.00 49.28 C ATOM 186 O GLY A 34 -2.013 22.175 56.141 1.00 48.95 O ATOM 0 H GLY A 34 -2.456 25.015 57.314 1.00 50.45 H new ATOM 0 HA2 GLY A 34 -0.714 24.048 58.270 1.00 50.25 H new ATOM 0 HA3 GLY A 34 -1.644 22.929 58.831 1.00 50.25 H new ATOM 187 N PHE A 35 0.147 22.310 56.711 1.00 49.08 N ATOM 188 CA PHE A 35 0.628 21.588 55.526 1.00 48.78 C ATOM 189 C PHE A 35 0.105 20.154 55.460 1.00 48.01 C ATOM 190 O PHE A 35 -0.439 19.736 54.442 1.00 46.06 O ATOM 191 CB PHE A 35 2.160 21.581 55.496 1.00 49.17 C ATOM 192 CG PHE A 35 2.732 20.887 54.283 1.00 50.22 C ATOM 193 CD1 PHE A 35 2.699 21.510 53.050 1.00 49.14 C ATOM 194 CD2 PHE A 35 3.278 19.618 54.387 1.00 50.04 C ATOM 195 CE1 PHE A 35 3.217 20.901 51.929 1.00 50.65 C ATOM 196 CE2 PHE A 35 3.778 18.999 53.291 1.00 49.92 C ATOM 197 CZ PHE A 35 3.755 19.637 52.049 1.00 50.94 C ATOM 0 H PHE A 35 0.761 22.516 57.277 1.00 49.08 H new ATOM 0 HA PHE A 35 0.284 22.059 54.751 1.00 48.78 H new ATOM 0 HB2 PHE A 35 2.482 22.496 55.519 1.00 49.17 H new ATOM 0 HB3 PHE A 35 2.491 21.144 56.296 1.00 49.17 H new ATOM 0 HD1 PHE A 35 2.320 22.356 52.976 1.00 49.14 H new ATOM 0 HD2 PHE A 35 3.301 19.190 55.212 1.00 50.04 H new ATOM 0 HE1 PHE A 35 3.204 21.334 51.106 1.00 50.65 H new ATOM 0 HE2 PHE A 35 4.138 18.145 53.366 1.00 49.92 H new ATOM 0 HZ PHE A 35 4.103 19.208 51.301 1.00 50.94 H new ATOM 198 N ASP A 36 0.262 19.411 56.562 1.00 47.42 N ATOM 199 CA ASP A 36 -0.089 18.004 56.561 1.00 47.64 C ATOM 200 C ASP A 36 -1.587 17.837 56.566 1.00 47.52 C ATOM 201 O ASP A 36 -2.067 16.871 56.017 1.00 48.14 O ATOM 202 CB ASP A 36 0.529 17.277 57.733 1.00 48.47 C ATOM 203 CG ASP A 36 2.037 17.279 57.687 1.00 49.08 C ATOM 204 OD1 ASP A 36 2.591 16.831 56.681 1.00 51.55 O ATOM 205 OD2 ASP A 36 2.670 17.716 58.671 1.00 53.40 O ATOM 0 H ASP A 36 0.568 19.707 57.309 1.00 47.42 H new ATOM 0 HA ASP A 36 0.268 17.610 55.750 1.00 47.64 H new ATOM 0 HB2 ASP A 36 0.233 17.691 58.559 1.00 48.47 H new ATOM 0 HB3 ASP A 36 0.210 16.361 57.746 1.00 48.47 H new ATOM 206 N ALA A 37 -2.317 18.804 57.134 1.00 47.27 N ATOM 207 CA ALA A 37 -3.785 18.798 57.124 1.00 47.32 C ATOM 208 C ALA A 37 -4.435 19.061 55.748 1.00 47.28 C ATOM 209 O ALA A 37 -5.578 18.721 55.553 1.00 48.35 O ATOM 210 CB ALA A 37 -4.356 19.793 58.218 1.00 46.66 C ATOM 0 H ALA A 37 -1.974 19.482 57.536 1.00 47.27 H new ATOM 0 HA ALA A 37 -4.034 17.887 57.344 1.00 47.32 H new ATOM 0 HB1 ALA A 37 -5.326 19.776 58.197 1.00 46.66 H new ATOM 0 HB2 ALA A 37 -4.047 19.520 59.096 1.00 46.66 H new ATOM 0 HB3 ALA A 37 -4.045 20.693 58.031 1.00 46.66 H new ATOM 211 N THR A 38 -3.704 19.626 54.793 1.00 47.36 N ATOM 212 CA THR A 38 -4.223 19.922 53.463 1.00 47.07 C ATOM 213 C THR A 38 -3.836 18.842 52.455 1.00 47.21 C ATOM 214 O THR A 38 -2.682 18.489 52.354 1.00 46.95 O ATOM 215 CB THR A 38 -3.655 21.234 52.980 1.00 47.19 C ATOM 216 OG1 THR A 38 -3.858 22.224 53.993 1.00 44.85 O ATOM 217 CG2 THR A 38 -4.302 21.671 51.651 1.00 46.29 C ATOM 0 H THR A 38 -2.881 19.851 54.901 1.00 47.36 H new ATOM 0 HA THR A 38 -5.190 19.962 53.530 1.00 47.07 H new ATOM 0 HB THR A 38 -2.706 21.127 52.812 1.00 47.19 H new ATOM 0 HG1 THR A 38 -4.676 22.407 54.047 1.00 44.85 H new ATOM 0 HG21 THR A 38 -3.918 22.515 51.366 1.00 46.29 H new ATOM 0 HG22 THR A 38 -4.138 20.996 50.974 1.00 46.29 H new ATOM 0 HG23 THR A 38 -5.258 21.777 51.776 1.00 46.29 H new ATOM 218 N SER A 39 -4.811 18.314 51.730 1.00 47.26 N ATOM 219 CA SER A 39 -4.575 17.264 50.747 1.00 48.43 C ATOM 220 C SER A 39 -4.272 17.882 49.384 1.00 48.28 C ATOM 221 O SER A 39 -4.545 19.057 49.153 1.00 47.46 O ATOM 222 CB SER A 39 -5.789 16.359 50.624 1.00 48.27 C ATOM 223 OG SER A 39 -6.839 17.062 50.005 1.00 50.04 O ATOM 0 H SER A 39 -5.634 18.555 51.794 1.00 47.26 H new ATOM 0 HA SER A 39 -3.817 16.738 51.045 1.00 48.43 H new ATOM 0 HB2 SER A 39 -5.565 15.570 50.105 1.00 48.27 H new ATOM 0 HB3 SER A 39 -6.066 16.052 51.502 1.00 48.27 H new ATOM 0 HG SER A 39 -7.510 16.561 49.936 1.00 50.04 H new ATOM 224 N VAL A 40 -3.684 17.097 48.485 1.00 49.49 N ATOM 225 CA VAL A 40 -3.444 17.605 47.133 1.00 49.62 C ATOM 226 C VAL A 40 -4.784 17.878 46.450 1.00 49.58 C ATOM 227 O VAL A 40 -4.883 18.794 45.653 1.00 48.87 O ATOM 228 CB VAL A 40 -2.440 16.737 46.278 1.00 50.29 C ATOM 229 CG1 VAL A 40 -1.075 16.709 46.962 1.00 49.95 C ATOM 230 CG2 VAL A 40 -2.955 15.307 46.000 1.00 50.40 C ATOM 0 H VAL A 40 -3.422 16.290 48.629 1.00 49.49 H new ATOM 0 HA VAL A 40 -2.969 18.448 47.209 1.00 49.62 H new ATOM 0 HB VAL A 40 -2.359 17.160 45.409 1.00 50.29 H new ATOM 0 HG11 VAL A 40 -0.460 16.175 46.435 1.00 49.95 H new ATOM 0 HG12 VAL A 40 -0.733 17.613 47.040 1.00 49.95 H new ATOM 0 HG13 VAL A 40 -1.164 16.320 47.846 1.00 49.95 H new ATOM 0 HG21 VAL A 40 -2.299 14.823 45.473 1.00 50.40 H new ATOM 0 HG22 VAL A 40 -3.098 14.845 46.841 1.00 50.40 H new ATOM 0 HG23 VAL A 40 -3.791 15.353 45.511 1.00 50.40 H new ATOM 231 N ASP A 41 -5.829 17.138 46.813 1.00 50.52 N ATOM 232 CA ASP A 41 -7.150 17.357 46.201 1.00 51.99 C ATOM 233 C ASP A 41 -7.760 18.708 46.603 1.00 52.34 C ATOM 234 O ASP A 41 -8.438 19.338 45.806 1.00 52.79 O ATOM 235 CB ASP A 41 -8.124 16.203 46.499 1.00 52.68 C ATOM 236 CG ASP A 41 -7.691 14.876 45.861 1.00 56.11 C ATOM 237 OD1 ASP A 41 -7.383 14.873 44.631 1.00 59.41 O ATOM 238 OD2 ASP A 41 -7.620 13.851 46.608 1.00 58.54 O ATOM 0 H ASP A 41 -5.802 16.512 47.402 1.00 50.52 H new ATOM 0 HA ASP A 41 -7.004 17.378 45.242 1.00 51.99 H new ATOM 0 HB2 ASP A 41 -8.196 16.087 47.459 1.00 52.68 H new ATOM 0 HB3 ASP A 41 -9.007 16.439 46.175 1.00 52.68 H new ATOM 239 N GLU A 42 -7.494 19.166 47.822 1.00 52.91 N ATOM 240 CA GLU A 42 -7.970 20.476 48.278 1.00 53.81 C ATOM 241 C GLU A 42 -7.288 21.609 47.539 1.00 53.52 C ATOM 242 O GLU A 42 -7.913 22.610 47.210 1.00 53.86 O ATOM 243 CB GLU A 42 -7.730 20.655 49.786 1.00 54.07 C ATOM 244 CG GLU A 42 -8.474 19.663 50.636 1.00 55.71 C ATOM 245 CD GLU A 42 -8.329 19.947 52.112 1.00 56.96 C ATOM 246 OE1 GLU A 42 -8.963 20.934 52.561 1.00 63.69 O ATOM 247 OE2 GLU A 42 -7.602 19.194 52.818 1.00 59.47 O ATOM 0 H GLU A 42 -7.036 18.733 48.407 1.00 52.91 H new ATOM 0 HA GLU A 42 -8.922 20.506 48.092 1.00 53.81 H new ATOM 0 HB2 GLU A 42 -6.780 20.576 49.966 1.00 54.07 H new ATOM 0 HB3 GLU A 42 -7.994 21.552 50.044 1.00 54.07 H new ATOM 0 HG2 GLU A 42 -9.414 19.677 50.397 1.00 55.71 H new ATOM 0 HG3 GLU A 42 -8.147 18.770 50.447 1.00 55.71 H new ATOM 248 N VAL A 43 -5.994 21.455 47.301 1.00 53.73 N ATOM 249 CA VAL A 43 -5.240 22.422 46.520 1.00 54.04 C ATOM 250 C VAL A 43 -5.791 22.464 45.103 1.00 54.78 C ATOM 251 O VAL A 43 -6.030 23.544 44.590 1.00 55.04 O ATOM 252 CB VAL A 43 -3.700 22.136 46.544 1.00 53.45 C ATOM 253 CG1 VAL A 43 -2.947 23.133 45.689 1.00 52.25 C ATOM 254 CG2 VAL A 43 -3.160 22.150 48.009 1.00 53.73 C ATOM 0 H VAL A 43 -5.530 20.790 47.586 1.00 53.73 H new ATOM 0 HA VAL A 43 -5.349 23.297 46.924 1.00 54.04 H new ATOM 0 HB VAL A 43 -3.555 21.252 46.172 1.00 53.45 H new ATOM 0 HG11 VAL A 43 -1.998 22.935 45.720 1.00 52.25 H new ATOM 0 HG12 VAL A 43 -3.259 23.074 44.772 1.00 52.25 H new ATOM 0 HG13 VAL A 43 -3.101 24.030 46.026 1.00 52.25 H new ATOM 0 HG21 VAL A 43 -2.207 21.971 48.004 1.00 53.73 H new ATOM 0 HG22 VAL A 43 -3.324 23.020 48.406 1.00 53.73 H new ATOM 0 HG23 VAL A 43 -3.614 21.468 48.528 1.00 53.73 H new ATOM 255 N ALA A 44 -6.017 21.301 44.486 1.00 55.30 N ATOM 256 CA ALA A 44 -6.597 21.251 43.147 1.00 56.34 C ATOM 257 C ALA A 44 -7.944 21.963 43.105 1.00 56.83 C ATOM 258 O ALA A 44 -8.125 22.883 42.322 1.00 57.27 O ATOM 259 CB ALA A 44 -6.733 19.789 42.637 1.00 55.57 C ATOM 0 H ALA A 44 -5.841 20.532 44.828 1.00 55.30 H new ATOM 0 HA ALA A 44 -5.989 21.717 42.552 1.00 56.34 H new ATOM 0 HB1 ALA A 44 -7.120 19.791 41.748 1.00 55.57 H new ATOM 0 HB2 ALA A 44 -5.857 19.374 42.607 1.00 55.57 H new ATOM 0 HB3 ALA A 44 -7.307 19.289 43.238 1.00 55.57 H new ATOM 260 N GLU A 45 -8.880 21.544 43.947 1.00 58.13 N ATOM 261 CA GLU A 45 -10.227 22.143 43.971 1.00 59.20 C ATOM 262 C GLU A 45 -10.183 23.639 44.279 1.00 59.08 C ATOM 263 O GLU A 45 -10.743 24.438 43.536 1.00 59.22 O ATOM 264 CB GLU A 45 -11.150 21.403 44.946 1.00 59.57 C ATOM 265 CG GLU A 45 -11.479 19.963 44.469 1.00 62.33 C ATOM 266 CD GLU A 45 -12.366 19.167 45.458 1.00 62.79 C ATOM 267 OE1 GLU A 45 -12.693 19.721 46.539 1.00 67.02 O ATOM 268 OE2 GLU A 45 -12.744 18.002 45.147 1.00 66.91 O ATOM 0 H GLU A 45 -8.763 20.912 44.518 1.00 58.13 H new ATOM 0 HA GLU A 45 -10.596 22.045 43.079 1.00 59.20 H new ATOM 0 HB2 GLU A 45 -10.730 21.364 45.819 1.00 59.57 H new ATOM 0 HB3 GLU A 45 -11.975 21.903 45.050 1.00 59.57 H new ATOM 0 HG2 GLU A 45 -11.928 20.010 43.610 1.00 62.33 H new ATOM 0 HG3 GLU A 45 -10.650 19.480 44.330 1.00 62.33 H new ATOM 269 N ALA A 46 -9.478 24.022 45.342 1.00 59.16 N ATOM 270 CA ALA A 46 -9.238 25.436 45.624 1.00 58.88 C ATOM 271 C ALA A 46 -8.665 26.195 44.404 1.00 58.85 C ATOM 272 O ALA A 46 -8.873 27.399 44.279 1.00 58.92 O ATOM 273 CB ALA A 46 -8.322 25.580 46.819 1.00 58.84 C ATOM 0 H ALA A 46 -9.130 23.480 45.912 1.00 59.16 H new ATOM 0 HA ALA A 46 -10.097 25.839 45.827 1.00 58.88 H new ATOM 0 HB1 ALA A 46 -8.169 26.521 46.998 1.00 58.84 H new ATOM 0 HB2 ALA A 46 -8.733 25.167 47.594 1.00 58.84 H new ATOM 0 HB3 ALA A 46 -7.475 25.145 46.632 1.00 58.84 H new ATOM 274 N SER A 47 -7.970 25.488 43.510 1.00 58.79 N ATOM 275 CA SER A 47 -7.348 26.079 42.310 1.00 58.89 C ATOM 276 C SER A 47 -8.235 25.990 41.062 1.00 58.85 C ATOM 277 O SER A 47 -7.840 26.462 39.988 1.00 58.64 O ATOM 278 CB SER A 47 -6.006 25.391 41.999 1.00 58.71 C ATOM 279 OG SER A 47 -5.055 25.529 43.061 1.00 60.35 O ATOM 0 H SER A 47 -7.842 24.640 43.580 1.00 58.79 H new ATOM 0 HA SER A 47 -7.215 27.017 42.519 1.00 58.89 H new ATOM 0 HB2 SER A 47 -6.162 24.449 41.830 1.00 58.71 H new ATOM 0 HB3 SER A 47 -5.634 25.768 41.186 1.00 58.71 H new ATOM 0 HG SER A 47 -5.217 24.960 43.658 1.00 60.35 H new ATOM 280 N GLY A 48 -9.411 25.379 41.195 1.00 59.04 N ATOM 281 CA GLY A 48 -10.337 25.201 40.066 1.00 59.56 C ATOM 282 C GLY A 48 -9.798 24.332 38.940 1.00 59.84 C ATOM 283 O GLY A 48 -10.074 24.588 37.770 1.00 60.54 O ATOM 0 H GLY A 48 -9.698 25.055 41.938 1.00 59.04 H new ATOM 0 HA2 GLY A 48 -11.160 24.809 40.396 1.00 59.56 H new ATOM 0 HA3 GLY A 48 -10.563 26.073 39.707 1.00 59.56 H new ATOM 284 N ILE A 49 -9.017 23.311 39.295 1.00 60.17 N ATOM 285 CA ILE A 49 -8.453 22.353 38.333 1.00 60.06 C ATOM 286 C ILE A 49 -8.604 20.913 38.840 1.00 60.47 C ATOM 287 O ILE A 49 -8.914 20.666 40.016 1.00 60.21 O ATOM 288 CB ILE A 49 -6.974 22.647 38.027 1.00 59.55 C ATOM 289 CG1 ILE A 49 -6.105 22.537 39.288 1.00 60.05 C ATOM 290 CG2 ILE A 49 -6.841 24.030 37.435 1.00 59.57 C ATOM 291 CD1 ILE A 49 -4.616 22.521 39.035 1.00 59.38 C ATOM 0 H ILE A 49 -8.796 23.151 40.110 1.00 60.17 H new ATOM 0 HA ILE A 49 -8.955 22.454 37.509 1.00 60.06 H new ATOM 0 HB ILE A 49 -6.663 21.985 37.390 1.00 59.55 H new ATOM 0 HG12 ILE A 49 -6.312 23.282 39.874 1.00 60.05 H new ATOM 0 HG13 ILE A 49 -6.348 21.727 39.763 1.00 60.05 H new ATOM 0 HG21 ILE A 49 -5.908 24.212 37.243 1.00 59.57 H new ATOM 0 HG22 ILE A 49 -7.355 24.082 36.614 1.00 59.57 H new ATOM 0 HG23 ILE A 49 -7.175 24.686 38.067 1.00 59.57 H new ATOM 0 HD11 ILE A 49 -4.145 22.450 39.880 1.00 59.38 H new ATOM 0 HD12 ILE A 49 -4.391 21.762 38.475 1.00 59.38 H new ATOM 0 HD13 ILE A 49 -4.355 23.341 38.588 1.00 59.38 H new ATOM 292 N ALA A 50 -8.404 19.970 37.930 1.00 61.35 N ATOM 293 CA ALA A 50 -8.459 18.549 38.242 1.00 62.00 C ATOM 294 C ALA A 50 -7.111 18.152 38.797 1.00 62.53 C ATOM 295 O ALA A 50 -6.106 18.812 38.524 1.00 62.20 O ATOM 296 CB ALA A 50 -8.785 17.727 36.979 1.00 62.38 C ATOM 0 H ALA A 50 -8.231 20.139 37.105 1.00 61.35 H new ATOM 0 HA ALA A 50 -9.159 18.374 38.891 1.00 62.00 H new ATOM 0 HB1 ALA A 50 -8.817 16.784 37.206 1.00 62.38 H new ATOM 0 HB2 ALA A 50 -9.645 18.004 36.625 1.00 62.38 H new ATOM 0 HB3 ALA A 50 -8.098 17.875 36.310 1.00 62.38 H new ATOM 297 N ARG A 51 -7.088 17.075 39.578 1.00 63.43 N ATOM 298 CA ARG A 51 -5.836 16.580 40.157 1.00 64.14 C ATOM 299 C ARG A 51 -4.873 16.113 39.066 1.00 64.20 C ATOM 300 O ARG A 51 -3.666 16.121 39.268 1.00 64.69 O ATOM 301 CB ARG A 51 -6.082 15.490 41.232 1.00 64.50 C ATOM 302 CG ARG A 51 -6.734 14.201 40.721 1.00 65.63 C ATOM 303 CD ARG A 51 -6.990 13.180 41.848 1.00 65.82 C ATOM 304 NE ARG A 51 -5.954 12.138 41.901 1.00 67.41 N ATOM 305 CZ ARG A 51 -5.049 11.984 42.874 1.00 67.24 C ATOM 306 NH1 ARG A 51 -5.027 12.801 43.936 1.00 65.99 N ATOM 307 NH2 ARG A 51 -4.157 10.987 42.778 1.00 66.21 N ATOM 0 H ARG A 51 -7.784 16.615 39.786 1.00 63.43 H new ATOM 0 HA ARG A 51 -5.413 17.322 40.617 1.00 64.14 H new ATOM 0 HB2 ARG A 51 -5.233 15.264 41.643 1.00 64.50 H new ATOM 0 HB3 ARG A 51 -6.643 15.865 41.929 1.00 64.50 H new ATOM 0 HG2 ARG A 51 -7.575 14.417 40.288 1.00 65.63 H new ATOM 0 HG3 ARG A 51 -6.163 13.799 40.048 1.00 65.63 H new ATOM 0 HD2 ARG A 51 -7.024 13.643 42.700 1.00 65.82 H new ATOM 0 HD3 ARG A 51 -7.857 12.765 41.715 1.00 65.82 H new ATOM 0 HE ARG A 51 -5.928 11.578 41.249 1.00 67.41 H new ATOM 0 HH11 ARG A 51 -5.601 13.438 44.001 1.00 65.99 H new ATOM 0 HH12 ARG A 51 -4.439 12.688 44.553 1.00 65.99 H new ATOM 0 HH21 ARG A 51 -4.173 10.460 42.099 1.00 66.21 H new ATOM 0 HH22 ARG A 51 -3.569 10.875 43.396 1.00 66.21 H new ATOM 308 N ARG A 52 -5.410 15.743 37.903 1.00 64.38 N ATOM 309 CA ARG A 52 -4.588 15.476 36.733 1.00 64.13 C ATOM 310 C ARG A 52 -3.887 16.758 36.289 1.00 63.68 C ATOM 311 O ARG A 52 -2.698 16.746 35.977 1.00 63.66 O ATOM 312 CB ARG A 52 -5.444 14.904 35.583 1.00 64.45 C ATOM 313 CG ARG A 52 -4.651 14.513 34.310 1.00 64.69 C ATOM 314 CD ARG A 52 -5.538 13.861 33.222 1.00 65.39 C ATOM 315 NE ARG A 52 -4.812 13.506 31.992 1.00 66.75 N ATOM 316 CZ ARG A 52 -5.349 12.943 30.900 1.00 66.63 C ATOM 317 NH1 ARG A 52 -6.651 12.652 30.832 1.00 66.58 N ATOM 318 NH2 ARG A 52 -4.573 12.671 29.853 1.00 66.65 N ATOM 0 H ARG A 52 -6.254 15.642 37.775 1.00 64.38 H new ATOM 0 HA ARG A 52 -3.918 14.815 36.968 1.00 64.13 H new ATOM 0 HB2 ARG A 52 -5.916 14.121 35.907 1.00 64.45 H new ATOM 0 HB3 ARG A 52 -6.116 15.560 35.341 1.00 64.45 H new ATOM 0 HG2 ARG A 52 -4.227 15.305 33.943 1.00 64.69 H new ATOM 0 HG3 ARG A 52 -3.941 13.898 34.553 1.00 64.69 H new ATOM 0 HD2 ARG A 52 -5.947 13.061 33.588 1.00 65.39 H new ATOM 0 HD3 ARG A 52 -6.258 14.470 32.997 1.00 65.39 H new ATOM 0 HE ARG A 52 -3.969 13.675 31.972 1.00 66.75 H new ATOM 0 HH11 ARG A 52 -7.166 12.826 31.499 1.00 66.58 H new ATOM 0 HH12 ARG A 52 -6.974 12.291 30.122 1.00 66.58 H new ATOM 0 HH21 ARG A 52 -3.734 12.856 29.880 1.00 66.65 H new ATOM 0 HH22 ARG A 52 -4.911 12.310 29.149 1.00 66.65 H new ATOM 319 N THR A 53 -4.623 17.862 36.235 1.00 63.17 N ATOM 320 CA THR A 53 -4.018 19.118 35.818 1.00 62.81 C ATOM 321 C THR A 53 -2.937 19.540 36.819 1.00 62.61 C ATOM 322 O THR A 53 -1.893 20.041 36.417 1.00 62.40 O ATOM 323 CB THR A 53 -5.053 20.258 35.650 1.00 63.12 C ATOM 324 OG1 THR A 53 -6.248 19.780 34.999 1.00 62.19 O ATOM 325 CG2 THR A 53 -4.446 21.407 34.836 1.00 63.46 C ATOM 0 H THR A 53 -5.459 17.905 36.432 1.00 63.17 H new ATOM 0 HA THR A 53 -3.621 18.963 34.947 1.00 62.81 H new ATOM 0 HB THR A 53 -5.291 20.580 36.534 1.00 63.12 H new ATOM 0 HG1 THR A 53 -6.796 20.412 34.919 1.00 62.19 H new ATOM 0 HG21 THR A 53 -5.102 22.115 34.737 1.00 63.46 H new ATOM 0 HG22 THR A 53 -3.665 21.752 35.296 1.00 63.46 H new ATOM 0 HG23 THR A 53 -4.187 21.081 33.960 1.00 63.46 H new ATOM 326 N LEU A 54 -3.180 19.317 38.116 1.00 61.92 N ATOM 327 CA LEU A 54 -2.215 19.670 39.156 1.00 61.90 C ATOM 328 C LEU A 54 -0.940 18.829 39.072 1.00 61.69 C ATOM 329 O LEU A 54 0.171 19.348 39.248 1.00 60.94 O ATOM 330 CB LEU A 54 -2.834 19.543 40.567 1.00 61.65 C ATOM 331 CG LEU A 54 -1.906 19.913 41.738 1.00 61.32 C ATOM 332 CD1 LEU A 54 -2.639 20.624 42.866 1.00 61.41 C ATOM 333 CD2 LEU A 54 -1.173 18.689 42.287 1.00 60.53 C ATOM 0 H LEU A 54 -3.904 18.960 38.412 1.00 61.92 H new ATOM 0 HA LEU A 54 -1.974 20.597 39.001 1.00 61.90 H new ATOM 0 HB2 LEU A 54 -3.621 20.108 40.609 1.00 61.65 H new ATOM 0 HB3 LEU A 54 -3.134 18.629 40.690 1.00 61.65 H new ATOM 0 HG LEU A 54 -1.254 20.531 41.372 1.00 61.32 H new ATOM 0 HD11 LEU A 54 -2.013 20.835 43.577 1.00 61.41 H new ATOM 0 HD12 LEU A 54 -3.034 21.444 42.530 1.00 61.41 H new ATOM 0 HD13 LEU A 54 -3.338 20.047 43.212 1.00 61.41 H new ATOM 0 HD21 LEU A 54 -0.599 18.958 43.021 1.00 60.53 H new ATOM 0 HD22 LEU A 54 -1.820 18.039 42.604 1.00 60.53 H new ATOM 0 HD23 LEU A 54 -0.634 18.292 41.585 1.00 60.53 H new ATOM 334 N PHE A 55 -1.100 17.532 38.821 1.00 61.88 N ATOM 335 CA PHE A 55 0.052 16.626 38.810 1.00 62.25 C ATOM 336 C PHE A 55 0.875 16.800 37.543 1.00 62.51 C ATOM 337 O PHE A 55 2.047 16.427 37.502 1.00 63.18 O ATOM 338 CB PHE A 55 -0.356 15.158 39.035 1.00 61.81 C ATOM 339 CG PHE A 55 -0.504 14.806 40.482 1.00 60.88 C ATOM 340 CD1 PHE A 55 0.558 14.962 41.343 1.00 60.34 C ATOM 341 CD2 PHE A 55 -1.709 14.353 40.993 1.00 60.75 C ATOM 342 CE1 PHE A 55 0.433 14.678 42.686 1.00 60.50 C ATOM 343 CE2 PHE A 55 -1.828 14.059 42.340 1.00 60.57 C ATOM 344 CZ PHE A 55 -0.745 14.224 43.177 1.00 60.32 C ATOM 0 H PHE A 55 -1.857 17.158 38.656 1.00 61.88 H new ATOM 0 HA PHE A 55 0.615 16.870 39.561 1.00 62.25 H new ATOM 0 HB2 PHE A 55 -1.195 14.987 38.579 1.00 61.81 H new ATOM 0 HB3 PHE A 55 0.309 14.578 38.633 1.00 61.81 H new ATOM 0 HD1 PHE A 55 1.373 15.264 41.013 1.00 60.34 H new ATOM 0 HD2 PHE A 55 -2.441 14.246 40.429 1.00 60.75 H new ATOM 0 HE1 PHE A 55 1.158 14.798 43.256 1.00 60.50 H new ATOM 0 HE2 PHE A 55 -2.637 13.751 42.680 1.00 60.57 H new ATOM 0 HZ PHE A 55 -0.823 14.023 44.082 1.00 60.32 H new ATOM 345 N ARG A 56 0.276 17.409 36.533 1.00 62.69 N ATOM 346 CA ARG A 56 1.031 17.857 35.381 1.00 62.78 C ATOM 347 C ARG A 56 2.066 18.905 35.773 1.00 62.31 C ATOM 348 O ARG A 56 3.180 18.901 35.224 1.00 62.63 O ATOM 349 CB ARG A 56 0.090 18.438 34.343 1.00 63.17 C ATOM 350 CG ARG A 56 0.773 18.941 33.100 1.00 64.09 C ATOM 351 CD ARG A 56 -0.216 18.918 31.968 1.00 66.34 C ATOM 352 NE ARG A 56 0.042 19.921 30.933 1.00 69.99 N ATOM 353 CZ ARG A 56 -0.602 21.083 30.806 1.00 71.29 C ATOM 354 NH1 ARG A 56 -1.556 21.445 31.675 1.00 71.62 N ATOM 355 NH2 ARG A 56 -0.293 21.890 29.784 1.00 71.84 N ATOM 0 H ARG A 56 -0.568 17.572 36.496 1.00 62.69 H new ATOM 0 HA ARG A 56 1.497 17.091 35.011 1.00 62.78 H new ATOM 0 HB2 ARG A 56 -0.556 17.760 34.092 1.00 63.17 H new ATOM 0 HB3 ARG A 56 -0.406 19.168 34.745 1.00 63.17 H new ATOM 0 HG2 ARG A 56 1.105 19.842 33.239 1.00 64.09 H new ATOM 0 HG3 ARG A 56 1.540 18.386 32.889 1.00 64.09 H new ATOM 0 HD2 ARG A 56 -0.208 18.037 31.561 1.00 66.34 H new ATOM 0 HD3 ARG A 56 -1.107 19.057 32.326 1.00 66.34 H new ATOM 0 HE ARG A 56 0.659 19.747 30.360 1.00 69.99 H new ATOM 0 HH11 ARG A 56 -1.762 20.925 32.328 1.00 71.62 H new ATOM 0 HH12 ARG A 56 -1.962 22.197 31.579 1.00 71.62 H new ATOM 0 HH21 ARG A 56 0.313 21.657 29.220 1.00 71.84 H new ATOM 0 HH22 ARG A 56 -0.701 22.641 29.691 1.00 71.84 H new ATOM 356 N TYR A 57 1.700 19.788 36.713 1.00 60.99 N ATOM 357 CA TYR A 57 2.563 20.904 37.133 1.00 60.01 C ATOM 358 C TYR A 57 3.438 20.570 38.345 1.00 58.89 C ATOM 359 O TYR A 57 4.527 21.097 38.485 1.00 58.24 O ATOM 360 CB TYR A 57 1.726 22.164 37.411 1.00 60.22 C ATOM 361 CG TYR A 57 1.042 22.730 36.182 1.00 60.44 C ATOM 362 CD1 TYR A 57 1.777 23.119 35.073 1.00 61.27 C ATOM 363 CD2 TYR A 57 -0.334 22.882 36.132 1.00 60.52 C ATOM 364 CE1 TYR A 57 1.157 23.631 33.942 1.00 60.24 C ATOM 365 CE2 TYR A 57 -0.965 23.397 35.003 1.00 61.08 C ATOM 366 CZ TYR A 57 -0.216 23.771 33.913 1.00 60.71 C ATOM 367 OH TYR A 57 -0.839 24.281 32.775 1.00 62.40 O ATOM 0 H TYR A 57 0.945 19.757 37.124 1.00 60.99 H new ATOM 0 HA TYR A 57 3.166 21.073 36.392 1.00 60.01 H new ATOM 0 HB2 TYR A 57 1.053 21.954 38.077 1.00 60.22 H new ATOM 0 HB3 TYR A 57 2.301 22.846 37.793 1.00 60.22 H new ATOM 0 HD1 TYR A 57 2.703 23.035 35.087 1.00 61.27 H new ATOM 0 HD2 TYR A 57 -0.847 22.635 36.868 1.00 60.52 H new ATOM 0 HE1 TYR A 57 1.666 23.880 33.204 1.00 60.24 H new ATOM 0 HE2 TYR A 57 -1.890 23.488 34.986 1.00 61.08 H new ATOM 0 HH TYR A 57 -1.669 24.309 32.899 1.00 62.40 H new ATOM 368 N PHE A 58 2.963 19.704 39.231 1.00 57.93 N ATOM 369 CA PHE A 58 3.768 19.292 40.375 1.00 57.60 C ATOM 370 C PHE A 58 3.819 17.771 40.482 1.00 57.68 C ATOM 371 O PHE A 58 2.791 17.125 40.362 1.00 59.43 O ATOM 372 CB PHE A 58 3.194 19.920 41.638 1.00 56.15 C ATOM 373 CG PHE A 58 3.082 21.410 41.559 1.00 54.83 C ATOM 374 CD1 PHE A 58 4.171 22.212 41.832 1.00 53.88 C ATOM 375 CD2 PHE A 58 1.906 22.010 41.166 1.00 53.55 C ATOM 376 CE1 PHE A 58 4.079 23.593 41.760 1.00 53.41 C ATOM 377 CE2 PHE A 58 1.813 23.388 41.071 1.00 54.06 C ATOM 378 CZ PHE A 58 2.902 24.178 41.373 1.00 53.77 C ATOM 0 H PHE A 58 2.183 19.345 39.190 1.00 57.93 H new ATOM 0 HA PHE A 58 4.680 19.600 40.258 1.00 57.60 H new ATOM 0 HB2 PHE A 58 2.316 19.544 41.808 1.00 56.15 H new ATOM 0 HB3 PHE A 58 3.755 19.684 42.393 1.00 56.15 H new ATOM 0 HD1 PHE A 58 4.980 21.819 42.068 1.00 53.88 H new ATOM 0 HD2 PHE A 58 1.167 21.484 40.962 1.00 53.55 H new ATOM 0 HE1 PHE A 58 4.814 24.121 41.974 1.00 53.41 H new ATOM 0 HE2 PHE A 58 1.014 23.782 40.803 1.00 54.06 H new ATOM 0 HZ PHE A 58 2.838 25.104 41.314 1.00 53.77 H new ATOM 379 N PRO A 59 5.016 17.185 40.650 1.00 57.10 N ATOM 380 CA PRO A 59 5.065 15.731 40.865 1.00 56.79 C ATOM 381 C PRO A 59 4.555 15.282 42.236 1.00 56.87 C ATOM 382 O PRO A 59 4.240 14.087 42.428 1.00 56.78 O ATOM 383 CB PRO A 59 6.562 15.405 40.755 1.00 56.96 C ATOM 384 CG PRO A 59 7.261 16.680 41.125 1.00 57.23 C ATOM 385 CD PRO A 59 6.363 17.782 40.596 1.00 57.08 C ATOM 0 HA PRO A 59 4.493 15.277 40.227 1.00 56.79 H new ATOM 0 HB2 PRO A 59 6.809 14.682 41.352 1.00 56.96 H new ATOM 0 HB3 PRO A 59 6.796 15.123 39.857 1.00 56.96 H new ATOM 0 HG2 PRO A 59 7.378 16.752 42.085 1.00 57.23 H new ATOM 0 HG3 PRO A 59 8.145 16.725 40.728 1.00 57.23 H new ATOM 0 HD2 PRO A 59 6.421 18.582 41.141 1.00 57.08 H new ATOM 0 HD3 PRO A 59 6.605 18.036 39.692 1.00 57.08 H new ATOM 386 N SER A 60 4.503 16.212 43.187 1.00 56.06 N ATOM 387 CA SER A 60 4.140 15.869 44.559 1.00 55.82 C ATOM 388 C SER A 60 3.587 17.065 45.304 1.00 55.12 C ATOM 389 O SER A 60 3.597 18.195 44.781 1.00 55.29 O ATOM 390 CB SER A 60 5.385 15.388 45.306 1.00 56.34 C ATOM 391 OG SER A 60 6.295 16.468 45.494 1.00 59.41 O ATOM 0 H SER A 60 4.674 17.045 43.059 1.00 56.06 H new ATOM 0 HA SER A 60 3.461 15.177 44.519 1.00 55.82 H new ATOM 0 HB2 SER A 60 5.131 15.017 46.166 1.00 56.34 H new ATOM 0 HB3 SER A 60 5.816 14.677 44.806 1.00 56.34 H new ATOM 0 HG SER A 60 6.974 16.194 45.906 1.00 59.41 H new ATOM 392 N LYS A 61 3.141 16.806 46.535 1.00 53.39 N ATOM 393 CA LYS A 61 2.663 17.838 47.423 1.00 52.75 C ATOM 394 C LYS A 61 3.833 18.699 47.866 1.00 51.99 C ATOM 395 O LYS A 61 3.713 19.913 47.994 1.00 51.59 O ATOM 396 CB LYS A 61 1.988 17.188 48.648 1.00 52.35 C ATOM 397 CG LYS A 61 1.188 18.129 49.514 1.00 52.12 C ATOM 398 CD LYS A 61 0.625 17.384 50.754 1.00 52.35 C ATOM 399 CE LYS A 61 0.268 18.316 51.873 1.00 50.80 C ATOM 400 NZ LYS A 61 -0.136 17.537 53.109 1.00 50.64 N ATOM 0 H LYS A 61 3.111 16.015 46.871 1.00 53.39 H new ATOM 0 HA LYS A 61 2.015 18.394 46.964 1.00 52.75 H new ATOM 0 HB2 LYS A 61 1.403 16.479 48.339 1.00 52.35 H new ATOM 0 HB3 LYS A 61 2.673 16.772 49.194 1.00 52.35 H new ATOM 0 HG2 LYS A 61 1.748 18.868 49.801 1.00 52.12 H new ATOM 0 HG3 LYS A 61 0.459 18.509 49.000 1.00 52.12 H new ATOM 0 HD2 LYS A 61 -0.162 16.879 50.494 1.00 52.35 H new ATOM 0 HD3 LYS A 61 1.282 16.743 51.068 1.00 52.35 H new ATOM 0 HE2 LYS A 61 1.024 18.888 52.078 1.00 50.80 H new ATOM 0 HE3 LYS A 61 -0.459 18.896 51.598 1.00 50.80 H new ATOM 0 HZ1 LYS A 61 -0.427 18.101 53.733 1.00 50.64 H new ATOM 0 HZ2 LYS A 61 -0.785 16.965 52.901 1.00 50.64 H new ATOM 0 HZ3 LYS A 61 0.567 17.088 53.420 1.00 50.64 H new ATOM 401 N ASN A 62 4.971 18.058 48.119 1.00 51.83 N ATOM 402 CA ASN A 62 6.161 18.791 48.547 1.00 51.75 C ATOM 403 C ASN A 62 6.697 19.786 47.502 1.00 51.20 C ATOM 404 O ASN A 62 7.372 20.746 47.888 1.00 51.66 O ATOM 405 CB ASN A 62 7.284 17.839 48.977 1.00 51.50 C ATOM 406 CG ASN A 62 6.926 17.010 50.171 1.00 53.10 C ATOM 407 OD1 ASN A 62 6.106 17.412 51.015 1.00 55.95 O ATOM 408 ND2 ASN A 62 7.533 15.825 50.260 1.00 51.72 N ATOM 0 H ASN A 62 5.076 17.207 48.050 1.00 51.83 H new ATOM 0 HA ASN A 62 5.868 19.315 49.309 1.00 51.75 H new ATOM 0 HB2 ASN A 62 7.504 17.252 48.237 1.00 51.50 H new ATOM 0 HB3 ASN A 62 8.080 18.356 49.176 1.00 51.50 H new ATOM 0 HD21 ASN A 62 7.363 15.303 50.922 1.00 51.72 H new ATOM 0 HD22 ASN A 62 8.095 15.583 49.655 1.00 51.72 H new ATOM 409 N ALA A 63 6.405 19.565 46.221 1.00 50.07 N ATOM 410 CA ALA A 63 6.784 20.527 45.165 1.00 50.86 C ATOM 411 C ALA A 63 5.942 21.815 45.174 1.00 50.65 C ATOM 412 O ALA A 63 6.410 22.861 44.748 1.00 50.14 O ATOM 413 CB ALA A 63 6.732 19.847 43.716 1.00 49.50 C ATOM 0 H ALA A 63 5.989 18.868 45.936 1.00 50.07 H new ATOM 0 HA ALA A 63 7.696 20.787 45.366 1.00 50.86 H new ATOM 0 HB1 ALA A 63 6.985 20.499 43.043 1.00 49.50 H new ATOM 0 HB2 ALA A 63 7.348 19.098 43.687 1.00 49.50 H new ATOM 0 HB3 ALA A 63 5.832 19.532 43.538 1.00 49.50 H new ATOM 414 N ILE A 64 4.709 21.760 45.677 1.00 51.10 N ATOM 415 CA ILE A 64 3.785 22.879 45.493 1.00 51.20 C ATOM 416 C ILE A 64 4.337 24.189 46.048 1.00 51.43 C ATOM 417 O ILE A 64 4.243 25.203 45.393 1.00 51.87 O ATOM 418 CB ILE A 64 2.362 22.573 46.013 1.00 51.22 C ATOM 419 CG1 ILE A 64 1.773 21.392 45.224 1.00 51.37 C ATOM 420 CG2 ILE A 64 1.436 23.817 45.877 1.00 50.17 C ATOM 421 CD1 ILE A 64 0.459 20.853 45.762 1.00 51.15 C ATOM 0 H ILE A 64 4.392 21.095 46.121 1.00 51.10 H new ATOM 0 HA ILE A 64 3.701 23.000 44.534 1.00 51.20 H new ATOM 0 HB ILE A 64 2.419 22.343 46.954 1.00 51.22 H new ATOM 0 HG12 ILE A 64 1.641 21.669 44.304 1.00 51.37 H new ATOM 0 HG13 ILE A 64 2.422 20.672 45.213 1.00 51.37 H new ATOM 0 HG21 ILE A 64 0.551 23.600 46.209 1.00 50.17 H new ATOM 0 HG22 ILE A 64 1.803 24.552 46.393 1.00 50.17 H new ATOM 0 HG23 ILE A 64 1.376 24.076 44.944 1.00 50.17 H new ATOM 0 HD11 ILE A 64 0.161 20.115 45.208 1.00 51.15 H new ATOM 0 HD12 ILE A 64 0.585 20.544 46.673 1.00 51.15 H new ATOM 0 HD13 ILE A 64 -0.209 21.556 45.749 1.00 51.15 H new ATOM 422 N PRO A 65 4.921 24.183 47.255 1.00 52.31 N ATOM 423 CA PRO A 65 5.498 25.457 47.742 1.00 52.45 C ATOM 424 C PRO A 65 6.634 26.055 46.910 1.00 52.25 C ATOM 425 O PRO A 65 6.901 27.232 47.030 1.00 51.83 O ATOM 426 CB PRO A 65 6.051 25.082 49.117 1.00 52.43 C ATOM 427 CG PRO A 65 5.215 23.894 49.548 1.00 53.16 C ATOM 428 CD PRO A 65 5.016 23.117 48.279 1.00 52.48 C ATOM 0 HA PRO A 65 4.812 26.143 47.716 1.00 52.45 H new ATOM 0 HB2 PRO A 65 6.992 24.853 49.069 1.00 52.43 H new ATOM 0 HB3 PRO A 65 5.969 25.818 49.744 1.00 52.43 H new ATOM 0 HG2 PRO A 65 5.669 23.365 50.222 1.00 53.16 H new ATOM 0 HG3 PRO A 65 4.369 24.174 49.930 1.00 53.16 H new ATOM 0 HD2 PRO A 65 5.757 22.515 48.105 1.00 52.48 H new ATOM 0 HD3 PRO A 65 4.212 22.575 48.311 1.00 52.48 H new ATOM 429 N TRP A 66 7.343 25.233 46.161 1.00 52.42 N ATOM 430 CA TRP A 66 8.502 25.702 45.411 1.00 53.56 C ATOM 431 C TRP A 66 8.096 26.404 44.107 1.00 54.06 C ATOM 432 O TRP A 66 8.884 27.169 43.544 1.00 54.98 O ATOM 433 CB TRP A 66 9.472 24.545 45.154 1.00 54.32 C ATOM 434 CG TRP A 66 10.431 24.309 46.300 1.00 53.95 C ATOM 435 CD1 TRP A 66 10.343 23.359 47.283 1.00 55.78 C ATOM 436 CD2 TRP A 66 11.606 25.064 46.581 1.00 54.36 C ATOM 437 NE1 TRP A 66 11.420 23.469 48.156 1.00 54.94 N ATOM 438 CE2 TRP A 66 12.206 24.508 47.737 1.00 54.39 C ATOM 439 CE3 TRP A 66 12.225 26.153 45.954 1.00 56.10 C ATOM 440 CZ2 TRP A 66 13.367 25.013 48.279 1.00 55.11 C ATOM 441 CZ3 TRP A 66 13.388 26.645 46.494 1.00 56.01 C ATOM 442 CH2 TRP A 66 13.946 26.075 47.647 1.00 55.84 C ATOM 0 H TRP A 66 7.173 24.395 46.070 1.00 52.42 H new ATOM 0 HA TRP A 66 8.959 26.367 45.950 1.00 53.56 H new ATOM 0 HB2 TRP A 66 8.964 23.734 44.992 1.00 54.32 H new ATOM 0 HB3 TRP A 66 9.979 24.728 44.348 1.00 54.32 H new ATOM 0 HD1 TRP A 66 9.661 22.731 47.356 1.00 55.78 H new ATOM 0 HE1 TRP A 66 11.567 22.970 48.841 1.00 54.94 H new ATOM 0 HE3 TRP A 66 11.857 26.534 45.190 1.00 56.10 H new ATOM 0 HZ2 TRP A 66 13.742 24.645 49.046 1.00 55.11 H new ATOM 0 HZ3 TRP A 66 13.812 27.367 46.089 1.00 56.01 H new ATOM 0 HH2 TRP A 66 14.733 26.431 47.991 1.00 55.84 H new ATOM 443 N GLY A 67 6.864 26.166 43.653 1.00 53.82 N ATOM 444 CA GLY A 67 6.330 26.817 42.477 1.00 53.95 C ATOM 445 C GLY A 67 7.055 26.359 41.230 1.00 54.11 C ATOM 446 O GLY A 67 7.438 25.196 41.115 1.00 54.50 O ATOM 0 H GLY A 67 6.318 25.617 44.027 1.00 53.82 H new ATOM 0 HA2 GLY A 67 5.384 26.621 42.396 1.00 53.95 H new ATOM 0 HA3 GLY A 67 6.413 27.779 42.569 1.00 53.95 H new ATOM 447 N ASP A 68 7.239 27.270 40.287 1.00 54.33 N ATOM 448 CA ASP A 68 8.012 26.974 39.085 1.00 54.27 C ATOM 449 C ASP A 68 9.463 27.380 39.314 1.00 54.40 C ATOM 450 O ASP A 68 9.939 28.380 38.787 1.00 54.30 O ATOM 451 CB ASP A 68 7.419 27.686 37.857 1.00 54.44 C ATOM 452 CG ASP A 68 7.944 27.123 36.544 1.00 53.49 C ATOM 453 OD1 ASP A 68 8.907 26.345 36.585 1.00 52.46 O ATOM 454 OD2 ASP A 68 7.392 27.446 35.474 1.00 53.47 O ATOM 0 H ASP A 68 6.924 28.070 40.321 1.00 54.33 H new ATOM 0 HA ASP A 68 7.974 26.021 38.906 1.00 54.27 H new ATOM 0 HB2 ASP A 68 6.453 27.606 37.876 1.00 54.44 H new ATOM 0 HB3 ASP A 68 7.626 28.632 37.905 1.00 54.44 H new ATOM 455 N PHE A 69 10.165 26.576 40.101 1.00 54.55 N ATOM 456 CA PHE A 69 11.513 26.912 40.507 1.00 54.39 C ATOM 457 C PHE A 69 12.469 26.838 39.342 1.00 53.75 C ATOM 458 O PHE A 69 13.440 27.577 39.315 1.00 52.79 O ATOM 459 CB PHE A 69 12.001 25.995 41.614 1.00 54.51 C ATOM 460 CG PHE A 69 13.238 26.489 42.324 1.00 54.33 C ATOM 461 CD1 PHE A 69 13.238 27.711 42.979 1.00 55.58 C ATOM 462 CD2 PHE A 69 14.393 25.720 42.354 1.00 54.70 C ATOM 463 CE1 PHE A 69 14.368 28.164 43.663 1.00 54.93 C ATOM 464 CE2 PHE A 69 15.526 26.160 43.019 1.00 54.71 C ATOM 465 CZ PHE A 69 15.517 27.392 43.675 1.00 54.12 C ATOM 0 H PHE A 69 9.874 25.828 40.410 1.00 54.55 H new ATOM 0 HA PHE A 69 11.489 27.823 40.840 1.00 54.39 H new ATOM 0 HB2 PHE A 69 11.290 25.882 42.264 1.00 54.51 H new ATOM 0 HB3 PHE A 69 12.183 25.119 41.238 1.00 54.51 H new ATOM 0 HD1 PHE A 69 12.472 28.238 42.963 1.00 55.58 H new ATOM 0 HD2 PHE A 69 14.407 24.897 41.921 1.00 54.70 H new ATOM 0 HE1 PHE A 69 14.349 28.980 44.108 1.00 54.93 H new ATOM 0 HE2 PHE A 69 16.293 25.634 43.028 1.00 54.71 H new ATOM 0 HZ PHE A 69 16.278 27.692 44.117 1.00 54.12 H new ATOM 466 N ASP A 70 12.220 25.923 38.417 1.00 53.62 N ATOM 467 CA ASP A 70 13.008 25.859 37.198 1.00 54.59 C ATOM 468 C ASP A 70 13.023 27.193 36.435 1.00 53.58 C ATOM 469 O ASP A 70 14.043 27.568 35.914 1.00 53.52 O ATOM 470 CB ASP A 70 12.504 24.752 36.258 1.00 55.29 C ATOM 471 CG ASP A 70 12.851 23.342 36.754 1.00 59.27 C ATOM 472 OD1 ASP A 70 13.512 23.212 37.792 1.00 61.14 O ATOM 473 OD2 ASP A 70 12.485 22.357 36.068 1.00 67.97 O ATOM 0 H ASP A 70 11.600 25.330 38.476 1.00 53.62 H new ATOM 0 HA ASP A 70 13.914 25.657 37.481 1.00 54.59 H new ATOM 0 HB2 ASP A 70 11.542 24.828 36.163 1.00 55.29 H new ATOM 0 HB3 ASP A 70 12.888 24.883 35.377 1.00 55.29 H new ATOM 474 N ALA A 71 11.890 27.881 36.371 1.00 53.24 N ATOM 475 CA ALA A 71 11.787 29.138 35.631 1.00 53.63 C ATOM 476 C ALA A 71 12.586 30.219 36.362 1.00 53.45 C ATOM 477 O ALA A 71 13.302 30.996 35.726 1.00 52.93 O ATOM 478 CB ALA A 71 10.341 29.548 35.459 1.00 52.45 C ATOM 0 H ALA A 71 11.160 27.636 36.753 1.00 53.24 H new ATOM 0 HA ALA A 71 12.158 29.018 34.743 1.00 53.63 H new ATOM 0 HB1 ALA A 71 10.297 30.383 34.967 1.00 52.45 H new ATOM 0 HB2 ALA A 71 9.865 28.859 34.969 1.00 52.45 H new ATOM 0 HB3 ALA A 71 9.932 29.666 36.331 1.00 52.45 H new ATOM 479 N HIS A 72 12.479 30.238 37.687 1.00 54.30 N ATOM 480 CA HIS A 72 13.261 31.138 38.566 1.00 54.20 C ATOM 481 C HIS A 72 14.729 30.890 38.331 1.00 53.55 C ATOM 482 O HIS A 72 15.483 31.832 38.124 1.00 53.34 O ATOM 483 CB HIS A 72 12.927 30.846 40.047 1.00 55.73 C ATOM 484 CG HIS A 72 13.576 31.756 41.077 1.00 58.18 C ATOM 485 ND1 HIS A 72 14.760 31.434 41.731 1.00 65.48 N ATOM 486 CD2 HIS A 72 13.114 32.881 41.692 1.00 62.23 C ATOM 487 CE1 HIS A 72 15.036 32.363 42.637 1.00 62.77 C ATOM 488 NE2 HIS A 72 14.056 33.256 42.627 1.00 63.19 N ATOM 0 H HIS A 72 11.943 29.722 38.118 1.00 54.30 H new ATOM 0 HA HIS A 72 13.040 32.061 38.366 1.00 54.20 H new ATOM 0 HB2 HIS A 72 11.965 30.899 40.158 1.00 55.73 H new ATOM 0 HB3 HIS A 72 13.186 29.932 40.243 1.00 55.73 H new ATOM 0 HD2 HIS A 72 12.311 33.316 41.514 1.00 62.23 H new ATOM 0 HE1 HIS A 72 15.787 32.384 43.185 1.00 62.77 H new ATOM 0 HE2 HIS A 72 14.014 33.957 43.124 1.00 63.19 H new ATOM 489 N LEU A 73 15.132 29.620 38.364 1.00 52.35 N ATOM 490 CA LEU A 73 16.538 29.289 38.151 1.00 51.98 C ATOM 491 C LEU A 73 17.038 29.700 36.782 1.00 49.61 C ATOM 492 O LEU A 73 18.182 30.057 36.656 1.00 49.25 O ATOM 493 CB LEU A 73 16.841 27.796 38.334 1.00 52.07 C ATOM 494 CG LEU A 73 16.910 27.260 39.745 1.00 53.30 C ATOM 495 CD1 LEU A 73 17.269 25.795 39.611 1.00 53.72 C ATOM 496 CD2 LEU A 73 17.904 28.041 40.656 1.00 55.19 C ATOM 0 H LEU A 73 14.616 28.947 38.506 1.00 52.35 H new ATOM 0 HA LEU A 73 17.003 29.797 38.834 1.00 51.98 H new ATOM 0 HB2 LEU A 73 16.162 27.293 37.857 1.00 52.07 H new ATOM 0 HB3 LEU A 73 17.689 27.609 37.902 1.00 52.07 H new ATOM 0 HG LEU A 73 16.058 27.375 40.195 1.00 53.30 H new ATOM 0 HD11 LEU A 73 17.328 25.394 40.492 1.00 53.72 H new ATOM 0 HD12 LEU A 73 16.586 25.340 39.094 1.00 53.72 H new ATOM 0 HD13 LEU A 73 18.124 25.711 39.160 1.00 53.72 H new ATOM 0 HD21 LEU A 73 17.904 27.651 41.544 1.00 55.19 H new ATOM 0 HD22 LEU A 73 18.797 27.988 40.281 1.00 55.19 H new ATOM 0 HD23 LEU A 73 17.631 28.970 40.711 1.00 55.19 H new ATOM 497 N ALA A 74 16.205 29.601 35.767 1.00 49.33 N ATOM 498 CA ALA A 74 16.599 30.023 34.406 1.00 49.49 C ATOM 499 C ALA A 74 16.774 31.561 34.291 1.00 49.23 C ATOM 500 O ALA A 74 17.620 32.033 33.522 1.00 50.39 O ATOM 501 CB ALA A 74 15.598 29.500 33.383 1.00 48.21 C ATOM 0 H ALA A 74 15.404 29.294 35.828 1.00 49.33 H new ATOM 0 HA ALA A 74 17.468 29.635 34.218 1.00 49.49 H new ATOM 0 HB1 ALA A 74 15.866 29.782 32.494 1.00 48.21 H new ATOM 0 HB2 ALA A 74 15.573 28.531 33.420 1.00 48.21 H new ATOM 0 HB3 ALA A 74 14.717 29.853 33.582 1.00 48.21 H new ATOM 502 N GLU A 75 15.971 32.343 35.027 1.00 49.05 N ATOM 503 CA GLU A 75 16.168 33.790 35.086 1.00 49.46 C ATOM 504 C GLU A 75 17.479 34.133 35.777 1.00 48.38 C ATOM 505 O GLU A 75 18.210 34.970 35.312 1.00 48.05 O ATOM 506 CB GLU A 75 15.051 34.504 35.837 1.00 49.22 C ATOM 507 CG GLU A 75 13.711 34.513 35.217 1.00 51.84 C ATOM 508 CD GLU A 75 12.673 35.217 36.103 1.00 53.52 C ATOM 509 OE1 GLU A 75 13.022 35.657 37.225 1.00 61.00 O ATOM 510 OE2 GLU A 75 11.503 35.362 35.693 1.00 61.45 O ATOM 0 H GLU A 75 15.311 32.052 35.495 1.00 49.05 H new ATOM 0 HA GLU A 75 16.174 34.091 34.164 1.00 49.46 H new ATOM 0 HB2 GLU A 75 14.972 34.097 36.714 1.00 49.22 H new ATOM 0 HB3 GLU A 75 15.324 35.425 35.975 1.00 49.22 H new ATOM 0 HG2 GLU A 75 13.756 34.959 34.357 1.00 51.84 H new ATOM 0 HG3 GLU A 75 13.427 33.601 35.049 1.00 51.84 H new ATOM 511 N MET A 76 17.766 33.513 36.912 1.00 48.50 N ATOM 512 CA MET A 76 19.004 33.827 37.619 1.00 48.41 C ATOM 513 C MET A 76 20.205 33.536 36.736 1.00 49.08 C ATOM 514 O MET A 76 21.133 34.318 36.680 1.00 49.10 O ATOM 515 CB MET A 76 19.123 33.035 38.904 1.00 48.00 C ATOM 516 CG MET A 76 20.236 33.559 39.850 1.00 48.72 C ATOM 517 SD MET A 76 20.189 32.851 41.538 1.00 44.94 S ATOM 518 CE MET A 76 20.356 31.133 41.150 1.00 51.28 C ATOM 0 H MET A 76 17.270 32.918 37.286 1.00 48.50 H new ATOM 0 HA MET A 76 18.982 34.771 37.839 1.00 48.41 H new ATOM 0 HB2 MET A 76 18.273 33.059 39.371 1.00 48.00 H new ATOM 0 HB3 MET A 76 19.302 32.106 38.688 1.00 48.00 H new ATOM 0 HG2 MET A 76 21.100 33.365 39.454 1.00 48.72 H new ATOM 0 HG3 MET A 76 20.163 34.524 39.914 1.00 48.72 H new ATOM 0 HE1 MET A 76 20.615 30.645 41.947 1.00 51.28 H new ATOM 0 HE2 MET A 76 19.509 30.791 40.823 1.00 51.28 H new ATOM 0 HE3 MET A 76 21.035 31.020 40.467 1.00 51.28 H new ATOM 519 N ARG A 77 20.160 32.402 36.044 1.00 49.79 N ATOM 520 CA ARG A 77 21.237 31.937 35.212 1.00 50.19 C ATOM 521 C ARG A 77 21.442 32.915 34.045 1.00 50.28 C ATOM 522 O ARG A 77 22.585 33.279 33.717 1.00 50.54 O ATOM 523 CB ARG A 77 20.885 30.520 34.732 1.00 50.40 C ATOM 524 CG ARG A 77 21.899 29.864 33.815 1.00 51.77 C ATOM 525 CD ARG A 77 21.523 28.415 33.415 1.00 54.59 C ATOM 526 NE ARG A 77 22.492 27.924 32.417 1.00 58.08 N ATOM 527 CZ ARG A 77 22.236 27.085 31.401 1.00 60.56 C ATOM 528 NH1 ARG A 77 21.017 26.591 31.180 1.00 62.64 N ATOM 529 NH2 ARG A 77 23.220 26.734 30.577 1.00 61.28 N ATOM 0 H ARG A 77 19.480 31.875 36.052 1.00 49.79 H new ATOM 0 HA ARG A 77 22.074 31.899 35.701 1.00 50.19 H new ATOM 0 HB2 ARG A 77 20.764 29.954 35.510 1.00 50.40 H new ATOM 0 HB3 ARG A 77 20.032 30.555 34.271 1.00 50.40 H new ATOM 0 HG2 ARG A 77 21.993 30.400 33.012 1.00 51.77 H new ATOM 0 HG3 ARG A 77 22.764 29.857 34.254 1.00 51.77 H new ATOM 0 HD2 ARG A 77 21.527 27.840 34.196 1.00 54.59 H new ATOM 0 HD3 ARG A 77 20.625 28.391 33.050 1.00 54.59 H new ATOM 0 HE ARG A 77 23.302 28.203 32.494 1.00 58.08 H new ATOM 0 HH11 ARG A 77 20.365 26.808 31.697 1.00 62.64 H new ATOM 0 HH12 ARG A 77 20.883 26.055 30.521 1.00 62.64 H new ATOM 0 HH21 ARG A 77 24.013 27.044 30.697 1.00 61.28 H new ATOM 0 HH22 ARG A 77 23.063 26.197 29.924 1.00 61.28 H new ATOM 530 N ALA A 78 20.345 33.343 33.412 1.00 49.96 N ATOM 531 CA ALA A 78 20.436 34.310 32.301 1.00 50.20 C ATOM 532 C ALA A 78 20.945 35.657 32.822 1.00 50.09 C ATOM 533 O ALA A 78 21.708 36.316 32.137 1.00 50.23 O ATOM 534 CB ALA A 78 19.087 34.469 31.546 1.00 49.07 C ATOM 0 H ALA A 78 19.546 33.091 33.605 1.00 49.96 H new ATOM 0 HA ALA A 78 21.071 33.963 31.655 1.00 50.20 H new ATOM 0 HB1 ALA A 78 19.192 35.111 30.827 1.00 49.07 H new ATOM 0 HB2 ALA A 78 18.819 33.613 31.177 1.00 49.07 H new ATOM 0 HB3 ALA A 78 18.406 34.782 32.162 1.00 49.07 H new ATOM 535 N GLN A 79 20.520 36.066 34.022 1.00 50.37 N ATOM 536 CA GLN A 79 21.037 37.296 34.617 1.00 50.88 C ATOM 537 C GLN A 79 22.546 37.183 34.775 1.00 50.70 C ATOM 538 O GLN A 79 23.295 38.023 34.301 1.00 51.03 O ATOM 539 CB GLN A 79 20.370 37.616 35.964 1.00 51.39 C ATOM 540 CG GLN A 79 21.304 38.369 36.988 1.00 52.39 C ATOM 541 CD GLN A 79 20.602 39.463 37.754 1.00 53.03 C ATOM 542 OE1 GLN A 79 19.706 40.123 37.226 1.00 57.36 O ATOM 543 NE2 GLN A 79 21.004 39.668 39.001 1.00 56.28 N ATOM 0 H GLN A 79 19.940 35.649 34.500 1.00 50.37 H new ATOM 0 HA GLN A 79 20.825 38.032 34.021 1.00 50.88 H new ATOM 0 HB2 GLN A 79 19.582 38.158 35.802 1.00 51.39 H new ATOM 0 HB3 GLN A 79 20.067 36.788 36.368 1.00 51.39 H new ATOM 0 HG2 GLN A 79 21.667 37.726 37.617 1.00 52.39 H new ATOM 0 HG3 GLN A 79 22.055 38.751 36.508 1.00 52.39 H new ATOM 0 HE21 GLN A 79 21.633 39.186 39.335 1.00 56.28 H new ATOM 0 HE22 GLN A 79 20.635 40.283 39.476 1.00 56.28 H new ATOM 544 N LEU A 80 22.993 36.127 35.444 1.00 51.19 N ATOM 545 CA LEU A 80 24.420 35.947 35.688 1.00 51.13 C ATOM 546 C LEU A 80 25.217 35.917 34.372 1.00 50.72 C ATOM 547 O LEU A 80 26.294 36.470 34.315 1.00 49.49 O ATOM 548 CB LEU A 80 24.687 34.700 36.525 1.00 50.49 C ATOM 549 CG LEU A 80 24.324 34.870 37.993 1.00 50.70 C ATOM 550 CD1 LEU A 80 24.192 33.511 38.691 1.00 47.62 C ATOM 551 CD2 LEU A 80 25.357 35.769 38.674 1.00 50.73 C ATOM 0 H LEU A 80 22.491 35.506 35.764 1.00 51.19 H new ATOM 0 HA LEU A 80 24.726 36.714 36.197 1.00 51.13 H new ATOM 0 HB2 LEU A 80 24.182 33.958 36.158 1.00 50.49 H new ATOM 0 HB3 LEU A 80 25.626 34.467 36.456 1.00 50.49 H new ATOM 0 HG LEU A 80 23.457 35.300 38.060 1.00 50.70 H new ATOM 0 HD11 LEU A 80 23.961 33.647 39.623 1.00 47.62 H new ATOM 0 HD12 LEU A 80 23.497 32.991 38.258 1.00 47.62 H new ATOM 0 HD13 LEU A 80 25.035 33.034 38.634 1.00 47.62 H new ATOM 0 HD21 LEU A 80 25.125 35.877 39.610 1.00 50.73 H new ATOM 0 HD22 LEU A 80 26.235 35.364 38.604 1.00 50.73 H new ATOM 0 HD23 LEU A 80 25.366 36.637 38.241 1.00 50.73 H new ATOM 552 N ALA A 81 24.649 35.295 33.340 1.00 51.33 N ATOM 553 CA ALA A 81 25.296 35.136 32.043 1.00 51.96 C ATOM 554 C ALA A 81 25.250 36.437 31.223 1.00 52.55 C ATOM 555 O ALA A 81 26.086 36.649 30.352 1.00 51.19 O ATOM 556 CB ALA A 81 24.648 33.999 31.266 1.00 51.48 C ATOM 0 H ALA A 81 23.863 34.948 33.377 1.00 51.33 H new ATOM 0 HA ALA A 81 26.228 34.921 32.203 1.00 51.96 H new ATOM 0 HB1 ALA A 81 25.087 33.903 30.406 1.00 51.48 H new ATOM 0 HB2 ALA A 81 24.736 33.173 31.767 1.00 51.48 H new ATOM 0 HB3 ALA A 81 23.708 34.195 31.129 1.00 51.48 H new ATOM 557 N ALA A 82 24.280 37.305 31.519 1.00 53.74 N ATOM 558 CA ALA A 82 24.155 38.598 30.825 1.00 54.34 C ATOM 559 C ALA A 82 24.943 39.713 31.507 1.00 55.26 C ATOM 560 O ALA A 82 25.106 40.781 30.913 1.00 55.83 O ATOM 561 CB ALA A 82 22.697 39.007 30.705 1.00 54.29 C ATOM 0 H ALA A 82 23.681 37.167 32.120 1.00 53.74 H new ATOM 0 HA ALA A 82 24.533 38.470 29.941 1.00 54.34 H new ATOM 0 HB1 ALA A 82 22.637 39.859 30.246 1.00 54.29 H new ATOM 0 HB2 ALA A 82 22.212 38.334 30.202 1.00 54.29 H new ATOM 0 HB3 ALA A 82 22.310 39.089 31.591 1.00 54.29 H new ATOM 562 N GLN A 83 25.413 39.503 32.743 1.00 56.04 N ATOM 563 CA GLN A 83 26.269 40.519 33.388 1.00 56.50 C ATOM 564 C GLN A 83 27.584 40.657 32.616 1.00 56.44 C ATOM 565 O GLN A 83 28.206 39.654 32.248 1.00 56.47 O ATOM 566 CB GLN A 83 26.522 40.241 34.886 1.00 56.44 C ATOM 567 CG GLN A 83 25.395 40.818 35.773 1.00 58.18 C ATOM 568 CD GLN A 83 25.693 40.843 37.280 1.00 58.39 C ATOM 569 OE1 GLN A 83 24.809 40.560 38.094 1.00 63.55 O ATOM 570 NE2 GLN A 83 26.924 41.198 37.652 1.00 60.67 N ATOM 0 H GLN A 83 25.256 38.802 33.216 1.00 56.04 H new ATOM 0 HA GLN A 83 25.789 41.361 33.357 1.00 56.50 H new ATOM 0 HB2 GLN A 83 26.590 39.284 35.031 1.00 56.44 H new ATOM 0 HB3 GLN A 83 27.371 40.629 35.148 1.00 56.44 H new ATOM 0 HG2 GLN A 83 25.205 41.723 35.481 1.00 58.18 H new ATOM 0 HG3 GLN A 83 24.590 40.298 35.626 1.00 58.18 H new ATOM 0 HE21 GLN A 83 27.515 41.388 37.057 1.00 60.67 H new ATOM 0 HE22 GLN A 83 27.127 41.236 38.487 1.00 60.67 H new ATOM 571 N PRO A 84 27.981 41.904 32.311 1.00 56.82 N ATOM 572 CA PRO A 84 29.275 42.124 31.656 1.00 56.48 C ATOM 573 C PRO A 84 30.436 41.467 32.414 1.00 56.17 C ATOM 574 O PRO A 84 30.429 41.428 33.653 1.00 55.97 O ATOM 575 CB PRO A 84 29.397 43.653 31.630 1.00 56.48 C ATOM 576 CG PRO A 84 27.980 44.149 31.633 1.00 56.26 C ATOM 577 CD PRO A 84 27.231 43.167 32.489 1.00 57.05 C ATOM 0 HA PRO A 84 29.319 41.724 30.773 1.00 56.48 H new ATOM 0 HB2 PRO A 84 29.887 43.981 32.401 1.00 56.48 H new ATOM 0 HB3 PRO A 84 29.874 43.955 30.841 1.00 56.48 H new ATOM 0 HG2 PRO A 84 27.922 45.047 31.995 1.00 56.26 H new ATOM 0 HG3 PRO A 84 27.617 44.181 30.734 1.00 56.26 H new ATOM 0 HD2 PRO A 84 27.215 43.444 33.418 1.00 57.05 H new ATOM 0 HD3 PRO A 84 26.308 43.077 32.204 1.00 57.05 H new ATOM 578 N ASP A 85 31.399 40.941 31.654 1.00 55.97 N ATOM 579 CA ASP A 85 32.525 40.162 32.191 1.00 56.44 C ATOM 580 C ASP A 85 33.664 41.029 32.733 1.00 56.04 C ATOM 581 O ASP A 85 34.621 40.527 33.320 1.00 55.89 O ATOM 582 CB ASP A 85 33.056 39.120 31.175 1.00 56.92 C ATOM 583 CG ASP A 85 33.496 39.733 29.846 1.00 59.48 C ATOM 584 OD1 ASP A 85 34.341 40.668 29.878 1.00 63.49 O ATOM 585 OD2 ASP A 85 33.010 39.299 28.770 1.00 61.95 O ATOM 0 H ASP A 85 31.419 41.027 30.799 1.00 55.97 H new ATOM 0 HA ASP A 85 32.160 39.680 32.949 1.00 56.44 H new ATOM 0 HB2 ASP A 85 33.806 38.648 31.569 1.00 56.92 H new ATOM 0 HB3 ASP A 85 32.364 38.462 31.006 1.00 56.92 H new ATOM 586 N ASP A 86 33.531 42.337 32.562 1.00 55.83 N ATOM 587 CA ASP A 86 34.433 43.295 33.183 1.00 55.75 C ATOM 588 C ASP A 86 34.029 43.605 34.645 1.00 55.26 C ATOM 589 O ASP A 86 34.476 44.585 35.208 1.00 55.86 O ATOM 590 CB ASP A 86 34.551 44.583 32.313 1.00 55.65 C ATOM 591 CG ASP A 86 33.210 45.354 32.149 1.00 56.56 C ATOM 592 OD1 ASP A 86 32.166 44.945 32.709 1.00 58.30 O ATOM 593 OD2 ASP A 86 33.172 46.365 31.439 1.00 60.65 O ATOM 0 H ASP A 86 32.914 42.695 32.082 1.00 55.83 H new ATOM 0 HA ASP A 86 35.314 42.892 33.227 1.00 55.75 H new ATOM 0 HB2 ASP A 86 35.208 45.174 32.713 1.00 55.65 H new ATOM 0 HB3 ASP A 86 34.885 44.341 31.435 1.00 55.65 H new ATOM 594 N ILE A 87 33.198 42.766 35.253 1.00 54.78 N ATOM 595 CA ILE A 87 32.643 43.020 36.584 1.00 54.48 C ATOM 596 C ILE A 87 33.132 41.915 37.538 1.00 54.21 C ATOM 597 O ILE A 87 33.128 40.749 37.172 1.00 54.32 O ATOM 598 CB ILE A 87 31.083 43.029 36.524 1.00 54.70 C ATOM 599 CG1 ILE A 87 30.589 44.245 35.716 1.00 54.32 C ATOM 600 CG2 ILE A 87 30.458 42.962 37.929 1.00 54.06 C ATOM 601 CD1 ILE A 87 29.184 44.096 35.184 1.00 53.96 C ATOM 0 H ILE A 87 32.936 42.025 34.904 1.00 54.78 H new ATOM 0 HA ILE A 87 32.939 43.886 36.905 1.00 54.48 H new ATOM 0 HB ILE A 87 30.788 42.229 36.062 1.00 54.70 H new ATOM 0 HG12 ILE A 87 30.630 45.034 36.278 1.00 54.32 H new ATOM 0 HG13 ILE A 87 31.193 44.395 34.972 1.00 54.32 H new ATOM 0 HG21 ILE A 87 29.491 42.969 37.854 1.00 54.06 H new ATOM 0 HG22 ILE A 87 30.741 42.146 38.371 1.00 54.06 H new ATOM 0 HG23 ILE A 87 30.747 43.728 38.449 1.00 54.06 H new ATOM 0 HD11 ILE A 87 28.939 44.893 34.688 1.00 53.96 H new ATOM 0 HD12 ILE A 87 29.140 43.325 34.597 1.00 53.96 H new ATOM 0 HD13 ILE A 87 28.569 43.974 35.924 1.00 53.96 H new ATOM 602 N PRO A 88 33.554 42.275 38.755 1.00 53.43 N ATOM 603 CA PRO A 88 34.085 41.257 39.647 1.00 53.58 C ATOM 604 C PRO A 88 33.060 40.156 39.937 1.00 53.44 C ATOM 605 O PRO A 88 31.855 40.419 39.965 1.00 53.69 O ATOM 606 CB PRO A 88 34.389 42.035 40.938 1.00 53.51 C ATOM 607 CG PRO A 88 34.431 43.445 40.559 1.00 53.42 C ATOM 608 CD PRO A 88 33.525 43.600 39.386 1.00 53.70 C ATOM 0 HA PRO A 88 34.855 40.808 39.265 1.00 53.58 H new ATOM 0 HB2 PRO A 88 33.706 41.876 41.608 1.00 53.51 H new ATOM 0 HB3 PRO A 88 35.234 41.754 41.322 1.00 53.51 H new ATOM 0 HG2 PRO A 88 34.142 44.008 41.294 1.00 53.42 H new ATOM 0 HG3 PRO A 88 35.335 43.714 40.334 1.00 53.42 H new ATOM 0 HD2 PRO A 88 32.627 43.847 39.658 1.00 53.70 H new ATOM 0 HD3 PRO A 88 33.838 44.291 38.781 1.00 53.70 H new ATOM 609 N ILE A 89 33.545 38.942 40.174 1.00 53.14 N ATOM 610 CA ILE A 89 32.686 37.778 40.329 1.00 52.64 C ATOM 611 C ILE A 89 31.794 37.934 41.580 1.00 53.14 C ATOM 612 O ILE A 89 30.594 37.615 41.555 1.00 52.66 O ATOM 613 CB ILE A 89 33.515 36.474 40.389 1.00 52.18 C ATOM 614 CG1 ILE A 89 34.272 36.259 39.072 1.00 51.91 C ATOM 615 CG2 ILE A 89 32.602 35.279 40.673 1.00 52.17 C ATOM 616 CD1 ILE A 89 35.169 35.044 39.030 1.00 51.51 C ATOM 0 H ILE A 89 34.384 38.771 40.249 1.00 53.14 H new ATOM 0 HA ILE A 89 32.110 37.717 39.551 1.00 52.64 H new ATOM 0 HB ILE A 89 34.161 36.553 41.108 1.00 52.18 H new ATOM 0 HG12 ILE A 89 33.625 36.189 38.353 1.00 51.91 H new ATOM 0 HG13 ILE A 89 34.811 37.046 38.894 1.00 51.91 H new ATOM 0 HG21 ILE A 89 33.132 34.468 40.708 1.00 52.17 H new ATOM 0 HG22 ILE A 89 32.154 35.409 41.523 1.00 52.17 H new ATOM 0 HG23 ILE A 89 31.941 35.202 39.968 1.00 52.17 H new ATOM 0 HD11 ILE A 89 35.603 34.991 38.164 1.00 51.51 H new ATOM 0 HD12 ILE A 89 35.842 35.115 39.725 1.00 51.51 H new ATOM 0 HD13 ILE A 89 34.639 34.245 39.175 1.00 51.51 H new ATOM 617 N VAL A 90 32.384 38.446 42.658 1.00 53.11 N ATOM 618 CA VAL A 90 31.666 38.637 43.910 1.00 53.16 C ATOM 619 C VAL A 90 30.473 39.588 43.731 1.00 53.34 C ATOM 620 O VAL A 90 29.431 39.367 44.335 1.00 53.17 O ATOM 621 CB VAL A 90 32.596 39.169 45.017 1.00 53.20 C ATOM 622 CG1 VAL A 90 32.968 40.630 44.758 1.00 52.24 C ATOM 623 CG2 VAL A 90 31.943 38.983 46.390 1.00 53.23 C ATOM 0 H VAL A 90 33.208 38.691 42.682 1.00 53.11 H new ATOM 0 HA VAL A 90 31.332 37.767 44.179 1.00 53.16 H new ATOM 0 HB VAL A 90 33.420 38.658 45.008 1.00 53.20 H new ATOM 0 HG11 VAL A 90 33.553 40.945 45.465 1.00 52.24 H new ATOM 0 HG12 VAL A 90 33.425 40.702 43.905 1.00 52.24 H new ATOM 0 HG13 VAL A 90 32.163 41.171 44.740 1.00 52.24 H new ATOM 0 HG21 VAL A 90 32.536 39.321 47.079 1.00 53.23 H new ATOM 0 HG22 VAL A 90 31.105 39.470 46.418 1.00 53.23 H new ATOM 0 HG23 VAL A 90 31.774 38.040 46.543 1.00 53.23 H new ATOM 624 N ASP A 91 30.630 40.618 42.894 1.00 53.13 N ATOM 625 CA ASP A 91 29.559 41.566 42.638 1.00 53.59 C ATOM 626 C ASP A 91 28.448 40.896 41.842 1.00 53.81 C ATOM 627 O ASP A 91 27.264 41.124 42.085 1.00 54.04 O ATOM 628 CB ASP A 91 30.074 42.803 41.885 1.00 54.64 C ATOM 629 CG ASP A 91 30.950 43.717 42.752 1.00 55.24 C ATOM 630 OD1 ASP A 91 31.408 43.290 43.837 1.00 57.84 O ATOM 631 OD2 ASP A 91 31.183 44.871 42.337 1.00 57.05 O ATOM 0 H ASP A 91 31.357 40.780 42.465 1.00 53.13 H new ATOM 0 HA ASP A 91 29.209 41.860 43.493 1.00 53.59 H new ATOM 0 HB2 ASP A 91 30.584 42.515 41.112 1.00 54.64 H new ATOM 0 HB3 ASP A 91 29.317 43.310 41.553 1.00 54.64 H new ATOM 632 N GLY A 92 28.827 40.051 40.892 1.00 53.82 N ATOM 633 CA GLY A 92 27.852 39.208 40.214 1.00 53.31 C ATOM 634 C GLY A 92 27.052 38.397 41.204 1.00 53.13 C ATOM 635 O GLY A 92 25.828 38.354 41.139 1.00 53.25 O ATOM 0 H GLY A 92 29.639 39.950 40.626 1.00 53.82 H new ATOM 0 HA2 GLY A 92 27.254 39.760 39.686 1.00 53.31 H new ATOM 0 HA3 GLY A 92 28.307 38.613 39.598 1.00 53.31 H new ATOM 636 N LEU A 93 27.757 37.750 42.129 1.00 52.78 N ATOM 637 CA LEU A 93 27.144 36.885 43.113 1.00 52.44 C ATOM 638 C LEU A 93 26.194 37.666 44.036 1.00 52.09 C ATOM 639 O LEU A 93 25.075 37.249 44.270 1.00 51.37 O ATOM 640 CB LEU A 93 28.225 36.170 43.926 1.00 52.20 C ATOM 641 CG LEU A 93 29.081 35.158 43.160 1.00 52.15 C ATOM 642 CD1 LEU A 93 30.102 34.562 44.134 1.00 50.50 C ATOM 643 CD2 LEU A 93 28.242 34.070 42.474 1.00 50.97 C ATOM 0 H LEU A 93 28.612 37.806 42.198 1.00 52.78 H new ATOM 0 HA LEU A 93 26.612 36.223 42.645 1.00 52.44 H new ATOM 0 HB2 LEU A 93 28.813 36.840 44.309 1.00 52.20 H new ATOM 0 HB3 LEU A 93 27.798 35.711 44.666 1.00 52.20 H new ATOM 0 HG LEU A 93 29.540 35.615 42.438 1.00 52.15 H new ATOM 0 HD11 LEU A 93 30.656 33.917 43.668 1.00 50.50 H new ATOM 0 HD12 LEU A 93 30.661 35.270 44.490 1.00 50.50 H new ATOM 0 HD13 LEU A 93 29.636 34.121 44.862 1.00 50.50 H new ATOM 0 HD21 LEU A 93 28.829 33.457 42.004 1.00 50.97 H new ATOM 0 HD22 LEU A 93 27.734 33.583 43.142 1.00 50.97 H new ATOM 0 HD23 LEU A 93 27.632 34.482 41.842 1.00 50.97 H new ATOM 644 N THR A 94 26.639 38.816 44.515 1.00 52.20 N ATOM 645 CA THR A 94 25.808 39.701 45.313 1.00 53.07 C ATOM 646 C THR A 94 24.525 40.155 44.604 1.00 53.91 C ATOM 647 O THR A 94 23.437 40.082 45.196 1.00 53.55 O ATOM 648 CB THR A 94 26.618 40.919 45.747 1.00 52.63 C ATOM 649 OG1 THR A 94 27.813 40.462 46.384 1.00 52.67 O ATOM 650 CG2 THR A 94 25.829 41.785 46.712 1.00 52.27 C ATOM 0 H THR A 94 27.438 39.108 44.386 1.00 52.20 H new ATOM 0 HA THR A 94 25.525 39.186 46.085 1.00 53.07 H new ATOM 0 HB THR A 94 26.828 41.455 44.966 1.00 52.63 H new ATOM 0 HG1 THR A 94 28.379 40.252 45.800 1.00 52.67 H new ATOM 0 HG21 THR A 94 26.365 42.551 46.972 1.00 52.27 H new ATOM 0 HG22 THR A 94 25.016 42.091 46.281 1.00 52.27 H new ATOM 0 HG23 THR A 94 25.602 41.267 47.500 1.00 52.27 H new ATOM 651 N ALA A 95 24.650 40.609 43.350 1.00 54.88 N ATOM 652 CA ALA A 95 23.513 41.081 42.570 1.00 55.99 C ATOM 653 C ALA A 95 22.433 40.008 42.433 1.00 57.50 C ATOM 654 O ALA A 95 21.250 40.280 42.671 1.00 58.30 O ATOM 655 CB ALA A 95 23.972 41.537 41.194 1.00 55.93 C ATOM 0 H ALA A 95 25.401 40.649 42.933 1.00 54.88 H new ATOM 0 HA ALA A 95 23.125 41.832 43.045 1.00 55.99 H new ATOM 0 HB1 ALA A 95 23.208 41.849 40.684 1.00 55.93 H new ATOM 0 HB2 ALA A 95 24.613 42.259 41.289 1.00 55.93 H new ATOM 0 HB3 ALA A 95 24.389 40.795 40.729 1.00 55.93 H new ATOM 656 N ALA A 96 22.846 38.795 42.055 1.00 58.64 N ATOM 657 CA ALA A 96 21.952 37.638 41.960 1.00 59.17 C ATOM 658 C ALA A 96 21.289 37.271 43.305 1.00 60.38 C ATOM 659 O ALA A 96 20.084 37.004 43.390 1.00 61.25 O ATOM 660 CB ALA A 96 22.724 36.453 41.439 1.00 59.35 C ATOM 0 H ALA A 96 23.661 38.620 41.845 1.00 58.64 H new ATOM 0 HA ALA A 96 21.237 37.880 41.351 1.00 59.17 H new ATOM 0 HB1 ALA A 96 22.135 35.685 41.375 1.00 59.35 H new ATOM 0 HB2 ALA A 96 23.081 36.660 40.561 1.00 59.35 H new ATOM 0 HB3 ALA A 96 23.454 36.250 42.045 1.00 59.35 H new ATOM 661 N LEU A 97 22.083 37.224 44.358 1.00 60.80 N ATOM 662 CA LEU A 97 21.557 36.910 45.684 1.00 60.92 C ATOM 663 C LEU A 97 20.424 37.905 46.047 1.00 61.15 C ATOM 664 O LEU A 97 19.366 37.518 46.560 1.00 61.14 O ATOM 665 CB LEU A 97 22.687 36.998 46.725 1.00 60.95 C ATOM 666 CG LEU A 97 22.541 36.405 48.126 1.00 61.34 C ATOM 667 CD1 LEU A 97 21.920 35.002 48.026 1.00 60.53 C ATOM 668 CD2 LEU A 97 23.835 36.405 48.903 1.00 63.11 C ATOM 0 H LEU A 97 22.930 37.370 44.333 1.00 60.80 H new ATOM 0 HA LEU A 97 21.198 36.009 45.681 1.00 60.92 H new ATOM 0 HB2 LEU A 97 23.469 36.585 46.326 1.00 60.95 H new ATOM 0 HB3 LEU A 97 22.891 37.940 46.839 1.00 60.95 H new ATOM 0 HG LEU A 97 21.944 36.976 48.634 1.00 61.34 H new ATOM 0 HD11 LEU A 97 21.827 34.625 48.915 1.00 60.53 H new ATOM 0 HD12 LEU A 97 21.047 35.063 47.608 1.00 60.53 H new ATOM 0 HD13 LEU A 97 22.494 34.431 47.492 1.00 60.53 H new ATOM 0 HD21 LEU A 97 23.686 36.020 49.781 1.00 63.11 H new ATOM 0 HD22 LEU A 97 24.498 35.880 48.428 1.00 63.11 H new ATOM 0 HD23 LEU A 97 24.154 37.316 49.000 1.00 63.11 H new ATOM 669 N LEU A 98 20.659 39.178 45.755 1.00 61.35 N ATOM 670 CA LEU A 98 19.791 40.249 46.215 1.00 61.89 C ATOM 671 C LEU A 98 18.553 40.369 45.344 1.00 62.49 C ATOM 672 O LEU A 98 17.441 40.535 45.859 1.00 62.87 O ATOM 673 CB LEU A 98 20.554 41.579 46.257 1.00 61.69 C ATOM 674 CG LEU A 98 21.084 42.093 47.598 1.00 61.43 C ATOM 675 CD1 LEU A 98 21.335 41.004 48.634 1.00 61.76 C ATOM 676 CD2 LEU A 98 22.332 42.917 47.367 1.00 61.71 C ATOM 0 H LEU A 98 21.327 39.444 45.284 1.00 61.35 H new ATOM 0 HA LEU A 98 19.500 40.031 47.114 1.00 61.89 H new ATOM 0 HB2 LEU A 98 21.310 41.501 45.655 1.00 61.69 H new ATOM 0 HB3 LEU A 98 19.970 42.262 45.892 1.00 61.69 H new ATOM 0 HG LEU A 98 20.383 42.645 47.978 1.00 61.43 H new ATOM 0 HD11 LEU A 98 21.668 41.406 49.452 1.00 61.76 H new ATOM 0 HD12 LEU A 98 20.506 40.535 48.818 1.00 61.76 H new ATOM 0 HD13 LEU A 98 21.991 40.377 48.292 1.00 61.76 H new ATOM 0 HD21 LEU A 98 22.667 43.242 48.217 1.00 61.71 H new ATOM 0 HD22 LEU A 98 23.009 42.367 46.942 1.00 61.71 H new ATOM 0 HD23 LEU A 98 22.121 43.670 46.794 1.00 61.71 H new ATOM 677 N GLN A 99 18.752 40.279 44.031 1.00 62.73 N ATOM 678 CA GLN A 99 17.651 40.351 43.068 1.00 62.82 C ATOM 679 C GLN A 99 16.667 39.208 43.191 1.00 62.57 C ATOM 680 O GLN A 99 15.457 39.427 43.226 1.00 62.13 O ATOM 681 CB GLN A 99 18.193 40.357 41.644 1.00 62.54 C ATOM 682 CG GLN A 99 18.813 41.667 41.287 1.00 63.85 C ATOM 683 CD GLN A 99 18.770 41.964 39.799 1.00 64.09 C ATOM 684 OE1 GLN A 99 19.669 42.621 39.289 1.00 67.09 O ATOM 685 NE2 GLN A 99 17.720 41.498 39.099 1.00 64.38 N ATOM 0 H GLN A 99 19.527 40.175 43.672 1.00 62.73 H new ATOM 0 HA GLN A 99 17.180 41.175 43.269 1.00 62.82 H new ATOM 0 HB2 GLN A 99 18.851 39.651 41.546 1.00 62.54 H new ATOM 0 HB3 GLN A 99 17.473 40.161 41.024 1.00 62.54 H new ATOM 0 HG2 GLN A 99 18.355 42.376 41.766 1.00 63.85 H new ATOM 0 HG3 GLN A 99 19.736 41.673 41.585 1.00 63.85 H new ATOM 0 HE21 GLN A 99 17.109 41.040 39.494 1.00 64.38 H new ATOM 0 HE22 GLN A 99 17.660 41.658 38.256 1.00 64.38 H new ATOM 686 N PHE A 100 17.188 37.985 43.246 1.00 62.72 N ATOM 687 CA PHE A 100 16.334 36.814 43.179 1.00 62.97 C ATOM 688 C PHE A 100 15.753 36.394 44.504 1.00 63.86 C ATOM 689 O PHE A 100 15.046 35.404 44.587 1.00 64.37 O ATOM 690 CB PHE A 100 17.025 35.705 42.401 1.00 62.85 C ATOM 691 CG PHE A 100 17.114 36.045 40.948 1.00 62.79 C ATOM 692 CD1 PHE A 100 16.042 35.765 40.097 1.00 62.91 C ATOM 693 CD2 PHE A 100 18.194 36.774 40.459 1.00 62.51 C ATOM 694 CE1 PHE A 100 16.085 36.142 38.740 1.00 62.89 C ATOM 695 CE2 PHE A 100 18.247 37.164 39.106 1.00 62.44 C ATOM 696 CZ PHE A 100 17.191 36.848 38.251 1.00 62.36 C ATOM 0 H PHE A 100 18.028 37.817 43.322 1.00 62.72 H new ATOM 0 HA PHE A 100 15.539 37.057 42.678 1.00 62.97 H new ATOM 0 HB2 PHE A 100 17.915 35.561 42.758 1.00 62.85 H new ATOM 0 HB3 PHE A 100 16.537 34.874 42.513 1.00 62.85 H new ATOM 0 HD1 PHE A 100 15.293 35.326 40.429 1.00 62.91 H new ATOM 0 HD2 PHE A 100 18.889 37.006 41.032 1.00 62.51 H new ATOM 0 HE1 PHE A 100 15.382 35.923 38.172 1.00 62.89 H new ATOM 0 HE2 PHE A 100 18.984 37.631 38.784 1.00 62.44 H new ATOM 0 HZ PHE A 100 17.221 37.106 37.358 1.00 62.36 H new ATOM 697 N ASN A 101 16.006 37.196 45.524 1.00 64.21 N ATOM 698 CA ASN A 101 15.231 37.139 46.728 1.00 65.25 C ATOM 699 C ASN A 101 14.497 38.457 46.969 1.00 65.46 C ATOM 700 O ASN A 101 13.985 38.692 48.040 1.00 65.90 O ATOM 701 CB ASN A 101 16.156 36.758 47.875 1.00 64.80 C ATOM 702 CG ASN A 101 16.868 35.462 47.603 1.00 63.82 C ATOM 703 OD1 ASN A 101 18.016 35.442 47.162 1.00 63.20 O ATOM 704 ND2 ASN A 101 16.165 34.372 47.797 1.00 62.02 N ATOM 0 H ASN A 101 16.633 37.785 45.530 1.00 64.21 H new ATOM 0 HA ASN A 101 14.539 36.463 46.654 1.00 65.25 H new ATOM 0 HB2 ASN A 101 16.807 37.463 48.014 1.00 64.80 H new ATOM 0 HB3 ASN A 101 15.642 36.680 48.694 1.00 64.80 H new ATOM 0 HD21 ASN A 101 16.504 33.603 47.614 1.00 62.02 H new ATOM 0 HD22 ASN A 101 15.365 34.426 48.107 1.00 62.02 H new ATOM 705 N ALA A 102 14.413 39.286 45.938 1.00 66.29 N ATOM 706 CA ALA A 102 13.782 40.600 46.035 1.00 66.86 C ATOM 707 C ALA A 102 12.343 40.549 45.509 1.00 67.36 C ATOM 708 O ALA A 102 12.103 40.168 44.357 1.00 67.27 O ATOM 709 CB ALA A 102 14.600 41.666 45.268 1.00 66.37 C ATOM 0 H ALA A 102 14.722 39.103 45.156 1.00 66.29 H new ATOM 0 HA ALA A 102 13.759 40.852 46.971 1.00 66.86 H new ATOM 0 HB1 ALA A 102 14.163 42.528 45.347 1.00 66.37 H new ATOM 0 HB2 ALA A 102 15.493 41.721 45.644 1.00 66.37 H new ATOM 0 HB3 ALA A 102 14.658 41.418 44.332 1.00 66.37 H new ATOM 710 N PHE A 103 11.412 40.962 46.371 1.00 67.60 N ATOM 711 CA PHE A 103 9.983 41.026 46.075 1.00 67.72 C ATOM 712 C PHE A 103 9.485 42.472 46.252 1.00 68.00 C ATOM 713 O PHE A 103 10.040 43.231 47.062 1.00 67.97 O ATOM 714 CB PHE A 103 9.216 40.089 47.024 1.00 67.69 C ATOM 715 CG PHE A 103 9.679 40.162 48.458 1.00 67.82 C ATOM 716 CD1 PHE A 103 9.224 41.181 49.310 1.00 67.82 C ATOM 717 CD2 PHE A 103 10.590 39.230 48.955 1.00 67.63 C ATOM 718 CE1 PHE A 103 9.661 41.261 50.650 1.00 67.47 C ATOM 719 CE2 PHE A 103 11.029 39.295 50.285 1.00 67.92 C ATOM 720 CZ PHE A 103 10.564 40.318 51.137 1.00 67.35 C ATOM 0 H PHE A 103 11.603 41.220 47.169 1.00 67.60 H new ATOM 0 HA PHE A 103 9.830 40.745 45.159 1.00 67.72 H new ATOM 0 HB2 PHE A 103 8.272 40.307 46.986 1.00 67.69 H new ATOM 0 HB3 PHE A 103 9.309 39.176 46.709 1.00 67.69 H new ATOM 0 HD1 PHE A 103 8.625 41.814 48.986 1.00 67.82 H new ATOM 0 HD2 PHE A 103 10.910 38.558 48.398 1.00 67.63 H new ATOM 0 HE1 PHE A 103 9.348 41.939 51.204 1.00 67.47 H new ATOM 0 HE2 PHE A 103 11.629 38.661 50.606 1.00 67.92 H new ATOM 0 HZ PHE A 103 10.858 40.363 52.018 1.00 67.35 H new ATOM 721 N PRO A 104 8.444 42.868 45.491 1.00 68.28 N ATOM 722 CA PRO A 104 7.703 44.085 45.856 1.00 68.35 C ATOM 723 C PRO A 104 7.075 43.982 47.254 1.00 68.37 C ATOM 724 O PRO A 104 6.795 42.875 47.719 1.00 68.36 O ATOM 725 CB PRO A 104 6.602 44.165 44.788 1.00 68.53 C ATOM 726 CG PRO A 104 7.079 43.322 43.654 1.00 68.45 C ATOM 727 CD PRO A 104 7.923 42.248 44.258 1.00 68.22 C ATOM 0 HA PRO A 104 8.279 44.865 45.887 1.00 68.35 H new ATOM 0 HB2 PRO A 104 5.757 43.838 45.134 1.00 68.53 H new ATOM 0 HB3 PRO A 104 6.457 45.081 44.504 1.00 68.53 H new ATOM 0 HG2 PRO A 104 6.331 42.942 43.167 1.00 68.45 H new ATOM 0 HG3 PRO A 104 7.591 43.850 43.021 1.00 68.45 H new ATOM 0 HD2 PRO A 104 7.403 41.452 44.451 1.00 68.22 H new ATOM 0 HD3 PRO A 104 8.640 41.981 43.662 1.00 68.22 H new ATOM 728 N ALA A 105 6.854 45.122 47.911 1.00 68.62 N ATOM 729 CA ALA A 105 6.176 45.163 49.221 1.00 68.63 C ATOM 730 C ALA A 105 4.882 44.347 49.161 1.00 68.75 C ATOM 731 O ALA A 105 4.531 43.638 50.113 1.00 68.66 O ATOM 732 CB ALA A 105 5.886 46.608 49.640 1.00 68.44 C ATOM 0 H ALA A 105 7.090 45.894 47.615 1.00 68.62 H new ATOM 0 HA ALA A 105 6.763 44.773 49.888 1.00 68.63 H new ATOM 0 HB1 ALA A 105 5.441 46.612 50.502 1.00 68.44 H new ATOM 0 HB2 ALA A 105 6.720 47.100 49.705 1.00 68.44 H new ATOM 0 HB3 ALA A 105 5.314 47.028 48.979 1.00 68.44 H new ATOM 733 N SER A 106 4.205 44.464 48.016 1.00 68.77 N ATOM 734 CA SER A 106 3.021 43.682 47.653 1.00 68.78 C ATOM 735 C SER A 106 3.162 42.170 47.880 1.00 69.05 C ATOM 736 O SER A 106 2.228 41.526 48.368 1.00 69.28 O ATOM 737 CB SER A 106 2.695 43.949 46.171 1.00 68.83 C ATOM 738 OG SER A 106 1.688 43.083 45.677 1.00 68.76 O ATOM 0 H SER A 106 4.433 45.025 47.405 1.00 68.77 H new ATOM 0 HA SER A 106 2.306 43.970 48.241 1.00 68.78 H new ATOM 0 HB2 SER A 106 2.407 44.869 46.066 1.00 68.83 H new ATOM 0 HB3 SER A 106 3.500 43.841 45.641 1.00 68.83 H new ATOM 0 HG SER A 106 1.538 43.260 44.870 1.00 68.76 H new ATOM 739 N GLU A 107 4.322 41.611 47.529 1.00 68.93 N ATOM 740 CA GLU A 107 4.530 40.163 47.538 1.00 68.58 C ATOM 741 C GLU A 107 5.155 39.607 48.822 1.00 68.20 C ATOM 742 O GLU A 107 5.370 38.398 48.910 1.00 67.87 O ATOM 743 CB GLU A 107 5.400 39.763 46.342 1.00 69.04 C ATOM 744 CG GLU A 107 4.710 39.915 44.983 1.00 70.65 C ATOM 745 CD GLU A 107 3.589 38.900 44.758 1.00 72.38 C ATOM 746 OE1 GLU A 107 3.711 37.721 45.188 1.00 73.47 O ATOM 747 OE2 GLU A 107 2.578 39.296 44.146 1.00 72.33 O ATOM 0 H GLU A 107 5.010 42.062 47.279 1.00 68.93 H new ATOM 0 HA GLU A 107 3.643 39.774 47.484 1.00 68.58 H new ATOM 0 HB2 GLU A 107 6.206 40.303 46.346 1.00 69.04 H new ATOM 0 HB3 GLU A 107 5.677 38.840 46.451 1.00 69.04 H new ATOM 0 HG2 GLU A 107 4.346 40.811 44.910 1.00 70.65 H new ATOM 0 HG3 GLU A 107 5.371 39.819 44.279 1.00 70.65 H new ATOM 748 N GLU A 108 5.435 40.462 49.812 1.00 67.76 N ATOM 749 CA GLU A 108 6.132 40.015 51.028 1.00 67.20 C ATOM 750 C GLU A 108 5.353 38.959 51.808 1.00 66.21 C ATOM 751 O GLU A 108 5.906 37.916 52.129 1.00 65.66 O ATOM 752 CB GLU A 108 6.501 41.176 51.976 1.00 67.30 C ATOM 753 CG GLU A 108 7.421 40.694 53.145 1.00 68.20 C ATOM 754 CD GLU A 108 7.699 41.735 54.216 1.00 68.86 C ATOM 755 OE1 GLU A 108 7.835 42.940 53.872 1.00 70.00 O ATOM 756 OE2 GLU A 108 7.792 41.322 55.406 1.00 70.16 O ATOM 0 H GLU A 108 5.233 41.298 49.801 1.00 67.76 H new ATOM 0 HA GLU A 108 6.952 39.614 50.699 1.00 67.20 H new ATOM 0 HB2 GLU A 108 6.952 41.873 51.475 1.00 67.30 H new ATOM 0 HB3 GLU A 108 5.692 41.567 52.340 1.00 67.30 H new ATOM 0 HG2 GLU A 108 7.011 39.921 53.563 1.00 68.20 H new ATOM 0 HG3 GLU A 108 8.267 40.399 52.772 1.00 68.20 H new ATOM 757 N ILE A 109 4.091 39.242 52.125 1.00 65.62 N ATOM 758 CA ILE A 109 3.254 38.304 52.891 1.00 65.23 C ATOM 759 C ILE A 109 3.254 36.916 52.212 1.00 64.04 C ATOM 760 O ILE A 109 3.557 35.915 52.850 1.00 63.58 O ATOM 761 CB ILE A 109 1.792 38.869 53.145 1.00 65.44 C ATOM 762 CG1 ILE A 109 1.814 40.034 54.153 1.00 65.99 C ATOM 763 CG2 ILE A 109 0.848 37.791 53.670 1.00 65.49 C ATOM 764 CD1 ILE A 109 2.137 39.615 55.625 1.00 66.24 C ATOM 0 H ILE A 109 3.695 39.974 51.907 1.00 65.62 H new ATOM 0 HA ILE A 109 3.643 38.199 53.774 1.00 65.23 H new ATOM 0 HB ILE A 109 1.468 39.183 52.286 1.00 65.44 H new ATOM 0 HG12 ILE A 109 2.472 40.685 53.863 1.00 65.99 H new ATOM 0 HG13 ILE A 109 0.951 40.476 54.137 1.00 65.99 H new ATOM 0 HG21 ILE A 109 -0.032 38.173 53.813 1.00 65.49 H new ATOM 0 HG22 ILE A 109 0.787 37.071 53.023 1.00 65.49 H new ATOM 0 HG23 ILE A 109 1.189 37.443 54.509 1.00 65.49 H new ATOM 0 HD11 ILE A 109 2.132 40.401 56.194 1.00 66.24 H new ATOM 0 HD12 ILE A 109 1.468 38.986 55.937 1.00 66.24 H new ATOM 0 HD13 ILE A 109 3.012 39.198 55.658 1.00 66.24 H new ATOM 765 N ASN A 110 2.990 36.854 50.914 1.00 63.36 N ATOM 766 CA ASN A 110 3.043 35.562 50.218 1.00 62.81 C ATOM 767 C ASN A 110 4.436 34.885 50.195 1.00 61.64 C ATOM 768 O ASN A 110 4.529 33.663 50.266 1.00 61.00 O ATOM 769 CB ASN A 110 2.513 35.684 48.785 1.00 63.34 C ATOM 770 CG ASN A 110 1.039 36.103 48.724 1.00 64.95 C ATOM 771 OD1 ASN A 110 0.327 36.104 49.743 1.00 68.06 O ATOM 772 ND2 ASN A 110 0.580 36.473 47.520 1.00 63.43 N ATOM 0 H ASN A 110 2.782 37.528 50.422 1.00 63.36 H new ATOM 0 HA ASN A 110 2.470 34.983 50.745 1.00 62.81 H new ATOM 0 HB2 ASN A 110 3.049 36.333 48.302 1.00 63.34 H new ATOM 0 HB3 ASN A 110 2.621 34.833 48.332 1.00 63.34 H new ATOM 0 HD21 ASN A 110 -0.238 36.724 47.430 1.00 63.43 H new ATOM 0 HD22 ASN A 110 1.103 36.459 46.838 1.00 63.43 H new ATOM 773 N HIS A 111 5.508 35.659 50.065 1.00 60.44 N ATOM 774 CA HIS A 111 6.849 35.075 50.022 1.00 60.02 C ATOM 775 C HIS A 111 7.309 34.558 51.410 1.00 59.55 C ATOM 776 O HIS A 111 7.979 33.519 51.547 1.00 58.65 O ATOM 777 CB HIS A 111 7.848 36.092 49.545 1.00 59.65 C ATOM 778 CG HIS A 111 9.217 35.532 49.420 1.00 60.49 C ATOM 779 ND1 HIS A 111 9.499 34.457 48.604 1.00 61.46 N ATOM 780 CD2 HIS A 111 10.375 35.849 50.042 1.00 61.06 C ATOM 781 CE1 HIS A 111 10.782 34.164 48.696 1.00 61.24 C ATOM 782 NE2 HIS A 111 11.336 34.988 49.568 1.00 60.94 N ATOM 0 H HIS A 111 5.484 36.516 50.000 1.00 60.44 H new ATOM 0 HA HIS A 111 6.804 34.325 49.409 1.00 60.02 H new ATOM 0 HB2 HIS A 111 7.565 36.440 48.685 1.00 59.65 H new ATOM 0 HB3 HIS A 111 7.863 36.840 50.163 1.00 59.65 H new ATOM 0 HD1 HIS A 111 8.928 34.043 48.112 1.00 61.46 H new ATOM 0 HD2 HIS A 111 10.498 36.522 50.672 1.00 61.06 H new ATOM 0 HE1 HIS A 111 11.222 33.492 48.227 1.00 61.24 H new ATOM 783 N ARG A 112 6.952 35.319 52.424 1.00 58.81 N ATOM 784 CA ARG A 112 7.141 34.921 53.790 1.00 59.10 C ATOM 785 C ARG A 112 6.348 33.653 54.122 1.00 58.70 C ATOM 786 O ARG A 112 6.869 32.762 54.782 1.00 58.55 O ATOM 787 CB ARG A 112 6.734 36.083 54.693 1.00 59.04 C ATOM 788 CG ARG A 112 6.966 35.836 56.115 1.00 58.69 C ATOM 789 CD ARG A 112 6.885 37.116 56.939 1.00 59.46 C ATOM 790 NE ARG A 112 7.567 36.801 58.181 1.00 61.38 N ATOM 791 CZ ARG A 112 8.775 37.219 58.544 1.00 59.82 C ATOM 792 NH1 ARG A 112 9.469 38.099 57.830 1.00 57.44 N ATOM 793 NH2 ARG A 112 9.247 36.786 59.701 1.00 62.66 N ATOM 0 H ARG A 112 6.588 36.093 52.332 1.00 58.81 H new ATOM 0 HA ARG A 112 8.075 34.706 53.937 1.00 59.10 H new ATOM 0 HB2 ARG A 112 7.226 36.876 54.427 1.00 59.04 H new ATOM 0 HB3 ARG A 112 5.793 36.274 54.556 1.00 59.04 H new ATOM 0 HG2 ARG A 112 6.311 35.200 56.443 1.00 58.69 H new ATOM 0 HG3 ARG A 112 7.839 35.431 56.234 1.00 58.69 H new ATOM 0 HD2 ARG A 112 7.312 37.857 56.481 1.00 59.46 H new ATOM 0 HD3 ARG A 112 5.964 37.374 57.099 1.00 59.46 H new ATOM 0 HE ARG A 112 7.149 36.295 58.736 1.00 61.38 H new ATOM 0 HH11 ARG A 112 9.139 38.420 57.104 1.00 57.44 H new ATOM 0 HH12 ARG A 112 10.249 38.348 58.094 1.00 57.44 H new ATOM 0 HH21 ARG A 112 8.776 36.255 60.186 1.00 62.66 H new ATOM 0 HH22 ARG A 112 10.025 37.036 59.968 1.00 62.66 H new ATOM 794 N LYS A 113 5.108 33.560 53.646 1.00 58.55 N ATOM 795 CA LYS A 113 4.369 32.294 53.702 1.00 58.68 C ATOM 796 C LYS A 113 5.136 31.134 53.050 1.00 57.75 C ATOM 797 O LYS A 113 5.255 30.058 53.633 1.00 57.42 O ATOM 798 CB LYS A 113 2.994 32.434 53.039 1.00 59.10 C ATOM 799 CG LYS A 113 2.037 33.254 53.841 1.00 60.43 C ATOM 800 CD LYS A 113 0.668 33.389 53.175 1.00 60.49 C ATOM 801 CE LYS A 113 -0.281 34.140 54.137 1.00 61.99 C ATOM 802 NZ LYS A 113 -1.509 34.644 53.437 1.00 63.30 N ATOM 0 H LYS A 113 4.677 34.212 53.288 1.00 58.55 H new ATOM 0 HA LYS A 113 4.257 32.085 54.643 1.00 58.68 H new ATOM 0 HB2 LYS A 113 3.103 32.838 52.164 1.00 59.10 H new ATOM 0 HB3 LYS A 113 2.617 31.551 52.899 1.00 59.10 H new ATOM 0 HG2 LYS A 113 1.928 32.851 54.717 1.00 60.43 H new ATOM 0 HG3 LYS A 113 2.413 34.137 53.980 1.00 60.43 H new ATOM 0 HD2 LYS A 113 0.748 33.871 52.337 1.00 60.49 H new ATOM 0 HD3 LYS A 113 0.309 32.513 52.965 1.00 60.49 H new ATOM 0 HE2 LYS A 113 -0.542 33.548 54.860 1.00 61.99 H new ATOM 0 HE3 LYS A 113 0.191 34.887 54.538 1.00 61.99 H new ATOM 0 HZ1 LYS A 113 -1.994 35.131 54.002 1.00 63.30 H new ATOM 0 HZ2 LYS A 113 -1.270 35.147 52.743 1.00 63.30 H new ATOM 0 HZ3 LYS A 113 -1.992 33.954 53.151 1.00 63.30 H new ATOM 803 N ARG A 114 5.669 31.366 51.852 1.00 57.10 N ATOM 804 CA ARG A 114 6.396 30.331 51.105 1.00 56.46 C ATOM 805 C ARG A 114 7.587 29.818 51.909 1.00 55.73 C ATOM 806 O ARG A 114 7.764 28.617 52.078 1.00 54.64 O ATOM 807 CB ARG A 114 6.888 30.871 49.761 1.00 56.46 C ATOM 808 CG ARG A 114 7.570 29.825 48.874 1.00 56.78 C ATOM 809 CD ARG A 114 8.011 30.367 47.519 1.00 57.78 C ATOM 810 NE ARG A 114 6.920 31.105 46.882 1.00 59.97 N ATOM 811 CZ ARG A 114 6.084 30.636 45.947 1.00 60.88 C ATOM 812 NH1 ARG A 114 6.176 29.397 45.470 1.00 60.89 N ATOM 813 NH2 ARG A 114 5.136 31.433 45.470 1.00 60.86 N ATOM 0 H ARG A 114 5.622 32.124 51.448 1.00 57.10 H new ATOM 0 HA ARG A 114 5.780 29.599 50.946 1.00 56.46 H new ATOM 0 HB2 ARG A 114 6.134 31.246 49.279 1.00 56.46 H new ATOM 0 HB3 ARG A 114 7.510 31.597 49.924 1.00 56.46 H new ATOM 0 HG2 ARG A 114 8.344 29.472 49.340 1.00 56.78 H new ATOM 0 HG3 ARG A 114 6.960 29.083 48.734 1.00 56.78 H new ATOM 0 HD2 ARG A 114 8.779 30.948 47.632 1.00 57.78 H new ATOM 0 HD3 ARG A 114 8.291 29.635 46.947 1.00 57.78 H new ATOM 0 HE ARG A 114 6.804 31.920 47.133 1.00 59.97 H new ATOM 0 HH11 ARG A 114 6.788 28.868 45.762 1.00 60.89 H new ATOM 0 HH12 ARG A 114 5.624 29.125 44.869 1.00 60.89 H new ATOM 0 HH21 ARG A 114 5.065 32.239 45.762 1.00 60.86 H new ATOM 0 HH22 ARG A 114 4.593 31.144 44.869 1.00 60.86 H new ATOM 814 N MET A 115 8.408 30.745 52.392 1.00 55.47 N ATOM 815 CA MET A 115 9.680 30.393 53.006 1.00 55.04 C ATOM 816 C MET A 115 9.440 29.823 54.406 1.00 54.76 C ATOM 817 O MET A 115 10.189 28.975 54.861 1.00 55.03 O ATOM 818 CB MET A 115 10.647 31.582 52.970 1.00 54.59 C ATOM 819 CG MET A 115 11.022 32.042 51.497 1.00 56.74 C ATOM 820 SD MET A 115 11.555 30.676 50.437 1.00 51.31 S ATOM 821 CE MET A 115 12.151 31.421 48.929 1.00 59.66 C ATOM 0 H MET A 115 8.244 31.589 52.373 1.00 55.47 H new ATOM 0 HA MET A 115 10.115 29.692 52.496 1.00 55.04 H new ATOM 0 HB2 MET A 115 10.249 32.329 53.444 1.00 54.59 H new ATOM 0 HB3 MET A 115 11.459 31.345 53.445 1.00 54.59 H new ATOM 0 HG2 MET A 115 10.253 32.475 51.094 1.00 56.74 H new ATOM 0 HG3 MET A 115 11.730 32.704 51.542 1.00 56.74 H new ATOM 0 HE1 MET A 115 12.788 30.826 48.504 1.00 59.66 H new ATOM 0 HE2 MET A 115 11.405 31.578 48.329 1.00 59.66 H new ATOM 0 HE3 MET A 115 12.584 32.265 49.134 1.00 59.66 H new ATOM 822 N GLY A 116 8.354 30.241 55.044 1.00 54.35 N ATOM 823 CA GLY A 116 7.890 29.624 56.278 1.00 54.43 C ATOM 824 C GLY A 116 7.629 28.135 56.184 1.00 54.20 C ATOM 825 O GLY A 116 8.072 27.375 57.038 1.00 55.01 O ATOM 0 H GLY A 116 7.864 30.893 54.772 1.00 54.35 H new ATOM 0 HA2 GLY A 116 8.550 29.781 56.971 1.00 54.43 H new ATOM 0 HA3 GLY A 116 7.073 30.066 56.559 1.00 54.43 H new ATOM 826 N LEU A 117 6.879 27.724 55.171 1.00 53.81 N ATOM 827 CA LEU A 117 6.704 26.314 54.853 1.00 54.01 C ATOM 828 C LEU A 117 8.053 25.637 54.540 1.00 54.45 C ATOM 829 O LEU A 117 8.428 24.660 55.192 1.00 54.68 O ATOM 830 CB LEU A 117 5.754 26.142 53.664 1.00 53.29 C ATOM 831 CG LEU A 117 4.312 26.582 53.960 1.00 53.52 C ATOM 832 CD1 LEU A 117 3.457 26.644 52.712 1.00 47.98 C ATOM 833 CD2 LEU A 117 3.658 25.707 55.035 1.00 49.78 C ATOM 0 H LEU A 117 6.455 28.257 54.646 1.00 53.81 H new ATOM 0 HA LEU A 117 6.319 25.886 55.634 1.00 54.01 H new ATOM 0 HB2 LEU A 117 6.092 26.654 52.913 1.00 53.29 H new ATOM 0 HB3 LEU A 117 5.751 25.210 53.394 1.00 53.29 H new ATOM 0 HG LEU A 117 4.370 27.485 54.309 1.00 53.52 H new ATOM 0 HD11 LEU A 117 2.559 26.925 52.948 1.00 47.98 H new ATOM 0 HD12 LEU A 117 3.841 27.280 52.088 1.00 47.98 H new ATOM 0 HD13 LEU A 117 3.423 25.767 52.299 1.00 47.98 H new ATOM 0 HD21 LEU A 117 2.752 26.014 55.195 1.00 49.78 H new ATOM 0 HD22 LEU A 117 3.639 24.785 54.734 1.00 49.78 H new ATOM 0 HD23 LEU A 117 4.169 25.768 55.857 1.00 49.78 H new ATOM 834 N ILE A 118 8.792 26.171 53.566 1.00 54.22 N ATOM 835 CA ILE A 118 10.014 25.514 53.091 1.00 54.37 C ATOM 836 C ILE A 118 11.076 25.329 54.180 1.00 54.29 C ATOM 837 O ILE A 118 11.726 24.296 54.220 1.00 53.93 O ATOM 838 CB ILE A 118 10.625 26.256 51.881 1.00 54.45 C ATOM 839 CG1 ILE A 118 9.706 26.139 50.659 1.00 54.75 C ATOM 840 CG2 ILE A 118 12.030 25.753 51.576 1.00 54.01 C ATOM 841 CD1 ILE A 118 10.041 27.144 49.507 1.00 54.04 C ATOM 0 H ILE A 118 8.605 26.910 53.168 1.00 54.22 H new ATOM 0 HA ILE A 118 9.734 24.627 52.815 1.00 54.37 H new ATOM 0 HB ILE A 118 10.702 27.196 52.108 1.00 54.45 H new ATOM 0 HG12 ILE A 118 9.760 25.235 50.312 1.00 54.75 H new ATOM 0 HG13 ILE A 118 8.789 26.280 50.942 1.00 54.75 H new ATOM 0 HG21 ILE A 118 12.388 26.235 50.814 1.00 54.01 H new ATOM 0 HG22 ILE A 118 12.600 25.898 52.347 1.00 54.01 H new ATOM 0 HG23 ILE A 118 11.997 24.805 51.372 1.00 54.01 H new ATOM 0 HD11 ILE A 118 9.422 27.012 48.772 1.00 54.04 H new ATOM 0 HD12 ILE A 118 9.962 28.053 49.837 1.00 54.04 H new ATOM 0 HD13 ILE A 118 10.947 26.991 49.197 1.00 54.04 H new ATOM 842 N LEU A 119 11.259 26.321 55.042 1.00 55.07 N ATOM 843 CA LEU A 119 12.303 26.267 56.085 1.00 56.20 C ATOM 844 C LEU A 119 11.895 25.558 57.360 1.00 56.16 C ATOM 845 O LEU A 119 12.766 25.127 58.086 1.00 56.84 O ATOM 846 CB LEU A 119 12.830 27.667 56.462 1.00 56.84 C ATOM 847 CG LEU A 119 13.778 28.354 55.436 1.00 60.38 C ATOM 848 CD1 LEU A 119 13.877 29.848 55.731 1.00 62.76 C ATOM 849 CD2 LEU A 119 15.177 27.742 55.448 1.00 62.88 C ATOM 0 H LEU A 119 10.791 27.042 55.047 1.00 55.07 H new ATOM 0 HA LEU A 119 13.003 25.742 55.666 1.00 56.20 H new ATOM 0 HB2 LEU A 119 12.068 28.249 56.607 1.00 56.84 H new ATOM 0 HB3 LEU A 119 13.299 27.597 57.308 1.00 56.84 H new ATOM 0 HG LEU A 119 13.397 28.214 54.555 1.00 60.38 H new ATOM 0 HD11 LEU A 119 14.469 30.267 55.087 1.00 62.76 H new ATOM 0 HD12 LEU A 119 12.996 30.249 55.668 1.00 62.76 H new ATOM 0 HD13 LEU A 119 14.228 29.979 56.626 1.00 62.76 H new ATOM 0 HD21 LEU A 119 15.735 28.196 54.797 1.00 62.88 H new ATOM 0 HD22 LEU A 119 15.566 27.840 56.331 1.00 62.88 H new ATOM 0 HD23 LEU A 119 15.120 26.800 55.223 1.00 62.88 H new ATOM 850 N ARG A 120 10.598 25.402 57.623 1.00 56.57 N ATOM 851 CA ARG A 120 10.135 24.915 58.944 1.00 56.74 C ATOM 852 C ARG A 120 9.292 23.668 58.935 1.00 56.09 C ATOM 853 O ARG A 120 9.040 23.162 60.001 1.00 55.91 O ATOM 854 CB ARG A 120 9.314 25.990 59.648 1.00 58.17 C ATOM 855 CG ARG A 120 10.015 27.320 59.816 1.00 61.84 C ATOM 856 CD ARG A 120 10.776 27.345 61.087 1.00 66.79 C ATOM 857 NE ARG A 120 11.524 28.591 61.316 1.00 69.66 N ATOM 858 CZ ARG A 120 12.789 28.825 60.926 1.00 71.71 C ATOM 859 NH1 ARG A 120 13.473 27.903 60.254 1.00 72.30 N ATOM 860 NH2 ARG A 120 13.375 29.997 61.219 1.00 71.38 N ATOM 0 H ARG A 120 9.968 25.568 57.062 1.00 56.57 H new ATOM 0 HA ARG A 120 10.962 24.699 59.402 1.00 56.74 H new ATOM 0 HB2 ARG A 120 8.495 26.132 59.148 1.00 58.17 H new ATOM 0 HB3 ARG A 120 9.058 25.661 60.524 1.00 58.17 H new ATOM 0 HG2 ARG A 120 10.615 27.472 59.070 1.00 61.84 H new ATOM 0 HG3 ARG A 120 9.364 28.039 59.808 1.00 61.84 H new ATOM 0 HD2 ARG A 120 10.160 27.209 61.824 1.00 66.79 H new ATOM 0 HD3 ARG A 120 11.397 26.600 61.095 1.00 66.79 H new ATOM 0 HE ARG A 120 11.118 29.223 61.735 1.00 69.66 H new ATOM 0 HH11 ARG A 120 13.106 27.148 60.065 1.00 72.30 H new ATOM 0 HH12 ARG A 120 14.282 28.062 60.009 1.00 72.30 H new ATOM 0 HH21 ARG A 120 12.941 30.597 61.656 1.00 71.38 H new ATOM 0 HH22 ARG A 120 14.184 30.147 60.970 1.00 71.38 H new ATOM 861 N VAL A 121 8.767 23.212 57.786 1.00 55.44 N ATOM 862 CA VAL A 121 8.097 21.913 57.729 1.00 55.04 C ATOM 863 C VAL A 121 9.170 20.878 57.474 1.00 55.33 C ATOM 864 O VAL A 121 9.800 20.900 56.425 1.00 56.76 O ATOM 865 CB VAL A 121 7.018 21.831 56.624 1.00 55.48 C ATOM 866 CG1 VAL A 121 6.473 20.382 56.486 1.00 52.82 C ATOM 867 CG2 VAL A 121 5.894 22.847 56.887 1.00 54.40 C ATOM 0 H VAL A 121 8.790 23.638 57.039 1.00 55.44 H new ATOM 0 HA VAL A 121 7.631 21.763 58.566 1.00 55.04 H new ATOM 0 HB VAL A 121 7.427 22.064 55.776 1.00 55.48 H new ATOM 0 HG11 VAL A 121 5.799 20.355 55.789 1.00 52.82 H new ATOM 0 HG12 VAL A 121 7.200 19.783 56.256 1.00 52.82 H new ATOM 0 HG13 VAL A 121 6.079 20.103 57.327 1.00 52.82 H new ATOM 0 HG21 VAL A 121 5.228 22.781 56.185 1.00 54.40 H new ATOM 0 HG22 VAL A 121 5.480 22.658 57.744 1.00 54.40 H new ATOM 0 HG23 VAL A 121 6.264 23.744 56.898 1.00 54.40 H new ATOM 868 N PRO A 122 9.398 19.956 58.418 1.00 55.91 N ATOM 869 CA PRO A 122 10.517 19.036 58.212 1.00 55.88 C ATOM 870 C PRO A 122 10.534 18.253 56.885 1.00 55.66 C ATOM 871 O PRO A 122 11.606 18.136 56.290 1.00 56.15 O ATOM 872 CB PRO A 122 10.467 18.113 59.436 1.00 55.58 C ATOM 873 CG PRO A 122 9.761 18.920 60.481 1.00 57.26 C ATOM 874 CD PRO A 122 8.737 19.735 59.716 1.00 56.03 C ATOM 0 HA PRO A 122 11.341 19.541 58.131 1.00 55.88 H new ATOM 0 HB2 PRO A 122 9.989 17.292 59.241 1.00 55.58 H new ATOM 0 HB3 PRO A 122 11.358 17.861 59.726 1.00 55.58 H new ATOM 0 HG2 PRO A 122 9.335 18.348 61.139 1.00 57.26 H new ATOM 0 HG3 PRO A 122 10.380 19.493 60.961 1.00 57.26 H new ATOM 0 HD2 PRO A 122 7.899 19.257 59.616 1.00 56.03 H new ATOM 0 HD3 PRO A 122 8.535 20.571 60.164 1.00 56.03 H new ATOM 875 N ALA A 123 9.403 17.744 56.403 1.00 55.65 N ATOM 876 CA ALA A 123 9.398 17.038 55.100 1.00 55.71 C ATOM 877 C ALA A 123 9.778 17.955 53.908 1.00 56.09 C ATOM 878 O ALA A 123 10.313 17.496 52.913 1.00 56.50 O ATOM 879 CB ALA A 123 8.059 16.386 54.851 1.00 55.49 C ATOM 0 H ALA A 123 8.639 17.789 56.796 1.00 55.65 H new ATOM 0 HA ALA A 123 10.084 16.355 55.158 1.00 55.71 H new ATOM 0 HB1 ALA A 123 8.075 15.930 53.995 1.00 55.49 H new ATOM 0 HB2 ALA A 123 7.875 15.745 55.555 1.00 55.49 H new ATOM 0 HB3 ALA A 123 7.365 17.064 54.842 1.00 55.49 H new ATOM 880 N LEU A 124 9.518 19.251 54.014 1.00 56.33 N ATOM 881 CA LEU A 124 9.925 20.186 52.969 1.00 56.51 C ATOM 882 C LEU A 124 11.406 20.538 53.121 1.00 57.02 C ATOM 883 O LEU A 124 12.091 20.669 52.134 1.00 56.82 O ATOM 884 CB LEU A 124 9.058 21.461 52.957 1.00 56.34 C ATOM 885 CG LEU A 124 7.554 21.357 52.609 1.00 55.09 C ATOM 886 CD1 LEU A 124 6.840 22.722 52.778 1.00 50.64 C ATOM 887 CD2 LEU A 124 7.304 20.781 51.230 1.00 52.68 C ATOM 0 H LEU A 124 9.109 19.611 54.679 1.00 56.33 H new ATOM 0 HA LEU A 124 9.791 19.745 52.115 1.00 56.51 H new ATOM 0 HB2 LEU A 124 9.126 21.867 53.836 1.00 56.34 H new ATOM 0 HB3 LEU A 124 9.460 22.080 52.327 1.00 56.34 H new ATOM 0 HG LEU A 124 7.172 20.731 53.244 1.00 55.09 H new ATOM 0 HD11 LEU A 124 5.901 22.626 52.553 1.00 50.64 H new ATOM 0 HD12 LEU A 124 6.923 23.019 53.697 1.00 50.64 H new ATOM 0 HD13 LEU A 124 7.248 23.376 52.189 1.00 50.64 H new ATOM 0 HD21 LEU A 124 6.349 20.739 51.065 1.00 52.68 H new ATOM 0 HD22 LEU A 124 7.722 21.347 50.562 1.00 52.68 H new ATOM 0 HD23 LEU A 124 7.680 19.888 51.179 1.00 52.68 H new ATOM 888 N GLN A 125 11.906 20.648 54.357 1.00 57.85 N ATOM 889 CA GLN A 125 13.354 20.810 54.575 1.00 57.68 C ATOM 890 C GLN A 125 14.145 19.663 53.938 1.00 57.93 C ATOM 891 O GLN A 125 15.134 19.901 53.221 1.00 57.43 O ATOM 892 CB GLN A 125 13.691 20.906 56.039 1.00 57.49 C ATOM 893 CG GLN A 125 13.297 22.204 56.675 1.00 58.01 C ATOM 894 CD GLN A 125 13.529 22.164 58.163 1.00 58.57 C ATOM 895 OE1 GLN A 125 12.760 21.551 58.904 1.00 58.41 O ATOM 896 NE2 GLN A 125 14.614 22.779 58.609 1.00 59.42 N ATOM 0 H GLN A 125 11.433 20.632 55.075 1.00 57.85 H new ATOM 0 HA GLN A 125 13.608 21.642 54.147 1.00 57.68 H new ATOM 0 HB2 GLN A 125 13.252 20.180 56.510 1.00 57.49 H new ATOM 0 HB3 GLN A 125 14.646 20.780 56.150 1.00 57.49 H new ATOM 0 HG2 GLN A 125 13.808 22.929 56.283 1.00 58.01 H new ATOM 0 HG3 GLN A 125 12.362 22.387 56.494 1.00 58.01 H new ATOM 0 HE21 GLN A 125 15.127 23.197 58.060 1.00 59.42 H new ATOM 0 HE22 GLN A 125 14.805 22.760 59.447 1.00 59.42 H new ATOM 897 N ALA A 126 13.686 18.438 54.186 1.00 57.35 N ATOM 898 CA ALA A 126 14.283 17.249 53.584 1.00 57.49 C ATOM 899 C ALA A 126 14.218 17.318 52.056 1.00 57.45 C ATOM 900 O ALA A 126 15.228 17.195 51.396 1.00 57.10 O ATOM 901 CB ALA A 126 13.610 15.966 54.104 1.00 57.32 C ATOM 0 H ALA A 126 13.022 18.274 54.707 1.00 57.35 H new ATOM 0 HA ALA A 126 15.217 17.222 53.845 1.00 57.49 H new ATOM 0 HB1 ALA A 126 14.024 15.193 53.690 1.00 57.32 H new ATOM 0 HB2 ALA A 126 13.716 15.912 55.067 1.00 57.32 H new ATOM 0 HB3 ALA A 126 12.666 15.984 53.884 1.00 57.32 H new ATOM 902 N TYR A 127 13.037 17.566 51.508 1.00 57.80 N ATOM 903 CA TYR A 127 12.839 17.607 50.042 1.00 57.83 C ATOM 904 C TYR A 127 13.597 18.748 49.332 1.00 57.63 C ATOM 905 O TYR A 127 13.915 18.706 48.141 1.00 56.70 O ATOM 906 CB TYR A 127 11.337 17.720 49.762 1.00 58.41 C ATOM 907 CG TYR A 127 10.953 17.839 48.306 1.00 58.05 C ATOM 908 CD1 TYR A 127 10.636 16.719 47.563 1.00 58.62 C ATOM 909 CD2 TYR A 127 10.870 19.089 47.689 1.00 57.80 C ATOM 910 CE1 TYR A 127 10.262 16.833 46.207 1.00 59.25 C ATOM 911 CE2 TYR A 127 10.504 19.208 46.362 1.00 58.67 C ATOM 912 CZ TYR A 127 10.204 18.079 45.628 1.00 58.42 C ATOM 913 OH TYR A 127 9.845 18.209 44.307 1.00 60.62 O ATOM 0 H TYR A 127 12.323 17.716 51.963 1.00 57.80 H new ATOM 0 HA TYR A 127 13.210 16.787 49.679 1.00 57.83 H new ATOM 0 HB2 TYR A 127 10.895 16.941 50.134 1.00 58.41 H new ATOM 0 HB3 TYR A 127 10.993 18.494 50.235 1.00 58.41 H new ATOM 0 HD1 TYR A 127 10.669 15.879 47.961 1.00 58.62 H new ATOM 0 HD2 TYR A 127 11.064 19.855 48.180 1.00 57.80 H new ATOM 0 HE1 TYR A 127 10.057 16.074 45.710 1.00 59.25 H new ATOM 0 HE2 TYR A 127 10.460 20.048 45.964 1.00 58.67 H new ATOM 0 HH TYR A 127 9.852 19.021 44.093 1.00 60.62 H new ATOM 914 N SER A 128 13.907 19.793 50.058 1.00 57.37 N ATOM 915 CA SER A 128 14.410 20.947 49.372 1.00 56.99 C ATOM 916 C SER A 128 15.952 20.839 49.083 1.00 56.21 C ATOM 917 O SER A 128 16.523 21.700 48.435 1.00 54.15 O ATOM 918 CB SER A 128 14.006 22.185 50.162 1.00 56.46 C ATOM 919 OG SER A 128 15.017 22.442 51.096 1.00 61.16 O ATOM 0 H SER A 128 13.838 19.855 50.913 1.00 57.37 H new ATOM 0 HA SER A 128 14.014 21.013 48.489 1.00 56.99 H new ATOM 0 HB2 SER A 128 13.889 22.944 49.569 1.00 56.46 H new ATOM 0 HB3 SER A 128 13.158 22.041 50.610 1.00 56.46 H new ATOM 0 HG SER A 128 15.358 23.194 50.940 1.00 61.16 H new ATOM 920 N VAL A 129 16.613 19.776 49.564 1.00 56.37 N ATOM 921 CA VAL A 129 18.047 19.566 49.279 1.00 55.95 C ATOM 922 C VAL A 129 18.289 19.503 47.766 1.00 55.02 C ATOM 923 O VAL A 129 19.262 20.058 47.277 1.00 53.98 O ATOM 924 CB VAL A 129 18.678 18.308 50.032 1.00 57.09 C ATOM 925 CG1 VAL A 129 17.786 17.079 49.941 1.00 59.28 C ATOM 926 CG2 VAL A 129 20.072 17.937 49.471 1.00 56.44 C ATOM 0 H VAL A 129 16.254 19.167 50.054 1.00 56.37 H new ATOM 0 HA VAL A 129 18.515 20.335 49.640 1.00 55.95 H new ATOM 0 HB VAL A 129 18.762 18.577 50.960 1.00 57.09 H new ATOM 0 HG11 VAL A 129 18.204 16.340 50.410 1.00 59.28 H new ATOM 0 HG12 VAL A 129 16.926 17.272 50.346 1.00 59.28 H new ATOM 0 HG13 VAL A 129 17.658 16.840 49.010 1.00 59.28 H new ATOM 0 HG21 VAL A 129 20.421 17.171 49.952 1.00 56.44 H new ATOM 0 HG22 VAL A 129 19.994 17.719 48.529 1.00 56.44 H new ATOM 0 HG23 VAL A 129 20.675 18.689 49.579 1.00 56.44 H new ATOM 927 N VAL A 130 17.394 18.854 47.036 1.00 54.09 N ATOM 928 CA VAL A 130 17.503 18.789 45.578 1.00 53.73 C ATOM 929 C VAL A 130 17.219 20.157 44.902 1.00 53.36 C ATOM 930 O VAL A 130 17.879 20.515 43.965 1.00 51.88 O ATOM 931 CB VAL A 130 16.610 17.680 45.005 1.00 54.06 C ATOM 932 CG1 VAL A 130 16.676 17.653 43.475 1.00 50.90 C ATOM 933 CG2 VAL A 130 17.030 16.329 45.600 1.00 54.34 C ATOM 0 H VAL A 130 16.713 18.442 47.362 1.00 54.09 H new ATOM 0 HA VAL A 130 18.424 18.566 45.372 1.00 53.73 H new ATOM 0 HB VAL A 130 15.689 17.860 45.249 1.00 54.06 H new ATOM 0 HG11 VAL A 130 16.104 16.945 43.139 1.00 50.90 H new ATOM 0 HG12 VAL A 130 16.376 18.505 43.123 1.00 50.90 H new ATOM 0 HG13 VAL A 130 17.590 17.491 43.193 1.00 50.90 H new ATOM 0 HG21 VAL A 130 16.466 15.627 45.239 1.00 54.34 H new ATOM 0 HG22 VAL A 130 17.956 16.149 45.373 1.00 54.34 H new ATOM 0 HG23 VAL A 130 16.934 16.356 46.565 1.00 54.34 H new ATOM 934 N MET A 131 16.289 20.947 45.428 1.00 53.17 N ATOM 935 CA MET A 131 16.069 22.290 44.894 1.00 52.57 C ATOM 936 C MET A 131 17.299 23.181 45.123 1.00 52.08 C ATOM 937 O MET A 131 17.725 23.900 44.230 1.00 51.80 O ATOM 938 CB MET A 131 14.820 22.907 45.537 1.00 52.59 C ATOM 939 CG MET A 131 13.519 22.130 45.295 1.00 53.55 C ATOM 940 SD MET A 131 13.035 22.200 43.555 1.00 55.25 S ATOM 941 CE MET A 131 13.683 20.630 43.063 1.00 57.90 C ATOM 0 H MET A 131 15.780 20.730 46.086 1.00 53.17 H new ATOM 0 HA MET A 131 15.928 22.225 43.936 1.00 52.57 H new ATOM 0 HB2 MET A 131 14.966 22.978 46.493 1.00 52.59 H new ATOM 0 HB3 MET A 131 14.710 23.810 45.199 1.00 52.59 H new ATOM 0 HG2 MET A 131 13.636 21.206 45.565 1.00 53.55 H new ATOM 0 HG3 MET A 131 12.811 22.499 45.846 1.00 53.55 H new ATOM 0 HE1 MET A 131 14.263 20.746 42.294 1.00 57.90 H new ATOM 0 HE2 MET A 131 14.190 20.245 43.795 1.00 57.90 H new ATOM 0 HE3 MET A 131 12.952 20.037 42.829 1.00 57.90 H new ATOM 942 N TYR A 132 17.868 23.121 46.321 1.00 51.42 N ATOM 943 CA TYR A 132 19.061 23.905 46.659 1.00 51.59 C ATOM 944 C TYR A 132 20.272 23.493 45.858 1.00 50.24 C ATOM 945 O TYR A 132 21.104 24.313 45.542 1.00 48.49 O ATOM 946 CB TYR A 132 19.417 23.774 48.146 1.00 53.77 C ATOM 947 CG TYR A 132 18.365 24.288 49.137 1.00 53.67 C ATOM 948 CD1 TYR A 132 17.706 25.496 48.924 1.00 56.49 C ATOM 949 CD2 TYR A 132 18.063 23.574 50.279 1.00 57.30 C ATOM 950 CE1 TYR A 132 16.752 25.965 49.821 1.00 55.97 C ATOM 951 CE2 TYR A 132 17.097 24.043 51.201 1.00 56.41 C ATOM 952 CZ TYR A 132 16.452 25.240 50.948 1.00 56.48 C ATOM 953 OH TYR A 132 15.504 25.720 51.829 1.00 57.03 O ATOM 0 H TYR A 132 17.578 22.627 46.963 1.00 51.42 H new ATOM 0 HA TYR A 132 18.834 24.823 46.445 1.00 51.59 H new ATOM 0 HB2 TYR A 132 19.587 22.839 48.338 1.00 53.77 H new ATOM 0 HB3 TYR A 132 20.246 24.252 48.305 1.00 53.77 H new ATOM 0 HD1 TYR A 132 17.907 25.999 48.168 1.00 56.49 H new ATOM 0 HD2 TYR A 132 18.502 22.771 50.445 1.00 57.30 H new ATOM 0 HE1 TYR A 132 16.317 26.770 49.657 1.00 55.97 H new ATOM 0 HE2 TYR A 132 16.899 23.553 51.966 1.00 56.41 H new ATOM 0 HH TYR A 132 15.418 25.183 52.469 1.00 57.03 H new ATOM 954 N GLU A 133 20.382 22.213 45.554 1.00 49.77 N ATOM 955 CA GLU A 133 21.461 21.733 44.718 1.00 50.68 C ATOM 956 C GLU A 133 21.429 22.366 43.306 1.00 48.86 C ATOM 957 O GLU A 133 22.440 22.788 42.801 1.00 48.97 O ATOM 958 CB GLU A 133 21.417 20.208 44.615 1.00 50.50 C ATOM 959 CG GLU A 133 22.518 19.695 43.724 1.00 51.76 C ATOM 960 CD GLU A 133 22.521 18.208 43.546 1.00 54.57 C ATOM 961 OE1 GLU A 133 21.469 17.551 43.723 1.00 63.40 O ATOM 962 OE2 GLU A 133 23.592 17.688 43.190 1.00 61.89 O ATOM 0 H GLU A 133 19.839 21.603 45.824 1.00 49.77 H new ATOM 0 HA GLU A 133 22.293 22.001 45.138 1.00 50.68 H new ATOM 0 HB2 GLU A 133 21.504 19.818 45.499 1.00 50.50 H new ATOM 0 HB3 GLU A 133 20.557 19.929 44.265 1.00 50.50 H new ATOM 0 HG2 GLU A 133 22.438 20.115 42.853 1.00 51.76 H new ATOM 0 HG3 GLU A 133 23.373 19.968 44.093 1.00 51.76 H new ATOM 963 N GLY A 134 20.253 22.449 42.710 1.00 48.50 N ATOM 964 CA GLY A 134 20.076 23.109 41.416 1.00 49.03 C ATOM 965 C GLY A 134 20.400 24.578 41.490 1.00 48.64 C ATOM 966 O GLY A 134 20.995 25.117 40.605 1.00 49.50 O ATOM 0 H GLY A 134 19.528 22.125 43.041 1.00 48.50 H new ATOM 0 HA2 GLY A 134 20.646 22.685 40.756 1.00 49.03 H new ATOM 0 HA3 GLY A 134 19.161 22.994 41.117 1.00 49.03 H new ATOM 967 N TRP A 135 20.004 25.234 42.562 1.00 49.37 N ATOM 968 CA TRP A 135 20.380 26.622 42.802 1.00 48.83 C ATOM 969 C TRP A 135 21.922 26.768 42.887 1.00 48.63 C ATOM 970 O TRP A 135 22.516 27.601 42.206 1.00 46.94 O ATOM 971 CB TRP A 135 19.714 27.080 44.085 1.00 50.19 C ATOM 972 CG TRP A 135 19.809 28.530 44.367 1.00 51.06 C ATOM 973 CD1 TRP A 135 18.913 29.496 44.016 1.00 51.99 C ATOM 974 CD2 TRP A 135 20.851 29.188 45.098 1.00 50.61 C ATOM 975 NE1 TRP A 135 19.344 30.711 44.467 1.00 53.38 N ATOM 976 CE2 TRP A 135 20.523 30.546 45.149 1.00 52.26 C ATOM 977 CE3 TRP A 135 22.018 28.747 45.725 1.00 52.18 C ATOM 978 CZ2 TRP A 135 21.334 31.478 45.773 1.00 53.35 C ATOM 979 CZ3 TRP A 135 22.817 29.656 46.342 1.00 52.44 C ATOM 980 CH2 TRP A 135 22.479 31.013 46.369 1.00 52.98 C ATOM 0 H TRP A 135 19.508 24.891 43.176 1.00 49.37 H new ATOM 0 HA TRP A 135 20.083 27.178 42.065 1.00 48.83 H new ATOM 0 HB2 TRP A 135 18.777 26.833 44.051 1.00 50.19 H new ATOM 0 HB3 TRP A 135 20.108 26.595 44.827 1.00 50.19 H new ATOM 0 HD1 TRP A 135 18.127 29.350 43.541 1.00 51.99 H new ATOM 0 HE1 TRP A 135 18.941 31.460 44.343 1.00 53.38 H new ATOM 0 HE3 TRP A 135 22.245 27.845 45.720 1.00 52.18 H new ATOM 0 HZ2 TRP A 135 21.112 32.381 45.788 1.00 53.35 H new ATOM 0 HZ3 TRP A 135 23.601 29.372 46.753 1.00 52.44 H new ATOM 0 HH2 TRP A 135 23.043 31.613 46.801 1.00 52.98 H new ATOM 981 N ARG A 136 22.566 25.946 43.713 1.00 47.65 N ATOM 982 CA ARG A 136 24.017 25.996 43.826 1.00 47.37 C ATOM 983 C ARG A 136 24.709 25.739 42.496 1.00 46.81 C ATOM 984 O ARG A 136 25.747 26.327 42.244 1.00 46.44 O ATOM 985 CB ARG A 136 24.551 25.010 44.844 1.00 46.17 C ATOM 986 CG ARG A 136 24.194 25.360 46.246 1.00 47.86 C ATOM 987 CD ARG A 136 24.919 24.501 47.254 1.00 45.83 C ATOM 988 NE ARG A 136 24.358 23.159 47.304 1.00 46.44 N ATOM 989 CZ ARG A 136 24.849 22.085 46.708 1.00 44.29 C ATOM 990 NH1 ARG A 136 25.945 22.133 45.992 1.00 49.73 N ATOM 991 NH2 ARG A 136 24.239 20.936 46.851 1.00 45.71 N ATOM 0 H ARG A 136 22.184 25.358 44.211 1.00 47.65 H new ATOM 0 HA ARG A 136 24.216 26.898 44.121 1.00 47.37 H new ATOM 0 HB2 ARG A 136 24.207 24.126 44.640 1.00 46.17 H new ATOM 0 HB3 ARG A 136 25.517 24.964 44.765 1.00 46.17 H new ATOM 0 HG2 ARG A 136 24.405 26.293 46.408 1.00 47.86 H new ATOM 0 HG3 ARG A 136 23.237 25.260 46.368 1.00 47.86 H new ATOM 0 HD2 ARG A 136 25.860 24.452 47.024 1.00 45.83 H new ATOM 0 HD3 ARG A 136 24.863 24.911 48.131 1.00 45.83 H new ATOM 0 HE ARG A 136 23.639 23.054 47.765 1.00 46.44 H new ATOM 0 HH11 ARG A 136 26.366 22.877 45.899 1.00 49.73 H new ATOM 0 HH12 ARG A 136 26.244 21.420 45.615 1.00 49.73 H new ATOM 0 HH21 ARG A 136 23.526 20.884 47.329 1.00 45.71 H new ATOM 0 HH22 ARG A 136 24.551 20.233 46.467 1.00 45.71 H new ATOM 992 N ASN A 137 24.178 24.831 41.680 1.00 47.28 N ATOM 993 CA ASN A 137 24.804 24.521 40.381 1.00 47.60 C ATOM 994 C ASN A 137 24.833 25.740 39.463 1.00 47.55 C ATOM 995 O ASN A 137 25.742 25.879 38.634 1.00 46.98 O ATOM 996 CB ASN A 137 24.088 23.365 39.652 1.00 48.15 C ATOM 997 CG ASN A 137 24.339 21.988 40.300 1.00 51.28 C ATOM 998 OD1 ASN A 137 25.206 21.843 41.177 1.00 55.85 O ATOM 999 ND2 ASN A 137 23.558 20.981 39.883 1.00 49.27 N ATOM 0 H ASN A 137 23.463 24.384 41.851 1.00 47.28 H new ATOM 0 HA ASN A 137 25.713 24.250 40.583 1.00 47.60 H new ATOM 0 HB2 ASN A 137 23.134 23.540 39.639 1.00 48.15 H new ATOM 0 HB3 ASN A 137 24.384 23.340 38.729 1.00 48.15 H new ATOM 0 HD21 ASN A 137 23.647 20.197 40.226 1.00 49.27 H new ATOM 0 HD22 ASN A 137 22.968 21.119 39.273 1.00 49.27 H new ATOM 1000 N VAL A 138 23.821 26.609 39.577 1.00 47.46 N ATOM 1001 CA VAL A 138 23.779 27.836 38.766 1.00 47.43 C ATOM 1002 C VAL A 138 24.945 28.727 39.210 1.00 47.09 C ATOM 1003 O VAL A 138 25.717 29.194 38.393 1.00 44.68 O ATOM 1004 CB VAL A 138 22.414 28.543 38.862 1.00 47.50 C ATOM 1005 CG1 VAL A 138 22.472 29.916 38.212 1.00 47.46 C ATOM 1006 CG2 VAL A 138 21.337 27.680 38.179 1.00 48.22 C ATOM 0 H VAL A 138 23.155 26.509 40.112 1.00 47.46 H new ATOM 0 HA VAL A 138 23.880 27.621 37.826 1.00 47.43 H new ATOM 0 HB VAL A 138 22.188 28.660 39.798 1.00 47.50 H new ATOM 0 HG11 VAL A 138 21.605 30.345 38.283 1.00 47.46 H new ATOM 0 HG12 VAL A 138 23.138 30.459 38.662 1.00 47.46 H new ATOM 0 HG13 VAL A 138 22.710 29.822 37.276 1.00 47.46 H new ATOM 0 HG21 VAL A 138 20.478 28.126 38.240 1.00 48.22 H new ATOM 0 HG22 VAL A 138 21.569 27.552 37.246 1.00 48.22 H new ATOM 0 HG23 VAL A 138 21.285 26.818 38.620 1.00 48.22 H new ATOM 1007 N ILE A 139 25.130 28.858 40.525 1.00 46.71 N ATOM 1008 CA ILE A 139 26.262 29.612 41.045 1.00 47.54 C ATOM 1009 C ILE A 139 27.623 29.009 40.587 1.00 47.92 C ATOM 1010 O ILE A 139 28.450 29.737 40.029 1.00 48.26 O ATOM 1011 CB ILE A 139 26.200 29.797 42.574 1.00 48.00 C ATOM 1012 CG1 ILE A 139 24.875 30.469 43.015 1.00 48.37 C ATOM 1013 CG2 ILE A 139 27.409 30.572 43.056 1.00 47.11 C ATOM 1014 CD1 ILE A 139 24.524 31.801 42.289 1.00 49.66 C ATOM 0 H ILE A 139 24.615 28.520 41.125 1.00 46.71 H new ATOM 0 HA ILE A 139 26.198 30.500 40.660 1.00 47.54 H new ATOM 0 HB ILE A 139 26.218 28.920 42.988 1.00 48.00 H new ATOM 0 HG12 ILE A 139 24.149 29.841 42.873 1.00 48.37 H new ATOM 0 HG13 ILE A 139 24.920 30.641 43.969 1.00 48.37 H new ATOM 0 HG21 ILE A 139 27.360 30.683 44.018 1.00 47.11 H new ATOM 0 HG22 ILE A 139 28.217 30.086 42.827 1.00 47.11 H new ATOM 0 HG23 ILE A 139 27.425 31.444 42.631 1.00 47.11 H new ATOM 0 HD11 ILE A 139 23.683 32.144 42.630 1.00 49.66 H new ATOM 0 HD12 ILE A 139 25.226 32.451 42.448 1.00 49.66 H new ATOM 0 HD13 ILE A 139 24.444 31.639 41.336 1.00 49.66 H new ATOM 1015 N ALA A 140 27.840 27.701 40.782 1.00 48.16 N ATOM 1016 CA ALA A 140 29.079 27.024 40.315 1.00 48.30 C ATOM 1017 C ALA A 140 29.345 27.201 38.803 1.00 48.56 C ATOM 1018 O ALA A 140 30.501 27.392 38.380 1.00 48.12 O ATOM 1019 CB ALA A 140 29.080 25.523 40.683 1.00 46.85 C ATOM 0 H ALA A 140 27.285 27.181 41.183 1.00 48.16 H new ATOM 0 HA ALA A 140 29.805 27.465 40.783 1.00 48.30 H new ATOM 0 HB1 ALA A 140 29.899 25.112 40.365 1.00 46.85 H new ATOM 0 HB2 ALA A 140 29.023 25.426 41.646 1.00 46.85 H new ATOM 0 HB3 ALA A 140 28.319 25.088 40.269 1.00 46.85 H new ATOM 1020 N GLU A 141 28.291 27.082 37.993 1.00 49.45 N ATOM 1021 CA GLU A 141 28.400 27.275 36.539 1.00 49.89 C ATOM 1022 C GLU A 141 28.907 28.685 36.191 1.00 49.77 C ATOM 1023 O GLU A 141 29.776 28.857 35.372 1.00 49.60 O ATOM 1024 CB GLU A 141 27.039 27.032 35.871 1.00 49.92 C ATOM 1025 CG GLU A 141 26.993 27.426 34.365 1.00 51.51 C ATOM 1026 CD GLU A 141 25.595 27.301 33.749 1.00 52.83 C ATOM 1027 OE1 GLU A 141 24.594 27.476 34.513 1.00 54.32 O ATOM 1028 OE2 GLU A 141 25.529 27.047 32.505 1.00 55.81 O ATOM 0 H GLU A 141 27.498 26.889 38.265 1.00 49.45 H new ATOM 0 HA GLU A 141 29.046 26.633 36.204 1.00 49.89 H new ATOM 0 HB2 GLU A 141 26.810 26.093 35.957 1.00 49.92 H new ATOM 0 HB3 GLU A 141 26.361 27.535 36.348 1.00 49.92 H new ATOM 0 HG2 GLU A 141 27.303 28.340 34.267 1.00 51.51 H new ATOM 0 HG3 GLU A 141 27.609 26.863 33.871 1.00 51.51 H new ATOM 1029 N TYR A 142 28.348 29.699 36.837 1.00 50.52 N ATOM 1030 CA TYR A 142 28.766 31.086 36.612 1.00 50.25 C ATOM 1031 C TYR A 142 30.225 31.311 37.012 1.00 50.19 C ATOM 1032 O TYR A 142 30.995 31.927 36.258 1.00 50.04 O ATOM 1033 CB TYR A 142 27.842 32.047 37.402 1.00 50.58 C ATOM 1034 CG TYR A 142 28.379 33.456 37.536 1.00 50.42 C ATOM 1035 CD1 TYR A 142 28.448 34.305 36.433 1.00 49.54 C ATOM 1036 CD2 TYR A 142 28.833 33.931 38.768 1.00 50.33 C ATOM 1037 CE1 TYR A 142 28.953 35.594 36.551 1.00 49.99 C ATOM 1038 CE2 TYR A 142 29.352 35.228 38.895 1.00 50.20 C ATOM 1039 CZ TYR A 142 29.400 36.044 37.795 1.00 50.60 C ATOM 1040 OH TYR A 142 29.903 37.309 37.926 1.00 51.15 O ATOM 0 H TYR A 142 27.719 29.609 37.416 1.00 50.52 H new ATOM 0 HA TYR A 142 28.692 31.270 35.662 1.00 50.25 H new ATOM 0 HB2 TYR A 142 26.978 32.082 36.963 1.00 50.58 H new ATOM 0 HB3 TYR A 142 27.695 31.682 38.289 1.00 50.58 H new ATOM 0 HD1 TYR A 142 28.151 34.004 35.605 1.00 49.54 H new ATOM 0 HD2 TYR A 142 28.791 33.379 39.515 1.00 50.33 H new ATOM 0 HE1 TYR A 142 28.993 36.152 35.808 1.00 49.99 H new ATOM 0 HE2 TYR A 142 29.661 35.531 39.718 1.00 50.20 H new ATOM 0 HH TYR A 142 29.536 37.816 37.366 1.00 51.15 H new ATOM 1041 N VAL A 143 30.575 30.854 38.222 1.00 50.13 N ATOM 1042 CA VAL A 143 31.925 31.022 38.760 1.00 49.68 C ATOM 1043 C VAL A 143 32.918 30.277 37.873 1.00 49.60 C ATOM 1044 O VAL A 143 33.984 30.822 37.562 1.00 49.25 O ATOM 1045 CB VAL A 143 32.065 30.526 40.233 1.00 49.67 C ATOM 1046 CG1 VAL A 143 33.502 30.697 40.718 1.00 48.08 C ATOM 1047 CG2 VAL A 143 31.093 31.278 41.188 1.00 48.95 C ATOM 0 H VAL A 143 30.036 30.440 38.749 1.00 50.13 H new ATOM 0 HA VAL A 143 32.113 31.974 38.765 1.00 49.68 H new ATOM 0 HB VAL A 143 31.831 29.585 40.246 1.00 49.67 H new ATOM 0 HG11 VAL A 143 33.574 30.385 41.634 1.00 48.08 H new ATOM 0 HG12 VAL A 143 34.098 30.181 40.153 1.00 48.08 H new ATOM 0 HG13 VAL A 143 33.749 31.634 40.676 1.00 48.08 H new ATOM 0 HG21 VAL A 143 31.206 30.946 42.092 1.00 48.95 H new ATOM 0 HG22 VAL A 143 31.288 32.228 41.166 1.00 48.95 H new ATOM 0 HG23 VAL A 143 30.178 31.129 40.902 1.00 48.95 H new ATOM 1048 N ALA A 144 32.554 29.055 37.458 1.00 49.41 N ATOM 1049 CA ALA A 144 33.401 28.235 36.566 1.00 50.45 C ATOM 1050 C ALA A 144 33.715 28.927 35.243 1.00 50.55 C ATOM 1051 O ALA A 144 34.861 28.909 34.821 1.00 50.86 O ATOM 1052 CB ALA A 144 32.784 26.860 36.301 1.00 49.54 C ATOM 0 H ALA A 144 31.814 28.678 37.683 1.00 49.41 H new ATOM 0 HA ALA A 144 34.238 28.116 37.041 1.00 50.45 H new ATOM 0 HB1 ALA A 144 33.365 26.352 35.714 1.00 49.54 H new ATOM 0 HB2 ALA A 144 32.678 26.385 37.140 1.00 49.54 H new ATOM 0 HB3 ALA A 144 31.917 26.970 35.880 1.00 49.54 H new ATOM 1053 N SER A 145 32.714 29.533 34.598 1.00 51.47 N ATOM 1054 CA SER A 145 32.936 30.206 33.309 1.00 52.48 C ATOM 1055 C SER A 145 33.852 31.382 33.479 1.00 52.64 C ATOM 1056 O SER A 145 34.732 31.583 32.670 1.00 53.19 O ATOM 1057 CB SER A 145 31.639 30.726 32.685 1.00 53.20 C ATOM 1058 OG SER A 145 30.706 29.679 32.443 1.00 56.11 O ATOM 0 H SER A 145 31.904 29.567 34.885 1.00 51.47 H new ATOM 0 HA SER A 145 33.326 29.537 32.725 1.00 52.48 H new ATOM 0 HB2 SER A 145 31.239 31.385 33.274 1.00 53.20 H new ATOM 0 HB3 SER A 145 31.841 31.177 31.850 1.00 53.20 H new ATOM 0 HG SER A 145 30.406 29.396 33.175 1.00 56.11 H new ATOM 1059 N ARG A 146 33.636 32.157 34.539 1.00 52.89 N ATOM 1060 CA ARG A 146 34.417 33.366 34.784 1.00 52.75 C ATOM 1061 C ARG A 146 35.863 33.067 35.125 1.00 52.57 C ATOM 1062 O ARG A 146 36.761 33.829 34.762 1.00 53.08 O ATOM 1063 CB ARG A 146 33.770 34.196 35.898 1.00 53.05 C ATOM 1064 CG ARG A 146 32.480 34.863 35.448 1.00 54.45 C ATOM 1065 CD ARG A 146 32.753 35.895 34.359 1.00 56.12 C ATOM 1066 NE ARG A 146 33.871 36.719 34.794 1.00 57.86 N ATOM 1067 CZ ARG A 146 33.774 37.816 35.547 1.00 58.16 C ATOM 1068 NH1 ARG A 146 34.879 38.462 35.906 1.00 58.05 N ATOM 1069 NH2 ARG A 146 32.589 38.289 35.914 1.00 58.39 N ATOM 0 H ARG A 146 33.035 31.998 35.134 1.00 52.89 H new ATOM 0 HA ARG A 146 34.420 33.875 33.958 1.00 52.75 H new ATOM 0 HB2 ARG A 146 33.587 33.624 36.660 1.00 53.05 H new ATOM 0 HB3 ARG A 146 34.395 34.875 36.197 1.00 53.05 H new ATOM 0 HG2 ARG A 146 31.863 34.192 35.116 1.00 54.45 H new ATOM 0 HG3 ARG A 146 32.052 35.292 36.205 1.00 54.45 H new ATOM 0 HD2 ARG A 146 32.961 35.456 33.520 1.00 56.12 H new ATOM 0 HD3 ARG A 146 31.967 36.443 34.205 1.00 56.12 H new ATOM 0 HE ARG A 146 34.659 36.479 34.545 1.00 57.86 H new ATOM 0 HH11 ARG A 146 35.648 38.172 35.653 1.00 58.05 H new ATOM 0 HH12 ARG A 146 34.825 39.170 36.391 1.00 58.05 H new ATOM 0 HH21 ARG A 146 31.870 37.887 35.666 1.00 58.39 H new ATOM 0 HH22 ARG A 146 32.540 38.997 36.400 1.00 58.39 H new ATOM 1070 N LEU A 147 36.089 31.968 35.830 1.00 52.38 N ATOM 1071 CA LEU A 147 37.441 31.515 36.124 1.00 52.12 C ATOM 1072 C LEU A 147 38.007 30.672 34.973 1.00 52.05 C ATOM 1073 O LEU A 147 39.172 30.304 35.003 1.00 52.45 O ATOM 1074 CB LEU A 147 37.460 30.691 37.408 1.00 51.76 C ATOM 1075 CG LEU A 147 37.227 31.402 38.729 1.00 50.68 C ATOM 1076 CD1 LEU A 147 37.037 30.352 39.794 1.00 48.56 C ATOM 1077 CD2 LEU A 147 38.394 32.345 39.068 1.00 49.78 C ATOM 0 H LEU A 147 35.468 31.466 36.150 1.00 52.38 H new ATOM 0 HA LEU A 147 37.995 32.303 36.236 1.00 52.12 H new ATOM 0 HB2 LEU A 147 36.787 29.998 37.323 1.00 51.76 H new ATOM 0 HB3 LEU A 147 38.320 30.246 37.460 1.00 51.76 H new ATOM 0 HG LEU A 147 36.434 31.958 38.672 1.00 50.68 H new ATOM 0 HD11 LEU A 147 36.886 30.783 40.650 1.00 48.56 H new ATOM 0 HD12 LEU A 147 36.272 29.799 39.571 1.00 48.56 H new ATOM 0 HD13 LEU A 147 37.831 29.797 39.847 1.00 48.56 H new ATOM 0 HD21 LEU A 147 38.219 32.785 39.915 1.00 49.78 H new ATOM 0 HD22 LEU A 147 39.215 31.833 39.133 1.00 49.78 H new ATOM 0 HD23 LEU A 147 38.484 33.012 38.370 1.00 49.78 H new ATOM 1078 N GLY A 148 37.183 30.352 33.980 1.00 51.81 N ATOM 1079 CA GLY A 148 37.621 29.558 32.831 1.00 51.81 C ATOM 1080 C GLY A 148 37.858 28.120 33.223 1.00 51.84 C ATOM 1081 O GLY A 148 38.760 27.468 32.740 1.00 51.64 O ATOM 0 H GLY A 148 36.356 30.587 33.951 1.00 51.81 H new ATOM 0 HA2 GLY A 148 36.951 29.599 32.131 1.00 51.81 H new ATOM 0 HA3 GLY A 148 38.436 29.935 32.465 1.00 51.81 H new ATOM 1082 N THR A 149 37.024 27.619 34.123 1.00 52.42 N ATOM 1083 CA THR A 149 37.296 26.362 34.794 1.00 51.83 C ATOM 1084 C THR A 149 36.048 25.452 34.720 1.00 51.60 C ATOM 1085 O THR A 149 35.150 25.729 33.936 1.00 51.79 O ATOM 1086 CB THR A 149 37.828 26.728 36.200 1.00 52.30 C ATOM 1087 OG1 THR A 149 38.874 25.829 36.564 1.00 54.18 O ATOM 1088 CG2 THR A 149 36.737 26.819 37.252 1.00 49.36 C ATOM 0 H THR A 149 36.289 27.997 34.360 1.00 52.42 H new ATOM 0 HA THR A 149 37.982 25.820 34.374 1.00 51.83 H new ATOM 0 HB THR A 149 38.194 27.625 36.156 1.00 52.30 H new ATOM 0 HG1 THR A 149 38.544 25.086 36.776 1.00 54.18 H new ATOM 0 HG21 THR A 149 37.131 27.050 38.108 1.00 49.36 H new ATOM 0 HG22 THR A 149 36.097 27.501 36.996 1.00 49.36 H new ATOM 0 HG23 THR A 149 36.286 25.964 37.325 1.00 49.36 H new ATOM 1089 N SER A 150 35.980 24.361 35.484 1.00 51.31 N ATOM 1090 CA SER A 150 34.804 23.456 35.424 1.00 50.59 C ATOM 1091 C SER A 150 33.892 23.601 36.662 1.00 50.02 C ATOM 1092 O SER A 150 34.389 23.764 37.754 1.00 49.00 O ATOM 1093 CB SER A 150 35.248 21.988 35.222 1.00 50.78 C ATOM 1094 OG SER A 150 34.326 21.058 35.803 1.00 50.70 O ATOM 0 H SER A 150 36.590 24.121 36.040 1.00 51.31 H new ATOM 0 HA SER A 150 34.276 23.722 34.655 1.00 50.59 H new ATOM 0 HB2 SER A 150 35.334 21.806 34.273 1.00 50.78 H new ATOM 0 HB3 SER A 150 36.125 21.860 35.616 1.00 50.78 H new ATOM 0 HG SER A 150 34.599 20.274 35.673 1.00 50.70 H new ATOM 1095 N PRO A 151 32.556 23.534 36.468 1.00 49.70 N ATOM 1096 CA PRO A 151 31.579 23.707 37.520 1.00 49.94 C ATOM 1097 C PRO A 151 31.651 22.654 38.613 1.00 50.03 C ATOM 1098 O PRO A 151 31.226 22.907 39.742 1.00 50.43 O ATOM 1099 CB PRO A 151 30.236 23.619 36.788 1.00 50.33 C ATOM 1100 CG PRO A 151 30.518 22.971 35.509 1.00 50.25 C ATOM 1101 CD PRO A 151 31.912 23.275 35.161 1.00 50.20 C ATOM 0 HA PRO A 151 31.727 24.544 37.987 1.00 49.94 H new ATOM 0 HB2 PRO A 151 29.593 23.107 37.303 1.00 50.33 H new ATOM 0 HB3 PRO A 151 29.855 24.501 36.654 1.00 50.33 H new ATOM 0 HG2 PRO A 151 30.383 22.013 35.575 1.00 50.25 H new ATOM 0 HG3 PRO A 151 29.916 23.296 34.821 1.00 50.25 H new ATOM 0 HD2 PRO A 151 32.333 22.534 34.698 1.00 50.20 H new ATOM 0 HD3 PRO A 151 31.972 24.046 34.576 1.00 50.20 H new ATOM 1102 N THR A 152 32.202 21.488 38.295 1.00 49.60 N ATOM 1103 CA THR A 152 32.427 20.472 39.319 1.00 49.16 C ATOM 1104 C THR A 152 33.803 20.582 40.003 1.00 48.61 C ATOM 1105 O THR A 152 34.143 19.739 40.828 1.00 48.20 O ATOM 1106 CB THR A 152 32.235 19.066 38.729 1.00 48.99 C ATOM 1107 OG1 THR A 152 33.058 18.927 37.584 1.00 48.11 O ATOM 1108 CG2 THR A 152 30.785 18.869 38.338 1.00 49.23 C ATOM 0 H THR A 152 32.451 21.266 37.502 1.00 49.60 H new ATOM 0 HA THR A 152 31.765 20.631 40.010 1.00 49.16 H new ATOM 0 HB THR A 152 32.479 18.400 39.391 1.00 48.99 H new ATOM 0 HG1 THR A 152 32.958 18.159 37.258 1.00 48.11 H new ATOM 0 HG21 THR A 152 30.668 17.981 37.966 1.00 49.23 H new ATOM 0 HG22 THR A 152 30.222 18.968 39.122 1.00 49.23 H new ATOM 0 HG23 THR A 152 30.535 19.532 37.675 1.00 49.23 H new ATOM 1109 N ASP A 153 34.579 21.619 39.689 1.00 48.00 N ATOM 1110 CA ASP A 153 35.822 21.846 40.404 1.00 48.22 C ATOM 1111 C ASP A 153 35.551 22.382 41.817 1.00 48.56 C ATOM 1112 O ASP A 153 34.427 22.822 42.146 1.00 48.50 O ATOM 1113 CB ASP A 153 36.766 22.776 39.634 1.00 48.52 C ATOM 1114 CG ASP A 153 37.296 22.153 38.344 1.00 48.29 C ATOM 1115 OD1 ASP A 153 37.269 20.916 38.204 1.00 49.43 O ATOM 1116 OD2 ASP A 153 37.726 22.913 37.458 1.00 48.63 O ATOM 0 H ASP A 153 34.403 22.193 39.073 1.00 48.00 H new ATOM 0 HA ASP A 153 36.269 20.989 40.484 1.00 48.22 H new ATOM 0 HB2 ASP A 153 36.299 23.599 39.422 1.00 48.52 H new ATOM 0 HB3 ASP A 153 37.514 23.013 40.204 1.00 48.52 H new ATOM 1117 N HIS A 154 36.594 22.341 42.643 1.00 48.24 N ATOM 1118 CA HIS A 154 36.479 22.654 44.059 1.00 48.14 C ATOM 1119 C HIS A 154 36.036 24.099 44.320 1.00 47.80 C ATOM 1120 O HIS A 154 35.109 24.341 45.096 1.00 47.99 O ATOM 1121 CB HIS A 154 37.809 22.344 44.779 1.00 48.29 C ATOM 1122 CG HIS A 154 37.721 22.419 46.276 1.00 48.28 C ATOM 1123 ND1 HIS A 154 36.637 21.935 46.983 1.00 49.75 N ATOM 1124 CD2 HIS A 154 38.587 22.902 47.202 1.00 48.39 C ATOM 1125 CE1 HIS A 154 36.832 22.133 48.278 1.00 48.19 C ATOM 1126 NE2 HIS A 154 38.008 22.718 48.439 1.00 48.87 N ATOM 0 H HIS A 154 37.390 22.130 42.394 1.00 48.24 H new ATOM 0 HA HIS A 154 35.779 22.089 44.421 1.00 48.14 H new ATOM 0 HB2 HIS A 154 38.105 21.456 44.525 1.00 48.29 H new ATOM 0 HB3 HIS A 154 38.486 22.967 44.472 1.00 48.29 H new ATOM 0 HD2 HIS A 154 39.417 23.286 47.033 1.00 48.39 H new ATOM 0 HE1 HIS A 154 36.242 21.900 48.959 1.00 48.19 H new ATOM 0 HE2 HIS A 154 38.354 22.946 49.192 1.00 48.87 H new ATOM 1127 N VAL A 155 36.677 25.053 43.671 1.00 47.08 N ATOM 1128 CA VAL A 155 36.398 26.446 43.947 1.00 47.65 C ATOM 1129 C VAL A 155 34.943 26.815 43.602 1.00 48.00 C ATOM 1130 O VAL A 155 34.234 27.307 44.482 1.00 47.99 O ATOM 1131 CB VAL A 155 37.477 27.400 43.328 1.00 48.01 C ATOM 1132 CG1 VAL A 155 36.979 28.859 43.232 1.00 46.98 C ATOM 1133 CG2 VAL A 155 38.761 27.328 44.185 1.00 47.06 C ATOM 0 H VAL A 155 37.275 24.915 43.069 1.00 47.08 H new ATOM 0 HA VAL A 155 36.473 26.581 44.905 1.00 47.65 H new ATOM 0 HB VAL A 155 37.661 27.105 42.422 1.00 48.01 H new ATOM 0 HG11 VAL A 155 37.674 29.414 42.845 1.00 46.98 H new ATOM 0 HG12 VAL A 155 36.188 28.895 42.672 1.00 46.98 H new ATOM 0 HG13 VAL A 155 36.761 29.186 44.119 1.00 46.98 H new ATOM 0 HG21 VAL A 155 39.435 27.916 43.809 1.00 47.06 H new ATOM 0 HG22 VAL A 155 38.561 27.606 45.093 1.00 47.06 H new ATOM 0 HG23 VAL A 155 39.095 26.417 44.192 1.00 47.06 H new ATOM 1134 N PRO A 156 34.480 26.548 42.357 1.00 47.82 N ATOM 1135 CA PRO A 156 33.073 26.832 42.024 1.00 47.97 C ATOM 1136 C PRO A 156 32.034 26.137 42.936 1.00 48.33 C ATOM 1137 O PRO A 156 31.037 26.748 43.343 1.00 48.50 O ATOM 1138 CB PRO A 156 32.961 26.340 40.569 1.00 48.10 C ATOM 1139 CG PRO A 156 34.329 26.416 40.045 1.00 47.29 C ATOM 1140 CD PRO A 156 35.197 26.009 41.185 1.00 47.91 C ATOM 0 HA PRO A 156 32.867 27.771 42.150 1.00 47.97 H new ATOM 0 HB2 PRO A 156 32.618 25.434 40.529 1.00 48.10 H new ATOM 0 HB3 PRO A 156 32.355 26.896 40.055 1.00 48.10 H new ATOM 0 HG2 PRO A 156 34.448 25.826 39.284 1.00 47.29 H new ATOM 0 HG3 PRO A 156 34.541 27.313 39.744 1.00 47.29 H new ATOM 0 HD2 PRO A 156 35.295 25.045 41.236 1.00 47.91 H new ATOM 0 HD3 PRO A 156 36.089 26.381 41.108 1.00 47.91 H new ATOM 1141 N ARG A 157 32.283 24.877 43.266 1.00 48.38 N ATOM 1142 CA ARG A 157 31.424 24.127 44.161 1.00 48.12 C ATOM 1143 C ARG A 157 31.365 24.753 45.552 1.00 48.19 C ATOM 1144 O ARG A 157 30.269 24.828 46.153 1.00 48.19 O ATOM 1145 CB ARG A 157 31.927 22.693 44.242 1.00 47.82 C ATOM 1146 CG ARG A 157 31.048 21.734 44.988 1.00 48.69 C ATOM 1147 CD ARG A 157 31.842 20.460 45.364 1.00 49.49 C ATOM 1148 NE ARG A 157 32.303 19.699 44.197 1.00 51.76 N ATOM 1149 CZ ARG A 157 31.554 18.846 43.480 1.00 51.84 C ATOM 1150 NH1 ARG A 157 30.277 18.647 43.763 1.00 53.51 N ATOM 1151 NH2 ARG A 157 32.080 18.196 42.462 1.00 48.83 N ATOM 0 H ARG A 157 32.959 24.433 42.974 1.00 48.38 H new ATOM 0 HA ARG A 157 30.521 24.142 43.807 1.00 48.12 H new ATOM 0 HB2 ARG A 157 32.048 22.359 43.339 1.00 47.82 H new ATOM 0 HB3 ARG A 157 32.801 22.698 44.662 1.00 47.82 H new ATOM 0 HG2 ARG A 157 30.705 22.157 45.790 1.00 48.69 H new ATOM 0 HG3 ARG A 157 30.282 21.496 44.443 1.00 48.69 H new ATOM 0 HD2 ARG A 157 32.609 20.711 45.902 1.00 49.49 H new ATOM 0 HD3 ARG A 157 31.284 19.889 45.915 1.00 49.49 H new ATOM 0 HE ARG A 157 33.120 19.808 43.952 1.00 51.76 H new ATOM 0 HH11 ARG A 157 29.911 19.068 44.417 1.00 53.51 H new ATOM 0 HH12 ARG A 157 29.813 18.097 43.292 1.00 53.51 H new ATOM 0 HH21 ARG A 157 32.906 18.317 42.255 1.00 48.83 H new ATOM 0 HH22 ARG A 157 31.598 17.650 42.005 1.00 48.83 H new ATOM 1152 N THR A 158 32.526 25.170 46.070 1.00 47.77 N ATOM 1153 CA THR A 158 32.624 25.765 47.411 1.00 47.77 C ATOM 1154 C THR A 158 31.863 27.075 47.451 1.00 48.12 C ATOM 1155 O THR A 158 31.078 27.319 48.358 1.00 48.26 O ATOM 1156 CB THR A 158 34.096 26.006 47.846 1.00 47.59 C ATOM 1157 OG1 THR A 158 34.742 24.746 47.985 1.00 46.54 O ATOM 1158 CG2 THR A 158 34.187 26.750 49.178 1.00 46.72 C ATOM 0 H THR A 158 33.277 25.116 45.655 1.00 47.77 H new ATOM 0 HA THR A 158 32.234 25.132 48.034 1.00 47.77 H new ATOM 0 HB THR A 158 34.523 26.552 47.167 1.00 47.59 H new ATOM 0 HG1 THR A 158 34.937 24.446 47.225 1.00 46.54 H new ATOM 0 HG21 THR A 158 35.119 26.880 49.413 1.00 46.72 H new ATOM 0 HG22 THR A 158 33.751 27.613 49.097 1.00 46.72 H new ATOM 0 HG23 THR A 158 33.749 26.230 49.870 1.00 46.72 H new ATOM 1159 N VAL A 159 32.075 27.901 46.438 1.00 48.07 N ATOM 1160 CA VAL A 159 31.368 29.162 46.342 1.00 48.04 C ATOM 1161 C VAL A 159 29.838 28.985 46.320 1.00 48.59 C ATOM 1162 O VAL A 159 29.113 29.735 46.983 1.00 48.19 O ATOM 1163 CB VAL A 159 31.837 29.957 45.127 1.00 47.39 C ATOM 1164 CG1 VAL A 159 30.975 31.164 44.936 1.00 45.25 C ATOM 1165 CG2 VAL A 159 33.314 30.364 45.331 1.00 47.83 C ATOM 0 H VAL A 159 32.626 27.748 45.795 1.00 48.07 H new ATOM 0 HA VAL A 159 31.582 29.663 47.145 1.00 48.04 H new ATOM 0 HB VAL A 159 31.765 29.410 44.329 1.00 47.39 H new ATOM 0 HG11 VAL A 159 31.282 31.662 44.162 1.00 45.25 H new ATOM 0 HG12 VAL A 159 30.056 30.887 44.798 1.00 45.25 H new ATOM 0 HG13 VAL A 159 31.028 31.728 45.724 1.00 45.25 H new ATOM 0 HG21 VAL A 159 33.620 30.870 44.562 1.00 47.83 H new ATOM 0 HG22 VAL A 159 33.392 30.910 46.129 1.00 47.83 H new ATOM 0 HG23 VAL A 159 33.859 29.567 45.430 1.00 47.83 H new ATOM 1166 N GLY A 160 29.354 28.013 45.556 1.00 48.93 N ATOM 1167 CA GLY A 160 27.930 27.715 45.511 1.00 49.14 C ATOM 1168 C GLY A 160 27.386 27.397 46.889 1.00 49.69 C ATOM 1169 O GLY A 160 26.334 27.910 47.285 1.00 50.38 O ATOM 0 H GLY A 160 29.838 27.511 45.053 1.00 48.93 H new ATOM 0 HA2 GLY A 160 27.451 28.472 45.140 1.00 49.14 H new ATOM 0 HA3 GLY A 160 27.774 26.963 44.919 1.00 49.14 H new ATOM 1170 N TYR A 161 28.090 26.522 47.612 1.00 49.91 N ATOM 1171 CA TYR A 161 27.749 26.221 48.994 1.00 49.81 C ATOM 1172 C TYR A 161 27.824 27.421 49.965 1.00 49.75 C ATOM 1173 O TYR A 161 27.038 27.505 50.902 1.00 49.80 O ATOM 1174 CB TYR A 161 28.651 25.096 49.526 1.00 50.75 C ATOM 1175 CG TYR A 161 28.070 23.714 49.389 1.00 51.04 C ATOM 1176 CD1 TYR A 161 26.970 23.318 50.158 1.00 49.58 C ATOM 1177 CD2 TYR A 161 28.609 22.804 48.490 1.00 51.22 C ATOM 1178 CE1 TYR A 161 26.442 22.052 50.024 1.00 51.09 C ATOM 1179 CE2 TYR A 161 28.084 21.545 48.346 1.00 50.74 C ATOM 1180 CZ TYR A 161 27.010 21.172 49.104 1.00 51.60 C ATOM 1181 OH TYR A 161 26.509 19.913 48.948 1.00 52.00 O ATOM 0 H TYR A 161 28.772 26.092 47.313 1.00 49.91 H new ATOM 0 HA TYR A 161 26.817 25.952 48.968 1.00 49.81 H new ATOM 0 HB2 TYR A 161 29.499 25.126 49.055 1.00 50.75 H new ATOM 0 HB3 TYR A 161 28.840 25.264 50.462 1.00 50.75 H new ATOM 0 HD1 TYR A 161 26.592 23.914 50.764 1.00 49.58 H new ATOM 0 HD2 TYR A 161 29.342 23.053 47.974 1.00 51.22 H new ATOM 0 HE1 TYR A 161 25.716 21.788 50.541 1.00 51.09 H new ATOM 0 HE2 TYR A 161 28.456 20.949 47.737 1.00 50.74 H new ATOM 0 HH TYR A 161 26.952 19.506 48.362 1.00 52.00 H new ATOM 1182 N LEU A 162 28.801 28.312 49.787 1.00 49.43 N ATOM 1183 CA LEU A 162 28.953 29.496 50.672 1.00 49.07 C ATOM 1184 C LEU A 162 27.865 30.541 50.405 1.00 48.98 C ATOM 1185 O LEU A 162 27.353 31.165 51.331 1.00 48.44 O ATOM 1186 CB LEU A 162 30.320 30.151 50.477 1.00 48.90 C ATOM 1187 CG LEU A 162 31.537 29.313 50.879 1.00 49.12 C ATOM 1188 CD1 LEU A 162 32.823 30.026 50.438 1.00 47.55 C ATOM 1189 CD2 LEU A 162 31.519 29.024 52.367 1.00 46.47 C ATOM 0 H LEU A 162 29.391 28.258 49.163 1.00 49.43 H new ATOM 0 HA LEU A 162 28.870 29.177 51.584 1.00 49.07 H new ATOM 0 HB2 LEU A 162 30.412 30.392 49.542 1.00 48.90 H new ATOM 0 HB3 LEU A 162 30.337 30.977 50.986 1.00 48.90 H new ATOM 0 HG LEU A 162 31.505 28.455 50.428 1.00 49.12 H new ATOM 0 HD11 LEU A 162 33.592 29.494 50.694 1.00 47.55 H new ATOM 0 HD12 LEU A 162 32.815 30.141 49.475 1.00 47.55 H new ATOM 0 HD13 LEU A 162 32.875 30.895 50.866 1.00 47.55 H new ATOM 0 HD21 LEU A 162 32.296 28.493 52.603 1.00 46.47 H new ATOM 0 HD22 LEU A 162 31.537 29.860 52.859 1.00 46.47 H new ATOM 0 HD23 LEU A 162 30.713 28.534 52.592 1.00 46.47 H new ATOM 1190 N LEU A 163 27.519 30.733 49.138 1.00 48.92 N ATOM 1191 CA LEU A 163 26.432 31.627 48.788 1.00 49.64 C ATOM 1192 C LEU A 163 25.104 31.075 49.317 1.00 50.80 C ATOM 1193 O LEU A 163 24.273 31.846 49.796 1.00 51.35 O ATOM 1194 CB LEU A 163 26.380 31.882 47.276 1.00 49.68 C ATOM 1195 CG LEU A 163 25.780 33.222 46.814 1.00 50.22 C ATOM 1196 CD1 LEU A 163 26.574 34.424 47.281 1.00 48.42 C ATOM 1197 CD2 LEU A 163 25.619 33.275 45.309 1.00 48.74 C ATOM 0 H LEU A 163 27.903 30.354 48.468 1.00 48.92 H new ATOM 0 HA LEU A 163 26.592 32.485 49.211 1.00 49.64 H new ATOM 0 HB2 LEU A 163 27.284 31.820 46.929 1.00 49.68 H new ATOM 0 HB3 LEU A 163 25.869 31.166 46.867 1.00 49.68 H new ATOM 0 HG LEU A 163 24.905 33.267 47.231 1.00 50.22 H new ATOM 0 HD11 LEU A 163 26.150 35.236 46.961 1.00 48.42 H new ATOM 0 HD12 LEU A 163 26.604 34.436 48.250 1.00 48.42 H new ATOM 0 HD13 LEU A 163 27.477 34.372 46.931 1.00 48.42 H new ATOM 0 HD21 LEU A 163 25.240 34.130 45.054 1.00 48.74 H new ATOM 0 HD22 LEU A 163 26.486 33.167 44.887 1.00 48.74 H new ATOM 0 HD23 LEU A 163 25.029 32.561 45.021 1.00 48.74 H new ATOM 1198 N LEU A 164 24.907 29.750 49.267 1.00 50.59 N ATOM 1199 CA LEU A 164 23.690 29.178 49.810 1.00 50.09 C ATOM 1200 C LEU A 164 23.598 29.382 51.303 1.00 50.39 C ATOM 1201 O LEU A 164 22.507 29.566 51.841 1.00 51.60 O ATOM 1202 CB LEU A 164 23.564 27.690 49.480 1.00 50.22 C ATOM 1203 CG LEU A 164 22.282 26.981 49.954 1.00 50.14 C ATOM 1204 CD1 LEU A 164 21.009 27.554 49.262 1.00 48.63 C ATOM 1205 CD2 LEU A 164 22.387 25.462 49.774 1.00 50.50 C ATOM 0 H LEU A 164 25.459 29.184 48.928 1.00 50.59 H new ATOM 0 HA LEU A 164 22.953 29.647 49.388 1.00 50.09 H new ATOM 0 HB2 LEU A 164 23.628 27.587 48.518 1.00 50.22 H new ATOM 0 HB3 LEU A 164 24.325 27.229 49.866 1.00 50.22 H new ATOM 0 HG LEU A 164 22.190 27.158 50.903 1.00 50.14 H new ATOM 0 HD11 LEU A 164 20.225 27.083 49.586 1.00 48.63 H new ATOM 0 HD12 LEU A 164 20.926 28.498 49.467 1.00 48.63 H new ATOM 0 HD13 LEU A 164 21.082 27.437 48.302 1.00 48.63 H new ATOM 0 HD21 LEU A 164 21.568 25.042 50.080 1.00 50.50 H new ATOM 0 HD22 LEU A 164 22.525 25.256 48.836 1.00 50.50 H new ATOM 0 HD23 LEU A 164 23.135 25.126 50.292 1.00 50.50 H new ATOM 1206 N GLY A 165 24.734 29.282 51.994 1.00 50.00 N ATOM 1207 CA GLY A 165 24.798 29.531 53.402 1.00 48.63 C ATOM 1208 C GLY A 165 24.358 30.914 53.834 1.00 48.48 C ATOM 1209 O GLY A 165 23.671 31.049 54.858 1.00 47.30 O ATOM 0 H GLY A 165 25.488 29.065 51.641 1.00 50.00 H new ATOM 0 HA2 GLY A 165 24.247 28.875 53.857 1.00 48.63 H new ATOM 0 HA3 GLY A 165 25.710 29.390 53.699 1.00 48.63 H new ATOM 1210 N VAL A 166 24.749 31.951 53.087 1.00 48.00 N ATOM 1211 CA VAL A 166 24.291 33.299 53.434 1.00 48.02 C ATOM 1212 C VAL A 166 22.774 33.425 53.190 1.00 48.12 C ATOM 1213 O VAL A 166 22.065 34.000 54.016 1.00 46.59 O ATOM 1214 CB VAL A 166 25.146 34.512 52.807 1.00 48.33 C ATOM 1215 CG1 VAL A 166 26.580 34.527 53.255 1.00 45.47 C ATOM 1216 CG2 VAL A 166 24.993 34.609 51.325 1.00 47.17 C ATOM 0 H VAL A 166 25.262 31.900 52.398 1.00 48.00 H new ATOM 0 HA VAL A 166 24.461 33.402 54.383 1.00 48.02 H new ATOM 0 HB VAL A 166 24.761 35.324 53.173 1.00 48.33 H new ATOM 0 HG11 VAL A 166 27.039 35.277 52.845 1.00 45.47 H new ATOM 0 HG12 VAL A 166 26.617 34.614 54.220 1.00 45.47 H new ATOM 0 HG13 VAL A 166 27.011 33.700 52.989 1.00 45.47 H new ATOM 0 HG21 VAL A 166 25.523 35.350 50.993 1.00 47.17 H new ATOM 0 HG22 VAL A 166 25.296 33.785 50.914 1.00 47.17 H new ATOM 0 HG23 VAL A 166 24.060 34.755 51.105 1.00 47.17 H new ATOM 1217 N ALA A 167 22.275 32.848 52.088 1.00 48.11 N ATOM 1218 CA ALA A 167 20.829 32.850 51.801 1.00 48.35 C ATOM 1219 C ALA A 167 20.010 32.184 52.923 1.00 48.55 C ATOM 1220 O ALA A 167 19.035 32.737 53.402 1.00 48.79 O ATOM 1221 CB ALA A 167 20.549 32.168 50.439 1.00 48.01 C ATOM 0 H ALA A 167 22.755 32.451 51.495 1.00 48.11 H new ATOM 0 HA ALA A 167 20.545 33.776 51.755 1.00 48.35 H new ATOM 0 HB1 ALA A 167 19.595 32.176 50.263 1.00 48.01 H new ATOM 0 HB2 ALA A 167 21.012 32.649 49.735 1.00 48.01 H new ATOM 0 HB3 ALA A 167 20.865 31.251 50.465 1.00 48.01 H new ATOM 1222 N MET A 168 20.430 30.995 53.338 1.00 49.15 N ATOM 1223 CA MET A 168 19.738 30.203 54.357 1.00 48.77 C ATOM 1224 C MET A 168 19.711 30.903 55.729 1.00 48.59 C ATOM 1225 O MET A 168 18.686 30.939 56.397 1.00 46.77 O ATOM 1226 CB MET A 168 20.408 28.809 54.499 1.00 49.26 C ATOM 1227 CG MET A 168 20.272 27.806 53.312 1.00 48.52 C ATOM 1228 SD MET A 168 18.586 27.451 52.781 1.00 48.92 S ATOM 1229 CE MET A 168 17.928 26.435 54.092 1.00 51.85 C ATOM 0 H MET A 168 21.138 30.616 53.031 1.00 49.15 H new ATOM 0 HA MET A 168 18.820 30.102 54.061 1.00 48.77 H new ATOM 0 HB2 MET A 168 21.354 28.949 54.662 1.00 49.26 H new ATOM 0 HB3 MET A 168 20.043 28.383 55.291 1.00 49.26 H new ATOM 0 HG2 MET A 168 20.765 28.158 52.554 1.00 48.52 H new ATOM 0 HG3 MET A 168 20.697 26.971 53.565 1.00 48.52 H new ATOM 0 HE1 MET A 168 17.022 26.168 53.871 1.00 51.85 H new ATOM 0 HE2 MET A 168 18.481 25.645 54.198 1.00 51.85 H new ATOM 0 HE3 MET A 168 17.923 26.939 54.921 1.00 51.85 H new ATOM 1230 N SER A 169 20.858 31.429 56.137 1.00 48.46 N ATOM 1231 CA SER A 169 20.963 32.215 57.338 1.00 48.96 C ATOM 1232 C SER A 169 20.031 33.445 57.364 1.00 49.17 C ATOM 1233 O SER A 169 19.309 33.666 58.357 1.00 48.31 O ATOM 1234 CB SER A 169 22.399 32.681 57.572 1.00 48.34 C ATOM 1235 OG SER A 169 22.453 33.231 58.917 1.00 52.19 O ATOM 0 H SER A 169 21.601 31.334 55.714 1.00 48.46 H new ATOM 0 HA SER A 169 20.681 31.620 58.050 1.00 48.96 H new ATOM 0 HB2 SER A 169 23.019 31.941 57.478 1.00 48.34 H new ATOM 0 HB3 SER A 169 22.654 33.350 56.917 1.00 48.34 H new ATOM 0 HG SER A 169 23.233 33.497 59.080 1.00 52.19 H new ATOM 1236 N ALA A 170 20.085 34.240 56.295 1.00 49.14 N ATOM 1237 CA ALA A 170 19.218 35.405 56.121 1.00 49.96 C ATOM 1238 C ALA A 170 17.750 35.040 56.264 1.00 50.30 C ATOM 1239 O ALA A 170 17.040 35.681 57.024 1.00 50.45 O ATOM 1240 CB ALA A 170 19.460 36.088 54.766 1.00 48.85 C ATOM 0 H ALA A 170 20.632 34.116 55.643 1.00 49.14 H new ATOM 0 HA ALA A 170 19.446 36.030 56.827 1.00 49.96 H new ATOM 0 HB1 ALA A 170 18.872 36.855 54.680 1.00 48.85 H new ATOM 0 HB2 ALA A 170 20.383 36.381 54.711 1.00 48.85 H new ATOM 0 HB3 ALA A 170 19.278 35.460 54.050 1.00 48.85 H new ATOM 1241 N TYR A 171 17.309 34.010 55.556 1.00 50.54 N ATOM 1242 CA TYR A 171 15.918 33.603 55.619 1.00 51.84 C ATOM 1243 C TYR A 171 15.495 33.095 56.984 1.00 52.51 C ATOM 1244 O TYR A 171 14.384 33.400 57.439 1.00 54.28 O ATOM 1245 CB TYR A 171 15.602 32.524 54.565 1.00 52.84 C ATOM 1246 CG TYR A 171 15.247 33.061 53.196 1.00 52.54 C ATOM 1247 CD1 TYR A 171 16.114 32.900 52.121 1.00 52.86 C ATOM 1248 CD2 TYR A 171 14.038 33.707 52.979 1.00 52.09 C ATOM 1249 CE1 TYR A 171 15.787 33.373 50.857 1.00 55.95 C ATOM 1250 CE2 TYR A 171 13.700 34.208 51.712 1.00 54.13 C ATOM 1251 CZ TYR A 171 14.574 34.037 50.652 1.00 55.69 C ATOM 1252 OH TYR A 171 14.250 34.516 49.384 1.00 54.81 O ATOM 0 H TYR A 171 17.800 33.535 55.034 1.00 50.54 H new ATOM 0 HA TYR A 171 15.411 34.409 55.435 1.00 51.84 H new ATOM 0 HB2 TYR A 171 16.370 31.938 54.480 1.00 52.84 H new ATOM 0 HB3 TYR A 171 14.865 31.981 54.887 1.00 52.84 H new ATOM 0 HD1 TYR A 171 16.927 32.468 52.251 1.00 52.86 H new ATOM 0 HD2 TYR A 171 13.442 33.810 53.685 1.00 52.09 H new ATOM 0 HE1 TYR A 171 16.375 33.248 50.147 1.00 55.95 H new ATOM 0 HE2 TYR A 171 12.893 34.653 51.585 1.00 54.13 H new ATOM 0 HH TYR A 171 13.426 34.675 49.346 1.00 54.81 H new ATOM 1253 N GLU A 172 16.351 32.320 57.654 1.00 52.99 N ATOM 1254 CA GLU A 172 16.045 31.852 59.020 1.00 53.15 C ATOM 1255 C GLU A 172 15.906 33.040 59.962 1.00 52.60 C ATOM 1256 O GLU A 172 15.024 33.073 60.838 1.00 52.14 O ATOM 1257 CB GLU A 172 17.143 30.923 59.554 1.00 53.37 C ATOM 1258 CG GLU A 172 17.039 29.490 59.075 1.00 54.80 C ATOM 1259 CD GLU A 172 18.163 28.580 59.612 1.00 55.24 C ATOM 1260 OE1 GLU A 172 18.930 28.979 60.518 1.00 55.94 O ATOM 1261 OE2 GLU A 172 18.278 27.447 59.104 1.00 58.20 O ATOM 0 H GLU A 172 17.108 32.054 57.344 1.00 52.99 H new ATOM 0 HA GLU A 172 15.211 31.359 58.979 1.00 53.15 H new ATOM 0 HB2 GLU A 172 18.007 31.278 59.292 1.00 53.37 H new ATOM 0 HB3 GLU A 172 17.115 30.931 60.524 1.00 53.37 H new ATOM 0 HG2 GLU A 172 16.181 29.127 59.346 1.00 54.80 H new ATOM 0 HG3 GLU A 172 17.058 29.478 58.105 1.00 54.80 H new ATOM 1262 N GLN A 173 16.799 34.005 59.774 1.00 52.60 N ATOM 1263 CA GLN A 173 16.840 35.205 60.604 1.00 52.92 C ATOM 1264 C GLN A 173 15.579 36.019 60.358 1.00 52.77 C ATOM 1265 O GLN A 173 14.946 36.490 61.288 1.00 51.41 O ATOM 1266 CB GLN A 173 18.098 36.041 60.310 1.00 52.27 C ATOM 1267 CG GLN A 173 18.538 36.915 61.471 1.00 52.60 C ATOM 1268 CD GLN A 173 18.897 36.109 62.701 1.00 50.80 C ATOM 1269 OE1 GLN A 173 18.583 36.478 63.830 1.00 50.20 O ATOM 1270 NE2 GLN A 173 19.527 34.982 62.478 1.00 51.41 N ATOM 0 H GLN A 173 17.400 33.983 59.160 1.00 52.60 H new ATOM 0 HA GLN A 173 16.880 34.945 61.538 1.00 52.92 H new ATOM 0 HB2 GLN A 173 18.825 35.444 60.072 1.00 52.27 H new ATOM 0 HB3 GLN A 173 17.929 36.604 59.538 1.00 52.27 H new ATOM 0 HG2 GLN A 173 19.304 37.445 61.201 1.00 52.60 H new ATOM 0 HG3 GLN A 173 17.827 37.536 61.692 1.00 52.60 H new ATOM 0 HE21 GLN A 173 19.731 34.755 61.674 1.00 51.41 H new ATOM 0 HE22 GLN A 173 19.736 34.469 63.136 1.00 51.41 H new ATOM 1271 N TRP A 174 15.180 36.087 59.090 1.00 53.52 N ATOM 1272 CA TRP A 174 14.036 36.880 58.669 1.00 54.41 C ATOM 1273 C TRP A 174 12.741 36.271 59.138 1.00 55.17 C ATOM 1274 O TRP A 174 11.856 36.978 59.584 1.00 54.84 O ATOM 1275 CB TRP A 174 14.033 36.962 57.164 1.00 54.25 C ATOM 1276 CG TRP A 174 12.947 37.721 56.536 1.00 53.78 C ATOM 1277 CD1 TRP A 174 12.671 39.026 56.711 1.00 53.64 C ATOM 1278 CD2 TRP A 174 12.055 37.245 55.514 1.00 53.47 C ATOM 1279 NE1 TRP A 174 11.632 39.401 55.894 1.00 54.16 N ATOM 1280 CE2 TRP A 174 11.236 38.324 55.145 1.00 54.18 C ATOM 1281 CE3 TRP A 174 11.866 36.013 54.888 1.00 53.23 C ATOM 1282 CZ2 TRP A 174 10.219 38.207 54.187 1.00 54.40 C ATOM 1283 CZ3 TRP A 174 10.867 35.895 53.927 1.00 53.73 C ATOM 1284 CH2 TRP A 174 10.056 36.989 53.584 1.00 53.80 C ATOM 0 H TRP A 174 15.571 35.670 58.447 1.00 53.52 H new ATOM 0 HA TRP A 174 14.110 37.764 59.062 1.00 54.41 H new ATOM 0 HB2 TRP A 174 14.875 37.353 56.883 1.00 54.25 H new ATOM 0 HB3 TRP A 174 14.009 36.058 56.814 1.00 54.25 H new ATOM 0 HD1 TRP A 174 13.118 39.591 57.299 1.00 53.64 H new ATOM 0 HE1 TRP A 174 11.285 40.187 55.858 1.00 54.16 H new ATOM 0 HE3 TRP A 174 12.398 35.283 55.109 1.00 53.23 H new ATOM 0 HZ2 TRP A 174 9.676 38.930 53.969 1.00 54.40 H new ATOM 0 HZ3 TRP A 174 10.734 35.077 53.504 1.00 53.73 H new ATOM 0 HH2 TRP A 174 9.397 36.884 52.936 1.00 53.80 H new ATOM 1285 N LEU A 175 12.621 34.958 59.050 1.00 56.33 N ATOM 1286 CA LEU A 175 11.429 34.314 59.598 1.00 57.42 C ATOM 1287 C LEU A 175 11.307 34.465 61.084 1.00 58.21 C ATOM 1288 O LEU A 175 10.207 34.414 61.607 1.00 58.52 O ATOM 1289 CB LEU A 175 11.429 32.823 59.305 1.00 57.84 C ATOM 1290 CG LEU A 175 11.199 32.472 57.859 1.00 56.51 C ATOM 1291 CD1 LEU A 175 11.374 30.984 57.768 1.00 56.67 C ATOM 1292 CD2 LEU A 175 9.792 32.893 57.450 1.00 57.40 C ATOM 0 H LEU A 175 13.196 34.430 58.689 1.00 56.33 H new ATOM 0 HA LEU A 175 10.683 34.761 59.168 1.00 57.42 H new ATOM 0 HB2 LEU A 175 12.279 32.450 59.586 1.00 57.84 H new ATOM 0 HB3 LEU A 175 10.742 32.399 59.842 1.00 57.84 H new ATOM 0 HG LEU A 175 11.815 32.927 57.264 1.00 56.51 H new ATOM 0 HD11 LEU A 175 11.237 30.697 56.852 1.00 56.67 H new ATOM 0 HD12 LEU A 175 12.271 30.746 58.050 1.00 56.67 H new ATOM 0 HD13 LEU A 175 10.728 30.546 58.344 1.00 56.67 H new ATOM 0 HD21 LEU A 175 9.644 32.667 56.518 1.00 57.40 H new ATOM 0 HD22 LEU A 175 9.142 32.430 58.002 1.00 57.40 H new ATOM 0 HD23 LEU A 175 9.693 33.851 57.569 1.00 57.40 H new ATOM 1293 N ASP A 176 12.441 34.579 61.763 1.00 59.65 N ATOM 1294 CA ASP A 176 12.469 34.648 63.212 1.00 59.96 C ATOM 1295 C ASP A 176 12.050 36.026 63.752 1.00 60.22 C ATOM 1296 O ASP A 176 11.770 36.140 64.935 1.00 59.57 O ATOM 1297 CB ASP A 176 13.879 34.315 63.721 1.00 60.58 C ATOM 1298 CG ASP A 176 13.955 34.247 65.227 1.00 62.67 C ATOM 1299 OD1 ASP A 176 13.449 33.242 65.785 1.00 69.83 O ATOM 1300 OD2 ASP A 176 14.518 35.182 65.872 1.00 68.44 O ATOM 0 H ASP A 176 13.217 34.618 61.393 1.00 59.65 H new ATOM 0 HA ASP A 176 11.825 33.999 63.537 1.00 59.96 H new ATOM 0 HB2 ASP A 176 14.161 33.465 63.348 1.00 60.58 H new ATOM 0 HB3 ASP A 176 14.501 34.986 63.400 1.00 60.58 H new ATOM 1301 N ASP A 177 12.022 37.050 62.890 1.00 60.48 N ATOM 1302 CA ASP A 177 11.795 38.435 63.310 1.00 61.19 C ATOM 1303 C ASP A 177 11.240 39.293 62.156 1.00 61.65 C ATOM 1304 O ASP A 177 11.997 39.761 61.309 1.00 61.61 O ATOM 1305 CB ASP A 177 13.118 39.014 63.857 1.00 61.15 C ATOM 1306 CG ASP A 177 12.965 40.378 64.564 1.00 60.38 C ATOM 1307 OD1 ASP A 177 11.945 41.083 64.400 1.00 59.33 O ATOM 1308 OD2 ASP A 177 13.916 40.748 65.288 1.00 59.35 O ATOM 0 H ASP A 177 12.135 36.958 62.042 1.00 60.48 H new ATOM 0 HA ASP A 177 11.125 38.449 64.011 1.00 61.19 H new ATOM 0 HB2 ASP A 177 13.504 38.379 64.480 1.00 61.15 H new ATOM 0 HB3 ASP A 177 13.746 39.109 63.124 1.00 61.15 H new ATOM 1309 N ASP A 178 9.907 39.467 62.168 1.00 62.49 N ATOM 1310 CA ASP A 178 9.108 40.430 61.342 1.00 62.55 C ATOM 1311 C ASP A 178 9.692 41.822 61.094 1.00 62.28 C ATOM 1312 O ASP A 178 9.471 42.412 60.033 1.00 62.57 O ATOM 1313 CB ASP A 178 7.755 40.712 62.039 1.00 63.44 C ATOM 1314 CG ASP A 178 6.790 39.536 61.973 1.00 65.87 C ATOM 1315 OD1 ASP A 178 7.074 38.605 61.185 1.00 67.62 O ATOM 1316 OD2 ASP A 178 5.761 39.542 62.703 1.00 69.46 O ATOM 0 H ASP A 178 9.404 39.001 62.688 1.00 62.49 H new ATOM 0 HA ASP A 178 9.067 39.972 60.488 1.00 62.55 H new ATOM 0 HB2 ASP A 178 7.917 40.938 62.968 1.00 63.44 H new ATOM 0 HB3 ASP A 178 7.341 41.486 61.627 1.00 63.44 H new ATOM 1317 N SER A 179 10.369 42.363 62.101 1.00 61.35 N ATOM 1318 CA SER A 179 10.904 43.719 62.037 1.00 60.74 C ATOM 1319 C SER A 179 12.182 43.830 61.197 1.00 60.25 C ATOM 1320 O SER A 179 12.710 44.935 61.018 1.00 60.50 O ATOM 1321 CB SER A 179 11.191 44.233 63.453 1.00 60.55 C ATOM 1322 OG SER A 179 12.389 43.679 63.968 1.00 60.20 O ATOM 0 H SER A 179 10.531 41.955 62.840 1.00 61.35 H new ATOM 0 HA SER A 179 10.226 44.260 61.602 1.00 60.74 H new ATOM 0 HB2 SER A 179 11.259 45.201 63.441 1.00 60.55 H new ATOM 0 HB3 SER A 179 10.450 44.008 64.038 1.00 60.55 H new ATOM 0 HG SER A 179 12.305 42.846 64.038 1.00 60.20 H new ATOM 1323 N LEU A 180 12.703 42.698 60.717 1.00 59.30 N ATOM 1324 CA LEU A 180 13.935 42.703 59.937 1.00 58.57 C ATOM 1325 C LEU A 180 13.613 42.663 58.438 1.00 58.05 C ATOM 1326 O LEU A 180 12.590 42.107 58.018 1.00 57.67 O ATOM 1327 CB LEU A 180 14.822 41.513 60.316 1.00 58.26 C ATOM 1328 CG LEU A 180 15.206 41.317 61.779 1.00 57.97 C ATOM 1329 CD1 LEU A 180 16.095 40.079 61.928 1.00 55.43 C ATOM 1330 CD2 LEU A 180 15.884 42.556 62.360 1.00 57.34 C ATOM 0 H LEU A 180 12.356 41.920 60.834 1.00 59.30 H new ATOM 0 HA LEU A 180 14.418 43.521 60.135 1.00 58.57 H new ATOM 0 HB2 LEU A 180 14.372 40.706 60.020 1.00 58.26 H new ATOM 0 HB3 LEU A 180 15.643 41.584 59.804 1.00 58.26 H new ATOM 0 HG LEU A 180 14.391 41.178 62.287 1.00 57.97 H new ATOM 0 HD11 LEU A 180 16.334 39.962 62.861 1.00 55.43 H new ATOM 0 HD12 LEU A 180 15.614 39.296 61.618 1.00 55.43 H new ATOM 0 HD13 LEU A 180 16.901 40.194 61.400 1.00 55.43 H new ATOM 0 HD21 LEU A 180 16.113 42.394 63.289 1.00 57.34 H new ATOM 0 HD22 LEU A 180 16.691 42.749 61.857 1.00 57.34 H new ATOM 0 HD23 LEU A 180 15.279 43.312 62.303 1.00 57.34 H new ATOM 1331 N GLU A 181 14.506 43.256 57.652 1.00 57.37 N ATOM 1332 CA GLU A 181 14.393 43.290 56.204 1.00 57.01 C ATOM 1333 C GLU A 181 15.285 42.216 55.614 1.00 56.22 C ATOM 1334 O GLU A 181 16.469 42.123 55.964 1.00 55.35 O ATOM 1335 CB GLU A 181 14.801 44.670 55.659 1.00 57.34 C ATOM 1336 CG GLU A 181 13.857 45.819 56.022 1.00 58.79 C ATOM 1337 CD GLU A 181 12.433 45.632 55.496 1.00 59.90 C ATOM 1338 OE1 GLU A 181 12.279 45.384 54.281 1.00 59.57 O ATOM 1339 OE2 GLU A 181 11.471 45.737 56.289 1.00 61.41 O ATOM 0 H GLU A 181 15.205 43.656 57.953 1.00 57.37 H new ATOM 0 HA GLU A 181 13.470 43.127 55.953 1.00 57.01 H new ATOM 0 HB2 GLU A 181 15.688 44.883 55.989 1.00 57.34 H new ATOM 0 HB3 GLU A 181 14.863 44.615 54.693 1.00 57.34 H new ATOM 0 HG2 GLU A 181 13.828 45.911 56.987 1.00 58.79 H new ATOM 0 HG3 GLU A 181 14.218 46.647 55.669 1.00 58.79 H new ATOM 1340 N LEU A 182 14.705 41.411 54.720 1.00 55.73 N ATOM 1341 CA LEU A 182 15.423 40.319 54.065 1.00 55.45 C ATOM 1342 C LEU A 182 16.625 40.852 53.281 1.00 54.96 C ATOM 1343 O LEU A 182 17.724 40.313 53.390 1.00 54.29 O ATOM 1344 CB LEU A 182 14.487 39.513 53.145 1.00 55.45 C ATOM 1345 CG LEU A 182 15.059 38.261 52.450 1.00 55.47 C ATOM 1346 CD1 LEU A 182 15.675 37.280 53.474 1.00 54.16 C ATOM 1347 CD2 LEU A 182 14.004 37.562 51.572 1.00 54.47 C ATOM 0 H LEU A 182 13.883 41.485 54.477 1.00 55.73 H new ATOM 0 HA LEU A 182 15.751 39.722 54.756 1.00 55.45 H new ATOM 0 HB2 LEU A 182 13.719 39.237 53.670 1.00 55.45 H new ATOM 0 HB3 LEU A 182 14.159 40.112 52.456 1.00 55.45 H new ATOM 0 HG LEU A 182 15.770 38.560 51.862 1.00 55.47 H new ATOM 0 HD11 LEU A 182 16.026 36.504 53.009 1.00 54.16 H new ATOM 0 HD12 LEU A 182 16.394 37.721 53.953 1.00 54.16 H new ATOM 0 HD13 LEU A 182 14.993 36.998 54.103 1.00 54.16 H new ATOM 0 HD21 LEU A 182 14.398 36.781 51.152 1.00 54.47 H new ATOM 0 HD22 LEU A 182 13.254 37.288 52.123 1.00 54.47 H new ATOM 0 HD23 LEU A 182 13.695 38.175 50.887 1.00 54.47 H new ATOM 1348 N ASN A 183 16.426 41.931 52.531 1.00 54.81 N ATOM 1349 CA ASN A 183 17.500 42.481 51.697 1.00 54.99 C ATOM 1350 C ASN A 183 18.675 42.970 52.537 1.00 54.56 C ATOM 1351 O ASN A 183 19.831 42.854 52.141 1.00 54.98 O ATOM 1352 CB ASN A 183 16.983 43.612 50.788 1.00 55.37 C ATOM 1353 CG ASN A 183 16.451 44.815 51.572 1.00 57.06 C ATOM 1354 OD1 ASN A 183 15.574 44.679 52.431 1.00 61.47 O ATOM 1355 ND2 ASN A 183 16.978 45.998 51.273 1.00 59.00 N ATOM 0 H ASN A 183 15.682 42.360 52.488 1.00 54.81 H new ATOM 0 HA ASN A 183 17.816 41.757 51.134 1.00 54.99 H new ATOM 0 HB2 ASN A 183 17.701 43.904 50.204 1.00 55.37 H new ATOM 0 HB3 ASN A 183 16.278 43.266 50.219 1.00 55.37 H new ATOM 0 HD21 ASN A 183 16.710 46.704 51.683 1.00 59.00 H new ATOM 0 HD22 ASN A 183 17.587 46.057 50.669 1.00 59.00 H new ATOM 1356 N GLU A 184 18.370 43.507 53.705 1.00 53.83 N ATOM 1357 CA GLU A 184 19.393 43.971 54.603 1.00 53.74 C ATOM 1358 C GLU A 184 20.172 42.783 55.175 1.00 53.07 C ATOM 1359 O GLU A 184 21.411 42.826 55.252 1.00 53.24 O ATOM 1360 CB GLU A 184 18.756 44.810 55.712 1.00 53.79 C ATOM 1361 CG GLU A 184 19.751 45.513 56.610 1.00 54.72 C ATOM 1362 CD GLU A 184 19.087 46.524 57.536 1.00 55.99 C ATOM 1363 OE1 GLU A 184 17.824 46.604 57.530 1.00 58.92 O ATOM 1364 OE2 GLU A 184 19.830 47.237 58.266 1.00 58.23 O ATOM 0 H GLU A 184 17.567 43.610 53.994 1.00 53.83 H new ATOM 0 HA GLU A 184 20.022 44.530 54.121 1.00 53.74 H new ATOM 0 HB2 GLU A 184 18.175 45.474 55.308 1.00 53.79 H new ATOM 0 HB3 GLU A 184 18.195 44.236 56.256 1.00 53.79 H new ATOM 0 HG2 GLU A 184 20.225 44.854 57.142 1.00 54.72 H new ATOM 0 HG3 GLU A 184 20.413 45.965 56.063 1.00 54.72 H new ATOM 1365 N LEU A 185 19.446 41.731 55.576 1.00 51.97 N ATOM 1366 CA LEU A 185 20.067 40.517 56.113 1.00 51.31 C ATOM 1367 C LEU A 185 20.938 39.814 55.079 1.00 51.01 C ATOM 1368 O LEU A 185 22.039 39.373 55.397 1.00 51.21 O ATOM 1369 CB LEU A 185 19.004 39.549 56.608 1.00 50.89 C ATOM 1370 CG LEU A 185 18.290 39.936 57.888 1.00 50.38 C ATOM 1371 CD1 LEU A 185 17.032 39.096 58.020 1.00 49.30 C ATOM 1372 CD2 LEU A 185 19.238 39.759 59.077 1.00 48.57 C ATOM 0 H LEU A 185 18.587 41.703 55.544 1.00 51.97 H new ATOM 0 HA LEU A 185 20.632 40.794 56.851 1.00 51.31 H new ATOM 0 HB2 LEU A 185 18.340 39.442 55.909 1.00 50.89 H new ATOM 0 HB3 LEU A 185 19.419 38.682 56.740 1.00 50.89 H new ATOM 0 HG LEU A 185 18.026 40.869 57.869 1.00 50.38 H new ATOM 0 HD11 LEU A 185 16.567 39.336 58.837 1.00 49.30 H new ATOM 0 HD12 LEU A 185 16.453 39.258 57.259 1.00 49.30 H new ATOM 0 HD13 LEU A 185 17.272 38.156 58.049 1.00 49.30 H new ATOM 0 HD21 LEU A 185 18.780 40.007 59.896 1.00 48.57 H new ATOM 0 HD22 LEU A 185 19.519 38.832 59.132 1.00 48.57 H new ATOM 0 HD23 LEU A 185 20.016 40.326 58.958 1.00 48.57 H new ATOM 1373 N LEU A 186 20.441 39.710 53.844 1.00 50.42 N ATOM 1374 CA LEU A 186 21.220 39.145 52.758 1.00 50.10 C ATOM 1375 C LEU A 186 22.490 39.959 52.532 1.00 49.60 C ATOM 1376 O LEU A 186 23.559 39.404 52.327 1.00 48.71 O ATOM 1377 CB LEU A 186 20.379 39.051 51.463 1.00 50.03 C ATOM 1378 CG LEU A 186 19.259 37.981 51.415 1.00 49.85 C ATOM 1379 CD1 LEU A 186 18.249 38.233 50.311 1.00 48.07 C ATOM 1380 CD2 LEU A 186 19.812 36.533 51.290 1.00 47.54 C ATOM 0 H LEU A 186 19.650 39.964 53.621 1.00 50.42 H new ATOM 0 HA LEU A 186 21.479 38.244 53.006 1.00 50.10 H new ATOM 0 HB2 LEU A 186 19.972 39.918 51.306 1.00 50.03 H new ATOM 0 HB3 LEU A 186 20.985 38.884 50.724 1.00 50.03 H new ATOM 0 HG LEU A 186 18.806 38.063 52.269 1.00 49.85 H new ATOM 0 HD11 LEU A 186 17.573 37.537 50.326 1.00 48.07 H new ATOM 0 HD12 LEU A 186 17.827 39.096 50.449 1.00 48.07 H new ATOM 0 HD13 LEU A 186 18.700 38.227 49.452 1.00 48.07 H new ATOM 0 HD21 LEU A 186 19.073 35.905 51.264 1.00 47.54 H new ATOM 0 HD22 LEU A 186 20.331 36.454 50.475 1.00 47.54 H new ATOM 0 HD23 LEU A 186 20.377 36.335 52.053 1.00 47.54 H new ATOM 1381 N ALA A 187 22.382 41.280 52.631 1.00 50.34 N ATOM 1382 CA ALA A 187 23.525 42.168 52.385 1.00 50.23 C ATOM 1383 C ALA A 187 24.582 42.053 53.477 1.00 50.06 C ATOM 1384 O ALA A 187 25.765 41.971 53.157 1.00 50.06 O ATOM 1385 CB ALA A 187 23.068 43.624 52.211 1.00 50.47 C ATOM 0 H ALA A 187 21.654 41.688 52.840 1.00 50.34 H new ATOM 0 HA ALA A 187 23.937 41.880 51.555 1.00 50.23 H new ATOM 0 HB1 ALA A 187 23.840 44.189 52.050 1.00 50.47 H new ATOM 0 HB2 ALA A 187 22.461 43.685 51.457 1.00 50.47 H new ATOM 0 HB3 ALA A 187 22.614 43.919 53.016 1.00 50.47 H new ATOM 1386 N SER A 188 24.170 42.036 54.750 1.00 49.91 N ATOM 1387 CA SER A 188 25.109 41.763 55.862 1.00 49.92 C ATOM 1388 C SER A 188 25.825 40.428 55.692 1.00 49.89 C ATOM 1389 O SER A 188 27.036 40.313 55.964 1.00 49.74 O ATOM 1390 CB SER A 188 24.380 41.685 57.191 1.00 49.69 C ATOM 1391 OG SER A 188 23.848 42.930 57.517 1.00 51.18 O ATOM 0 H SER A 188 23.358 42.178 54.995 1.00 49.91 H new ATOM 0 HA SER A 188 25.745 42.495 55.849 1.00 49.92 H new ATOM 0 HB2 SER A 188 23.671 41.025 57.141 1.00 49.69 H new ATOM 0 HB3 SER A 188 24.990 41.394 57.886 1.00 49.69 H new ATOM 0 HG SER A 188 23.445 42.879 58.252 1.00 51.18 H new ATOM 1392 N GLY A 189 25.049 39.410 55.299 1.00 49.52 N ATOM 1393 CA GLY A 189 25.570 38.063 55.146 1.00 49.64 C ATOM 1394 C GLY A 189 26.573 38.044 54.023 1.00 49.78 C ATOM 1395 O GLY A 189 27.650 37.436 54.133 1.00 49.36 O ATOM 0 H GLY A 189 24.212 39.489 55.117 1.00 49.52 H new ATOM 0 HA2 GLY A 189 25.987 37.770 55.971 1.00 49.64 H new ATOM 0 HA3 GLY A 189 24.847 37.444 54.959 1.00 49.64 H new ATOM 1396 N MET A 190 26.224 38.735 52.943 1.00 49.88 N ATOM 1397 CA MET A 190 27.096 38.798 51.790 1.00 50.72 C ATOM 1398 C MET A 190 28.362 39.597 52.121 1.00 51.02 C ATOM 1399 O MET A 190 29.450 39.235 51.672 1.00 51.46 O ATOM 1400 CB MET A 190 26.339 39.363 50.561 1.00 50.67 C ATOM 1401 CG MET A 190 26.931 38.991 49.228 1.00 49.89 C ATOM 1402 SD MET A 190 27.139 37.228 48.922 1.00 48.93 S ATOM 1403 CE MET A 190 28.686 37.270 48.003 1.00 49.94 C ATOM 0 H MET A 190 25.487 39.172 52.863 1.00 49.88 H new ATOM 0 HA MET A 190 27.379 37.900 51.556 1.00 50.72 H new ATOM 0 HB2 MET A 190 25.421 39.051 50.591 1.00 50.67 H new ATOM 0 HB3 MET A 190 26.312 40.330 50.630 1.00 50.67 H new ATOM 0 HG2 MET A 190 26.367 39.358 48.530 1.00 49.89 H new ATOM 0 HG3 MET A 190 27.797 39.420 49.148 1.00 49.89 H new ATOM 0 HE1 MET A 190 28.941 36.367 47.757 1.00 49.94 H new ATOM 0 HE2 MET A 190 28.572 37.803 47.201 1.00 49.94 H new ATOM 0 HE3 MET A 190 29.380 37.663 48.555 1.00 49.94 H new ATOM 1404 N GLN A 191 28.241 40.647 52.935 1.00 51.37 N ATOM 1405 CA GLN A 191 29.415 41.437 53.317 1.00 51.60 C ATOM 1406 C GLN A 191 30.418 40.583 54.066 1.00 51.60 C ATOM 1407 O GLN A 191 31.624 40.727 53.889 1.00 51.36 O ATOM 1408 CB GLN A 191 29.035 42.640 54.200 1.00 51.93 C ATOM 1409 CG GLN A 191 30.211 43.579 54.512 1.00 52.10 C ATOM 1410 CD GLN A 191 30.757 44.233 53.247 1.00 54.87 C ATOM 1411 OE1 GLN A 191 30.005 44.847 52.492 1.00 55.45 O ATOM 1412 NE2 GLN A 191 32.061 44.089 53.004 1.00 55.47 N ATOM 0 H GLN A 191 27.498 40.917 53.274 1.00 51.37 H new ATOM 0 HA GLN A 191 29.809 41.765 52.493 1.00 51.60 H new ATOM 0 HB2 GLN A 191 28.336 43.147 53.758 1.00 51.93 H new ATOM 0 HB3 GLN A 191 28.663 42.313 55.034 1.00 51.93 H new ATOM 0 HG2 GLN A 191 29.922 44.266 55.133 1.00 52.10 H new ATOM 0 HG3 GLN A 191 30.918 43.079 54.950 1.00 52.10 H new ATOM 0 HE21 GLN A 191 32.556 43.652 53.556 1.00 55.47 H new ATOM 0 HE22 GLN A 191 32.407 44.433 52.296 1.00 55.47 H new ATOM 1413 N SER A 192 29.918 39.717 54.936 1.00 51.99 N ATOM 1414 CA SER A 192 30.789 38.817 55.664 1.00 52.65 C ATOM 1415 C SER A 192 31.493 37.801 54.738 1.00 52.70 C ATOM 1416 O SER A 192 32.655 37.472 54.942 1.00 53.04 O ATOM 1417 CB SER A 192 30.008 38.105 56.752 1.00 52.83 C ATOM 1418 OG SER A 192 30.807 37.082 57.301 1.00 55.69 O ATOM 0 H SER A 192 29.081 39.637 55.117 1.00 51.99 H new ATOM 0 HA SER A 192 31.488 39.352 56.071 1.00 52.65 H new ATOM 0 HB2 SER A 192 29.748 38.734 57.443 1.00 52.83 H new ATOM 0 HB3 SER A 192 29.191 37.731 56.387 1.00 52.83 H new ATOM 0 HG SER A 192 30.379 36.686 57.905 1.00 55.69 H new ATOM 1419 N LEU A 193 30.801 37.328 53.715 1.00 52.88 N ATOM 1420 CA LEU A 193 31.417 36.418 52.742 1.00 53.25 C ATOM 1421 C LEU A 193 32.464 37.157 51.892 1.00 53.15 C ATOM 1422 O LEU A 193 33.503 36.594 51.566 1.00 53.24 O ATOM 1423 CB LEU A 193 30.349 35.745 51.867 1.00 52.82 C ATOM 1424 CG LEU A 193 30.813 34.627 50.928 1.00 53.41 C ATOM 1425 CD1 LEU A 193 31.702 33.625 51.598 1.00 51.46 C ATOM 1426 CD2 LEU A 193 29.597 33.938 50.290 1.00 53.34 C ATOM 0 H LEU A 193 29.976 37.516 53.560 1.00 52.88 H new ATOM 0 HA LEU A 193 31.877 35.716 53.229 1.00 53.25 H new ATOM 0 HB2 LEU A 193 29.667 35.381 52.453 1.00 52.82 H new ATOM 0 HB3 LEU A 193 29.925 36.432 51.329 1.00 52.82 H new ATOM 0 HG LEU A 193 31.350 35.043 50.236 1.00 53.41 H new ATOM 0 HD11 LEU A 193 31.963 32.945 50.958 1.00 51.46 H new ATOM 0 HD12 LEU A 193 32.494 34.070 51.937 1.00 51.46 H new ATOM 0 HD13 LEU A 193 31.225 33.210 52.334 1.00 51.46 H new ATOM 0 HD21 LEU A 193 29.899 33.232 49.697 1.00 53.34 H new ATOM 0 HD22 LEU A 193 29.038 33.558 50.986 1.00 53.34 H new ATOM 0 HD23 LEU A 193 29.085 34.588 49.783 1.00 53.34 H new ATOM 1427 N TYR A 194 32.191 38.427 51.591 1.00 53.45 N ATOM 1428 CA TYR A 194 33.106 39.322 50.847 1.00 53.35 C ATOM 1429 C TYR A 194 34.392 39.599 51.617 1.00 53.11 C ATOM 1430 O TYR A 194 35.485 39.427 51.078 1.00 52.84 O ATOM 1431 CB TYR A 194 32.363 40.630 50.553 1.00 53.62 C ATOM 1432 CG TYR A 194 33.098 41.739 49.822 1.00 53.74 C ATOM 1433 CD1 TYR A 194 33.020 41.848 48.442 1.00 54.71 C ATOM 1434 CD2 TYR A 194 33.796 42.731 50.520 1.00 54.17 C ATOM 1435 CE1 TYR A 194 33.656 42.888 47.752 1.00 54.27 C ATOM 1436 CE2 TYR A 194 34.434 43.764 49.850 1.00 54.13 C ATOM 1437 CZ TYR A 194 34.359 43.840 48.452 1.00 54.38 C ATOM 1438 OH TYR A 194 34.977 44.863 47.746 1.00 53.63 O ATOM 0 H TYR A 194 31.453 38.808 51.816 1.00 53.45 H new ATOM 0 HA TYR A 194 33.368 38.886 50.021 1.00 53.35 H new ATOM 0 HB2 TYR A 194 31.573 40.409 50.035 1.00 53.62 H new ATOM 0 HB3 TYR A 194 32.055 40.990 51.400 1.00 53.62 H new ATOM 0 HD1 TYR A 194 32.534 41.216 47.963 1.00 54.71 H new ATOM 0 HD2 TYR A 194 33.833 42.697 51.449 1.00 54.17 H new ATOM 0 HE1 TYR A 194 33.603 42.934 46.825 1.00 54.27 H new ATOM 0 HE2 TYR A 194 34.910 44.405 50.327 1.00 54.13 H new ATOM 0 HH TYR A 194 35.370 45.376 48.282 1.00 53.63 H new ATOM 1439 N ASP A 195 34.242 40.012 52.878 1.00 53.14 N ATOM 1440 CA ASP A 195 35.367 40.329 53.766 1.00 53.17 C ATOM 1441 C ASP A 195 36.170 39.109 54.181 1.00 53.04 C ATOM 1442 O ASP A 195 37.378 39.204 54.402 1.00 52.98 O ATOM 1443 CB ASP A 195 34.867 40.931 55.082 1.00 53.43 C ATOM 1444 CG ASP A 195 34.198 42.281 54.920 1.00 54.84 C ATOM 1445 OD1 ASP A 195 34.545 43.039 53.982 1.00 55.45 O ATOM 1446 OD2 ASP A 195 33.321 42.581 55.772 1.00 57.20 O ATOM 0 H ASP A 195 33.473 40.118 53.248 1.00 53.14 H new ATOM 0 HA ASP A 195 35.917 40.940 53.251 1.00 53.17 H new ATOM 0 HB2 ASP A 195 34.240 40.315 55.492 1.00 53.43 H new ATOM 0 HB3 ASP A 195 35.616 41.021 55.692 1.00 53.43 H new ATOM 1447 N GLY A 196 35.472 37.992 54.385 1.00 52.76 N ATOM 1448 CA GLY A 196 36.066 36.792 54.971 1.00 52.38 C ATOM 1449 C GLY A 196 36.088 36.832 56.491 1.00 52.01 C ATOM 1450 O GLY A 196 35.881 37.872 57.110 1.00 51.39 O ATOM 0 H GLY A 196 34.639 37.909 54.187 1.00 52.76 H new ATOM 0 HA2 GLY A 196 35.568 36.013 54.679 1.00 52.38 H new ATOM 0 HA3 GLY A 196 36.972 36.689 54.641 1.00 52.38 H new ATOM 1451 N LEU A 197 36.354 35.684 57.099 1.00 51.66 N ATOM 1452 CA LEU A 197 36.209 35.551 58.538 1.00 51.76 C ATOM 1453 C LEU A 197 37.501 35.800 59.331 1.00 51.80 C ATOM 1454 O LEU A 197 37.500 35.650 60.562 1.00 52.00 O ATOM 1455 CB LEU A 197 35.619 34.174 58.877 1.00 51.38 C ATOM 1456 CG LEU A 197 34.216 33.864 58.339 1.00 50.58 C ATOM 1457 CD1 LEU A 197 33.730 32.532 58.906 1.00 49.46 C ATOM 1458 CD2 LEU A 197 33.211 34.976 58.634 1.00 48.82 C ATOM 0 H LEU A 197 36.619 34.972 56.696 1.00 51.66 H new ATOM 0 HA LEU A 197 35.601 36.254 58.815 1.00 51.76 H new ATOM 0 HB2 LEU A 197 36.226 33.496 58.543 1.00 51.38 H new ATOM 0 HB3 LEU A 197 35.598 34.085 59.843 1.00 51.38 H new ATOM 0 HG LEU A 197 34.281 33.803 57.373 1.00 50.58 H new ATOM 0 HD11 LEU A 197 32.843 32.339 58.564 1.00 49.46 H new ATOM 0 HD12 LEU A 197 34.339 31.825 58.641 1.00 49.46 H new ATOM 0 HD13 LEU A 197 33.699 32.584 59.874 1.00 49.46 H new ATOM 0 HD21 LEU A 197 32.344 34.732 58.275 1.00 48.82 H new ATOM 0 HD22 LEU A 197 33.140 35.102 59.593 1.00 48.82 H new ATOM 0 HD23 LEU A 197 33.511 35.801 58.222 1.00 48.82 H new ATOM 1459 N SER A 198 38.584 36.204 58.657 1.00 51.77 N ATOM 1460 CA SER A 198 39.845 36.527 59.351 1.00 51.93 C ATOM 1461 C SER A 198 39.627 37.503 60.526 1.00 52.16 C ATOM 1462 O SER A 198 40.066 37.238 61.648 1.00 51.95 O ATOM 1463 CB SER A 198 40.902 37.072 58.374 1.00 51.64 C ATOM 1464 OG SER A 198 40.371 38.090 57.544 1.00 50.46 O ATOM 0 H SER A 198 38.613 36.298 57.803 1.00 51.77 H new ATOM 0 HA SER A 198 40.180 35.696 59.723 1.00 51.93 H new ATOM 0 HB2 SER A 198 41.656 37.422 58.874 1.00 51.64 H new ATOM 0 HB3 SER A 198 41.239 36.348 57.824 1.00 51.64 H new ATOM 0 HG SER A 198 40.969 38.368 57.024 1.00 50.46 H new ATOM 1465 N SER A 199 38.911 38.595 60.276 1.00 52.50 N ATOM 1466 CA SER A 199 38.722 39.648 61.276 1.00 53.12 C ATOM 1467 C SER A 199 37.608 39.383 62.317 1.00 53.74 C ATOM 1468 O SER A 199 37.343 40.237 63.172 1.00 53.89 O ATOM 1469 CB SER A 199 38.422 40.973 60.574 1.00 53.03 C ATOM 1470 OG SER A 199 37.060 41.027 60.189 1.00 53.39 O ATOM 0 H SER A 199 38.521 38.748 59.525 1.00 52.50 H new ATOM 0 HA SER A 199 39.555 39.673 61.773 1.00 53.12 H new ATOM 0 HB2 SER A 199 38.627 41.714 61.166 1.00 53.03 H new ATOM 0 HB3 SER A 199 38.990 41.068 59.793 1.00 53.03 H new ATOM 0 HG SER A 199 36.906 41.759 59.806 1.00 53.39 H new ATOM 1471 N LEU A 200 36.961 38.220 62.249 1.00 54.20 N ATOM 1472 CA LEU A 200 35.790 37.934 63.088 1.00 54.32 C ATOM 1473 C LEU A 200 36.158 37.910 64.568 1.00 54.64 C ATOM 1474 O LEU A 200 37.003 37.128 64.984 1.00 54.14 O ATOM 1475 CB LEU A 200 35.139 36.603 62.652 1.00 54.30 C ATOM 1476 CG LEU A 200 33.903 36.123 63.407 1.00 53.78 C ATOM 1477 CD1 LEU A 200 32.750 37.092 63.242 1.00 53.36 C ATOM 1478 CD2 LEU A 200 33.528 34.747 62.937 1.00 53.37 C ATOM 0 H LEU A 200 37.184 37.578 61.721 1.00 54.20 H new ATOM 0 HA LEU A 200 35.145 38.648 62.966 1.00 54.32 H new ATOM 0 HB2 LEU A 200 34.901 36.682 61.715 1.00 54.30 H new ATOM 0 HB3 LEU A 200 35.813 35.909 62.716 1.00 54.30 H new ATOM 0 HG LEU A 200 34.110 36.084 64.354 1.00 53.78 H new ATOM 0 HD11 LEU A 200 31.979 36.764 63.731 1.00 53.36 H new ATOM 0 HD12 LEU A 200 33.006 37.961 63.588 1.00 53.36 H new ATOM 0 HD13 LEU A 200 32.526 37.172 62.302 1.00 53.36 H new ATOM 0 HD21 LEU A 200 32.742 34.444 63.418 1.00 53.37 H new ATOM 0 HD22 LEU A 200 33.336 34.771 61.987 1.00 53.37 H new ATOM 0 HD23 LEU A 200 34.264 34.137 63.102 1.00 53.37 H new ATOM 1479 N GLY A 201 35.519 38.784 65.348 1.00 55.51 N ATOM 1480 CA GLY A 201 35.741 38.869 66.791 1.00 56.09 C ATOM 1481 C GLY A 201 37.066 39.504 67.195 1.00 56.88 C ATOM 1482 O GLY A 201 37.460 39.461 68.378 1.00 56.16 O ATOM 0 H GLY A 201 34.941 39.347 65.051 1.00 55.51 H new ATOM 0 HA2 GLY A 201 35.018 39.379 67.188 1.00 56.09 H new ATOM 0 HA3 GLY A 201 35.697 37.975 67.166 1.00 56.09 H new ATOM 1483 N GLU A 202 37.737 40.125 66.225 1.00 57.87 N ATOM 1484 CA GLU A 202 39.125 40.569 66.384 1.00 58.39 C ATOM 1485 C GLU A 202 39.195 42.086 66.703 1.00 59.05 C ATOM 1486 O GLU A 202 38.406 42.867 66.159 1.00 59.47 O ATOM 1487 CB GLU A 202 39.896 40.215 65.101 1.00 58.74 C ATOM 1488 CG GLU A 202 41.368 39.838 65.280 1.00 59.34 C ATOM 1489 CD GLU A 202 41.608 38.491 65.983 1.00 61.83 C ATOM 1490 OE1 GLU A 202 40.818 38.099 66.872 1.00 62.79 O ATOM 1491 OE2 GLU A 202 42.622 37.833 65.657 1.00 63.01 O ATOM 0 H GLU A 202 37.400 40.302 65.454 1.00 57.87 H new ATOM 0 HA GLU A 202 39.534 40.115 67.137 1.00 58.39 H new ATOM 0 HB2 GLU A 202 39.442 39.476 64.667 1.00 58.74 H new ATOM 0 HB3 GLU A 202 39.846 40.972 64.497 1.00 58.74 H new ATOM 0 HG2 GLU A 202 41.791 39.813 64.407 1.00 59.34 H new ATOM 0 HG3 GLU A 202 41.808 40.537 65.789 1.00 59.34 H new ATOM 1492 N PRO A 203 40.106 42.503 67.615 1.00 59.30 N ATOM 1493 CA PRO A 203 40.286 43.930 67.895 1.00 59.37 C ATOM 1494 C PRO A 203 41.275 44.591 66.933 1.00 59.61 C ATOM 1495 O PRO A 203 40.926 44.867 65.784 1.00 60.09 O ATOM 1496 CB PRO A 203 40.859 43.932 69.316 1.00 59.60 C ATOM 1497 CG PRO A 203 41.681 42.685 69.383 1.00 59.55 C ATOM 1498 CD PRO A 203 41.003 41.676 68.449 1.00 59.40 C ATOM 0 HA PRO A 203 39.459 44.428 67.796 1.00 59.37 H new ATOM 0 HB2 PRO A 203 41.399 44.721 69.479 1.00 59.60 H new ATOM 0 HB3 PRO A 203 40.154 43.928 69.982 1.00 59.60 H new ATOM 0 HG2 PRO A 203 42.594 42.856 69.104 1.00 59.55 H new ATOM 0 HG3 PRO A 203 41.721 42.345 70.290 1.00 59.55 H new ATOM 0 HD2 PRO A 203 41.653 41.201 67.908 1.00 59.40 H new ATOM 0 HD3 PRO A 203 40.508 41.008 68.948 1.00 59.40 H new TER 1499 PRO A 203 HETATM 1500 O HOH A 208 12.307 31.611 32.990 1.00 38.15 O HETATM 1501 O HOH A 209 38.254 26.786 39.705 1.00 52.48 O HETATM 1502 O HOH A 210 5.149 16.285 56.400 1.00 44.64 O HETATM 1503 O HOH A 211 7.030 17.360 57.966 1.00 47.47 O HETATM 1504 O HOH A 212 27.916 24.048 45.166 1.00 39.52 O HETATM 1505 O HOH A 213 23.313 35.586 55.948 1.00 46.67 O HETATM 1506 O HOH A 214 20.554 24.243 38.179 1.00 45.08 O HETATM 1507 O HOH A 215 27.547 22.754 42.840 1.00 47.56 O HETATM 1508 O HOH A 216 1.641 15.959 54.112 1.00 47.90 O HETATM 1509 O HOH A 217 14.201 15.905 47.338 1.00 59.51 O HETATM 1510 O HOH A 218 34.792 47.394 30.352 1.00 47.86 O HETATM 1511 O HOH A 219 29.757 46.646 32.526 1.00 56.70 O HETATM 1512 O HOH A 220 1.812 20.247 59.011 1.00 63.66 O HETATM 1513 O HOH A 221 20.300 27.436 62.210 1.00 51.89 O HETATM 1514 O HOH A 222 15.975 25.923 34.932 1.00 46.50 O HETATM 1515 O HOH A 223 39.854 38.341 54.913 1.00 48.94 O HETATM 1516 O HOH A 224 17.845 22.654 59.039 1.00 46.25 O HETATM 1517 O HOH A 225 24.884 29.515 35.748 1.00 47.13 O HETATM 1518 O HOH A 226 13.361 42.754 51.993 1.00 62.18 O HETATM 1519 O HOH A 227 39.094 21.024 41.846 1.00 53.85 O HETATM 1520 O HOH A 228 21.647 20.438 48.498 1.00 54.01 O HETATM 1521 O HOH A 229 -0.403 32.347 49.227 1.00 71.24 O HETATM 1522 O HOH A 230 3.370 29.769 55.581 1.00 49.28 O HETATM 1523 O HOH A 231 6.375 35.157 40.792 1.00 45.95 O HETATM 1524 O HOH A 232 7.982 36.767 38.818 1.00 55.64 O HETATM 1525 O HOH A 233 5.203 35.717 46.917 1.00 58.66 O HETATM 1526 O HOH A 234 18.553 30.537 31.488 1.00 52.12 O HETATM 1527 O HOH A 235 37.787 39.505 58.002 1.00 63.14 O HETATM 1528 O HOH A 236 21.696 35.385 29.202 1.00 61.99 O HETATM 1529 O HOH A 237 10.685 14.642 52.730 1.00 56.14 O HETATM 1530 O HOH A 238 20.382 25.689 35.321 1.00 56.76 O HETATM 1531 O HOH A 239 14.403 24.016 53.437 1.00 49.56 O HETATM 1532 O HOH A 240 38.866 24.538 41.635 1.00 54.67 O HETATM 1533 O HOH A 241 4.332 33.928 41.296 1.00 55.83 O HETATM 1534 O HOH A 242 8.378 34.460 41.715 1.00 49.55 O HETATM 1535 O HOH A 243 4.974 29.250 36.299 1.00 61.57 O HETATM 1536 O HOH A 244 5.423 35.078 36.019 1.00 66.08 O HETATM 1537 O HOH A 245 2.179 34.143 40.538 1.00 56.40 O HETATM 1538 O HOH A 246 3.212 33.030 37.428 1.00 69.83 O END