USER MOD reduce.3.24.130724 H: found=0, std=0, add=2000, rem=0, adj=71 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER TRANSFERASE 24-JAN-08 3C26 TITLE CRYSTAL STRUCTURE OF A PUTATIVE ACETYLTRANSFERASE (NP_394282.1) FROM TITLE 2 THERMOPLASMA ACIDOPHILUM AT 2.00 A RESOLUTION COMPND MOL_ID: 1; COMPND 2 MOLECULE: PUTATIVE ACETYLTRANSFERASE TA0821; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: THERMOPLASMA ACIDOPHILUM DSM 1728; SOURCE 3 ORGANISM_TAXID: 273075; SOURCE 4 STRAIN: DSM 1728 / AMRC-C165 / IFO 15155 / JCM 9062; SOURCE 5 ATCC: 25905; SOURCE 6 GENE: NP_394282.1, TA0821; SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 8 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 9 EXPRESSION_SYSTEM_STRAIN: HK100; SOURCE 0 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 1 EXPRESSION_SYSTEM_PLASMID: SPEEDET KEYWDS NP_394282.1, A PUTATIVE ACETYLTRANSFERASE, ACETYLTRANSFERASE (GNAT) KEYWDS 2 FAMILY, STRUCTURAL GENOMICS, JOINT CENTER FOR STRUCTURAL GENOMICS, KEYWDS 3 JCSG, PROTEIN STRUCTURE INITIATIVE, PSI-2, TRANSFERASE EXPDTA X-RAY DIFFRACTION AUTHOR JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) REVDAT 3 13-JUL-11 3C26 1 VERSN REVDAT 2 24-FEB-09 3C26 1 VERSN REVDAT 1 05-FEB-08 3C26 0 JRNL AUTH JOINT CENTER FOR STRUCTURAL GENOMICS (JCSG) JRNL TITL CRYSTAL STRUCTURE OF A PUTATIVE ACETYLTRANSFERASE JRNL TITL 2 (NP_394282.1) FROM THERMOPLASMA ACIDOPHILUM AT 2.00 A JRNL TITL 3 RESOLUTION JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. 2.00 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.4.0067 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) : 2.00 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 29.49 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.9 REMARK 3 NUMBER OF REFLECTIONS : 17882 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) : 0.182 REMARK 3 R VALUE (WORKING SET) : 0.179 REMARK 3 FREE R VALUE : 0.242 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.100 REMARK 3 FREE R VALUE TEST SET COUNT : 912 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.00 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.05 REMARK 3 REFLECTION IN BIN (WORKING SET) : 1193 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 99.22 REMARK 3 BIN R VALUE (WORKING SET) : 0.2110 REMARK 3 BIN FREE R VALUE SET COUNT : 79 REMARK 3 BIN FREE R VALUE : 0.3080 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2067 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 32 REMARK 3 SOLVENT ATOMS : 150 REMARK 3 REMARK 3 B VALUES. REMARK 3 B VALUE TYPE : LIKELY RESIDUAL REMARK 3 FROM WILSON PLOT (A**2) : 23.54 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 22.44 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.00000 REMARK 3 B22 (A**2) : 0.00000 REMARK 3 B33 (A**2) : 0.01000 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): 0.195 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.180 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.123 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 8.552 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.954 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.918 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 2159 ; 0.017 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): 1476 ; 0.001 ; 0.020 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 2920 ; 1.609 ; 1.950 REMARK 3 BOND ANGLES OTHERS (DEGREES): 3544 ; 1.288 ; 3.001 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 259 ; 4.419 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 103 ;31.466 ;22.816 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 340 ;14.232 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 16 ;15.807 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 305 ; 0.089 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 2411 ; 0.008 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): 487 ; 0.002 ; 0.020 REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 1289 ; 0.894 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): 525 ; 0.217 ; 1.500 REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 2065 ; 1.606 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 870 ; 2.585 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 853 ; 4.037 ; 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 : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 5 A 265 REMARK 3 ORIGIN FOR THE GROUP (A): 32.6470 29.6270 17.4760 REMARK 3 T TENSOR REMARK 3 T11: -0.0471 T22: -0.0161 REMARK 3 T33: -0.0974 T12: -0.0206 REMARK 3 T13: 0.0005 T23: 0.0021 REMARK 3 L TENSOR REMARK 3 L11: 0.7190 L22: 1.0069 REMARK 3 L33: 0.6665 L12: -0.0694 REMARK 3 L13: -0.0155 L23: -0.1242 REMARK 3 S TENSOR REMARK 3 S11: -0.0146 S12: 0.0539 S13: 0.0245 REMARK 3 S21: -0.0092 S22: 0.0031 S23: 0.0347 REMARK 3 S31: 0.0321 S32: -0.0636 S33: 0.0115 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: REMARK 3 1. HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS. REMARK 3 2. A MET-INHIBITION PROTOCOL WAS USED FOR SELENOMETHIONINE REMARK 3 INCORPORATION DURING PROTEIN EXPRESSION. THE OCCUPANCY REMARK 3 OF THE SE ATOMS IN THE MSE RESIDUES WAS REDUCED TO 0.75 REMARK 3 FOR THE REDUCED SCATTERING POWER DUE TO PARTIAL S-MET REMARK 3 INCORPORATION. REMARK 3 3. ATOM RECORD CONTAINS RESIDUAL B FACTORS ONLY. REMARK 3 4. THERE IS AN UNKNOWN DENSITY NEAR HIS 140. REMARK 3 5. NO3 AND EDO WERE MODELED BASED ON CRYSTALLIZATION REMARK 3 AND CRYOPROTECTION CONDITIONS. REMARK 4 REMARK 4 3C26 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 25-JAN-08. REMARK 100 THE RCSB ID CODE IS RCSB046247. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 09-DEC-07 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 6.8 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : SSRL REMARK 200 BEAMLINE : BL11-1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.97895 REMARK 200 MONOCHROMATOR : SINGLE CRYSTAL SI(111) BENT REMARK 200 (HORIZONTAL FOCUSING) REMARK 200 OPTICS : FLAT MIRROR (VERTICAL FOCUSING) REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARMOSAIC 325 MM CCD REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS REMARK 200 DATA SCALING SOFTWARE : XSCALE REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 17927 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.000 REMARK 200 RESOLUTION RANGE LOW (A) : 29.488 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : -3.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.8 REMARK 200 DATA REDUNDANCY : NULL REMARK 200 R MERGE (I) : 0.10500 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 10.5300 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.00 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.07 REMARK 200 COMPLETENESS FOR SHELL (%) : 99.1 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : 0.60000 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 2.200 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: SAD REMARK 200 SOFTWARE USED: SHELXD, AUTOSHARP REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 39.85 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.04 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: NANODROP, 0.2M NANO3, 20.0% PEG 3350, REMARK 280 NO BUFFER PH 6.8, VAPOR DIFFUSION, SITTING DROP, TEMPERATURE 293K 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 33.63000 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 43.41000 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 43.41000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 50.44500 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 43.41000 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 43.41000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 16.81500 REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 43.41000 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 43.41000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 50.44500 REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 43.41000 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 43.41000 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 16.81500 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 33.63000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: DIMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 TOTAL BURIED SURFACE AREA: 2450 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 86.82000 REMARK 350 BIOMT2 2 -1.000000 0.000000 0.000000 86.82000 REMARK 350 BIOMT3 2 0.000000 0.000000 -1.000000 33.63000 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 GLY A 0 REMARK 465 MSE A 1 REMARK 465 SER A 2 REMARK 465 ALA A 3 REMARK 465 ASP A 4 REMARK 465 THR A 155 REMARK 465 ALA A 156 REMARK 465 VAL A 157 REMARK 465 PRO A 158 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 ILE A 5 CG1 CG2 CD1 REMARK 470 ARG A 9 CZ NH1 NH2 REMARK 470 LYS A 27 CG CD CE NZ REMARK 470 ARG A 136 CZ NH1 NH2 REMARK 470 SER A 154 OG REMARK 470 ARG A 166 CG CD NE CZ NH1 NH2 REMARK 470 ASP A 187 CG OD1 OD2 REMARK 470 ILE A 189 CG1 CG2 CD1 REMARK 470 GLU A 191 CG CD OE1 OE2 REMARK 470 ASP A 222 CG OD1 OD2 REMARK 470 LYS A 230 CE NZ 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 SER A 98 -169.36 -78.22 REMARK 500 ASN A 164 66.23 -119.56 REMARK 500 ASP A 200 107.20 -171.98 REMARK 500 ASP A 223 80.82 -153.32 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NO3 A 266 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NO3 A 267 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE NO3 A 268 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A 269 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A 270 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC6 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A 271 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC7 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A 272 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC8 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE EDO A 273 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 376023 RELATED DB: TARGETDB REMARK 999 REMARK 999 SEQUENCE REMARK 999 THE CONSTRUCT WAS EXPRESSED WITH A PURIFICATION TAG REMARK 999 MGSDKIHHHHHHENLYFQG. THE TAG WAS REMOVED WITH TEV PROTEASE REMARK 999 LEAVING ONLY A GLYCINE FOLLOWED BY THE TARGET SEQUENCE. DBREF 3C26 A 1 265 UNP Q9HJZ0 Q9HJZ0_THEAC 1 265 SEQADV 3C26 GLY A 0 UNP Q9HJZ0 LEADER SEQUENCE SEQRES 1 A 266 GLY MSE SER ALA ASP ILE VAL PHE ASP ARG GLY SER PRO SEQRES 2 A 266 SER ASP ILE ASP GLU ILE LYS THR PHE THR SER ASN THR SEQRES 3 A 266 TRP LYS VAL GLY TYR TYR THR ASP LEU TYR SER LYS LEU SEQRES 4 A 266 ALA ASP THR GLY THR MSE ASP ASP TYR VAL ASP LYS VAL SEQRES 5 A 266 ILE GLU ARG TRP VAL ASN ASP GLY SER VAL TYR VAL LEU SEQRES 6 A 266 ARG VAL SER GLY ARG PRO VAL ALA THR ILE HIS MSE GLU SEQRES 7 A 266 LYS LEU PRO ASP GLY SER VAL MSE LEU GLY GLY LEU ARG SEQRES 8 A 266 VAL HIS PRO GLU TYR ARG GLY SER ARG LEU GLY MSE SER SEQRES 9 A 266 ILE MSE GLN GLU THR ILE GLN PHE LEU ARG GLY LYS THR SEQRES 10 A 266 GLU ARG LEU ARG SER ALA VAL TYR SER TRP ASN GLU PRO SEQRES 11 A 266 SER LEU ARG LEU VAL HIS ARG LEU GLY PHE HIS GLN VAL SEQRES 12 A 266 GLU GLU TYR PRO ILE TYR THR PHE GLN GLY GLY SER THR SEQRES 13 A 266 ALA VAL PRO ALA LEU LYS PRO VAL ASN GLU ARG TYR ALA SEQRES 14 A 266 GLY ARG TRP ARG CYS PHE PHE ILE ASP TRP LYS TYR MSE SEQRES 15 A 266 CYS SER ASP ASP PRO ASP ILE ILE HIS GLU GLU TYR SER SEQRES 16 A 266 ASN ASN LEU ILE VAL ASP GLY SER THR PHE VAL TYR PHE SEQRES 17 A 266 ASP ILE TYR GLU GLY GLY ILE ASP LEU PHE VAL ASN ASP SEQRES 18 A 266 SER ASP ASP ALA SER SER PHE ILE GLU LYS TYR ARG SER SEQRES 19 A 266 MSE ASN GLY ARG ILE THR PHE TYR VAL ARG LYS ALA LEU SEQRES 20 A 266 ALA ASN GLY LEU PRO TYR VAL PRO ALA SER SER LEU THR SEQRES 21 A 266 VAL TRP GLU TYR ARG TYR MODRES 3C26 MSE A 44 MET SELENOMETHIONINE MODRES 3C26 MSE A 76 MET SELENOMETHIONINE MODRES 3C26 MSE A 85 MET SELENOMETHIONINE MODRES 3C26 MSE A 102 MET SELENOMETHIONINE MODRES 3C26 MSE A 105 MET SELENOMETHIONINE MODRES 3C26 MSE A 181 MET SELENOMETHIONINE MODRES 3C26 MSE A 234 MET SELENOMETHIONINE HET MSE A 44 8 HET MSE A 76 8 HET MSE A 85 8 HET MSE A 102 8 HET MSE A 105 8 HET MSE A 181 8 HET MSE A 234 8 HET NO3 A 266 4 HET NO3 A 267 4 HET NO3 A 268 4 HET EDO A 269 4 HET EDO A 270 4 HET EDO A 271 4 HET EDO A 272 4 HET EDO A 273 4 HETNAM MSE SELENOMETHIONINE HETNAM NO3 NITRATE ION HETNAM EDO 1,2-ETHANEDIOL HETSYN EDO ETHYLENE GLYCOL FORMUL 1 MSE 7(C5 H11 N O2 SE) FORMUL 2 NO3 3(N O3 1-) FORMUL 5 EDO 5(C2 H6 O2) FORMUL 10 HOH *150(H2 O) HELIX 1 1 SER A 11 SER A 13 5 3 HELIX 2 2 ASP A 14 LYS A 19 1 6 HELIX 3 3 GLY A 29 ASP A 40 1 12 HELIX 4 4 THR A 43 ASP A 58 1 16 HELIX 5 5 PRO A 93 ARG A 96 5 4 HELIX 6 6 ARG A 99 ARG A 113 1 15 HELIX 7 7 ASN A 127 GLY A 138 1 12 HELIX 8 8 ASP A 185 TYR A 193 1 9 HELIX 9 9 ASP A 223 ARG A 232 1 10 HELIX 10 10 ARG A 243 ASN A 248 1 6 SHEET 1 A12 VAL A 6 ARG A 9 0 SHEET 2 A12 VAL A 61 VAL A 66 -1 O VAL A 63 N ASP A 8 SHEET 3 A12 ARG A 69 LYS A 78 -1 O VAL A 71 N LEU A 64 SHEET 4 A12 VAL A 84 VAL A 91 -1 O GLY A 87 N HIS A 75 SHEET 5 A12 ARG A 118 TYR A 124 1 O ARG A 120 N LEU A 86 SHEET 6 A12 SER A 257 ARG A 264 -1 O TRP A 261 N SER A 121 SHEET 7 A12 HIS A 140 GLY A 152 -1 N VAL A 142 O VAL A 260 SHEET 8 A12 GLY A 236 VAL A 242 -1 O ILE A 238 N PHE A 150 SHEET 9 A12 GLY A 213 ASP A 220 1 N LEU A 216 O THR A 239 SHEET 10 A12 THR A 203 TYR A 210 -1 N TYR A 206 O PHE A 217 SHEET 11 A12 LEU A 197 GLY A 201 -1 N ILE A 198 O VAL A 205 SHEET 12 A12 VAL A 163 TYR A 167 1 N ARG A 166 O GLY A 201 SHEET 1 B 2 CYS A 173 ILE A 176 0 SHEET 2 B 2 LYS A 179 CYS A 182 -1 O LYS A 179 N ILE A 176 SSBOND *** CYS A 173 CYS A 182 1555 1555 2.02 LINK C THR A 43 N MSE A 44 1555 1555 1.32 LINK C MSE A 44 N ASP A 45 1555 1555 1.32 LINK C HIS A 75 N MSE A 76 1555 1555 1.33 LINK C MSE A 76 N GLU A 77 1555 1555 1.31 LINK C VAL A 84 N MSE A 85 1555 1555 1.32 LINK C MSE A 85 N LEU A 86 1555 1555 1.31 LINK C GLY A 101 N MSE A 102 1555 1555 1.32 LINK C MSE A 102 N SER A 103 1555 1555 1.32 LINK C ILE A 104 N MSE A 105 1555 1555 1.32 LINK C MSE A 105 N GLN A 106 1555 1555 1.32 LINK C TYR A 180 N MSE A 181 1555 1555 1.32 LINK C MSE A 181 N CYS A 182 1555 1555 1.31 LINK C SER A 233 N MSE A 234 1555 1555 1.31 LINK C MSE A 234 N ASN A 235 1555 1555 1.31 SITE *** AC1 7 ASP A 45 VAL A 48 GLY A 88 ARG A 90 SITE *** AC1 7 HOH A 291 HOH A 297 HOH A 368 SITE *** AC2 6 ASP A 81 GLY A 82 SER A 83 THR A 116 SITE *** AC2 6 GLU A 117 ARG A 118 SITE *** AC3 6 SER A 121 ALA A 122 VAL A 123 SER A 130 SITE *** AC3 6 HOH A 307 HOH A 333 SITE *** AC4 8 TRP A 55 HIS A 75 MSE A 85 GLY A 87 SITE *** AC4 8 TRP A 178 HOH A 280 HOH A 285 HOH A 308 SITE *** AC5 2 GLU A 144 LYS A 244 SITE *** AC6 5 HIS A 135 HIS A 140 GLN A 141 ALA A 245 SITE *** AC6 5 TRP A 261 SITE *** AC7 4 SER A 125 ALA A 255 SER A 256 HOH A 338 SITE *** AC8 3 GLU A 128 LEU A 131 HIS A 135 CRYST1 86.820 86.820 67.260 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 0.011518 0.000000 0.000000 0.00000 SCALE2 0.000000 0.011518 0.000000 0.00000 SCALE3 0.000000 0.000000 0.014868 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 244 LYS NZ :NH3+ 178:sc= 0.0377! (180deg=-0.456) USER MOD Set 1.2: A 270 EDO O1 : rot -44:sc= 0.811 USER MOD Set 2.1: A 145 TYR OH : rot 154:sc= 1.07 USER MOD Set 2.2: A 219 ASN : amide:sc= 1.9 K(o=3,f=-3.2!) USER MOD Set 3.1: A 179 LYS NZ :NH3+ 150:sc= 1.94 (180deg=0.339) USER MOD Set 3.2: A 193 TYR OH : rot 180:sc= 1.14 USER MOD Set 4.1: A 164 ASN : amide:sc= -2.08! C(o=-4.6!,f=-7.4!) USER MOD Set 4.2: A 190 HIS : no HD1:sc= -2.52! C(o=-4.6!,f=-9.4!) USER MOD Set 5.1: A 127 ASN : amide:sc= -0.14 K(o=-0.091,f=-3.9!) USER MOD Set 5.2: A 130 SER OG A: rot -151:sc= 0.0488 USER MOD Set 6.1: A 125 SER OG : rot 92:sc= 1.86 USER MOD Set 6.2: A 272 EDO O2 : rot -3:sc= 1.12 USER MOD Set 7.1: A 60 SER OG : rot -46:sc= 0.195 USER MOD Set 7.2: A 75 HIS : no HE2:sc= 1.85 K(o=4.1,f=-11!) USER MOD Set 7.3: A 269 EDO O1 : rot 5:sc= 1.04 USER MOD Set 7.4: A 269 EDO O2 : rot 180:sc= 1.03 USER MOD Set 8.1: A 43 THR OG1 : rot -170:sc= 1.35 USER MOD Set 8.2: A 241 TYR OH : rot 12:sc= 1.45 USER MOD Set 9.1: A 23 SER OG : rot -133:sc= 2.5 USER MOD Set 9.2: A 35 TYR OH : rot 172:sc= 2.3 USER MOD Set10.1: A 11 SER OG : rot 166:sc= 0.647 USER MOD Set10.2: A 13 SER OG : rot -45:sc= 0.544 USER MOD Single : A 19 LYS NZ :NH3+ -152:sc= 0.00827 (180deg=0) USER MOD Single : A 20 THR OG1 : rot -72:sc= 1.35 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -1.83 K(o=-1.8,f=-4.8!) USER MOD Single : A 25 THR OG1 : rot -91:sc= 0.0041 USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 170:sc= 0.153 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ A:NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ B:NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 THR OG1 : rot -74:sc= 3.37 USER MOD Single : A 47 TYR OH : rot 45:sc= 1.55 USER MOD Single : A 50 LYS NZ :NH3+ -170:sc= 1.73 (180deg=1.64) USER MOD Single : A 57 ASN : amide:sc= -1.22 K(o=-1.2,f=-4.2!) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 82:sc= 0.156 USER MOD Single : A 78 LYS NZ :NH3+ 169:sc= 0.244 (180deg=0.218) USER MOD Single : A 83 SER OG : rot -68:sc= 1.3 USER MOD Single : A 92 HIS : no HD1:sc= -6.61! C(o=-6.6!,f=-8.9!) USER MOD Single : A 95 TYR OH : rot -128:sc= 1.44 USER MOD Single : A 98 SER OG : rot -86:sc= 1.22 USER MOD Single : A 103 SER OG : rot 71:sc= 0.326 USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 108 THR OG1 : rot 77:sc= 0.452 USER MOD Single : A 110 GLN : amide:sc= -0.143 K(o=-0.14,f=-1.6!) USER MOD Single : A 115 LYS NZ :NH3+ 167:sc= 0.43 (180deg=0.352) USER MOD Single : A 116 THR OG1 : rot 84:sc= 1.24 USER MOD Single : A 121 SER OG : rot -111:sc= 0.882 USER MOD Single : A 124 TYR OH : rot 18:sc= 1.26 USER MOD Single : A 130 SER OG B: rot 71:sc= 0.687 USER MOD Single : A 135 HIS : no HD1:sc= 0.302 X(o=0.3,f=0.0086) USER MOD Single : A 140 HIS : no HD1:sc= 0 X(o=0,f=-0.0034) USER MOD Single : A 141 GLN : amide:sc= 0.745 X(o=0.74,f=0.47) USER MOD Single : A 148 TYR OH : rot 168:sc= 0.00364 USER MOD Single : A 149 THR OG1 : rot 125:sc= 2.3 USER MOD Single : A 151 GLN : amide:sc= -0.155 K(o=-0.15,f=-1.9!) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 TYR OH : rot -23:sc= 1.42 USER MOD Single : A 180 TYR OH : rot 174:sc= 0.923 USER MOD Single : A 183 SER OG : rot -112:sc= 1.21 USER MOD Single : A 194 SER OG : rot 180:sc= 0 USER MOD Single : A 195 ASN : amide:sc= -0.0903 K(o=-0.09,f=-1.3!) USER MOD Single : A 196 ASN : amide:sc= 1.09 K(o=1.1,f=-0.04) USER MOD Single : A 202 SER OG : rot 180:sc= 0 USER MOD Single : A 203 THR OG1 : rot -94:sc= 0.284 USER MOD Single : A 206 TYR OH : rot 15:sc= 1.11 USER MOD Single : A 210 TYR OH : rot 156:sc= 1.71 USER MOD Single : A 221 SER OG : rot 73:sc= 1.53 USER MOD Single : A 225 SER OG : rot 78:sc= 0.972 USER MOD Single : A 226 SER OG : rot 104:sc= 1.46 USER MOD Single : A 231 TYR OH : rot 180:sc= 0 USER MOD Single : A 233 SER OG : rot 180:sc= 0 USER MOD Single : A 235 ASN : amide:sc= -0.129 K(o=-0.13,f=-1.1) USER MOD Single : A 239 THR OG1 : rot 91:sc= 1.71 USER MOD Single : A 248 ASN : amide:sc= -0.0188 K(o=-0.019,f=-0.74) USER MOD Single : A 252 TYR OH : rot 180:sc= 0 USER MOD Single : A 256 SER OG : rot -40:sc= 1.45 USER MOD Single : A 257 SER OG : rot -171:sc= 1.18 USER MOD Single : A 259 THR OG1 : rot -31:sc= 1.31 USER MOD Single : A 263 TYR OH : rot 159:sc= 1.4 USER MOD Single : A 265 TYR OH : rot -39:sc= 1.2 USER MOD Single : A 270 EDO O2 : rot 180:sc= 0 USER MOD Single : A 271 EDO O1 : rot -86:sc= 0.135 USER MOD Single : A 271 EDO O2 : rot 180:sc= 0 USER MOD Single : A 272 EDO O1 : rot -101:sc= 0.943 USER MOD Single : A 273 EDO O1 : rot -33:sc= 0.00896 USER MOD Single : A 273 EDO O2 : rot 180:sc= 0.00794 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 5 46.886 6.530 21.717 1.00 37.65 N ATOM 2 CA ILE A 5 45.874 7.619 21.718 1.00 37.55 C ATOM 3 C ILE A 5 44.554 7.130 21.126 1.00 37.03 C ATOM 4 O ILE A 5 44.432 6.806 19.951 1.00 38.36 O ATOM 5 CB ILE A 5 46.385 8.908 21.001 1.00 37.96 C ATOM 0 HA ILE A 5 45.717 7.867 22.643 1.00 37.55 H new ATOM 6 N VAL A 6 43.579 7.082 22.018 1.00 35.43 N ATOM 7 CA VAL A 6 42.221 6.632 21.764 1.00 33.24 C ATOM 8 C VAL A 6 41.177 7.770 21.735 1.00 30.77 C ATOM 9 O VAL A 6 41.111 8.573 22.625 1.00 28.72 O ATOM 10 CB VAL A 6 41.786 5.691 22.906 1.00 33.76 C ATOM 11 CG1 VAL A 6 40.253 5.521 22.918 1.00 32.83 C ATOM 12 CG2 VAL A 6 42.567 4.348 22.848 1.00 34.61 C ATOM 0 H VAL A 6 43.698 7.325 22.834 1.00 35.43 H new ATOM 0 HA VAL A 6 42.244 6.208 20.892 1.00 33.24 H new ATOM 0 HB VAL A 6 42.018 6.094 23.758 1.00 33.76 H new ATOM 0 HG11 VAL A 6 39.999 4.927 23.642 1.00 32.83 H new ATOM 0 HG12 VAL A 6 39.832 6.385 23.047 1.00 32.83 H new ATOM 0 HG13 VAL A 6 39.962 5.143 22.073 1.00 32.83 H new ATOM 0 HG21 VAL A 6 42.278 3.774 23.574 1.00 34.61 H new ATOM 0 HG22 VAL A 6 42.394 3.909 22.000 1.00 34.61 H new ATOM 0 HG23 VAL A 6 43.517 4.522 22.933 1.00 34.61 H new ATOM 13 N PHE A 7 40.317 7.726 20.726 1.00 29.02 N ATOM 14 CA PHE A 7 39.209 8.692 20.499 1.00 28.44 C ATOM 15 C PHE A 7 37.924 8.131 21.085 1.00 28.82 C ATOM 16 O PHE A 7 37.444 7.079 20.697 1.00 28.40 O ATOM 17 CB PHE A 7 39.058 8.958 18.999 1.00 28.73 C ATOM 18 CG PHE A 7 37.989 9.962 18.636 1.00 26.56 C ATOM 19 CD1 PHE A 7 38.175 11.301 18.867 1.00 25.18 C ATOM 20 CD2 PHE A 7 36.839 9.565 17.984 1.00 26.51 C ATOM 21 CE1 PHE A 7 37.221 12.219 18.505 1.00 24.81 C ATOM 22 CE2 PHE A 7 35.865 10.493 17.611 1.00 24.73 C ATOM 23 CZ PHE A 7 36.063 11.821 17.889 1.00 24.55 C ATOM 0 H PHE A 7 40.352 7.114 20.123 1.00 29.02 H new ATOM 0 HA PHE A 7 39.407 9.533 20.939 1.00 28.44 H new ATOM 0 HB2 PHE A 7 39.908 9.270 18.652 1.00 28.73 H new ATOM 0 HB3 PHE A 7 38.861 8.119 18.553 1.00 28.73 H new ATOM 0 HD1 PHE A 7 38.959 11.591 19.275 1.00 25.18 H new ATOM 0 HD2 PHE A 7 36.711 8.665 17.790 1.00 26.51 H new ATOM 0 HE1 PHE A 7 37.362 13.122 18.680 1.00 24.81 H new ATOM 0 HE2 PHE A 7 35.090 10.214 17.179 1.00 24.73 H new ATOM 0 HZ PHE A 7 35.415 12.448 17.661 1.00 24.55 H new ATOM 24 N ASP A 8 37.353 8.865 22.023 1.00 29.09 N ATOM 25 CA ASP A 8 36.234 8.365 22.805 1.00 29.51 C ATOM 26 C ASP A 8 35.291 9.507 23.184 1.00 28.89 C ATOM 27 O ASP A 8 35.671 10.672 23.185 1.00 28.34 O ATOM 28 CB ASP A 8 36.852 7.819 24.106 1.00 30.26 C ATOM 29 CG ASP A 8 35.994 6.824 24.809 1.00 33.40 C ATOM 30 OD1 ASP A 8 35.124 6.191 24.158 1.00 38.27 O ATOM 31 OD2 ASP A 8 36.214 6.630 26.015 1.00 37.92 O ATOM 0 H ASP A 8 37.600 9.664 22.225 1.00 29.09 H new ATOM 0 HA ASP A 8 35.734 7.701 22.305 1.00 29.51 H new ATOM 0 HB2 ASP A 8 37.707 7.409 23.901 1.00 30.26 H new ATOM 0 HB3 ASP A 8 37.030 8.561 24.705 1.00 30.26 H new ATOM 32 N ARG A 9 34.088 9.165 23.598 1.00 27.97 N ATOM 33 CA ARG A 9 33.180 10.188 24.029 1.00 28.37 C ATOM 34 C ARG A 9 33.615 10.630 25.426 1.00 27.27 C ATOM 35 O ARG A 9 34.080 9.823 26.240 1.00 27.02 O ATOM 36 CB ARG A 9 31.719 9.737 24.057 1.00 28.65 C ATOM 37 CG ARG A 9 30.794 10.887 24.365 1.00 31.29 C ATOM 38 CD ARG A 9 29.399 10.440 24.702 1.00 35.69 C ATOM 39 NE ARG A 9 28.671 9.929 23.542 1.00 38.56 N ATOM 0 H ARG A 9 33.786 8.361 23.635 1.00 27.97 H new ATOM 0 HA ARG A 9 33.218 10.916 23.389 1.00 28.37 H new ATOM 0 HB2 ARG A 9 31.482 9.350 23.200 1.00 28.65 H new ATOM 0 HB3 ARG A 9 31.606 9.041 24.724 1.00 28.65 H new ATOM 0 HG2 ARG A 9 31.154 11.396 25.108 1.00 31.29 H new ATOM 0 HG3 ARG A 9 30.762 11.484 23.601 1.00 31.29 H new ATOM 0 HD2 ARG A 9 29.441 9.750 25.382 1.00 35.69 H new ATOM 0 HD3 ARG A 9 28.909 11.185 25.084 1.00 35.69 H new ATOM 40 N GLY A 10 33.554 11.939 25.624 1.00 26.19 N ATOM 41 CA GLY A 10 33.774 12.570 26.945 1.00 25.45 C ATOM 42 C GLY A 10 32.662 12.194 27.942 1.00 25.13 C ATOM 43 O GLY A 10 31.504 12.021 27.599 1.00 23.68 O ATOM 0 H GLY A 10 33.383 12.502 24.997 1.00 26.19 H new ATOM 0 HA2 GLY A 10 34.634 12.293 27.298 1.00 25.45 H new ATOM 0 HA3 GLY A 10 33.806 13.534 26.843 1.00 25.45 H new ATOM 44 N SER A 11 33.028 12.022 29.196 1.00 25.91 N ATOM 45 CA SER A 11 32.023 11.701 30.204 1.00 26.39 C ATOM 46 C SER A 11 32.161 12.605 31.397 1.00 25.91 C ATOM 47 O SER A 11 33.177 13.229 31.542 1.00 26.14 O ATOM 48 CB SER A 11 32.119 10.246 30.633 1.00 26.43 C ATOM 49 OG SER A 11 32.969 10.125 31.754 1.00 30.76 O ATOM 0 H SER A 11 33.835 12.084 29.487 1.00 25.91 H new ATOM 0 HA SER A 11 31.150 11.842 29.805 1.00 26.39 H new ATOM 0 HB2 SER A 11 31.237 9.906 30.849 1.00 26.43 H new ATOM 0 HB3 SER A 11 32.459 9.707 29.901 1.00 26.43 H new ATOM 0 HG SER A 11 32.864 9.369 32.105 1.00 30.76 H new ATOM 50 N PRO A 12 31.110 12.714 32.234 1.00 27.04 N ATOM 51 CA PRO A 12 31.182 13.605 33.391 1.00 27.17 C ATOM 52 C PRO A 12 32.371 13.369 34.298 1.00 27.71 C ATOM 53 O PRO A 12 32.782 14.283 35.008 1.00 27.03 O ATOM 54 CB PRO A 12 29.862 13.337 34.115 1.00 27.60 C ATOM 55 CG PRO A 12 28.912 13.039 33.003 1.00 27.75 C ATOM 56 CD PRO A 12 29.732 12.213 32.037 1.00 26.23 C ATOM 0 HA PRO A 12 31.307 14.527 33.115 1.00 27.17 H new ATOM 0 HB2 PRO A 12 29.937 12.591 34.731 1.00 27.60 H new ATOM 0 HB3 PRO A 12 29.576 14.105 34.633 1.00 27.60 H new ATOM 0 HG2 PRO A 12 28.136 12.550 33.319 1.00 27.75 H new ATOM 0 HG3 PRO A 12 28.585 13.852 32.587 1.00 27.75 H new ATOM 0 HD2 PRO A 12 29.666 11.265 32.232 1.00 26.23 H new ATOM 0 HD3 PRO A 12 29.435 12.335 31.122 1.00 26.23 H new ATOM 57 N SER A 13 32.947 12.167 34.257 1.00 27.49 N ATOM 58 CA SER A 13 34.093 11.883 35.106 1.00 27.19 C ATOM 59 C SER A 13 35.337 12.565 34.568 1.00 26.95 C ATOM 60 O SER A 13 36.346 12.684 35.275 1.00 25.47 O ATOM 61 CB SER A 13 34.328 10.377 35.275 1.00 28.01 C ATOM 62 OG SER A 13 34.606 9.756 34.043 1.00 30.75 O ATOM 0 H SER A 13 32.693 11.517 33.754 1.00 27.49 H new ATOM 0 HA SER A 13 33.896 12.241 35.986 1.00 27.19 H new ATOM 0 HB2 SER A 13 35.067 10.230 35.886 1.00 28.01 H new ATOM 0 HB3 SER A 13 33.544 9.969 35.675 1.00 28.01 H new ATOM 0 HG SER A 13 34.062 10.027 33.463 1.00 30.75 H new ATOM 63 N ASP A 14 35.224 13.073 33.334 1.00 25.69 N ATOM 64 CA ASP A 14 36.332 13.752 32.640 1.00 24.76 C ATOM 65 C ASP A 14 36.300 15.250 32.877 1.00 24.54 C ATOM 66 O ASP A 14 37.237 15.954 32.520 1.00 23.59 O ATOM 67 CB ASP A 14 36.252 13.549 31.108 1.00 25.74 C ATOM 68 CG ASP A 14 36.361 12.095 30.687 1.00 23.97 C ATOM 69 OD1 ASP A 14 37.173 11.364 31.261 1.00 25.37 O ATOM 70 OD2 ASP A 14 35.679 11.704 29.718 1.00 22.35 O ATOM 0 H ASP A 14 34.499 13.034 32.873 1.00 25.69 H new ATOM 0 HA ASP A 14 37.145 13.362 32.998 1.00 24.76 H new ATOM 0 HB2 ASP A 14 35.412 13.911 30.784 1.00 25.74 H new ATOM 0 HB3 ASP A 14 36.962 14.056 30.684 1.00 25.74 H new ATOM 71 N ILE A 15 35.234 15.732 33.510 1.00 24.22 N ATOM 72 CA ILE A 15 35.001 17.186 33.624 1.00 23.92 C ATOM 73 C ILE A 15 36.097 17.943 34.374 1.00 23.51 C ATOM 74 O ILE A 15 36.490 19.026 33.974 1.00 21.42 O ATOM 75 CB ILE A 15 33.621 17.543 34.195 1.00 24.66 C ATOM 76 CG1 ILE A 15 32.536 17.048 33.228 1.00 27.38 C ATOM 77 CG2 ILE A 15 33.430 19.055 34.292 1.00 23.78 C ATOM 78 CD1 ILE A 15 31.049 17.345 33.710 1.00 31.39 C ATOM 0 H ILE A 15 34.632 15.243 33.881 1.00 24.22 H new ATOM 0 HA ILE A 15 35.029 17.487 32.702 1.00 23.92 H new ATOM 0 HB ILE A 15 33.558 17.136 35.073 1.00 24.66 H new ATOM 0 HG12 ILE A 15 32.674 17.464 32.363 1.00 27.38 H new ATOM 0 HG13 ILE A 15 32.640 16.092 33.103 1.00 27.38 H new ATOM 0 HG21 ILE A 15 32.551 19.248 34.655 1.00 23.78 H new ATOM 0 HG22 ILE A 15 34.109 19.431 34.874 1.00 23.78 H new ATOM 0 HG23 ILE A 15 33.508 19.449 33.409 1.00 23.78 H new ATOM 0 HD11 ILE A 15 30.422 17.006 33.053 1.00 31.39 H new ATOM 0 HD12 ILE A 15 30.892 16.909 34.562 1.00 31.39 H new ATOM 0 HD13 ILE A 15 30.926 18.302 33.810 1.00 31.39 H new ATOM 79 N ASP A 16 36.589 17.369 35.456 1.00 23.21 N ATOM 80 CA ASP A 16 37.602 18.077 36.236 1.00 24.33 C ATOM 81 C ASP A 16 38.875 18.295 35.420 1.00 23.54 C ATOM 82 O ASP A 16 39.542 19.318 35.521 1.00 23.08 O ATOM 83 CB ASP A 16 37.931 17.354 37.537 1.00 25.30 C ATOM 84 CG ASP A 16 37.031 17.753 38.683 1.00 27.12 C ATOM 85 OD1 ASP A 16 36.206 18.686 38.546 1.00 28.82 O ATOM 86 OD2 ASP A 16 37.190 17.130 39.759 1.00 31.08 O ATOM 0 H ASP A 16 36.363 16.595 35.754 1.00 23.21 H new ATOM 0 HA ASP A 16 37.225 18.941 36.463 1.00 24.33 H new ATOM 0 HB2 ASP A 16 37.860 16.397 37.395 1.00 25.30 H new ATOM 0 HB3 ASP A 16 38.853 17.537 37.778 1.00 25.30 H new ATOM 87 N GLU A 17 39.170 17.332 34.556 1.00 23.82 N ATOM 88 CA GLU A 17 40.366 17.401 33.720 1.00 22.81 C ATOM 89 C GLU A 17 40.108 18.363 32.596 1.00 21.75 C ATOM 90 O GLU A 17 40.888 19.241 32.337 1.00 19.96 O ATOM 91 CB GLU A 17 40.776 16.024 33.207 1.00 23.59 C ATOM 92 CG GLU A 17 41.438 15.214 34.309 1.00 24.75 C ATOM 93 CD GLU A 17 41.391 13.736 34.096 1.00 27.31 C ATOM 94 OE1 GLU A 17 40.327 13.109 34.333 1.00 29.69 O ATOM 95 OE2 GLU A 17 42.441 13.173 33.742 1.00 31.66 O ATOM 0 H GLU A 17 38.691 16.628 34.437 1.00 23.82 H new ATOM 0 HA GLU A 17 41.113 17.721 34.250 1.00 22.81 H new ATOM 0 HB2 GLU A 17 39.996 15.552 32.877 1.00 23.59 H new ATOM 0 HB3 GLU A 17 41.387 16.121 32.460 1.00 23.59 H new ATOM 0 HG2 GLU A 17 42.365 15.490 34.387 1.00 24.75 H new ATOM 0 HG3 GLU A 17 41.008 15.423 35.153 1.00 24.75 H new ATOM 96 N ILE A 18 38.936 18.215 32.002 1.00 22.08 N ATOM 97 CA ILE A 18 38.520 19.019 30.877 1.00 22.47 C ATOM 98 C ILE A 18 38.544 20.516 31.208 1.00 22.69 C ATOM 99 O ILE A 18 38.908 21.348 30.378 1.00 21.12 O ATOM 100 CB ILE A 18 37.115 18.620 30.340 1.00 22.37 C ATOM 101 CG1 ILE A 18 37.202 17.243 29.632 1.00 24.25 C ATOM 102 CG2 ILE A 18 36.617 19.707 29.389 1.00 21.73 C ATOM 103 CD1 ILE A 18 35.820 16.571 29.204 1.00 21.65 C ATOM 0 H ILE A 18 38.352 17.634 32.248 1.00 22.08 H new ATOM 0 HA ILE A 18 39.167 18.843 30.176 1.00 22.47 H new ATOM 0 HB ILE A 18 36.484 18.540 31.072 1.00 22.37 H new ATOM 0 HG12 ILE A 18 37.749 17.345 28.837 1.00 24.25 H new ATOM 0 HG13 ILE A 18 37.668 16.629 30.220 1.00 24.25 H new ATOM 0 HG21 ILE A 18 35.741 19.464 29.050 1.00 21.73 H new ATOM 0 HG22 ILE A 18 36.557 20.550 29.864 1.00 21.73 H new ATOM 0 HG23 ILE A 18 37.236 19.797 28.648 1.00 21.73 H new ATOM 0 HD11 ILE A 18 35.994 15.720 28.773 1.00 21.65 H new ATOM 0 HD12 ILE A 18 35.272 16.429 29.991 1.00 21.65 H new ATOM 0 HD13 ILE A 18 35.353 17.156 28.587 1.00 21.65 H new ATOM 104 N LYS A 19 38.169 20.825 32.440 1.00 22.19 N ATOM 105 CA LYS A 19 38.095 22.223 32.895 1.00 22.25 C ATOM 106 C LYS A 19 39.431 22.908 32.901 1.00 22.33 C ATOM 107 O LYS A 19 39.472 24.124 32.892 1.00 21.60 O ATOM 108 CB LYS A 19 37.523 22.360 34.314 1.00 22.79 C ATOM 109 CG LYS A 19 36.016 22.358 34.467 1.00 25.41 C ATOM 110 CD LYS A 19 35.759 21.820 35.875 1.00 28.57 C ATOM 111 CE LYS A 19 34.366 21.916 36.377 1.00 31.55 C ATOM 112 NZ LYS A 19 34.310 21.232 37.788 1.00 30.81 N ATOM 0 H LYS A 19 37.951 20.245 33.036 1.00 22.19 H new ATOM 0 HA LYS A 19 37.504 22.644 32.251 1.00 22.25 H new ATOM 0 HB2 LYS A 19 37.879 21.635 34.851 1.00 22.79 H new ATOM 0 HB3 LYS A 19 37.861 23.186 34.694 1.00 22.79 H new ATOM 0 HG2 LYS A 19 35.651 23.251 34.361 1.00 25.41 H new ATOM 0 HG3 LYS A 19 35.596 21.798 33.795 1.00 25.41 H new ATOM 0 HD2 LYS A 19 36.026 20.888 35.897 1.00 28.57 H new ATOM 0 HD3 LYS A 19 36.337 22.295 36.492 1.00 28.57 H new ATOM 0 HE2 LYS A 19 34.091 22.844 36.439 1.00 31.55 H new ATOM 0 HE3 LYS A 19 33.754 21.479 35.764 1.00 31.55 H new ATOM 0 HZ1 LYS A 19 33.491 20.913 37.931 1.00 30.81 H new ATOM 0 HZ2 LYS A 19 34.898 20.564 37.818 1.00 30.81 H new ATOM 0 HZ3 LYS A 19 34.509 21.830 38.416 1.00 30.81 H new ATOM 113 N THR A 20 40.510 22.131 32.916 1.00 22.33 N ATOM 114 CA THR A 20 41.895 22.674 32.872 1.00 21.95 C ATOM 115 C THR A 20 42.482 22.829 31.455 1.00 21.66 C ATOM 116 O THR A 20 43.575 23.371 31.244 1.00 20.96 O ATOM 117 CB THR A 20 42.850 21.803 33.655 1.00 23.11 C ATOM 118 OG1 THR A 20 42.994 20.543 32.980 1.00 24.32 O ATOM 119 CG2 THR A 20 42.345 21.632 35.132 1.00 21.45 C ATOM 0 H THR A 20 40.474 21.273 32.952 1.00 22.33 H new ATOM 0 HA THR A 20 41.809 23.558 33.263 1.00 21.95 H new ATOM 0 HB THR A 20 43.723 22.222 33.703 1.00 23.11 H new ATOM 0 HG1 THR A 20 42.288 20.096 33.067 1.00 24.32 H new ATOM 0 HG21 THR A 20 42.966 21.072 35.624 1.00 21.45 H new ATOM 0 HG22 THR A 20 42.288 22.502 35.558 1.00 21.45 H new ATOM 0 HG23 THR A 20 41.468 21.217 35.128 1.00 21.45 H new ATOM 120 N PHE A 21 41.729 22.372 30.477 1.00 20.88 N ATOM 121 CA PHE A 21 42.146 22.459 29.062 1.00 21.06 C ATOM 122 C PHE A 21 41.986 23.915 28.539 1.00 21.81 C ATOM 123 O PHE A 21 41.112 24.670 29.002 1.00 19.71 O ATOM 124 CB PHE A 21 41.272 21.535 28.185 1.00 21.15 C ATOM 125 CG PHE A 21 41.472 20.026 28.390 1.00 19.49 C ATOM 126 CD1 PHE A 21 42.230 19.520 29.407 1.00 17.37 C ATOM 127 CD2 PHE A 21 40.815 19.121 27.564 1.00 18.76 C ATOM 128 CE1 PHE A 21 42.326 18.134 29.609 1.00 20.89 C ATOM 129 CE2 PHE A 21 40.958 17.782 27.728 1.00 18.34 C ATOM 130 CZ PHE A 21 41.699 17.276 28.770 1.00 19.28 C ATOM 0 H PHE A 21 40.962 22.001 30.597 1.00 20.88 H new ATOM 0 HA PHE A 21 43.075 22.186 29.010 1.00 21.06 H new ATOM 0 HB2 PHE A 21 40.340 21.746 28.353 1.00 21.15 H new ATOM 0 HB3 PHE A 21 41.446 21.743 27.254 1.00 21.15 H new ATOM 0 HD1 PHE A 21 42.688 20.100 29.972 1.00 17.37 H new ATOM 0 HD2 PHE A 21 40.266 19.440 26.885 1.00 18.76 H new ATOM 0 HE1 PHE A 21 42.823 17.804 30.323 1.00 20.89 H new ATOM 0 HE2 PHE A 21 40.550 17.199 27.129 1.00 18.34 H new ATOM 0 HZ PHE A 21 41.769 16.357 28.897 1.00 19.28 H new ATOM 131 N THR A 22 42.835 24.303 27.582 1.00 23.01 N ATOM 132 CA THR A 22 42.706 25.610 26.905 1.00 24.45 C ATOM 133 C THR A 22 42.709 25.489 25.382 1.00 22.76 C ATOM 134 O THR A 22 43.212 24.538 24.805 1.00 20.46 O ATOM 135 CB THR A 22 43.846 26.611 27.267 1.00 24.47 C ATOM 136 OG1 THR A 22 45.108 26.114 26.811 1.00 31.84 O ATOM 137 CG2 THR A 22 43.945 26.845 28.811 1.00 28.98 C ATOM 0 H THR A 22 43.495 23.826 27.306 1.00 23.01 H new ATOM 0 HA THR A 22 41.853 25.945 27.224 1.00 24.45 H new ATOM 0 HB THR A 22 43.632 27.451 26.831 1.00 24.47 H new ATOM 0 HG1 THR A 22 45.713 26.661 27.010 1.00 31.84 H new ATOM 0 HG21 THR A 22 44.662 27.471 28.998 1.00 28.98 H new ATOM 0 HG22 THR A 22 43.107 27.207 29.138 1.00 28.98 H new ATOM 0 HG23 THR A 22 44.128 26.002 29.255 1.00 28.98 H new ATOM 138 N SER A 23 42.112 26.496 24.758 1.00 22.63 N ATOM 139 CA SER A 23 42.119 26.651 23.298 1.00 23.21 C ATOM 140 C SER A 23 43.500 27.018 22.755 1.00 23.43 C ATOM 141 O SER A 23 43.732 26.961 21.547 1.00 23.85 O ATOM 142 CB SER A 23 41.150 27.746 22.870 1.00 24.16 C ATOM 143 OG SER A 23 41.554 28.989 23.377 1.00 22.14 O ATOM 0 H SER A 23 41.685 27.119 25.170 1.00 22.63 H new ATOM 0 HA SER A 23 41.854 25.791 22.937 1.00 23.21 H new ATOM 0 HB2 SER A 23 41.106 27.785 21.902 1.00 24.16 H new ATOM 0 HB3 SER A 23 40.257 27.537 23.187 1.00 24.16 H new ATOM 0 HG SER A 23 40.893 29.382 23.716 1.00 22.14 H new ATOM 144 N ASN A 24 44.397 27.396 23.646 1.00 23.49 N ATOM 145 CA ASN A 24 45.783 27.804 23.310 1.00 24.56 C ATOM 146 C ASN A 24 46.583 26.561 22.987 1.00 26.60 C ATOM 147 O ASN A 24 47.046 25.837 23.846 1.00 26.51 O ATOM 148 CB ASN A 24 46.401 28.606 24.478 1.00 24.65 C ATOM 149 CG ASN A 24 47.743 29.286 24.142 1.00 24.96 C ATOM 150 OD1 ASN A 24 48.453 28.898 23.239 1.00 23.78 O ATOM 151 ND2 ASN A 24 48.079 30.309 24.915 1.00 20.67 N ATOM 0 H ASN A 24 44.229 27.429 24.489 1.00 23.49 H new ATOM 0 HA ASN A 24 45.789 28.387 22.535 1.00 24.56 H new ATOM 0 HB2 ASN A 24 45.768 29.285 24.760 1.00 24.65 H new ATOM 0 HB3 ASN A 24 46.533 28.010 25.232 1.00 24.65 H new ATOM 0 HD21 ASN A 24 48.822 30.721 24.784 1.00 20.67 H new ATOM 0 HD22 ASN A 24 47.554 30.561 25.548 1.00 20.67 H new ATOM 152 N THR A 25 46.735 26.325 21.697 1.00 28.90 N ATOM 153 CA THR A 25 47.396 25.128 21.201 1.00 31.13 C ATOM 154 C THR A 25 48.764 25.449 20.594 1.00 32.07 C ATOM 155 O THR A 25 49.428 24.593 20.015 1.00 33.77 O ATOM 156 CB THR A 25 46.591 24.493 20.079 1.00 31.54 C ATOM 157 OG1 THR A 25 46.474 25.453 19.034 1.00 31.40 O ATOM 158 CG2 THR A 25 45.203 24.048 20.571 1.00 30.43 C ATOM 0 H THR A 25 46.457 26.855 21.079 1.00 28.90 H new ATOM 0 HA THR A 25 47.483 24.536 21.965 1.00 31.13 H new ATOM 0 HB THR A 25 47.042 23.697 19.758 1.00 31.54 H new ATOM 0 HG1 THR A 25 45.774 25.904 19.145 1.00 31.40 H new ATOM 0 HG21 THR A 25 44.712 23.647 19.836 1.00 30.43 H new ATOM 0 HG22 THR A 25 45.305 23.398 21.284 1.00 30.43 H new ATOM 0 HG23 THR A 25 44.715 24.818 20.903 1.00 30.43 H new ATOM 159 N TRP A 26 49.166 26.688 20.770 1.00 32.58 N ATOM 160 CA TRP A 26 50.415 27.197 20.199 1.00 32.86 C ATOM 161 C TRP A 26 51.673 26.745 20.958 1.00 34.55 C ATOM 162 O TRP A 26 51.623 26.363 22.130 1.00 34.80 O ATOM 163 CB TRP A 26 50.367 28.738 20.128 1.00 31.85 C ATOM 164 CG TRP A 26 49.356 29.301 19.165 1.00 28.02 C ATOM 165 CD1 TRP A 26 48.297 28.646 18.594 1.00 27.40 C ATOM 166 CD2 TRP A 26 49.248 30.673 18.752 1.00 26.26 C ATOM 167 NE1 TRP A 26 47.566 29.520 17.787 1.00 26.12 N ATOM 168 CE2 TRP A 26 48.121 30.772 17.896 1.00 25.79 C ATOM 169 CE3 TRP A 26 50.000 31.827 19.014 1.00 25.10 C ATOM 170 CZ2 TRP A 26 47.755 31.961 17.288 1.00 22.42 C ATOM 171 CZ3 TRP A 26 49.617 33.029 18.386 1.00 25.31 C ATOM 172 CH2 TRP A 26 48.516 33.076 17.555 1.00 23.17 C ATOM 0 H TRP A 26 48.726 27.270 21.226 1.00 32.58 H new ATOM 0 HA TRP A 26 50.485 26.818 19.309 1.00 32.86 H new ATOM 0 HB2 TRP A 26 50.176 29.083 21.014 1.00 31.85 H new ATOM 0 HB3 TRP A 26 51.246 29.064 19.880 1.00 31.85 H new ATOM 0 HD1 TRP A 26 48.094 27.748 18.725 1.00 27.40 H new ATOM 0 HE1 TRP A 26 46.885 29.311 17.305 1.00 26.12 H new ATOM 0 HE3 TRP A 26 50.732 31.800 19.587 1.00 25.10 H new ATOM 0 HZ2 TRP A 26 47.021 32.005 16.719 1.00 22.42 H new ATOM 0 HZ3 TRP A 26 50.113 33.802 18.534 1.00 25.31 H new ATOM 0 HH2 TRP A 26 48.281 33.886 17.163 1.00 23.17 H new ATOM 173 N LYS A 27 52.787 26.784 20.217 1.00 36.19 N ATOM 174 CA LYS A 27 54.154 26.497 20.726 1.00 37.10 C ATOM 175 C LYS A 27 54.433 27.301 21.974 1.00 37.85 C ATOM 176 O LYS A 27 54.292 28.528 21.986 1.00 39.23 O ATOM 177 CB LYS A 27 55.239 26.854 19.674 1.00 37.14 C ATOM 0 H LYS A 27 52.776 26.983 19.380 1.00 36.19 H new ATOM 0 HA LYS A 27 54.190 25.547 20.919 1.00 37.10 H new ATOM 178 N VAL A 28 54.860 26.602 23.022 1.00 38.49 N ATOM 179 CA VAL A 28 55.125 27.236 24.324 1.00 38.03 C ATOM 180 C VAL A 28 56.287 28.224 24.179 1.00 38.12 C ATOM 181 O VAL A 28 57.269 27.926 23.542 1.00 37.43 O ATOM 182 CB VAL A 28 55.376 26.182 25.475 1.00 38.79 C ATOM 183 CG1 VAL A 28 55.852 26.875 26.759 1.00 37.38 C ATOM 184 CG2 VAL A 28 54.094 25.346 25.754 1.00 35.92 C ATOM 0 H VAL A 28 55.005 25.754 23.005 1.00 38.49 H new ATOM 0 HA VAL A 28 54.331 27.723 24.594 1.00 38.03 H new ATOM 0 HB VAL A 28 56.074 25.579 25.176 1.00 38.79 H new ATOM 0 HG11 VAL A 28 55.999 26.210 27.450 1.00 37.38 H new ATOM 0 HG12 VAL A 28 56.681 27.348 26.584 1.00 37.38 H new ATOM 0 HG13 VAL A 28 55.177 27.505 27.056 1.00 37.38 H new ATOM 0 HG21 VAL A 28 54.272 24.707 26.462 1.00 35.92 H new ATOM 0 HG22 VAL A 28 53.375 25.937 26.025 1.00 35.92 H new ATOM 0 HG23 VAL A 28 53.835 24.871 24.949 1.00 35.92 H new ATOM 185 N GLY A 29 56.137 29.405 24.780 1.00 38.33 N ATOM 186 CA GLY A 29 57.117 30.512 24.654 1.00 38.19 C ATOM 187 C GLY A 29 56.431 31.844 24.370 1.00 38.44 C ATOM 188 O GLY A 29 55.373 32.147 24.930 1.00 39.33 O ATOM 0 H GLY A 29 55.462 29.597 25.278 1.00 38.33 H new ATOM 0 HA2 GLY A 29 57.633 30.582 25.472 1.00 38.19 H new ATOM 0 HA3 GLY A 29 57.742 30.311 23.940 1.00 38.19 H new ATOM 189 N TYR A 30 57.010 32.620 23.454 1.00 38.30 N ATOM 190 CA TYR A 30 56.475 33.968 23.110 1.00 37.91 C ATOM 191 C TYR A 30 55.062 33.874 22.598 1.00 36.54 C ATOM 192 O TYR A 30 54.158 34.627 22.973 1.00 35.98 O ATOM 193 CB TYR A 30 57.286 34.674 21.997 1.00 38.25 C ATOM 194 CG TYR A 30 58.701 34.934 22.384 1.00 41.30 C ATOM 195 CD1 TYR A 30 59.010 35.150 23.709 1.00 44.19 C ATOM 196 CD2 TYR A 30 59.736 34.969 21.440 1.00 44.45 C ATOM 197 CE1 TYR A 30 60.302 35.375 24.114 1.00 46.32 C ATOM 198 CE2 TYR A 30 61.050 35.215 21.837 1.00 45.01 C ATOM 199 CZ TYR A 30 61.313 35.423 23.186 1.00 45.50 C ATOM 200 OH TYR A 30 62.566 35.656 23.681 1.00 46.18 O ATOM 0 H TYR A 30 57.714 32.396 23.013 1.00 38.30 H new ATOM 0 HA TYR A 30 56.530 34.476 23.934 1.00 37.91 H new ATOM 0 HB2 TYR A 30 57.270 34.127 21.196 1.00 38.25 H new ATOM 0 HB3 TYR A 30 56.857 35.515 21.775 1.00 38.25 H new ATOM 0 HD1 TYR A 30 58.329 35.143 24.342 1.00 44.19 H new ATOM 0 HD2 TYR A 30 59.545 34.827 20.541 1.00 44.45 H new ATOM 0 HE1 TYR A 30 60.493 35.495 25.016 1.00 46.32 H new ATOM 0 HE2 TYR A 30 61.737 35.239 21.211 1.00 45.01 H new ATOM 0 HH TYR A 30 63.119 35.668 23.049 1.00 46.18 H new ATOM 201 N TYR A 31 54.877 32.919 21.709 1.00 34.70 N ATOM 202 CA TYR A 31 53.617 32.847 21.035 1.00 33.40 C ATOM 203 C TYR A 31 52.508 32.402 22.004 1.00 32.22 C ATOM 204 O TYR A 31 51.372 32.761 21.797 1.00 31.29 O ATOM 205 CB TYR A 31 53.731 32.032 19.744 1.00 33.72 C ATOM 206 CG TYR A 31 54.766 32.652 18.842 1.00 34.21 C ATOM 207 CD1 TYR A 31 54.625 33.956 18.410 1.00 35.52 C ATOM 208 CD2 TYR A 31 55.914 31.956 18.457 1.00 36.61 C ATOM 209 CE1 TYR A 31 55.592 34.559 17.589 1.00 36.18 C ATOM 210 CE2 TYR A 31 56.883 32.549 17.637 1.00 35.89 C ATOM 211 CZ TYR A 31 56.717 33.849 17.205 1.00 35.90 C ATOM 212 OH TYR A 31 57.682 34.449 16.393 1.00 34.57 O ATOM 0 H TYR A 31 55.455 32.321 21.490 1.00 34.70 H new ATOM 0 HA TYR A 31 53.348 33.731 20.740 1.00 33.40 H new ATOM 0 HB2 TYR A 31 53.976 31.116 19.950 1.00 33.72 H new ATOM 0 HB3 TYR A 31 52.873 32.002 19.293 1.00 33.72 H new ATOM 0 HD1 TYR A 31 53.876 34.444 18.667 1.00 35.52 H new ATOM 0 HD2 TYR A 31 56.038 31.082 18.751 1.00 36.61 H new ATOM 0 HE1 TYR A 31 55.477 35.436 17.303 1.00 36.18 H new ATOM 0 HE2 TYR A 31 57.637 32.067 17.384 1.00 35.89 H new ATOM 0 HH TYR A 31 58.302 33.903 16.244 1.00 34.57 H new ATOM 213 N THR A 32 52.799 31.657 23.075 1.00 30.67 N ATOM 214 CA THR A 32 51.678 31.269 23.932 1.00 30.39 C ATOM 215 C THR A 32 51.135 32.508 24.617 1.00 28.96 C ATOM 216 O THR A 32 49.935 32.620 24.849 1.00 27.72 O ATOM 217 CB THR A 32 51.927 30.071 24.939 1.00 30.74 C ATOM 218 OG1 THR A 32 53.293 29.957 25.231 1.00 32.92 O ATOM 219 CG2 THR A 32 51.480 28.732 24.315 1.00 32.64 C ATOM 0 H THR A 32 53.579 31.383 23.311 1.00 30.67 H new ATOM 0 HA THR A 32 51.012 30.884 23.341 1.00 30.39 H new ATOM 0 HB THR A 32 51.417 30.257 25.743 1.00 30.74 H new ATOM 0 HG1 THR A 32 53.400 29.416 25.865 1.00 32.92 H new ATOM 0 HG21 THR A 32 51.640 28.012 24.945 1.00 32.64 H new ATOM 0 HG22 THR A 32 50.534 28.773 24.104 1.00 32.64 H new ATOM 0 HG23 THR A 32 51.985 28.569 23.503 1.00 32.64 H new ATOM 220 N ASP A 33 52.031 33.441 24.926 1.00 27.90 N ATOM 221 CA ASP A 33 51.639 34.699 25.581 1.00 27.32 C ATOM 222 C ASP A 33 50.863 35.557 24.590 1.00 24.96 C ATOM 223 O ASP A 33 49.905 36.206 24.923 1.00 23.77 O ATOM 224 CB ASP A 33 52.849 35.474 26.112 1.00 27.27 C ATOM 225 CG ASP A 33 53.421 34.881 27.400 1.00 32.60 C ATOM 226 OD1 ASP A 33 52.755 34.021 28.026 1.00 35.75 O ATOM 227 OD2 ASP A 33 54.526 35.308 27.819 1.00 32.50 O ATOM 0 H ASP A 33 52.873 33.370 24.767 1.00 27.90 H new ATOM 0 HA ASP A 33 51.082 34.481 26.344 1.00 27.32 H new ATOM 0 HB2 ASP A 33 53.541 35.487 25.433 1.00 27.27 H new ATOM 0 HB3 ASP A 33 52.591 36.395 26.273 1.00 27.27 H new ATOM 228 N LEU A 34 51.327 35.568 23.366 1.00 23.81 N ATOM 229 CA LEU A 34 50.608 36.246 22.278 1.00 23.49 C ATOM 230 C LEU A 34 49.186 35.653 22.051 1.00 22.52 C ATOM 231 O LEU A 34 48.224 36.398 21.860 1.00 21.91 O ATOM 232 CB LEU A 34 51.428 36.278 20.997 1.00 23.60 C ATOM 233 CG LEU A 34 50.736 36.928 19.794 1.00 23.50 C ATOM 234 CD1 LEU A 34 50.144 38.323 20.129 1.00 27.18 C ATOM 235 CD2 LEU A 34 51.690 36.930 18.598 1.00 22.13 C ATOM 0 H LEU A 34 52.061 35.190 23.126 1.00 23.81 H new ATOM 0 HA LEU A 34 50.479 37.166 22.556 1.00 23.49 H new ATOM 0 HB2 LEU A 34 52.255 36.753 21.172 1.00 23.60 H new ATOM 0 HB3 LEU A 34 51.668 35.368 20.761 1.00 23.60 H new ATOM 0 HG LEU A 34 49.962 36.397 19.550 1.00 23.50 H new ATOM 0 HD11 LEU A 34 49.718 38.692 19.339 1.00 27.18 H new ATOM 0 HD12 LEU A 34 49.488 38.235 20.838 1.00 27.18 H new ATOM 0 HD13 LEU A 34 50.855 38.915 20.419 1.00 27.18 H new ATOM 0 HD21 LEU A 34 51.253 37.341 17.836 1.00 22.13 H new ATOM 0 HD22 LEU A 34 52.489 37.432 18.822 1.00 22.13 H new ATOM 0 HD23 LEU A 34 51.934 36.018 18.377 1.00 22.13 H new ATOM 236 N TYR A 35 49.048 34.327 22.092 1.00 22.48 N ATOM 237 CA TYR A 35 47.703 33.718 21.969 1.00 22.47 C ATOM 238 C TYR A 35 46.713 34.307 22.996 1.00 23.88 C ATOM 239 O TYR A 35 45.569 34.647 22.685 1.00 24.25 O ATOM 240 CB TYR A 35 47.725 32.180 22.167 1.00 21.59 C ATOM 241 CG TYR A 35 46.374 31.575 21.909 1.00 18.00 C ATOM 242 CD1 TYR A 35 46.001 31.146 20.632 1.00 20.92 C ATOM 243 CD2 TYR A 35 45.410 31.512 22.926 1.00 18.41 C ATOM 244 CE1 TYR A 35 44.694 30.641 20.392 1.00 17.82 C ATOM 245 CE2 TYR A 35 44.157 31.010 22.699 1.00 19.23 C ATOM 246 CZ TYR A 35 43.794 30.583 21.406 1.00 21.15 C ATOM 247 OH TYR A 35 42.512 30.049 21.198 1.00 22.72 O ATOM 0 H TYR A 35 49.695 33.769 22.187 1.00 22.48 H new ATOM 0 HA TYR A 35 47.414 33.923 21.066 1.00 22.47 H new ATOM 0 HB2 TYR A 35 48.378 31.784 21.569 1.00 21.59 H new ATOM 0 HB3 TYR A 35 48.007 31.973 23.072 1.00 21.59 H new ATOM 0 HD1 TYR A 35 46.613 31.191 19.933 1.00 20.92 H new ATOM 0 HD2 TYR A 35 45.628 31.819 23.776 1.00 18.41 H new ATOM 0 HE1 TYR A 35 44.456 30.351 19.541 1.00 17.82 H new ATOM 0 HE2 TYR A 35 43.546 30.951 23.397 1.00 19.23 H new ATOM 0 HH TYR A 35 42.115 29.979 21.935 1.00 22.72 H new ATOM 248 N SER A 36 47.157 34.386 24.242 1.00 25.22 N ATOM 249 CA SER A 36 46.279 34.842 25.315 1.00 26.06 C ATOM 250 C SER A 36 45.788 36.252 25.073 1.00 25.21 C ATOM 251 O SER A 36 44.628 36.576 25.268 1.00 26.45 O ATOM 252 CB SER A 36 47.004 34.814 26.675 1.00 27.24 C ATOM 253 OG SER A 36 47.536 33.534 26.935 1.00 31.48 O ATOM 0 H SER A 36 47.955 34.183 24.489 1.00 25.22 H new ATOM 0 HA SER A 36 45.523 34.234 25.328 1.00 26.06 H new ATOM 0 HB2 SER A 36 47.717 35.472 26.679 1.00 27.24 H new ATOM 0 HB3 SER A 36 46.386 35.061 27.381 1.00 27.24 H new ATOM 0 HG SER A 36 47.928 33.539 27.678 1.00 31.48 H new ATOM 254 N LYS A 37 46.689 37.118 24.644 1.00 24.64 N ATOM 255 CA ALYS A 37 46.313 38.510 24.396 0.50 23.78 C ATOM 256 CA BLYS A 37 46.323 38.508 24.388 0.50 24.08 C ATOM 257 C LYS A 37 45.307 38.597 23.261 1.00 23.30 C ATOM 258 O LYS A 37 44.373 39.359 23.315 1.00 23.70 O ATOM 259 CB ALYS A 37 47.540 39.369 24.069 0.50 24.34 C ATOM 260 CB BLYS A 37 47.566 39.329 24.032 0.50 24.88 C ATOM 261 CG ALYS A 37 48.602 39.474 25.166 0.50 23.84 C ATOM 262 CG BLYS A 37 48.589 39.501 25.154 0.50 25.65 C ATOM 263 CD ALYS A 37 49.624 40.509 24.716 0.50 25.09 C ATOM 264 CD BLYS A 37 49.812 40.201 24.588 0.50 29.04 C ATOM 265 CE ALYS A 37 50.808 40.725 25.637 0.50 25.45 C ATOM 266 CE BLYS A 37 50.649 40.968 25.612 0.50 30.26 C ATOM 267 NZ ALYS A 37 51.788 41.731 25.016 0.50 22.82 N ATOM 268 NZ BLYS A 37 51.612 40.143 26.433 0.50 31.78 N ATOM 0 H ALYS A 37 47.514 36.930 24.490 0.50 24.64 H new ATOM 0 H BLYS A 37 47.514 36.928 24.494 0.50 24.64 H new ATOM 0 HA ALYS A 37 45.907 38.853 25.208 0.50 24.08 H new ATOM 0 HA BLYS A 37 45.925 38.869 25.195 0.50 24.08 H new ATOM 0 HB2ALYS A 37 47.960 39.010 23.271 0.50 24.88 H new ATOM 0 HB2BLYS A 37 48.006 38.908 23.277 0.50 24.88 H new ATOM 0 HB3ALYS A 37 47.236 40.264 23.852 0.50 24.88 H new ATOM 0 HB3BLYS A 37 47.280 40.209 23.740 0.50 24.88 H new ATOM 0 HG2ALYS A 37 48.198 39.737 26.008 0.50 25.65 H new ATOM 0 HG2BLYS A 37 48.209 40.020 25.880 0.50 25.65 H new ATOM 0 HG3ALYS A 37 49.028 38.615 25.312 0.50 25.65 H new ATOM 0 HG3BLYS A 37 48.835 38.638 25.521 0.50 25.65 H new ATOM 0 HD2ALYS A 37 49.960 40.247 23.844 0.50 29.04 H new ATOM 0 HD2BLYS A 37 50.377 39.540 24.159 0.50 29.04 H new ATOM 0 HD3ALYS A 37 49.168 41.358 24.601 0.50 29.04 H new ATOM 0 HD3BLYS A 37 49.524 40.819 23.898 0.50 29.04 H new ATOM 0 HE2ALYS A 37 50.501 41.051 26.497 0.50 30.26 H new ATOM 0 HE2BLYS A 37 51.154 41.651 25.144 0.50 30.26 H new ATOM 0 HE3ALYS A 37 51.259 39.881 25.798 0.50 30.26 H new ATOM 0 HE3BLYS A 37 50.046 41.426 26.218 0.50 30.26 H new ATOM 0 HZ1ALYS A 37 52.479 41.850 25.565 0.50 31.78 H new ATOM 0 HZ1BLYS A 37 52.051 40.673 26.997 0.50 31.78 H new ATOM 0 HZ2ALYS A 37 52.080 41.418 24.236 0.50 31.78 H new ATOM 0 HZ2BLYS A 37 51.160 39.530 26.893 0.50 31.78 H new ATOM 0 HZ3ALYS A 37 51.374 42.508 24.887 0.50 31.78 H new ATOM 0 HZ3BLYS A 37 52.193 39.739 25.893 0.50 31.78 H new ATOM 269 N LEU A 38 45.541 37.822 22.225 1.00 22.39 N ATOM 270 CA LEU A 38 44.686 37.810 21.039 1.00 20.67 C ATOM 271 C LEU A 38 43.313 37.250 21.424 1.00 20.84 C ATOM 272 O LEU A 38 42.250 37.786 21.053 1.00 20.40 O ATOM 273 CB LEU A 38 45.342 37.040 19.889 1.00 20.70 C ATOM 274 CG LEU A 38 46.577 37.743 19.230 1.00 19.60 C ATOM 275 CD1 LEU A 38 47.337 36.865 18.201 1.00 19.59 C ATOM 276 CD2 LEU A 38 46.186 39.110 18.581 1.00 20.37 C ATOM 0 H LEU A 38 46.206 37.278 22.181 1.00 22.39 H new ATOM 0 HA LEU A 38 44.563 38.715 20.711 1.00 20.67 H new ATOM 0 HB2 LEU A 38 45.621 36.171 20.219 1.00 20.70 H new ATOM 0 HB3 LEU A 38 44.675 36.882 19.203 1.00 20.70 H new ATOM 0 HG LEU A 38 47.190 37.899 19.965 1.00 19.60 H new ATOM 0 HD11 LEU A 38 48.084 37.365 17.838 1.00 19.59 H new ATOM 0 HD12 LEU A 38 47.667 36.065 18.639 1.00 19.59 H new ATOM 0 HD13 LEU A 38 46.736 36.615 17.482 1.00 19.59 H new ATOM 0 HD21 LEU A 38 46.972 39.516 18.184 1.00 20.37 H new ATOM 0 HD22 LEU A 38 45.517 38.963 17.895 1.00 20.37 H new ATOM 0 HD23 LEU A 38 45.826 39.700 19.261 1.00 20.37 H new ATOM 277 N ALA A 39 43.335 36.240 22.257 1.00 21.42 N ATOM 278 CA ALA A 39 42.092 35.547 22.638 1.00 22.37 C ATOM 279 C ALA A 39 41.156 36.495 23.407 1.00 23.52 C ATOM 280 O ALA A 39 39.930 36.379 23.318 1.00 23.04 O ATOM 281 CB ALA A 39 42.401 34.273 23.481 1.00 21.82 C ATOM 0 H ALA A 39 44.048 35.927 22.622 1.00 21.42 H new ATOM 0 HA ALA A 39 41.642 35.267 21.826 1.00 22.37 H new ATOM 0 HB1 ALA A 39 41.570 33.834 23.720 1.00 21.82 H new ATOM 0 HB2 ALA A 39 42.949 33.665 22.960 1.00 21.82 H new ATOM 0 HB3 ALA A 39 42.876 34.526 24.288 1.00 21.82 H new ATOM 282 N ASP A 40 41.770 37.429 24.128 1.00 24.46 N ATOM 283 CA ASP A 40 41.048 38.441 24.923 1.00 25.71 C ATOM 284 C ASP A 40 40.303 39.434 24.057 1.00 25.79 C ATOM 285 O ASP A 40 39.402 40.095 24.520 1.00 27.42 O ATOM 286 CB ASP A 40 41.996 39.204 25.844 1.00 26.98 C ATOM 287 CG ASP A 40 42.471 38.360 27.014 1.00 31.68 C ATOM 288 OD1 ASP A 40 41.830 37.328 27.275 1.00 35.81 O ATOM 289 OD2 ASP A 40 43.499 38.706 27.665 1.00 39.22 O ATOM 0 H ASP A 40 42.626 37.500 24.175 1.00 24.46 H new ATOM 0 HA ASP A 40 40.402 37.949 25.454 1.00 25.71 H new ATOM 0 HB2 ASP A 40 42.764 39.507 25.334 1.00 26.98 H new ATOM 0 HB3 ASP A 40 41.548 39.996 26.180 1.00 26.98 H new ATOM 290 N THR A 41 40.659 39.509 22.785 1.00 24.68 N ATOM 291 CA THR A 41 40.051 40.468 21.849 1.00 23.45 C ATOM 292 C THR A 41 38.725 39.935 21.249 1.00 24.30 C ATOM 293 O THR A 41 38.103 40.578 20.397 1.00 25.44 O ATOM 294 CB THR A 41 41.029 40.935 20.731 1.00 23.17 C ATOM 295 OG1 THR A 41 41.292 39.876 19.827 1.00 24.44 O ATOM 296 CG2 THR A 41 42.329 41.487 21.309 1.00 21.06 C ATOM 0 H THR A 41 41.261 39.008 22.430 1.00 24.68 H new ATOM 0 HA THR A 41 39.841 41.253 22.378 1.00 23.45 H new ATOM 0 HB THR A 41 40.598 41.657 20.248 1.00 23.17 H new ATOM 0 HG1 THR A 41 41.804 39.318 20.190 1.00 24.44 H new ATOM 0 HG21 THR A 41 42.912 41.767 20.586 1.00 21.06 H new ATOM 0 HG22 THR A 41 42.133 42.247 21.879 1.00 21.06 H new ATOM 0 HG23 THR A 41 42.770 40.798 21.830 1.00 21.06 H new ATOM 297 N GLY A 42 38.340 38.743 21.712 1.00 22.45 N ATOM 298 CA GLY A 42 37.110 38.072 21.346 1.00 21.91 C ATOM 299 C GLY A 42 36.480 37.375 22.512 1.00 21.72 C ATOM 300 O GLY A 42 37.035 37.379 23.627 1.00 21.94 O ATOM 0 H GLY A 42 38.814 38.292 22.270 1.00 22.45 H new ATOM 0 HA2 GLY A 42 36.486 38.719 20.982 1.00 21.91 H new ATOM 0 HA3 GLY A 42 37.291 37.427 20.645 1.00 21.91 H new ATOM 301 N THR A 43 35.339 36.722 22.275 1.00 22.02 N ATOM 302 CA THR A 43 34.572 36.155 23.378 1.00 21.22 C ATOM 303 C THR A 43 34.203 34.703 23.214 1.00 21.13 C ATOM 304 O THR A 43 33.477 34.134 24.018 1.00 22.24 O ATOM 305 CB THR A 43 33.305 36.989 23.649 1.00 21.14 C ATOM 306 OG1 THR A 43 32.409 36.874 22.548 1.00 23.72 O ATOM 307 CG2 THR A 43 33.644 38.450 23.893 1.00 21.05 C ATOM 0 H THR A 43 34.999 36.599 21.495 1.00 22.02 H new ATOM 0 HA THR A 43 35.171 36.192 24.140 1.00 21.22 H new ATOM 0 HB THR A 43 32.882 36.644 24.451 1.00 21.14 H new ATOM 0 HG1 THR A 43 31.785 37.430 22.635 1.00 23.72 H new ATOM 0 HG21 THR A 43 32.829 38.948 24.060 1.00 21.05 H new ATOM 0 HG22 THR A 43 34.230 38.522 24.663 1.00 21.05 H new ATOM 0 HG23 THR A 43 34.090 38.814 23.112 1.00 21.05 H new HETATM 308 N MSE A 44 34.760 34.075 22.190 1.00 21.33 N HETATM 309 CA MSE A 44 34.500 32.666 21.977 1.00 21.64 C HETATM 310 C MSE A 44 34.975 31.806 23.151 1.00 22.48 C HETATM 311 O MSE A 44 34.343 30.829 23.509 1.00 22.52 O HETATM 312 CB MSE A 44 35.163 32.159 20.707 1.00 21.38 C HETATM 313 CG MSE A 44 34.661 30.813 20.299 1.00 21.17 C HETATM 314 SE MSE A 44 34.990 30.346 18.418 0.75 23.45 SE HETATM 315 CE MSE A 44 36.934 30.318 18.400 1.00 24.71 C HETATM 0 H MSE A 44 35.284 34.442 21.615 1.00 21.33 H new HETATM 0 HA MSE A 44 33.537 32.586 21.896 1.00 21.64 H new HETATM 0 HB2 MSE A 44 35.005 32.791 19.989 1.00 21.38 H new HETATM 0 HB3 MSE A 44 36.123 32.116 20.841 1.00 21.38 H new HETATM 0 HG2 MSE A 44 35.076 30.142 20.863 1.00 21.17 H new HETATM 0 HG3 MSE A 44 33.706 30.773 20.467 1.00 21.17 H new HETATM 0 HE1 MSE A 44 37.246 30.095 17.509 1.00 24.71 H new HETATM 0 HE2 MSE A 44 37.273 31.191 18.652 1.00 24.71 H new HETATM 0 HE3 MSE A 44 37.254 29.654 19.030 1.00 24.71 H new ATOM 316 N ASP A 45 36.085 32.192 23.751 1.00 23.04 N ATOM 317 CA ASP A 45 36.662 31.422 24.868 1.00 23.47 C ATOM 318 C ASP A 45 35.773 31.466 26.078 1.00 22.01 C ATOM 319 O ASP A 45 35.625 30.468 26.780 1.00 20.52 O ATOM 320 CB ASP A 45 38.096 31.881 25.261 1.00 23.73 C ATOM 321 CG ASP A 45 39.184 31.258 24.374 1.00 25.93 C ATOM 322 OD1 ASP A 45 39.659 30.157 24.704 1.00 27.13 O ATOM 323 OD2 ASP A 45 39.525 31.820 23.311 1.00 28.63 O ATOM 0 H ASP A 45 36.529 32.896 23.536 1.00 23.04 H new ATOM 0 HA ASP A 45 36.728 30.510 24.544 1.00 23.47 H new ATOM 0 HB2 ASP A 45 38.150 32.848 25.201 1.00 23.73 H new ATOM 0 HB3 ASP A 45 38.265 31.645 26.187 1.00 23.73 H new ATOM 324 N ASP A 46 35.175 32.622 26.309 1.00 20.92 N ATOM 325 CA ASP A 46 34.308 32.814 27.453 1.00 21.84 C ATOM 326 C ASP A 46 33.007 32.060 27.244 1.00 21.35 C ATOM 327 O ASP A 46 32.375 31.611 28.203 1.00 20.85 O ATOM 328 CB ASP A 46 33.953 34.293 27.654 1.00 23.55 C ATOM 329 CG ASP A 46 35.180 35.173 27.926 1.00 27.25 C ATOM 330 OD1 ASP A 46 35.933 34.936 28.882 1.00 30.08 O ATOM 331 OD2 ASP A 46 35.386 36.083 27.142 1.00 33.69 O ATOM 0 H ASP A 46 35.261 33.315 25.808 1.00 20.92 H new ATOM 0 HA ASP A 46 34.786 32.487 28.231 1.00 21.84 H new ATOM 0 HB2 ASP A 46 33.495 34.621 26.864 1.00 23.55 H new ATOM 0 HB3 ASP A 46 33.333 34.374 28.395 1.00 23.55 H new ATOM 332 N TYR A 47 32.571 32.009 25.989 1.00 20.00 N ATOM 333 CA TYR A 47 31.372 31.258 25.616 1.00 20.41 C ATOM 334 C TYR A 47 31.608 29.792 25.946 1.00 20.25 C ATOM 335 O TYR A 47 30.862 29.171 26.664 1.00 21.63 O ATOM 336 CB TYR A 47 31.031 31.362 24.109 1.00 20.19 C ATOM 337 CG TYR A 47 29.899 30.389 23.722 1.00 20.13 C ATOM 338 CD1 TYR A 47 28.591 30.591 24.155 1.00 22.53 C ATOM 339 CD2 TYR A 47 30.144 29.268 22.946 1.00 20.30 C ATOM 340 CE1 TYR A 47 27.566 29.713 23.822 1.00 19.63 C ATOM 341 CE2 TYR A 47 29.134 28.398 22.597 1.00 18.53 C ATOM 342 CZ TYR A 47 27.854 28.608 23.044 1.00 20.90 C ATOM 343 OH TYR A 47 26.857 27.729 22.680 1.00 23.96 O ATOM 0 H TYR A 47 32.958 32.406 25.332 1.00 20.00 H new ATOM 0 HA TYR A 47 30.628 31.636 26.110 1.00 20.41 H new ATOM 0 HB2 TYR A 47 30.766 32.271 23.897 1.00 20.19 H new ATOM 0 HB3 TYR A 47 31.822 31.167 23.582 1.00 20.19 H new ATOM 0 HD1 TYR A 47 28.398 31.333 24.681 1.00 22.53 H new ATOM 0 HD2 TYR A 47 31.010 29.099 22.654 1.00 20.30 H new ATOM 0 HE1 TYR A 47 26.698 29.867 24.119 1.00 19.63 H new ATOM 0 HE2 TYR A 47 29.321 27.665 22.056 1.00 18.53 H new ATOM 0 HH TYR A 47 26.182 28.160 22.427 1.00 23.96 H new ATOM 344 N VAL A 48 32.628 29.221 25.340 1.00 21.97 N ATOM 345 CA VAL A 48 32.910 27.792 25.526 1.00 20.74 C ATOM 346 C VAL A 48 33.135 27.488 27.036 1.00 21.72 C ATOM 347 O VAL A 48 32.737 26.439 27.558 1.00 21.95 O ATOM 348 CB VAL A 48 34.118 27.336 24.641 1.00 21.81 C ATOM 349 CG1 VAL A 48 34.481 25.836 24.953 1.00 21.16 C ATOM 350 CG2 VAL A 48 33.856 27.525 23.090 1.00 17.73 C ATOM 0 H VAL A 48 33.174 29.631 24.817 1.00 21.97 H new ATOM 0 HA VAL A 48 32.143 27.277 25.232 1.00 20.74 H new ATOM 0 HB VAL A 48 34.866 27.910 24.869 1.00 21.81 H new ATOM 0 HG11 VAL A 48 35.230 25.562 24.400 1.00 21.16 H new ATOM 0 HG12 VAL A 48 34.721 25.749 25.889 1.00 21.16 H new ATOM 0 HG13 VAL A 48 33.716 25.271 24.762 1.00 21.16 H new ATOM 0 HG21 VAL A 48 34.633 27.228 22.592 1.00 17.73 H new ATOM 0 HG22 VAL A 48 33.084 27.001 22.826 1.00 17.73 H new ATOM 0 HG23 VAL A 48 33.690 28.462 22.901 1.00 17.73 H new ATOM 351 N ASP A 49 33.739 28.424 27.760 1.00 21.71 N ATOM 352 CA ASP A 49 34.009 28.183 29.172 1.00 21.72 C ATOM 353 C ASP A 49 32.654 28.001 29.868 1.00 22.59 C ATOM 354 O ASP A 49 32.494 27.226 30.792 1.00 20.13 O ATOM 355 CB ASP A 49 34.667 29.358 29.871 1.00 22.03 C ATOM 356 CG ASP A 49 36.132 29.470 29.643 1.00 22.27 C ATOM 357 OD1 ASP A 49 36.785 28.543 29.102 1.00 25.35 O ATOM 358 OD2 ASP A 49 36.629 30.515 30.096 1.00 24.49 O ATOM 0 H ASP A 49 33.996 29.189 27.462 1.00 21.71 H new ATOM 0 HA ASP A 49 34.601 27.417 29.223 1.00 21.72 H new ATOM 0 HB2 ASP A 49 34.241 30.177 29.573 1.00 22.03 H new ATOM 0 HB3 ASP A 49 34.504 29.285 30.824 1.00 22.03 H new ATOM 359 N LYS A 50 31.674 28.736 29.369 1.00 22.70 N ATOM 360 CA LYS A 50 30.370 28.770 30.020 1.00 23.91 C ATOM 361 C LYS A 50 29.549 27.516 29.771 1.00 23.39 C ATOM 362 O LYS A 50 28.826 27.066 30.635 1.00 24.62 O ATOM 363 CB LYS A 50 29.612 30.033 29.562 1.00 24.37 C ATOM 364 CG LYS A 50 28.144 30.113 29.960 1.00 27.43 C ATOM 365 CD LYS A 50 27.472 31.404 29.377 1.00 28.94 C ATOM 366 CE LYS A 50 27.152 31.310 27.881 1.00 30.00 C ATOM 367 NZ LYS A 50 26.603 32.606 27.370 1.00 28.79 N ATOM 0 H LYS A 50 31.739 29.219 28.661 1.00 22.70 H new ATOM 0 HA LYS A 50 30.515 28.802 30.979 1.00 23.91 H new ATOM 0 HB2 LYS A 50 30.069 30.810 29.920 1.00 24.37 H new ATOM 0 HB3 LYS A 50 29.670 30.091 28.595 1.00 24.37 H new ATOM 0 HG2 LYS A 50 27.675 29.327 29.638 1.00 27.43 H new ATOM 0 HG3 LYS A 50 28.067 30.113 30.927 1.00 27.43 H new ATOM 0 HD2 LYS A 50 26.652 31.581 29.864 1.00 28.94 H new ATOM 0 HD3 LYS A 50 28.060 32.161 29.527 1.00 28.94 H new ATOM 0 HE2 LYS A 50 27.955 31.078 27.389 1.00 30.00 H new ATOM 0 HE3 LYS A 50 26.510 30.599 27.728 1.00 30.00 H new ATOM 0 HZ1 LYS A 50 26.290 32.491 26.545 1.00 28.79 H new ATOM 0 HZ2 LYS A 50 25.944 32.880 27.902 1.00 28.79 H new ATOM 0 HZ3 LYS A 50 27.249 33.219 27.359 1.00 28.79 H new ATOM 368 N VAL A 51 29.679 26.929 28.586 1.00 22.79 N ATOM 369 CA VAL A 51 28.784 25.812 28.172 1.00 22.22 C ATOM 370 C VAL A 51 29.427 24.405 28.085 1.00 22.89 C ATOM 371 O VAL A 51 28.756 23.402 27.932 1.00 22.49 O ATOM 372 CB VAL A 51 28.142 26.124 26.801 1.00 22.17 C ATOM 373 CG1 VAL A 51 27.213 27.291 26.891 1.00 23.34 C ATOM 374 CG2 VAL A 51 29.188 26.373 25.753 1.00 20.71 C ATOM 0 H VAL A 51 30.269 27.149 28.001 1.00 22.79 H new ATOM 0 HA VAL A 51 28.135 25.765 28.891 1.00 22.22 H new ATOM 0 HB VAL A 51 27.628 25.344 26.540 1.00 22.17 H new ATOM 0 HG11 VAL A 51 26.825 27.464 26.019 1.00 23.34 H new ATOM 0 HG12 VAL A 51 26.506 27.094 27.525 1.00 23.34 H new ATOM 0 HG13 VAL A 51 27.704 28.073 27.187 1.00 23.34 H new ATOM 0 HG21 VAL A 51 28.758 26.566 24.905 1.00 20.71 H new ATOM 0 HG22 VAL A 51 29.736 27.129 26.016 1.00 20.71 H new ATOM 0 HG23 VAL A 51 29.747 25.586 25.660 1.00 20.71 H new ATOM 375 N ILE A 52 30.741 24.344 28.211 1.00 23.13 N ATOM 376 CA ILE A 52 31.468 23.085 27.966 1.00 23.68 C ATOM 377 C ILE A 52 31.045 21.968 28.918 1.00 23.13 C ATOM 378 O ILE A 52 31.040 20.814 28.525 1.00 23.23 O ATOM 379 CB ILE A 52 33.027 23.275 27.974 1.00 23.57 C ATOM 380 CG1 ILE A 52 33.719 22.000 27.409 1.00 26.44 C ATOM 381 CG2 ILE A 52 33.499 23.663 29.371 1.00 26.37 C ATOM 382 CD1 ILE A 52 35.204 22.172 26.929 1.00 25.08 C ATOM 0 H ILE A 52 31.238 25.009 28.435 1.00 23.13 H new ATOM 0 HA ILE A 52 31.217 22.810 27.070 1.00 23.68 H new ATOM 0 HB ILE A 52 33.281 24.006 27.389 1.00 23.57 H new ATOM 0 HG12 ILE A 52 33.697 21.313 28.093 1.00 26.44 H new ATOM 0 HG13 ILE A 52 33.193 21.673 26.662 1.00 26.44 H new ATOM 0 HG21 ILE A 52 34.462 23.778 29.367 1.00 26.37 H new ATOM 0 HG22 ILE A 52 33.075 24.494 29.637 1.00 26.37 H new ATOM 0 HG23 ILE A 52 33.260 22.964 29.999 1.00 26.37 H new ATOM 0 HD11 ILE A 52 35.538 21.324 26.598 1.00 25.08 H new ATOM 0 HD12 ILE A 52 35.241 22.832 26.220 1.00 25.08 H new ATOM 0 HD13 ILE A 52 35.753 22.466 27.673 1.00 25.08 H new ATOM 383 N GLU A 53 30.738 22.313 30.169 1.00 22.50 N ATOM 384 CA GLU A 53 30.306 21.308 31.162 1.00 22.32 C ATOM 385 C GLU A 53 28.977 20.696 30.734 1.00 22.38 C ATOM 386 O GLU A 53 28.810 19.443 30.751 1.00 21.61 O ATOM 387 CB GLU A 53 30.248 21.869 32.590 1.00 23.02 C ATOM 388 CG GLU A 53 29.910 20.756 33.575 1.00 25.40 C ATOM 389 CD GLU A 53 30.002 21.179 35.022 1.00 29.22 C ATOM 390 OE1 GLU A 53 30.216 22.368 35.299 1.00 32.20 O ATOM 391 OE2 GLU A 53 29.874 20.297 35.890 1.00 32.86 O ATOM 0 H GLU A 53 30.771 23.119 30.468 1.00 22.50 H new ATOM 0 HA GLU A 53 30.977 20.608 31.187 1.00 22.32 H new ATOM 0 HB2 GLU A 53 31.100 22.269 32.823 1.00 23.02 H new ATOM 0 HB3 GLU A 53 29.581 22.571 32.643 1.00 23.02 H new ATOM 0 HG2 GLU A 53 29.011 20.438 33.396 1.00 25.40 H new ATOM 0 HG3 GLU A 53 30.511 20.009 33.426 1.00 25.40 H new ATOM 392 N ARG A 54 28.083 21.572 30.256 1.00 22.09 N ATOM 393 CA ARG A 54 26.756 21.173 29.735 1.00 23.70 C ATOM 394 C ARG A 54 26.899 20.223 28.554 1.00 23.46 C ATOM 395 O ARG A 54 26.260 19.170 28.468 1.00 23.05 O ATOM 396 CB ARG A 54 25.887 22.386 29.351 1.00 25.07 C ATOM 397 CG ARG A 54 25.096 22.938 30.534 1.00 32.56 C ATOM 398 CD ARG A 54 24.331 24.237 30.276 1.00 37.89 C ATOM 399 NE ARG A 54 25.167 25.452 30.325 1.00 40.34 N ATOM 400 CZ ARG A 54 24.728 26.655 29.970 1.00 44.22 C ATOM 401 NH1 ARG A 54 23.484 26.799 29.523 1.00 46.50 N ATOM 402 NH2 ARG A 54 25.527 27.713 30.027 1.00 46.47 N ATOM 0 H ARG A 54 28.226 22.419 30.223 1.00 22.09 H new ATOM 0 HA ARG A 54 26.300 20.710 30.455 1.00 23.70 H new ATOM 0 HB2 ARG A 54 26.455 23.085 28.991 1.00 25.07 H new ATOM 0 HB3 ARG A 54 25.272 22.129 28.646 1.00 25.07 H new ATOM 0 HG2 ARG A 54 24.463 22.262 30.822 1.00 32.56 H new ATOM 0 HG3 ARG A 54 25.709 23.085 31.271 1.00 32.56 H new ATOM 0 HD2 ARG A 54 23.907 24.183 29.405 1.00 37.89 H new ATOM 0 HD3 ARG A 54 23.621 24.318 30.932 1.00 37.89 H new ATOM 0 HE ARG A 54 25.979 25.378 30.597 1.00 40.34 H new ATOM 0 HH11 ARG A 54 22.966 26.115 29.464 1.00 46.50 H new ATOM 0 HH12 ARG A 54 23.197 27.576 29.293 1.00 46.50 H new ATOM 0 HH21 ARG A 54 26.339 27.625 30.296 1.00 46.47 H new ATOM 0 HH22 ARG A 54 25.233 28.487 29.795 1.00 46.47 H new ATOM 403 N TRP A 55 27.790 20.596 27.654 1.00 23.04 N ATOM 404 CA TRP A 55 28.068 19.785 26.487 1.00 23.24 C ATOM 405 C TRP A 55 28.522 18.401 26.840 1.00 23.94 C ATOM 406 O TRP A 55 28.076 17.453 26.239 1.00 23.72 O ATOM 407 CB TRP A 55 29.177 20.414 25.627 1.00 23.45 C ATOM 408 CG TRP A 55 28.745 21.648 24.840 1.00 21.69 C ATOM 409 CD1 TRP A 55 27.466 22.025 24.552 1.00 23.52 C ATOM 410 CD2 TRP A 55 29.592 22.566 24.150 1.00 21.67 C ATOM 411 NE1 TRP A 55 27.467 23.128 23.751 1.00 23.01 N ATOM 412 CE2 TRP A 55 28.764 23.491 23.499 1.00 20.43 C ATOM 413 CE3 TRP A 55 30.982 22.699 24.022 1.00 24.54 C ATOM 414 CZ2 TRP A 55 29.275 24.535 22.724 1.00 21.21 C ATOM 415 CZ3 TRP A 55 31.478 23.755 23.255 1.00 19.72 C ATOM 416 CH2 TRP A 55 30.637 24.630 22.607 1.00 18.85 C ATOM 0 H TRP A 55 28.248 21.322 27.702 1.00 23.04 H new ATOM 0 HA TRP A 55 27.230 19.739 26.001 1.00 23.24 H new ATOM 0 HB2 TRP A 55 29.919 20.655 26.203 1.00 23.45 H new ATOM 0 HB3 TRP A 55 29.506 19.746 25.005 1.00 23.45 H new ATOM 0 HD1 TRP A 55 26.702 21.591 24.858 1.00 23.52 H new ATOM 0 HE1 TRP A 55 26.768 23.530 23.453 1.00 23.01 H new ATOM 0 HE3 TRP A 55 31.559 22.099 24.437 1.00 24.54 H new ATOM 0 HZ2 TRP A 55 28.711 25.143 22.303 1.00 21.21 H new ATOM 0 HZ3 TRP A 55 32.398 23.870 23.180 1.00 19.72 H new ATOM 0 HH2 TRP A 55 31.001 25.302 22.077 1.00 18.85 H new ATOM 417 N VAL A 56 29.493 18.332 27.756 1.00 24.33 N ATOM 418 CA VAL A 56 30.069 17.051 28.219 1.00 24.99 C ATOM 419 C VAL A 56 28.967 16.175 28.772 1.00 25.56 C ATOM 420 O VAL A 56 28.872 14.989 28.481 1.00 24.26 O ATOM 421 CB VAL A 56 31.225 17.218 29.291 1.00 25.42 C ATOM 422 CG1 VAL A 56 31.674 15.858 29.808 1.00 23.76 C ATOM 423 CG2 VAL A 56 32.411 18.019 28.700 1.00 23.83 C ATOM 0 H VAL A 56 29.840 19.024 28.130 1.00 24.33 H new ATOM 0 HA VAL A 56 30.482 16.635 27.446 1.00 24.99 H new ATOM 0 HB VAL A 56 30.878 17.722 30.043 1.00 25.42 H new ATOM 0 HG11 VAL A 56 32.380 15.977 30.462 1.00 23.76 H new ATOM 0 HG12 VAL A 56 30.923 15.405 30.223 1.00 23.76 H new ATOM 0 HG13 VAL A 56 32.005 15.324 29.069 1.00 23.76 H new ATOM 0 HG21 VAL A 56 33.106 18.110 29.370 1.00 23.83 H new ATOM 0 HG22 VAL A 56 32.766 17.550 27.928 1.00 23.83 H new ATOM 0 HG23 VAL A 56 32.105 18.899 28.431 1.00 23.83 H new ATOM 424 N ASN A 57 28.106 16.798 29.556 1.00 27.06 N ATOM 425 CA ASN A 57 26.971 16.097 30.179 1.00 26.92 C ATOM 426 C ASN A 57 25.912 15.642 29.174 1.00 27.91 C ATOM 427 O ASN A 57 25.212 14.668 29.411 1.00 26.59 O ATOM 428 CB ASN A 57 26.339 16.960 31.271 1.00 27.13 C ATOM 429 CG ASN A 57 27.137 16.926 32.563 1.00 27.40 C ATOM 430 OD1 ASN A 57 27.635 15.882 32.941 1.00 30.08 O ATOM 431 ND2 ASN A 57 27.182 18.039 33.280 1.00 30.19 N ATOM 0 H ASN A 57 28.153 17.635 29.748 1.00 27.06 H new ATOM 0 HA ASN A 57 27.335 15.290 30.576 1.00 26.92 H new ATOM 0 HB2 ASN A 57 26.271 17.876 30.959 1.00 27.13 H new ATOM 0 HB3 ASN A 57 25.436 16.651 31.443 1.00 27.13 H new ATOM 0 HD21 ASN A 57 27.575 18.042 34.045 1.00 30.19 H new ATOM 0 HD22 ASN A 57 26.819 18.759 32.980 1.00 30.19 H new ATOM 432 N ASP A 58 25.837 16.340 28.042 1.00 28.90 N ATOM 433 CA ASP A 58 24.834 16.027 26.992 1.00 29.79 C ATOM 434 C ASP A 58 25.367 14.961 26.039 1.00 29.17 C ATOM 435 O ASP A 58 24.672 14.504 25.151 1.00 29.16 O ATOM 436 CB ASP A 58 24.492 17.238 26.117 1.00 31.14 C ATOM 437 CG ASP A 58 23.752 18.342 26.858 1.00 36.19 C ATOM 438 OD1 ASP A 58 23.278 18.131 28.006 1.00 40.92 O ATOM 439 OD2 ASP A 58 23.651 19.450 26.249 1.00 41.25 O ATOM 0 H ASP A 58 26.353 17.001 27.852 1.00 28.90 H new ATOM 0 HA ASP A 58 24.046 15.730 27.473 1.00 29.79 H new ATOM 0 HB2 ASP A 58 25.312 17.601 25.748 1.00 31.14 H new ATOM 0 HB3 ASP A 58 23.950 16.943 25.369 1.00 31.14 H new ATOM 440 N GLY A 59 26.638 14.630 26.184 1.00 27.64 N ATOM 441 CA GLY A 59 27.277 13.645 25.292 1.00 27.13 C ATOM 442 C GLY A 59 27.783 14.160 23.955 1.00 25.99 C ATOM 443 O GLY A 59 27.954 13.388 23.033 1.00 26.62 O ATOM 0 H GLY A 59 27.157 14.957 26.787 1.00 27.64 H new ATOM 0 HA2 GLY A 59 28.025 13.248 25.766 1.00 27.13 H new ATOM 0 HA3 GLY A 59 26.640 12.934 25.121 1.00 27.13 H new ATOM 444 N SER A 60 28.037 15.461 23.845 1.00 24.32 N ATOM 445 CA SER A 60 28.423 16.049 22.563 1.00 24.06 C ATOM 446 C SER A 60 29.899 16.330 22.524 1.00 23.39 C ATOM 447 O SER A 60 30.433 16.836 21.524 1.00 23.82 O ATOM 448 CB SER A 60 27.614 17.321 22.262 1.00 23.89 C ATOM 449 OG SER A 60 27.800 18.276 23.267 1.00 24.86 O ATOM 0 H SER A 60 27.992 16.020 24.497 1.00 24.32 H new ATOM 0 HA SER A 60 28.220 15.401 21.870 1.00 24.06 H new ATOM 0 HB2 SER A 60 27.887 17.688 21.406 1.00 23.89 H new ATOM 0 HB3 SER A 60 26.672 17.101 22.189 1.00 23.89 H new ATOM 0 HG SER A 60 27.732 17.908 24.019 1.00 24.86 H new ATOM 450 N VAL A 61 30.566 15.983 23.617 1.00 23.04 N ATOM 451 CA VAL A 61 32.018 16.198 23.706 1.00 22.65 C ATOM 452 C VAL A 61 32.781 14.870 23.560 1.00 22.48 C ATOM 453 O VAL A 61 32.479 13.865 24.155 1.00 21.57 O ATOM 454 CB VAL A 61 32.450 16.975 24.958 1.00 21.90 C ATOM 455 CG1 VAL A 61 33.943 17.176 24.951 1.00 21.25 C ATOM 456 CG2 VAL A 61 31.750 18.307 25.025 1.00 21.75 C ATOM 0 H VAL A 61 30.209 15.626 24.313 1.00 23.04 H new ATOM 0 HA VAL A 61 32.256 16.768 22.958 1.00 22.65 H new ATOM 0 HB VAL A 61 32.203 16.458 25.741 1.00 21.90 H new ATOM 0 HG11 VAL A 61 34.207 17.667 25.745 1.00 21.25 H new ATOM 0 HG12 VAL A 61 34.386 16.313 24.943 1.00 21.25 H new ATOM 0 HG13 VAL A 61 34.199 17.677 24.161 1.00 21.25 H new ATOM 0 HG21 VAL A 61 32.035 18.783 25.821 1.00 21.75 H new ATOM 0 HG22 VAL A 61 31.973 18.830 24.239 1.00 21.75 H new ATOM 0 HG23 VAL A 61 30.791 18.167 25.058 1.00 21.75 H new ATOM 457 N TYR A 62 33.734 14.890 22.653 1.00 23.75 N ATOM 458 CA TYR A 62 34.610 13.745 22.406 1.00 23.33 C ATOM 459 C TYR A 62 36.016 14.133 22.804 1.00 22.86 C ATOM 460 O TYR A 62 36.401 15.318 22.784 1.00 21.15 O ATOM 461 CB TYR A 62 34.528 13.291 20.943 1.00 24.20 C ATOM 462 CG TYR A 62 33.258 12.512 20.694 1.00 26.03 C ATOM 463 CD1 TYR A 62 32.034 13.155 20.592 1.00 30.14 C ATOM 464 CD2 TYR A 62 33.275 11.148 20.609 1.00 26.81 C ATOM 465 CE1 TYR A 62 30.864 12.433 20.429 1.00 30.68 C ATOM 466 CE2 TYR A 62 32.119 10.432 20.448 1.00 30.61 C ATOM 467 CZ TYR A 62 30.929 11.070 20.352 1.00 31.44 C ATOM 468 OH TYR A 62 29.792 10.310 20.184 1.00 36.98 O ATOM 0 H TYR A 62 33.900 15.571 22.154 1.00 23.75 H new ATOM 0 HA TYR A 62 34.326 12.986 22.939 1.00 23.33 H new ATOM 0 HB2 TYR A 62 34.558 14.064 20.358 1.00 24.20 H new ATOM 0 HB3 TYR A 62 35.297 12.741 20.727 1.00 24.20 H new ATOM 0 HD1 TYR A 62 31.998 14.083 20.634 1.00 30.14 H new ATOM 0 HD2 TYR A 62 34.087 10.698 20.662 1.00 26.81 H new ATOM 0 HE1 TYR A 62 30.045 12.870 20.373 1.00 30.68 H new ATOM 0 HE2 TYR A 62 32.152 9.504 20.404 1.00 30.61 H new ATOM 0 HH TYR A 62 30.000 9.497 20.155 1.00 36.98 H new ATOM 469 N VAL A 63 36.769 13.118 23.186 1.00 22.53 N ATOM 470 CA VAL A 63 38.124 13.308 23.677 1.00 22.88 C ATOM 471 C VAL A 63 39.116 12.342 23.096 1.00 24.10 C ATOM 472 O VAL A 63 38.768 11.272 22.582 1.00 24.65 O ATOM 473 CB VAL A 63 38.207 13.220 25.239 1.00 23.70 C ATOM 474 CG1 VAL A 63 37.330 14.333 25.886 1.00 21.16 C ATOM 475 CG2 VAL A 63 37.827 11.813 25.761 1.00 20.36 C ATOM 0 H VAL A 63 36.511 12.298 23.169 1.00 22.53 H new ATOM 0 HA VAL A 63 38.359 14.202 23.384 1.00 22.88 H new ATOM 0 HB VAL A 63 39.129 13.368 25.501 1.00 23.70 H new ATOM 0 HG11 VAL A 63 37.388 14.270 26.852 1.00 21.16 H new ATOM 0 HG12 VAL A 63 37.648 15.203 25.599 1.00 21.16 H new ATOM 0 HG13 VAL A 63 36.407 14.219 25.610 1.00 21.16 H new ATOM 0 HG21 VAL A 63 37.890 11.799 26.729 1.00 20.36 H new ATOM 0 HG22 VAL A 63 36.919 11.603 25.494 1.00 20.36 H new ATOM 0 HG23 VAL A 63 38.434 11.154 25.388 1.00 20.36 H new ATOM 476 N LEU A 64 40.361 12.798 23.114 1.00 24.28 N ATOM 477 CA LEU A 64 41.512 11.940 22.927 1.00 24.55 C ATOM 478 C LEU A 64 41.953 11.541 24.319 1.00 24.89 C ATOM 479 O LEU A 64 42.029 12.382 25.226 1.00 24.77 O ATOM 480 CB LEU A 64 42.649 12.617 22.155 1.00 24.93 C ATOM 481 CG LEU A 64 42.501 12.723 20.642 1.00 23.20 C ATOM 482 CD1 LEU A 64 43.795 13.316 20.085 1.00 22.78 C ATOM 483 CD2 LEU A 64 42.258 11.428 20.057 1.00 22.28 C ATOM 0 H LEU A 64 40.560 13.626 23.237 1.00 24.28 H new ATOM 0 HA LEU A 64 41.274 11.172 22.384 1.00 24.55 H new ATOM 0 HB2 LEU A 64 42.760 13.513 22.509 1.00 24.93 H new ATOM 0 HB3 LEU A 64 43.469 12.134 22.343 1.00 24.93 H new ATOM 0 HG LEU A 64 41.744 13.289 20.425 1.00 23.20 H new ATOM 0 HD11 LEU A 64 43.727 13.394 19.121 1.00 22.78 H new ATOM 0 HD12 LEU A 64 43.941 14.194 20.471 1.00 22.78 H new ATOM 0 HD13 LEU A 64 44.540 12.737 20.310 1.00 22.78 H new ATOM 0 HD21 LEU A 64 42.167 11.519 19.096 1.00 22.28 H new ATOM 0 HD22 LEU A 64 43.001 10.838 20.257 1.00 22.28 H new ATOM 0 HD23 LEU A 64 41.442 11.055 20.425 1.00 22.28 H new ATOM 484 N ARG A 65 42.209 10.248 24.494 1.00 24.32 N ATOM 485 CA ARG A 65 42.647 9.717 25.784 1.00 26.04 C ATOM 486 C ARG A 65 43.996 9.046 25.696 1.00 27.41 C ATOM 487 O ARG A 65 44.299 8.351 24.735 1.00 27.90 O ATOM 488 CB ARG A 65 41.697 8.635 26.323 1.00 25.10 C ATOM 489 CG ARG A 65 40.281 9.074 26.549 1.00 25.57 C ATOM 490 CD ARG A 65 39.550 8.000 27.353 1.00 23.25 C ATOM 491 NE ARG A 65 38.148 8.333 27.379 1.00 22.69 N ATOM 492 CZ ARG A 65 37.596 9.116 28.284 1.00 22.09 C ATOM 493 NH1 ARG A 65 38.331 9.589 29.261 1.00 21.29 N ATOM 494 NH2 ARG A 65 36.312 9.404 28.212 1.00 22.65 N ATOM 0 H ARG A 65 42.135 9.657 23.874 1.00 24.32 H new ATOM 0 HA ARG A 65 42.670 10.492 26.367 1.00 26.04 H new ATOM 0 HB2 ARG A 65 41.693 7.891 25.701 1.00 25.10 H new ATOM 0 HB3 ARG A 65 42.054 8.302 27.161 1.00 25.10 H new ATOM 0 HG2 ARG A 65 40.264 9.919 27.025 1.00 25.57 H new ATOM 0 HG3 ARG A 65 39.835 9.218 25.700 1.00 25.57 H new ATOM 0 HD2 ARG A 65 39.683 7.127 26.951 1.00 23.25 H new ATOM 0 HD3 ARG A 65 39.903 7.954 28.255 1.00 23.25 H new ATOM 0 HE ARG A 65 37.642 8.001 26.768 1.00 22.69 H new ATOM 0 HH11 ARG A 65 39.166 9.388 29.307 1.00 21.29 H new ATOM 0 HH12 ARG A 65 37.978 10.101 29.856 1.00 21.29 H new ATOM 0 HH21 ARG A 65 35.834 9.081 27.574 1.00 22.65 H new ATOM 0 HH22 ARG A 65 35.952 9.915 28.803 1.00 22.65 H new ATOM 495 N VAL A 66 44.771 9.283 26.742 1.00 29.34 N ATOM 496 CA VAL A 66 46.040 8.611 26.982 1.00 30.51 C ATOM 497 C VAL A 66 45.873 7.819 28.278 1.00 31.27 C ATOM 498 O VAL A 66 45.659 8.371 29.347 1.00 31.62 O ATOM 499 CB VAL A 66 47.181 9.588 27.124 1.00 31.08 C ATOM 500 CG1 VAL A 66 48.422 8.860 27.653 1.00 31.30 C ATOM 501 CG2 VAL A 66 47.432 10.346 25.754 1.00 29.13 C ATOM 0 H VAL A 66 44.569 9.856 27.351 1.00 29.34 H new ATOM 0 HA VAL A 66 46.258 8.039 26.229 1.00 30.51 H new ATOM 0 HB VAL A 66 46.956 10.272 27.774 1.00 31.08 H new ATOM 0 HG11 VAL A 66 49.153 9.491 27.743 1.00 31.30 H new ATOM 0 HG12 VAL A 66 48.224 8.469 28.519 1.00 31.30 H new ATOM 0 HG13 VAL A 66 48.675 8.159 27.033 1.00 31.30 H new ATOM 0 HG21 VAL A 66 48.167 10.970 25.859 1.00 29.13 H new ATOM 0 HG22 VAL A 66 47.652 9.702 25.063 1.00 29.13 H new ATOM 0 HG23 VAL A 66 46.631 10.831 25.501 1.00 29.13 H new ATOM 502 N SER A 67 45.937 6.502 28.155 1.00 31.63 N ATOM 503 CA SER A 67 45.748 5.620 29.304 1.00 31.91 C ATOM 504 C SER A 67 44.521 6.030 30.121 1.00 31.13 C ATOM 505 O SER A 67 44.564 6.149 31.349 1.00 30.43 O ATOM 506 CB SER A 67 47.000 5.604 30.180 1.00 32.63 C ATOM 507 OG SER A 67 48.189 5.582 29.380 1.00 34.46 O ATOM 0 H SER A 67 46.089 6.094 27.413 1.00 31.63 H new ATOM 0 HA SER A 67 45.595 4.722 28.970 1.00 31.91 H new ATOM 0 HB2 SER A 67 47.007 6.386 30.754 1.00 32.63 H new ATOM 0 HB3 SER A 67 46.983 4.827 30.760 1.00 32.63 H new ATOM 0 HG SER A 67 48.864 5.575 29.880 1.00 34.46 H new ATOM 508 N GLY A 68 43.436 6.270 29.383 1.00 30.62 N ATOM 509 CA GLY A 68 42.117 6.560 29.949 1.00 29.02 C ATOM 510 C GLY A 68 41.948 7.996 30.362 1.00 28.28 C ATOM 511 O GLY A 68 40.851 8.414 30.730 1.00 28.21 O ATOM 0 H GLY A 68 43.446 6.269 28.523 1.00 30.62 H new ATOM 0 HA2 GLY A 68 41.436 6.336 29.296 1.00 29.02 H new ATOM 0 HA3 GLY A 68 41.970 5.989 30.719 1.00 29.02 H new ATOM 512 N ARG A 69 43.047 8.746 30.326 1.00 27.36 N ATOM 513 CA ARG A 69 43.019 10.162 30.745 1.00 27.21 C ATOM 514 C ARG A 69 42.726 11.076 29.581 1.00 24.70 C ATOM 515 O ARG A 69 43.382 10.981 28.574 1.00 24.10 O ATOM 516 CB ARG A 69 44.342 10.616 31.393 1.00 28.14 C ATOM 517 CG ARG A 69 44.615 10.101 32.814 1.00 33.42 C ATOM 518 CD ARG A 69 46.036 10.505 33.278 1.00 38.43 C ATOM 519 NE ARG A 69 47.079 9.756 32.568 1.00 42.42 N ATOM 520 CZ ARG A 69 47.764 10.212 31.529 1.00 45.04 C ATOM 521 NH1 ARG A 69 47.552 11.445 31.052 1.00 47.31 N ATOM 522 NH2 ARG A 69 48.659 9.419 30.961 1.00 45.90 N ATOM 0 H ARG A 69 43.817 8.464 30.066 1.00 27.36 H new ATOM 0 HA ARG A 69 42.310 10.223 31.404 1.00 27.21 H new ATOM 0 HB2 ARG A 69 45.073 10.335 30.821 1.00 28.14 H new ATOM 0 HB3 ARG A 69 44.354 11.586 31.413 1.00 28.14 H new ATOM 0 HG2 ARG A 69 43.955 10.462 33.426 1.00 33.42 H new ATOM 0 HG3 ARG A 69 44.525 9.135 32.836 1.00 33.42 H new ATOM 0 HD2 ARG A 69 46.165 11.455 33.132 1.00 38.43 H new ATOM 0 HD3 ARG A 69 46.120 10.350 34.232 1.00 38.43 H new ATOM 0 HE ARG A 69 47.259 8.963 32.847 1.00 42.42 H new ATOM 0 HH11 ARG A 69 46.964 11.953 31.420 1.00 47.31 H new ATOM 0 HH12 ARG A 69 48.003 11.728 30.377 1.00 47.31 H new ATOM 0 HH21 ARG A 69 48.786 8.625 31.267 1.00 45.90 H new ATOM 0 HH22 ARG A 69 49.113 9.697 30.286 1.00 45.90 H new ATOM 523 N PRO A 70 41.731 11.957 29.714 1.00 22.88 N ATOM 524 CA PRO A 70 41.479 12.864 28.591 1.00 22.34 C ATOM 525 C PRO A 70 42.588 13.901 28.403 1.00 23.02 C ATOM 526 O PRO A 70 43.052 14.473 29.391 1.00 22.33 O ATOM 527 CB PRO A 70 40.168 13.534 28.966 1.00 22.23 C ATOM 528 CG PRO A 70 40.086 13.440 30.445 1.00 22.07 C ATOM 529 CD PRO A 70 40.777 12.157 30.818 1.00 22.82 C ATOM 0 HA PRO A 70 41.447 12.389 27.746 1.00 22.34 H new ATOM 0 HB2 PRO A 70 40.152 14.459 28.673 1.00 22.23 H new ATOM 0 HB3 PRO A 70 39.415 13.090 28.545 1.00 22.23 H new ATOM 0 HG2 PRO A 70 40.516 14.201 30.866 1.00 22.07 H new ATOM 0 HG3 PRO A 70 39.163 13.436 30.742 1.00 22.07 H new ATOM 0 HD2 PRO A 70 41.229 12.229 31.674 1.00 22.82 H new ATOM 0 HD3 PRO A 70 40.151 11.420 30.889 1.00 22.82 H new ATOM 530 N VAL A 71 43.025 14.112 27.146 1.00 22.17 N ATOM 531 CA VAL A 71 44.085 15.109 26.876 1.00 22.38 C ATOM 532 C VAL A 71 43.656 16.241 25.892 1.00 22.10 C ATOM 533 O VAL A 71 44.305 17.285 25.770 1.00 21.26 O ATOM 534 CB VAL A 71 45.452 14.430 26.436 1.00 21.82 C ATOM 535 CG1 VAL A 71 45.976 13.445 27.533 1.00 20.15 C ATOM 536 CG2 VAL A 71 45.321 13.745 25.065 1.00 22.12 C ATOM 0 H VAL A 71 42.730 13.700 26.452 1.00 22.17 H new ATOM 0 HA VAL A 71 44.238 15.549 27.727 1.00 22.38 H new ATOM 0 HB VAL A 71 46.115 15.132 26.342 1.00 21.82 H new ATOM 0 HG11 VAL A 71 46.810 13.046 27.238 1.00 20.15 H new ATOM 0 HG12 VAL A 71 46.125 13.930 28.360 1.00 20.15 H new ATOM 0 HG13 VAL A 71 45.319 12.747 27.682 1.00 20.15 H new ATOM 0 HG21 VAL A 71 46.169 13.340 24.823 1.00 22.12 H new ATOM 0 HG22 VAL A 71 44.637 13.059 25.110 1.00 22.12 H new ATOM 0 HG23 VAL A 71 45.075 14.403 24.396 1.00 22.12 H new ATOM 537 N ALA A 72 42.532 16.020 25.228 1.00 21.88 N ATOM 538 CA ALA A 72 41.980 16.985 24.244 1.00 21.07 C ATOM 539 C ALA A 72 40.476 16.800 24.116 1.00 21.99 C ATOM 540 O ALA A 72 39.918 15.687 24.344 1.00 23.11 O ATOM 541 CB ALA A 72 42.621 16.816 22.878 1.00 20.91 C ATOM 0 H ALA A 72 42.056 15.310 25.325 1.00 21.88 H new ATOM 0 HA ALA A 72 42.177 17.878 24.569 1.00 21.07 H new ATOM 0 HB1 ALA A 72 42.240 17.459 22.260 1.00 20.91 H new ATOM 0 HB2 ALA A 72 43.577 16.963 22.949 1.00 20.91 H new ATOM 0 HB3 ALA A 72 42.456 15.918 22.552 1.00 20.91 H new ATOM 542 N THR A 73 39.813 17.893 23.764 1.00 20.93 N ATOM 543 CA THR A 73 38.371 17.844 23.518 1.00 20.22 C ATOM 544 C THR A 73 38.039 18.375 22.155 1.00 20.69 C ATOM 545 O THR A 73 38.779 19.180 21.563 1.00 20.88 O ATOM 546 CB THR A 73 37.573 18.719 24.547 1.00 20.64 C ATOM 547 OG1 THR A 73 37.963 20.112 24.430 1.00 19.80 O ATOM 548 CG2 THR A 73 37.793 18.250 25.979 1.00 18.36 C ATOM 0 H THR A 73 40.172 18.668 23.662 1.00 20.93 H new ATOM 0 HA THR A 73 38.119 16.911 23.602 1.00 20.22 H new ATOM 0 HB THR A 73 36.631 18.623 24.339 1.00 20.64 H new ATOM 0 HG1 THR A 73 37.544 20.468 23.795 1.00 19.80 H new ATOM 0 HG21 THR A 73 37.286 18.812 26.585 1.00 18.36 H new ATOM 0 HG22 THR A 73 37.497 17.330 26.068 1.00 18.36 H new ATOM 0 HG23 THR A 73 38.736 18.308 26.197 1.00 18.36 H new ATOM 549 N ILE A 74 36.914 17.889 21.651 1.00 20.53 N ATOM 550 CA ILE A 74 36.242 18.501 20.518 1.00 20.91 C ATOM 551 C ILE A 74 34.727 18.385 20.761 1.00 21.68 C ATOM 552 O ILE A 74 34.247 17.325 21.179 1.00 20.93 O ATOM 553 CB ILE A 74 36.618 17.862 19.133 1.00 21.34 C ATOM 554 CG1 ILE A 74 35.993 18.631 17.983 1.00 23.20 C ATOM 555 CG2 ILE A 74 36.070 16.434 19.012 1.00 17.78 C ATOM 556 CD1 ILE A 74 36.724 19.805 17.562 1.00 26.95 C ATOM 0 H ILE A 74 36.517 17.191 21.959 1.00 20.53 H new ATOM 0 HA ILE A 74 36.531 19.425 20.460 1.00 20.91 H new ATOM 0 HB ILE A 74 37.587 17.879 19.090 1.00 21.34 H new ATOM 0 HG12 ILE A 74 35.903 18.034 17.224 1.00 23.20 H new ATOM 0 HG13 ILE A 74 35.097 18.900 18.241 1.00 23.20 H new ATOM 0 HG21 ILE A 74 36.316 16.065 18.150 1.00 17.78 H new ATOM 0 HG22 ILE A 74 36.443 15.883 19.718 1.00 17.78 H new ATOM 0 HG23 ILE A 74 35.103 16.450 19.092 1.00 17.78 H new ATOM 0 HD11 ILE A 74 36.256 20.232 16.828 1.00 26.95 H new ATOM 0 HD12 ILE A 74 36.795 20.426 18.304 1.00 26.95 H new ATOM 0 HD13 ILE A 74 37.613 19.546 17.272 1.00 26.95 H new ATOM 557 N HIS A 75 34.002 19.485 20.505 1.00 22.56 N ATOM 558 CA HIS A 75 32.528 19.486 20.545 1.00 23.97 C ATOM 559 C HIS A 75 31.956 19.307 19.127 1.00 24.33 C ATOM 560 O HIS A 75 32.470 19.857 18.175 1.00 24.55 O ATOM 561 CB HIS A 75 31.999 20.790 21.167 1.00 23.41 C ATOM 562 CG HIS A 75 30.498 20.907 21.175 1.00 24.12 C ATOM 563 ND1 HIS A 75 29.817 21.927 20.530 1.00 21.93 N ATOM 564 CD2 HIS A 75 29.551 20.130 21.757 1.00 18.44 C ATOM 565 CE1 HIS A 75 28.515 21.750 20.702 1.00 22.00 C ATOM 566 NE2 HIS A 75 28.330 20.676 21.452 1.00 18.86 N ATOM 0 H HIS A 75 34.348 20.246 20.305 1.00 22.56 H new ATOM 0 HA HIS A 75 32.239 18.743 21.098 1.00 23.97 H new ATOM 0 HB2 HIS A 75 32.323 20.856 22.079 1.00 23.41 H new ATOM 0 HB3 HIS A 75 32.369 21.542 20.679 1.00 23.41 H new ATOM 0 HD1 HIS A 75 30.180 22.570 20.090 1.00 21.93 H new ATOM 0 HD2 HIS A 75 29.702 19.368 22.268 1.00 18.44 H new ATOM 0 HE1 HIS A 75 27.843 22.291 20.354 1.00 22.00 H new HETATM 567 N MSE A 76 30.896 18.510 19.008 1.00 24.43 N HETATM 568 CA MSE A 76 30.181 18.348 17.744 1.00 25.36 C HETATM 569 C MSE A 76 28.667 18.531 17.950 1.00 25.50 C HETATM 570 O MSE A 76 28.073 18.051 18.908 1.00 25.91 O HETATM 571 CB MSE A 76 30.344 16.939 17.172 1.00 25.64 C HETATM 572 CG MSE A 76 31.703 16.407 17.109 1.00 29.83 C HETATM 573 SE MSE A 76 31.581 14.452 16.792 0.75 30.76 SE HETATM 574 CE MSE A 76 33.359 14.146 17.488 1.00 34.00 C HETATM 0 H MSE A 76 30.572 18.049 19.657 1.00 24.43 H new HETATM 0 HA MSE A 76 30.554 19.012 17.144 1.00 25.36 H new HETATM 0 HB2 MSE A 76 29.806 16.332 17.705 1.00 25.64 H new HETATM 0 HB3 MSE A 76 29.975 16.932 16.275 1.00 25.64 H new HETATM 0 HG2 MSE A 76 32.202 16.836 16.396 1.00 29.83 H new HETATM 0 HG3 MSE A 76 32.177 16.588 17.936 1.00 29.83 H new HETATM 0 HE1 MSE A 76 33.565 13.199 17.445 1.00 34.00 H new HETATM 0 HE2 MSE A 76 34.004 14.641 16.959 1.00 34.00 H new HETATM 0 HE3 MSE A 76 33.401 14.444 18.410 1.00 34.00 H new ATOM 575 N GLU A 77 28.036 19.206 17.018 1.00 25.62 N ATOM 576 CA GLU A 77 26.615 19.388 17.124 1.00 25.28 C ATOM 577 C GLU A 77 25.950 19.434 15.772 1.00 25.51 C ATOM 578 O GLU A 77 26.249 20.301 14.956 1.00 23.87 O ATOM 579 CB GLU A 77 26.278 20.650 17.933 1.00 25.31 C ATOM 580 CG GLU A 77 24.784 20.825 18.021 1.00 26.48 C ATOM 581 CD GLU A 77 24.344 21.813 19.051 1.00 28.82 C ATOM 582 OE1 GLU A 77 25.029 21.955 20.067 1.00 32.58 O ATOM 583 OE2 GLU A 77 23.292 22.447 18.824 1.00 32.71 O ATOM 0 H GLU A 77 28.405 19.561 16.327 1.00 25.62 H new ATOM 0 HA GLU A 77 26.265 18.616 17.597 1.00 25.28 H new ATOM 0 HB2 GLU A 77 26.656 20.582 18.824 1.00 25.31 H new ATOM 0 HB3 GLU A 77 26.678 21.428 17.514 1.00 25.31 H new ATOM 0 HG2 GLU A 77 24.450 21.105 17.155 1.00 26.48 H new ATOM 0 HG3 GLU A 77 24.379 19.966 18.217 1.00 26.48 H new ATOM 584 N LYS A 78 25.030 18.486 15.572 1.00 24.80 N ATOM 585 CA LYS A 78 24.288 18.373 14.315 1.00 26.40 C ATOM 586 C LYS A 78 23.291 19.517 14.270 1.00 26.19 C ATOM 587 O LYS A 78 22.602 19.795 15.241 1.00 25.99 O ATOM 588 CB LYS A 78 23.604 17.013 14.187 1.00 26.38 C ATOM 589 CG LYS A 78 22.971 16.765 12.828 1.00 29.52 C ATOM 590 CD LYS A 78 22.640 15.339 12.646 1.00 34.21 C ATOM 591 CE LYS A 78 23.588 14.668 11.654 1.00 37.53 C ATOM 592 NZ LYS A 78 23.284 13.173 11.503 1.00 38.86 N ATOM 0 H LYS A 78 24.820 17.894 16.159 1.00 24.80 H new ATOM 0 HA LYS A 78 24.894 18.433 13.560 1.00 26.40 H new ATOM 0 HB2 LYS A 78 24.255 16.316 14.362 1.00 26.38 H new ATOM 0 HB3 LYS A 78 22.920 16.940 14.870 1.00 26.38 H new ATOM 0 HG2 LYS A 78 22.167 17.300 12.741 1.00 29.52 H new ATOM 0 HG3 LYS A 78 23.579 17.050 12.128 1.00 29.52 H new ATOM 0 HD2 LYS A 78 22.688 14.883 13.501 1.00 34.21 H new ATOM 0 HD3 LYS A 78 21.727 15.255 12.330 1.00 34.21 H new ATOM 0 HE2 LYS A 78 23.514 15.103 10.790 1.00 37.53 H new ATOM 0 HE3 LYS A 78 24.504 14.784 11.952 1.00 37.53 H new ATOM 0 HZ1 LYS A 78 23.738 12.846 10.811 1.00 38.86 H new ATOM 0 HZ2 LYS A 78 23.525 12.744 12.245 1.00 38.86 H new ATOM 0 HZ3 LYS A 78 22.412 13.060 11.365 1.00 38.86 H new ATOM 593 N LEU A 79 23.262 20.192 13.136 1.00 25.89 N ATOM 594 CA LEU A 79 22.435 21.376 12.932 1.00 25.33 C ATOM 595 C LEU A 79 21.198 20.993 12.132 1.00 26.24 C ATOM 596 O LEU A 79 21.105 19.894 11.641 1.00 26.35 O ATOM 597 CB LEU A 79 23.225 22.460 12.222 1.00 25.66 C ATOM 598 CG LEU A 79 24.606 22.810 12.833 1.00 24.01 C ATOM 599 CD1 LEU A 79 25.214 23.968 12.103 1.00 22.12 C ATOM 600 CD2 LEU A 79 24.450 23.071 14.351 1.00 16.54 C ATOM 0 H LEU A 79 23.729 19.975 12.448 1.00 25.89 H new ATOM 0 HA LEU A 79 22.158 21.728 13.792 1.00 25.33 H new ATOM 0 HB2 LEU A 79 23.359 22.186 11.301 1.00 25.66 H new ATOM 0 HB3 LEU A 79 22.687 23.267 12.202 1.00 25.66 H new ATOM 0 HG LEU A 79 25.217 22.064 12.730 1.00 24.01 H new ATOM 0 HD11 LEU A 79 26.077 24.179 12.492 1.00 22.12 H new ATOM 0 HD12 LEU A 79 25.329 23.737 11.168 1.00 22.12 H new ATOM 0 HD13 LEU A 79 24.630 24.739 12.175 1.00 22.12 H new ATOM 0 HD21 LEU A 79 25.315 23.290 14.732 1.00 16.54 H new ATOM 0 HD22 LEU A 79 23.839 23.811 14.491 1.00 16.54 H new ATOM 0 HD23 LEU A 79 24.099 22.276 14.782 1.00 16.54 H new ATOM 601 N PRO A 80 20.246 21.901 12.013 1.00 26.08 N ATOM 602 CA PRO A 80 18.995 21.557 11.347 1.00 26.43 C ATOM 603 C PRO A 80 19.151 21.339 9.829 1.00 25.65 C ATOM 604 O PRO A 80 18.371 20.620 9.207 1.00 27.33 O ATOM 605 CB PRO A 80 18.093 22.766 11.645 1.00 26.54 C ATOM 606 CG PRO A 80 18.706 23.476 12.763 1.00 26.68 C ATOM 607 CD PRO A 80 20.198 23.213 12.671 1.00 27.38 C ATOM 0 HA PRO A 80 18.638 20.714 11.667 1.00 26.43 H new ATOM 0 HB2 PRO A 80 18.021 23.342 10.868 1.00 26.54 H new ATOM 0 HB3 PRO A 80 17.194 22.479 11.870 1.00 26.54 H new ATOM 0 HG2 PRO A 80 18.519 24.426 12.713 1.00 26.68 H new ATOM 0 HG3 PRO A 80 18.351 23.161 13.609 1.00 26.68 H new ATOM 0 HD2 PRO A 80 20.654 23.894 12.153 1.00 27.38 H new ATOM 0 HD3 PRO A 80 20.617 23.194 13.546 1.00 27.38 H new ATOM 608 N ASP A 81 20.139 21.975 9.234 1.00 24.17 N ATOM 609 CA ASP A 81 20.372 21.804 7.781 1.00 24.22 C ATOM 610 C ASP A 81 21.098 20.469 7.496 1.00 23.81 C ATOM 611 O ASP A 81 21.361 20.106 6.353 1.00 25.04 O ATOM 612 CB ASP A 81 21.132 22.996 7.189 1.00 23.93 C ATOM 613 CG ASP A 81 22.467 23.213 7.846 1.00 24.86 C ATOM 614 OD1 ASP A 81 22.850 22.407 8.697 1.00 26.60 O ATOM 615 OD2 ASP A 81 23.139 24.207 7.534 1.00 26.95 O ATOM 0 H ASP A 81 20.687 22.506 9.630 1.00 24.17 H new ATOM 0 HA ASP A 81 19.508 21.772 7.342 1.00 24.22 H new ATOM 0 HB2 ASP A 81 21.262 22.853 6.239 1.00 23.93 H new ATOM 0 HB3 ASP A 81 20.594 23.798 7.284 1.00 23.93 H new ATOM 616 N GLY A 82 21.416 19.749 8.555 1.00 24.05 N ATOM 617 CA GLY A 82 22.012 18.431 8.437 1.00 23.70 C ATOM 618 C GLY A 82 23.529 18.464 8.557 1.00 23.42 C ATOM 619 O GLY A 82 24.183 17.426 8.573 1.00 23.32 O ATOM 0 H GLY A 82 21.293 20.010 9.365 1.00 24.05 H new ATOM 0 HA2 GLY A 82 21.649 17.852 9.125 1.00 23.70 H new ATOM 0 HA3 GLY A 82 21.767 18.044 7.582 1.00 23.70 H new ATOM 620 N SER A 83 24.089 19.671 8.643 1.00 23.93 N ATOM 621 CA SER A 83 25.553 19.819 8.799 1.00 23.29 C ATOM 622 C SER A 83 25.898 19.589 10.259 1.00 23.26 C ATOM 623 O SER A 83 25.010 19.461 11.107 1.00 21.64 O ATOM 624 CB SER A 83 26.051 21.196 8.394 1.00 23.73 C ATOM 625 OG SER A 83 25.427 22.188 9.158 1.00 26.87 O ATOM 0 H SER A 83 23.653 20.412 8.614 1.00 23.93 H new ATOM 0 HA SER A 83 25.982 19.173 8.217 1.00 23.29 H new ATOM 0 HB2 SER A 83 27.012 21.246 8.513 1.00 23.73 H new ATOM 0 HB3 SER A 83 25.873 21.346 7.452 1.00 23.73 H new ATOM 0 HG SER A 83 24.612 22.223 8.960 1.00 26.87 H new ATOM 626 N VAL A 84 27.194 19.512 10.535 1.00 22.06 N ATOM 627 CA VAL A 84 27.689 19.362 11.911 1.00 22.28 C ATOM 628 C VAL A 84 28.666 20.489 12.184 1.00 22.21 C ATOM 629 O VAL A 84 29.646 20.664 11.476 1.00 22.76 O ATOM 630 CB VAL A 84 28.364 17.960 12.168 1.00 22.85 C ATOM 631 CG1 VAL A 84 28.993 17.887 13.558 1.00 21.80 C ATOM 632 CG2 VAL A 84 27.354 16.845 11.935 1.00 20.81 C ATOM 0 H VAL A 84 27.813 19.544 9.939 1.00 22.06 H new ATOM 0 HA VAL A 84 26.935 19.407 12.519 1.00 22.28 H new ATOM 0 HB VAL A 84 29.089 17.844 11.534 1.00 22.85 H new ATOM 0 HG11 VAL A 84 29.398 17.015 13.685 1.00 21.80 H new ATOM 0 HG12 VAL A 84 29.672 18.574 13.643 1.00 21.80 H new ATOM 0 HG13 VAL A 84 28.308 18.025 14.231 1.00 21.80 H new ATOM 0 HG21 VAL A 84 27.777 15.987 12.095 1.00 20.81 H new ATOM 0 HG22 VAL A 84 26.605 16.954 12.542 1.00 20.81 H new ATOM 0 HG23 VAL A 84 27.036 16.883 11.019 1.00 20.81 H new HETATM 633 N MSE A 85 28.402 21.216 13.257 1.00 23.13 N HETATM 634 CA MSE A 85 29.286 22.281 13.706 1.00 22.41 C HETATM 635 C MSE A 85 30.251 21.696 14.683 1.00 22.14 C HETATM 636 O MSE A 85 29.891 20.960 15.587 1.00 22.01 O HETATM 637 CB MSE A 85 28.526 23.387 14.443 1.00 22.09 C HETATM 638 CG MSE A 85 29.321 24.601 14.669 1.00 19.89 C HETATM 639 SE MSE A 85 29.530 25.669 13.090 0.75 20.73 SE HETATM 640 CE MSE A 85 30.464 27.205 13.760 1.00 22.27 C HETATM 0 H MSE A 85 27.704 21.107 13.748 1.00 23.13 H new HETATM 0 HA MSE A 85 29.718 22.660 12.925 1.00 22.41 H new HETATM 0 HB2 MSE A 85 27.734 23.619 13.933 1.00 22.09 H new HETATM 0 HB3 MSE A 85 28.223 23.045 15.298 1.00 22.09 H new HETATM 0 HG2 MSE A 85 28.898 25.134 15.360 1.00 19.89 H new HETATM 0 HG3 MSE A 85 30.197 24.350 15.001 1.00 19.89 H new HETATM 0 HE1 MSE A 85 30.627 27.827 13.034 1.00 22.27 H new HETATM 0 HE2 MSE A 85 29.927 27.638 14.442 1.00 22.27 H new HETATM 0 HE3 MSE A 85 31.310 26.927 14.144 1.00 22.27 H new ATOM 641 N LEU A 86 31.486 22.088 14.500 1.00 22.41 N ATOM 642 CA LEU A 86 32.558 21.649 15.369 1.00 22.39 C ATOM 643 C LEU A 86 33.159 22.849 16.024 1.00 22.66 C ATOM 644 O LEU A 86 33.269 23.942 15.422 1.00 22.55 O ATOM 645 CB LEU A 86 33.645 20.970 14.573 1.00 22.35 C ATOM 646 CG LEU A 86 33.227 19.764 13.728 1.00 21.92 C ATOM 647 CD1 LEU A 86 34.397 19.386 12.873 1.00 25.27 C ATOM 648 CD2 LEU A 86 32.704 18.565 14.610 1.00 18.05 C ATOM 0 H LEU A 86 31.734 22.617 13.869 1.00 22.41 H new ATOM 0 HA LEU A 86 32.196 21.028 16.021 1.00 22.39 H new ATOM 0 HB2 LEU A 86 34.045 21.628 13.984 1.00 22.35 H new ATOM 0 HB3 LEU A 86 34.337 20.683 15.189 1.00 22.35 H new ATOM 0 HG LEU A 86 32.473 19.998 13.165 1.00 21.92 H new ATOM 0 HD11 LEU A 86 34.163 18.622 12.324 1.00 25.27 H new ATOM 0 HD12 LEU A 86 34.636 20.133 12.302 1.00 25.27 H new ATOM 0 HD13 LEU A 86 35.151 19.158 13.439 1.00 25.27 H new ATOM 0 HD21 LEU A 86 32.451 17.826 14.035 1.00 18.05 H new ATOM 0 HD22 LEU A 86 33.406 18.278 15.215 1.00 18.05 H new ATOM 0 HD23 LEU A 86 31.933 18.853 15.123 1.00 18.05 H new ATOM 649 N GLY A 87 33.529 22.625 17.275 1.00 20.58 N ATOM 650 CA GLY A 87 34.303 23.580 18.021 1.00 20.20 C ATOM 651 C GLY A 87 34.694 23.127 19.397 1.00 19.85 C ATOM 652 O GLY A 87 34.696 21.943 19.707 1.00 21.19 O ATOM 0 H GLY A 87 33.334 21.910 17.711 1.00 20.58 H new ATOM 0 HA2 GLY A 87 35.108 23.788 17.521 1.00 20.20 H new ATOM 0 HA3 GLY A 87 33.795 24.403 18.096 1.00 20.20 H new ATOM 653 N GLY A 88 35.078 24.076 20.212 1.00 20.12 N ATOM 654 CA GLY A 88 35.477 23.749 21.554 1.00 20.09 C ATOM 655 C GLY A 88 36.728 22.881 21.556 1.00 20.63 C ATOM 656 O GLY A 88 36.897 22.031 22.409 1.00 19.90 O ATOM 0 H GLY A 88 35.115 24.911 20.011 1.00 20.12 H new ATOM 0 HA2 GLY A 88 35.644 24.564 22.053 1.00 20.09 H new ATOM 0 HA3 GLY A 88 34.756 23.283 22.005 1.00 20.09 H new ATOM 657 N LEU A 89 37.582 23.064 20.548 1.00 20.63 N ATOM 658 CA LEU A 89 38.886 22.347 20.475 1.00 20.69 C ATOM 659 C LEU A 89 39.872 22.875 21.537 1.00 20.99 C ATOM 660 O LEU A 89 40.374 24.007 21.489 1.00 19.80 O ATOM 661 CB LEU A 89 39.503 22.383 19.041 1.00 20.87 C ATOM 662 CG LEU A 89 40.511 21.253 18.726 1.00 20.70 C ATOM 663 CD1 LEU A 89 40.840 21.209 17.204 1.00 21.36 C ATOM 664 CD2 LEU A 89 41.838 21.356 19.547 1.00 21.87 C ATOM 0 H LEU A 89 37.436 23.597 19.889 1.00 20.63 H new ATOM 0 HA LEU A 89 38.711 21.414 20.674 1.00 20.69 H new ATOM 0 HB2 LEU A 89 38.782 22.343 18.394 1.00 20.87 H new ATOM 0 HB3 LEU A 89 39.947 23.236 18.918 1.00 20.87 H new ATOM 0 HG LEU A 89 40.073 20.429 18.992 1.00 20.70 H new ATOM 0 HD11 LEU A 89 41.473 20.495 17.030 1.00 21.36 H new ATOM 0 HD12 LEU A 89 40.026 21.049 16.701 1.00 21.36 H new ATOM 0 HD13 LEU A 89 41.227 22.056 16.932 1.00 21.36 H new ATOM 0 HD21 LEU A 89 42.426 20.623 19.306 1.00 21.87 H new ATOM 0 HD22 LEU A 89 42.276 22.199 19.350 1.00 21.87 H new ATOM 0 HD23 LEU A 89 41.637 21.310 20.495 1.00 21.87 H new ATOM 665 N ARG A 90 40.119 22.009 22.511 1.00 21.81 N ATOM 666 CA ARG A 90 40.985 22.316 23.666 1.00 21.10 C ATOM 667 C ARG A 90 41.895 21.166 23.994 1.00 21.47 C ATOM 668 O ARG A 90 41.594 20.014 23.748 1.00 21.61 O ATOM 669 CB ARG A 90 40.139 22.711 24.883 1.00 21.08 C ATOM 670 CG ARG A 90 39.437 24.036 24.655 1.00 21.62 C ATOM 671 CD ARG A 90 38.649 24.511 25.871 1.00 21.39 C ATOM 672 NE ARG A 90 38.050 25.817 25.632 1.00 20.95 N ATOM 673 CZ ARG A 90 37.539 26.604 26.577 1.00 18.07 C ATOM 674 NH1 ARG A 90 37.504 26.224 27.844 1.00 19.79 N ATOM 675 NH2 ARG A 90 37.103 27.806 26.268 1.00 20.74 N ATOM 0 H ARG A 90 39.789 21.215 22.529 1.00 21.81 H new ATOM 0 HA ARG A 90 41.546 23.070 23.425 1.00 21.10 H new ATOM 0 HB2 ARG A 90 39.482 22.020 25.061 1.00 21.08 H new ATOM 0 HB3 ARG A 90 40.706 22.773 25.668 1.00 21.08 H new ATOM 0 HG2 ARG A 90 40.095 24.709 24.420 1.00 21.62 H new ATOM 0 HG3 ARG A 90 38.835 23.951 23.899 1.00 21.62 H new ATOM 0 HD2 ARG A 90 37.955 23.867 26.081 1.00 21.39 H new ATOM 0 HD3 ARG A 90 39.236 24.557 26.642 1.00 21.39 H new ATOM 0 HE ARG A 90 38.024 26.101 24.821 1.00 20.95 H new ATOM 0 HH11 ARG A 90 37.815 25.455 28.071 1.00 19.79 H new ATOM 0 HH12 ARG A 90 37.170 26.746 28.440 1.00 19.79 H new ATOM 0 HH21 ARG A 90 37.148 28.084 25.455 1.00 20.74 H new ATOM 0 HH22 ARG A 90 36.773 28.314 26.879 1.00 20.74 H new ATOM 676 N VAL A 91 43.058 21.527 24.513 1.00 21.33 N ATOM 677 CA VAL A 91 44.068 20.578 24.900 1.00 21.26 C ATOM 678 C VAL A 91 44.556 20.913 26.332 1.00 22.13 C ATOM 679 O VAL A 91 44.531 22.079 26.827 1.00 20.73 O ATOM 680 CB VAL A 91 45.276 20.551 23.908 1.00 21.37 C ATOM 681 CG1 VAL A 91 44.790 20.336 22.413 1.00 19.08 C ATOM 682 CG2 VAL A 91 46.139 21.833 24.038 1.00 22.61 C ATOM 0 H VAL A 91 43.280 22.346 24.650 1.00 21.33 H new ATOM 0 HA VAL A 91 43.671 19.693 24.879 1.00 21.26 H new ATOM 0 HB VAL A 91 45.834 19.794 24.147 1.00 21.37 H new ATOM 0 HG11 VAL A 91 45.559 20.324 21.821 1.00 19.08 H new ATOM 0 HG12 VAL A 91 44.316 19.492 22.345 1.00 19.08 H new ATOM 0 HG13 VAL A 91 44.198 21.061 22.158 1.00 19.08 H new ATOM 0 HG21 VAL A 91 46.879 21.790 23.413 1.00 22.61 H new ATOM 0 HG22 VAL A 91 45.595 22.611 23.840 1.00 22.61 H new ATOM 0 HG23 VAL A 91 46.484 21.901 24.942 1.00 22.61 H new ATOM 683 N HIS A 92 44.964 19.847 26.993 1.00 22.49 N ATOM 684 CA HIS A 92 45.612 19.969 28.272 1.00 24.28 C ATOM 685 C HIS A 92 46.875 20.835 28.057 1.00 24.61 C ATOM 686 O HIS A 92 47.554 20.713 27.058 1.00 23.30 O ATOM 687 CB HIS A 92 45.991 18.600 28.817 1.00 25.70 C ATOM 688 CG HIS A 92 46.739 18.692 30.107 1.00 30.15 C ATOM 689 ND1 HIS A 92 48.099 18.909 30.165 1.00 31.50 N ATOM 690 CD2 HIS A 92 46.301 18.694 31.390 1.00 37.32 C ATOM 691 CE1 HIS A 92 48.473 18.980 31.430 1.00 37.39 C ATOM 692 NE2 HIS A 92 47.403 18.856 32.195 1.00 37.55 N ATOM 0 H HIS A 92 44.872 19.039 26.712 1.00 22.49 H new ATOM 0 HA HIS A 92 45.017 20.379 28.919 1.00 24.28 H new ATOM 0 HB2 HIS A 92 45.188 18.072 28.948 1.00 25.70 H new ATOM 0 HB3 HIS A 92 46.534 18.133 28.163 1.00 25.70 H new ATOM 0 HD2 HIS A 92 45.420 18.603 31.673 1.00 37.32 H new ATOM 0 HE1 HIS A 92 49.345 19.098 31.732 1.00 37.39 H new ATOM 0 HE2 HIS A 92 47.397 18.874 33.055 1.00 37.55 H new ATOM 693 N PRO A 93 47.205 21.712 29.007 1.00 25.79 N ATOM 694 CA PRO A 93 48.267 22.680 28.731 1.00 26.69 C ATOM 695 C PRO A 93 49.661 22.104 28.507 1.00 26.42 C ATOM 696 O PRO A 93 50.490 22.722 27.847 1.00 27.03 O ATOM 697 CB PRO A 93 48.226 23.592 29.941 1.00 27.04 C ATOM 698 CG PRO A 93 46.921 23.386 30.511 1.00 27.65 C ATOM 699 CD PRO A 93 46.547 21.985 30.278 1.00 26.14 C ATOM 0 HA PRO A 93 48.104 23.122 27.883 1.00 26.69 H new ATOM 0 HB2 PRO A 93 48.926 23.369 30.574 1.00 27.04 H new ATOM 0 HB3 PRO A 93 48.357 24.519 29.688 1.00 27.04 H new ATOM 0 HG2 PRO A 93 46.930 23.582 31.461 1.00 27.65 H new ATOM 0 HG3 PRO A 93 46.274 23.983 30.104 1.00 27.65 H new ATOM 0 HD2 PRO A 93 46.863 21.401 30.985 1.00 26.14 H new ATOM 0 HD3 PRO A 93 45.586 21.869 30.223 1.00 26.14 H new ATOM 700 N GLU A 94 49.878 20.901 28.994 1.00 26.07 N ATOM 701 CA GLU A 94 51.163 20.166 28.771 1.00 26.48 C ATOM 702 C GLU A 94 51.354 19.730 27.332 1.00 26.20 C ATOM 703 O GLU A 94 52.444 19.340 26.932 1.00 24.57 O ATOM 704 CB GLU A 94 51.207 18.890 29.621 1.00 27.46 C ATOM 705 CG GLU A 94 51.317 19.150 31.059 1.00 31.79 C ATOM 706 CD GLU A 94 52.745 19.330 31.473 1.00 39.51 C ATOM 707 OE1 GLU A 94 53.486 18.304 31.475 1.00 43.44 O ATOM 708 OE2 GLU A 94 53.120 20.488 31.809 1.00 43.11 O ATOM 0 H GLU A 94 49.303 20.468 29.464 1.00 26.07 H new ATOM 0 HA GLU A 94 51.863 20.791 29.016 1.00 26.48 H new ATOM 0 HB2 GLU A 94 50.405 18.371 29.454 1.00 27.46 H new ATOM 0 HB3 GLU A 94 51.960 18.348 29.339 1.00 27.46 H new ATOM 0 HG2 GLU A 94 50.810 19.945 31.286 1.00 31.79 H new ATOM 0 HG3 GLU A 94 50.925 18.413 31.554 1.00 31.79 H new ATOM 709 N TYR A 95 50.286 19.812 26.540 1.00 24.65 N ATOM 710 CA TYR A 95 50.320 19.257 25.177 1.00 25.47 C ATOM 711 C TYR A 95 50.275 20.333 24.099 1.00 27.44 C ATOM 712 O TYR A 95 50.108 20.071 22.901 1.00 27.81 O ATOM 713 CB TYR A 95 49.144 18.307 24.967 1.00 25.21 C ATOM 714 CG TYR A 95 49.184 17.033 25.789 1.00 24.46 C ATOM 715 CD1 TYR A 95 48.911 17.036 27.163 1.00 25.32 C ATOM 716 CD2 TYR A 95 49.486 15.810 25.190 1.00 25.96 C ATOM 717 CE1 TYR A 95 48.940 15.854 27.894 1.00 25.18 C ATOM 718 CE2 TYR A 95 49.516 14.645 25.924 1.00 25.70 C ATOM 719 CZ TYR A 95 49.238 14.666 27.263 1.00 24.85 C ATOM 720 OH TYR A 95 49.269 13.463 27.971 1.00 26.78 O ATOM 0 H TYR A 95 49.541 20.178 26.764 1.00 24.65 H new ATOM 0 HA TYR A 95 51.163 18.785 25.094 1.00 25.47 H new ATOM 0 HB2 TYR A 95 48.323 18.781 25.173 1.00 25.21 H new ATOM 0 HB3 TYR A 95 49.105 18.067 24.028 1.00 25.21 H new ATOM 0 HD1 TYR A 95 48.708 17.837 27.590 1.00 25.32 H new ATOM 0 HD2 TYR A 95 49.670 15.781 24.279 1.00 25.96 H new ATOM 0 HE1 TYR A 95 48.759 15.865 28.806 1.00 25.18 H new ATOM 0 HE2 TYR A 95 49.726 13.841 25.507 1.00 25.70 H new ATOM 0 HH TYR A 95 49.999 13.073 27.829 1.00 26.78 H new ATOM 721 N ARG A 96 50.433 21.563 24.536 1.00 29.33 N ATOM 722 CA ARG A 96 50.468 22.681 23.582 1.00 31.45 C ATOM 723 C ARG A 96 51.643 22.496 22.634 1.00 32.00 C ATOM 724 O ARG A 96 52.740 22.115 23.049 1.00 32.45 O ATOM 725 CB ARG A 96 50.580 24.039 24.292 1.00 31.47 C ATOM 726 CG ARG A 96 49.425 24.343 25.148 1.00 34.09 C ATOM 727 CD ARG A 96 49.578 25.672 25.846 1.00 40.36 C ATOM 728 NE ARG A 96 50.591 25.560 26.881 1.00 43.29 N ATOM 729 CZ ARG A 96 50.766 26.447 27.842 1.00 47.76 C ATOM 730 NH1 ARG A 96 49.962 27.501 27.915 1.00 50.50 N ATOM 731 NH2 ARG A 96 51.723 26.266 28.740 1.00 47.64 N ATOM 0 H ARG A 96 50.521 21.783 25.363 1.00 29.33 H new ATOM 0 HA ARG A 96 49.634 22.679 23.087 1.00 31.45 H new ATOM 0 HB2 ARG A 96 51.386 24.050 24.831 1.00 31.47 H new ATOM 0 HB3 ARG A 96 50.675 24.738 23.626 1.00 31.47 H new ATOM 0 HG2 ARG A 96 48.618 24.351 24.611 1.00 34.09 H new ATOM 0 HG3 ARG A 96 49.319 23.641 25.809 1.00 34.09 H new ATOM 0 HD2 ARG A 96 49.829 26.357 25.207 1.00 40.36 H new ATOM 0 HD3 ARG A 96 48.732 25.943 26.235 1.00 40.36 H new ATOM 0 HE ARG A 96 51.109 24.873 26.867 1.00 43.29 H new ATOM 0 HH11 ARG A 96 49.332 27.602 27.338 1.00 50.50 H new ATOM 0 HH12 ARG A 96 50.071 28.083 28.539 1.00 50.50 H new ATOM 0 HH21 ARG A 96 52.228 25.572 28.696 1.00 47.64 H new ATOM 0 HH22 ARG A 96 51.839 26.843 29.367 1.00 47.64 H new ATOM 732 N GLY A 97 51.400 22.767 21.354 1.00 34.00 N ATOM 733 CA GLY A 97 52.460 22.670 20.336 1.00 34.19 C ATOM 734 C GLY A 97 52.563 21.268 19.769 1.00 34.62 C ATOM 735 O GLY A 97 53.313 21.000 18.841 1.00 34.87 O ATOM 0 H GLY A 97 50.633 23.008 21.049 1.00 34.00 H new ATOM 0 HA2 GLY A 97 52.279 23.297 19.619 1.00 34.19 H new ATOM 0 HA3 GLY A 97 53.310 22.925 20.728 1.00 34.19 H new ATOM 736 N SER A 98 51.800 20.358 20.355 1.00 34.69 N ATOM 737 CA SER A 98 51.771 18.984 19.853 1.00 34.34 C ATOM 738 C SER A 98 50.886 18.953 18.614 1.00 33.64 C ATOM 739 O SER A 98 50.495 19.986 18.091 1.00 32.82 O ATOM 740 CB SER A 98 51.202 18.023 20.884 1.00 34.21 C ATOM 741 OG SER A 98 49.828 18.307 21.102 1.00 37.12 O ATOM 0 H SER A 98 51.296 20.508 21.036 1.00 34.69 H new ATOM 0 HA SER A 98 52.678 18.706 19.651 1.00 34.34 H new ATOM 0 HB2 SER A 98 51.307 17.108 20.578 1.00 34.21 H new ATOM 0 HB3 SER A 98 51.693 18.102 21.717 1.00 34.21 H new ATOM 0 HG SER A 98 49.755 18.906 21.686 1.00 37.12 H new ATOM 742 N ARG A 99 50.571 17.754 18.156 1.00 32.73 N ATOM 743 CA ARG A 99 49.724 17.609 16.991 1.00 32.86 C ATOM 744 C ARG A 99 48.384 17.040 17.430 1.00 30.71 C ATOM 745 O ARG A 99 47.677 16.388 16.679 1.00 28.64 O ATOM 746 CB ARG A 99 50.440 16.766 15.924 1.00 34.05 C ATOM 747 CG ARG A 99 51.315 17.657 15.033 1.00 37.70 C ATOM 748 CD ARG A 99 52.729 17.127 14.747 1.00 44.64 C ATOM 749 NE ARG A 99 52.794 15.940 13.886 1.00 49.05 N ATOM 750 CZ ARG A 99 53.262 14.757 14.281 1.00 51.83 C ATOM 751 NH1 ARG A 99 53.724 14.599 15.515 1.00 54.02 N ATOM 752 NH2 ARG A 99 53.291 13.730 13.443 1.00 51.81 N ATOM 0 H ARG A 99 50.837 17.014 18.505 1.00 32.73 H new ATOM 0 HA ARG A 99 49.547 18.467 16.575 1.00 32.86 H new ATOM 0 HB2 ARG A 99 50.988 16.090 16.352 1.00 34.05 H new ATOM 0 HB3 ARG A 99 49.786 16.299 15.381 1.00 34.05 H new ATOM 0 HG2 ARG A 99 50.859 17.788 14.187 1.00 37.70 H new ATOM 0 HG3 ARG A 99 51.392 18.529 15.451 1.00 37.70 H new ATOM 0 HD2 ARG A 99 53.246 17.836 14.334 1.00 44.64 H new ATOM 0 HD3 ARG A 99 53.157 16.919 15.592 1.00 44.64 H new ATOM 0 HE ARG A 99 52.513 16.013 13.077 1.00 49.05 H new ATOM 0 HH11 ARG A 99 53.722 15.262 16.063 1.00 54.02 H new ATOM 0 HH12 ARG A 99 54.025 13.834 15.767 1.00 54.02 H new ATOM 0 HH21 ARG A 99 53.006 13.824 12.637 1.00 51.81 H new ATOM 0 HH22 ARG A 99 53.595 12.969 13.705 1.00 51.81 H new ATOM 753 N LEU A 100 48.050 17.298 18.688 1.00 28.37 N ATOM 754 CA LEU A 100 46.783 16.792 19.215 1.00 27.11 C ATOM 755 C LEU A 100 45.609 17.371 18.445 1.00 26.45 C ATOM 756 O LEU A 100 44.615 16.691 18.201 1.00 27.62 O ATOM 757 CB LEU A 100 46.595 17.125 20.702 1.00 27.13 C ATOM 758 CG LEU A 100 47.266 16.319 21.768 1.00 27.32 C ATOM 759 CD1 LEU A 100 46.583 16.598 23.116 1.00 22.94 C ATOM 760 CD2 LEU A 100 47.174 14.848 21.425 1.00 29.37 C ATOM 0 H LEU A 100 48.526 17.751 19.243 1.00 28.37 H new ATOM 0 HA LEU A 100 46.813 15.828 19.112 1.00 27.11 H new ATOM 0 HB2 LEU A 100 46.876 18.045 20.824 1.00 27.13 H new ATOM 0 HB3 LEU A 100 45.642 17.094 20.881 1.00 27.13 H new ATOM 0 HG LEU A 100 48.202 16.566 21.829 1.00 27.32 H new ATOM 0 HD11 LEU A 100 47.015 16.077 23.811 1.00 22.94 H new ATOM 0 HD12 LEU A 100 46.656 17.542 23.327 1.00 22.94 H new ATOM 0 HD13 LEU A 100 45.647 16.351 23.062 1.00 22.94 H new ATOM 0 HD21 LEU A 100 47.610 14.326 22.117 1.00 29.37 H new ATOM 0 HD22 LEU A 100 46.242 14.588 21.363 1.00 29.37 H new ATOM 0 HD23 LEU A 100 47.612 14.686 20.575 1.00 29.37 H new ATOM 761 N GLY A 101 45.738 18.630 18.048 1.00 25.49 N ATOM 762 CA GLY A 101 44.628 19.331 17.398 1.00 24.86 C ATOM 763 C GLY A 101 44.326 18.629 16.091 1.00 25.35 C ATOM 764 O GLY A 101 43.210 18.259 15.791 1.00 23.44 O ATOM 0 H GLY A 101 46.453 19.098 18.143 1.00 25.49 H new ATOM 0 HA2 GLY A 101 43.845 19.330 17.971 1.00 24.86 H new ATOM 0 HA3 GLY A 101 44.861 20.259 17.238 1.00 24.86 H new HETATM 765 N MSE A 102 45.373 18.435 15.319 1.00 25.45 N HETATM 766 CA MSE A 102 45.250 17.711 14.078 1.00 26.23 C HETATM 767 C MSE A 102 44.692 16.300 14.245 1.00 25.43 C HETATM 768 O MSE A 102 43.834 15.876 13.498 1.00 26.17 O HETATM 769 CB MSE A 102 46.609 17.653 13.455 1.00 27.36 C HETATM 770 CG MSE A 102 46.823 16.470 12.601 1.00 33.26 C HETATM 771 SE MSE A 102 47.891 17.187 11.231 0.75 45.50 SE HETATM 772 CE MSE A 102 46.250 17.886 10.397 1.00 42.09 C HETATM 0 H MSE A 102 46.166 18.716 15.496 1.00 25.45 H new HETATM 0 HA MSE A 102 44.613 18.179 13.516 1.00 26.23 H new HETATM 0 HB2 MSE A 102 46.747 18.453 12.925 1.00 27.36 H new HETATM 0 HB3 MSE A 102 47.278 17.660 14.157 1.00 27.36 H new HETATM 0 HG2 MSE A 102 47.271 15.753 13.076 1.00 33.26 H new HETATM 0 HG3 MSE A 102 45.989 16.108 12.263 1.00 33.26 H new HETATM 0 HE1 MSE A 102 46.478 18.360 9.582 1.00 42.09 H new HETATM 0 HE2 MSE A 102 45.654 17.150 10.187 1.00 42.09 H new HETATM 0 HE3 MSE A 102 45.808 18.494 11.011 1.00 42.09 H new ATOM 773 N SER A 103 45.128 15.608 15.281 1.00 24.62 N ATOM 774 CA SER A 103 44.728 14.205 15.477 1.00 24.79 C ATOM 775 C SER A 103 43.289 14.140 15.821 1.00 23.10 C ATOM 776 O SER A 103 42.585 13.304 15.333 1.00 24.28 O ATOM 777 CB SER A 103 45.505 13.506 16.591 1.00 25.33 C ATOM 778 OG SER A 103 46.901 13.536 16.298 1.00 29.02 O ATOM 0 H SER A 103 45.654 15.920 15.886 1.00 24.62 H new ATOM 0 HA SER A 103 44.921 13.750 14.642 1.00 24.79 H new ATOM 0 HB2 SER A 103 45.335 13.944 17.440 1.00 25.33 H new ATOM 0 HB3 SER A 103 45.204 12.588 16.680 1.00 25.33 H new ATOM 0 HG SER A 103 47.189 14.320 16.385 1.00 29.02 H new ATOM 779 N ILE A 104 42.854 15.015 16.696 1.00 23.10 N ATOM 780 CA ILE A 104 41.442 14.983 17.111 1.00 24.00 C ATOM 781 C ILE A 104 40.547 15.360 15.940 1.00 23.77 C ATOM 782 O ILE A 104 39.501 14.811 15.787 1.00 25.01 O ATOM 783 CB ILE A 104 41.113 15.803 18.393 1.00 24.02 C ATOM 784 CG1 ILE A 104 39.834 15.209 18.983 1.00 23.90 C ATOM 785 CG2 ILE A 104 41.019 17.349 18.141 1.00 24.21 C ATOM 786 CD1 ILE A 104 39.579 15.595 20.406 1.00 23.75 C ATOM 0 H ILE A 104 43.333 15.627 17.063 1.00 23.10 H new ATOM 0 HA ILE A 104 41.258 14.067 17.373 1.00 24.00 H new ATOM 0 HB ILE A 104 41.842 15.729 19.029 1.00 24.02 H new ATOM 0 HG12 ILE A 104 39.079 15.490 18.442 1.00 23.90 H new ATOM 0 HG13 ILE A 104 39.881 14.242 18.924 1.00 23.90 H new ATOM 0 HG21 ILE A 104 40.813 17.801 18.974 1.00 24.21 H new ATOM 0 HG22 ILE A 104 41.867 17.673 17.799 1.00 24.21 H new ATOM 0 HG23 ILE A 104 40.319 17.530 17.494 1.00 24.21 H new ATOM 0 HD11 ILE A 104 38.755 15.183 20.711 1.00 23.75 H new ATOM 0 HD12 ILE A 104 40.315 15.293 20.960 1.00 23.75 H new ATOM 0 HD13 ILE A 104 39.501 16.560 20.471 1.00 23.75 H new HETATM 787 N MSE A 105 41.000 16.257 15.092 1.00 24.83 N HETATM 788 CA MSE A 105 40.229 16.666 13.895 1.00 24.10 C HETATM 789 C MSE A 105 40.151 15.526 12.873 1.00 24.01 C HETATM 790 O MSE A 105 39.087 15.244 12.249 1.00 23.60 O HETATM 791 CB MSE A 105 40.843 17.916 13.231 1.00 25.31 C HETATM 792 CG MSE A 105 40.598 19.213 14.023 1.00 26.68 C HETATM 793 SE MSE A 105 38.671 19.626 14.091 0.75 30.43 SE HETATM 794 CE MSE A 105 38.372 19.652 12.156 1.00 24.98 C HETATM 0 H MSE A 105 41.758 16.655 15.177 1.00 24.83 H new HETATM 0 HA MSE A 105 39.332 16.883 14.194 1.00 24.10 H new HETATM 0 HB2 MSE A 105 41.798 17.783 13.129 1.00 25.31 H new HETATM 0 HB3 MSE A 105 40.473 18.015 12.340 1.00 25.31 H new HETATM 0 HG2 MSE A 105 40.946 19.119 14.923 1.00 26.68 H new HETATM 0 HG3 MSE A 105 41.077 19.947 13.608 1.00 26.68 H new HETATM 0 HE1 MSE A 105 37.439 19.848 11.975 1.00 24.98 H new HETATM 0 HE2 MSE A 105 38.930 20.335 11.751 1.00 24.98 H new HETATM 0 HE3 MSE A 105 38.599 18.786 11.782 1.00 24.98 H new ATOM 795 N GLN A 106 41.278 14.862 12.680 1.00 22.64 N ATOM 796 CA GLN A 106 41.287 13.679 11.780 1.00 22.89 C ATOM 797 C GLN A 106 40.368 12.555 12.299 1.00 22.58 C ATOM 798 O GLN A 106 39.666 11.909 11.524 1.00 21.42 O ATOM 799 CB GLN A 106 42.688 13.156 11.543 1.00 22.56 C ATOM 800 CG GLN A 106 43.599 14.156 10.884 1.00 26.10 C ATOM 801 CD GLN A 106 45.020 13.650 10.756 1.00 28.89 C ATOM 802 OE1 GLN A 106 45.698 13.381 11.760 1.00 36.05 O ATOM 803 NE2 GLN A 106 45.494 13.567 9.545 1.00 28.20 N ATOM 0 H GLN A 106 42.034 15.058 13.040 1.00 22.64 H new ATOM 0 HA GLN A 106 40.936 13.981 10.928 1.00 22.89 H new ATOM 0 HB2 GLN A 106 43.073 12.888 12.392 1.00 22.56 H new ATOM 0 HB3 GLN A 106 42.639 12.360 10.990 1.00 22.56 H new ATOM 0 HG2 GLN A 106 43.255 14.371 10.003 1.00 26.10 H new ATOM 0 HG3 GLN A 106 43.597 14.979 11.398 1.00 26.10 H new ATOM 0 HE21 GLN A 106 44.994 13.762 8.873 1.00 28.20 H new ATOM 0 HE22 GLN A 106 46.307 13.318 9.418 1.00 28.20 H new ATOM 804 N GLU A 107 40.381 12.314 13.608 1.00 22.79 N ATOM 805 CA GLU A 107 39.497 11.304 14.163 1.00 23.01 C ATOM 806 C GLU A 107 38.080 11.746 13.977 1.00 23.01 C ATOM 807 O GLU A 107 37.201 10.944 13.661 1.00 24.02 O ATOM 808 CB GLU A 107 39.741 11.095 15.653 1.00 23.94 C ATOM 809 CG GLU A 107 41.066 10.565 15.939 1.00 26.45 C ATOM 810 CD GLU A 107 41.168 9.079 15.683 1.00 31.16 C ATOM 811 OE1 GLU A 107 40.128 8.413 15.450 1.00 33.19 O ATOM 812 OE2 GLU A 107 42.308 8.568 15.749 1.00 34.32 O ATOM 0 H GLU A 107 40.884 12.716 14.178 1.00 22.79 H new ATOM 0 HA GLU A 107 39.672 10.469 13.702 1.00 23.01 H new ATOM 0 HB2 GLU A 107 39.628 11.940 16.116 1.00 23.94 H new ATOM 0 HB3 GLU A 107 39.071 10.487 16.004 1.00 23.94 H new ATOM 0 HG2 GLU A 107 41.720 11.029 15.394 1.00 26.45 H new ATOM 0 HG3 GLU A 107 41.289 10.746 16.865 1.00 26.45 H new ATOM 813 N THR A 108 37.844 13.030 14.223 1.00 23.16 N ATOM 814 CA THR A 108 36.497 13.603 14.038 1.00 21.97 C ATOM 815 C THR A 108 35.996 13.474 12.565 1.00 22.63 C ATOM 816 O THR A 108 34.846 13.089 12.313 1.00 20.73 O ATOM 817 CB THR A 108 36.425 15.070 14.531 1.00 22.61 C ATOM 818 OG1 THR A 108 36.715 15.109 15.933 1.00 21.43 O ATOM 819 CG2 THR A 108 35.033 15.713 14.301 1.00 19.65 C ATOM 0 H THR A 108 38.438 13.589 14.496 1.00 23.16 H new ATOM 0 HA THR A 108 35.895 13.078 14.589 1.00 21.97 H new ATOM 0 HB THR A 108 37.075 15.576 14.018 1.00 22.61 H new ATOM 0 HG1 THR A 108 37.543 15.027 16.051 1.00 21.43 H new ATOM 0 HG21 THR A 108 35.041 16.627 14.626 1.00 19.65 H new ATOM 0 HG22 THR A 108 34.827 15.709 13.353 1.00 19.65 H new ATOM 0 HG23 THR A 108 34.359 15.206 14.780 1.00 19.65 H new ATOM 820 N ILE A 109 36.854 13.750 11.582 1.00 22.56 N ATOM 821 CA ILE A 109 36.396 13.688 10.174 1.00 22.52 C ATOM 822 C ILE A 109 35.981 12.278 9.831 1.00 22.70 C ATOM 823 O ILE A 109 34.965 12.045 9.173 1.00 22.99 O ATOM 824 CB ILE A 109 37.465 14.224 9.181 1.00 22.33 C ATOM 825 CG1 ILE A 109 37.606 15.748 9.399 1.00 23.32 C ATOM 826 CG2 ILE A 109 37.095 13.892 7.712 1.00 22.64 C ATOM 827 CD1 ILE A 109 38.921 16.322 8.964 1.00 19.23 C ATOM 0 H ILE A 109 37.678 13.969 11.693 1.00 22.56 H new ATOM 0 HA ILE A 109 35.626 14.272 10.084 1.00 22.52 H new ATOM 0 HB ILE A 109 38.315 13.789 9.351 1.00 22.33 H new ATOM 0 HG12 ILE A 109 36.895 16.199 8.918 1.00 23.32 H new ATOM 0 HG13 ILE A 109 37.478 15.941 10.341 1.00 23.32 H new ATOM 0 HG21 ILE A 109 37.780 14.239 7.119 1.00 22.64 H new ATOM 0 HG22 ILE A 109 37.031 12.930 7.604 1.00 22.64 H new ATOM 0 HG23 ILE A 109 36.242 14.299 7.493 1.00 22.64 H new ATOM 0 HD11 ILE A 109 38.929 17.277 9.133 1.00 19.23 H new ATOM 0 HD12 ILE A 109 39.639 15.900 9.461 1.00 19.23 H new ATOM 0 HD13 ILE A 109 39.047 16.161 8.016 1.00 19.23 H new ATOM 828 N GLN A 110 36.751 11.334 10.337 1.00 24.14 N ATOM 829 CA GLN A 110 36.517 9.910 10.082 1.00 25.09 C ATOM 830 C GLN A 110 35.234 9.453 10.757 1.00 25.02 C ATOM 831 O GLN A 110 34.393 8.796 10.155 1.00 25.29 O ATOM 832 CB GLN A 110 37.703 9.050 10.521 1.00 25.67 C ATOM 833 CG GLN A 110 37.358 7.570 10.523 1.00 30.01 C ATOM 834 CD GLN A 110 38.472 6.671 9.992 1.00 36.61 C ATOM 835 OE1 GLN A 110 39.571 7.132 9.694 1.00 42.99 O ATOM 836 NE2 GLN A 110 38.177 5.387 9.843 1.00 39.78 N ATOM 0 H GLN A 110 37.429 11.493 10.841 1.00 24.14 H new ATOM 0 HA GLN A 110 36.421 9.795 9.124 1.00 25.09 H new ATOM 0 HB2 GLN A 110 38.453 9.206 9.926 1.00 25.67 H new ATOM 0 HB3 GLN A 110 37.985 9.317 11.410 1.00 25.67 H new ATOM 0 HG2 GLN A 110 37.141 7.299 11.429 1.00 30.01 H new ATOM 0 HG3 GLN A 110 36.561 7.433 9.987 1.00 30.01 H new ATOM 0 HE21 GLN A 110 37.398 5.097 10.062 1.00 39.78 H new ATOM 0 HE22 GLN A 110 38.765 4.844 9.528 1.00 39.78 H new ATOM 837 N PHE A 111 35.118 9.832 12.018 1.00 24.77 N ATOM 838 CA PHE A 111 33.946 9.555 12.844 1.00 24.48 C ATOM 839 C PHE A 111 32.626 10.085 12.275 1.00 23.68 C ATOM 840 O PHE A 111 31.570 9.482 12.503 1.00 23.92 O ATOM 841 CB PHE A 111 34.157 10.174 14.228 1.00 25.43 C ATOM 842 CG PHE A 111 33.015 9.958 15.191 1.00 26.40 C ATOM 843 CD1 PHE A 111 32.789 8.719 15.729 1.00 30.27 C ATOM 844 CD2 PHE A 111 32.233 11.026 15.626 1.00 29.98 C ATOM 845 CE1 PHE A 111 31.766 8.509 16.646 1.00 31.13 C ATOM 846 CE2 PHE A 111 31.207 10.820 16.508 1.00 30.88 C ATOM 847 CZ PHE A 111 30.970 9.557 17.022 1.00 30.64 C ATOM 0 H PHE A 111 35.732 10.269 12.432 1.00 24.77 H new ATOM 0 HA PHE A 111 33.865 8.589 12.878 1.00 24.48 H new ATOM 0 HB2 PHE A 111 34.966 9.804 14.615 1.00 25.43 H new ATOM 0 HB3 PHE A 111 34.302 11.128 14.125 1.00 25.43 H new ATOM 0 HD1 PHE A 111 33.330 8.006 15.476 1.00 30.27 H new ATOM 0 HD2 PHE A 111 32.409 11.885 15.315 1.00 29.98 H new ATOM 0 HE1 PHE A 111 31.623 7.662 17.002 1.00 31.13 H new ATOM 0 HE2 PHE A 111 30.666 11.532 16.763 1.00 30.88 H new ATOM 0 HZ PHE A 111 30.272 9.421 17.621 1.00 30.64 H new ATOM 848 N LEU A 112 32.676 11.171 11.503 1.00 22.55 N ATOM 849 CA LEU A 112 31.447 11.824 10.981 1.00 21.72 C ATOM 850 C LEU A 112 31.183 11.486 9.516 1.00 21.88 C ATOM 851 O LEU A 112 30.152 11.815 8.971 1.00 21.60 O ATOM 852 CB LEU A 112 31.465 13.335 11.195 1.00 21.75 C ATOM 853 CG LEU A 112 31.383 13.798 12.650 1.00 22.40 C ATOM 854 CD1 LEU A 112 31.449 15.294 12.691 1.00 22.66 C ATOM 855 CD2 LEU A 112 30.130 13.284 13.308 1.00 23.29 C ATOM 0 H LEU A 112 33.408 11.554 11.264 1.00 22.55 H new ATOM 0 HA LEU A 112 30.712 11.460 11.498 1.00 21.72 H new ATOM 0 HB2 LEU A 112 32.278 13.691 10.805 1.00 21.75 H new ATOM 0 HB3 LEU A 112 30.722 13.723 10.707 1.00 21.75 H new ATOM 0 HG LEU A 112 32.133 13.436 13.147 1.00 22.40 H new ATOM 0 HD11 LEU A 112 31.397 15.595 13.612 1.00 22.66 H new ATOM 0 HD12 LEU A 112 32.285 15.592 12.300 1.00 22.66 H new ATOM 0 HD13 LEU A 112 30.707 15.665 12.188 1.00 22.66 H new ATOM 0 HD21 LEU A 112 30.099 13.589 14.228 1.00 23.29 H new ATOM 0 HD22 LEU A 112 29.354 13.617 12.831 1.00 23.29 H new ATOM 0 HD23 LEU A 112 30.129 12.314 13.289 1.00 23.29 H new ATOM 856 N ARG A 113 32.104 10.744 8.921 1.00 22.20 N ATOM 857 CA ARG A 113 31.974 10.313 7.529 1.00 22.76 C ATOM 858 C ARG A 113 30.714 9.461 7.423 1.00 21.55 C ATOM 859 O ARG A 113 30.581 8.453 8.103 1.00 22.09 O ATOM 860 CB ARG A 113 33.204 9.488 7.064 1.00 23.82 C ATOM 861 CG ARG A 113 33.303 9.271 5.503 1.00 28.96 C ATOM 862 CD ARG A 113 34.567 8.484 5.039 1.00 33.47 C ATOM 863 NE ARG A 113 35.748 8.762 5.901 1.00 40.72 N ATOM 864 CZ ARG A 113 36.582 9.792 5.728 1.00 41.69 C ATOM 865 NH1 ARG A 113 36.368 10.635 4.740 1.00 43.06 N ATOM 866 NH2 ARG A 113 37.615 9.998 6.546 1.00 43.89 N ATOM 0 H ARG A 113 32.823 10.474 9.308 1.00 22.20 H new ATOM 0 HA ARG A 113 31.920 11.095 6.957 1.00 22.76 H new ATOM 0 HB2 ARG A 113 34.010 9.934 7.368 1.00 23.82 H new ATOM 0 HB3 ARG A 113 33.179 8.621 7.498 1.00 23.82 H new ATOM 0 HG2 ARG A 113 32.512 8.796 5.203 1.00 28.96 H new ATOM 0 HG3 ARG A 113 33.297 10.137 5.066 1.00 28.96 H new ATOM 0 HD2 ARG A 113 34.377 7.533 5.051 1.00 33.47 H new ATOM 0 HD3 ARG A 113 34.775 8.721 4.122 1.00 33.47 H new ATOM 0 HE ARG A 113 35.904 8.224 6.554 1.00 40.72 H new ATOM 0 HH11 ARG A 113 35.697 10.520 4.214 1.00 43.06 H new ATOM 0 HH12 ARG A 113 36.899 11.301 4.620 1.00 43.06 H new ATOM 0 HH21 ARG A 113 37.757 9.462 7.203 1.00 43.89 H new ATOM 0 HH22 ARG A 113 38.139 10.667 6.416 1.00 43.89 H new ATOM 867 N GLY A 114 29.780 9.901 6.590 1.00 20.97 N ATOM 868 CA GLY A 114 28.550 9.150 6.326 1.00 20.30 C ATOM 869 C GLY A 114 27.376 9.564 7.182 1.00 20.19 C ATOM 870 O GLY A 114 26.234 9.145 6.951 1.00 20.12 O ATOM 0 H GLY A 114 29.837 10.643 6.160 1.00 20.97 H new ATOM 0 HA2 GLY A 114 28.311 9.259 5.392 1.00 20.30 H new ATOM 0 HA3 GLY A 114 28.723 8.206 6.467 1.00 20.30 H new ATOM 871 N LYS A 115 27.692 10.391 8.168 1.00 19.55 N ATOM 872 CA LYS A 115 26.702 10.927 9.133 1.00 20.38 C ATOM 873 C LYS A 115 26.194 12.312 8.726 1.00 21.14 C ATOM 874 O LYS A 115 25.115 12.743 9.117 1.00 20.53 O ATOM 875 CB LYS A 115 27.305 10.966 10.527 1.00 19.54 C ATOM 876 CG LYS A 115 27.767 9.600 11.008 1.00 19.49 C ATOM 877 CD LYS A 115 28.238 9.687 12.458 1.00 21.68 C ATOM 878 CE LYS A 115 28.715 8.344 12.950 1.00 22.23 C ATOM 879 NZ LYS A 115 29.499 8.453 14.209 1.00 20.84 N ATOM 0 H LYS A 115 28.494 10.668 8.309 1.00 19.55 H new ATOM 0 HA LYS A 115 25.936 10.332 9.132 1.00 20.38 H new ATOM 0 HB2 LYS A 115 28.058 11.578 10.532 1.00 19.54 H new ATOM 0 HB3 LYS A 115 26.649 11.318 11.149 1.00 19.54 H new ATOM 0 HG2 LYS A 115 27.041 8.961 10.934 1.00 19.49 H new ATOM 0 HG3 LYS A 115 28.488 9.278 10.445 1.00 19.49 H new ATOM 0 HD2 LYS A 115 28.955 10.336 12.531 1.00 21.68 H new ATOM 0 HD3 LYS A 115 27.513 10.002 13.019 1.00 21.68 H new ATOM 0 HE2 LYS A 115 27.951 7.765 13.096 1.00 22.23 H new ATOM 0 HE3 LYS A 115 29.261 7.926 12.266 1.00 22.23 H new ATOM 0 HZ1 LYS A 115 29.601 7.644 14.567 1.00 20.84 H new ATOM 0 HZ2 LYS A 115 30.299 8.801 14.032 1.00 20.84 H new ATOM 0 HZ3 LYS A 115 29.068 8.979 14.783 1.00 20.84 H new ATOM 880 N THR A 116 26.972 12.955 7.863 1.00 22.06 N ATOM 881 CA THR A 116 26.667 14.304 7.374 1.00 22.18 C ATOM 882 C THR A 116 27.443 14.509 6.105 1.00 22.85 C ATOM 883 O THR A 116 28.391 13.792 5.823 1.00 22.10 O ATOM 884 CB THR A 116 27.076 15.408 8.423 1.00 22.27 C ATOM 885 OG1 THR A 116 26.668 16.736 7.999 1.00 23.85 O ATOM 886 CG2 THR A 116 28.548 15.392 8.665 1.00 22.02 C ATOM 0 H THR A 116 27.697 12.623 7.540 1.00 22.06 H new ATOM 0 HA THR A 116 25.712 14.384 7.225 1.00 22.18 H new ATOM 0 HB THR A 116 26.612 15.197 9.248 1.00 22.27 H new ATOM 0 HG1 THR A 116 25.869 16.868 8.221 1.00 23.85 H new ATOM 0 HG21 THR A 116 28.777 16.077 9.312 1.00 22.02 H new ATOM 0 HG22 THR A 116 28.810 14.523 9.008 1.00 22.02 H new ATOM 0 HG23 THR A 116 29.015 15.565 7.832 1.00 22.02 H new ATOM 887 N GLU A 117 27.019 15.501 5.338 1.00 24.60 N ATOM 888 CA GLU A 117 27.710 15.897 4.110 1.00 25.33 C ATOM 889 C GLU A 117 28.673 17.073 4.330 1.00 24.65 C ATOM 890 O GLU A 117 29.575 17.300 3.529 1.00 24.18 O ATOM 891 CB GLU A 117 26.713 16.273 3.029 1.00 26.40 C ATOM 892 CG GLU A 117 26.102 15.070 2.303 1.00 29.84 C ATOM 893 CD GLU A 117 27.153 14.237 1.548 1.00 38.01 C ATOM 894 OE1 GLU A 117 28.164 14.800 1.035 1.00 43.31 O ATOM 895 OE2 GLU A 117 26.964 12.993 1.454 1.00 43.23 O ATOM 0 H GLU A 117 26.319 15.969 5.512 1.00 24.60 H new ATOM 0 HA GLU A 117 28.230 15.127 3.830 1.00 25.33 H new ATOM 0 HB2 GLU A 117 26.000 16.796 3.427 1.00 26.40 H new ATOM 0 HB3 GLU A 117 27.153 16.842 2.379 1.00 26.40 H new ATOM 0 HG2 GLU A 117 25.648 14.504 2.947 1.00 29.84 H new ATOM 0 HG3 GLU A 117 25.430 15.382 1.676 1.00 29.84 H new ATOM 896 N ARG A 118 28.459 17.784 5.440 1.00 24.60 N ATOM 897 CA ARG A 118 29.193 19.020 5.782 1.00 24.17 C ATOM 898 C ARG A 118 29.557 19.210 7.243 1.00 23.18 C ATOM 899 O ARG A 118 28.755 18.997 8.164 1.00 22.66 O ATOM 900 CB ARG A 118 28.380 20.274 5.352 1.00 25.16 C ATOM 901 CG ARG A 118 27.947 20.307 3.867 1.00 26.57 C ATOM 902 CD ARG A 118 26.850 21.370 3.583 1.00 33.15 C ATOM 903 NE ARG A 118 25.548 20.935 4.122 1.00 40.85 N ATOM 904 CZ ARG A 118 24.416 21.659 4.159 1.00 44.04 C ATOM 905 NH1 ARG A 118 24.369 22.906 3.692 1.00 43.82 N ATOM 906 NH2 ARG A 118 23.314 21.128 4.685 1.00 42.99 N ATOM 0 H ARG A 118 27.874 17.562 6.029 1.00 24.60 H new ATOM 0 HA ARG A 118 30.026 18.918 5.296 1.00 24.17 H new ATOM 0 HB2 ARG A 118 27.586 20.331 5.906 1.00 25.16 H new ATOM 0 HB3 ARG A 118 28.912 21.064 5.536 1.00 25.16 H new ATOM 0 HG2 ARG A 118 28.721 20.491 3.313 1.00 26.57 H new ATOM 0 HG3 ARG A 118 27.617 19.431 3.611 1.00 26.57 H new ATOM 0 HD2 ARG A 118 27.103 22.217 3.982 1.00 33.15 H new ATOM 0 HD3 ARG A 118 26.776 21.517 2.627 1.00 33.15 H new ATOM 0 HE ARG A 118 25.509 20.139 4.445 1.00 40.85 H new ATOM 0 HH11 ARG A 118 25.074 23.266 3.357 1.00 43.82 H new ATOM 0 HH12 ARG A 118 23.634 23.350 3.726 1.00 43.82 H new ATOM 0 HH21 ARG A 118 23.330 20.327 4.998 1.00 42.99 H new ATOM 0 HH22 ARG A 118 22.587 21.586 4.712 1.00 42.99 H new ATOM 907 N LEU A 119 30.776 19.695 7.415 1.00 21.43 N ATOM 908 CA LEU A 119 31.309 20.096 8.710 1.00 21.34 C ATOM 909 C LEU A 119 31.621 21.576 8.597 1.00 21.40 C ATOM 910 O LEU A 119 32.078 22.053 7.558 1.00 20.90 O ATOM 911 CB LEU A 119 32.612 19.372 9.063 1.00 21.27 C ATOM 912 CG LEU A 119 32.655 17.851 8.975 1.00 20.47 C ATOM 913 CD1 LEU A 119 34.097 17.334 9.215 1.00 18.52 C ATOM 914 CD2 LEU A 119 31.617 17.190 9.918 1.00 18.22 C ATOM 0 H LEU A 119 31.332 19.804 6.768 1.00 21.43 H new ATOM 0 HA LEU A 119 30.660 19.882 9.399 1.00 21.34 H new ATOM 0 HB2 LEU A 119 33.307 19.719 8.483 1.00 21.27 H new ATOM 0 HB3 LEU A 119 32.849 19.620 9.970 1.00 21.27 H new ATOM 0 HG LEU A 119 32.401 17.590 8.076 1.00 20.47 H new ATOM 0 HD11 LEU A 119 34.108 16.366 9.156 1.00 18.52 H new ATOM 0 HD12 LEU A 119 34.690 17.705 8.543 1.00 18.52 H new ATOM 0 HD13 LEU A 119 34.396 17.607 10.096 1.00 18.52 H new ATOM 0 HD21 LEU A 119 31.673 16.225 9.836 1.00 18.22 H new ATOM 0 HD22 LEU A 119 31.803 17.447 10.835 1.00 18.22 H new ATOM 0 HD23 LEU A 119 30.725 17.484 9.675 1.00 18.22 H new ATOM 915 N ARG A 120 31.348 22.279 9.684 1.00 21.21 N ATOM 916 CA ARG A 120 31.674 23.699 9.808 1.00 21.15 C ATOM 917 C ARG A 120 32.383 23.971 11.116 1.00 21.02 C ATOM 918 O ARG A 120 32.224 23.244 12.100 1.00 19.53 O ATOM 919 CB ARG A 120 30.425 24.584 9.693 1.00 21.09 C ATOM 920 CG ARG A 120 29.695 24.415 8.411 1.00 22.16 C ATOM 921 CD ARG A 120 28.614 25.399 8.221 1.00 26.57 C ATOM 922 NE ARG A 120 27.905 25.112 6.976 1.00 26.98 N ATOM 923 CZ ARG A 120 26.606 24.839 6.874 1.00 24.05 C ATOM 924 NH1 ARG A 120 25.835 24.933 7.905 1.00 22.51 N ATOM 925 NH2 ARG A 120 26.072 24.562 5.698 1.00 26.78 N ATOM 0 H ARG A 120 30.965 21.947 10.379 1.00 21.21 H new ATOM 0 HA ARG A 120 32.266 23.923 9.073 1.00 21.15 H new ATOM 0 HB2 ARG A 120 29.825 24.381 10.428 1.00 21.09 H new ATOM 0 HB3 ARG A 120 30.686 25.513 9.788 1.00 21.09 H new ATOM 0 HG2 ARG A 120 30.324 24.489 7.676 1.00 22.16 H new ATOM 0 HG3 ARG A 120 29.320 23.521 8.375 1.00 22.16 H new ATOM 0 HD2 ARG A 120 27.998 25.366 8.970 1.00 26.57 H new ATOM 0 HD3 ARG A 120 28.981 26.296 8.195 1.00 26.57 H new ATOM 0 HE ARG A 120 28.365 25.120 6.249 1.00 26.98 H new ATOM 0 HH11 ARG A 120 26.160 25.173 8.664 1.00 22.51 H new ATOM 0 HH12 ARG A 120 24.997 24.755 7.833 1.00 22.51 H new ATOM 0 HH21 ARG A 120 26.564 24.557 4.993 1.00 26.78 H new ATOM 0 HH22 ARG A 120 25.232 24.386 5.638 1.00 26.78 H new ATOM 926 N SER A 121 33.139 25.065 11.110 1.00 21.81 N ATOM 927 CA SER A 121 33.873 25.503 12.288 1.00 22.21 C ATOM 928 C SER A 121 34.208 26.986 12.182 1.00 22.42 C ATOM 929 O SER A 121 34.465 27.517 11.086 1.00 21.11 O ATOM 930 CB SER A 121 35.165 24.675 12.465 1.00 23.37 C ATOM 931 OG SER A 121 35.706 24.757 13.783 1.00 27.44 O ATOM 0 H SER A 121 33.240 25.572 10.423 1.00 21.81 H new ATOM 0 HA SER A 121 33.311 25.364 13.066 1.00 22.21 H new ATOM 0 HB2 SER A 121 34.979 23.747 12.255 1.00 23.37 H new ATOM 0 HB3 SER A 121 35.829 24.982 11.829 1.00 23.37 H new ATOM 0 HG SER A 121 36.428 25.186 13.763 1.00 27.44 H new ATOM 932 N ALA A 122 34.269 27.614 13.359 1.00 20.64 N ATOM 933 CA ALA A 122 34.599 28.994 13.449 1.00 21.14 C ATOM 934 C ALA A 122 36.040 29.159 13.941 1.00 21.26 C ATOM 935 O ALA A 122 36.448 28.586 14.966 1.00 21.27 O ATOM 936 CB ALA A 122 33.588 29.747 14.354 1.00 20.66 C ATOM 0 H ALA A 122 34.117 27.234 14.115 1.00 20.64 H new ATOM 0 HA ALA A 122 34.539 29.391 12.566 1.00 21.14 H new ATOM 0 HB1 ALA A 122 33.832 30.685 14.401 1.00 20.66 H new ATOM 0 HB2 ALA A 122 32.696 29.663 13.982 1.00 20.66 H new ATOM 0 HB3 ALA A 122 33.604 29.364 15.245 1.00 20.66 H new ATOM 937 N VAL A 123 36.804 29.937 13.179 1.00 21.82 N ATOM 938 CA VAL A 123 38.223 30.207 13.474 1.00 21.45 C ATOM 939 C VAL A 123 38.559 31.711 13.436 1.00 21.15 C ATOM 940 O VAL A 123 38.194 32.401 12.509 1.00 18.51 O ATOM 941 CB VAL A 123 39.157 29.472 12.480 1.00 22.16 C ATOM 942 CG1 VAL A 123 40.573 29.577 12.928 1.00 22.96 C ATOM 943 CG2 VAL A 123 38.699 28.000 12.300 1.00 20.35 C ATOM 0 H VAL A 123 36.517 30.329 12.469 1.00 21.82 H new ATOM 0 HA VAL A 123 38.370 29.876 14.374 1.00 21.45 H new ATOM 0 HB VAL A 123 39.101 29.897 11.610 1.00 22.16 H new ATOM 0 HG11 VAL A 123 41.147 29.114 12.298 1.00 22.96 H new ATOM 0 HG12 VAL A 123 40.830 30.511 12.972 1.00 22.96 H new ATOM 0 HG13 VAL A 123 40.666 29.175 13.806 1.00 22.96 H new ATOM 0 HG21 VAL A 123 39.291 27.551 11.676 1.00 20.35 H new ATOM 0 HG22 VAL A 123 38.727 27.545 13.156 1.00 20.35 H new ATOM 0 HG23 VAL A 123 37.793 27.983 11.955 1.00 20.35 H new ATOM 944 N TYR A 124 39.208 32.215 14.491 1.00 19.46 N ATOM 945 CA TYR A 124 39.612 33.628 14.510 1.00 20.29 C ATOM 946 C TYR A 124 40.587 33.911 13.379 1.00 20.55 C ATOM 947 O TYR A 124 41.434 33.097 13.067 1.00 20.32 O ATOM 948 CB TYR A 124 40.277 34.010 15.813 1.00 21.20 C ATOM 949 CG TYR A 124 39.374 34.201 17.009 1.00 18.56 C ATOM 950 CD1 TYR A 124 38.446 35.236 17.045 1.00 23.18 C ATOM 951 CD2 TYR A 124 39.521 33.424 18.141 1.00 21.86 C ATOM 952 CE1 TYR A 124 37.665 35.441 18.120 1.00 20.07 C ATOM 953 CE2 TYR A 124 38.759 33.661 19.264 1.00 20.00 C ATOM 954 CZ TYR A 124 37.819 34.643 19.239 1.00 21.56 C ATOM 955 OH TYR A 124 37.073 34.899 20.387 1.00 20.81 O ATOM 0 H TYR A 124 39.421 31.767 15.193 1.00 19.46 H new ATOM 0 HA TYR A 124 38.803 34.152 14.405 1.00 20.29 H new ATOM 0 HB2 TYR A 124 40.928 33.325 16.032 1.00 21.20 H new ATOM 0 HB3 TYR A 124 40.769 34.834 15.671 1.00 21.20 H new ATOM 0 HD1 TYR A 124 38.364 35.799 16.309 1.00 23.18 H new ATOM 0 HD2 TYR A 124 40.142 32.732 18.145 1.00 21.86 H new ATOM 0 HE1 TYR A 124 37.025 36.116 18.111 1.00 20.07 H new ATOM 0 HE2 TYR A 124 38.887 33.153 20.033 1.00 20.00 H new ATOM 0 HH TYR A 124 36.416 35.385 20.192 1.00 20.81 H new ATOM 956 N SER A 125 40.438 35.081 12.772 1.00 21.51 N ATOM 957 CA SER A 125 41.265 35.530 11.627 1.00 20.63 C ATOM 958 C SER A 125 42.763 35.604 11.989 1.00 20.98 C ATOM 959 O SER A 125 43.627 35.516 11.125 1.00 19.87 O ATOM 960 CB SER A 125 40.832 36.923 11.174 1.00 21.39 C ATOM 961 OG SER A 125 40.891 37.859 12.259 1.00 18.04 O ATOM 0 H SER A 125 39.845 35.656 13.010 1.00 21.51 H new ATOM 0 HA SER A 125 41.136 34.877 10.921 1.00 20.63 H new ATOM 0 HB2 SER A 125 41.405 37.224 10.451 1.00 21.39 H new ATOM 0 HB3 SER A 125 39.928 36.886 10.823 1.00 21.39 H new ATOM 0 HG SER A 125 41.644 38.231 12.268 1.00 18.04 H new ATOM 962 N TRP A 126 43.068 35.768 13.272 1.00 20.31 N ATOM 963 CA TRP A 126 44.495 35.847 13.735 1.00 19.45 C ATOM 964 C TRP A 126 45.087 34.489 14.126 1.00 20.08 C ATOM 965 O TRP A 126 46.275 34.360 14.440 1.00 20.22 O ATOM 966 CB TRP A 126 44.618 36.787 14.944 1.00 20.24 C ATOM 967 CG TRP A 126 43.627 36.515 16.072 1.00 19.06 C ATOM 968 CD1 TRP A 126 42.503 37.260 16.352 1.00 22.38 C ATOM 969 CD2 TRP A 126 43.692 35.514 17.083 1.00 21.03 C ATOM 970 NE1 TRP A 126 41.852 36.745 17.420 1.00 20.10 N ATOM 971 CE2 TRP A 126 42.564 35.689 17.915 1.00 22.42 C ATOM 972 CE3 TRP A 126 44.581 34.461 17.362 1.00 25.93 C ATOM 973 CZ2 TRP A 126 42.293 34.852 19.013 1.00 24.46 C ATOM 974 CZ3 TRP A 126 44.324 33.637 18.475 1.00 22.01 C ATOM 975 CH2 TRP A 126 43.191 33.835 19.276 1.00 25.11 C ATOM 0 H TRP A 126 42.485 35.837 13.900 1.00 20.31 H new ATOM 0 HA TRP A 126 44.995 36.185 12.976 1.00 19.45 H new ATOM 0 HB2 TRP A 126 45.518 36.720 15.299 1.00 20.24 H new ATOM 0 HB3 TRP A 126 44.500 37.701 14.640 1.00 20.24 H new ATOM 0 HD1 TRP A 126 42.230 38.010 15.875 1.00 22.38 H new ATOM 0 HE1 TRP A 126 41.108 37.036 17.737 1.00 20.10 H new ATOM 0 HE3 TRP A 126 45.324 34.312 16.823 1.00 25.93 H new ATOM 0 HZ2 TRP A 126 41.538 34.978 19.542 1.00 24.46 H new ATOM 0 HZ3 TRP A 126 44.916 32.950 18.682 1.00 22.01 H new ATOM 0 HH2 TRP A 126 43.040 33.270 19.999 1.00 25.11 H new ATOM 976 N ASN A 127 44.242 33.458 14.140 1.00 20.81 N ATOM 977 CA ASN A 127 44.673 32.143 14.631 1.00 20.78 C ATOM 978 C ASN A 127 45.258 31.328 13.498 1.00 21.06 C ATOM 979 O ASN A 127 44.680 30.376 13.008 1.00 19.43 O ATOM 980 CB ASN A 127 43.559 31.404 15.360 1.00 20.37 C ATOM 981 CG ASN A 127 44.074 30.206 16.099 1.00 20.29 C ATOM 982 OD1 ASN A 127 45.257 29.897 16.008 1.00 20.16 O ATOM 983 ND2 ASN A 127 43.207 29.543 16.889 1.00 18.62 N ATOM 0 H ASN A 127 43.425 33.495 13.874 1.00 20.81 H new ATOM 0 HA ASN A 127 45.370 32.283 15.291 1.00 20.78 H new ATOM 0 HB2 ASN A 127 43.126 32.007 15.984 1.00 20.37 H new ATOM 0 HB3 ASN A 127 42.885 31.124 14.721 1.00 20.37 H new ATOM 0 HD21 ASN A 127 43.477 28.873 17.356 1.00 18.62 H new ATOM 0 HD22 ASN A 127 42.384 29.790 16.926 1.00 18.62 H new ATOM 984 N GLU A 128 46.450 31.753 13.114 1.00 21.92 N ATOM 985 CA GLU A 128 47.102 31.248 11.944 1.00 22.61 C ATOM 986 C GLU A 128 47.334 29.736 11.979 1.00 23.81 C ATOM 987 O GLU A 128 47.124 29.083 10.975 1.00 23.64 O ATOM 988 CB GLU A 128 48.409 31.981 11.677 1.00 22.86 C ATOM 989 CG GLU A 128 48.942 31.752 10.295 1.00 24.99 C ATOM 990 CD GLU A 128 48.103 32.412 9.172 1.00 28.44 C ATOM 991 OE1 GLU A 128 47.277 33.291 9.428 1.00 27.24 O ATOM 992 OE2 GLU A 128 48.304 32.029 8.004 1.00 29.01 O ATOM 0 H GLU A 128 46.901 32.351 13.537 1.00 21.92 H new ATOM 0 HA GLU A 128 46.490 31.418 11.211 1.00 22.61 H new ATOM 0 HB2 GLU A 128 48.273 32.932 11.812 1.00 22.86 H new ATOM 0 HB3 GLU A 128 49.072 31.695 12.325 1.00 22.86 H new ATOM 0 HG2 GLU A 128 49.849 32.092 10.249 1.00 24.99 H new ATOM 0 HG3 GLU A 128 48.988 30.797 10.131 1.00 24.99 H new ATOM 993 N PRO A 129 47.826 29.181 13.117 1.00 24.46 N ATOM 994 CA PRO A 129 48.024 27.725 13.181 1.00 23.98 C ATOM 995 C PRO A 129 46.706 26.955 12.985 1.00 24.88 C ATOM 996 O PRO A 129 46.658 25.945 12.307 1.00 23.59 O ATOM 997 CB PRO A 129 48.568 27.536 14.598 1.00 24.96 C ATOM 998 CG PRO A 129 49.326 28.798 14.846 1.00 25.21 C ATOM 999 CD PRO A 129 48.438 29.859 14.281 1.00 24.20 C ATOM 0 HA PRO A 129 48.609 27.388 12.485 1.00 23.98 H new ATOM 0 HB2 PRO A 129 47.853 27.415 15.243 1.00 24.96 H new ATOM 0 HB3 PRO A 129 49.141 26.756 14.660 1.00 24.96 H new ATOM 0 HG2 PRO A 129 49.489 28.936 15.792 1.00 25.21 H new ATOM 0 HG3 PRO A 129 50.191 28.786 14.408 1.00 25.21 H new ATOM 0 HD2 PRO A 129 47.770 30.149 14.922 1.00 24.20 H new ATOM 0 HD3 PRO A 129 48.939 30.646 14.017 1.00 24.20 H new ATOM 1000 N SER A 130 45.639 27.439 13.580 1.00 24.85 N ATOM 1001 CA ASER A 130 44.345 26.781 13.409 0.50 25.31 C ATOM 1002 CA BSER A 130 44.331 26.807 13.421 0.50 25.19 C ATOM 1003 C SER A 130 43.812 26.951 11.992 1.00 25.16 C ATOM 1004 O SER A 130 43.245 26.035 11.443 1.00 26.15 O ATOM 1005 CB ASER A 130 43.333 27.283 14.422 0.50 25.02 C ATOM 1006 CB BSER A 130 43.330 27.424 14.389 0.50 24.84 C ATOM 1007 OG ASER A 130 43.799 27.003 15.734 0.50 26.07 O ATOM 1008 OG BSER A 130 42.042 26.876 14.246 0.50 25.25 O ATOM 0 H ASER A 130 45.631 28.137 14.082 0.50 24.85 H new ATOM 0 H BSER A 130 45.641 28.136 14.084 0.50 24.85 H new ATOM 0 HA ASER A 130 44.485 25.834 13.563 0.50 25.19 H new ATOM 0 HA BSER A 130 44.434 25.862 13.615 0.50 25.19 H new ATOM 0 HB2ASER A 130 43.198 28.237 14.313 0.50 24.84 H new ATOM 0 HB2BSER A 130 43.638 27.289 15.299 0.50 24.84 H new ATOM 0 HB3ASER A 130 42.474 26.856 14.275 0.50 24.84 H new ATOM 0 HB3BSER A 130 43.290 28.382 14.243 0.50 24.84 H new ATOM 0 HG ASER A 130 43.143 26.900 16.249 0.50 25.25 H new ATOM 0 HG BSER A 130 42.038 26.090 14.541 0.50 25.25 H new ATOM 1009 N LEU A 131 44.030 28.122 11.399 1.00 25.24 N ATOM 1010 CA LEU A 131 43.580 28.394 10.006 1.00 24.73 C ATOM 1011 C LEU A 131 44.347 27.468 9.048 1.00 24.27 C ATOM 1012 O LEU A 131 43.810 26.925 8.095 1.00 24.21 O ATOM 1013 CB LEU A 131 43.811 29.861 9.634 1.00 24.73 C ATOM 1014 CG LEU A 131 42.934 30.961 10.298 1.00 24.08 C ATOM 1015 CD1 LEU A 131 43.480 32.353 10.021 1.00 23.27 C ATOM 1016 CD2 LEU A 131 41.502 30.867 9.831 1.00 19.60 C ATOM 0 H LEU A 131 44.436 28.781 11.775 1.00 25.24 H new ATOM 0 HA LEU A 131 42.628 28.221 9.937 1.00 24.73 H new ATOM 0 HB2 LEU A 131 44.738 30.069 9.830 1.00 24.73 H new ATOM 0 HB3 LEU A 131 43.700 29.939 8.674 1.00 24.73 H new ATOM 0 HG LEU A 131 42.961 30.809 11.256 1.00 24.08 H new ATOM 0 HD11 LEU A 131 42.913 33.014 10.447 1.00 23.27 H new ATOM 0 HD12 LEU A 131 44.380 32.424 10.375 1.00 23.27 H new ATOM 0 HD13 LEU A 131 43.496 32.510 9.064 1.00 23.27 H new ATOM 0 HD21 LEU A 131 40.976 31.561 10.258 1.00 19.60 H new ATOM 0 HD22 LEU A 131 41.467 30.981 8.868 1.00 19.60 H new ATOM 0 HD23 LEU A 131 41.141 29.998 10.066 1.00 19.60 H new ATOM 1017 N ARG A 132 45.628 27.314 9.311 1.00 23.47 N ATOM 1018 CA ARG A 132 46.471 26.392 8.526 1.00 23.59 C ATOM 1019 C ARG A 132 46.015 24.938 8.680 1.00 23.33 C ATOM 1020 O ARG A 132 46.002 24.158 7.733 1.00 22.43 O ATOM 1021 CB ARG A 132 47.949 26.516 8.930 1.00 24.04 C ATOM 1022 CG ARG A 132 48.562 27.887 8.585 1.00 26.04 C ATOM 1023 CD ARG A 132 48.475 28.205 7.088 1.00 32.49 C ATOM 1024 NE ARG A 132 49.301 27.295 6.293 1.00 40.28 N ATOM 1025 CZ ARG A 132 50.632 27.364 6.139 1.00 43.57 C ATOM 1026 NH1 ARG A 132 51.354 28.310 6.743 1.00 43.94 N ATOM 1027 NH2 ARG A 132 51.244 26.457 5.367 1.00 44.14 N ATOM 0 H ARG A 132 46.043 27.729 9.939 1.00 23.47 H new ATOM 0 HA ARG A 132 46.375 26.646 7.595 1.00 23.59 H new ATOM 0 HB2 ARG A 132 48.031 26.363 9.884 1.00 24.04 H new ATOM 0 HB3 ARG A 132 48.459 25.820 8.486 1.00 24.04 H new ATOM 0 HG2 ARG A 132 48.104 28.579 9.087 1.00 26.04 H new ATOM 0 HG3 ARG A 132 49.491 27.902 8.863 1.00 26.04 H new ATOM 0 HD2 ARG A 132 47.552 28.143 6.797 1.00 32.49 H new ATOM 0 HD3 ARG A 132 48.760 29.119 6.934 1.00 32.49 H new ATOM 0 HE ARG A 132 48.895 26.656 5.886 1.00 40.28 H new ATOM 0 HH11 ARG A 132 50.967 28.892 7.244 1.00 43.94 H new ATOM 0 HH12 ARG A 132 52.206 28.337 6.632 1.00 43.94 H new ATOM 0 HH21 ARG A 132 50.784 25.842 4.979 1.00 44.14 H new ATOM 0 HH22 ARG A 132 52.097 26.489 5.259 1.00 44.14 H new ATOM 1028 N LEU A 133 45.602 24.596 9.880 1.00 23.87 N ATOM 1029 CA LEU A 133 45.159 23.210 10.190 1.00 23.84 C ATOM 1030 C LEU A 133 43.875 22.896 9.413 1.00 23.27 C ATOM 1031 O LEU A 133 43.799 21.898 8.683 1.00 23.59 O ATOM 1032 CB LEU A 133 44.934 23.044 11.706 1.00 24.78 C ATOM 1033 CG LEU A 133 44.259 21.721 12.090 1.00 25.07 C ATOM 1034 CD1 LEU A 133 45.192 20.613 11.653 1.00 28.95 C ATOM 1035 CD2 LEU A 133 43.947 21.608 13.533 1.00 28.44 C ATOM 0 H LEU A 133 45.562 25.138 10.546 1.00 23.87 H new ATOM 0 HA LEU A 133 45.850 22.586 9.919 1.00 23.84 H new ATOM 0 HB2 LEU A 133 45.789 23.105 12.160 1.00 24.78 H new ATOM 0 HB3 LEU A 133 44.390 23.780 12.026 1.00 24.78 H new ATOM 0 HG LEU A 133 43.398 21.666 11.647 1.00 25.07 H new ATOM 0 HD11 LEU A 133 44.802 19.754 11.878 1.00 28.95 H new ATOM 0 HD12 LEU A 133 45.329 20.664 10.694 1.00 28.95 H new ATOM 0 HD13 LEU A 133 46.044 20.709 12.106 1.00 28.95 H new ATOM 0 HD21 LEU A 133 43.524 20.753 13.707 1.00 28.44 H new ATOM 0 HD22 LEU A 133 44.767 21.673 14.048 1.00 28.44 H new ATOM 0 HD23 LEU A 133 43.346 22.324 13.791 1.00 28.44 H new ATOM 1036 N VAL A 134 42.888 23.785 9.507 1.00 22.75 N ATOM 1037 CA VAL A 134 41.613 23.562 8.808 1.00 22.49 C ATOM 1038 C VAL A 134 41.815 23.533 7.293 1.00 22.53 C ATOM 1039 O VAL A 134 41.232 22.718 6.586 1.00 22.71 O ATOM 1040 CB VAL A 134 40.412 24.462 9.284 1.00 21.73 C ATOM 1041 CG1 VAL A 134 40.020 24.097 10.727 1.00 21.89 C ATOM 1042 CG2 VAL A 134 40.683 25.982 9.132 1.00 24.44 C ATOM 0 H VAL A 134 42.930 24.514 9.962 1.00 22.75 H new ATOM 0 HA VAL A 134 41.317 22.678 9.076 1.00 22.49 H new ATOM 0 HB VAL A 134 39.664 24.275 8.696 1.00 21.73 H new ATOM 0 HG11 VAL A 134 39.280 24.655 11.013 1.00 21.89 H new ATOM 0 HG12 VAL A 134 39.754 23.165 10.764 1.00 21.89 H new ATOM 0 HG13 VAL A 134 40.778 24.240 11.315 1.00 21.89 H new ATOM 0 HG21 VAL A 134 39.910 26.481 9.440 1.00 24.44 H new ATOM 0 HG22 VAL A 134 41.458 26.227 9.661 1.00 24.44 H new ATOM 0 HG23 VAL A 134 40.850 26.189 8.199 1.00 24.44 H new ATOM 1043 N HIS A 135 42.677 24.399 6.805 1.00 23.17 N ATOM 1044 CA HIS A 135 42.951 24.497 5.384 1.00 23.26 C ATOM 1045 C HIS A 135 43.569 23.203 4.923 1.00 23.27 C ATOM 1046 O HIS A 135 43.136 22.578 3.970 1.00 22.65 O ATOM 1047 CB HIS A 135 43.925 25.648 5.088 1.00 24.20 C ATOM 1048 CG HIS A 135 44.221 25.794 3.638 1.00 27.41 C ATOM 1049 ND1 HIS A 135 45.309 25.199 3.026 1.00 32.25 N ATOM 1050 CD2 HIS A 135 43.514 26.393 2.653 1.00 30.91 C ATOM 1051 CE1 HIS A 135 45.279 25.471 1.734 1.00 32.24 C ATOM 1052 NE2 HIS A 135 44.199 26.194 1.486 1.00 31.02 N ATOM 0 H HIS A 135 43.124 24.952 7.289 1.00 23.17 H new ATOM 0 HA HIS A 135 42.119 24.670 4.916 1.00 23.26 H new ATOM 0 HB2 HIS A 135 43.550 26.478 5.422 1.00 24.20 H new ATOM 0 HB3 HIS A 135 44.753 25.497 5.569 1.00 24.20 H new ATOM 0 HD2 HIS A 135 42.712 26.854 2.751 1.00 30.91 H new ATOM 0 HE1 HIS A 135 45.909 25.201 1.106 1.00 32.24 H new ATOM 0 HE2 HIS A 135 43.965 26.492 0.714 1.00 31.02 H new ATOM 1053 N ARG A 136 44.616 22.813 5.627 1.00 23.75 N ATOM 1054 CA ARG A 136 45.347 21.572 5.320 1.00 24.52 C ATOM 1055 C ARG A 136 44.436 20.348 5.304 1.00 25.01 C ATOM 1056 O ARG A 136 44.624 19.398 4.522 1.00 24.58 O ATOM 1057 CB ARG A 136 46.403 21.317 6.362 1.00 25.47 C ATOM 1058 CG ARG A 136 47.354 20.245 5.944 1.00 30.46 C ATOM 1059 CD ARG A 136 48.180 19.787 7.119 1.00 33.95 C ATOM 1060 NE ARG A 136 48.853 20.911 7.775 1.00 37.24 N ATOM 0 H ARG A 136 44.931 23.251 6.297 1.00 23.75 H new ATOM 0 HA ARG A 136 45.734 21.699 4.440 1.00 24.52 H new ATOM 0 HB2 ARG A 136 46.894 22.136 6.531 1.00 25.47 H new ATOM 0 HB3 ARG A 136 45.978 21.064 7.197 1.00 25.47 H new ATOM 0 HG2 ARG A 136 46.863 19.495 5.575 1.00 30.46 H new ATOM 0 HG3 ARG A 136 47.936 20.576 5.242 1.00 30.46 H new ATOM 0 HD2 ARG A 136 47.610 19.332 7.759 1.00 33.95 H new ATOM 0 HD3 ARG A 136 48.841 19.143 6.820 1.00 33.95 H new ATOM 1061 N LEU A 137 43.427 20.395 6.163 1.00 24.13 N ATOM 1062 CA LEU A 137 42.481 19.265 6.296 1.00 24.65 C ATOM 1063 C LEU A 137 41.393 19.298 5.230 1.00 24.39 C ATOM 1064 O LEU A 137 40.626 18.338 5.064 1.00 26.87 O ATOM 1065 CB LEU A 137 41.901 19.209 7.693 1.00 23.46 C ATOM 1066 CG LEU A 137 42.850 18.780 8.828 1.00 25.72 C ATOM 1067 CD1 LEU A 137 42.079 18.843 10.110 1.00 23.53 C ATOM 1068 CD2 LEU A 137 43.434 17.381 8.652 1.00 26.30 C ATOM 0 H LEU A 137 43.263 21.062 6.680 1.00 24.13 H new ATOM 0 HA LEU A 137 42.982 18.447 6.150 1.00 24.65 H new ATOM 0 HB2 LEU A 137 41.550 20.087 7.909 1.00 23.46 H new ATOM 0 HB3 LEU A 137 41.148 18.598 7.682 1.00 23.46 H new ATOM 0 HG LEU A 137 43.609 19.384 8.824 1.00 25.72 H new ATOM 0 HD11 LEU A 137 42.652 18.577 10.846 1.00 23.53 H new ATOM 0 HD12 LEU A 137 41.766 19.750 10.255 1.00 23.53 H new ATOM 0 HD13 LEU A 137 41.318 18.243 10.060 1.00 23.53 H new ATOM 0 HD21 LEU A 137 44.019 17.178 9.399 1.00 26.30 H new ATOM 0 HD22 LEU A 137 42.714 16.731 8.620 1.00 26.30 H new ATOM 0 HD23 LEU A 137 43.941 17.343 7.826 1.00 26.30 H new ATOM 1069 N GLY A 138 41.375 20.367 4.446 1.00 23.77 N ATOM 1070 CA GLY A 138 40.447 20.455 3.313 1.00 23.62 C ATOM 1071 C GLY A 138 39.163 21.258 3.498 1.00 22.34 C ATOM 1072 O GLY A 138 38.212 21.171 2.729 1.00 23.17 O ATOM 0 H GLY A 138 41.886 21.051 4.547 1.00 23.77 H new ATOM 0 HA2 GLY A 138 40.930 20.836 2.563 1.00 23.62 H new ATOM 0 HA3 GLY A 138 40.199 19.552 3.062 1.00 23.62 H new ATOM 1073 N PHE A 139 39.156 22.049 4.543 1.00 22.36 N ATOM 1074 CA PHE A 139 38.117 23.043 4.754 1.00 21.04 C ATOM 1075 C PHE A 139 38.431 24.265 3.875 1.00 20.94 C ATOM 1076 O PHE A 139 39.572 24.512 3.511 1.00 18.18 O ATOM 1077 CB PHE A 139 38.118 23.521 6.191 1.00 21.61 C ATOM 1078 CG PHE A 139 37.590 22.535 7.196 1.00 20.35 C ATOM 1079 CD1 PHE A 139 38.332 21.453 7.590 1.00 23.85 C ATOM 1080 CD2 PHE A 139 36.375 22.758 7.817 1.00 23.76 C ATOM 1081 CE1 PHE A 139 37.867 20.587 8.555 1.00 23.63 C ATOM 1082 CE2 PHE A 139 35.899 21.894 8.791 1.00 21.87 C ATOM 1083 CZ PHE A 139 36.666 20.785 9.144 1.00 22.83 C ATOM 0 H PHE A 139 39.755 22.030 5.159 1.00 22.36 H new ATOM 0 HA PHE A 139 37.259 22.645 4.538 1.00 21.04 H new ATOM 0 HB2 PHE A 139 39.026 23.757 6.437 1.00 21.61 H new ATOM 0 HB3 PHE A 139 37.589 24.332 6.247 1.00 21.61 H new ATOM 0 HD1 PHE A 139 39.162 21.301 7.200 1.00 23.85 H new ATOM 0 HD2 PHE A 139 35.868 23.500 7.577 1.00 23.76 H new ATOM 0 HE1 PHE A 139 38.386 19.857 8.805 1.00 23.63 H new ATOM 0 HE2 PHE A 139 35.080 22.052 9.203 1.00 21.87 H new ATOM 0 HZ PHE A 139 36.353 20.184 9.781 1.00 22.83 H new ATOM 1084 N HIS A 140 37.387 25.006 3.544 1.00 21.37 N ATOM 1085 CA HIS A 140 37.506 26.291 2.852 1.00 22.72 C ATOM 1086 C HIS A 140 36.644 27.339 3.531 1.00 23.02 C ATOM 1087 O HIS A 140 35.597 27.040 4.039 1.00 22.02 O ATOM 1088 CB HIS A 140 37.182 26.179 1.356 1.00 23.98 C ATOM 1089 CG HIS A 140 35.970 25.356 1.059 1.00 28.15 C ATOM 1090 ND1 HIS A 140 36.054 24.020 0.701 1.00 31.96 N ATOM 1091 CD2 HIS A 140 34.650 25.673 1.060 1.00 28.74 C ATOM 1092 CE1 HIS A 140 34.828 23.546 0.527 1.00 34.19 C ATOM 1093 NE2 HIS A 140 33.963 24.532 0.728 1.00 30.68 N ATOM 0 H HIS A 140 36.575 24.779 3.715 1.00 21.37 H new ATOM 0 HA HIS A 140 38.433 26.571 2.911 1.00 22.72 H new ATOM 0 HB2 HIS A 140 37.054 27.070 0.994 1.00 23.98 H new ATOM 0 HB3 HIS A 140 37.944 25.793 0.897 1.00 23.98 H new ATOM 0 HD2 HIS A 140 34.281 26.505 1.250 1.00 28.74 H new ATOM 0 HE1 HIS A 140 34.611 22.670 0.302 1.00 34.19 H new ATOM 0 HE2 HIS A 140 33.108 24.467 0.661 1.00 30.68 H new ATOM 1094 N GLN A 141 37.160 28.553 3.632 1.00 23.52 N ATOM 1095 CA GLN A 141 36.412 29.651 4.241 1.00 24.14 C ATOM 1096 C GLN A 141 35.149 30.006 3.465 1.00 24.63 C ATOM 1097 O GLN A 141 35.207 30.234 2.263 1.00 24.46 O ATOM 1098 CB GLN A 141 37.257 30.904 4.345 1.00 24.67 C ATOM 1099 CG GLN A 141 36.653 31.912 5.296 1.00 25.52 C ATOM 1100 CD GLN A 141 37.577 33.071 5.585 1.00 25.99 C ATOM 1101 OE1 GLN A 141 38.734 32.889 5.944 1.00 29.86 O ATOM 1102 NE2 GLN A 141 37.060 34.265 5.450 1.00 26.09 N ATOM 0 H GLN A 141 37.945 28.767 3.354 1.00 23.52 H new ATOM 0 HA GLN A 141 36.164 29.333 5.123 1.00 24.14 H new ATOM 0 HB2 GLN A 141 38.148 30.669 4.647 1.00 24.67 H new ATOM 0 HB3 GLN A 141 37.351 31.304 3.466 1.00 24.67 H new ATOM 0 HG2 GLN A 141 35.825 32.250 4.920 1.00 25.52 H new ATOM 0 HG3 GLN A 141 36.426 31.469 6.129 1.00 25.52 H new ATOM 0 HE21 GLN A 141 36.243 34.354 5.196 1.00 26.09 H new ATOM 0 HE22 GLN A 141 37.537 34.961 5.616 1.00 26.09 H new ATOM 1103 N VAL A 142 34.014 30.087 4.161 1.00 23.96 N ATOM 1104 CA VAL A 142 32.749 30.387 3.480 1.00 23.24 C ATOM 1105 C VAL A 142 32.124 31.696 3.949 1.00 23.51 C ATOM 1106 O VAL A 142 31.258 32.278 3.280 1.00 22.62 O ATOM 1107 CB VAL A 142 31.702 29.207 3.648 1.00 23.81 C ATOM 1108 CG1 VAL A 142 32.214 27.908 3.019 1.00 23.62 C ATOM 1109 CG2 VAL A 142 31.343 28.967 5.133 1.00 22.41 C ATOM 0 H VAL A 142 33.952 29.974 5.011 1.00 23.96 H new ATOM 0 HA VAL A 142 32.972 30.483 2.541 1.00 23.24 H new ATOM 0 HB VAL A 142 30.898 29.481 3.180 1.00 23.81 H new ATOM 0 HG11 VAL A 142 31.553 27.208 3.138 1.00 23.62 H new ATOM 0 HG12 VAL A 142 32.370 28.047 2.072 1.00 23.62 H new ATOM 0 HG13 VAL A 142 33.043 27.645 3.448 1.00 23.62 H new ATOM 0 HG21 VAL A 142 30.703 28.241 5.198 1.00 22.41 H new ATOM 0 HG22 VAL A 142 32.145 28.735 5.627 1.00 22.41 H new ATOM 0 HG23 VAL A 142 30.956 29.774 5.507 1.00 22.41 H new ATOM 1110 N GLU A 143 32.525 32.151 5.122 1.00 22.23 N ATOM 1111 CA GLU A 143 32.008 33.420 5.624 1.00 22.26 C ATOM 1112 C GLU A 143 32.941 34.073 6.642 1.00 22.39 C ATOM 1113 O GLU A 143 33.852 33.438 7.187 1.00 21.28 O ATOM 1114 CB GLU A 143 30.562 33.229 6.158 1.00 20.82 C ATOM 1115 CG GLU A 143 29.727 34.522 6.521 1.00 22.86 C ATOM 1116 CD GLU A 143 29.648 35.593 5.442 1.00 24.11 C ATOM 1117 OE1 GLU A 143 30.588 36.416 5.265 1.00 26.36 O ATOM 1118 OE2 GLU A 143 28.632 35.601 4.718 1.00 26.62 O ATOM 0 H GLU A 143 33.085 31.753 5.639 1.00 22.23 H new ATOM 0 HA GLU A 143 31.970 34.047 4.885 1.00 22.26 H new ATOM 0 HB2 GLU A 143 30.063 32.730 5.492 1.00 20.82 H new ATOM 0 HB3 GLU A 143 30.609 32.674 6.952 1.00 20.82 H new ATOM 0 HG2 GLU A 143 28.824 34.249 6.747 1.00 22.86 H new ATOM 0 HG3 GLU A 143 30.111 34.919 7.318 1.00 22.86 H new ATOM 1119 N GLU A 144 32.681 35.343 6.930 1.00 22.55 N ATOM 1120 CA GLU A 144 33.514 36.049 7.896 1.00 23.26 C ATOM 1121 C GLU A 144 32.727 37.137 8.612 1.00 22.87 C ATOM 1122 O GLU A 144 31.924 37.842 7.988 1.00 22.76 O ATOM 1123 CB GLU A 144 34.735 36.606 7.125 1.00 24.42 C ATOM 1124 CG GLU A 144 35.355 37.820 7.646 1.00 27.48 C ATOM 1125 CD GLU A 144 36.713 38.077 7.020 1.00 29.75 C ATOM 1126 OE1 GLU A 144 36.822 38.276 5.785 1.00 35.65 O ATOM 1127 OE2 GLU A 144 37.677 38.070 7.771 1.00 32.63 O ATOM 0 H GLU A 144 32.043 35.806 6.587 1.00 22.55 H new ATOM 0 HA GLU A 144 33.818 35.450 8.596 1.00 23.26 H new ATOM 0 HB2 GLU A 144 35.412 35.912 7.093 1.00 24.42 H new ATOM 0 HB3 GLU A 144 34.461 36.777 6.210 1.00 24.42 H new ATOM 0 HG2 GLU A 144 34.773 38.578 7.477 1.00 27.48 H new ATOM 0 HG3 GLU A 144 35.452 37.746 8.608 1.00 27.48 H new ATOM 1128 N TYR A 145 32.954 37.241 9.928 1.00 22.51 N ATOM 1129 CA TYR A 145 32.281 38.213 10.817 1.00 22.08 C ATOM 1130 C TYR A 145 33.273 39.097 11.565 1.00 22.14 C ATOM 1131 O TYR A 145 33.726 38.742 12.662 1.00 22.20 O ATOM 1132 CB TYR A 145 31.382 37.528 11.875 1.00 21.81 C ATOM 1133 CG TYR A 145 30.121 36.939 11.317 1.00 22.92 C ATOM 1134 CD1 TYR A 145 30.168 35.848 10.455 1.00 22.91 C ATOM 1135 CD2 TYR A 145 28.878 37.462 11.639 1.00 21.77 C ATOM 1136 CE1 TYR A 145 29.005 35.310 9.902 1.00 24.17 C ATOM 1137 CE2 TYR A 145 27.698 36.923 11.101 1.00 22.95 C ATOM 1138 CZ TYR A 145 27.777 35.851 10.239 1.00 24.05 C ATOM 1139 OH TYR A 145 26.637 35.317 9.728 1.00 24.09 O ATOM 0 H TYR A 145 33.516 36.738 10.342 1.00 22.51 H new ATOM 0 HA TYR A 145 31.736 38.752 10.223 1.00 22.08 H new ATOM 0 HB2 TYR A 145 31.890 36.826 12.312 1.00 21.81 H new ATOM 0 HB3 TYR A 145 31.150 38.177 12.558 1.00 21.81 H new ATOM 0 HD1 TYR A 145 30.991 35.470 10.243 1.00 22.91 H new ATOM 0 HD2 TYR A 145 28.825 38.184 12.223 1.00 21.77 H new ATOM 0 HE1 TYR A 145 29.055 34.593 9.311 1.00 24.17 H new ATOM 0 HE2 TYR A 145 26.871 37.286 11.324 1.00 22.95 H new ATOM 0 HH TYR A 145 25.997 35.470 10.250 1.00 24.09 H new ATOM 1140 N PRO A 146 33.615 40.263 10.988 1.00 22.50 N ATOM 1141 CA PRO A 146 34.459 41.212 11.689 1.00 22.21 C ATOM 1142 C PRO A 146 33.909 41.506 13.078 1.00 22.24 C ATOM 1143 O PRO A 146 32.706 41.526 13.276 1.00 20.97 O ATOM 1144 CB PRO A 146 34.392 42.458 10.807 1.00 22.79 C ATOM 1145 CG PRO A 146 34.096 42.010 9.527 1.00 23.54 C ATOM 1146 CD PRO A 146 33.286 40.738 9.637 1.00 22.54 C ATOM 0 HA PRO A 146 35.363 40.887 11.825 1.00 22.21 H new ATOM 0 HB2 PRO A 146 33.712 43.072 11.125 1.00 22.79 H new ATOM 0 HB3 PRO A 146 35.235 42.938 10.820 1.00 22.79 H new ATOM 0 HG2 PRO A 146 33.598 42.685 9.041 1.00 23.54 H new ATOM 0 HG3 PRO A 146 34.913 41.847 9.030 1.00 23.54 H new ATOM 0 HD2 PRO A 146 32.336 40.906 9.535 1.00 22.54 H new ATOM 0 HD3 PRO A 146 33.535 40.092 8.957 1.00 22.54 H new ATOM 1147 N ILE A 147 34.818 41.701 14.029 1.00 22.40 N ATOM 1148 CA ILE A 147 34.484 41.852 15.461 1.00 22.52 C ATOM 1149 C ILE A 147 34.679 43.274 15.980 1.00 23.53 C ATOM 1150 O ILE A 147 35.727 43.840 15.816 1.00 24.95 O ATOM 1151 CB ILE A 147 35.388 40.958 16.293 1.00 22.50 C ATOM 1152 CG1 ILE A 147 35.201 39.462 15.942 1.00 22.90 C ATOM 1153 CG2 ILE A 147 35.110 41.183 17.790 1.00 20.62 C ATOM 1154 CD1 ILE A 147 36.266 38.508 16.577 1.00 22.21 C ATOM 0 H ILE A 147 35.661 41.751 13.867 1.00 22.40 H new ATOM 0 HA ILE A 147 33.547 41.614 15.541 1.00 22.52 H new ATOM 0 HB ILE A 147 36.306 41.196 16.090 1.00 22.50 H new ATOM 0 HG12 ILE A 147 34.319 39.181 16.232 1.00 22.90 H new ATOM 0 HG13 ILE A 147 35.228 39.362 14.978 1.00 22.90 H new ATOM 0 HG21 ILE A 147 35.689 40.610 18.317 1.00 20.62 H new ATOM 0 HG22 ILE A 147 35.282 42.111 18.015 1.00 20.62 H new ATOM 0 HG23 ILE A 147 34.184 40.970 17.983 1.00 20.62 H new ATOM 0 HD11 ILE A 147 36.081 37.594 16.311 1.00 22.21 H new ATOM 0 HD12 ILE A 147 37.151 38.761 16.270 1.00 22.21 H new ATOM 0 HD13 ILE A 147 36.227 38.577 17.544 1.00 22.21 H new ATOM 1155 N TYR A 148 33.656 43.824 16.612 1.00 24.18 N ATOM 1156 CA TYR A 148 33.647 45.197 17.155 1.00 24.08 C ATOM 1157 C TYR A 148 33.314 45.137 18.600 1.00 23.45 C ATOM 1158 O TYR A 148 32.231 44.703 18.964 1.00 23.30 O ATOM 1159 CB TYR A 148 32.585 46.061 16.451 1.00 25.25 C ATOM 1160 CG TYR A 148 32.726 46.027 14.964 1.00 25.79 C ATOM 1161 CD1 TYR A 148 32.232 44.957 14.228 1.00 27.89 C ATOM 1162 CD2 TYR A 148 33.437 47.030 14.288 1.00 28.98 C ATOM 1163 CE1 TYR A 148 32.403 44.892 12.838 1.00 26.53 C ATOM 1164 CE2 TYR A 148 33.617 46.966 12.941 1.00 28.91 C ATOM 1165 CZ TYR A 148 33.072 45.899 12.208 1.00 29.91 C ATOM 1166 OH TYR A 148 33.271 45.840 10.840 1.00 30.69 O ATOM 0 H TYR A 148 32.918 43.404 16.747 1.00 24.18 H new ATOM 0 HA TYR A 148 34.522 45.591 17.012 1.00 24.08 H new ATOM 0 HB2 TYR A 148 31.701 45.748 16.698 1.00 25.25 H new ATOM 0 HB3 TYR A 148 32.659 46.977 16.761 1.00 25.25 H new ATOM 0 HD1 TYR A 148 31.780 44.272 14.665 1.00 27.89 H new ATOM 0 HD2 TYR A 148 33.789 47.746 14.766 1.00 28.98 H new ATOM 0 HE1 TYR A 148 32.065 44.173 12.354 1.00 26.53 H new ATOM 0 HE2 TYR A 148 34.101 47.629 12.505 1.00 28.91 H new ATOM 0 HH TYR A 148 33.542 46.585 10.564 1.00 30.69 H new ATOM 1167 N THR A 149 34.259 45.554 19.435 1.00 23.58 N ATOM 1168 CA THR A 149 34.093 45.496 20.872 1.00 24.17 C ATOM 1169 C THR A 149 33.939 46.882 21.440 1.00 24.93 C ATOM 1170 O THR A 149 34.679 47.800 21.114 1.00 23.29 O ATOM 1171 CB THR A 149 35.255 44.756 21.620 1.00 24.68 C ATOM 1172 OG1 THR A 149 35.451 43.430 21.111 1.00 24.58 O ATOM 1173 CG2 THR A 149 34.937 44.621 23.108 1.00 22.21 C ATOM 0 H THR A 149 35.014 45.878 19.180 1.00 23.58 H new ATOM 0 HA THR A 149 33.288 44.975 21.020 1.00 24.17 H new ATOM 0 HB THR A 149 36.054 45.288 21.480 1.00 24.68 H new ATOM 0 HG1 THR A 149 36.253 43.334 20.879 1.00 24.58 H new ATOM 0 HG21 THR A 149 35.665 44.162 23.554 1.00 22.21 H new ATOM 0 HG22 THR A 149 34.825 45.503 23.496 1.00 22.21 H new ATOM 0 HG23 THR A 149 34.118 44.113 23.219 1.00 22.21 H new ATOM 1174 N PHE A 150 32.953 47.003 22.316 1.00 26.76 N ATOM 1175 CA PHE A 150 32.580 48.269 22.930 1.00 27.93 C ATOM 1176 C PHE A 150 32.570 48.182 24.421 1.00 30.32 C ATOM 1177 O PHE A 150 32.367 47.123 25.029 1.00 30.55 O ATOM 1178 CB PHE A 150 31.206 48.737 22.427 1.00 27.96 C ATOM 1179 CG PHE A 150 31.211 49.133 20.981 1.00 26.34 C ATOM 1180 CD1 PHE A 150 31.518 50.417 20.612 1.00 25.33 C ATOM 1181 CD2 PHE A 150 30.983 48.193 19.989 1.00 24.93 C ATOM 1182 CE1 PHE A 150 31.585 50.772 19.269 1.00 26.33 C ATOM 1183 CE2 PHE A 150 31.055 48.538 18.622 1.00 26.03 C ATOM 1184 CZ PHE A 150 31.342 49.815 18.273 1.00 25.18 C ATOM 0 H PHE A 150 32.472 46.339 22.576 1.00 26.76 H new ATOM 0 HA PHE A 150 33.252 48.919 22.670 1.00 27.93 H new ATOM 0 HB2 PHE A 150 30.560 48.026 22.559 1.00 27.96 H new ATOM 0 HB3 PHE A 150 30.912 49.491 22.962 1.00 27.96 H new ATOM 0 HD1 PHE A 150 31.683 51.057 21.266 1.00 25.33 H new ATOM 0 HD2 PHE A 150 30.779 47.318 20.228 1.00 24.93 H new ATOM 0 HE1 PHE A 150 31.792 51.647 19.031 1.00 26.33 H new ATOM 0 HE2 PHE A 150 30.907 47.895 17.967 1.00 26.03 H new ATOM 0 HZ PHE A 150 31.378 50.056 17.376 1.00 25.18 H new ATOM 1185 N GLN A 151 32.829 49.320 25.025 1.00 33.46 N ATOM 1186 CA GLN A 151 32.776 49.379 26.466 1.00 36.21 C ATOM 1187 C GLN A 151 31.528 50.098 26.755 1.00 39.00 C ATOM 1188 O GLN A 151 31.449 51.322 26.643 1.00 38.75 O ATOM 1189 CB GLN A 151 34.003 49.967 27.158 1.00 36.28 C ATOM 1190 CG GLN A 151 34.725 51.070 26.476 1.00 36.52 C ATOM 1191 CD GLN A 151 36.112 51.268 27.082 1.00 37.00 C ATOM 1192 OE1 GLN A 151 36.635 50.386 27.745 1.00 37.35 O ATOM 1193 NE2 GLN A 151 36.710 52.403 26.828 1.00 36.56 N ATOM 0 H GLN A 151 33.034 50.056 24.630 1.00 33.46 H new ATOM 0 HA GLN A 151 32.786 48.484 26.840 1.00 36.21 H new ATOM 0 HB2 GLN A 151 33.727 50.287 28.031 1.00 36.28 H new ATOM 0 HB3 GLN A 151 34.634 49.246 27.307 1.00 36.28 H new ATOM 0 HG2 GLN A 151 34.806 50.872 25.530 1.00 36.52 H new ATOM 0 HG3 GLN A 151 34.214 51.891 26.551 1.00 36.52 H new ATOM 0 HE21 GLN A 151 36.312 53.003 26.357 1.00 36.56 H new ATOM 0 HE22 GLN A 151 37.501 52.550 27.132 1.00 36.56 H new ATOM 1194 N GLY A 152 30.539 49.234 27.015 1.00 42.60 N ATOM 1195 CA GLY A 152 29.145 49.572 27.329 1.00 44.68 C ATOM 1196 C GLY A 152 29.005 50.189 28.712 1.00 47.22 C ATOM 1197 O GLY A 152 29.377 49.585 29.751 1.00 47.92 O ATOM 0 H GLY A 152 30.673 48.385 27.012 1.00 42.60 H new ATOM 0 HA2 GLY A 152 28.806 50.191 26.664 1.00 44.68 H new ATOM 0 HA3 GLY A 152 28.599 48.772 27.276 1.00 44.68 H new ATOM 1198 N GLY A 153 28.436 51.394 28.706 1.00 48.81 N ATOM 1199 CA GLY A 153 28.308 52.212 29.906 1.00 50.17 C ATOM 1200 C GLY A 153 26.955 52.395 30.567 1.00 51.15 C ATOM 1201 O GLY A 153 26.870 52.378 31.798 1.00 52.38 O ATOM 0 H GLY A 153 28.112 51.760 27.999 1.00 48.81 H new ATOM 0 HA2 GLY A 153 28.905 51.839 30.573 1.00 50.17 H new ATOM 0 HA3 GLY A 153 28.643 53.096 29.688 1.00 50.17 H new ATOM 1202 N SER A 154 25.901 52.573 29.777 1.00 51.93 N ATOM 1203 CA SER A 154 24.557 52.902 30.329 1.00 52.47 C ATOM 1204 C SER A 154 23.871 51.796 31.159 1.00 52.67 C ATOM 1205 O SER A 154 23.310 50.833 30.625 1.00 52.86 O ATOM 1206 CB SER A 154 23.620 53.383 29.215 1.00 52.40 C ATOM 0 H SER A 154 25.928 52.511 28.920 1.00 51.93 H new ATOM 0 HA SER A 154 24.732 53.612 30.966 1.00 52.47 H new ATOM 1207 N ALA A 159 16.476 45.375 28.517 1.00 42.29 N ATOM 1208 CA ALA A 159 16.351 46.467 27.543 1.00 41.51 C ATOM 1209 C ALA A 159 16.722 45.905 26.159 1.00 40.66 C ATOM 1210 O ALA A 159 16.581 46.559 25.100 1.00 40.99 O ATOM 1211 CB ALA A 159 17.246 47.638 27.943 1.00 41.84 C ATOM 0 HA ALA A 159 15.443 46.807 27.517 1.00 41.51 H new ATOM 0 HB1 ALA A 159 17.155 48.352 27.293 1.00 41.84 H new ATOM 0 HB2 ALA A 159 16.983 47.963 28.818 1.00 41.84 H new ATOM 0 HB3 ALA A 159 18.170 47.344 27.972 1.00 41.84 H new ATOM 1212 N LEU A 160 17.229 44.676 26.213 1.00 38.50 N ATOM 1213 CA LEU A 160 17.463 43.868 25.029 1.00 36.32 C ATOM 1214 C LEU A 160 16.426 42.763 25.142 1.00 35.60 C ATOM 1215 O LEU A 160 16.467 41.893 26.036 1.00 35.19 O ATOM 1216 CB LEU A 160 18.867 43.278 24.964 1.00 35.53 C ATOM 1217 CG LEU A 160 19.223 42.683 23.596 1.00 31.58 C ATOM 1218 CD1 LEU A 160 19.048 43.677 22.497 1.00 25.67 C ATOM 1219 CD2 LEU A 160 20.643 42.174 23.643 1.00 26.71 C ATOM 0 H LEU A 160 17.448 44.287 26.948 1.00 38.50 H new ATOM 0 HA LEU A 160 17.389 44.400 24.221 1.00 36.32 H new ATOM 0 HB2 LEU A 160 19.510 43.970 25.184 1.00 35.53 H new ATOM 0 HB3 LEU A 160 18.951 42.587 25.640 1.00 35.53 H new ATOM 0 HG LEU A 160 18.618 41.949 23.405 1.00 31.58 H new ATOM 0 HD11 LEU A 160 19.282 43.267 21.649 1.00 25.67 H new ATOM 0 HD12 LEU A 160 18.124 43.971 22.470 1.00 25.67 H new ATOM 0 HD13 LEU A 160 19.625 44.441 22.656 1.00 25.67 H new ATOM 0 HD21 LEU A 160 20.880 41.795 22.782 1.00 26.71 H new ATOM 0 HD22 LEU A 160 21.243 42.908 23.849 1.00 26.71 H new ATOM 0 HD23 LEU A 160 20.720 41.492 24.328 1.00 26.71 H new ATOM 1220 N LYS A 161 15.483 42.856 24.225 1.00 34.46 N ATOM 1221 CA LYS A 161 14.344 41.969 24.156 1.00 33.96 C ATOM 1222 C LYS A 161 14.208 41.418 22.727 1.00 33.24 C ATOM 1223 O LYS A 161 14.567 42.083 21.763 1.00 33.29 O ATOM 1224 CB LYS A 161 13.099 42.764 24.558 1.00 33.88 C ATOM 1225 CG LYS A 161 13.001 43.079 26.055 1.00 33.78 C ATOM 1226 CD LYS A 161 12.062 42.071 26.740 1.00 35.67 C ATOM 1227 CE LYS A 161 11.817 42.379 28.224 1.00 36.48 C ATOM 1228 NZ LYS A 161 12.712 41.592 29.132 1.00 36.11 N ATOM 0 H LYS A 161 15.489 43.455 23.608 1.00 34.46 H new ATOM 0 HA LYS A 161 14.454 41.216 24.758 1.00 33.96 H new ATOM 0 HB2 LYS A 161 13.088 43.598 24.062 1.00 33.88 H new ATOM 0 HB3 LYS A 161 12.311 42.265 24.292 1.00 33.88 H new ATOM 0 HG2 LYS A 161 13.881 43.040 26.460 1.00 33.78 H new ATOM 0 HG3 LYS A 161 12.669 43.981 26.183 1.00 33.78 H new ATOM 0 HD2 LYS A 161 11.212 42.062 26.273 1.00 35.67 H new ATOM 0 HD3 LYS A 161 12.439 41.181 26.659 1.00 35.67 H new ATOM 0 HE2 LYS A 161 11.955 43.326 28.381 1.00 36.48 H new ATOM 0 HE3 LYS A 161 10.892 42.187 28.442 1.00 36.48 H new ATOM 0 HZ1 LYS A 161 12.535 41.802 29.979 1.00 36.11 H new ATOM 0 HZ2 LYS A 161 12.571 40.722 29.007 1.00 36.11 H new ATOM 0 HZ3 LYS A 161 13.562 41.784 28.950 1.00 36.11 H new ATOM 1229 N PRO A 162 13.699 40.191 22.595 1.00 32.83 N ATOM 1230 CA PRO A 162 13.582 39.610 21.274 1.00 32.67 C ATOM 1231 C PRO A 162 12.503 40.239 20.441 1.00 33.23 C ATOM 1232 O PRO A 162 11.513 40.683 20.967 1.00 33.69 O ATOM 1233 CB PRO A 162 13.191 38.171 21.583 1.00 32.67 C ATOM 1234 CG PRO A 162 12.421 38.284 22.853 1.00 32.03 C ATOM 1235 CD PRO A 162 13.231 39.261 23.638 1.00 32.22 C ATOM 0 HA PRO A 162 14.398 39.724 20.763 1.00 32.67 H new ATOM 0 HB2 PRO A 162 12.654 37.787 20.873 1.00 32.67 H new ATOM 0 HB3 PRO A 162 13.971 37.604 21.688 1.00 32.67 H new ATOM 0 HG2 PRO A 162 11.518 38.604 22.700 1.00 32.03 H new ATOM 0 HG3 PRO A 162 12.346 37.430 23.307 1.00 32.03 H new ATOM 0 HD2 PRO A 162 12.700 39.712 24.313 1.00 32.22 H new ATOM 0 HD3 PRO A 162 13.969 38.832 24.098 1.00 32.22 H new ATOM 1236 N VAL A 163 12.719 40.274 19.132 1.00 33.68 N ATOM 1237 CA VAL A 163 11.699 40.749 18.175 1.00 33.99 C ATOM 1238 C VAL A 163 11.383 39.613 17.206 1.00 34.45 C ATOM 1239 O VAL A 163 12.243 39.029 16.562 1.00 33.22 O ATOM 1240 CB VAL A 163 12.103 41.992 17.430 1.00 34.47 C ATOM 1241 CG1 VAL A 163 11.022 42.359 16.389 1.00 33.55 C ATOM 1242 CG2 VAL A 163 12.315 43.107 18.411 1.00 32.77 C ATOM 0 H VAL A 163 13.456 40.026 18.765 1.00 33.68 H new ATOM 0 HA VAL A 163 10.910 41.000 18.681 1.00 33.99 H new ATOM 0 HB VAL A 163 12.933 41.837 16.953 1.00 34.47 H new ATOM 0 HG11 VAL A 163 11.290 43.161 15.913 1.00 33.55 H new ATOM 0 HG12 VAL A 163 10.918 41.629 15.759 1.00 33.55 H new ATOM 0 HG13 VAL A 163 10.178 42.518 16.841 1.00 33.55 H new ATOM 0 HG21 VAL A 163 12.576 43.911 17.936 1.00 32.77 H new ATOM 0 HG22 VAL A 163 11.492 43.272 18.897 1.00 32.77 H new ATOM 0 HG23 VAL A 163 13.015 42.860 19.036 1.00 32.77 H new ATOM 1243 N ASN A 164 10.108 39.306 17.131 1.00 35.82 N ATOM 1244 CA ASN A 164 9.680 38.094 16.464 1.00 37.32 C ATOM 1245 C ASN A 164 8.762 38.307 15.277 1.00 37.53 C ATOM 1246 O ASN A 164 7.583 37.930 15.293 1.00 38.20 O ATOM 1247 CB ASN A 164 9.010 37.201 17.488 1.00 38.27 C ATOM 1248 CG ASN A 164 8.819 35.818 16.988 1.00 40.98 C ATOM 1249 OD1 ASN A 164 9.206 35.507 15.853 1.00 44.63 O ATOM 1250 ND2 ASN A 164 8.185 34.962 17.815 1.00 44.07 N ATOM 0 H ASN A 164 9.472 39.783 17.458 1.00 35.82 H new ATOM 0 HA ASN A 164 10.476 37.684 16.090 1.00 37.32 H new ATOM 0 HB2 ASN A 164 9.546 37.180 18.296 1.00 38.27 H new ATOM 0 HB3 ASN A 164 8.149 37.578 17.729 1.00 38.27 H new ATOM 0 HD21 ASN A 164 8.031 34.154 17.562 1.00 44.07 H new ATOM 0 HD22 ASN A 164 7.935 35.224 18.595 1.00 44.07 H new ATOM 1251 N GLU A 165 9.342 38.925 14.254 1.00 37.33 N ATOM 1252 CA GLU A 165 8.669 39.201 12.994 1.00 36.74 C ATOM 1253 C GLU A 165 9.253 38.380 11.852 1.00 35.76 C ATOM 1254 O GLU A 165 10.066 37.495 12.049 1.00 35.95 O ATOM 1255 CB GLU A 165 8.777 40.680 12.661 1.00 36.79 C ATOM 1256 CG GLU A 165 8.146 41.566 13.718 1.00 38.48 C ATOM 1257 CD GLU A 165 6.616 41.401 13.818 1.00 41.39 C ATOM 1258 OE1 GLU A 165 6.055 40.394 13.300 1.00 42.23 O ATOM 1259 OE2 GLU A 165 5.968 42.300 14.411 1.00 41.18 O ATOM 0 H GLU A 165 10.156 39.201 14.275 1.00 37.33 H new ATOM 0 HA GLU A 165 7.737 38.953 13.099 1.00 36.74 H new ATOM 0 HB2 GLU A 165 9.712 40.918 12.561 1.00 36.79 H new ATOM 0 HB3 GLU A 165 8.349 40.847 11.807 1.00 36.79 H new ATOM 0 HG2 GLU A 165 8.544 41.365 14.579 1.00 38.48 H new ATOM 0 HG3 GLU A 165 8.353 42.493 13.520 1.00 38.48 H new ATOM 1260 N ARG A 166 8.825 38.714 10.647 1.00 34.64 N ATOM 1261 CA ARG A 166 9.256 37.998 9.440 1.00 33.76 C ATOM 1262 C ARG A 166 10.538 38.579 8.857 1.00 32.32 C ATOM 1263 O ARG A 166 10.745 39.784 8.839 1.00 32.67 O ATOM 1264 CB ARG A 166 8.146 37.986 8.366 1.00 33.82 C ATOM 0 H ARG A 166 8.277 39.360 10.497 1.00 34.64 H new ATOM 0 HA ARG A 166 9.437 37.085 9.711 1.00 33.76 H new ATOM 1265 N TYR A 167 11.383 37.670 8.397 1.00 30.89 N ATOM 1266 CA TYR A 167 12.651 38.002 7.771 1.00 30.43 C ATOM 1267 C TYR A 167 12.464 38.108 6.271 1.00 30.24 C ATOM 1268 O TYR A 167 12.251 37.108 5.562 1.00 30.81 O ATOM 1269 CB TYR A 167 13.696 36.947 8.032 1.00 29.78 C ATOM 1270 CG TYR A 167 15.027 37.239 7.402 1.00 28.61 C ATOM 1271 CD1 TYR A 167 15.648 38.451 7.598 1.00 25.76 C ATOM 1272 CD2 TYR A 167 15.689 36.277 6.650 1.00 27.68 C ATOM 1273 CE1 TYR A 167 16.854 38.704 7.062 1.00 26.65 C ATOM 1274 CE2 TYR A 167 16.941 36.517 6.129 1.00 25.60 C ATOM 1275 CZ TYR A 167 17.502 37.746 6.303 1.00 26.52 C ATOM 1276 OH TYR A 167 18.762 38.034 5.788 1.00 23.37 O ATOM 0 H TYR A 167 11.232 36.824 8.441 1.00 30.89 H new ATOM 0 HA TYR A 167 12.948 38.844 8.150 1.00 30.43 H new ATOM 0 HB2 TYR A 167 13.815 36.853 8.990 1.00 29.78 H new ATOM 0 HB3 TYR A 167 13.372 36.095 7.701 1.00 29.78 H new ATOM 0 HD1 TYR A 167 15.227 39.104 8.109 1.00 25.76 H new ATOM 0 HD2 TYR A 167 15.280 35.456 6.496 1.00 27.68 H new ATOM 0 HE1 TYR A 167 17.257 39.530 7.203 1.00 26.65 H new ATOM 0 HE2 TYR A 167 17.396 35.851 5.666 1.00 25.60 H new ATOM 0 HH TYR A 167 18.861 38.867 5.738 1.00 23.37 H new ATOM 1277 N ALA A 168 12.575 39.342 5.822 1.00 29.39 N ATOM 1278 CA ALA A 168 12.376 39.710 4.416 1.00 29.38 C ATOM 1279 C ALA A 168 13.714 39.804 3.710 1.00 28.37 C ATOM 1280 O ALA A 168 13.802 40.059 2.525 1.00 29.66 O ATOM 1281 CB ALA A 168 11.595 41.055 4.330 1.00 28.92 C ATOM 0 H ALA A 168 12.772 40.009 6.328 1.00 29.39 H new ATOM 0 HA ALA A 168 11.851 39.025 3.972 1.00 29.38 H new ATOM 0 HB1 ALA A 168 11.465 41.295 3.399 1.00 28.92 H new ATOM 0 HB2 ALA A 168 10.732 40.956 4.761 1.00 28.92 H new ATOM 0 HB3 ALA A 168 12.101 41.752 4.776 1.00 28.92 H new ATOM 1282 N GLY A 169 14.754 39.591 4.480 1.00 28.01 N ATOM 1283 CA GLY A 169 16.128 39.639 4.012 1.00 27.68 C ATOM 1284 C GLY A 169 16.480 38.465 3.108 1.00 27.55 C ATOM 1285 O GLY A 169 15.692 37.527 2.923 1.00 27.12 O ATOM 0 H GLY A 169 14.685 39.408 5.317 1.00 28.01 H new ATOM 0 HA2 GLY A 169 16.273 40.468 3.531 1.00 27.68 H new ATOM 0 HA3 GLY A 169 16.726 39.646 4.776 1.00 27.68 H new ATOM 1286 N ARG A 170 17.729 38.504 2.663 1.00 26.57 N ATOM 1287 CA ARG A 170 18.219 37.693 1.575 1.00 26.72 C ATOM 1288 C ARG A 170 19.260 36.680 1.934 1.00 27.01 C ATOM 1289 O ARG A 170 19.754 35.948 1.062 1.00 26.70 O ATOM 1290 CB ARG A 170 18.809 38.648 0.517 1.00 27.08 C ATOM 1291 CG ARG A 170 17.784 39.391 -0.328 1.00 27.02 C ATOM 1292 CD ARG A 170 17.519 38.669 -1.635 1.00 27.93 C ATOM 1293 NE ARG A 170 16.932 37.341 -1.422 1.00 30.47 N ATOM 1294 CZ ARG A 170 15.711 37.132 -0.937 1.00 30.28 C ATOM 1295 NH1 ARG A 170 14.951 38.146 -0.572 1.00 30.68 N ATOM 1296 NH2 ARG A 170 15.252 35.914 -0.793 1.00 30.07 N ATOM 0 H ARG A 170 18.328 39.021 3.000 1.00 26.57 H new ATOM 0 HA ARG A 170 17.462 37.176 1.259 1.00 26.72 H new ATOM 0 HB2 ARG A 170 19.370 39.299 0.967 1.00 27.08 H new ATOM 0 HB3 ARG A 170 19.385 38.138 -0.073 1.00 27.08 H new ATOM 0 HG2 ARG A 170 16.956 39.480 0.169 1.00 27.02 H new ATOM 0 HG3 ARG A 170 18.102 40.289 -0.511 1.00 27.02 H new ATOM 0 HD2 ARG A 170 16.921 39.202 -2.182 1.00 27.93 H new ATOM 0 HD3 ARG A 170 18.350 38.579 -2.128 1.00 27.93 H new ATOM 0 HE ARG A 170 17.408 36.654 -1.624 1.00 30.47 H new ATOM 0 HH11 ARG A 170 15.244 38.951 -0.647 1.00 30.68 H new ATOM 0 HH12 ARG A 170 14.163 38.002 -0.259 1.00 30.68 H new ATOM 0 HH21 ARG A 170 15.741 35.241 -1.013 1.00 30.07 H new ATOM 0 HH22 ARG A 170 14.462 35.787 -0.479 1.00 30.07 H new ATOM 1297 N TRP A 171 19.634 36.662 3.207 1.00 26.23 N ATOM 1298 CA TRP A 171 20.566 35.659 3.686 1.00 26.12 C ATOM 1299 C TRP A 171 19.795 34.437 4.170 1.00 26.79 C ATOM 1300 O TRP A 171 18.657 34.556 4.645 1.00 28.08 O ATOM 1301 CB TRP A 171 21.394 36.193 4.828 1.00 26.81 C ATOM 1302 CG TRP A 171 22.261 37.226 4.358 1.00 25.19 C ATOM 1303 CD1 TRP A 171 22.033 38.572 4.386 1.00 25.04 C ATOM 1304 CD2 TRP A 171 23.464 37.032 3.663 1.00 24.11 C ATOM 1305 NE1 TRP A 171 23.059 39.219 3.791 1.00 22.54 N ATOM 1306 CE2 TRP A 171 23.962 38.289 3.344 1.00 24.41 C ATOM 1307 CE3 TRP A 171 24.207 35.902 3.312 1.00 26.90 C ATOM 1308 CZ2 TRP A 171 25.161 38.457 2.674 1.00 25.22 C ATOM 1309 CZ3 TRP A 171 25.405 36.085 2.677 1.00 24.92 C ATOM 1310 CH2 TRP A 171 25.852 37.341 2.340 1.00 24.46 C ATOM 0 H TRP A 171 19.361 37.218 3.804 1.00 26.23 H new ATOM 0 HA TRP A 171 21.156 35.419 2.954 1.00 26.12 H new ATOM 0 HB2 TRP A 171 20.814 36.539 5.525 1.00 26.81 H new ATOM 0 HB3 TRP A 171 21.916 35.477 5.223 1.00 26.81 H new ATOM 0 HD1 TRP A 171 21.285 38.981 4.758 1.00 25.04 H new ATOM 0 HE1 TRP A 171 23.133 40.072 3.707 1.00 22.54 H new ATOM 0 HE3 TRP A 171 23.895 35.047 3.505 1.00 26.90 H new ATOM 0 HZ2 TRP A 171 25.480 39.304 2.461 1.00 25.22 H new ATOM 0 HZ3 TRP A 171 25.928 35.345 2.469 1.00 24.92 H new ATOM 0 HH2 TRP A 171 26.650 37.426 1.870 1.00 24.46 H new ATOM 1311 N ARG A 172 20.392 33.270 3.963 1.00 25.20 N ATOM 1312 CA ARG A 172 19.807 31.998 4.381 1.00 23.73 C ATOM 1313 C ARG A 172 20.692 31.190 5.267 1.00 22.64 C ATOM 1314 O ARG A 172 20.321 30.110 5.653 1.00 21.21 O ATOM 1315 CB ARG A 172 19.496 31.119 3.197 1.00 23.99 C ATOM 1316 CG ARG A 172 18.081 30.956 2.940 1.00 26.01 C ATOM 1317 CD ARG A 172 17.497 32.230 2.613 1.00 29.49 C ATOM 1318 NE ARG A 172 16.050 32.170 2.717 1.00 28.86 N ATOM 1319 CZ ARG A 172 15.292 33.242 2.751 1.00 32.00 C ATOM 1320 NH1 ARG A 172 15.850 34.468 2.706 1.00 32.34 N ATOM 1321 NH2 ARG A 172 13.984 33.081 2.851 1.00 32.21 N ATOM 0 H ARG A 172 21.154 33.191 3.573 1.00 25.20 H new ATOM 0 HA ARG A 172 19.007 32.257 4.865 1.00 23.73 H new ATOM 0 HB2 ARG A 172 19.917 31.494 2.408 1.00 23.99 H new ATOM 0 HB3 ARG A 172 19.892 30.245 3.342 1.00 23.99 H new ATOM 0 HG2 ARG A 172 17.946 30.332 2.210 1.00 26.01 H new ATOM 0 HG3 ARG A 172 17.643 30.580 3.720 1.00 26.01 H new ATOM 0 HD2 ARG A 172 17.841 32.912 3.210 1.00 29.49 H new ATOM 0 HD3 ARG A 172 17.751 32.487 1.713 1.00 29.49 H new ATOM 0 HE ARG A 172 15.673 31.398 2.758 1.00 28.86 H new ATOM 0 HH11 ARG A 172 16.705 34.550 2.655 1.00 32.34 H new ATOM 0 HH12 ARG A 172 15.351 35.168 2.728 1.00 32.34 H new ATOM 0 HH21 ARG A 172 13.650 32.290 2.892 1.00 32.21 H new ATOM 0 HH22 ARG A 172 13.467 33.768 2.875 1.00 32.21 H new ATOM 1322 N CYS A 173 21.911 31.662 5.472 1.00 23.28 N ATOM 1323 CA CYS A 173 22.828 31.023 6.458 1.00 23.60 C ATOM 1324 C CYS A 173 23.143 32.087 7.437 1.00 23.91 C ATOM 1325 O CYS A 173 23.346 33.236 7.052 1.00 24.13 O ATOM 1326 CB CYS A 173 24.102 30.468 5.855 1.00 24.17 C ATOM 1327 SG CYS A 173 23.825 29.310 4.556 1.00 25.92 S ATOM 0 H CYS A 173 22.241 32.343 5.064 1.00 23.28 H new ATOM 0 HA CYS A 173 22.394 30.250 6.852 1.00 23.60 H new ATOM 0 HB2 CYS A 173 24.636 31.203 5.514 1.00 24.17 H new ATOM 0 HB3 CYS A 173 24.621 30.040 6.554 1.00 24.17 H new ATOM 1328 N PHE A 174 23.141 31.682 8.701 1.00 23.83 N ATOM 1329 CA PHE A 174 23.269 32.563 9.847 1.00 24.08 C ATOM 1330 C PHE A 174 24.055 31.957 10.979 1.00 22.88 C ATOM 1331 O PHE A 174 24.112 30.763 11.142 1.00 21.32 O ATOM 1332 CB PHE A 174 21.889 32.805 10.514 1.00 24.95 C ATOM 1333 CG PHE A 174 20.746 32.957 9.572 1.00 28.29 C ATOM 1334 CD1 PHE A 174 20.045 31.844 9.130 1.00 29.88 C ATOM 1335 CD2 PHE A 174 20.308 34.229 9.205 1.00 32.92 C ATOM 1336 CE1 PHE A 174 18.996 31.981 8.290 1.00 28.82 C ATOM 1337 CE2 PHE A 174 19.235 34.376 8.350 1.00 33.29 C ATOM 1338 CZ PHE A 174 18.580 33.252 7.892 1.00 32.08 C ATOM 0 H PHE A 174 23.062 30.854 8.920 1.00 23.83 H new ATOM 0 HA PHE A 174 23.692 33.356 9.483 1.00 24.08 H new ATOM 0 HB2 PHE A 174 21.701 32.064 11.111 1.00 24.95 H new ATOM 0 HB3 PHE A 174 21.946 33.604 11.062 1.00 24.95 H new ATOM 0 HD1 PHE A 174 20.300 30.996 9.415 1.00 29.88 H new ATOM 0 HD2 PHE A 174 20.741 34.982 9.538 1.00 32.92 H new ATOM 0 HE1 PHE A 174 18.551 31.227 7.977 1.00 28.82 H new ATOM 0 HE2 PHE A 174 18.957 35.223 8.086 1.00 33.29 H new ATOM 0 HZ PHE A 174 17.857 33.342 7.314 1.00 32.08 H new ATOM 1339 N PHE A 175 24.630 32.839 11.779 1.00 23.79 N ATOM 1340 CA PHE A 175 25.277 32.468 13.034 1.00 24.09 C ATOM 1341 C PHE A 175 24.205 32.526 14.075 1.00 25.30 C ATOM 1342 O PHE A 175 23.609 33.573 14.296 1.00 28.35 O ATOM 1343 CB PHE A 175 26.429 33.395 13.429 1.00 24.31 C ATOM 1344 CG PHE A 175 27.764 32.729 13.450 1.00 22.75 C ATOM 1345 CD1 PHE A 175 27.945 31.531 14.115 1.00 26.32 C ATOM 1346 CD2 PHE A 175 28.859 33.326 12.873 1.00 26.77 C ATOM 1347 CE1 PHE A 175 29.179 30.905 14.182 1.00 27.38 C ATOM 1348 CE2 PHE A 175 30.104 32.704 12.929 1.00 28.46 C ATOM 1349 CZ PHE A 175 30.247 31.483 13.606 1.00 31.08 C ATOM 0 H PHE A 175 24.658 33.682 11.610 1.00 23.79 H new ATOM 0 HA PHE A 175 25.676 31.589 12.941 1.00 24.09 H new ATOM 0 HB2 PHE A 175 26.459 34.140 12.809 1.00 24.31 H new ATOM 0 HB3 PHE A 175 26.248 33.764 14.308 1.00 24.31 H new ATOM 0 HD1 PHE A 175 27.215 31.132 14.531 1.00 26.32 H new ATOM 0 HD2 PHE A 175 28.769 34.146 12.445 1.00 26.77 H new ATOM 0 HE1 PHE A 175 29.268 30.091 14.622 1.00 27.38 H new ATOM 0 HE2 PHE A 175 30.840 33.097 12.518 1.00 28.46 H new ATOM 0 HZ PHE A 175 31.081 31.074 13.656 1.00 31.08 H new ATOM 1350 N ILE A 176 23.896 31.377 14.654 1.00 24.84 N ATOM 1351 CA ILE A 176 22.980 31.326 15.748 1.00 24.67 C ATOM 1352 C ILE A 176 23.591 30.497 16.879 1.00 24.70 C ATOM 1353 O ILE A 176 23.989 29.346 16.685 1.00 24.57 O ATOM 1354 CB ILE A 176 21.657 30.751 15.335 1.00 24.80 C ATOM 1355 CG1 ILE A 176 21.026 31.628 14.235 1.00 26.65 C ATOM 1356 CG2 ILE A 176 20.694 30.688 16.508 1.00 22.28 C ATOM 1357 CD1 ILE A 176 19.603 31.235 13.925 1.00 29.27 C ATOM 0 H ILE A 176 24.215 30.614 14.417 1.00 24.84 H new ATOM 0 HA ILE A 176 22.818 32.232 16.056 1.00 24.67 H new ATOM 0 HB ILE A 176 21.816 29.853 15.005 1.00 24.80 H new ATOM 0 HG12 ILE A 176 21.048 32.557 14.514 1.00 26.65 H new ATOM 0 HG13 ILE A 176 21.559 31.562 13.428 1.00 26.65 H new ATOM 0 HG21 ILE A 176 19.849 30.313 16.214 1.00 22.28 H new ATOM 0 HG22 ILE A 176 21.070 30.128 17.206 1.00 22.28 H new ATOM 0 HG23 ILE A 176 20.547 31.582 16.855 1.00 22.28 H new ATOM 0 HD11 ILE A 176 19.251 31.813 13.230 1.00 29.27 H new ATOM 0 HD12 ILE A 176 19.580 30.314 13.621 1.00 29.27 H new ATOM 0 HD13 ILE A 176 19.061 31.325 14.724 1.00 29.27 H new ATOM 1358 N ASP A 177 23.659 31.087 18.057 1.00 24.12 N ATOM 1359 CA ASP A 177 24.256 30.377 19.210 1.00 23.49 C ATOM 1360 C ASP A 177 25.542 29.661 18.815 1.00 23.39 C ATOM 1361 O ASP A 177 25.712 28.464 19.043 1.00 23.39 O ATOM 1362 CB ASP A 177 23.270 29.376 19.798 1.00 23.08 C ATOM 1363 CG ASP A 177 23.791 28.686 21.075 1.00 24.86 C ATOM 1364 OD1 ASP A 177 24.556 29.283 21.815 1.00 23.55 O ATOM 1365 OD2 ASP A 177 23.393 27.540 21.350 1.00 25.66 O ATOM 0 H ASP A 177 23.376 31.882 18.224 1.00 24.12 H new ATOM 0 HA ASP A 177 24.469 31.044 19.882 1.00 23.49 H new ATOM 0 HB2 ASP A 177 22.438 29.832 20.000 1.00 23.08 H new ATOM 0 HB3 ASP A 177 23.069 28.700 19.132 1.00 23.08 H new ATOM 1366 N TRP A 178 26.423 30.413 18.163 1.00 23.29 N ATOM 1367 CA TRP A 178 27.787 29.975 17.762 1.00 22.64 C ATOM 1368 C TRP A 178 27.872 28.823 16.767 1.00 23.42 C ATOM 1369 O TRP A 178 28.904 28.153 16.632 1.00 24.01 O ATOM 1370 CB TRP A 178 28.667 29.666 18.984 1.00 23.42 C ATOM 1371 CG TRP A 178 28.929 30.853 19.825 1.00 19.69 C ATOM 1372 CD1 TRP A 178 28.126 31.318 20.846 1.00 22.28 C ATOM 1373 CD2 TRP A 178 30.024 31.783 19.730 1.00 20.35 C ATOM 1374 NE1 TRP A 178 28.655 32.454 21.359 1.00 19.25 N ATOM 1375 CE2 TRP A 178 29.830 32.751 20.730 1.00 21.06 C ATOM 1376 CE3 TRP A 178 31.135 31.895 18.891 1.00 22.52 C ATOM 1377 CZ2 TRP A 178 30.706 33.821 20.928 1.00 23.16 C ATOM 1378 CZ3 TRP A 178 32.015 32.958 19.105 1.00 26.47 C ATOM 1379 CH2 TRP A 178 31.778 33.906 20.104 1.00 22.51 C ATOM 0 H TRP A 178 26.250 31.222 17.928 1.00 23.29 H new ATOM 0 HA TRP A 178 28.124 30.747 17.282 1.00 22.64 H new ATOM 0 HB2 TRP A 178 28.236 28.984 19.522 1.00 23.42 H new ATOM 0 HB3 TRP A 178 29.512 29.297 18.682 1.00 23.42 H new ATOM 0 HD1 TRP A 178 27.341 30.913 21.137 1.00 22.28 H new ATOM 0 HE1 TRP A 178 28.302 32.921 21.989 1.00 19.25 H new ATOM 0 HE3 TRP A 178 31.284 31.280 18.210 1.00 22.52 H new ATOM 0 HZ2 TRP A 178 30.559 34.449 21.598 1.00 23.16 H new ATOM 0 HZ3 TRP A 178 32.773 33.037 18.572 1.00 26.47 H new ATOM 0 HH2 TRP A 178 32.372 34.614 20.206 1.00 22.51 H new ATOM 1380 N LYS A 179 26.760 28.626 16.091 1.00 23.29 N ATOM 1381 CA LYS A 179 26.600 27.637 15.053 1.00 23.39 C ATOM 1382 C LYS A 179 26.206 28.373 13.766 1.00 24.34 C ATOM 1383 O LYS A 179 25.311 29.194 13.762 1.00 25.50 O ATOM 1384 CB LYS A 179 25.526 26.617 15.476 1.00 22.72 C ATOM 1385 CG LYS A 179 25.870 25.806 16.714 1.00 22.14 C ATOM 1386 CD LYS A 179 24.672 25.022 17.283 1.00 23.20 C ATOM 1387 CE LYS A 179 23.872 25.865 18.240 1.00 25.94 C ATOM 1388 NZ LYS A 179 22.585 25.227 18.799 1.00 26.15 N ATOM 0 H LYS A 179 26.047 29.086 16.231 1.00 23.29 H new ATOM 0 HA LYS A 179 27.423 27.146 14.902 1.00 23.39 H new ATOM 0 HB2 LYS A 179 24.694 27.090 15.635 1.00 22.72 H new ATOM 0 HB3 LYS A 179 25.369 26.007 14.738 1.00 22.72 H new ATOM 0 HG2 LYS A 179 26.582 25.184 16.498 1.00 22.14 H new ATOM 0 HG3 LYS A 179 26.213 26.402 17.398 1.00 22.14 H new ATOM 0 HD2 LYS A 179 24.102 24.725 16.556 1.00 23.20 H new ATOM 0 HD3 LYS A 179 24.990 24.226 17.738 1.00 23.20 H new ATOM 0 HE2 LYS A 179 24.443 26.103 18.987 1.00 25.94 H new ATOM 0 HE3 LYS A 179 23.633 26.691 17.791 1.00 25.94 H new ATOM 0 HZ1 LYS A 179 22.424 25.548 19.613 1.00 26.15 H new ATOM 0 HZ2 LYS A 179 21.901 25.420 18.264 1.00 26.15 H new ATOM 0 HZ3 LYS A 179 22.686 24.344 18.843 1.00 26.15 H new ATOM 1389 N TYR A 180 26.923 28.089 12.682 1.00 24.33 N ATOM 1390 CA TYR A 180 26.583 28.636 11.374 1.00 24.48 C ATOM 1391 C TYR A 180 25.695 27.612 10.643 1.00 24.15 C ATOM 1392 O TYR A 180 26.136 26.538 10.232 1.00 23.02 O ATOM 1393 CB TYR A 180 27.848 28.993 10.557 1.00 23.51 C ATOM 1394 CG TYR A 180 27.573 29.926 9.393 1.00 24.78 C ATOM 1395 CD1 TYR A 180 27.324 31.296 9.613 1.00 23.95 C ATOM 1396 CD2 TYR A 180 27.582 29.468 8.084 1.00 23.06 C ATOM 1397 CE1 TYR A 180 27.103 32.158 8.579 1.00 24.54 C ATOM 1398 CE2 TYR A 180 27.322 30.332 7.054 1.00 21.50 C ATOM 1399 CZ TYR A 180 27.071 31.666 7.297 1.00 22.38 C ATOM 1400 OH TYR A 180 26.830 32.505 6.230 1.00 26.88 O ATOM 0 H TYR A 180 27.615 27.578 12.684 1.00 24.33 H new ATOM 0 HA TYR A 180 26.096 29.468 11.482 1.00 24.48 H new ATOM 0 HB2 TYR A 180 28.499 29.405 11.146 1.00 23.51 H new ATOM 0 HB3 TYR A 180 28.248 28.176 10.220 1.00 23.51 H new ATOM 0 HD1 TYR A 180 27.310 31.620 10.485 1.00 23.95 H new ATOM 0 HD2 TYR A 180 27.765 28.574 7.906 1.00 23.06 H new ATOM 0 HE1 TYR A 180 26.976 33.065 8.740 1.00 24.54 H new ATOM 0 HE2 TYR A 180 27.315 30.015 6.180 1.00 21.50 H new ATOM 0 HH TYR A 180 26.929 32.081 5.512 1.00 26.88 H new HETATM 1401 N MSE A 181 24.448 27.992 10.457 1.00 24.13 N HETATM 1402 CA MSE A 181 23.433 27.094 9.934 1.00 24.92 C HETATM 1403 C MSE A 181 22.587 27.749 8.862 1.00 25.51 C HETATM 1404 O MSE A 181 22.376 28.951 8.866 1.00 25.57 O HETATM 1405 CB MSE A 181 22.508 26.656 11.093 1.00 25.88 C HETATM 1406 CG MSE A 181 21.721 27.787 11.725 1.00 25.84 C HETATM 1407 SE MSE A 181 20.527 27.285 13.244 0.75 26.78 SE HETATM 1408 CE MSE A 181 21.837 27.040 14.638 1.00 22.48 C HETATM 0 H MSE A 181 24.161 28.784 10.631 1.00 24.13 H new HETATM 0 HA MSE A 181 23.886 26.334 9.536 1.00 24.92 H new HETATM 0 HB2 MSE A 181 21.886 25.989 10.762 1.00 25.88 H new HETATM 0 HB3 MSE A 181 23.046 26.228 11.778 1.00 25.88 H new HETATM 0 HG2 MSE A 181 22.348 28.457 12.038 1.00 25.84 H new HETATM 0 HG3 MSE A 181 21.180 28.204 11.037 1.00 25.84 H new HETATM 0 HE1 MSE A 181 21.391 26.786 15.461 1.00 22.48 H new HETATM 0 HE2 MSE A 181 22.459 26.342 14.379 1.00 22.48 H new HETATM 0 HE3 MSE A 181 22.322 27.869 14.776 1.00 22.48 H new ATOM 1409 N CYS A 182 22.076 26.926 7.975 1.00 26.28 N ATOM 1410 CA CYS A 182 21.238 27.397 6.897 1.00 28.31 C ATOM 1411 C CYS A 182 19.855 26.781 6.973 1.00 30.30 C ATOM 1412 O CYS A 182 19.637 25.698 7.529 1.00 28.35 O ATOM 1413 CB CYS A 182 21.863 27.123 5.530 1.00 27.67 C ATOM 1414 SG CYS A 182 23.648 27.504 5.444 1.00 26.91 S ATOM 0 H CYS A 182 22.204 26.076 7.979 1.00 26.28 H new ATOM 0 HA CYS A 182 21.157 28.358 7.001 1.00 28.31 H new ATOM 0 HB2 CYS A 182 21.729 26.189 5.304 1.00 27.67 H new ATOM 0 HB3 CYS A 182 21.397 27.647 4.860 1.00 27.67 H new ATOM 1415 N SER A 183 18.913 27.542 6.462 1.00 32.97 N ATOM 1416 CA SER A 183 17.545 27.051 6.306 1.00 36.05 C ATOM 1417 C SER A 183 16.784 27.896 5.286 1.00 38.42 C ATOM 1418 O SER A 183 16.689 29.123 5.429 1.00 38.79 O ATOM 1419 CB SER A 183 16.811 27.001 7.642 1.00 36.33 C ATOM 1420 OG SER A 183 15.436 26.769 7.408 1.00 38.72 O ATOM 0 H SER A 183 19.036 28.350 6.195 1.00 32.97 H new ATOM 0 HA SER A 183 17.591 26.142 5.972 1.00 36.05 H new ATOM 0 HB2 SER A 183 17.179 26.297 8.199 1.00 36.33 H new ATOM 0 HB3 SER A 183 16.932 27.835 8.122 1.00 36.33 H new ATOM 0 HG SER A 183 14.997 27.454 7.615 1.00 38.72 H new ATOM 1421 N ASP A 184 16.279 27.191 4.262 1.00 41.28 N ATOM 1422 CA ASP A 184 15.519 27.749 3.080 1.00 43.02 C ATOM 1423 C ASP A 184 14.420 28.645 3.529 1.00 43.66 C ATOM 1424 O ASP A 184 14.056 29.650 2.902 1.00 43.30 O ATOM 1425 CB ASP A 184 14.817 26.634 2.273 1.00 43.41 C ATOM 1426 CG ASP A 184 15.800 25.751 1.490 1.00 44.67 C ATOM 1427 OD1 ASP A 184 17.029 26.030 1.528 1.00 46.15 O ATOM 1428 OD2 ASP A 184 15.346 24.780 0.847 1.00 44.86 O ATOM 0 H ASP A 184 16.364 26.336 4.219 1.00 41.28 H new ATOM 0 HA ASP A 184 16.179 28.216 2.544 1.00 43.02 H new ATOM 0 HB2 ASP A 184 14.302 26.078 2.879 1.00 43.41 H new ATOM 0 HB3 ASP A 184 14.188 27.037 1.654 1.00 43.41 H new ATOM 1429 N ASP A 185 13.832 28.153 4.591 1.00 44.79 N ATOM 1430 CA ASP A 185 12.797 28.842 5.286 1.00 45.63 C ATOM 1431 C ASP A 185 13.352 29.185 6.638 1.00 46.05 C ATOM 1432 O ASP A 185 13.361 28.314 7.507 1.00 46.28 O ATOM 1433 CB ASP A 185 11.599 27.939 5.484 1.00 46.27 C ATOM 1434 CG ASP A 185 10.528 28.601 6.332 1.00 48.42 C ATOM 1435 OD1 ASP A 185 10.681 29.823 6.584 1.00 49.75 O ATOM 1436 OD2 ASP A 185 9.560 27.921 6.747 1.00 50.62 O ATOM 0 H ASP A 185 14.032 27.389 4.932 1.00 44.79 H new ATOM 0 HA ASP A 185 12.517 29.625 4.786 1.00 45.63 H new ATOM 0 HB2 ASP A 185 11.227 27.701 4.620 1.00 46.27 H new ATOM 0 HB3 ASP A 185 11.883 27.114 5.907 1.00 46.27 H new ATOM 1437 N PRO A 186 13.824 30.451 6.820 1.00 46.60 N ATOM 1438 CA PRO A 186 14.414 30.954 8.094 1.00 46.51 C ATOM 1439 C PRO A 186 13.403 30.985 9.248 1.00 46.73 C ATOM 1440 O PRO A 186 13.764 31.279 10.382 1.00 46.61 O ATOM 1441 CB PRO A 186 14.883 32.386 7.753 1.00 46.37 C ATOM 1442 CG PRO A 186 14.784 32.544 6.235 1.00 47.16 C ATOM 1443 CD PRO A 186 13.756 31.509 5.777 1.00 46.53 C ATOM 0 HA PRO A 186 15.128 30.374 8.401 1.00 46.51 H new ATOM 0 HB2 PRO A 186 14.330 33.044 8.203 1.00 46.37 H new ATOM 0 HB3 PRO A 186 15.794 32.529 8.054 1.00 46.37 H new ATOM 0 HG2 PRO A 186 14.505 33.442 5.996 1.00 47.16 H new ATOM 0 HG3 PRO A 186 15.644 32.392 5.812 1.00 47.16 H new ATOM 0 HD2 PRO A 186 12.867 31.893 5.718 1.00 46.53 H new ATOM 0 HD3 PRO A 186 13.972 31.157 4.899 1.00 46.53 H new ATOM 1444 N ASP A 187 12.148 30.651 8.926 1.00 47.17 N ATOM 1445 CA ASP A 187 11.013 30.640 9.887 1.00 46.96 C ATOM 1446 C ASP A 187 11.202 29.531 10.907 1.00 46.92 C ATOM 1447 O ASP A 187 10.791 29.655 12.062 1.00 46.58 O ATOM 1448 CB ASP A 187 9.665 30.459 9.171 1.00 46.52 C ATOM 0 H ASP A 187 11.920 30.419 8.130 1.00 47.17 H new ATOM 0 HA ASP A 187 11.002 31.499 10.337 1.00 46.96 H new ATOM 1449 N ILE A 188 11.841 28.453 10.454 1.00 47.10 N ATOM 1450 CA ILE A 188 12.175 27.303 11.330 1.00 46.91 C ATOM 1451 C ILE A 188 13.266 27.705 12.340 1.00 46.63 C ATOM 1452 O ILE A 188 13.057 27.680 13.549 1.00 45.62 O ATOM 1453 CB ILE A 188 12.658 26.063 10.549 1.00 47.06 C ATOM 1454 CG1 ILE A 188 11.481 25.416 9.816 1.00 45.92 C ATOM 1455 CG2 ILE A 188 13.327 25.043 11.503 1.00 47.91 C ATOM 1456 CD1 ILE A 188 11.311 25.928 8.435 1.00 44.11 C ATOM 0 H ILE A 188 12.096 28.358 9.638 1.00 47.10 H new ATOM 0 HA ILE A 188 11.353 27.063 11.785 1.00 46.91 H new ATOM 0 HB ILE A 188 13.318 26.345 9.896 1.00 47.06 H new ATOM 0 HG12 ILE A 188 11.613 24.455 9.786 1.00 45.92 H new ATOM 0 HG13 ILE A 188 10.666 25.575 10.318 1.00 45.92 H new ATOM 0 HG21 ILE A 188 13.624 24.271 10.996 1.00 47.91 H new ATOM 0 HG22 ILE A 188 14.089 25.457 11.937 1.00 47.91 H new ATOM 0 HG23 ILE A 188 12.687 24.761 12.175 1.00 47.91 H new ATOM 0 HD11 ILE A 188 10.555 25.487 8.017 1.00 44.11 H new ATOM 0 HD12 ILE A 188 11.153 26.885 8.462 1.00 44.11 H new ATOM 0 HD13 ILE A 188 12.114 25.748 7.922 1.00 44.11 H new ATOM 1457 N ILE A 189 14.433 28.042 11.811 1.00 46.80 N ATOM 1458 CA ILE A 189 15.524 28.544 12.630 1.00 47.06 C ATOM 1459 C ILE A 189 14.940 29.568 13.606 1.00 47.43 C ATOM 1460 O ILE A 189 15.224 29.570 14.814 1.00 47.70 O ATOM 1461 CB ILE A 189 16.609 29.261 11.776 1.00 47.29 C ATOM 0 H ILE A 189 14.614 27.987 10.972 1.00 46.80 H new ATOM 0 HA ILE A 189 15.940 27.794 13.084 1.00 47.06 H new ATOM 1462 N HIS A 190 14.060 30.404 13.078 1.00 47.45 N ATOM 1463 CA HIS A 190 13.511 31.517 13.856 1.00 47.25 C ATOM 1464 C HIS A 190 12.728 31.067 15.085 1.00 47.03 C ATOM 1465 O HIS A 190 13.004 31.503 16.204 1.00 47.38 O ATOM 1466 CB HIS A 190 12.657 32.469 12.998 1.00 47.31 C ATOM 1467 CG HIS A 190 12.228 33.694 13.738 1.00 47.57 C ATOM 1468 ND1 HIS A 190 12.923 34.166 14.831 1.00 47.38 N ATOM 1469 CD2 HIS A 190 11.215 34.570 13.530 1.00 47.75 C ATOM 1470 CE1 HIS A 190 12.333 35.255 15.291 1.00 46.84 C ATOM 1471 NE2 HIS A 190 11.298 35.526 14.517 1.00 47.78 N ATOM 0 H HIS A 190 13.764 30.349 12.272 1.00 47.45 H new ATOM 0 HA HIS A 190 14.287 32.006 14.172 1.00 47.25 H new ATOM 0 HB2 HIS A 190 13.163 32.732 12.214 1.00 47.31 H new ATOM 0 HB3 HIS A 190 11.871 31.996 12.683 1.00 47.31 H new ATOM 0 HD2 HIS A 190 10.583 34.532 12.849 1.00 47.75 H new ATOM 0 HE1 HIS A 190 12.601 35.747 16.033 1.00 46.84 H new ATOM 0 HE2 HIS A 190 10.762 36.192 14.614 1.00 47.78 H new ATOM 1472 N GLU A 191 11.762 30.189 14.881 1.00 46.70 N ATOM 1473 CA GLU A 191 10.875 29.764 15.971 1.00 46.39 C ATOM 1474 C GLU A 191 11.625 28.932 17.013 1.00 45.80 C ATOM 1475 O GLU A 191 11.113 28.620 18.078 1.00 46.13 O ATOM 1476 CB GLU A 191 9.671 28.983 15.421 1.00 46.57 C ATOM 0 H GLU A 191 11.596 29.822 14.121 1.00 46.70 H new ATOM 0 HA GLU A 191 10.549 30.564 16.411 1.00 46.39 H new ATOM 1477 N GLU A 192 12.870 28.618 16.705 1.00 45.47 N ATOM 1478 CA GLU A 192 13.691 27.755 17.572 1.00 44.61 C ATOM 1479 C GLU A 192 14.573 28.509 18.583 1.00 42.04 C ATOM 1480 O GLU A 192 14.846 28.032 19.687 1.00 42.75 O ATOM 1481 CB GLU A 192 14.567 26.906 16.667 1.00 45.35 C ATOM 1482 CG GLU A 192 15.189 25.721 17.283 1.00 48.68 C ATOM 1483 CD GLU A 192 15.995 25.022 16.234 1.00 54.86 C ATOM 1484 OE1 GLU A 192 16.251 25.680 15.194 1.00 57.94 O ATOM 1485 OE2 GLU A 192 16.361 23.837 16.424 1.00 60.15 O ATOM 0 H GLU A 192 13.271 28.891 15.995 1.00 45.47 H new ATOM 0 HA GLU A 192 13.084 27.226 18.112 1.00 44.61 H new ATOM 0 HB2 GLU A 192 14.031 26.612 15.914 1.00 45.35 H new ATOM 0 HB3 GLU A 192 15.272 27.469 16.311 1.00 45.35 H new ATOM 0 HG2 GLU A 192 15.755 25.983 18.026 1.00 48.68 H new ATOM 0 HG3 GLU A 192 14.509 25.128 17.639 1.00 48.68 H new ATOM 1486 N TYR A 193 15.035 29.681 18.198 1.00 39.15 N ATOM 1487 CA TYR A 193 15.876 30.515 19.103 1.00 36.75 C ATOM 1488 C TYR A 193 15.238 31.875 19.285 1.00 34.67 C ATOM 1489 O TYR A 193 15.902 32.904 19.384 1.00 32.00 O ATOM 1490 CB TYR A 193 17.251 30.704 18.531 1.00 36.76 C ATOM 1491 CG TYR A 193 18.048 29.447 18.379 1.00 36.00 C ATOM 1492 CD1 TYR A 193 18.835 28.978 19.407 1.00 35.70 C ATOM 1493 CD2 TYR A 193 18.041 28.763 17.181 1.00 35.84 C ATOM 1494 CE1 TYR A 193 19.587 27.835 19.252 1.00 36.57 C ATOM 1495 CE2 TYR A 193 18.757 27.629 17.013 1.00 36.71 C ATOM 1496 CZ TYR A 193 19.539 27.165 18.041 1.00 38.02 C ATOM 1497 OH TYR A 193 20.278 26.028 17.834 1.00 38.26 O ATOM 0 H TYR A 193 14.886 30.029 17.426 1.00 39.15 H new ATOM 0 HA TYR A 193 15.945 30.058 19.956 1.00 36.75 H new ATOM 0 HB2 TYR A 193 17.170 31.127 17.662 1.00 36.76 H new ATOM 0 HB3 TYR A 193 17.743 31.316 19.100 1.00 36.76 H new ATOM 0 HD1 TYR A 193 18.859 29.438 20.215 1.00 35.70 H new ATOM 0 HD2 TYR A 193 17.533 29.089 16.474 1.00 35.84 H new ATOM 0 HE1 TYR A 193 20.117 27.519 19.948 1.00 36.57 H new ATOM 0 HE2 TYR A 193 18.720 27.167 16.207 1.00 36.71 H new ATOM 0 HH TYR A 193 20.141 25.742 17.056 1.00 38.26 H new ATOM 1498 N SER A 194 13.915 31.812 19.353 1.00 32.62 N ATOM 1499 CA SER A 194 13.043 32.986 19.338 1.00 31.35 C ATOM 1500 C SER A 194 13.313 34.026 20.440 1.00 29.50 C ATOM 1501 O SER A 194 13.198 35.232 20.203 1.00 28.22 O ATOM 1502 CB SER A 194 11.577 32.541 19.378 1.00 31.41 C ATOM 1503 OG SER A 194 11.312 31.838 20.594 1.00 33.40 O ATOM 0 H SER A 194 13.486 31.069 19.411 1.00 32.62 H new ATOM 0 HA SER A 194 13.247 33.446 18.509 1.00 31.35 H new ATOM 0 HB2 SER A 194 10.995 33.314 19.309 1.00 31.41 H new ATOM 0 HB3 SER A 194 11.383 31.971 18.617 1.00 31.41 H new ATOM 0 HG SER A 194 10.507 31.599 20.610 1.00 33.40 H new ATOM 1504 N ASN A 195 13.692 33.550 21.621 1.00 28.30 N ATOM 1505 CA ASN A 195 13.957 34.430 22.774 1.00 27.87 C ATOM 1506 C ASN A 195 15.328 35.086 22.717 1.00 26.88 C ATOM 1507 O ASN A 195 15.690 35.901 23.576 1.00 24.39 O ATOM 1508 CB ASN A 195 13.814 33.687 24.107 1.00 29.19 C ATOM 1509 CG ASN A 195 12.368 33.560 24.553 1.00 32.33 C ATOM 1510 OD1 ASN A 195 11.501 34.366 24.176 1.00 35.02 O ATOM 1511 ND2 ASN A 195 12.100 32.549 25.365 1.00 35.32 N ATOM 0 H ASN A 195 13.805 32.713 21.784 1.00 28.30 H new ATOM 0 HA ASN A 195 13.284 35.126 22.720 1.00 27.87 H new ATOM 0 HB2 ASN A 195 14.202 32.802 24.023 1.00 29.19 H new ATOM 0 HB3 ASN A 195 14.320 34.155 24.790 1.00 29.19 H new ATOM 0 HD21 ASN A 195 11.299 32.430 25.653 1.00 35.32 H new ATOM 0 HD22 ASN A 195 12.727 32.012 25.604 1.00 35.32 H new ATOM 1512 N ASN A 196 16.085 34.716 21.684 1.00 24.91 N ATOM 1513 CA ASN A 196 17.408 35.276 21.455 1.00 24.26 C ATOM 1514 C ASN A 196 17.553 35.888 20.076 1.00 23.03 C ATOM 1515 O ASN A 196 18.635 36.064 19.618 1.00 23.51 O ATOM 1516 CB ASN A 196 18.506 34.218 21.621 1.00 24.68 C ATOM 1517 CG ASN A 196 18.685 33.782 23.051 1.00 26.96 C ATOM 1518 OD1 ASN A 196 17.932 32.969 23.543 1.00 26.66 O ATOM 1519 ND2 ASN A 196 19.713 34.287 23.707 1.00 30.02 N ATOM 0 H ASN A 196 15.843 34.134 21.099 1.00 24.91 H new ATOM 0 HA ASN A 196 17.510 35.972 22.123 1.00 24.26 H new ATOM 0 HB2 ASN A 196 18.290 33.445 21.076 1.00 24.68 H new ATOM 0 HB3 ASN A 196 19.345 34.574 21.288 1.00 24.68 H new ATOM 0 HD21 ASN A 196 19.870 34.041 24.516 1.00 30.02 H new ATOM 0 HD22 ASN A 196 20.226 34.862 23.325 1.00 30.02 H new ATOM 1520 N LEU A 197 16.442 36.198 19.427 1.00 23.32 N ATOM 1521 CA LEU A 197 16.480 36.781 18.106 1.00 23.06 C ATOM 1522 C LEU A 197 15.730 38.106 18.015 1.00 23.20 C ATOM 1523 O LEU A 197 14.688 38.330 18.633 1.00 21.76 O ATOM 1524 CB LEU A 197 15.926 35.779 17.080 1.00 23.65 C ATOM 1525 CG LEU A 197 16.827 34.582 16.802 1.00 22.97 C ATOM 1526 CD1 LEU A 197 16.047 33.375 16.266 1.00 27.07 C ATOM 1527 CD2 LEU A 197 17.935 34.990 15.818 1.00 24.94 C ATOM 0 H LEU A 197 15.651 36.076 19.741 1.00 23.32 H new ATOM 0 HA LEU A 197 17.409 36.978 17.908 1.00 23.06 H new ATOM 0 HB2 LEU A 197 15.068 35.455 17.395 1.00 23.65 H new ATOM 0 HB3 LEU A 197 15.764 36.246 16.246 1.00 23.65 H new ATOM 0 HG LEU A 197 17.222 34.307 17.644 1.00 22.97 H new ATOM 0 HD11 LEU A 197 16.659 32.640 16.104 1.00 27.07 H new ATOM 0 HD12 LEU A 197 15.382 33.104 16.918 1.00 27.07 H new ATOM 0 HD13 LEU A 197 15.606 33.617 15.436 1.00 27.07 H new ATOM 0 HD21 LEU A 197 18.508 34.228 15.642 1.00 24.94 H new ATOM 0 HD22 LEU A 197 17.535 35.293 14.988 1.00 24.94 H new ATOM 0 HD23 LEU A 197 18.462 35.708 16.203 1.00 24.94 H new ATOM 1528 N ILE A 198 16.323 38.986 17.228 1.00 22.74 N ATOM 1529 CA ILE A 198 15.729 40.249 16.833 1.00 22.54 C ATOM 1530 C ILE A 198 15.638 40.109 15.322 1.00 23.46 C ATOM 1531 O ILE A 198 16.646 40.150 14.612 1.00 21.44 O ATOM 1532 CB ILE A 198 16.554 41.475 17.201 1.00 21.85 C ATOM 1533 CG1 ILE A 198 16.698 41.566 18.724 1.00 23.27 C ATOM 1534 CG2 ILE A 198 15.911 42.737 16.657 1.00 21.91 C ATOM 1535 CD1 ILE A 198 17.572 42.703 19.167 1.00 20.65 C ATOM 0 H ILE A 198 17.107 38.861 16.898 1.00 22.74 H new ATOM 0 HA ILE A 198 14.885 40.398 17.287 1.00 22.54 H new ATOM 0 HB ILE A 198 17.434 41.388 16.803 1.00 21.85 H new ATOM 0 HG12 ILE A 198 15.819 41.668 19.121 1.00 23.27 H new ATOM 0 HG13 ILE A 198 17.066 40.733 19.059 1.00 23.27 H new ATOM 0 HG21 ILE A 198 16.450 43.506 16.901 1.00 21.91 H new ATOM 0 HG22 ILE A 198 15.850 42.679 15.691 1.00 21.91 H new ATOM 0 HG23 ILE A 198 15.021 42.834 17.031 1.00 21.91 H new ATOM 0 HD11 ILE A 198 17.626 42.711 20.135 1.00 20.65 H new ATOM 0 HD12 ILE A 198 18.461 42.592 18.795 1.00 20.65 H new ATOM 0 HD13 ILE A 198 17.194 43.541 18.858 1.00 20.65 H new ATOM 1536 N VAL A 199 14.423 39.829 14.860 1.00 24.56 N ATOM 1537 CA VAL A 199 14.163 39.606 13.439 1.00 25.30 C ATOM 1538 C VAL A 199 13.005 40.454 13.003 1.00 26.92 C ATOM 1539 O VAL A 199 11.911 40.411 13.578 1.00 27.85 O ATOM 1540 CB VAL A 199 13.849 38.142 13.105 1.00 25.51 C ATOM 1541 CG1 VAL A 199 13.517 38.002 11.596 1.00 23.96 C ATOM 1542 CG2 VAL A 199 15.023 37.253 13.477 1.00 24.32 C ATOM 0 H VAL A 199 13.726 39.763 15.360 1.00 24.56 H new ATOM 0 HA VAL A 199 14.976 39.847 12.967 1.00 25.30 H new ATOM 0 HB VAL A 199 13.077 37.860 13.621 1.00 25.51 H new ATOM 0 HG11 VAL A 199 13.320 37.074 11.393 1.00 23.96 H new ATOM 0 HG12 VAL A 199 12.746 38.551 11.382 1.00 23.96 H new ATOM 0 HG13 VAL A 199 14.277 38.294 11.069 1.00 23.96 H new ATOM 0 HG21 VAL A 199 14.812 36.331 13.261 1.00 24.32 H new ATOM 0 HG22 VAL A 199 15.809 37.529 12.980 1.00 24.32 H new ATOM 0 HG23 VAL A 199 15.199 37.330 14.428 1.00 24.32 H new ATOM 1543 N ASP A 200 13.266 41.244 11.975 1.00 27.91 N ATOM 1544 CA ASP A 200 12.268 42.170 11.473 1.00 28.63 C ATOM 1545 C ASP A 200 12.755 42.806 10.177 1.00 28.03 C ATOM 1546 O ASP A 200 13.648 43.662 10.164 1.00 28.92 O ATOM 1547 CB ASP A 200 12.046 43.240 12.527 1.00 29.03 C ATOM 1548 CG ASP A 200 10.821 44.055 12.286 1.00 30.36 C ATOM 1549 OD1 ASP A 200 10.022 43.713 11.400 1.00 35.11 O ATOM 1550 OD2 ASP A 200 10.652 45.033 13.022 1.00 33.72 O ATOM 0 H ASP A 200 14.016 41.259 11.554 1.00 27.91 H new ATOM 0 HA ASP A 200 11.438 41.703 11.290 1.00 28.63 H new ATOM 0 HB2 ASP A 200 11.981 42.819 13.398 1.00 29.03 H new ATOM 0 HB3 ASP A 200 12.818 43.827 12.552 1.00 29.03 H new ATOM 1551 N GLY A 201 12.148 42.378 9.089 1.00 27.37 N ATOM 1552 CA GLY A 201 12.517 42.873 7.763 1.00 26.95 C ATOM 1553 C GLY A 201 13.867 42.352 7.351 1.00 26.17 C ATOM 1554 O GLY A 201 14.023 41.148 7.104 1.00 26.85 O ATOM 0 H GLY A 201 11.514 41.797 9.089 1.00 27.37 H new ATOM 0 HA2 GLY A 201 11.849 42.600 7.115 1.00 26.95 H new ATOM 0 HA3 GLY A 201 12.528 43.843 7.767 1.00 26.95 H new ATOM 1555 N SER A 202 14.849 43.260 7.274 1.00 24.90 N ATOM 1556 CA SER A 202 16.238 42.880 6.934 1.00 23.93 C ATOM 1557 C SER A 202 17.117 42.708 8.148 1.00 23.24 C ATOM 1558 O SER A 202 18.268 42.300 8.035 1.00 21.90 O ATOM 1559 CB SER A 202 16.912 43.873 5.987 1.00 24.23 C ATOM 1560 OG SER A 202 16.426 43.734 4.675 1.00 25.86 O ATOM 0 H SER A 202 14.736 44.101 7.414 1.00 24.90 H new ATOM 0 HA SER A 202 16.146 42.025 6.486 1.00 23.93 H new ATOM 0 HB2 SER A 202 16.755 44.778 6.298 1.00 24.23 H new ATOM 0 HB3 SER A 202 17.872 43.732 5.996 1.00 24.23 H new ATOM 0 HG SER A 202 16.809 44.289 4.174 1.00 25.86 H new ATOM 1561 N THR A 203 16.564 43.030 9.308 1.00 23.12 N ATOM 1562 CA THR A 203 17.282 42.826 10.576 1.00 22.71 C ATOM 1563 C THR A 203 17.192 41.355 11.021 1.00 21.96 C ATOM 1564 O THR A 203 16.150 40.746 11.080 1.00 19.96 O ATOM 1565 CB THR A 203 16.779 43.715 11.721 1.00 23.07 C ATOM 1566 OG1 THR A 203 16.741 45.089 11.303 1.00 24.79 O ATOM 1567 CG2 THR A 203 17.720 43.600 12.877 1.00 23.26 C ATOM 0 H THR A 203 15.777 43.367 9.392 1.00 23.12 H new ATOM 0 HA THR A 203 18.201 43.076 10.394 1.00 22.71 H new ATOM 0 HB THR A 203 15.888 43.428 11.974 1.00 23.07 H new ATOM 0 HG1 THR A 203 17.454 45.471 11.529 1.00 24.79 H new ATOM 0 HG21 THR A 203 17.408 44.160 13.605 1.00 23.26 H new ATOM 0 HG22 THR A 203 17.758 42.677 13.173 1.00 23.26 H new ATOM 0 HG23 THR A 203 18.605 43.889 12.604 1.00 23.26 H new ATOM 1568 N PHE A 204 18.348 40.777 11.274 1.00 21.78 N ATOM 1569 CA PHE A 204 18.408 39.414 11.748 1.00 22.36 C ATOM 1570 C PHE A 204 19.624 39.313 12.650 1.00 22.27 C ATOM 1571 O PHE A 204 20.742 39.164 12.185 1.00 22.89 O ATOM 1572 CB PHE A 204 18.476 38.446 10.577 1.00 22.91 C ATOM 1573 CG PHE A 204 18.246 37.010 10.955 1.00 25.09 C ATOM 1574 CD1 PHE A 204 17.267 36.262 10.345 1.00 28.77 C ATOM 1575 CD2 PHE A 204 18.973 36.435 11.968 1.00 26.32 C ATOM 1576 CE1 PHE A 204 17.058 34.935 10.714 1.00 31.90 C ATOM 1577 CE2 PHE A 204 18.777 35.133 12.341 1.00 26.67 C ATOM 1578 CZ PHE A 204 17.828 34.370 11.714 1.00 29.40 C ATOM 0 H PHE A 204 19.113 41.159 11.177 1.00 21.78 H new ATOM 0 HA PHE A 204 17.611 39.176 12.247 1.00 22.36 H new ATOM 0 HB2 PHE A 204 17.816 38.706 9.916 1.00 22.91 H new ATOM 0 HB3 PHE A 204 19.346 38.524 10.155 1.00 22.91 H new ATOM 0 HD1 PHE A 204 16.740 36.645 9.681 1.00 28.77 H new ATOM 0 HD2 PHE A 204 19.614 36.943 12.411 1.00 26.32 H new ATOM 0 HE1 PHE A 204 16.402 34.431 10.289 1.00 31.90 H new ATOM 0 HE2 PHE A 204 19.290 34.765 13.023 1.00 26.67 H new ATOM 0 HZ PHE A 204 17.703 33.481 11.958 1.00 29.40 H new ATOM 1579 N VAL A 205 19.369 39.472 13.950 1.00 21.65 N ATOM 1580 CA VAL A 205 20.385 39.486 14.986 1.00 20.57 C ATOM 1581 C VAL A 205 20.154 38.431 16.079 1.00 20.66 C ATOM 1582 O VAL A 205 19.079 38.283 16.656 1.00 21.28 O ATOM 1583 CB VAL A 205 20.466 40.900 15.694 1.00 20.36 C ATOM 1584 CG1 VAL A 205 21.549 40.956 16.765 1.00 16.12 C ATOM 1585 CG2 VAL A 205 20.692 41.988 14.674 1.00 16.42 C ATOM 0 H VAL A 205 18.572 39.578 14.256 1.00 21.65 H new ATOM 0 HA VAL A 205 21.214 39.282 14.525 1.00 20.57 H new ATOM 0 HB VAL A 205 19.615 41.042 16.137 1.00 20.36 H new ATOM 0 HG11 VAL A 205 21.560 41.838 17.168 1.00 16.12 H new ATOM 0 HG12 VAL A 205 21.365 40.291 17.447 1.00 16.12 H new ATOM 0 HG13 VAL A 205 22.412 40.774 16.362 1.00 16.12 H new ATOM 0 HG21 VAL A 205 20.739 42.847 15.122 1.00 16.42 H new ATOM 0 HG22 VAL A 205 21.524 41.823 14.203 1.00 16.42 H new ATOM 0 HG23 VAL A 205 19.958 41.995 14.040 1.00 16.42 H new ATOM 1586 N TYR A 206 21.195 37.686 16.316 1.00 20.17 N ATOM 1587 CA TYR A 206 21.201 36.731 17.411 1.00 20.94 C ATOM 1588 C TYR A 206 21.989 37.350 18.578 1.00 20.58 C ATOM 1589 O TYR A 206 23.087 37.850 18.394 1.00 21.46 O ATOM 1590 CB TYR A 206 21.834 35.405 16.978 1.00 20.84 C ATOM 1591 CG TYR A 206 21.921 34.466 18.145 1.00 23.23 C ATOM 1592 CD1 TYR A 206 20.855 33.668 18.511 1.00 25.35 C ATOM 1593 CD2 TYR A 206 23.056 34.454 18.945 1.00 26.67 C ATOM 1594 CE1 TYR A 206 20.944 32.827 19.621 1.00 24.85 C ATOM 1595 CE2 TYR A 206 23.141 33.653 20.050 1.00 25.29 C ATOM 1596 CZ TYR A 206 22.105 32.858 20.394 1.00 26.68 C ATOM 1597 OH TYR A 206 22.276 32.083 21.527 1.00 29.36 O ATOM 0 H TYR A 206 21.921 37.710 15.856 1.00 20.17 H new ATOM 0 HA TYR A 206 20.291 36.539 17.685 1.00 20.94 H new ATOM 0 HB2 TYR A 206 21.307 35.003 16.270 1.00 20.84 H new ATOM 0 HB3 TYR A 206 22.720 35.565 16.616 1.00 20.84 H new ATOM 0 HD1 TYR A 206 20.070 33.691 18.013 1.00 25.35 H new ATOM 0 HD2 TYR A 206 23.774 35.003 18.724 1.00 26.67 H new ATOM 0 HE1 TYR A 206 20.243 32.257 19.841 1.00 24.85 H new ATOM 0 HE2 TYR A 206 23.915 33.656 20.566 1.00 25.29 H new ATOM 0 HH TYR A 206 21.693 31.478 21.544 1.00 29.36 H new ATOM 1598 N PHE A 207 21.396 37.343 19.763 1.00 21.09 N ATOM 1599 CA PHE A 207 22.046 37.867 20.950 1.00 20.70 C ATOM 1600 C PHE A 207 22.121 36.860 22.107 1.00 21.52 C ATOM 1601 O PHE A 207 21.297 35.968 22.238 1.00 18.91 O ATOM 1602 CB PHE A 207 21.421 39.203 21.431 1.00 21.99 C ATOM 1603 CG PHE A 207 20.040 39.079 21.941 1.00 21.97 C ATOM 1604 CD1 PHE A 207 19.795 38.776 23.282 1.00 21.69 C ATOM 1605 CD2 PHE A 207 18.969 39.310 21.106 1.00 22.05 C ATOM 1606 CE1 PHE A 207 18.504 38.629 23.739 1.00 19.01 C ATOM 1607 CE2 PHE A 207 17.702 39.160 21.565 1.00 18.78 C ATOM 1608 CZ PHE A 207 17.466 38.847 22.901 1.00 20.92 C ATOM 0 H PHE A 207 20.605 37.034 19.900 1.00 21.09 H new ATOM 0 HA PHE A 207 22.958 38.044 20.671 1.00 20.70 H new ATOM 0 HB2 PHE A 207 21.980 39.577 22.130 1.00 21.99 H new ATOM 0 HB3 PHE A 207 21.427 39.834 20.695 1.00 21.99 H new ATOM 0 HD1 PHE A 207 20.508 38.673 23.870 1.00 21.69 H new ATOM 0 HD2 PHE A 207 19.115 39.570 20.225 1.00 22.05 H new ATOM 0 HE1 PHE A 207 18.347 38.381 24.621 1.00 19.01 H new ATOM 0 HE2 PHE A 207 16.985 39.267 20.983 1.00 18.78 H new ATOM 0 HZ PHE A 207 16.593 38.788 23.217 1.00 20.92 H new ATOM 1609 N ASP A 208 23.171 37.039 22.910 1.00 21.33 N ATOM 1610 CA ASP A 208 23.454 36.203 24.067 1.00 23.38 C ATOM 1611 C ASP A 208 23.976 37.090 25.190 1.00 22.26 C ATOM 1612 O ASP A 208 25.076 37.618 25.141 1.00 22.72 O ATOM 1613 CB ASP A 208 24.480 35.103 23.703 1.00 24.16 C ATOM 1614 CG ASP A 208 24.714 34.112 24.839 1.00 26.83 C ATOM 1615 OD1 ASP A 208 23.977 34.153 25.814 1.00 30.96 O ATOM 1616 OD2 ASP A 208 25.657 33.296 24.750 1.00 28.84 O ATOM 0 H ASP A 208 23.749 37.665 22.791 1.00 21.33 H new ATOM 0 HA ASP A 208 22.644 35.757 24.360 1.00 23.38 H new ATOM 0 HB2 ASP A 208 24.169 34.623 22.920 1.00 24.16 H new ATOM 0 HB3 ASP A 208 25.323 35.519 23.464 1.00 24.16 H new ATOM 1617 N ILE A 209 23.089 37.315 26.146 1.00 22.38 N ATOM 1618 CA ILE A 209 23.364 38.105 27.334 1.00 21.57 C ATOM 1619 C ILE A 209 24.017 37.165 28.334 1.00 22.36 C ATOM 1620 O ILE A 209 23.512 36.057 28.595 1.00 22.88 O ATOM 1621 CB ILE A 209 22.074 38.589 27.972 1.00 21.18 C ATOM 1622 CG1 ILE A 209 21.326 39.513 27.008 1.00 17.72 C ATOM 1623 CG2 ILE A 209 22.347 39.212 29.358 1.00 21.70 C ATOM 1624 CD1 ILE A 209 20.009 39.970 27.567 1.00 15.90 C ATOM 0 H ILE A 209 22.288 37.004 26.121 1.00 22.38 H new ATOM 0 HA ILE A 209 23.915 38.868 27.098 1.00 21.57 H new ATOM 0 HB ILE A 209 21.486 37.836 28.139 1.00 21.18 H new ATOM 0 HG12 ILE A 209 21.877 40.286 26.810 1.00 17.72 H new ATOM 0 HG13 ILE A 209 21.176 39.050 26.169 1.00 17.72 H new ATOM 0 HG21 ILE A 209 21.512 39.514 29.747 1.00 21.70 H new ATOM 0 HG22 ILE A 209 22.752 38.548 29.937 1.00 21.70 H new ATOM 0 HG23 ILE A 209 22.949 39.966 29.261 1.00 21.70 H new ATOM 0 HD11 ILE A 209 19.570 40.551 26.927 1.00 15.90 H new ATOM 0 HD12 ILE A 209 19.447 39.199 27.742 1.00 15.90 H new ATOM 0 HD13 ILE A 209 20.159 40.455 28.394 1.00 15.90 H new ATOM 1625 N TYR A 210 25.132 37.599 28.908 1.00 21.95 N ATOM 1626 CA TYR A 210 25.831 36.738 29.866 1.00 22.08 C ATOM 1627 C TYR A 210 26.273 37.572 31.041 1.00 21.42 C ATOM 1628 O TYR A 210 25.987 38.767 31.075 1.00 20.93 O ATOM 1629 CB TYR A 210 27.006 35.996 29.203 1.00 22.70 C ATOM 1630 CG TYR A 210 28.071 36.902 28.586 1.00 22.78 C ATOM 1631 CD1 TYR A 210 29.151 37.341 29.342 1.00 25.34 C ATOM 1632 CD2 TYR A 210 28.002 37.298 27.271 1.00 22.37 C ATOM 1633 CE1 TYR A 210 30.103 38.162 28.817 1.00 23.07 C ATOM 1634 CE2 TYR A 210 28.953 38.156 26.730 1.00 19.93 C ATOM 1635 CZ TYR A 210 30.012 38.557 27.506 1.00 22.72 C ATOM 1636 OH TYR A 210 30.981 39.392 27.008 1.00 23.81 O ATOM 0 H TYR A 210 25.496 38.365 28.765 1.00 21.95 H new ATOM 0 HA TYR A 210 25.226 36.050 30.184 1.00 22.08 H new ATOM 0 HB2 TYR A 210 27.428 35.427 29.866 1.00 22.70 H new ATOM 0 HB3 TYR A 210 26.655 35.413 28.511 1.00 22.70 H new ATOM 0 HD1 TYR A 210 29.226 37.068 30.228 1.00 25.34 H new ATOM 0 HD2 TYR A 210 27.308 36.987 26.735 1.00 22.37 H new ATOM 0 HE1 TYR A 210 30.811 38.453 29.345 1.00 23.07 H new ATOM 0 HE2 TYR A 210 28.873 38.455 25.853 1.00 19.93 H new ATOM 0 HH TYR A 210 31.024 39.305 26.174 1.00 23.81 H new ATOM 1637 N GLU A 211 26.922 36.928 32.005 1.00 21.04 N ATOM 1638 CA GLU A 211 27.390 37.619 33.194 1.00 21.40 C ATOM 1639 C GLU A 211 28.574 38.486 32.865 1.00 20.91 C ATOM 1640 O GLU A 211 29.672 37.992 32.669 1.00 23.14 O ATOM 1641 CB GLU A 211 27.769 36.638 34.327 1.00 21.23 C ATOM 1642 CG GLU A 211 26.664 35.766 34.788 1.00 21.06 C ATOM 1643 CD GLU A 211 25.618 36.488 35.593 1.00 18.51 C ATOM 1644 OE1 GLU A 211 25.926 37.521 36.207 1.00 17.83 O ATOM 1645 OE2 GLU A 211 24.483 36.002 35.638 1.00 21.78 O ATOM 0 H GLU A 211 27.101 36.087 31.987 1.00 21.04 H new ATOM 0 HA GLU A 211 26.656 38.170 33.508 1.00 21.40 H new ATOM 0 HB2 GLU A 211 28.500 36.078 34.022 1.00 21.23 H new ATOM 0 HB3 GLU A 211 28.099 37.148 35.083 1.00 21.23 H new ATOM 0 HG2 GLU A 211 26.242 35.358 34.016 1.00 21.06 H new ATOM 0 HG3 GLU A 211 27.033 35.046 35.324 1.00 21.06 H new ATOM 1646 N GLY A 212 28.370 39.793 32.775 1.00 20.84 N ATOM 1647 CA GLY A 212 29.481 40.675 32.434 1.00 21.13 C ATOM 1648 C GLY A 212 29.403 41.315 31.034 1.00 20.97 C ATOM 1649 O GLY A 212 30.120 42.262 30.708 1.00 21.54 O ATOM 0 H GLY A 212 27.615 40.184 32.904 1.00 20.84 H new ATOM 0 HA2 GLY A 212 29.528 41.383 33.096 1.00 21.13 H new ATOM 0 HA3 GLY A 212 30.307 40.171 32.498 1.00 21.13 H new ATOM 1650 N GLY A 213 28.478 40.858 30.234 1.00 20.73 N ATOM 1651 CA GLY A 213 28.326 41.436 28.890 1.00 20.49 C ATOM 1652 C GLY A 213 27.286 40.803 28.011 1.00 20.67 C ATOM 1653 O GLY A 213 26.428 40.065 28.476 1.00 20.83 O ATOM 0 H GLY A 213 27.928 40.226 30.427 1.00 20.73 H new ATOM 0 HA2 GLY A 213 28.113 42.378 28.985 1.00 20.49 H new ATOM 0 HA3 GLY A 213 29.182 41.383 28.437 1.00 20.49 H new ATOM 1654 N ILE A 214 27.393 41.119 26.712 1.00 20.59 N ATOM 1655 CA ILE A 214 26.446 40.665 25.700 1.00 20.01 C ATOM 1656 C ILE A 214 27.142 40.564 24.379 1.00 20.68 C ATOM 1657 O ILE A 214 27.947 41.421 24.012 1.00 19.99 O ATOM 1658 CB ILE A 214 25.231 41.642 25.506 1.00 20.05 C ATOM 1659 CG1 ILE A 214 24.575 42.003 26.837 1.00 20.29 C ATOM 1660 CG2 ILE A 214 24.175 41.059 24.551 1.00 17.30 C ATOM 1661 CD1 ILE A 214 23.644 43.220 26.759 1.00 20.63 C ATOM 0 H ILE A 214 28.026 41.608 26.398 1.00 20.59 H new ATOM 0 HA ILE A 214 26.109 39.809 26.009 1.00 20.01 H new ATOM 0 HB ILE A 214 25.593 42.450 25.110 1.00 20.05 H new ATOM 0 HG12 ILE A 214 24.069 41.239 27.156 1.00 20.29 H new ATOM 0 HG13 ILE A 214 25.268 42.178 27.493 1.00 20.29 H new ATOM 0 HG21 ILE A 214 23.442 41.688 24.456 1.00 17.30 H new ATOM 0 HG22 ILE A 214 24.577 40.898 23.683 1.00 17.30 H new ATOM 0 HG23 ILE A 214 23.839 40.223 24.911 1.00 17.30 H new ATOM 0 HD11 ILE A 214 23.263 43.393 27.634 1.00 20.63 H new ATOM 0 HD12 ILE A 214 24.149 43.995 26.467 1.00 20.63 H new ATOM 0 HD13 ILE A 214 22.931 43.042 26.126 1.00 20.63 H new ATOM 1662 N ASP A 215 26.903 39.440 23.713 1.00 21.53 N ATOM 1663 CA ASP A 215 27.378 39.231 22.368 1.00 21.03 C ATOM 1664 C ASP A 215 26.180 39.328 21.418 1.00 21.18 C ATOM 1665 O ASP A 215 25.108 38.805 21.721 1.00 21.93 O ATOM 1666 CB ASP A 215 27.998 37.812 22.203 1.00 21.60 C ATOM 1667 CG ASP A 215 29.270 37.576 23.040 1.00 22.23 C ATOM 1668 OD1 ASP A 215 30.102 38.480 23.212 1.00 23.05 O ATOM 1669 OD2 ASP A 215 29.456 36.442 23.514 1.00 25.48 O ATOM 0 H ASP A 215 26.458 38.779 24.036 1.00 21.53 H new ATOM 0 HA ASP A 215 28.055 39.898 22.172 1.00 21.03 H new ATOM 0 HB2 ASP A 215 27.334 37.149 22.449 1.00 21.60 H new ATOM 0 HB3 ASP A 215 28.208 37.669 21.267 1.00 21.60 H new ATOM 1670 N LEU A 216 26.384 40.022 20.296 1.00 20.13 N ATOM 1671 CA LEU A 216 25.410 40.167 19.236 1.00 20.68 C ATOM 1672 C LEU A 216 26.012 39.785 17.918 1.00 20.14 C ATOM 1673 O LEU A 216 27.057 40.288 17.536 1.00 22.52 O ATOM 1674 CB LEU A 216 24.824 41.615 19.170 1.00 21.45 C ATOM 1675 CG LEU A 216 24.261 42.100 20.535 1.00 20.78 C ATOM 1676 CD1 LEU A 216 25.291 42.892 21.342 1.00 21.76 C ATOM 1677 CD2 LEU A 216 22.989 42.943 20.327 1.00 20.06 C ATOM 0 H LEU A 216 27.122 40.432 20.134 1.00 20.13 H new ATOM 0 HA LEU A 216 24.674 39.567 19.435 1.00 20.68 H new ATOM 0 HB2 LEU A 216 25.517 42.227 18.875 1.00 21.45 H new ATOM 0 HB3 LEU A 216 24.118 41.644 18.505 1.00 21.45 H new ATOM 0 HG LEU A 216 24.040 41.306 21.047 1.00 20.78 H new ATOM 0 HD11 LEU A 216 24.897 43.173 22.183 1.00 21.76 H new ATOM 0 HD12 LEU A 216 26.064 42.333 21.519 1.00 21.76 H new ATOM 0 HD13 LEU A 216 25.567 43.673 20.837 1.00 21.76 H new ATOM 0 HD21 LEU A 216 22.651 43.237 21.187 1.00 20.06 H new ATOM 0 HD22 LEU A 216 23.199 43.717 19.781 1.00 20.06 H new ATOM 0 HD23 LEU A 216 22.314 42.407 19.882 1.00 20.06 H new ATOM 1678 N PHE A 217 25.359 38.862 17.238 1.00 20.12 N ATOM 1679 CA PHE A 217 25.750 38.436 15.913 1.00 20.13 C ATOM 1680 C PHE A 217 24.822 39.047 14.869 1.00 20.15 C ATOM 1681 O PHE A 217 23.654 38.674 14.724 1.00 21.28 O ATOM 1682 CB PHE A 217 25.701 36.928 15.792 1.00 20.60 C ATOM 1683 CG PHE A 217 26.789 36.244 16.477 1.00 22.39 C ATOM 1684 CD1 PHE A 217 26.822 36.162 17.860 1.00 24.60 C ATOM 1685 CD2 PHE A 217 27.846 35.714 15.747 1.00 26.85 C ATOM 1686 CE1 PHE A 217 27.856 35.517 18.495 1.00 22.97 C ATOM 1687 CE2 PHE A 217 28.897 35.038 16.390 1.00 25.27 C ATOM 1688 CZ PHE A 217 28.910 34.963 17.747 1.00 22.34 C ATOM 0 H PHE A 217 24.663 38.458 17.540 1.00 20.12 H new ATOM 0 HA PHE A 217 26.660 38.736 15.761 1.00 20.13 H new ATOM 0 HB2 PHE A 217 24.856 36.611 16.149 1.00 20.60 H new ATOM 0 HB3 PHE A 217 25.720 36.687 14.853 1.00 20.60 H new ATOM 0 HD1 PHE A 217 26.140 36.546 18.362 1.00 24.60 H new ATOM 0 HD2 PHE A 217 27.858 35.808 14.822 1.00 26.85 H new ATOM 0 HE1 PHE A 217 27.859 35.447 19.422 1.00 22.97 H new ATOM 0 HE2 PHE A 217 29.577 34.646 15.892 1.00 25.27 H new ATOM 0 HZ PHE A 217 29.618 34.544 18.182 1.00 22.34 H new ATOM 1689 N VAL A 218 25.360 39.981 14.113 1.00 20.25 N ATOM 1690 CA VAL A 218 24.558 40.703 13.131 1.00 20.13 C ATOM 1691 C VAL A 218 24.668 39.992 11.816 1.00 20.35 C ATOM 1692 O VAL A 218 25.631 40.148 11.074 1.00 20.59 O ATOM 1693 CB VAL A 218 24.983 42.144 13.014 1.00 19.87 C ATOM 1694 CG1 VAL A 218 24.017 42.948 12.077 1.00 18.33 C ATOM 1695 CG2 VAL A 218 25.001 42.739 14.399 1.00 17.91 C ATOM 0 H VAL A 218 26.186 40.217 14.147 1.00 20.25 H new ATOM 0 HA VAL A 218 23.632 40.716 13.419 1.00 20.13 H new ATOM 0 HB VAL A 218 25.867 42.193 12.617 1.00 19.87 H new ATOM 0 HG11 VAL A 218 24.314 43.870 12.020 1.00 18.33 H new ATOM 0 HG12 VAL A 218 24.021 42.552 11.191 1.00 18.33 H new ATOM 0 HG13 VAL A 218 23.117 42.920 12.439 1.00 18.33 H new ATOM 0 HG21 VAL A 218 25.273 43.669 14.348 1.00 17.91 H new ATOM 0 HG22 VAL A 218 24.114 42.682 14.787 1.00 17.91 H new ATOM 0 HG23 VAL A 218 25.628 42.249 14.954 1.00 17.91 H new ATOM 1696 N ASN A 219 23.640 39.202 11.559 1.00 20.98 N ATOM 1697 CA ASN A 219 23.515 38.386 10.337 1.00 21.06 C ATOM 1698 C ASN A 219 22.971 39.142 9.129 1.00 21.58 C ATOM 1699 O ASN A 219 23.198 38.763 7.981 1.00 22.04 O ATOM 1700 CB ASN A 219 22.631 37.179 10.624 1.00 20.25 C ATOM 1701 CG ASN A 219 23.314 36.158 11.545 1.00 21.36 C ATOM 1702 OD1 ASN A 219 24.385 35.665 11.217 1.00 23.81 O ATOM 1703 ND2 ASN A 219 22.704 35.861 12.694 1.00 21.52 N ATOM 0 H ASN A 219 22.974 39.115 12.096 1.00 20.98 H new ATOM 0 HA ASN A 219 24.415 38.115 10.099 1.00 21.06 H new ATOM 0 HB2 ASN A 219 21.804 37.477 11.033 1.00 20.25 H new ATOM 0 HB3 ASN A 219 22.394 36.749 9.788 1.00 20.25 H new ATOM 0 HD21 ASN A 219 23.063 35.302 13.240 1.00 21.52 H new ATOM 0 HD22 ASN A 219 21.951 36.229 12.889 1.00 21.52 H new ATOM 1704 N ASP A 220 22.208 40.182 9.425 1.00 21.83 N ATOM 1705 CA ASP A 220 21.601 41.056 8.425 1.00 23.03 C ATOM 1706 C ASP A 220 21.050 42.318 9.073 1.00 23.48 C ATOM 1707 O ASP A 220 20.639 42.345 10.238 1.00 21.67 O ATOM 1708 CB ASP A 220 20.487 40.358 7.615 1.00 22.99 C ATOM 1709 CG ASP A 220 20.241 41.040 6.236 1.00 24.37 C ATOM 1710 OD1 ASP A 220 20.848 42.127 5.972 1.00 18.83 O ATOM 1711 OD2 ASP A 220 19.491 40.446 5.425 1.00 23.06 O ATOM 0 H ASP A 220 22.022 40.408 10.234 1.00 21.83 H new ATOM 0 HA ASP A 220 22.308 41.290 7.804 1.00 23.03 H new ATOM 0 HB2 ASP A 220 20.726 39.428 7.475 1.00 22.99 H new ATOM 0 HB3 ASP A 220 19.664 40.365 8.128 1.00 22.99 H new ATOM 1712 N SER A 221 21.104 43.383 8.300 1.00 24.72 N ATOM 1713 CA SER A 221 20.557 44.670 8.736 1.00 26.34 C ATOM 1714 C SER A 221 20.489 45.638 7.570 1.00 27.86 C ATOM 1715 O SER A 221 21.373 45.617 6.730 1.00 29.26 O ATOM 1716 CB SER A 221 21.402 45.300 9.846 1.00 25.64 C ATOM 1717 OG SER A 221 20.869 46.585 10.132 1.00 25.52 O ATOM 0 H SER A 221 21.453 43.391 7.514 1.00 24.72 H new ATOM 0 HA SER A 221 19.667 44.497 9.081 1.00 26.34 H new ATOM 0 HB2 SER A 221 21.387 44.743 10.640 1.00 25.64 H new ATOM 0 HB3 SER A 221 22.328 45.372 9.567 1.00 25.64 H new ATOM 0 HG SER A 221 20.142 46.502 10.544 1.00 25.52 H new ATOM 1718 N ASP A 222 19.457 46.471 7.512 1.00 28.70 N ATOM 1719 CA ASP A 222 19.407 47.468 6.452 1.00 30.04 C ATOM 1720 C ASP A 222 20.262 48.638 6.849 1.00 30.85 C ATOM 1721 O ASP A 222 20.616 49.438 6.012 1.00 32.32 O ATOM 1722 CB ASP A 222 17.974 47.934 6.133 1.00 30.56 C ATOM 0 H ASP A 222 18.794 46.477 8.059 1.00 28.70 H new ATOM 0 HA ASP A 222 19.745 47.058 5.640 1.00 30.04 H new ATOM 1723 N ASP A 223 20.611 48.715 8.132 1.00 30.97 N ATOM 1724 CA ASP A 223 21.482 49.796 8.645 1.00 30.38 C ATOM 1725 C ASP A 223 22.260 49.374 9.888 1.00 30.07 C ATOM 1726 O ASP A 223 21.895 49.705 11.023 1.00 29.30 O ATOM 1727 CB ASP A 223 20.658 51.058 8.929 1.00 30.78 C ATOM 1728 CG ASP A 223 21.494 52.206 9.435 1.00 30.15 C ATOM 1729 OD1 ASP A 223 22.736 52.111 9.425 1.00 30.63 O ATOM 1730 OD2 ASP A 223 20.888 53.196 9.869 1.00 27.80 O ATOM 0 H ASP A 223 20.357 48.152 8.731 1.00 30.97 H new ATOM 0 HA ASP A 223 22.134 49.991 7.954 1.00 30.38 H new ATOM 0 HB2 ASP A 223 20.202 51.330 8.117 1.00 30.78 H new ATOM 0 HB3 ASP A 223 19.973 50.850 9.583 1.00 30.78 H new ATOM 1731 N ALA A 224 23.351 48.657 9.650 1.00 29.86 N ATOM 1732 CA ALA A 224 24.151 48.105 10.769 1.00 30.18 C ATOM 1733 C ALA A 224 24.763 49.202 11.629 1.00 30.49 C ATOM 1734 O ALA A 224 24.831 49.071 12.844 1.00 30.08 O ATOM 1735 CB ALA A 224 25.245 47.116 10.278 1.00 29.66 C ATOM 0 H ALA A 224 23.652 48.474 8.865 1.00 29.86 H new ATOM 0 HA ALA A 224 23.531 47.605 11.323 1.00 30.18 H new ATOM 0 HB1 ALA A 224 25.743 46.780 11.040 1.00 29.66 H new ATOM 0 HB2 ALA A 224 24.826 46.375 9.813 1.00 29.66 H new ATOM 0 HB3 ALA A 224 25.849 47.575 9.674 1.00 29.66 H new ATOM 1736 N SER A 225 25.192 50.296 11.008 1.00 30.91 N ATOM 1737 CA SER A 225 25.756 51.417 11.813 1.00 30.71 C ATOM 1738 C SER A 225 24.793 51.862 12.910 1.00 29.81 C ATOM 1739 O SER A 225 25.173 52.048 14.058 1.00 28.60 O ATOM 1740 CB SER A 225 26.088 52.633 10.951 1.00 30.51 C ATOM 1741 OG SER A 225 27.132 52.322 10.057 1.00 32.24 O ATOM 0 H SER A 225 25.174 50.422 10.158 1.00 30.91 H new ATOM 0 HA SER A 225 26.571 51.071 12.210 1.00 30.71 H new ATOM 0 HB2 SER A 225 25.302 52.912 10.457 1.00 30.51 H new ATOM 0 HB3 SER A 225 26.347 53.378 11.516 1.00 30.51 H new ATOM 0 HG SER A 225 26.827 51.877 9.413 1.00 32.24 H new ATOM 1742 N SER A 226 23.527 52.026 12.543 1.00 29.67 N ATOM 1743 CA SER A 226 22.524 52.519 13.518 1.00 29.27 C ATOM 1744 C SER A 226 22.246 51.488 14.578 1.00 28.84 C ATOM 1745 O SER A 226 22.032 51.804 15.758 1.00 28.44 O ATOM 1746 CB SER A 226 21.193 52.888 12.846 1.00 29.78 C ATOM 1747 OG SER A 226 21.296 54.126 12.187 1.00 29.90 O ATOM 0 H SER A 226 23.221 51.865 11.755 1.00 29.67 H new ATOM 0 HA SER A 226 22.908 53.315 13.918 1.00 29.27 H new ATOM 0 HB2 SER A 226 20.944 52.198 12.211 1.00 29.78 H new ATOM 0 HB3 SER A 226 20.489 52.928 13.512 1.00 29.78 H new ATOM 0 HG SER A 226 21.363 53.998 11.359 1.00 29.90 H new ATOM 1748 N PHE A 227 22.238 50.237 14.141 1.00 28.08 N ATOM 1749 CA PHE A 227 21.999 49.133 15.072 1.00 27.59 C ATOM 1750 C PHE A 227 23.112 49.098 16.137 1.00 28.16 C ATOM 1751 O PHE A 227 22.879 48.949 17.341 1.00 28.67 O ATOM 1752 CB PHE A 227 21.885 47.783 14.342 1.00 26.96 C ATOM 1753 CG PHE A 227 21.528 46.667 15.262 1.00 25.85 C ATOM 1754 CD1 PHE A 227 20.205 46.380 15.544 1.00 25.77 C ATOM 1755 CD2 PHE A 227 22.533 45.951 15.930 1.00 26.05 C ATOM 1756 CE1 PHE A 227 19.877 45.368 16.456 1.00 27.31 C ATOM 1757 CE2 PHE A 227 22.222 44.971 16.839 1.00 24.55 C ATOM 1758 CZ PHE A 227 20.888 44.681 17.111 1.00 25.03 C ATOM 0 H PHE A 227 22.366 50.003 13.323 1.00 28.08 H new ATOM 0 HA PHE A 227 21.148 49.286 15.512 1.00 27.59 H new ATOM 0 HB2 PHE A 227 21.214 47.851 13.645 1.00 26.96 H new ATOM 0 HB3 PHE A 227 22.728 47.582 13.906 1.00 26.96 H new ATOM 0 HD1 PHE A 227 19.528 46.862 15.126 1.00 25.77 H new ATOM 0 HD2 PHE A 227 23.426 46.144 15.754 1.00 26.05 H new ATOM 0 HE1 PHE A 227 18.986 45.158 16.621 1.00 27.31 H new ATOM 0 HE2 PHE A 227 22.899 44.503 17.271 1.00 24.55 H new ATOM 0 HZ PHE A 227 20.674 44.024 17.734 1.00 25.03 H new ATOM 1759 N ILE A 228 24.337 49.270 15.693 1.00 28.93 N ATOM 1760 CA ILE A 228 25.456 49.237 16.625 1.00 28.86 C ATOM 1761 C ILE A 228 25.447 50.449 17.528 1.00 29.79 C ATOM 1762 O ILE A 228 25.705 50.363 18.724 1.00 29.25 O ATOM 1763 CB ILE A 228 26.798 49.185 15.888 1.00 29.17 C ATOM 1764 CG1 ILE A 228 27.014 47.781 15.338 1.00 28.16 C ATOM 1765 CG2 ILE A 228 27.913 49.544 16.816 1.00 27.57 C ATOM 1766 CD1 ILE A 228 28.069 47.733 14.336 1.00 28.59 C ATOM 0 H ILE A 228 24.548 49.406 14.870 1.00 28.93 H new ATOM 0 HA ILE A 228 25.352 48.433 17.157 1.00 28.86 H new ATOM 0 HB ILE A 228 26.786 49.823 15.158 1.00 29.17 H new ATOM 0 HG12 ILE A 228 27.237 47.182 16.067 1.00 28.16 H new ATOM 0 HG13 ILE A 228 26.186 47.458 14.948 1.00 28.16 H new ATOM 0 HG21 ILE A 228 28.756 49.507 16.338 1.00 27.57 H new ATOM 0 HG22 ILE A 228 27.774 50.441 17.157 1.00 27.57 H new ATOM 0 HG23 ILE A 228 27.933 48.917 17.556 1.00 27.57 H new ATOM 0 HD11 ILE A 228 28.170 46.823 14.016 1.00 28.59 H new ATOM 0 HD12 ILE A 228 27.837 48.313 13.594 1.00 28.59 H new ATOM 0 HD13 ILE A 228 28.904 48.031 14.730 1.00 28.59 H new ATOM 1767 N GLU A 229 25.175 51.597 16.933 1.00 30.63 N ATOM 1768 CA GLU A 229 25.214 52.861 17.689 1.00 31.31 C ATOM 1769 C GLU A 229 24.188 52.853 18.819 1.00 31.68 C ATOM 1770 O GLU A 229 24.436 53.378 19.903 1.00 32.23 O ATOM 1771 CB GLU A 229 24.992 54.062 16.784 1.00 31.93 C ATOM 1772 CG GLU A 229 24.778 55.358 17.550 1.00 33.20 C ATOM 1773 CD GLU A 229 26.020 55.781 18.321 1.00 38.72 C ATOM 1774 OE1 GLU A 229 27.112 55.261 18.009 1.00 39.66 O ATOM 1775 OE2 GLU A 229 25.910 56.657 19.220 1.00 40.47 O ATOM 0 H GLU A 229 24.967 51.678 16.103 1.00 30.63 H new ATOM 0 HA GLU A 229 26.100 52.938 18.075 1.00 31.31 H new ATOM 0 HB2 GLU A 229 25.757 54.163 16.197 1.00 31.93 H new ATOM 0 HB3 GLU A 229 24.221 53.896 16.219 1.00 31.93 H new ATOM 0 HG2 GLU A 229 24.529 56.061 16.930 1.00 33.20 H new ATOM 0 HG3 GLU A 229 24.038 55.249 18.167 1.00 33.20 H new ATOM 1776 N LYS A 230 23.056 52.208 18.568 1.00 31.46 N ATOM 1777 CA LYS A 230 21.970 52.106 19.562 1.00 32.17 C ATOM 1778 C LYS A 230 22.277 51.190 20.738 1.00 32.43 C ATOM 1779 O LYS A 230 22.018 51.521 21.897 1.00 32.36 O ATOM 1780 CB LYS A 230 20.693 51.544 18.940 1.00 32.28 C ATOM 1781 CG LYS A 230 19.631 51.175 19.970 1.00 33.14 C ATOM 1782 CD LYS A 230 18.252 50.867 19.328 1.00 33.34 C ATOM 0 H LYS A 230 22.887 51.815 17.822 1.00 31.46 H new ATOM 0 HA LYS A 230 21.867 53.019 19.874 1.00 32.17 H new ATOM 0 HB2 LYS A 230 20.325 52.198 18.326 1.00 32.28 H new ATOM 0 HB3 LYS A 230 20.915 50.757 18.417 1.00 32.28 H new ATOM 0 HG2 LYS A 230 19.929 50.401 20.473 1.00 33.14 H new ATOM 0 HG3 LYS A 230 19.533 51.904 20.603 1.00 33.14 H new ATOM 1783 N TYR A 231 22.841 50.031 20.421 1.00 32.42 N ATOM 1784 CA TYR A 231 23.031 48.975 21.425 1.00 32.79 C ATOM 1785 C TYR A 231 24.419 48.875 22.053 1.00 32.50 C ATOM 1786 O TYR A 231 24.618 48.144 23.024 1.00 31.85 O ATOM 1787 CB TYR A 231 22.675 47.628 20.809 1.00 33.25 C ATOM 1788 CG TYR A 231 21.226 47.455 20.492 1.00 36.54 C ATOM 1789 CD1 TYR A 231 20.285 47.217 21.503 1.00 39.20 C ATOM 1790 CD2 TYR A 231 20.781 47.501 19.187 1.00 39.50 C ATOM 1791 CE1 TYR A 231 18.944 47.043 21.204 1.00 38.85 C ATOM 1792 CE2 TYR A 231 19.447 47.340 18.885 1.00 39.47 C ATOM 1793 CZ TYR A 231 18.535 47.106 19.887 1.00 40.07 C ATOM 1794 OH TYR A 231 17.204 46.945 19.541 1.00 38.92 O ATOM 0 H TYR A 231 23.122 49.831 19.633 1.00 32.42 H new ATOM 0 HA TYR A 231 22.442 49.224 22.154 1.00 32.79 H new ATOM 0 HB2 TYR A 231 23.189 47.512 19.994 1.00 33.25 H new ATOM 0 HB3 TYR A 231 22.947 46.924 21.419 1.00 33.25 H new ATOM 0 HD1 TYR A 231 20.566 47.175 22.389 1.00 39.20 H new ATOM 0 HD2 TYR A 231 21.392 47.643 18.500 1.00 39.50 H new ATOM 0 HE1 TYR A 231 18.327 46.886 21.882 1.00 38.85 H new ATOM 0 HE2 TYR A 231 19.162 47.390 18.001 1.00 39.47 H new ATOM 0 HH TYR A 231 17.121 47.011 18.708 1.00 38.92 H new ATOM 1795 N ARG A 232 25.378 49.598 21.492 1.00 32.33 N ATOM 1796 CA ARG A 232 26.761 49.549 21.993 1.00 33.13 C ATOM 1797 C ARG A 232 26.852 50.052 23.431 1.00 33.61 C ATOM 1798 O ARG A 232 27.807 49.762 24.156 1.00 34.10 O ATOM 1799 CB ARG A 232 27.706 50.394 21.127 1.00 32.91 C ATOM 1800 CG ARG A 232 27.448 51.880 21.208 1.00 34.14 C ATOM 1801 CD ARG A 232 28.609 52.690 20.646 1.00 36.64 C ATOM 1802 NE ARG A 232 28.283 54.108 20.571 1.00 35.22 N ATOM 1803 CZ ARG A 232 28.391 54.988 21.571 1.00 35.63 C ATOM 1804 NH1 ARG A 232 28.828 54.648 22.771 1.00 34.99 N ATOM 1805 NH2 ARG A 232 28.039 56.240 21.361 1.00 38.20 N ATOM 0 H ARG A 232 25.258 50.124 20.822 1.00 32.33 H new ATOM 0 HA ARG A 232 27.031 48.618 21.955 1.00 33.13 H new ATOM 0 HB2 ARG A 232 28.621 50.219 21.397 1.00 32.91 H new ATOM 0 HB3 ARG A 232 27.624 50.110 20.203 1.00 32.91 H new ATOM 0 HG2 ARG A 232 26.638 52.094 20.719 1.00 34.14 H new ATOM 0 HG3 ARG A 232 27.296 52.132 22.132 1.00 34.14 H new ATOM 0 HD2 ARG A 232 29.392 52.566 21.205 1.00 36.64 H new ATOM 0 HD3 ARG A 232 28.836 52.362 19.762 1.00 36.64 H new ATOM 0 HE ARG A 232 27.996 54.405 19.817 1.00 35.22 H new ATOM 0 HH11 ARG A 232 29.056 53.834 22.931 1.00 34.99 H new ATOM 0 HH12 ARG A 232 28.885 55.241 23.392 1.00 34.99 H new ATOM 0 HH21 ARG A 232 27.745 56.480 20.589 1.00 38.20 H new ATOM 0 HH22 ARG A 232 28.103 56.817 21.996 1.00 38.20 H new ATOM 1806 N SER A 233 25.824 50.774 23.837 1.00 33.90 N ATOM 1807 CA SER A 233 25.822 51.477 25.131 1.00 34.89 C ATOM 1808 C SER A 233 25.412 50.622 26.301 1.00 34.87 C ATOM 1809 O SER A 233 25.471 51.030 27.465 1.00 35.73 O ATOM 1810 CB SER A 233 24.883 52.685 25.064 1.00 35.28 C ATOM 1811 OG SER A 233 25.395 53.624 24.147 1.00 36.71 O ATOM 0 H SER A 233 25.103 50.877 23.379 1.00 33.90 H new ATOM 0 HA SER A 233 26.742 51.744 25.283 1.00 34.89 H new ATOM 0 HB2 SER A 233 23.996 52.403 24.792 1.00 35.28 H new ATOM 0 HB3 SER A 233 24.796 53.089 25.942 1.00 35.28 H new ATOM 0 HG SER A 233 24.881 54.287 24.108 1.00 36.71 H new HETATM 1812 N MSE A 234 24.968 49.436 25.984 1.00 34.20 N HETATM 1813 CA MSE A 234 24.512 48.542 27.005 1.00 34.23 C HETATM 1814 C MSE A 234 25.650 48.276 27.951 1.00 34.66 C HETATM 1815 O MSE A 234 26.821 48.481 27.641 1.00 35.03 O HETATM 1816 CB MSE A 234 23.973 47.264 26.399 1.00 33.99 C HETATM 1817 CG MSE A 234 22.700 47.550 25.627 1.00 33.96 C HETATM 1818 SE MSE A 234 21.796 45.981 24.960 0.75 31.11 SE HETATM 1819 CE MSE A 234 23.239 45.394 23.768 1.00 28.23 C HETATM 0 H MSE A 234 24.922 49.128 25.182 1.00 34.20 H new HETATM 0 HA MSE A 234 23.780 48.946 27.498 1.00 34.23 H new HETATM 0 HB2 MSE A 234 24.636 46.872 25.809 1.00 33.99 H new HETATM 0 HB3 MSE A 234 23.797 46.615 27.098 1.00 33.99 H new HETATM 0 HG2 MSE A 234 22.091 48.040 26.201 1.00 33.96 H new HETATM 0 HG3 MSE A 234 22.913 48.129 24.878 1.00 33.96 H new HETATM 0 HE1 MSE A 234 22.973 44.579 23.314 1.00 28.23 H new HETATM 0 HE2 MSE A 234 23.418 46.085 23.112 1.00 28.23 H new HETATM 0 HE3 MSE A 234 24.041 45.227 24.288 1.00 28.23 H new ATOM 1820 N ASN A 235 25.283 47.758 29.099 1.00 34.29 N ATOM 1821 CA ASN A 235 26.233 47.540 30.184 1.00 34.41 C ATOM 1822 C ASN A 235 27.151 46.307 30.065 1.00 32.80 C ATOM 1823 O ASN A 235 26.736 45.183 29.751 1.00 32.00 O ATOM 1824 CB ASN A 235 25.491 47.500 31.517 1.00 35.73 C ATOM 1825 CG ASN A 235 26.161 48.306 32.549 1.00 38.51 C ATOM 1826 OD1 ASN A 235 26.714 49.368 32.243 1.00 45.43 O ATOM 1827 ND2 ASN A 235 26.124 47.838 33.793 1.00 43.35 N ATOM 0 H ASN A 235 24.477 47.519 29.281 1.00 34.29 H new ATOM 0 HA ASN A 235 26.839 48.296 30.126 1.00 34.41 H new ATOM 0 HB2 ASN A 235 24.586 47.825 31.392 1.00 35.73 H new ATOM 0 HB3 ASN A 235 25.423 46.581 31.820 1.00 35.73 H new ATOM 0 HD21 ASN A 235 26.496 48.280 34.430 1.00 43.35 H new ATOM 0 HD22 ASN A 235 25.728 47.093 33.961 1.00 43.35 H new ATOM 1828 N GLY A 236 28.417 46.570 30.370 1.00 31.20 N ATOM 1829 CA GLY A 236 29.467 45.573 30.343 1.00 29.70 C ATOM 1830 C GLY A 236 30.136 45.487 29.005 1.00 28.56 C ATOM 1831 O GLY A 236 30.126 46.438 28.221 1.00 28.21 O ATOM 0 H GLY A 236 28.691 47.351 30.603 1.00 31.20 H new ATOM 0 HA2 GLY A 236 30.129 45.785 31.020 1.00 29.70 H new ATOM 0 HA3 GLY A 236 29.094 44.707 30.572 1.00 29.70 H new ATOM 1832 N ARG A 237 30.725 44.327 28.728 1.00 27.22 N ATOM 1833 CA ARG A 237 31.376 44.160 27.466 1.00 25.41 C ATOM 1834 C ARG A 237 30.369 43.834 26.348 1.00 24.39 C ATOM 1835 O ARG A 237 29.697 42.798 26.366 1.00 22.77 O ATOM 1836 CB ARG A 237 32.434 43.087 27.531 1.00 26.23 C ATOM 1837 CG ARG A 237 33.249 42.967 26.212 1.00 28.34 C ATOM 1838 CD ARG A 237 34.252 41.806 26.351 1.00 33.72 C ATOM 1839 NE ARG A 237 35.130 41.718 25.187 1.00 39.28 N ATOM 1840 CZ ARG A 237 36.227 40.964 25.104 1.00 40.04 C ATOM 1841 NH1 ARG A 237 36.602 40.191 26.117 1.00 42.25 N ATOM 1842 NH2 ARG A 237 36.946 40.984 23.995 1.00 40.13 N ATOM 0 H ARG A 237 30.752 43.646 29.253 1.00 27.22 H new ATOM 0 HA ARG A 237 31.804 45.005 27.257 1.00 25.41 H new ATOM 0 HB2 ARG A 237 33.039 43.279 28.264 1.00 26.23 H new ATOM 0 HB3 ARG A 237 32.014 42.235 27.726 1.00 26.23 H new ATOM 0 HG2 ARG A 237 32.654 42.808 25.463 1.00 28.34 H new ATOM 0 HG3 ARG A 237 33.718 43.796 26.031 1.00 28.34 H new ATOM 0 HD2 ARG A 237 34.785 41.931 27.152 1.00 33.72 H new ATOM 0 HD3 ARG A 237 33.770 40.971 26.459 1.00 33.72 H new ATOM 0 HE ARG A 237 34.923 42.191 24.499 1.00 39.28 H new ATOM 0 HH11 ARG A 237 36.135 40.172 26.839 1.00 42.25 H new ATOM 0 HH12 ARG A 237 37.312 39.710 26.051 1.00 42.25 H new ATOM 0 HH21 ARG A 237 36.705 41.480 23.335 1.00 40.13 H new ATOM 0 HH22 ARG A 237 37.655 40.501 23.933 1.00 40.13 H new ATOM 1843 N ILE A 238 30.274 44.751 25.389 1.00 22.92 N ATOM 1844 CA ILE A 238 29.352 44.591 24.248 1.00 22.08 C ATOM 1845 C ILE A 238 30.143 44.342 22.981 1.00 21.86 C ATOM 1846 O ILE A 238 30.917 45.194 22.535 1.00 22.87 O ATOM 1847 CB ILE A 238 28.396 45.812 24.022 1.00 22.19 C ATOM 1848 CG1 ILE A 238 27.724 46.218 25.322 1.00 21.07 C ATOM 1849 CG2 ILE A 238 27.327 45.471 22.988 1.00 21.62 C ATOM 1850 CD1 ILE A 238 27.056 45.050 26.067 1.00 20.81 C ATOM 0 H ILE A 238 30.733 45.478 25.374 1.00 22.92 H new ATOM 0 HA ILE A 238 28.788 43.832 24.466 1.00 22.08 H new ATOM 0 HB ILE A 238 28.932 46.552 23.697 1.00 22.19 H new ATOM 0 HG12 ILE A 238 28.384 46.626 25.904 1.00 21.07 H new ATOM 0 HG13 ILE A 238 27.055 46.895 25.133 1.00 21.07 H new ATOM 0 HG21 ILE A 238 26.745 46.236 22.860 1.00 21.62 H new ATOM 0 HG22 ILE A 238 27.752 45.244 22.146 1.00 21.62 H new ATOM 0 HG23 ILE A 238 26.804 44.716 23.300 1.00 21.62 H new ATOM 0 HD11 ILE A 238 26.648 45.378 26.884 1.00 20.81 H new ATOM 0 HD12 ILE A 238 26.374 44.654 25.502 1.00 20.81 H new ATOM 0 HD13 ILE A 238 27.724 44.381 26.285 1.00 20.81 H new ATOM 1851 N THR A 239 29.925 43.162 22.407 1.00 21.30 N ATOM 1852 CA THR A 239 30.657 42.693 21.221 1.00 20.68 C ATOM 1853 C THR A 239 29.710 42.295 20.094 1.00 21.23 C ATOM 1854 O THR A 239 28.787 41.450 20.244 1.00 20.53 O ATOM 1855 CB THR A 239 31.586 41.459 21.540 1.00 20.34 C ATOM 1856 OG1 THR A 239 32.323 41.661 22.780 1.00 22.17 O ATOM 1857 CG2 THR A 239 32.567 41.156 20.381 1.00 19.42 C ATOM 0 H THR A 239 29.341 42.600 22.696 1.00 21.30 H new ATOM 0 HA THR A 239 31.205 43.443 20.942 1.00 20.68 H new ATOM 0 HB THR A 239 31.003 40.691 21.645 1.00 20.34 H new ATOM 0 HG1 THR A 239 31.880 41.351 23.423 1.00 22.17 H new ATOM 0 HG21 THR A 239 33.119 40.393 20.615 1.00 19.42 H new ATOM 0 HG22 THR A 239 32.065 40.956 19.576 1.00 19.42 H new ATOM 0 HG23 THR A 239 33.133 41.928 20.225 1.00 19.42 H new ATOM 1858 N PHE A 240 29.972 42.928 18.960 1.00 21.98 N ATOM 1859 CA PHE A 240 29.245 42.664 17.732 1.00 22.47 C ATOM 1860 C PHE A 240 30.113 41.907 16.797 1.00 23.12 C ATOM 1861 O PHE A 240 31.241 42.297 16.520 1.00 22.11 O ATOM 1862 CB PHE A 240 28.833 43.949 17.031 1.00 22.82 C ATOM 1863 CG PHE A 240 27.943 44.830 17.854 1.00 22.62 C ATOM 1864 CD1 PHE A 240 28.494 45.709 18.777 1.00 23.37 C ATOM 1865 CD2 PHE A 240 26.555 44.777 17.729 1.00 20.10 C ATOM 1866 CE1 PHE A 240 27.701 46.520 19.534 1.00 21.56 C ATOM 1867 CE2 PHE A 240 25.754 45.607 18.502 1.00 17.82 C ATOM 1868 CZ PHE A 240 26.319 46.476 19.386 1.00 19.51 C ATOM 0 H PHE A 240 30.583 43.528 18.882 1.00 21.98 H new ATOM 0 HA PHE A 240 28.451 42.161 17.971 1.00 22.47 H new ATOM 0 HB2 PHE A 240 29.631 44.445 16.789 1.00 22.82 H new ATOM 0 HB3 PHE A 240 28.377 43.725 16.205 1.00 22.82 H new ATOM 0 HD1 PHE A 240 29.418 45.745 18.880 1.00 23.37 H new ATOM 0 HD2 PHE A 240 26.165 44.185 17.127 1.00 20.10 H new ATOM 0 HE1 PHE A 240 28.084 47.103 20.149 1.00 21.56 H new ATOM 0 HE2 PHE A 240 24.829 45.570 18.416 1.00 17.82 H new ATOM 0 HZ PHE A 240 25.780 47.041 19.891 1.00 19.51 H new ATOM 1869 N TYR A 241 29.537 40.798 16.328 1.00 23.05 N ATOM 1870 CA TYR A 241 30.110 39.979 15.268 1.00 22.65 C ATOM 1871 C TYR A 241 29.232 40.263 14.077 1.00 21.88 C ATOM 1872 O TYR A 241 28.074 39.890 14.052 1.00 22.10 O ATOM 1873 CB TYR A 241 30.083 38.519 15.652 1.00 22.25 C ATOM 1874 CG TYR A 241 30.923 38.163 16.869 1.00 20.74 C ATOM 1875 CD1 TYR A 241 30.427 38.278 18.157 1.00 17.48 C ATOM 1876 CD2 TYR A 241 32.186 37.671 16.712 1.00 19.20 C ATOM 1877 CE1 TYR A 241 31.168 37.909 19.233 1.00 20.18 C ATOM 1878 CE2 TYR A 241 32.947 37.283 17.788 1.00 20.47 C ATOM 1879 CZ TYR A 241 32.446 37.416 19.050 1.00 19.06 C ATOM 1880 OH TYR A 241 33.255 37.081 20.111 1.00 20.05 O ATOM 0 H TYR A 241 28.788 40.498 16.626 1.00 23.05 H new ATOM 0 HA TYR A 241 31.041 40.182 15.089 1.00 22.65 H new ATOM 0 HB2 TYR A 241 29.164 38.259 15.822 1.00 22.25 H new ATOM 0 HB3 TYR A 241 30.391 37.993 14.897 1.00 22.25 H new ATOM 0 HD1 TYR A 241 29.570 38.614 18.287 1.00 17.48 H new ATOM 0 HD2 TYR A 241 32.540 37.596 15.855 1.00 19.20 H new ATOM 0 HE1 TYR A 241 30.817 37.988 20.090 1.00 20.18 H new ATOM 0 HE2 TYR A 241 33.798 36.932 17.657 1.00 20.47 H new ATOM 0 HH TYR A 241 32.800 37.068 20.817 1.00 20.05 H new ATOM 1881 N VAL A 242 29.786 40.981 13.116 1.00 21.59 N ATOM 1882 CA VAL A 242 29.018 41.514 11.986 1.00 21.15 C ATOM 1883 C VAL A 242 29.406 40.877 10.672 1.00 21.48 C ATOM 1884 O VAL A 242 30.556 40.758 10.366 1.00 19.99 O ATOM 1885 CB VAL A 242 29.160 43.056 11.892 1.00 21.67 C ATOM 1886 CG1 VAL A 242 28.258 43.627 10.801 1.00 19.72 C ATOM 1887 CG2 VAL A 242 28.802 43.714 13.216 1.00 19.72 C ATOM 0 H VAL A 242 30.623 41.178 13.094 1.00 21.59 H new ATOM 0 HA VAL A 242 28.089 41.291 12.156 1.00 21.15 H new ATOM 0 HB VAL A 242 30.086 43.245 11.674 1.00 21.67 H new ATOM 0 HG11 VAL A 242 28.366 44.590 10.763 1.00 19.72 H new ATOM 0 HG12 VAL A 242 28.501 43.241 9.945 1.00 19.72 H new ATOM 0 HG13 VAL A 242 27.333 43.413 11.001 1.00 19.72 H new ATOM 0 HG21 VAL A 242 28.897 44.676 13.136 1.00 19.72 H new ATOM 0 HG22 VAL A 242 27.885 43.498 13.447 1.00 19.72 H new ATOM 0 HG23 VAL A 242 29.395 43.388 13.911 1.00 19.72 H new ATOM 1888 N ARG A 243 28.405 40.416 9.928 1.00 20.87 N ATOM 1889 CA ARG A 243 28.667 39.745 8.687 1.00 21.63 C ATOM 1890 C ARG A 243 29.467 40.674 7.775 1.00 21.71 C ATOM 1891 O ARG A 243 29.154 41.843 7.623 1.00 21.87 O ATOM 1892 CB ARG A 243 27.375 39.233 8.015 1.00 21.57 C ATOM 1893 CG ARG A 243 27.678 38.336 6.780 1.00 22.05 C ATOM 1894 CD ARG A 243 26.467 38.120 5.918 1.00 24.01 C ATOM 1895 NE ARG A 243 25.345 37.478 6.596 1.00 22.10 N ATOM 1896 CZ ARG A 243 25.134 36.169 6.691 1.00 22.12 C ATOM 1897 NH1 ARG A 243 25.988 35.301 6.222 1.00 22.57 N ATOM 1898 NH2 ARG A 243 24.054 35.739 7.300 1.00 22.45 N ATOM 0 H ARG A 243 27.573 40.487 10.133 1.00 20.87 H new ATOM 0 HA ARG A 243 29.196 38.952 8.865 1.00 21.63 H new ATOM 0 HB2 ARG A 243 26.854 38.730 8.660 1.00 21.57 H new ATOM 0 HB3 ARG A 243 26.833 39.989 7.740 1.00 21.57 H new ATOM 0 HG2 ARG A 243 28.380 38.746 6.250 1.00 22.05 H new ATOM 0 HG3 ARG A 243 28.014 37.478 7.082 1.00 22.05 H new ATOM 0 HD2 ARG A 243 26.173 38.978 5.573 1.00 24.01 H new ATOM 0 HD3 ARG A 243 26.721 37.579 5.154 1.00 24.01 H new ATOM 0 HE ARG A 243 24.767 37.994 6.968 1.00 22.10 H new ATOM 0 HH11 ARG A 243 26.709 35.571 5.840 1.00 22.57 H new ATOM 0 HH12 ARG A 243 25.829 34.459 6.295 1.00 22.57 H new ATOM 0 HH21 ARG A 243 23.494 36.302 7.631 1.00 22.45 H new ATOM 0 HH22 ARG A 243 23.906 34.895 7.368 1.00 22.45 H new ATOM 1899 N LYS A 244 30.525 40.132 7.193 1.00 22.86 N ATOM 1900 CA LYS A 244 31.474 40.909 6.346 1.00 22.94 C ATOM 1901 C LYS A 244 30.820 41.934 5.380 1.00 23.95 C ATOM 1902 O LYS A 244 31.213 43.128 5.320 1.00 23.56 O ATOM 1903 CB LYS A 244 32.374 39.934 5.591 1.00 22.40 C ATOM 1904 CG LYS A 244 33.432 40.571 4.747 1.00 27.60 C ATOM 1905 CD LYS A 244 34.330 41.398 5.590 1.00 31.32 C ATOM 1906 CE LYS A 244 35.689 41.591 4.968 1.00 35.76 C ATOM 1907 NZ LYS A 244 36.558 42.488 5.799 1.00 38.50 N ATOM 0 H LYS A 244 30.729 39.300 7.268 1.00 22.86 H new ATOM 0 HA LYS A 244 31.992 41.462 6.952 1.00 22.94 H new ATOM 0 HB2 LYS A 244 32.802 39.347 6.234 1.00 22.40 H new ATOM 0 HB3 LYS A 244 31.819 39.377 5.023 1.00 22.40 H new ATOM 0 HG2 LYS A 244 33.946 39.887 4.290 1.00 27.60 H new ATOM 0 HG3 LYS A 244 33.021 41.122 4.063 1.00 27.60 H new ATOM 0 HD2 LYS A 244 33.920 42.264 5.740 1.00 31.32 H new ATOM 0 HD3 LYS A 244 34.432 40.978 6.458 1.00 31.32 H new ATOM 0 HE2 LYS A 244 36.122 40.729 4.861 1.00 35.76 H new ATOM 0 HE3 LYS A 244 35.588 41.969 4.081 1.00 35.76 H new ATOM 0 HZ1 LYS A 244 37.360 42.558 5.421 1.00 38.50 H new ATOM 0 HZ2 LYS A 244 36.185 43.294 5.855 1.00 38.50 H new ATOM 0 HZ3 LYS A 244 36.645 42.145 6.615 1.00 38.50 H new ATOM 1908 N ALA A 245 29.786 41.486 4.687 1.00 24.05 N ATOM 1909 CA ALA A 245 29.166 42.304 3.651 1.00 25.14 C ATOM 1910 C ALA A 245 28.568 43.538 4.245 1.00 26.04 C ATOM 1911 O ALA A 245 28.484 44.568 3.565 1.00 26.27 O ATOM 1912 CB ALA A 245 28.121 41.541 2.853 1.00 24.99 C ATOM 0 H ALA A 245 29.426 40.713 4.798 1.00 24.05 H new ATOM 0 HA ALA A 245 29.869 42.556 3.032 1.00 25.14 H new ATOM 0 HB1 ALA A 245 27.739 42.124 2.179 1.00 24.99 H new ATOM 0 HB2 ALA A 245 28.537 40.778 2.421 1.00 24.99 H new ATOM 0 HB3 ALA A 245 27.420 41.233 3.449 1.00 24.99 H new ATOM 1913 N LEU A 246 28.181 43.452 5.515 1.00 26.74 N ATOM 1914 CA LEU A 246 27.604 44.600 6.224 1.00 27.46 C ATOM 1915 C LEU A 246 28.677 45.481 6.859 1.00 28.94 C ATOM 1916 O LEU A 246 28.505 46.694 7.054 1.00 28.72 O ATOM 1917 CB LEU A 246 26.717 44.133 7.368 1.00 28.15 C ATOM 1918 CG LEU A 246 25.516 43.245 7.121 1.00 29.52 C ATOM 1919 CD1 LEU A 246 24.758 43.223 8.390 1.00 32.56 C ATOM 1920 CD2 LEU A 246 24.664 43.810 6.051 1.00 32.17 C ATOM 0 H LEU A 246 28.243 42.737 5.988 1.00 26.74 H new ATOM 0 HA LEU A 246 27.105 45.098 5.558 1.00 27.46 H new ATOM 0 HB2 LEU A 246 27.289 43.666 7.997 1.00 28.15 H new ATOM 0 HB3 LEU A 246 26.392 44.929 7.817 1.00 28.15 H new ATOM 0 HG LEU A 246 25.791 42.357 6.843 1.00 29.52 H new ATOM 0 HD11 LEU A 246 23.972 42.664 8.288 1.00 32.56 H new ATOM 0 HD12 LEU A 246 25.319 42.865 9.096 1.00 32.56 H new ATOM 0 HD13 LEU A 246 24.485 44.125 8.620 1.00 32.56 H new ATOM 0 HD21 LEU A 246 23.900 43.230 5.905 1.00 32.17 H new ATOM 0 HD22 LEU A 246 24.355 44.691 6.314 1.00 32.17 H new ATOM 0 HD23 LEU A 246 25.178 43.880 5.231 1.00 32.17 H new ATOM 1921 N ALA A 247 29.760 44.821 7.249 1.00 29.54 N ATOM 1922 CA ALA A 247 30.867 45.442 8.015 1.00 30.14 C ATOM 1923 C ALA A 247 31.571 46.458 7.133 1.00 30.78 C ATOM 1924 O ALA A 247 32.196 47.437 7.556 1.00 31.01 O ATOM 1925 CB ALA A 247 31.843 44.356 8.483 1.00 29.36 C ATOM 0 H ALA A 247 29.886 43.987 7.080 1.00 29.54 H new ATOM 0 HA ALA A 247 30.518 45.895 8.798 1.00 30.14 H new ATOM 0 HB1 ALA A 247 32.566 44.765 8.984 1.00 29.36 H new ATOM 0 HB2 ALA A 247 31.375 43.723 9.050 1.00 29.36 H new ATOM 0 HB3 ALA A 247 32.206 43.893 7.712 1.00 29.36 H new ATOM 1926 N ASN A 248 31.386 46.223 5.862 1.00 31.90 N ATOM 1927 CA ASN A 248 32.043 46.999 4.838 1.00 31.76 C ATOM 1928 C ASN A 248 31.497 48.412 4.837 1.00 31.32 C ATOM 1929 O ASN A 248 32.142 49.344 4.390 1.00 32.07 O ATOM 1930 CB ASN A 248 31.900 46.299 3.467 1.00 33.25 C ATOM 1931 CG ASN A 248 32.732 45.008 3.372 1.00 33.51 C ATOM 1932 OD1 ASN A 248 33.687 44.807 4.121 1.00 37.33 O ATOM 1933 ND2 ASN A 248 32.373 44.144 2.444 1.00 35.55 N ATOM 0 H ASN A 248 30.871 45.604 5.560 1.00 31.90 H new ATOM 0 HA ASN A 248 32.993 47.059 5.024 1.00 31.76 H new ATOM 0 HB2 ASN A 248 30.966 46.090 3.310 1.00 33.25 H new ATOM 0 HB3 ASN A 248 32.176 46.910 2.766 1.00 33.25 H new ATOM 0 HD21 ASN A 248 32.811 43.411 2.347 1.00 35.55 H new ATOM 0 HD22 ASN A 248 31.700 44.314 1.936 1.00 35.55 H new ATOM 1934 N GLY A 249 30.312 48.582 5.393 1.00 31.14 N ATOM 1935 CA GLY A 249 29.650 49.899 5.429 1.00 30.02 C ATOM 1936 C GLY A 249 29.738 50.586 6.798 1.00 29.78 C ATOM 1937 O GLY A 249 29.128 51.614 7.044 1.00 29.52 O ATOM 0 H GLY A 249 29.861 47.949 5.761 1.00 31.14 H new ATOM 0 HA2 GLY A 249 30.052 50.474 4.759 1.00 30.02 H new ATOM 0 HA3 GLY A 249 28.717 49.791 5.188 1.00 30.02 H new ATOM 1938 N LEU A 250 30.540 50.032 7.684 1.00 28.90 N ATOM 1939 CA LEU A 250 30.722 50.611 9.025 1.00 28.04 C ATOM 1940 C LEU A 250 31.967 51.525 9.057 1.00 28.40 C ATOM 1941 O LEU A 250 32.924 51.270 8.351 1.00 28.53 O ATOM 1942 CB LEU A 250 30.871 49.503 10.082 1.00 27.98 C ATOM 1943 CG LEU A 250 29.628 48.690 10.434 1.00 28.10 C ATOM 1944 CD1 LEU A 250 29.985 47.512 11.378 1.00 27.62 C ATOM 1945 CD2 LEU A 250 28.533 49.536 11.044 1.00 24.87 C ATOM 0 H LEU A 250 30.996 49.317 7.540 1.00 28.90 H new ATOM 0 HA LEU A 250 29.934 51.139 9.231 1.00 28.04 H new ATOM 0 HB2 LEU A 250 31.554 48.887 9.775 1.00 27.98 H new ATOM 0 HB3 LEU A 250 31.203 49.910 10.897 1.00 27.98 H new ATOM 0 HG LEU A 250 29.286 48.334 9.599 1.00 28.10 H new ATOM 0 HD11 LEU A 250 29.182 47.010 11.588 1.00 27.62 H new ATOM 0 HD12 LEU A 250 30.625 46.929 10.940 1.00 27.62 H new ATOM 0 HD13 LEU A 250 30.372 47.859 12.197 1.00 27.62 H new ATOM 0 HD21 LEU A 250 27.768 48.976 11.249 1.00 24.87 H new ATOM 0 HD22 LEU A 250 28.859 49.949 11.859 1.00 24.87 H new ATOM 0 HD23 LEU A 250 28.269 50.226 10.416 1.00 24.87 H new ATOM 1946 N PRO A 251 31.968 52.591 9.883 1.00 28.71 N ATOM 1947 CA PRO A 251 33.175 53.459 9.955 1.00 28.75 C ATOM 1948 C PRO A 251 34.414 52.838 10.593 1.00 28.97 C ATOM 1949 O PRO A 251 35.527 53.108 10.193 1.00 29.97 O ATOM 1950 CB PRO A 251 32.727 54.634 10.845 1.00 28.37 C ATOM 1951 CG PRO A 251 31.501 54.178 11.532 1.00 28.97 C ATOM 1952 CD PRO A 251 30.820 53.228 10.543 1.00 29.06 C ATOM 0 HA PRO A 251 33.451 53.676 9.051 1.00 28.75 H new ATOM 0 HB2 PRO A 251 33.417 54.868 11.485 1.00 28.37 H new ATOM 0 HB3 PRO A 251 32.553 55.426 10.313 1.00 28.37 H new ATOM 0 HG2 PRO A 251 31.712 53.726 12.364 1.00 28.97 H new ATOM 0 HG3 PRO A 251 30.924 54.926 11.754 1.00 28.97 H new ATOM 0 HD2 PRO A 251 30.256 52.580 10.993 1.00 29.06 H new ATOM 0 HD3 PRO A 251 30.258 53.704 9.912 1.00 29.06 H new ATOM 1953 N TYR A 252 34.226 52.033 11.604 1.00 29.70 N ATOM 1954 CA TYR A 252 35.347 51.434 12.306 1.00 30.27 C ATOM 1955 C TYR A 252 35.865 50.307 11.467 1.00 29.75 C ATOM 1956 O TYR A 252 35.100 49.573 10.865 1.00 28.75 O ATOM 1957 CB TYR A 252 34.921 50.830 13.635 1.00 31.86 C ATOM 1958 CG TYR A 252 33.636 51.364 14.147 1.00 35.12 C ATOM 1959 CD1 TYR A 252 32.432 50.786 13.755 1.00 38.81 C ATOM 1960 CD2 TYR A 252 33.600 52.451 14.995 1.00 39.96 C ATOM 1961 CE1 TYR A 252 31.231 51.265 14.187 1.00 41.84 C ATOM 1962 CE2 TYR A 252 32.376 52.942 15.445 1.00 42.46 C ATOM 1963 CZ TYR A 252 31.204 52.336 15.037 1.00 43.93 C ATOM 1964 OH TYR A 252 29.982 52.808 15.469 1.00 49.46 O ATOM 0 H TYR A 252 33.453 51.813 11.909 1.00 29.70 H new ATOM 0 HA TYR A 252 36.009 52.125 12.465 1.00 30.27 H new ATOM 0 HB2 TYR A 252 34.846 49.868 13.535 1.00 31.86 H new ATOM 0 HB3 TYR A 252 35.615 50.993 14.293 1.00 31.86 H new ATOM 0 HD1 TYR A 252 32.447 50.053 13.183 1.00 38.81 H new ATOM 0 HD2 TYR A 252 34.392 52.856 15.266 1.00 39.96 H new ATOM 0 HE1 TYR A 252 30.438 50.868 13.907 1.00 41.84 H new ATOM 0 HE2 TYR A 252 32.348 53.674 16.017 1.00 42.46 H new ATOM 0 HH TYR A 252 30.100 53.462 15.983 1.00 49.46 H new ATOM 1965 N VAL A 253 37.180 50.195 11.428 1.00 29.36 N ATOM 1966 CA VAL A 253 37.847 49.088 10.785 1.00 29.77 C ATOM 1967 C VAL A 253 38.317 48.097 11.867 1.00 30.69 C ATOM 1968 O VAL A 253 39.207 48.420 12.647 1.00 29.78 O ATOM 1969 CB VAL A 253 39.053 49.571 10.031 1.00 29.45 C ATOM 1970 CG1 VAL A 253 39.819 48.402 9.423 1.00 30.19 C ATOM 1971 CG2 VAL A 253 38.637 50.586 8.981 1.00 30.77 C ATOM 0 H VAL A 253 37.715 50.769 11.780 1.00 29.36 H new ATOM 0 HA VAL A 253 37.230 48.663 10.169 1.00 29.77 H new ATOM 0 HB VAL A 253 39.656 50.012 10.649 1.00 29.45 H new ATOM 0 HG11 VAL A 253 40.592 48.737 8.942 1.00 30.19 H new ATOM 0 HG12 VAL A 253 40.112 47.805 10.129 1.00 30.19 H new ATOM 0 HG13 VAL A 253 39.241 47.920 8.811 1.00 30.19 H new ATOM 0 HG21 VAL A 253 39.421 50.893 8.499 1.00 30.77 H new ATOM 0 HG22 VAL A 253 38.017 50.174 8.360 1.00 30.77 H new ATOM 0 HG23 VAL A 253 38.207 51.341 9.413 1.00 30.77 H new ATOM 1972 N PRO A 254 37.732 46.880 11.911 1.00 31.67 N ATOM 1973 CA PRO A 254 38.161 45.941 12.928 1.00 31.74 C ATOM 1974 C PRO A 254 39.533 45.336 12.644 1.00 30.08 C ATOM 1975 O PRO A 254 39.974 45.245 11.507 1.00 30.50 O ATOM 1976 CB PRO A 254 37.089 44.866 12.848 1.00 32.49 C ATOM 1977 CG PRO A 254 36.862 44.772 11.343 1.00 33.20 C ATOM 1978 CD PRO A 254 36.967 46.200 10.842 1.00 33.19 C ATOM 0 HA PRO A 254 38.255 46.362 13.797 1.00 31.74 H new ATOM 0 HB2 PRO A 254 37.388 44.024 13.225 1.00 32.49 H new ATOM 0 HB3 PRO A 254 36.282 45.119 13.323 1.00 32.49 H new ATOM 0 HG2 PRO A 254 37.525 44.202 10.922 1.00 33.20 H new ATOM 0 HG3 PRO A 254 35.993 44.392 11.142 1.00 33.20 H new ATOM 0 HD2 PRO A 254 37.425 46.247 9.988 1.00 33.19 H new ATOM 0 HD3 PRO A 254 36.093 46.601 10.717 1.00 33.19 H new ATOM 1979 N ALA A 255 40.188 44.947 13.713 1.00 28.75 N ATOM 1980 CA ALA A 255 41.495 44.342 13.654 1.00 27.63 C ATOM 1981 C ALA A 255 41.354 42.859 13.416 1.00 27.40 C ATOM 1982 O ALA A 255 42.259 42.213 12.898 1.00 27.77 O ATOM 1983 CB ALA A 255 42.249 44.582 14.926 1.00 28.33 C ATOM 0 H ALA A 255 39.879 45.029 14.511 1.00 28.75 H new ATOM 0 HA ALA A 255 41.991 44.744 12.924 1.00 27.63 H new ATOM 0 HB1 ALA A 255 43.124 44.168 14.867 1.00 28.33 H new ATOM 0 HB2 ALA A 255 42.352 45.536 15.066 1.00 28.33 H new ATOM 0 HB3 ALA A 255 41.760 44.197 15.670 1.00 28.33 H new ATOM 1984 N SER A 256 40.196 42.321 13.721 1.00 25.94 N ATOM 1985 CA SER A 256 40.035 40.913 13.527 1.00 26.13 C ATOM 1986 C SER A 256 38.614 40.487 13.263 1.00 24.65 C ATOM 1987 O SER A 256 37.688 41.257 13.375 1.00 22.28 O ATOM 1988 CB SER A 256 40.581 40.153 14.739 1.00 27.42 C ATOM 1989 OG SER A 256 39.695 40.251 15.840 1.00 30.35 O ATOM 0 H SER A 256 39.513 42.741 14.032 1.00 25.94 H new ATOM 0 HA SER A 256 40.539 40.695 12.727 1.00 26.13 H new ATOM 0 HB2 SER A 256 40.713 39.220 14.508 1.00 27.42 H new ATOM 0 HB3 SER A 256 41.449 40.510 14.985 1.00 27.42 H new ATOM 0 HG SER A 256 39.383 41.030 15.881 1.00 30.35 H new ATOM 1990 N SER A 257 38.499 39.229 12.896 1.00 23.24 N ATOM 1991 CA SER A 257 37.220 38.636 12.542 1.00 24.22 C ATOM 1992 C SER A 257 37.066 37.177 12.973 1.00 23.78 C ATOM 1993 O SER A 257 38.036 36.471 13.294 1.00 22.76 O ATOM 1994 CB SER A 257 36.947 38.755 11.030 1.00 24.46 C ATOM 1995 OG SER A 257 37.661 37.833 10.222 1.00 26.04 O ATOM 0 H SER A 257 39.164 38.686 12.843 1.00 23.24 H new ATOM 0 HA SER A 257 36.563 39.148 13.039 1.00 24.22 H new ATOM 0 HB2 SER A 257 35.997 38.633 10.875 1.00 24.46 H new ATOM 0 HB3 SER A 257 37.168 39.655 10.744 1.00 24.46 H new ATOM 0 HG SER A 257 37.561 38.034 9.412 1.00 26.04 H new ATOM 1996 N LEU A 258 35.808 36.784 13.048 1.00 23.05 N ATOM 1997 CA LEU A 258 35.438 35.378 13.254 1.00 22.88 C ATOM 1998 C LEU A 258 35.075 34.778 11.906 1.00 22.98 C ATOM 1999 O LEU A 258 34.069 35.111 11.291 1.00 23.12 O ATOM 2000 CB LEU A 258 34.274 35.203 14.231 1.00 23.08 C ATOM 2001 CG LEU A 258 34.054 33.737 14.641 1.00 23.00 C ATOM 2002 CD1 LEU A 258 35.257 33.253 15.461 1.00 18.53 C ATOM 2003 CD2 LEU A 258 32.764 33.573 15.416 1.00 22.20 C ATOM 0 H LEU A 258 35.137 37.318 12.982 1.00 23.05 H new ATOM 0 HA LEU A 258 36.198 34.923 13.649 1.00 22.88 H new ATOM 0 HB2 LEU A 258 34.441 35.735 15.025 1.00 23.08 H new ATOM 0 HB3 LEU A 258 33.462 35.546 13.825 1.00 23.08 H new ATOM 0 HG LEU A 258 33.977 33.194 13.841 1.00 23.00 H new ATOM 0 HD11 LEU A 258 35.121 32.328 15.721 1.00 18.53 H new ATOM 0 HD12 LEU A 258 36.063 33.323 14.926 1.00 18.53 H new ATOM 0 HD13 LEU A 258 35.349 33.802 16.256 1.00 18.53 H new ATOM 0 HD21 LEU A 258 32.650 32.642 15.662 1.00 22.20 H new ATOM 0 HD22 LEU A 258 32.797 34.117 16.219 1.00 22.20 H new ATOM 0 HD23 LEU A 258 32.017 33.855 14.865 1.00 22.20 H new ATOM 2004 N THR A 259 35.901 33.854 11.471 1.00 22.20 N ATOM 2005 CA THR A 259 35.740 33.244 10.171 1.00 21.69 C ATOM 2006 C THR A 259 35.087 31.899 10.283 1.00 21.44 C ATOM 2007 O THR A 259 35.249 31.209 11.293 1.00 20.29 O ATOM 2008 CB THR A 259 37.131 33.092 9.456 1.00 22.55 C ATOM 2009 OG1 THR A 259 37.921 32.081 10.096 1.00 22.61 O ATOM 2010 CG2 THR A 259 37.907 34.440 9.432 1.00 22.92 C ATOM 0 H THR A 259 36.573 33.561 11.920 1.00 22.20 H new ATOM 0 HA THR A 259 35.170 33.825 9.643 1.00 21.69 H new ATOM 0 HB THR A 259 36.961 32.825 8.539 1.00 22.55 H new ATOM 0 HG1 THR A 259 37.730 32.051 10.913 1.00 22.61 H new ATOM 0 HG21 THR A 259 38.759 34.315 8.986 1.00 22.92 H new ATOM 0 HG22 THR A 259 37.387 35.105 8.954 1.00 22.92 H new ATOM 0 HG23 THR A 259 38.060 34.742 10.341 1.00 22.92 H new ATOM 2011 N VAL A 260 34.336 31.568 9.231 1.00 20.21 N ATOM 2012 CA VAL A 260 33.639 30.275 9.078 1.00 20.55 C ATOM 2013 C VAL A 260 34.206 29.443 7.924 1.00 19.57 C ATOM 2014 O VAL A 260 34.272 29.854 6.765 1.00 20.23 O ATOM 2015 CB VAL A 260 32.077 30.456 8.905 1.00 20.42 C ATOM 2016 CG1 VAL A 260 31.335 29.096 8.891 1.00 19.37 C ATOM 2017 CG2 VAL A 260 31.547 31.375 9.958 1.00 21.60 C ATOM 0 H VAL A 260 34.211 32.099 8.566 1.00 20.21 H new ATOM 0 HA VAL A 260 33.797 29.790 9.903 1.00 20.55 H new ATOM 0 HB VAL A 260 31.912 30.862 8.040 1.00 20.42 H new ATOM 0 HG11 VAL A 260 30.383 29.248 8.784 1.00 19.37 H new ATOM 0 HG12 VAL A 260 31.661 28.557 8.154 1.00 19.37 H new ATOM 0 HG13 VAL A 260 31.496 28.631 9.727 1.00 19.37 H new ATOM 0 HG21 VAL A 260 30.589 31.480 9.844 1.00 21.60 H new ATOM 0 HG22 VAL A 260 31.729 31.002 10.835 1.00 21.60 H new ATOM 0 HG23 VAL A 260 31.978 32.240 9.879 1.00 21.60 H new ATOM 2018 N TRP A 261 34.637 28.253 8.315 1.00 19.45 N ATOM 2019 CA TRP A 261 35.173 27.215 7.430 1.00 19.45 C ATOM 2020 C TRP A 261 34.235 26.014 7.286 1.00 19.34 C ATOM 2021 O TRP A 261 33.544 25.611 8.222 1.00 20.20 O ATOM 2022 CB TRP A 261 36.541 26.780 7.945 1.00 20.48 C ATOM 2023 CG TRP A 261 37.560 27.889 7.838 1.00 22.47 C ATOM 2024 CD1 TRP A 261 37.586 29.032 8.585 1.00 20.54 C ATOM 2025 CD2 TRP A 261 38.658 27.994 6.910 1.00 23.90 C ATOM 2026 NE1 TRP A 261 38.640 29.833 8.202 1.00 22.40 N ATOM 2027 CE2 TRP A 261 39.309 29.229 7.171 1.00 21.39 C ATOM 2028 CE3 TRP A 261 39.164 27.168 5.900 1.00 24.59 C ATOM 2029 CZ2 TRP A 261 40.436 29.639 6.476 1.00 21.47 C ATOM 2030 CZ3 TRP A 261 40.280 27.590 5.183 1.00 22.75 C ATOM 2031 CH2 TRP A 261 40.906 28.815 5.469 1.00 22.67 C ATOM 0 H TRP A 261 34.627 28.012 9.141 1.00 19.45 H new ATOM 0 HA TRP A 261 35.258 27.594 6.541 1.00 19.45 H new ATOM 0 HB2 TRP A 261 36.464 26.500 8.870 1.00 20.48 H new ATOM 0 HB3 TRP A 261 36.847 26.010 7.440 1.00 20.48 H new ATOM 0 HD1 TRP A 261 36.978 29.240 9.257 1.00 20.54 H new ATOM 0 HE1 TRP A 261 38.845 30.591 8.554 1.00 22.40 H new ATOM 0 HE3 TRP A 261 38.762 26.351 5.711 1.00 24.59 H new ATOM 0 HZ2 TRP A 261 40.862 30.440 6.680 1.00 21.47 H new ATOM 0 HZ3 TRP A 261 40.617 27.052 4.503 1.00 22.75 H new ATOM 0 HH2 TRP A 261 41.648 29.076 4.973 1.00 22.67 H new ATOM 2032 N GLU A 262 34.209 25.476 6.082 1.00 19.05 N ATOM 2033 CA GLU A 262 33.432 24.315 5.752 1.00 19.47 C ATOM 2034 C GLU A 262 34.212 23.244 4.980 1.00 20.07 C ATOM 2035 O GLU A 262 35.078 23.505 4.108 1.00 20.38 O ATOM 2036 CB GLU A 262 32.130 24.739 5.002 1.00 18.82 C ATOM 2037 CG GLU A 262 31.182 23.630 4.625 1.00 20.92 C ATOM 2038 CD GLU A 262 29.960 24.184 3.879 1.00 26.46 C ATOM 2039 OE1 GLU A 262 29.177 24.906 4.511 1.00 28.06 O ATOM 2040 OE2 GLU A 262 29.822 23.954 2.653 1.00 27.94 O ATOM 0 H GLU A 262 34.658 25.789 5.419 1.00 19.05 H new ATOM 0 HA GLU A 262 33.192 23.890 6.590 1.00 19.47 H new ATOM 0 HB2 GLU A 262 31.651 25.372 5.559 1.00 18.82 H new ATOM 0 HB3 GLU A 262 32.385 25.209 4.193 1.00 18.82 H new ATOM 0 HG2 GLU A 262 31.641 22.983 4.066 1.00 20.92 H new ATOM 0 HG3 GLU A 262 30.893 23.161 5.423 1.00 20.92 H new ATOM 2041 N TYR A 263 33.923 22.031 5.421 1.00 20.90 N ATOM 2042 CA TYR A 263 34.434 20.769 4.899 1.00 20.83 C ATOM 2043 C TYR A 263 33.252 19.979 4.284 1.00 22.86 C ATOM 2044 O TYR A 263 32.165 19.836 4.877 1.00 21.60 O ATOM 2045 CB TYR A 263 35.053 19.949 6.008 1.00 20.39 C ATOM 2046 CG TYR A 263 35.590 18.585 5.573 1.00 21.13 C ATOM 2047 CD1 TYR A 263 34.724 17.509 5.344 1.00 22.49 C ATOM 2048 CD2 TYR A 263 36.955 18.392 5.344 1.00 19.61 C ATOM 2049 CE1 TYR A 263 35.225 16.264 4.936 1.00 20.66 C ATOM 2050 CE2 TYR A 263 37.450 17.177 4.935 1.00 24.58 C ATOM 2051 CZ TYR A 263 36.575 16.108 4.739 1.00 24.09 C ATOM 2052 OH TYR A 263 37.089 14.904 4.295 1.00 24.06 O ATOM 0 H TYR A 263 33.384 21.912 6.081 1.00 20.90 H new ATOM 0 HA TYR A 263 35.113 20.949 4.230 1.00 20.83 H new ATOM 0 HB2 TYR A 263 35.779 20.457 6.403 1.00 20.39 H new ATOM 0 HB3 TYR A 263 34.390 19.815 6.703 1.00 20.39 H new ATOM 0 HD1 TYR A 263 33.808 17.621 5.463 1.00 22.49 H new ATOM 0 HD2 TYR A 263 37.542 19.102 5.471 1.00 19.61 H new ATOM 0 HE1 TYR A 263 34.647 15.549 4.800 1.00 20.66 H new ATOM 0 HE2 TYR A 263 38.362 17.068 4.790 1.00 24.58 H new ATOM 0 HH TYR A 263 37.846 15.031 3.953 1.00 24.06 H new ATOM 2053 N ARG A 264 33.490 19.479 3.078 1.00 23.34 N ATOM 2054 CA ARG A 264 32.497 18.647 2.363 1.00 24.98 C ATOM 2055 C ARG A 264 32.989 17.236 2.131 1.00 24.60 C ATOM 2056 O ARG A 264 34.055 17.048 1.608 1.00 25.67 O ATOM 2057 CB ARG A 264 32.235 19.235 0.991 1.00 25.89 C ATOM 2058 CG ARG A 264 31.517 20.567 1.008 1.00 29.85 C ATOM 2059 CD ARG A 264 30.022 20.359 1.099 1.00 36.22 C ATOM 2060 NE ARG A 264 29.270 21.189 0.147 1.00 38.19 N ATOM 2061 CZ ARG A 264 28.522 20.712 -0.849 1.00 37.92 C ATOM 2062 NH1 ARG A 264 28.369 19.406 -1.052 1.00 40.12 N ATOM 2063 NH2 ARG A 264 27.881 21.554 -1.627 1.00 37.53 N ATOM 0 H ARG A 264 34.222 19.605 2.645 1.00 23.34 H new ATOM 0 HA ARG A 264 31.702 18.630 2.919 1.00 24.98 H new ATOM 0 HB2 ARG A 264 33.082 19.342 0.530 1.00 25.89 H new ATOM 0 HB3 ARG A 264 31.710 18.603 0.475 1.00 25.89 H new ATOM 0 HG2 ARG A 264 31.822 21.096 1.762 1.00 29.85 H new ATOM 0 HG3 ARG A 264 31.732 21.067 0.205 1.00 29.85 H new ATOM 0 HD2 ARG A 264 29.820 19.424 0.936 1.00 36.22 H new ATOM 0 HD3 ARG A 264 29.726 20.561 2.001 1.00 36.22 H new ATOM 0 HE ARG A 264 29.316 22.043 0.239 1.00 38.19 H new ATOM 0 HH11 ARG A 264 28.758 18.842 -0.533 1.00 40.12 H new ATOM 0 HH12 ARG A 264 27.881 19.126 -1.702 1.00 40.12 H new ATOM 0 HH21 ARG A 264 27.947 22.401 -1.491 1.00 37.53 H new ATOM 0 HH22 ARG A 264 27.396 21.259 -2.273 1.00 37.53 H new ATOM 2064 N TYR A 265 32.190 16.258 2.502 1.00 23.92 N ATOM 2065 CA TYR A 265 32.526 14.862 2.193 1.00 23.31 C ATOM 2066 C TYR A 265 32.357 14.535 0.711 1.00 23.78 C ATOM 2067 O TYR A 265 32.949 13.550 0.232 1.00 22.58 O ATOM 2068 CB TYR A 265 31.736 13.885 3.039 1.00 22.89 C ATOM 2069 CG TYR A 265 32.194 13.865 4.458 1.00 22.05 C ATOM 2070 CD1 TYR A 265 33.277 13.091 4.849 1.00 20.49 C ATOM 2071 CD2 TYR A 265 31.577 14.645 5.403 1.00 20.69 C ATOM 2072 CE1 TYR A 265 33.705 13.092 6.131 1.00 19.14 C ATOM 2073 CE2 TYR A 265 31.976 14.613 6.708 1.00 16.17 C ATOM 2074 CZ TYR A 265 33.035 13.844 7.068 1.00 15.17 C ATOM 2075 OH TYR A 265 33.441 13.812 8.375 1.00 17.56 O ATOM 2076 OXT TYR A 265 31.640 15.233 -0.029 1.00 24.46 O ATOM 0 H TYR A 265 31.452 16.367 2.930 1.00 23.92 H new ATOM 0 HA TYR A 265 33.465 14.762 2.413 1.00 23.31 H new ATOM 0 HB2 TYR A 265 30.796 14.121 3.008 1.00 22.89 H new ATOM 0 HB3 TYR A 265 31.818 12.995 2.662 1.00 22.89 H new ATOM 0 HD1 TYR A 265 33.715 12.564 4.220 1.00 20.49 H new ATOM 0 HD2 TYR A 265 30.877 15.203 5.151 1.00 20.69 H new ATOM 0 HE1 TYR A 265 34.447 12.588 6.378 1.00 19.14 H new ATOM 0 HE2 TYR A 265 31.525 15.116 7.347 1.00 16.17 H new ATOM 0 HH TYR A 265 33.663 13.028 8.581 1.00 17.56 H new TER 2077 TYR A 265 HETATM 2078 N NO3 A 266 37.399 27.668 22.586 1.00 25.36 N HETATM 2079 O1 NO3 A 266 37.600 26.369 22.962 1.00 26.16 O HETATM 2080 O2 NO3 A 266 37.598 28.666 23.482 1.00 27.41 O HETATM 2081 O3 NO3 A 266 37.084 27.974 21.297 1.00 25.36 O HETATM 2082 N NO3 A 267 24.357 17.840 5.411 1.00 37.70 N HETATM 2083 O1 NO3 A 267 24.225 16.484 5.628 1.00 36.60 O HETATM 2084 O2 NO3 A 267 23.233 18.604 5.151 1.00 39.66 O HETATM 2085 O3 NO3 A 267 25.587 18.470 5.426 1.00 38.70 O HETATM 2086 N NO3 A 268 38.662 24.707 15.017 1.00 47.62 N HETATM 2087 O1 NO3 A 268 38.117 23.653 15.735 1.00 47.15 O HETATM 2088 O2 NO3 A 268 37.913 25.874 14.813 1.00 46.53 O HETATM 2089 O3 NO3 A 268 39.977 24.615 14.540 1.00 48.85 O HETATM 2090 C1 EDO A 269 29.402 24.840 18.056 1.00 33.03 C HETATM 2091 O1 EDO A 269 28.437 24.471 19.031 1.00 32.32 O HETATM 2092 C2 EDO A 269 30.749 24.921 18.721 1.00 34.27 C HETATM 2093 O2 EDO A 269 31.119 23.660 19.226 1.00 30.93 O HETATM 0 HO2 EDO A 269 31.872 23.715 19.595 1.00 30.93 H new HETATM 0 HO1 EDO A 269 28.800 24.444 19.788 1.00 32.32 H new HETATM 0 H22 EDO A 269 31.413 25.230 18.085 1.00 34.27 H new HETATM 0 H21 EDO A 269 30.723 25.570 19.441 1.00 34.27 H new HETATM 0 H12 EDO A 269 29.420 24.189 17.337 1.00 33.03 H new HETATM 0 H11 EDO A 269 29.170 25.694 17.659 1.00 33.03 H new HETATM 2094 C1 EDO A 270 38.305 42.236 8.258 1.00 43.72 C HETATM 2095 O1 EDO A 270 37.470 41.161 7.780 1.00 43.68 O HETATM 2096 C2 EDO A 270 38.903 41.959 9.642 1.00 42.87 C HETATM 2097 O2 EDO A 270 40.183 41.321 9.531 1.00 42.22 O HETATM 0 HO2 EDO A 270 40.493 41.179 10.299 1.00 42.22 H new HETATM 0 HO1 EDO A 270 37.846 40.425 7.932 1.00 43.68 H new HETATM 0 H22 EDO A 270 38.994 42.792 10.131 1.00 42.87 H new HETATM 0 H21 EDO A 270 38.300 41.395 10.152 1.00 42.87 H new HETATM 0 H12 EDO A 270 39.024 42.387 7.625 1.00 43.72 H new HETATM 0 H11 EDO A 270 37.783 43.053 8.294 1.00 43.72 H new HETATM 2098 C1 EDO A 271 39.569 28.429 1.179 1.00 40.31 C HETATM 2099 O1 EDO A 271 39.748 29.449 2.165 1.00 36.28 O HETATM 2100 C2 EDO A 271 40.892 28.051 0.526 1.00 41.90 C HETATM 2101 O2 EDO A 271 40.914 26.640 0.206 1.00 46.42 O HETATM 0 HO2 EDO A 271 41.648 26.446 -0.154 1.00 46.42 H new HETATM 0 HO1 EDO A 271 39.946 29.096 2.901 1.00 36.28 H new HETATM 0 H22 EDO A 271 41.022 28.573 -0.281 1.00 41.90 H new HETATM 0 H21 EDO A 271 41.626 28.264 1.123 1.00 41.90 H new HETATM 0 H12 EDO A 271 39.173 27.645 1.590 1.00 40.31 H new HETATM 0 H11 EDO A 271 38.948 28.737 0.501 1.00 40.31 H new HETATM 2102 C1 EDO A 272 44.738 40.520 12.649 1.00 43.64 C HETATM 2103 O1 EDO A 272 44.161 40.644 13.960 1.00 43.81 O HETATM 2104 C2 EDO A 272 44.366 39.176 12.054 1.00 42.66 C HETATM 2105 O2 EDO A 272 42.992 39.320 11.769 1.00 41.66 O HETATM 0 HO2 EDO A 272 42.729 40.074 12.030 1.00 41.66 H new HETATM 0 HO1 EDO A 272 43.472 41.122 13.919 1.00 43.81 H new HETATM 0 H22 EDO A 272 44.880 38.984 11.254 1.00 42.66 H new HETATM 0 H21 EDO A 272 44.529 38.451 12.677 1.00 42.66 H new HETATM 0 H12 EDO A 272 44.421 41.236 12.077 1.00 43.64 H new HETATM 0 H11 EDO A 272 45.703 40.605 12.701 1.00 43.64 H new HETATM 2106 C1 EDO A 273 44.531 30.994 6.054 1.00 47.01 C HETATM 2107 O1 EDO A 273 45.729 30.843 6.835 1.00 44.53 O HETATM 2108 C2 EDO A 273 44.703 30.374 4.680 1.00 46.58 C HETATM 2109 O2 EDO A 273 44.977 28.989 4.855 1.00 49.30 O HETATM 0 HO2 EDO A 273 45.075 28.625 4.104 1.00 49.30 H new HETATM 0 HO1 EDO A 273 46.108 30.122 6.630 1.00 44.53 H new HETATM 0 H22 EDO A 273 43.900 30.497 4.150 1.00 46.58 H new HETATM 0 H21 EDO A 273 45.428 30.805 4.201 1.00 46.58 H new HETATM 0 H12 EDO A 273 43.786 30.574 6.512 1.00 47.01 H new HETATM 0 H11 EDO A 273 44.315 31.935 5.964 1.00 47.01 H new HETATM 2110 O HOH A 274 30.940 34.943 25.217 1.00 19.83 O HETATM 2111 O HOH A 275 24.081 38.557 37.615 1.00 20.57 O HETATM 2112 O HOH A 276 26.977 31.747 3.536 1.00 23.82 O HETATM 2113 O HOH A 277 40.509 30.214 19.340 1.00 20.06 O HETATM 2114 O HOH A 278 39.676 38.557 18.023 1.00 25.68 O HETATM 2115 O HOH A 279 50.626 11.637 26.852 1.00 23.59 O HETATM 2116 O HOH A 280 26.705 26.187 20.322 1.00 24.42 O HETATM 2117 O HOH A 281 35.978 19.985 1.620 1.00 22.74 O HETATM 2118 O HOH A 282 38.384 14.504 35.389 1.00 23.63 O HETATM 2119 O HOH A 283 31.281 24.874 31.541 1.00 17.32 O HETATM 2120 O HOH A 284 48.866 23.883 12.333 1.00 31.87 O HETATM 2121 O HOH A 285 31.470 27.610 17.505 1.00 22.72 O HETATM 2122 O HOH A 286 25.662 19.958 21.902 1.00 25.31 O HETATM 2123 O HOH A 287 47.427 21.017 18.809 1.00 25.84 O HETATM 2124 O HOH A 288 27.770 34.209 23.681 1.00 27.65 O HETATM 2125 O HOH A 289 39.783 14.543 37.869 1.00 29.94 O HETATM 2126 O HOH A 290 42.147 47.582 12.203 1.00 27.34 O HETATM 2127 O HOH A 291 38.547 30.599 21.104 1.00 20.60 O HETATM 2128 O HOH A 292 44.566 41.425 24.578 1.00 25.09 O HETATM 2129 O HOH A 293 29.797 11.759 4.482 1.00 27.90 O HETATM 2130 O HOH A 294 34.215 46.194 27.081 1.00 35.24 O HETATM 2131 O HOH A 295 24.936 41.306 30.677 1.00 26.77 O HETATM 2132 O HOH A 296 34.114 47.801 9.266 1.00 21.89 O HETATM 2133 O HOH A 297 35.031 27.100 19.787 1.00 21.03 O HETATM 2134 O HOH A 298 35.129 41.122 22.475 1.00 26.27 O HETATM 2135 O HOH A 299 12.179 36.207 18.170 1.00 29.93 O HETATM 2136 O HOH A 300 39.257 30.673 31.762 1.00 34.58 O HETATM 2137 O HOH A 301 56.381 30.439 21.472 1.00 35.20 O HETATM 2138 O HOH A 302 24.664 33.657 28.994 1.00 27.63 O HETATM 2139 O HOH A 303 40.015 34.848 26.454 1.00 29.93 O HETATM 2140 O HOH A 304 33.561 47.114 29.467 1.00 35.34 O HETATM 2141 O HOH A 305 29.723 34.094 27.463 1.00 31.00 O HETATM 2142 O HOH A 306 37.766 43.053 19.863 1.00 21.96 O HETATM 2143 O HOH A 307 37.791 25.002 18.358 1.00 26.79 O HETATM 2144 O HOH A 308 32.204 26.750 19.917 1.00 26.01 O HETATM 2145 O HOH A 309 41.342 33.908 6.979 1.00 39.68 O HETATM 2146 O HOH A 310 47.885 20.090 15.537 1.00 36.83 O HETATM 2147 O HOH A 311 21.580 21.991 16.649 1.00 38.33 O HETATM 2148 O HOH A 312 32.320 32.399 30.384 1.00 33.01 O HETATM 2149 O HOH A 313 17.155 46.557 8.804 1.00 40.87 O HETATM 2150 O HOH A 314 34.759 34.473 3.453 1.00 33.68 O HETATM 2151 O HOH A 315 35.809 26.894 17.041 1.00 20.65 O HETATM 2152 O HOH A 316 25.641 33.775 31.825 1.00 28.40 O HETATM 2153 O HOH A 317 39.723 28.628 29.268 1.00 26.06 O HETATM 2154 O HOH A 318 35.530 32.897 30.879 1.00 29.44 O HETATM 2155 O HOH A 319 32.536 28.562 33.363 1.00 35.88 O HETATM 2156 O HOH A 320 42.961 5.395 26.663 1.00 30.21 O HETATM 2157 O HOH A 321 30.240 33.972 30.197 1.00 25.39 O HETATM 2158 O HOH A 322 29.698 51.984 24.114 1.00 32.27 O HETATM 2159 O HOH A 323 34.634 11.995 1.177 1.00 41.20 O HETATM 2160 O HOH A 324 41.661 23.614 2.001 1.00 25.98 O HETATM 2161 O HOH A 325 24.870 31.822 22.436 1.00 27.37 O HETATM 2162 O HOH A 326 35.900 20.370 40.896 1.00 20.12 O HETATM 2163 O HOH A 327 37.698 8.300 14.363 1.00 27.11 O HETATM 2164 O HOH A 328 28.084 34.116 31.671 1.00 30.15 O HETATM 2165 O HOH A 329 27.904 24.402 31.210 1.00 32.99 O HETATM 2166 O HOH A 330 48.320 21.625 20.764 1.00 31.04 O HETATM 2167 O HOH A 331 43.894 27.405 18.927 1.00 20.60 O HETATM 2168 O HOH A 332 19.012 41.091 2.905 1.00 21.18 O HETATM 2169 O HOH A 333 39.732 27.693 15.937 1.00 23.84 O HETATM 2170 O HOH A 334 41.140 26.192 33.467 1.00 28.09 O HETATM 2171 O HOH A 335 42.089 41.228 17.490 1.00 32.57 O HETATM 2172 O HOH A 336 27.695 27.582 3.180 1.00 34.49 O HETATM 2173 O HOH A 337 40.202 50.010 14.627 1.00 29.32 O HETATM 2174 O HOH A 338 44.396 41.816 16.316 0.50 25.89 O HETATM 2175 O HOH A 339 31.241 9.394 34.370 1.00 35.14 O HETATM 2176 O HOH A 340 46.144 37.747 28.747 1.00 37.21 O HETATM 2177 O HOH A 341 27.069 23.579 33.737 1.00 27.03 O HETATM 2178 O HOH A 342 29.300 12.608 -0.219 1.00 38.21 O HETATM 2179 O HOH A 343 50.459 37.141 27.484 1.00 39.04 O HETATM 2180 O HOH A 344 24.064 17.053 17.651 1.00 30.61 O HETATM 2181 O HOH A 345 24.146 33.424 33.998 1.00 44.27 O HETATM 2182 O HOH A 346 40.311 27.123 18.746 1.00 30.00 O HETATM 2183 O HOH A 347 55.919 18.442 30.528 1.00 34.74 O HETATM 2184 O HOH A 348 19.176 46.684 12.039 1.00 31.03 O HETATM 2185 O HOH A 349 33.579 38.615 27.900 1.00 45.28 O HETATM 2186 O HOH A 350 53.092 15.802 32.522 1.00 33.01 O HETATM 2187 O HOH A 351 31.478 48.513 29.907 1.00 37.06 O HETATM 2188 O HOH A 352 23.985 10.525 6.885 1.00 33.18 O HETATM 2189 O HOH A 353 37.644 51.807 15.864 1.00 42.56 O HETATM 2190 O HOH A 354 31.200 10.288 2.594 1.00 41.14 O HETATM 2191 O HOH A 355 42.029 18.445 36.940 1.00 33.81 O HETATM 2192 O HOH A 356 44.279 14.867 31.572 1.00 42.67 O HETATM 2193 O HOH A 357 35.301 15.066 37.015 1.00 27.79 O HETATM 2194 O HOH A 358 42.114 25.622 19.691 1.00 43.24 O HETATM 2195 O HOH A 359 40.427 11.972 8.653 1.00 33.72 O HETATM 2196 O HOH A 360 25.336 24.369 21.545 1.00 32.26 O HETATM 2197 O HOH A 361 48.326 21.904 10.803 1.00 49.99 O HETATM 2198 O HOH A 362 25.826 20.508 33.572 1.00 41.12 O HETATM 2199 O HOH A 363 24.187 17.935 20.347 1.00 36.08 O HETATM 2200 O HOH A 364 41.225 15.741 5.391 1.00 37.42 O HETATM 2201 O HOH A 365 39.330 15.778 40.691 1.00 33.29 O HETATM 2202 O HOH A 366 32.686 36.912 3.686 1.00 38.41 O HETATM 2203 O HOH A 367 57.316 17.447 32.006 1.00 39.53 O HETATM 2204 O HOH A 368 38.889 25.805 20.180 1.00 40.69 O HETATM 2205 O HOH A 369 39.363 45.732 16.562 1.00 48.35 O HETATM 2206 O HOH A 370 18.305 23.525 5.787 1.00 43.14 O HETATM 2207 O HOH A 371 19.461 49.513 11.977 1.00 30.56 O HETATM 2208 O HOH A 372 22.451 56.072 14.501 1.00 37.70 O HETATM 2209 O HOH A 373 18.228 49.252 25.632 1.00 59.28 O HETATM 2210 O HOH A 374 38.923 11.109 33.565 1.00 40.68 O HETATM 2211 O HOH A 375 29.466 44.579 0.970 1.00 39.26 O HETATM 2212 O HOH A 376 24.418 12.080 5.136 1.00 45.54 O HETATM 2213 O HOH A 377 17.162 23.537 8.013 1.00 50.44 O HETATM 2214 O HOH A 378 26.118 33.068 17.703 1.00 34.49 O HETATM 2215 O HOH A 379 24.265 26.577 23.907 1.00 47.58 O HETATM 2216 O HOH A 380 28.196 54.946 9.785 1.00 39.38 O HETATM 2217 O HOH A 381 14.586 46.382 7.516 1.00 46.63 O HETATM 2218 O HOH A 382 39.454 32.729 32.888 1.00 45.47 O HETATM 2219 O HOH A 383 19.826 24.836 3.672 1.00 36.99 O HETATM 2220 O HOH A 384 24.273 24.545 26.243 1.00 49.87 O HETATM 2221 O HOH A 385 29.981 55.876 8.248 1.00 49.16 O HETATM 2222 O HOH A 386 38.041 32.867 28.630 1.00 45.53 O HETATM 2223 O HOH A 387 37.754 36.893 26.236 1.00 36.92 O HETATM 2224 O HOH A 388 15.645 45.467 21.779 1.00 48.31 O HETATM 2225 O HOH A 389 27.823 52.697 14.300 1.00 43.75 O HETATM 2226 O HOH A 390 26.502 48.186 6.483 1.00 32.88 O HETATM 2227 O HOH A 391 39.114 6.855 31.444 1.00 32.43 O HETATM 2228 O HOH A 392 23.847 47.759 6.987 1.00 35.86 O HETATM 2229 O HOH A 393 35.087 44.750 6.740 1.00 45.88 O HETATM 2230 O HOH A 394 55.287 24.044 22.207 1.00 44.70 O HETATM 2231 O HOH A 395 46.392 24.974 16.330 1.00 44.97 O HETATM 2232 O HOH A 396 36.367 12.604 3.162 1.00 43.44 O HETATM 2233 O HOH A 397 24.922 19.367 1.688 1.00 44.34 O HETATM 2234 O HOH A 398 26.401 43.199 32.802 1.00 45.80 O HETATM 2235 O HOH A 399 50.429 30.756 7.490 1.00 45.09 O HETATM 2236 O HOH A 400 25.707 50.791 7.964 1.00 37.45 O HETATM 2237 O HOH A 401 41.566 14.129 7.916 1.00 44.28 O HETATM 2238 O HOH A 402 38.487 43.302 15.789 1.00 31.30 O HETATM 2239 O HOH A 403 40.988 32.091 3.828 1.00 49.55 O HETATM 2240 O HOH A 404 39.561 14.253 4.248 1.00 29.02 O HETATM 2241 O HOH A 405 37.471 11.370 37.876 1.00 48.16 O HETATM 2242 O HOH A 406 28.501 12.403 28.667 1.00 43.88 O HETATM 2243 O HOH A 407 47.734 24.784 5.227 1.00 37.37 O HETATM 2244 O HOH A 408 31.796 36.193 31.898 1.00 49.93 O HETATM 2245 O HOH A 409 38.701 38.749 27.645 1.00 43.02 O HETATM 2246 O HOH A 410 24.011 30.705 26.012 1.00 45.71 O HETATM 2247 O HOH A 411 14.421 30.824 22.602 1.00 46.60 O HETATM 2248 O HOH A 412 29.332 16.723 0.487 1.00 30.50 O HETATM 2249 O HOH A 413 34.859 7.666 31.343 1.00 43.94 O HETATM 2250 O HOH A 414 39.651 36.207 6.382 1.00 45.92 O HETATM 2251 O HOH A 415 31.854 43.421 32.240 1.00 41.56 O HETATM 2252 O HOH A 416 30.705 40.516 24.791 1.00 17.35 O HETATM 2253 O HOH A 417 38.302 34.232 22.757 1.00 18.36 O HETATM 2254 O HOH A 418 40.670 28.300 26.438 1.00 19.61 O HETATM 2255 O HOH A 419 30.106 14.459 26.142 1.00 18.13 O HETATM 2256 O HOH A 420 33.410 26.364 15.906 1.00 19.69 O HETATM 2257 O HOH A 421 40.180 30.337 16.547 1.00 12.81 O HETATM 2258 O HOH A 422 29.558 38.564 3.908 1.00 22.47 O HETATM 2259 O HOH A 423 22.986 32.643 2.320 1.00 27.80 O CONECT 303 308 CONECT 308 303 309 CONECT 309 308 310 312 CONECT 310 309 311 316 CONECT 311 310 CONECT 312 309 313 CONECT 313 312 314 CONECT 314 313 315 CONECT 315 314 CONECT 316 310 CONECT 559 567 CONECT 567 559 568 CONECT 568 567 569 571 CONECT 569 568 570 575 CONECT 570 569 CONECT 571 568 572 CONECT 572 571 573 CONECT 573 572 574 CONECT 574 573 CONECT 575 569 CONECT 628 633 CONECT 633 628 634 CONECT 634 633 635 637 CONECT 635 634 636 641 CONECT 636 635 CONECT 637 634 638 CONECT 638 637 639 CONECT 639 638 640 CONECT 640 639 CONECT 641 635 CONECT 763 765 CONECT 765 763 766 CONECT 766 765 767 769 CONECT 767 766 768 773 CONECT 768 767 CONECT 769 766 770 CONECT 770 769 771 CONECT 771 770 772 CONECT 772 771 CONECT 773 767 CONECT 781 787 CONECT 787 781 788 CONECT 788 787 789 791 CONECT 789 788 790 795 CONECT 790 789 CONECT 791 788 792 CONECT 792 791 793 CONECT 793 792 794 CONECT 794 793 CONECT 795 789 CONECT 1327 1414 CONECT 1391 1401 CONECT 1401 1391 1402 CONECT 1402 1401 1403 1405 CONECT 1403 1402 1404 1409 CONECT 1404 1403 CONECT 1405 1402 1406 CONECT 1406 1405 1407 CONECT 1407 1406 1408 CONECT 1408 1407 CONECT 1409 1403 CONECT 1414 1327 CONECT 1808 1812 CONECT 1812 1808 1813 CONECT 1813 1812 1814 1816 CONECT 1814 1813 1815 1820 CONECT 1815 1814 CONECT 1816 1813 1817 CONECT 1817 1816 1818 CONECT 1818 1817 1819 CONECT 1819 1818 CONECT 1820 1814 CONECT 2078 2079 2080 2081 CONECT 2079 2078 CONECT 2080 2078 CONECT 2081 2078 CONECT 2082 2083 2084 2085 CONECT 2083 2082 CONECT 2084 2082 CONECT 2085 2082 CONECT 2086 2087 2088 2089 CONECT 2087 2086 CONECT 2088 2086 CONECT 2089 2086 CONECT 2090 2091 2092 CONECT 2091 2090 CONECT 2092 2090 2093 CONECT 2093 2092 CONECT 2094 2095 2096 CONECT 2095 2094 CONECT 2096 2094 2097 CONECT 2097 2096 CONECT 2098 2099 2100 CONECT 2099 2098 CONECT 2100 2098 2101 CONECT 2101 2100 CONECT 2102 2103 2104 CONECT 2103 2102 CONECT 2104 2102 2105 CONECT 2105 2104 CONECT 2106 2107 2108 CONECT 2107 2106 CONECT 2108 2106 2109 CONECT 2109 2108 END