USER MOD reduce.3.24.130724 H: found=0, std=0, add=1566, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER PROTEIN BINDING 03-JUN-10 3NBI TITLE CRYSTAL STRUCTURE OF HUMAN RMI1 N-TERMINUS COMPND MOL_ID: 1; COMPND 2 MOLECULE: RECQ-MEDIATED GENOME INSTABILITY PROTEIN 1; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: RMI1N, RESIDUES 2-213; COMPND 5 SYNONYM: BLM-ASSOCIATED PROTEIN OF 75 KDA, BLAP75, FAAP75; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: RMI1, C9ORF76; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 469008; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 0 EXPRESSION_SYSTEM_PLASMID: PET28B-SUMO KEYWDS OB-FOLD, RPA-LIKE, PROTEIN BINDING EXPDTA X-RAY DIFFRACTION AUTHOR F.WANG,Y.YANG,T.R.SINGH,V.BUSYGINA,R.GUO,K.WAN,W.WANG,P.SUNG, AUTHOR 2 A.R.MEETEI,M.LEI REVDAT 1 22-SEP-10 3NBI 0 JRNL AUTH F.WANG,Y.YANG,T.R.SINGH,V.BUSYGINA,R.GUO,K.WAN,W.WANG, JRNL AUTH 2 P.SUNG,A.R.MEETEI,M.LEI JRNL TITL CRYSTAL STRUCTURES OF RMI1 AND RMI2, TWO OB-FOLD REGULATORY JRNL TITL 2 SUBUNITS OF THE BLM COMPLEX. JRNL REF STRUCTURE V. 18 1159 2010 JRNL REFN ISSN 0969-2126 JRNL PMID 20826342 JRNL DOI 10.1016/J.STR.2010.06.008 REMARK 2 REMARK 2 RESOLUTION. 2.00 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.1 REMARK 3 AUTHORS : BRUNGER,ADAMS,CLORE,DELANO,GROS,GROSSE- REMARK 3 : KUNSTLEVE,JIANG,KUSZEWSKI,NILGES,PANNU, REMARK 3 : READ,RICE,SIMONSON,WARREN REMARK 3 REMARK 3 REFINEMENT TARGET : ENGH & HUBER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.00 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 50.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 98.7 REMARK 3 NUMBER OF REFLECTIONS : 29382 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : NULL REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING SET) : 0.222 REMARK 3 FREE R VALUE : 0.255 REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 FREE R VALUE TEST SET COUNT : 2827 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : NULL REMARK 3 BIN RESOLUTION RANGE HIGH (A) : NULL REMARK 3 BIN RESOLUTION RANGE LOW (A) : NULL REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 REFLECTIONS IN BIN (WORKING SET) : NULL REMARK 3 BIN R VALUE (WORKING SET) : NULL REMARK 3 BIN FREE R VALUE : NULL REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 BIN FREE R VALUE TEST SET COUNT : NULL REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1539 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 72 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 31.40 REMARK 3 MEAN B VALUE (OVERALL, A**2) : NULL REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM SIGMAA (A) : NULL REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM C-V SIGMAA (A) : NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.007 REMARK 3 BOND ANGLES (DEGREES) : 1.35 REMARK 3 DIHEDRAL ANGLES (DEGREES) : NULL REMARK 3 IMPROPER ANGLES (DEGREES) : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 REMARK 3 BULK SOLVENT MODELING. REMARK 3 METHOD USED : NULL REMARK 3 KSOL : NULL REMARK 3 BSOL : NULL REMARK 3 REMARK 3 NCS MODEL : NULL REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : NULL REMARK 3 TOPOLOGY FILE 1 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 3NBI COMPLIES WITH FORMAT V. 3.20, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 08-JUN-10. REMARK 100 THE RCSB ID CODE IS RCSB059621. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 28-AUG-09 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 8.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 21-ID-D REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.97872 REMARK 200 MONOCHROMATOR : GRAPHITE REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARMOSAIC 225 MM CCD REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 29430 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.000 REMARK 200 RESOLUTION RANGE LOW (A) : 100.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.1 REMARK 200 DATA REDUNDANCY : 14.000 REMARK 200 R MERGE (I) : 0.07300 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 48.9000 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 (%) : 94.7 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: SAD REMARK 200 SOFTWARE USED: SHARP REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 46.99 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.32 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: THE PRECIPITANT/WELL SOLUTION REMARK 280 CONTAINED 100 MM TRIS-HCL PH 8.5, 18% PEG 3350, 300 MM NASCN, 10 REMARK 280 MM NICL2 AND 10 MM DTT., VAPOR DIFFUSION, HANGING DROP, REMARK 280 TEMPERATURE 277.15K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 31 2 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z+1/3 REMARK 290 3555 -X+Y,-X,Z+2/3 REMARK 290 4555 Y,X,-Z REMARK 290 5555 X-Y,-Y,-Z+2/3 REMARK 290 6555 -X,-X+Y,-Z+1/3 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 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 39.15833 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 78.31667 REMARK 290 SMTRY1 4 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 4 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 5 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 78.31667 REMARK 290 SMTRY1 6 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 39.15833 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 SOFTWARE DETERMINED QUATERNARY STRUCTURE: MONOMERIC REMARK 350 SOFTWARE USED: PISA REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 SER A -2 REMARK 465 GLY A -1 REMARK 465 GLY A 0 REMARK 465 ARG A 1 REMARK 465 ASN A 110 REMARK 465 THR A 111 REMARK 465 THR A 112 REMARK 465 ASN A 113 REMARK 465 ASP A 114 REMARK 465 LEU A 115 REMARK 465 VAL A 116 REMARK 465 THR A 117 REMARK 465 ALA A 118 REMARK 465 GLU A 119 REMARK 465 LYS A 205 REMARK 465 VAL A 206 REMARK 465 LEU A 207 REMARK 465 ALA A 208 REMARK 465 ARG A 209 REMARK 465 LEU A 210 REMARK 465 ILE A 211 REMARK 465 GLY A 212 REMARK 465 GLU A 213 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 PRO A 126 C - N - CA ANGL. DEV. = 14.8 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ASN A 39 13.52 56.00 REMARK 500 ASN A 42 65.28 -119.62 REMARK 500 PRO A 126 94.97 -45.47 REMARK 500 TRP A 127 133.96 -31.68 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3NBH RELATED DB: PDB DBREF 3NBI A 2 213 UNP Q9H9A7 RMI1_HUMAN 2 213 SEQADV 3NBI SER A -2 UNP Q9H9A7 EXPRESSION TAG SEQADV 3NBI GLY A -1 UNP Q9H9A7 EXPRESSION TAG SEQADV 3NBI GLY A 0 UNP Q9H9A7 EXPRESSION TAG SEQADV 3NBI ARG A 1 UNP Q9H9A7 EXPRESSION TAG SEQRES 1 A 216 SER GLY GLY ARG ASN VAL THR SER ILE ALA LEU ARG ALA SEQRES 2 A 216 GLU THR TRP LEU LEU ALA ALA TRP HIS VAL LYS VAL PRO SEQRES 3 A 216 PRO MSE TRP LEU GLU ALA CYS ILE ASN TRP ILE GLN GLU SEQRES 4 A 216 GLU ASN ASN ASN VAL ASN LEU SER GLN ALA GLN MSE ASN SEQRES 5 A 216 LYS GLN VAL PHE GLU GLN TRP LEU LEU THR ASP LEU ARG SEQRES 6 A 216 ASP LEU GLU HIS PRO LEU LEU PRO ASP GLY ILE LEU GLU SEQRES 7 A 216 ILE PRO LYS GLY GLU LEU ASN GLY PHE TYR ALA LEU GLN SEQRES 8 A 216 ILE ASN SER LEU VAL ASP VAL SER GLN PRO ALA TYR SER SEQRES 9 A 216 GLN ILE GLN LYS LEU ARG GLY LYS ASN THR THR ASN ASP SEQRES 10 A 216 LEU VAL THR ALA GLU ALA GLN VAL THR PRO LYS PRO TRP SEQRES 11 A 216 GLU ALA LYS PRO SER ARG MSE LEU MSE LEU GLN LEU THR SEQRES 12 A 216 ASP GLY ILE VAL GLN ILE GLN GLY MSE GLU TYR GLN PRO SEQRES 13 A 216 ILE PRO ILE LEU HIS SER ASP LEU PRO PRO GLY THR LYS SEQRES 14 A 216 ILE LEU ILE TYR GLY ASN ILE SER PHE ARG LEU GLY VAL SEQRES 15 A 216 LEU LEU LEU LYS PRO GLU ASN VAL LYS VAL LEU GLY GLY SEQRES 16 A 216 GLU VAL ASP ALA LEU LEU GLU GLU TYR ALA GLN GLU LYS SEQRES 17 A 216 VAL LEU ALA ARG LEU ILE GLY GLU MODRES 3NBI MSE A 25 MET SELENOMETHIONINE MODRES 3NBI MSE A 48 MET SELENOMETHIONINE MODRES 3NBI MSE A 134 MET SELENOMETHIONINE MODRES 3NBI MSE A 136 MET SELENOMETHIONINE MODRES 3NBI MSE A 149 MET SELENOMETHIONINE HET MSE A 25 8 HET MSE A 48 8 HET MSE A 134 8 HET MSE A 136 8 HET MSE A 149 8 HETNAM MSE SELENOMETHIONINE FORMUL 1 MSE 5(C5 H11 N O2 SE) FORMUL 2 HOH *72(H2 O) HELIX 1 1 ASN A 2 HIS A 19 1 18 HELIX 2 2 PRO A 23 ASN A 39 1 17 HELIX 3 3 SER A 44 LEU A 58 1 15 HELIX 4 4 ASP A 60 GLU A 65 1 6 HELIX 5 5 VAL A 95 LYS A 109 1 15 HELIX 6 6 LYS A 183 GLU A 185 5 3 HELIX 7 7 VAL A 194 ALA A 202 1 9 SHEET 1 A 7 VAL A 187 GLY A 191 0 SHEET 2 A 7 LYS A 166 ARG A 176 -1 N LEU A 168 O LYS A 188 SHEET 3 A 7 VAL A 179 LEU A 182 -1 O LEU A 181 N SER A 174 SHEET 4 A 7 GLN A 145 GLU A 150 1 N GLN A 147 O LEU A 180 SHEET 5 A 7 LEU A 135 THR A 140 -1 N LEU A 137 O GLY A 148 SHEET 6 A 7 LYS A 78 ASP A 94 -1 N SER A 91 O GLN A 138 SHEET 7 A 7 LYS A 166 ARG A 176 -1 O ILE A 173 N LEU A 81 LINK C PRO A 24 N MSE A 25 1555 1555 1.33 LINK C MSE A 25 N TRP A 26 1555 1555 1.33 LINK C GLN A 47 N MSE A 48 1555 1555 1.33 LINK C MSE A 48 N ASN A 49 1555 1555 1.33 LINK C ARG A 133 N MSE A 134 1555 1555 1.33 LINK C MSE A 134 N LEU A 135 1555 1555 1.33 LINK C LEU A 135 N MSE A 136 1555 1555 1.33 LINK C MSE A 136 N LEU A 137 1555 1555 1.33 LINK C GLY A 148 N MSE A 149 1555 1555 1.32 LINK C MSE A 149 N GLU A 150 1555 1555 1.33 CRYST1 57.896 57.896 117.475 90.00 90.00 120.00 P 31 2 1 6 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 0.017272 0.009972 0.000000 0.00000 SCALE2 0.000000 0.019944 0.000000 0.00000 SCALE3 0.000000 0.000000 0.008512 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 152 GLN : amide:sc= -2.43! C(o=-6.7!,f=-15!) USER MOD Set 1.2: A 183 LYS NZ :NH3+ -152:sc= -4.27! (180deg=-2.92!) USER MOD Set 2.1: A 138 GLN : amide:sc= -4.94! K(o=-11!,f=2.1) USER MOD Set 2.2: A 147 GLN : amide:sc= -5.62! K(o=-11!,f=2.4) USER MOD Set 3.1: A 100 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 104 GLN : amide:sc= -1.04 K(o=-1,f=-0.27) USER MOD Set 4.1: A 88 GLN : amide:sc= 1.28 K(o=0.7,f=-6.4!) USER MOD Set 4.2: A 90 ASN : amide:sc= -0.578 K(o=0.7,f=-11!) USER MOD Set 5.1: A 82 ASN : amide:sc= 0.71 X(o=0.77,f=0.75) USER MOD Set 5.2: A 172 ASN : amide:sc= 0.0639 K(o=0.77,f=1.7) USER MOD Set 6.1: A 45 GLN : amide:sc= 0.462 K(o=0.49,f=-1.6) USER MOD Set 6.2: A 49 ASN : amide:sc= 0.0284 K(o=0.49,f=-3.4) USER MOD Set 7.1: A 38 ASN : amide:sc= -3.78 K(o=-3.9,f=-1.1) USER MOD Set 7.2: A 51 GLN : amide:sc= -0.131 K(o=-3.9,f=-2.4) USER MOD Single : A 2 ASN : amide:sc= -1.74! K(o=-1.7!,f=-0.059) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 12 THR OG1 : rot 78:sc= 0.468 USER MOD Single : A 19 HIS : no HD1:sc=-0.000565 X(o=-0.00057,f=0) USER MOD Single : A 21 LYS NZ :NH3+ -154:sc= 0.00922 (180deg=0) USER MOD Single : A 30 CYS SG : rot 154:sc= 0.0155 USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 ASN : amide:sc= -10.4! C(o=-10!,f=-1.8!) USER MOD Single : A 42 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 44 SER OG : rot 126:sc= 0.142 USER MOD Single : A 47 GLN : amide:sc= 0 X(o=0,f=-0.025) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 GLN : amide:sc= 0.637 K(o=0.64,f=0.032) USER MOD Single : A 59 THR OG1 : rot 84:sc= 1.36 USER MOD Single : A 66 HIS : no HD1:sc= -0.834 X(o=-0.83,f=-0.98) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 TYR OH : rot 151:sc= 1.39 USER MOD Single : A 91 SER OG : rot 100:sc= 1.1 USER MOD Single : A 96 SER OG : rot 173:sc= 0.219 USER MOD Single : A 97 GLN : amide:sc= -1.88! C(o=-1.9!,f=-1.8!) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 105 LYS NZ :NH3+ 173:sc= -0.0237 (180deg=-0.112) USER MOD Single : A 109 LYS NZ :NH3+ -154:sc= -1.4 (180deg=-2.49!) USER MOD Single : A 121 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 THR OG1 : rot 20:sc= 0.385 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 44:sc= 1.31 USER MOD Single : A 145 GLN : amide:sc=-0.00358 X(o=-0.0036,f=-0.0035) USER MOD Single : A 151 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 HIS : no HD1:sc= 0.00659 K(o=0.0066,f=-4.6!) USER MOD Single : A 159 SER OG : rot 180:sc= 0 USER MOD Single : A 165 THR OG1 : rot 42:sc= 2.1 USER MOD Single : A 166 LYS NZ :NH3+ -163:sc= 2.37 (180deg=1.81) USER MOD Single : A 170 TYR OH : rot 180:sc= 0 USER MOD Single : A 174 SER OG : rot -95:sc= 0.579 USER MOD Single : A 186 ASN : amide:sc= -2.21! K(o=-2.2!,f=0.23) USER MOD Single : A 188 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 201 TYR OH : rot 180:sc= 0 USER MOD Single : A 203 GLN : amide:sc= -0.81 X(o=-0.81,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 2 39.014 -9.564 27.987 1.00 70.60 N ATOM 2 CA ASN A 2 37.563 -9.338 27.736 1.00 72.24 C ATOM 3 C ASN A 2 37.378 -8.018 26.991 1.00 69.70 C ATOM 4 O ASN A 2 36.860 -7.990 25.877 1.00 66.92 O ATOM 5 CB ASN A 2 36.797 -9.290 29.062 1.00 73.28 C ATOM 6 CG ASN A 2 35.292 -9.382 28.873 1.00 80.28 C ATOM 7 OD1 ASN A 2 34.522 -9.106 29.792 1.00 84.19 O ATOM 8 ND2 ASN A 2 34.866 -9.785 27.681 1.00 90.72 N ATOM 0 HA ASN A 2 37.217 -10.068 27.200 1.00 72.24 H new ATOM 0 HB2 ASN A 2 37.093 -10.019 29.629 1.00 73.28 H new ATOM 0 HB3 ASN A 2 37.011 -8.465 29.525 1.00 73.28 H new ATOM 0 HD21 ASN A 2 34.023 -9.861 27.529 1.00 90.72 H new ATOM 0 HD22 ASN A 2 35.433 -9.970 27.061 1.00 90.72 H new ATOM 9 N VAL A 3 37.818 -6.930 27.617 1.00 70.08 N ATOM 10 CA VAL A 3 37.710 -5.593 27.041 1.00 64.81 C ATOM 11 C VAL A 3 38.637 -5.374 25.844 1.00 62.00 C ATOM 12 O VAL A 3 38.235 -4.793 24.837 1.00 51.50 O ATOM 13 CB VAL A 3 38.013 -4.519 28.107 1.00 66.24 C ATOM 14 CG1 VAL A 3 39.289 -4.877 28.851 1.00 64.79 C ATOM 15 CG2 VAL A 3 38.144 -3.149 27.453 1.00 67.27 C ATOM 0 H VAL A 3 38.190 -6.947 28.392 1.00 70.08 H new ATOM 0 HA VAL A 3 36.796 -5.513 26.725 1.00 64.81 H new ATOM 0 HB VAL A 3 37.280 -4.486 28.741 1.00 66.24 H new ATOM 0 HG11 VAL A 3 39.475 -4.199 29.520 1.00 64.79 H new ATOM 0 HG12 VAL A 3 39.180 -5.738 29.285 1.00 64.79 H new ATOM 0 HG13 VAL A 3 40.027 -4.923 28.224 1.00 64.79 H new ATOM 0 HG21 VAL A 3 38.334 -2.483 28.132 1.00 67.27 H new ATOM 0 HG22 VAL A 3 38.867 -3.167 26.807 1.00 67.27 H new ATOM 0 HG23 VAL A 3 37.314 -2.924 27.004 1.00 67.27 H new ATOM 16 N THR A 4 39.878 -5.830 25.956 1.00 59.08 N ATOM 17 CA THR A 4 40.831 -5.666 24.868 1.00 56.19 C ATOM 18 C THR A 4 40.405 -6.522 23.681 1.00 51.43 C ATOM 19 O THR A 4 40.599 -6.136 22.528 1.00 45.39 O ATOM 20 CB THR A 4 42.256 -6.056 25.308 1.00 61.03 C ATOM 21 OG1 THR A 4 42.618 -5.289 26.464 1.00 64.55 O ATOM 22 CG2 THR A 4 43.261 -5.774 24.188 1.00 67.28 C ATOM 0 H THR A 4 40.187 -6.235 26.649 1.00 59.08 H new ATOM 0 HA THR A 4 40.841 -4.731 24.612 1.00 56.19 H new ATOM 0 HB THR A 4 42.271 -7.004 25.513 1.00 61.03 H new ATOM 0 HG1 THR A 4 43.394 -5.499 26.708 1.00 64.55 H new ATOM 0 HG21 THR A 4 44.151 -6.025 24.481 1.00 67.28 H new ATOM 0 HG22 THR A 4 43.023 -6.290 23.402 1.00 67.28 H new ATOM 0 HG23 THR A 4 43.247 -4.829 23.971 1.00 67.28 H new ATOM 23 N SER A 5 39.816 -7.681 23.965 1.00 47.22 N ATOM 24 CA SER A 5 39.346 -8.565 22.906 1.00 49.93 C ATOM 25 C SER A 5 38.214 -7.857 22.164 1.00 41.70 C ATOM 26 O SER A 5 38.131 -7.916 20.938 1.00 37.28 O ATOM 27 CB SER A 5 38.835 -9.884 23.490 1.00 53.99 C ATOM 28 OG SER A 5 38.358 -10.741 22.466 1.00 58.89 O ATOM 0 H SER A 5 39.680 -7.972 24.763 1.00 47.22 H new ATOM 0 HA SER A 5 40.077 -8.767 22.301 1.00 49.93 H new ATOM 0 HB2 SER A 5 39.549 -10.324 23.978 1.00 53.99 H new ATOM 0 HB3 SER A 5 38.124 -9.707 24.125 1.00 53.99 H new ATOM 0 HG SER A 5 38.084 -11.459 22.806 1.00 58.89 H new ATOM 29 N ILE A 6 37.349 -7.188 22.921 1.00 37.76 N ATOM 30 CA ILE A 6 36.227 -6.450 22.350 1.00 40.82 C ATOM 31 C ILE A 6 36.765 -5.328 21.473 1.00 35.14 C ATOM 32 O ILE A 6 36.308 -5.126 20.347 1.00 34.62 O ATOM 33 CB ILE A 6 35.349 -5.812 23.456 1.00 44.05 C ATOM 34 CG1 ILE A 6 34.674 -6.900 24.288 1.00 41.76 C ATOM 35 CG2 ILE A 6 34.294 -4.902 22.832 1.00 39.45 C ATOM 36 CD1 ILE A 6 33.972 -6.361 25.521 1.00 56.94 C ATOM 0 H ILE A 6 37.396 -7.149 23.779 1.00 37.76 H new ATOM 0 HA ILE A 6 35.689 -7.073 21.837 1.00 40.82 H new ATOM 0 HB ILE A 6 35.918 -5.282 24.036 1.00 44.05 H new ATOM 0 HG12 ILE A 6 34.029 -7.369 23.735 1.00 41.76 H new ATOM 0 HG13 ILE A 6 35.340 -7.550 24.561 1.00 41.76 H new ATOM 0 HG21 ILE A 6 33.751 -4.508 23.533 1.00 39.45 H new ATOM 0 HG22 ILE A 6 34.731 -4.198 22.328 1.00 39.45 H new ATOM 0 HG23 ILE A 6 33.729 -5.421 22.238 1.00 39.45 H new ATOM 0 HD11 ILE A 6 33.564 -7.094 26.008 1.00 56.94 H new ATOM 0 HD12 ILE A 6 34.617 -5.914 26.091 1.00 56.94 H new ATOM 0 HD13 ILE A 6 33.286 -5.730 25.253 1.00 56.94 H new ATOM 37 N ALA A 7 37.740 -4.601 22.008 1.00 33.24 N ATOM 38 CA ALA A 7 38.354 -3.486 21.307 1.00 29.11 C ATOM 39 C ALA A 7 39.007 -3.910 19.996 1.00 35.02 C ATOM 40 O ALA A 7 38.845 -3.245 18.972 1.00 33.78 O ATOM 41 CB ALA A 7 39.386 -2.808 22.209 1.00 28.26 C ATOM 0 H ALA A 7 38.064 -4.743 22.792 1.00 33.24 H new ATOM 0 HA ALA A 7 37.647 -2.860 21.086 1.00 29.11 H new ATOM 0 HB1 ALA A 7 39.792 -2.065 21.735 1.00 28.26 H new ATOM 0 HB2 ALA A 7 38.950 -2.480 23.011 1.00 28.26 H new ATOM 0 HB3 ALA A 7 40.072 -3.448 22.454 1.00 28.26 H new ATOM 42 N LEU A 8 39.742 -5.017 20.026 1.00 30.68 N ATOM 43 CA LEU A 8 40.429 -5.493 18.833 1.00 35.93 C ATOM 44 C LEU A 8 39.450 -5.903 17.737 1.00 32.72 C ATOM 45 O LEU A 8 39.690 -5.644 16.557 1.00 35.29 O ATOM 46 CB LEU A 8 41.353 -6.665 19.184 1.00 44.89 C ATOM 47 CG LEU A 8 42.235 -7.183 18.043 1.00 57.47 C ATOM 48 CD1 LEU A 8 43.118 -6.054 17.505 1.00 45.88 C ATOM 49 CD2 LEU A 8 43.085 -8.342 18.551 1.00 56.84 C ATOM 0 H LEU A 8 39.855 -5.505 20.725 1.00 30.68 H new ATOM 0 HA LEU A 8 40.961 -4.758 18.490 1.00 35.93 H new ATOM 0 HB2 LEU A 8 41.928 -6.394 19.917 1.00 44.89 H new ATOM 0 HB3 LEU A 8 40.808 -7.399 19.508 1.00 44.89 H new ATOM 0 HG LEU A 8 41.676 -7.498 17.316 1.00 57.47 H new ATOM 0 HD11 LEU A 8 43.672 -6.392 16.784 1.00 45.88 H new ATOM 0 HD12 LEU A 8 42.558 -5.335 17.172 1.00 45.88 H new ATOM 0 HD13 LEU A 8 43.685 -5.719 18.217 1.00 45.88 H new ATOM 0 HD21 LEU A 8 43.645 -8.673 17.831 1.00 56.84 H new ATOM 0 HD22 LEU A 8 43.645 -8.037 19.282 1.00 56.84 H new ATOM 0 HD23 LEU A 8 42.507 -9.055 18.864 1.00 56.84 H new ATOM 50 N ARG A 9 38.349 -6.536 18.130 1.00 28.90 N ATOM 51 CA ARG A 9 37.336 -6.967 17.172 1.00 34.28 C ATOM 52 C ARG A 9 36.597 -5.751 16.613 1.00 26.92 C ATOM 53 O ARG A 9 36.267 -5.719 15.435 1.00 28.85 O ATOM 54 CB ARG A 9 36.343 -7.934 17.834 1.00 28.12 C ATOM 55 CG ARG A 9 36.986 -9.209 18.361 1.00 43.26 C ATOM 56 CD ARG A 9 35.972 -10.119 19.049 1.00 48.56 C ATOM 57 NE ARG A 9 34.860 -10.453 18.164 1.00 66.12 N ATOM 58 CZ ARG A 9 33.855 -11.263 18.487 1.00 68.97 C ATOM 59 NH1 ARG A 9 33.815 -11.837 19.684 1.00 69.36 N ATOM 60 NH2 ARG A 9 32.884 -11.496 17.613 1.00 65.50 N ATOM 0 H ARG A 9 38.169 -6.726 18.949 1.00 28.90 H new ATOM 0 HA ARG A 9 37.776 -7.433 16.443 1.00 34.28 H new ATOM 0 HB2 ARG A 9 35.900 -7.478 18.567 1.00 28.12 H new ATOM 0 HB3 ARG A 9 35.656 -8.170 17.191 1.00 28.12 H new ATOM 0 HG2 ARG A 9 37.403 -9.687 17.627 1.00 43.26 H new ATOM 0 HG3 ARG A 9 37.691 -8.980 18.987 1.00 43.26 H new ATOM 0 HD2 ARG A 9 36.412 -10.934 19.338 1.00 48.56 H new ATOM 0 HD3 ARG A 9 35.632 -9.682 19.845 1.00 48.56 H new ATOM 0 HE ARG A 9 34.854 -10.102 17.379 1.00 66.12 H new ATOM 0 HH11 ARG A 9 34.441 -11.686 20.254 1.00 69.36 H new ATOM 0 HH12 ARG A 9 33.164 -12.360 19.889 1.00 69.36 H new ATOM 0 HH21 ARG A 9 32.904 -11.124 16.838 1.00 65.50 H new ATOM 0 HH22 ARG A 9 32.234 -12.019 17.821 1.00 65.50 H new ATOM 61 N ALA A 10 36.342 -4.754 17.460 1.00 24.03 N ATOM 62 CA ALA A 10 35.655 -3.540 17.016 1.00 26.17 C ATOM 63 C ALA A 10 36.563 -2.740 16.077 1.00 26.00 C ATOM 64 O ALA A 10 36.109 -2.182 15.076 1.00 25.93 O ATOM 65 CB ALA A 10 35.270 -2.679 18.213 1.00 29.40 C ATOM 0 H ALA A 10 36.557 -4.760 18.293 1.00 24.03 H new ATOM 0 HA ALA A 10 34.849 -3.797 16.542 1.00 26.17 H new ATOM 0 HB1 ALA A 10 34.816 -1.879 17.904 1.00 29.40 H new ATOM 0 HB2 ALA A 10 34.679 -3.181 18.796 1.00 29.40 H new ATOM 0 HB3 ALA A 10 36.069 -2.428 18.702 1.00 29.40 H new ATOM 66 N GLU A 11 37.848 -2.685 16.412 1.00 22.03 N ATOM 67 CA GLU A 11 38.812 -1.959 15.598 1.00 29.22 C ATOM 68 C GLU A 11 38.943 -2.624 14.223 1.00 34.29 C ATOM 69 O GLU A 11 38.981 -1.945 13.195 1.00 27.75 O ATOM 70 CB GLU A 11 40.178 -1.904 16.302 1.00 30.41 C ATOM 71 CG GLU A 11 41.260 -1.246 15.465 1.00 27.12 C ATOM 72 CD GLU A 11 42.575 -1.087 16.205 1.00 41.49 C ATOM 73 OE1 GLU A 11 42.874 -1.924 17.081 1.00 37.18 O ATOM 74 OE2 GLU A 11 43.317 -0.130 15.897 1.00 39.26 O ATOM 0 H GLU A 11 38.181 -3.063 17.109 1.00 22.03 H new ATOM 0 HA GLU A 11 38.496 -1.050 15.476 1.00 29.22 H new ATOM 0 HB2 GLU A 11 40.085 -1.420 17.137 1.00 30.41 H new ATOM 0 HB3 GLU A 11 40.455 -2.806 16.527 1.00 30.41 H new ATOM 0 HG2 GLU A 11 41.408 -1.774 14.665 1.00 27.12 H new ATOM 0 HG3 GLU A 11 40.951 -0.373 15.176 1.00 27.12 H new ATOM 75 N THR A 12 39.005 -3.952 14.207 1.00 28.60 N ATOM 76 CA THR A 12 39.107 -4.692 12.951 1.00 29.33 C ATOM 77 C THR A 12 37.849 -4.472 12.101 1.00 27.07 C ATOM 78 O THR A 12 37.925 -4.300 10.883 1.00 28.25 O ATOM 79 CB THR A 12 39.268 -6.207 13.207 1.00 33.63 C ATOM 80 OG1 THR A 12 40.506 -6.452 13.886 1.00 28.88 O ATOM 81 CG2 THR A 12 39.260 -6.972 11.893 1.00 33.44 C ATOM 0 H THR A 12 38.990 -4.444 14.912 1.00 28.60 H new ATOM 0 HA THR A 12 39.889 -4.362 12.482 1.00 29.33 H new ATOM 0 HB THR A 12 38.526 -6.509 13.754 1.00 33.63 H new ATOM 0 HG1 THR A 12 40.424 -6.256 14.699 1.00 28.88 H new ATOM 0 HG21 THR A 12 39.362 -7.920 12.070 1.00 33.44 H new ATOM 0 HG22 THR A 12 38.420 -6.818 11.434 1.00 33.44 H new ATOM 0 HG23 THR A 12 39.993 -6.667 11.336 1.00 33.44 H new ATOM 82 N TRP A 13 36.697 -4.459 12.759 1.00 26.43 N ATOM 83 CA TRP A 13 35.422 -4.266 12.074 1.00 29.97 C ATOM 84 C TRP A 13 35.293 -2.859 11.482 1.00 28.88 C ATOM 85 O TRP A 13 34.798 -2.692 10.366 1.00 26.71 O ATOM 86 CB TRP A 13 34.271 -4.531 13.048 1.00 29.36 C ATOM 87 CG TRP A 13 32.933 -4.453 12.413 1.00 30.41 C ATOM 88 CD1 TRP A 13 32.316 -5.416 11.661 1.00 39.37 C ATOM 89 CD2 TRP A 13 32.053 -3.332 12.430 1.00 32.19 C ATOM 90 NE1 TRP A 13 31.103 -4.956 11.209 1.00 36.75 N ATOM 91 CE2 TRP A 13 30.918 -3.679 11.666 1.00 34.89 C ATOM 92 CE3 TRP A 13 32.112 -2.064 13.019 1.00 30.74 C ATOM 93 CZ2 TRP A 13 29.851 -2.799 11.475 1.00 46.09 C ATOM 94 CZ3 TRP A 13 31.048 -1.190 12.828 1.00 32.99 C ATOM 95 CH2 TRP A 13 29.936 -1.563 12.063 1.00 36.79 C ATOM 0 H TRP A 13 36.630 -4.561 13.610 1.00 26.43 H new ATOM 0 HA TRP A 13 35.384 -4.895 11.337 1.00 29.97 H new ATOM 0 HB2 TRP A 13 34.384 -5.411 13.441 1.00 29.36 H new ATOM 0 HB3 TRP A 13 34.315 -3.889 13.773 1.00 29.36 H new ATOM 0 HD1 TRP A 13 32.667 -6.259 11.482 1.00 39.37 H new ATOM 0 HE1 TRP A 13 30.551 -5.398 10.720 1.00 36.75 H new ATOM 0 HE3 TRP A 13 32.848 -1.811 13.528 1.00 30.74 H new ATOM 0 HZ2 TRP A 13 29.110 -3.042 10.968 1.00 46.09 H new ATOM 0 HZ3 TRP A 13 31.075 -0.344 13.214 1.00 32.99 H new ATOM 0 HH2 TRP A 13 29.239 -0.958 11.951 1.00 36.79 H new ATOM 96 N LEU A 14 35.733 -1.853 12.231 1.00 26.74 N ATOM 97 CA LEU A 14 35.668 -0.466 11.770 1.00 24.38 C ATOM 98 C LEU A 14 36.506 -0.285 10.513 1.00 20.30 C ATOM 99 O LEU A 14 36.079 0.363 9.550 1.00 24.56 O ATOM 100 CB LEU A 14 36.185 0.494 12.850 1.00 23.97 C ATOM 101 CG LEU A 14 35.291 0.824 14.042 1.00 26.25 C ATOM 102 CD1 LEU A 14 36.109 1.614 15.079 1.00 22.04 C ATOM 103 CD2 LEU A 14 34.073 1.623 13.581 1.00 28.36 C ATOM 0 H LEU A 14 36.075 -1.951 13.014 1.00 26.74 H new ATOM 0 HA LEU A 14 34.739 -0.263 11.578 1.00 24.38 H new ATOM 0 HB2 LEU A 14 37.011 0.124 13.198 1.00 23.97 H new ATOM 0 HB3 LEU A 14 36.410 1.330 12.414 1.00 23.97 H new ATOM 0 HG LEU A 14 34.971 0.005 14.451 1.00 26.25 H new ATOM 0 HD11 LEU A 14 35.547 1.828 15.840 1.00 22.04 H new ATOM 0 HD12 LEU A 14 36.862 1.078 15.374 1.00 22.04 H new ATOM 0 HD13 LEU A 14 36.434 2.435 14.678 1.00 22.04 H new ATOM 0 HD21 LEU A 14 33.512 1.827 14.345 1.00 28.36 H new ATOM 0 HD22 LEU A 14 34.366 2.449 13.165 1.00 28.36 H new ATOM 0 HD23 LEU A 14 33.567 1.100 12.939 1.00 28.36 H new ATOM 104 N LEU A 15 37.703 -0.855 10.530 1.00 21.24 N ATOM 105 CA LEU A 15 38.604 -0.761 9.395 1.00 21.61 C ATOM 106 C LEU A 15 38.091 -1.571 8.203 1.00 30.15 C ATOM 107 O LEU A 15 38.029 -1.071 7.076 1.00 20.98 O ATOM 108 CB LEU A 15 39.995 -1.253 9.803 1.00 19.61 C ATOM 109 CG LEU A 15 41.084 -1.220 8.728 1.00 26.67 C ATOM 110 CD1 LEU A 15 41.175 0.171 8.112 1.00 28.46 C ATOM 111 CD2 LEU A 15 42.403 -1.627 9.342 1.00 21.87 C ATOM 0 H LEU A 15 38.013 -1.304 11.195 1.00 21.24 H new ATOM 0 HA LEU A 15 38.652 0.169 9.122 1.00 21.61 H new ATOM 0 HB2 LEU A 15 40.296 -0.718 10.554 1.00 19.61 H new ATOM 0 HB3 LEU A 15 39.911 -2.166 10.120 1.00 19.61 H new ATOM 0 HG LEU A 15 40.862 -1.845 8.020 1.00 26.67 H new ATOM 0 HD11 LEU A 15 41.868 0.180 7.433 1.00 28.46 H new ATOM 0 HD12 LEU A 15 40.324 0.403 7.708 1.00 28.46 H new ATOM 0 HD13 LEU A 15 41.391 0.817 8.802 1.00 28.46 H new ATOM 0 HD21 LEU A 15 43.096 -1.607 8.663 1.00 21.87 H new ATOM 0 HD22 LEU A 15 42.632 -1.011 10.055 1.00 21.87 H new ATOM 0 HD23 LEU A 15 42.329 -2.525 9.702 1.00 21.87 H new ATOM 112 N ALA A 16 37.709 -2.818 8.469 1.00 30.28 N ATOM 113 CA ALA A 16 37.220 -3.735 7.442 1.00 22.71 C ATOM 114 C ALA A 16 35.941 -3.278 6.759 1.00 22.79 C ATOM 115 O ALA A 16 35.845 -3.287 5.534 1.00 26.09 O ATOM 116 CB ALA A 16 37.010 -5.126 8.052 1.00 27.83 C ATOM 0 H ALA A 16 37.727 -3.159 9.258 1.00 30.28 H new ATOM 0 HA ALA A 16 37.902 -3.757 6.752 1.00 22.71 H new ATOM 0 HB1 ALA A 16 36.685 -5.733 7.369 1.00 27.83 H new ATOM 0 HB2 ALA A 16 37.852 -5.456 8.404 1.00 27.83 H new ATOM 0 HB3 ALA A 16 36.360 -5.070 8.770 1.00 27.83 H new ATOM 117 N ALA A 17 34.962 -2.867 7.555 1.00 22.08 N ATOM 118 CA ALA A 17 33.675 -2.437 7.023 1.00 27.14 C ATOM 119 C ALA A 17 33.611 -1.000 6.505 1.00 29.05 C ATOM 120 O ALA A 17 33.036 -0.738 5.439 1.00 27.40 O ATOM 121 CB ALA A 17 32.588 -2.646 8.091 1.00 26.62 C ATOM 0 H ALA A 17 35.023 -2.829 8.412 1.00 22.08 H new ATOM 0 HA ALA A 17 33.529 -2.990 6.240 1.00 27.14 H new ATOM 0 HB1 ALA A 17 31.730 -2.361 7.740 1.00 26.62 H new ATOM 0 HB2 ALA A 17 32.544 -3.585 8.328 1.00 26.62 H new ATOM 0 HB3 ALA A 17 32.804 -2.124 8.879 1.00 26.62 H new ATOM 122 N TRP A 18 34.210 -0.069 7.240 1.00 26.10 N ATOM 123 CA TRP A 18 34.125 1.335 6.851 1.00 23.31 C ATOM 124 C TRP A 18 35.434 2.080 6.616 1.00 27.51 C ATOM 125 O TRP A 18 35.413 3.284 6.372 1.00 26.51 O ATOM 126 CB TRP A 18 33.300 2.093 7.893 1.00 25.32 C ATOM 127 CG TRP A 18 32.057 1.361 8.332 1.00 25.44 C ATOM 128 CD1 TRP A 18 31.837 0.773 9.541 1.00 21.77 C ATOM 129 CD2 TRP A 18 30.865 1.153 7.560 1.00 25.89 C ATOM 130 NE1 TRP A 18 30.580 0.209 9.575 1.00 28.71 N ATOM 131 CE2 TRP A 18 29.962 0.428 8.374 1.00 30.82 C ATOM 132 CE3 TRP A 18 30.470 1.509 6.263 1.00 26.43 C ATOM 133 CZ2 TRP A 18 28.686 0.049 7.931 1.00 29.01 C ATOM 134 CZ3 TRP A 18 29.200 1.131 5.821 1.00 27.87 C ATOM 135 CH2 TRP A 18 28.325 0.410 6.657 1.00 23.70 C ATOM 0 H TRP A 18 34.663 -0.224 7.955 1.00 26.10 H new ATOM 0 HA TRP A 18 33.708 1.311 5.975 1.00 23.31 H new ATOM 0 HB2 TRP A 18 33.855 2.266 8.670 1.00 25.32 H new ATOM 0 HB3 TRP A 18 33.046 2.955 7.528 1.00 25.32 H new ATOM 0 HD1 TRP A 18 32.447 0.755 10.243 1.00 21.77 H new ATOM 0 HE1 TRP A 18 30.239 -0.212 10.243 1.00 28.71 H new ATOM 0 HE3 TRP A 18 31.042 1.987 5.708 1.00 26.43 H new ATOM 0 HZ2 TRP A 18 28.107 -0.429 8.480 1.00 29.01 H new ATOM 0 HZ3 TRP A 18 28.928 1.359 4.961 1.00 27.87 H new ATOM 0 HH2 TRP A 18 27.484 0.173 6.339 1.00 23.70 H new ATOM 136 N HIS A 19 36.560 1.377 6.689 1.00 26.76 N ATOM 137 CA HIS A 19 37.871 1.994 6.469 1.00 28.91 C ATOM 138 C HIS A 19 38.197 3.037 7.533 1.00 24.33 C ATOM 139 O HIS A 19 39.046 3.906 7.331 1.00 25.93 O ATOM 140 CB HIS A 19 37.907 2.645 5.089 1.00 21.26 C ATOM 141 CG HIS A 19 37.547 1.708 3.977 1.00 31.69 C ATOM 142 ND1 HIS A 19 38.431 0.781 3.470 1.00 29.65 N ATOM 143 CD2 HIS A 19 36.383 1.525 3.311 1.00 26.17 C ATOM 144 CE1 HIS A 19 37.827 0.065 2.537 1.00 25.60 C ATOM 145 NE2 HIS A 19 36.584 0.495 2.421 1.00 26.28 N ATOM 0 H HIS A 19 36.589 0.536 6.866 1.00 26.76 H new ATOM 0 HA HIS A 19 38.539 1.293 6.526 1.00 28.91 H new ATOM 0 HB2 HIS A 19 37.296 3.398 5.078 1.00 21.26 H new ATOM 0 HB3 HIS A 19 38.796 2.999 4.929 1.00 21.26 H new ATOM 0 HD2 HIS A 19 35.596 2.005 3.432 1.00 26.17 H new ATOM 0 HE1 HIS A 19 38.212 -0.624 2.046 1.00 25.60 H new ATOM 0 HE2 HIS A 19 35.996 0.182 1.877 1.00 26.28 H new ATOM 146 N VAL A 20 37.516 2.941 8.668 1.00 20.46 N ATOM 147 CA VAL A 20 37.728 3.862 9.776 1.00 21.34 C ATOM 148 C VAL A 20 38.932 3.395 10.591 1.00 27.81 C ATOM 149 O VAL A 20 39.100 2.201 10.823 1.00 24.08 O ATOM 150 CB VAL A 20 36.473 3.913 10.684 1.00 22.05 C ATOM 151 CG1 VAL A 20 36.773 4.648 11.994 1.00 21.70 C ATOM 152 CG2 VAL A 20 35.345 4.603 9.947 1.00 25.68 C ATOM 0 H VAL A 20 36.919 2.341 8.817 1.00 20.46 H new ATOM 0 HA VAL A 20 37.892 4.751 9.424 1.00 21.34 H new ATOM 0 HB VAL A 20 36.211 3.005 10.903 1.00 22.05 H new ATOM 0 HG11 VAL A 20 35.975 4.667 12.545 1.00 21.70 H new ATOM 0 HG12 VAL A 20 37.482 4.187 12.469 1.00 21.70 H new ATOM 0 HG13 VAL A 20 37.053 5.556 11.799 1.00 21.70 H new ATOM 0 HG21 VAL A 20 34.559 4.635 10.515 1.00 25.68 H new ATOM 0 HG22 VAL A 20 35.614 5.506 9.716 1.00 25.68 H new ATOM 0 HG23 VAL A 20 35.138 4.111 9.137 1.00 25.68 H new ATOM 153 N LYS A 21 39.778 4.342 10.993 1.00 28.13 N ATOM 154 CA LYS A 21 40.958 4.045 11.801 1.00 27.65 C ATOM 155 C LYS A 21 40.888 4.875 13.075 1.00 26.73 C ATOM 156 O LYS A 21 40.640 6.078 13.035 1.00 27.93 O ATOM 157 CB LYS A 21 42.243 4.365 11.028 1.00 29.41 C ATOM 158 CG LYS A 21 42.551 3.377 9.907 1.00 33.92 C ATOM 159 CD LYS A 21 43.821 3.754 9.158 1.00 43.12 C ATOM 160 CE LYS A 21 44.105 2.764 8.041 1.00 47.26 C ATOM 161 NZ LYS A 21 45.294 3.156 7.236 1.00 59.16 N ATOM 0 H LYS A 21 39.683 5.176 10.804 1.00 28.13 H new ATOM 0 HA LYS A 21 40.974 3.100 12.019 1.00 27.65 H new ATOM 0 HB2 LYS A 21 42.170 5.256 10.651 1.00 29.41 H new ATOM 0 HB3 LYS A 21 42.988 4.379 11.649 1.00 29.41 H new ATOM 0 HG2 LYS A 21 42.646 2.486 10.278 1.00 33.92 H new ATOM 0 HG3 LYS A 21 41.806 3.348 9.287 1.00 33.92 H new ATOM 0 HD2 LYS A 21 43.731 4.647 8.789 1.00 43.12 H new ATOM 0 HD3 LYS A 21 44.570 3.776 9.774 1.00 43.12 H new ATOM 0 HE2 LYS A 21 44.249 1.883 8.420 1.00 47.26 H new ATOM 0 HE3 LYS A 21 43.330 2.701 7.461 1.00 47.26 H new ATOM 0 HZ1 LYS A 21 45.223 2.817 6.416 1.00 59.16 H new ATOM 0 HZ2 LYS A 21 45.340 4.043 7.186 1.00 59.16 H new ATOM 0 HZ3 LYS A 21 46.031 2.843 7.623 1.00 59.16 H new ATOM 162 N VAL A 22 41.097 4.226 14.212 1.00 28.83 N ATOM 163 CA VAL A 22 41.015 4.915 15.492 1.00 25.76 C ATOM 164 C VAL A 22 42.160 4.567 16.431 1.00 34.31 C ATOM 165 O VAL A 22 42.750 3.489 16.335 1.00 29.60 O ATOM 166 CB VAL A 22 39.711 4.558 16.219 1.00 24.04 C ATOM 167 CG1 VAL A 22 38.518 5.121 15.469 1.00 30.18 C ATOM 168 CG2 VAL A 22 39.606 3.045 16.344 1.00 23.43 C ATOM 0 H VAL A 22 41.287 3.389 14.265 1.00 28.83 H new ATOM 0 HA VAL A 22 41.056 5.860 15.278 1.00 25.76 H new ATOM 0 HB VAL A 22 39.717 4.949 17.106 1.00 24.04 H new ATOM 0 HG11 VAL A 22 37.701 4.889 15.938 1.00 30.18 H new ATOM 0 HG12 VAL A 22 38.596 6.086 15.415 1.00 30.18 H new ATOM 0 HG13 VAL A 22 38.493 4.748 14.574 1.00 30.18 H new ATOM 0 HG21 VAL A 22 38.783 2.814 16.803 1.00 23.43 H new ATOM 0 HG22 VAL A 22 39.605 2.646 15.460 1.00 23.43 H new ATOM 0 HG23 VAL A 22 40.363 2.709 16.849 1.00 23.43 H new ATOM 169 N PRO A 23 42.486 5.487 17.354 1.00 29.95 N ATOM 170 CA PRO A 23 43.558 5.293 18.334 1.00 37.55 C ATOM 171 C PRO A 23 43.028 4.316 19.388 1.00 34.97 C ATOM 172 O PRO A 23 41.881 4.424 19.817 1.00 29.49 O ATOM 173 CB PRO A 23 43.758 6.691 18.924 1.00 42.19 C ATOM 174 CG PRO A 23 43.130 7.616 17.918 1.00 47.64 C ATOM 175 CD PRO A 23 41.939 6.848 17.451 1.00 33.62 C ATOM 0 HA PRO A 23 44.387 4.936 17.980 1.00 37.55 H new ATOM 0 HB2 PRO A 23 43.333 6.772 19.792 1.00 42.19 H new ATOM 0 HB3 PRO A 23 44.699 6.891 19.049 1.00 42.19 H new ATOM 0 HG2 PRO A 23 42.877 8.463 18.318 1.00 47.64 H new ATOM 0 HG3 PRO A 23 43.736 7.817 17.188 1.00 47.64 H new ATOM 0 HD2 PRO A 23 41.202 6.901 18.079 1.00 33.62 H new ATOM 0 HD3 PRO A 23 41.609 7.170 16.598 1.00 33.62 H new ATOM 176 N PRO A 24 43.852 3.353 19.818 1.00 42.77 N ATOM 177 CA PRO A 24 43.388 2.392 20.824 1.00 43.82 C ATOM 178 C PRO A 24 42.896 3.007 22.137 1.00 38.16 C ATOM 179 O PRO A 24 41.953 2.498 22.747 1.00 34.09 O ATOM 180 CB PRO A 24 44.598 1.475 21.011 1.00 45.31 C ATOM 181 CG PRO A 24 45.758 2.368 20.684 1.00 51.77 C ATOM 182 CD PRO A 24 45.260 3.106 19.465 1.00 43.74 C ATOM 0 HA PRO A 24 42.590 1.928 20.526 1.00 43.82 H new ATOM 0 HB2 PRO A 24 44.653 1.134 21.917 1.00 45.31 H new ATOM 0 HB3 PRO A 24 44.560 0.706 20.421 1.00 45.31 H new ATOM 0 HG2 PRO A 24 45.966 2.973 21.413 1.00 51.77 H new ATOM 0 HG3 PRO A 24 46.564 1.861 20.497 1.00 51.77 H new ATOM 0 HD2 PRO A 24 45.748 3.931 19.314 1.00 43.74 H new ATOM 0 HD3 PRO A 24 45.345 2.575 18.658 1.00 43.74 H new HETATM 183 N MSE A 25 43.515 4.103 22.564 1.00 38.58 N HETATM 184 CA MSE A 25 43.116 4.754 23.813 1.00 47.06 C HETATM 185 C MSE A 25 41.693 5.308 23.715 1.00 42.00 C HETATM 186 O MSE A 25 40.896 5.180 24.647 1.00 33.60 O HETATM 187 CB MSE A 25 44.091 5.882 24.161 1.00 59.69 C HETATM 188 CG MSE A 25 44.350 6.033 25.654 1.00 82.55 C HETATM 189 SE MSE A 25 45.280 4.504 26.409 1.00114.02 SE HETATM 190 CE MSE A 25 43.764 3.454 26.990 1.00 98.96 C HETATM 0 H MSE A 25 44.165 4.485 22.150 1.00 38.58 H new HETATM 0 HA MSE A 25 43.137 4.087 24.517 1.00 47.06 H new HETATM 0 HB2 MSE A 25 44.934 5.720 23.710 1.00 59.69 H new HETATM 0 HB3 MSE A 25 43.741 6.718 23.816 1.00 59.69 H new HETATM 0 HG2 MSE A 25 44.874 6.835 25.808 1.00 82.55 H new HETATM 0 HG3 MSE A 25 43.505 6.153 26.115 1.00 82.55 H new HETATM 0 HE1 MSE A 25 44.077 2.633 27.401 1.00 98.96 H new HETATM 0 HE2 MSE A 25 43.247 3.961 27.635 1.00 98.96 H new HETATM 0 HE3 MSE A 25 43.206 3.240 26.226 1.00 98.96 H new ATOM 191 N TRP A 26 41.375 5.931 22.585 1.00 35.90 N ATOM 192 CA TRP A 26 40.035 6.473 22.386 1.00 34.26 C ATOM 193 C TRP A 26 39.022 5.333 22.326 1.00 29.54 C ATOM 194 O TRP A 26 37.938 5.414 22.908 1.00 34.54 O ATOM 195 CB TRP A 26 39.961 7.261 21.078 1.00 34.50 C ATOM 196 CG TRP A 26 38.576 7.766 20.776 1.00 25.89 C ATOM 197 CD1 TRP A 26 38.032 8.952 21.169 1.00 28.12 C ATOM 198 CD2 TRP A 26 37.547 7.068 20.056 1.00 32.35 C ATOM 199 NE1 TRP A 26 36.726 9.040 20.737 1.00 29.11 N ATOM 200 CE2 TRP A 26 36.406 7.904 20.053 1.00 28.31 C ATOM 201 CE3 TRP A 26 37.483 5.826 19.412 1.00 28.29 C ATOM 202 CZ2 TRP A 26 35.204 7.525 19.433 1.00 30.11 C ATOM 203 CZ3 TRP A 26 36.285 5.450 18.795 1.00 36.86 C ATOM 204 CH2 TRP A 26 35.164 6.304 18.811 1.00 29.09 C ATOM 0 H TRP A 26 41.915 6.050 21.926 1.00 35.90 H new ATOM 0 HA TRP A 26 39.833 7.063 23.129 1.00 34.26 H new ATOM 0 HB2 TRP A 26 40.572 8.013 21.124 1.00 34.50 H new ATOM 0 HB3 TRP A 26 40.261 6.697 20.348 1.00 34.50 H new ATOM 0 HD1 TRP A 26 38.477 9.607 21.657 1.00 28.12 H new ATOM 0 HE1 TRP A 26 36.198 9.704 20.876 1.00 29.11 H new ATOM 0 HE3 TRP A 26 38.222 5.262 19.395 1.00 28.29 H new ATOM 0 HZ2 TRP A 26 34.460 8.083 19.444 1.00 30.11 H new ATOM 0 HZ3 TRP A 26 36.228 4.626 18.369 1.00 36.86 H new ATOM 0 HH2 TRP A 26 34.380 6.033 18.390 1.00 29.09 H new ATOM 205 N LEU A 27 39.385 4.271 21.613 1.00 33.85 N ATOM 206 CA LEU A 27 38.510 3.116 21.450 1.00 34.16 C ATOM 207 C LEU A 27 38.154 2.417 22.760 1.00 32.53 C ATOM 208 O LEU A 27 36.986 2.139 23.019 1.00 29.42 O ATOM 209 CB LEU A 27 39.151 2.111 20.492 1.00 38.33 C ATOM 210 CG LEU A 27 38.348 0.852 20.151 1.00 35.00 C ATOM 211 CD1 LEU A 27 36.962 1.239 19.625 1.00 33.58 C ATOM 212 CD2 LEU A 27 39.110 0.040 19.113 1.00 43.12 C ATOM 0 H LEU A 27 40.142 4.200 21.212 1.00 33.85 H new ATOM 0 HA LEU A 27 37.678 3.458 21.087 1.00 34.16 H new ATOM 0 HB2 LEU A 27 39.351 2.573 19.663 1.00 38.33 H new ATOM 0 HB3 LEU A 27 39.998 1.832 20.873 1.00 38.33 H new ATOM 0 HG LEU A 27 38.228 0.314 20.949 1.00 35.00 H new ATOM 0 HD11 LEU A 27 36.461 0.436 19.412 1.00 33.58 H new ATOM 0 HD12 LEU A 27 36.488 1.745 20.303 1.00 33.58 H new ATOM 0 HD13 LEU A 27 37.059 1.781 18.826 1.00 33.58 H new ATOM 0 HD21 LEU A 27 38.606 -0.759 18.893 1.00 43.12 H new ATOM 0 HD22 LEU A 27 39.235 0.573 18.313 1.00 43.12 H new ATOM 0 HD23 LEU A 27 39.975 -0.213 19.471 1.00 43.12 H new ATOM 213 N GLU A 28 39.150 2.126 23.590 1.00 35.78 N ATOM 214 CA GLU A 28 38.864 1.456 24.851 1.00 40.60 C ATOM 215 C GLU A 28 37.996 2.338 25.741 1.00 35.38 C ATOM 216 O GLU A 28 37.111 1.849 26.444 1.00 34.32 O ATOM 217 CB GLU A 28 40.160 1.079 25.575 1.00 41.69 C ATOM 218 CG GLU A 28 41.062 0.149 24.768 1.00 57.09 C ATOM 219 CD GLU A 28 42.055 -0.609 25.635 1.00 68.89 C ATOM 220 OE1 GLU A 28 42.564 -0.019 26.614 1.00 65.10 O ATOM 221 OE2 GLU A 28 42.331 -1.792 25.332 1.00 68.91 O ATOM 0 H GLU A 28 39.979 2.303 23.447 1.00 35.78 H new ATOM 0 HA GLU A 28 38.377 0.640 24.655 1.00 40.60 H new ATOM 0 HB2 GLU A 28 40.650 1.889 25.788 1.00 41.69 H new ATOM 0 HB3 GLU A 28 39.939 0.652 26.417 1.00 41.69 H new ATOM 0 HG2 GLU A 28 40.513 -0.486 24.282 1.00 57.09 H new ATOM 0 HG3 GLU A 28 41.547 0.668 24.107 1.00 57.09 H new ATOM 222 N ALA A 29 38.238 3.643 25.704 1.00 32.59 N ATOM 223 CA ALA A 29 37.453 4.566 26.513 1.00 31.51 C ATOM 224 C ALA A 29 36.037 4.620 25.963 1.00 36.00 C ATOM 225 O ALA A 29 35.071 4.763 26.715 1.00 34.83 O ATOM 226 CB ALA A 29 38.074 5.953 26.492 1.00 30.47 C ATOM 0 H ALA A 29 38.847 4.012 25.221 1.00 32.59 H new ATOM 0 HA ALA A 29 37.437 4.255 27.432 1.00 31.51 H new ATOM 0 HB1 ALA A 29 37.541 6.555 27.034 1.00 30.47 H new ATOM 0 HB2 ALA A 29 38.975 5.910 26.849 1.00 30.47 H new ATOM 0 HB3 ALA A 29 38.103 6.281 25.580 1.00 30.47 H new ATOM 227 N CYS A 30 35.918 4.497 24.644 1.00 35.55 N ATOM 228 CA CYS A 30 34.609 4.529 24.003 1.00 34.94 C ATOM 229 C CYS A 30 33.807 3.300 24.399 1.00 28.91 C ATOM 230 O CYS A 30 32.600 3.389 24.625 1.00 32.01 O ATOM 231 CB CYS A 30 34.749 4.563 22.479 1.00 33.41 C ATOM 232 SG CYS A 30 33.163 4.702 21.611 1.00 37.20 S ATOM 0 H CYS A 30 36.580 4.395 24.105 1.00 35.55 H new ATOM 0 HA CYS A 30 34.150 5.332 24.296 1.00 34.94 H new ATOM 0 HB2 CYS A 30 35.313 5.312 22.230 1.00 33.41 H new ATOM 0 HB3 CYS A 30 35.201 3.757 22.185 1.00 33.41 H new ATOM 0 HG CYS A 30 33.335 5.220 20.542 1.00 37.20 H new ATOM 233 N ILE A 31 34.477 2.154 24.479 1.00 34.75 N ATOM 234 CA ILE A 31 33.800 0.915 24.848 1.00 35.68 C ATOM 235 C ILE A 31 33.329 0.971 26.300 1.00 37.72 C ATOM 236 O ILE A 31 32.222 0.540 26.620 1.00 30.09 O ATOM 237 CB ILE A 31 34.716 -0.314 24.624 1.00 34.99 C ATOM 238 CG1 ILE A 31 35.039 -0.435 23.129 1.00 27.85 C ATOM 239 CG2 ILE A 31 34.027 -1.589 25.131 1.00 33.81 C ATOM 240 CD1 ILE A 31 35.859 -1.641 22.751 1.00 37.92 C ATOM 0 H ILE A 31 35.319 2.072 24.325 1.00 34.75 H new ATOM 0 HA ILE A 31 33.024 0.819 24.274 1.00 35.68 H new ATOM 0 HB ILE A 31 35.541 -0.199 25.121 1.00 34.99 H new ATOM 0 HG12 ILE A 31 34.206 -0.458 22.633 1.00 27.85 H new ATOM 0 HG13 ILE A 31 35.514 0.363 22.849 1.00 27.85 H new ATOM 0 HG21 ILE A 31 34.609 -2.351 24.986 1.00 33.81 H new ATOM 0 HG22 ILE A 31 33.840 -1.501 26.079 1.00 33.81 H new ATOM 0 HG23 ILE A 31 33.196 -1.721 24.649 1.00 33.81 H new ATOM 0 HD11 ILE A 31 36.016 -1.639 21.794 1.00 37.92 H new ATOM 0 HD12 ILE A 31 36.709 -1.614 23.218 1.00 37.92 H new ATOM 0 HD13 ILE A 31 35.381 -2.448 22.998 1.00 37.92 H new ATOM 241 N ASN A 32 34.170 1.511 27.173 1.00 38.58 N ATOM 242 CA ASN A 32 33.812 1.644 28.579 1.00 44.77 C ATOM 243 C ASN A 32 32.603 2.565 28.708 1.00 44.86 C ATOM 244 O ASN A 32 31.656 2.270 29.438 1.00 39.50 O ATOM 245 CB ASN A 32 34.988 2.220 29.373 1.00 48.02 C ATOM 246 CG ASN A 32 35.895 1.145 29.927 1.00 56.45 C ATOM 247 OD1 ASN A 32 35.482 0.349 30.770 1.00 63.15 O ATOM 248 ND2 ASN A 32 37.138 1.116 29.462 1.00 55.45 N ATOM 0 H ASN A 32 34.952 1.807 26.972 1.00 38.58 H new ATOM 0 HA ASN A 32 33.594 0.769 28.936 1.00 44.77 H new ATOM 0 HB2 ASN A 32 35.503 2.810 28.800 1.00 48.02 H new ATOM 0 HB3 ASN A 32 34.648 2.760 30.104 1.00 48.02 H new ATOM 0 HD21 ASN A 32 37.691 0.524 29.750 1.00 55.45 H new ATOM 0 HD22 ASN A 32 37.390 1.689 28.873 1.00 55.45 H new ATOM 249 N TRP A 33 32.636 3.679 27.985 1.00 41.61 N ATOM 250 CA TRP A 33 31.543 4.642 28.024 1.00 36.63 C ATOM 251 C TRP A 33 30.227 4.022 27.573 1.00 41.99 C ATOM 252 O TRP A 33 29.174 4.278 28.164 1.00 37.70 O ATOM 253 CB TRP A 33 31.849 5.839 27.128 1.00 38.87 C ATOM 254 CG TRP A 33 30.782 6.885 27.189 1.00 45.51 C ATOM 255 CD1 TRP A 33 30.607 7.825 28.167 1.00 48.80 C ATOM 256 CD2 TRP A 33 29.717 7.079 26.252 1.00 42.51 C ATOM 257 NE1 TRP A 33 29.499 8.592 27.896 1.00 49.17 N ATOM 258 CE2 TRP A 33 28.934 8.157 26.725 1.00 47.43 C ATOM 259 CE3 TRP A 33 29.347 6.447 25.057 1.00 42.73 C ATOM 260 CZ2 TRP A 33 27.803 8.619 26.044 1.00 43.45 C ATOM 261 CZ3 TRP A 33 28.219 6.905 24.379 1.00 48.51 C ATOM 262 CH2 TRP A 33 27.462 7.983 24.876 1.00 48.88 C ATOM 0 H TRP A 33 33.285 3.896 27.464 1.00 41.61 H new ATOM 0 HA TRP A 33 31.455 4.929 28.946 1.00 36.63 H new ATOM 0 HB2 TRP A 33 32.697 6.229 27.393 1.00 38.87 H new ATOM 0 HB3 TRP A 33 31.950 5.537 26.212 1.00 38.87 H new ATOM 0 HD1 TRP A 33 31.158 7.930 28.909 1.00 48.80 H new ATOM 0 HE1 TRP A 33 29.208 9.239 28.382 1.00 49.17 H new ATOM 0 HE3 TRP A 33 29.845 5.736 24.723 1.00 42.73 H new ATOM 0 HZ2 TRP A 33 27.301 9.330 26.370 1.00 43.45 H new ATOM 0 HZ3 TRP A 33 27.962 6.492 23.586 1.00 48.51 H new ATOM 0 HH2 TRP A 33 26.715 8.271 24.403 1.00 48.88 H new ATOM 263 N ILE A 34 30.288 3.213 26.519 1.00 35.03 N ATOM 264 CA ILE A 34 29.095 2.563 25.984 1.00 38.11 C ATOM 265 C ILE A 34 28.511 1.545 26.962 1.00 41.13 C ATOM 266 O ILE A 34 27.295 1.392 27.059 1.00 33.68 O ATOM 267 CB ILE A 34 29.402 1.865 24.646 1.00 36.84 C ATOM 268 CG1 ILE A 34 29.800 2.916 23.603 1.00 37.51 C ATOM 269 CG2 ILE A 34 28.189 1.077 24.176 1.00 37.59 C ATOM 270 CD1 ILE A 34 30.132 2.346 22.234 1.00 28.54 C ATOM 0 H ILE A 34 31.014 3.027 26.097 1.00 35.03 H new ATOM 0 HA ILE A 34 28.438 3.262 25.841 1.00 38.11 H new ATOM 0 HB ILE A 34 30.138 1.245 24.766 1.00 36.84 H new ATOM 0 HG12 ILE A 34 29.075 3.553 23.509 1.00 37.51 H new ATOM 0 HG13 ILE A 34 30.569 3.408 23.932 1.00 37.51 H new ATOM 0 HG21 ILE A 34 28.392 0.642 23.333 1.00 37.59 H new ATOM 0 HG22 ILE A 34 27.961 0.407 24.839 1.00 37.59 H new ATOM 0 HG23 ILE A 34 27.438 1.679 24.055 1.00 37.59 H new ATOM 0 HD11 ILE A 34 30.373 3.068 21.632 1.00 28.54 H new ATOM 0 HD12 ILE A 34 30.876 1.729 22.312 1.00 28.54 H new ATOM 0 HD13 ILE A 34 29.359 1.877 21.882 1.00 28.54 H new ATOM 271 N GLN A 35 29.378 0.845 27.680 1.00 38.10 N ATOM 272 CA GLN A 35 28.917 -0.140 28.649 1.00 47.58 C ATOM 273 C GLN A 35 28.214 0.563 29.801 1.00 44.45 C ATOM 274 O GLN A 35 27.172 0.107 30.273 1.00 44.73 O ATOM 275 CB GLN A 35 30.094 -0.965 29.176 1.00 41.09 C ATOM 276 CG GLN A 35 30.754 -1.825 28.119 1.00 43.29 C ATOM 277 CD GLN A 35 31.823 -2.729 28.686 1.00 46.89 C ATOM 278 OE1 GLN A 35 32.726 -2.274 29.384 1.00 51.41 O ATOM 279 NE2 GLN A 35 31.733 -4.019 28.381 1.00 52.18 N ATOM 0 H GLN A 35 30.232 0.924 27.623 1.00 38.10 H new ATOM 0 HA GLN A 35 28.293 -0.740 28.212 1.00 47.58 H new ATOM 0 HB2 GLN A 35 30.756 -0.365 29.554 1.00 41.09 H new ATOM 0 HB3 GLN A 35 29.783 -1.534 29.897 1.00 41.09 H new ATOM 0 HG2 GLN A 35 30.079 -2.365 27.679 1.00 43.29 H new ATOM 0 HG3 GLN A 35 31.146 -1.253 27.441 1.00 43.29 H new ATOM 0 HE21 GLN A 35 31.086 -4.300 27.889 1.00 52.18 H new ATOM 0 HE22 GLN A 35 32.322 -4.573 28.675 1.00 52.18 H new ATOM 280 N GLU A 36 28.780 1.684 30.237 1.00 49.38 N ATOM 281 CA GLU A 36 28.207 2.456 31.333 1.00 57.75 C ATOM 282 C GLU A 36 26.889 3.121 30.944 1.00 59.36 C ATOM 283 O GLU A 36 26.041 3.368 31.800 1.00 66.65 O ATOM 284 CB GLU A 36 29.206 3.511 31.816 1.00 62.54 C ATOM 285 CG GLU A 36 30.359 2.932 32.630 1.00 77.11 C ATOM 286 CD GLU A 36 31.428 3.962 32.962 1.00 86.65 C ATOM 287 OE1 GLU A 36 31.077 5.047 33.472 1.00 89.12 O ATOM 288 OE2 GLU A 36 32.622 3.681 32.719 1.00 89.21 O ATOM 0 H GLU A 36 29.502 2.016 29.908 1.00 49.38 H new ATOM 0 HA GLU A 36 28.017 1.835 32.054 1.00 57.75 H new ATOM 0 HB2 GLU A 36 29.566 3.980 31.047 1.00 62.54 H new ATOM 0 HB3 GLU A 36 28.737 4.167 32.355 1.00 62.54 H new ATOM 0 HG2 GLU A 36 30.011 2.558 33.454 1.00 77.11 H new ATOM 0 HG3 GLU A 36 30.763 2.202 32.135 1.00 77.11 H new ATOM 289 N GLU A 37 26.716 3.408 29.656 1.00 54.69 N ATOM 290 CA GLU A 37 25.491 4.039 29.171 1.00 55.22 C ATOM 291 C GLU A 37 24.358 3.030 29.062 1.00 56.15 C ATOM 292 O GLU A 37 23.205 3.336 29.372 1.00 57.74 O ATOM 293 CB GLU A 37 25.711 4.671 27.794 1.00 53.03 C ATOM 294 CG GLU A 37 26.631 5.878 27.772 1.00 66.66 C ATOM 295 CD GLU A 37 26.156 7.000 28.676 1.00 71.14 C ATOM 296 OE1 GLU A 37 24.932 7.240 28.735 1.00 73.36 O ATOM 297 OE2 GLU A 37 27.010 7.649 29.316 1.00 78.82 O ATOM 0 H GLU A 37 27.298 3.245 29.045 1.00 54.69 H new ATOM 0 HA GLU A 37 25.252 4.725 29.814 1.00 55.22 H new ATOM 0 HB2 GLU A 37 26.074 3.996 27.199 1.00 53.03 H new ATOM 0 HB3 GLU A 37 24.849 4.933 27.434 1.00 53.03 H new ATOM 0 HG2 GLU A 37 27.521 5.605 28.044 1.00 66.66 H new ATOM 0 HG3 GLU A 37 26.701 6.209 26.863 1.00 66.66 H new ATOM 298 N ASN A 38 24.691 1.829 28.608 1.00 57.47 N ATOM 299 CA ASN A 38 23.699 0.779 28.438 1.00 60.13 C ATOM 300 C ASN A 38 23.472 0.009 29.730 1.00 60.91 C ATOM 301 O ASN A 38 22.627 -0.886 29.784 1.00 58.90 O ATOM 302 CB ASN A 38 24.146 -0.193 27.342 1.00 65.36 C ATOM 303 CG ASN A 38 24.420 0.502 26.024 1.00 67.39 C ATOM 304 OD1 ASN A 38 23.584 1.248 25.518 1.00 71.42 O ATOM 305 ND2 ASN A 38 25.594 0.253 25.458 1.00 75.73 N ATOM 0 H ASN A 38 25.492 1.601 28.392 1.00 57.47 H new ATOM 0 HA ASN A 38 22.864 1.203 28.184 1.00 60.13 H new ATOM 0 HB2 ASN A 38 24.947 -0.656 27.632 1.00 65.36 H new ATOM 0 HB3 ASN A 38 23.460 -0.867 27.212 1.00 65.36 H new ATOM 0 HD21 ASN A 38 25.795 0.620 24.707 1.00 75.73 H new ATOM 0 HD22 ASN A 38 26.153 -0.275 25.843 1.00 75.73 H new ATOM 306 N ASN A 39 24.226 0.357 30.768 1.00 57.20 N ATOM 307 CA ASN A 39 24.115 -0.326 32.051 1.00 62.71 C ATOM 308 C ASN A 39 24.341 -1.813 31.821 1.00 62.27 C ATOM 309 O ASN A 39 24.060 -2.640 32.685 1.00 62.05 O ATOM 310 CB ASN A 39 22.729 -0.104 32.660 1.00 69.88 C ATOM 311 CG ASN A 39 22.413 1.362 32.858 1.00 74.57 C ATOM 312 OD1 ASN A 39 23.172 2.089 33.501 1.00 78.63 O ATOM 313 ND2 ASN A 39 21.289 1.807 32.308 1.00 78.94 N ATOM 0 H ASN A 39 24.810 0.988 30.749 1.00 57.20 H new ATOM 0 HA ASN A 39 24.777 0.027 32.666 1.00 62.71 H new ATOM 0 HB2 ASN A 39 22.058 -0.502 32.083 1.00 69.88 H new ATOM 0 HB3 ASN A 39 22.677 -0.562 33.514 1.00 69.88 H new ATOM 0 HD21 ASN A 39 21.066 2.633 32.394 1.00 78.94 H new ATOM 0 HD22 ASN A 39 20.784 1.269 31.866 1.00 78.94 H new ATOM 314 N ASN A 40 24.851 -2.140 30.640 1.00 63.17 N ATOM 315 CA ASN A 40 25.112 -3.522 30.278 1.00 62.86 C ATOM 316 C ASN A 40 26.587 -3.727 29.983 1.00 60.03 C ATOM 317 O ASN A 40 27.173 -3.037 29.147 1.00 58.44 O ATOM 318 CB ASN A 40 24.290 -3.914 29.048 1.00 62.95 C ATOM 319 CG ASN A 40 24.475 -5.370 28.662 1.00 67.65 C ATOM 320 OD1 ASN A 40 24.061 -5.795 27.584 1.00 75.10 O ATOM 321 ND2 ASN A 40 25.089 -6.146 29.547 1.00 68.97 N ATOM 0 H ASN A 40 25.054 -1.569 30.030 1.00 63.17 H new ATOM 0 HA ASN A 40 24.857 -4.083 31.027 1.00 62.86 H new ATOM 0 HB2 ASN A 40 23.351 -3.746 29.224 1.00 62.95 H new ATOM 0 HB3 ASN A 40 24.544 -3.350 28.301 1.00 62.95 H new ATOM 0 HD21 ASN A 40 25.210 -6.980 29.376 1.00 68.97 H new ATOM 0 HD22 ASN A 40 25.365 -5.815 30.291 1.00 68.97 H new ATOM 322 N VAL A 41 27.181 -4.684 30.683 1.00 58.13 N ATOM 323 CA VAL A 41 28.583 -5.014 30.500 1.00 60.13 C ATOM 324 C VAL A 41 28.688 -6.114 29.446 1.00 58.78 C ATOM 325 O VAL A 41 29.772 -6.404 28.940 1.00 64.33 O ATOM 326 CB VAL A 41 29.198 -5.526 31.822 1.00 64.24 C ATOM 327 CG1 VAL A 41 30.668 -5.849 31.629 1.00 64.24 C ATOM 328 CG2 VAL A 41 29.017 -4.483 32.910 1.00 66.69 C ATOM 0 H VAL A 41 26.781 -5.160 31.277 1.00 58.13 H new ATOM 0 HA VAL A 41 29.064 -4.220 30.219 1.00 60.13 H new ATOM 0 HB VAL A 41 28.742 -6.339 32.090 1.00 64.24 H new ATOM 0 HG11 VAL A 41 31.042 -6.169 32.465 1.00 64.24 H new ATOM 0 HG12 VAL A 41 30.762 -6.535 30.950 1.00 64.24 H new ATOM 0 HG13 VAL A 41 31.141 -5.050 31.349 1.00 64.24 H new ATOM 0 HG21 VAL A 41 29.404 -4.808 33.738 1.00 66.69 H new ATOM 0 HG22 VAL A 41 29.460 -3.661 32.647 1.00 66.69 H new ATOM 0 HG23 VAL A 41 28.071 -4.313 33.041 1.00 66.69 H new ATOM 329 N ASN A 42 27.550 -6.713 29.105 1.00 54.99 N ATOM 330 CA ASN A 42 27.533 -7.803 28.143 1.00 51.18 C ATOM 331 C ASN A 42 26.713 -7.604 26.867 1.00 51.62 C ATOM 332 O ASN A 42 25.721 -8.299 26.640 1.00 50.82 O ATOM 333 CB ASN A 42 27.083 -9.081 28.853 1.00 51.68 C ATOM 334 CG ASN A 42 27.854 -9.327 30.135 1.00 48.79 C ATOM 335 OD1 ASN A 42 29.089 -9.328 30.140 1.00 38.51 O ATOM 336 ND2 ASN A 42 27.132 -9.538 31.231 1.00 50.57 N ATOM 0 H ASN A 42 26.779 -6.501 29.421 1.00 54.99 H new ATOM 0 HA ASN A 42 28.446 -7.852 27.818 1.00 51.18 H new ATOM 0 HB2 ASN A 42 26.136 -9.021 29.054 1.00 51.68 H new ATOM 0 HB3 ASN A 42 27.199 -9.838 28.257 1.00 51.68 H new ATOM 0 HD21 ASN A 42 27.524 -9.683 31.983 1.00 50.57 H new ATOM 0 HD22 ASN A 42 26.273 -9.530 31.188 1.00 50.57 H new ATOM 337 N LEU A 43 27.131 -6.652 26.037 1.00 49.28 N ATOM 338 CA LEU A 43 26.467 -6.410 24.758 1.00 43.45 C ATOM 339 C LEU A 43 27.142 -7.349 23.767 1.00 38.75 C ATOM 340 O LEU A 43 28.296 -7.732 23.964 1.00 38.32 O ATOM 341 CB LEU A 43 26.681 -4.971 24.279 1.00 51.72 C ATOM 342 CG LEU A 43 25.756 -3.827 24.701 1.00 64.20 C ATOM 343 CD1 LEU A 43 25.886 -3.558 26.186 1.00 67.61 C ATOM 344 CD2 LEU A 43 26.125 -2.580 23.907 1.00 68.02 C ATOM 0 H LEU A 43 27.799 -6.134 26.196 1.00 49.28 H new ATOM 0 HA LEU A 43 25.511 -6.555 24.839 1.00 43.45 H new ATOM 0 HB2 LEU A 43 27.578 -4.718 24.547 1.00 51.72 H new ATOM 0 HB3 LEU A 43 26.671 -4.995 23.309 1.00 51.72 H new ATOM 0 HG LEU A 43 24.835 -4.072 24.520 1.00 64.20 H new ATOM 0 HD11 LEU A 43 25.294 -2.831 26.436 1.00 67.61 H new ATOM 0 HD12 LEU A 43 25.645 -4.356 26.682 1.00 67.61 H new ATOM 0 HD13 LEU A 43 26.802 -3.314 26.392 1.00 67.61 H new ATOM 0 HD21 LEU A 43 25.545 -1.847 24.166 1.00 68.02 H new ATOM 0 HD22 LEU A 43 27.047 -2.341 24.089 1.00 68.02 H new ATOM 0 HD23 LEU A 43 26.018 -2.756 22.959 1.00 68.02 H new ATOM 345 N SER A 44 26.441 -7.727 22.706 1.00 36.65 N ATOM 346 CA SER A 44 27.046 -8.600 21.712 1.00 40.09 C ATOM 347 C SER A 44 28.141 -7.794 21.016 1.00 40.43 C ATOM 348 O SER A 44 28.198 -6.571 21.146 1.00 33.55 O ATOM 349 CB SER A 44 26.002 -9.047 20.687 1.00 48.39 C ATOM 350 OG SER A 44 25.504 -7.943 19.950 1.00 46.70 O ATOM 0 H SER A 44 25.629 -7.494 22.545 1.00 36.65 H new ATOM 0 HA SER A 44 27.409 -9.395 22.133 1.00 40.09 H new ATOM 0 HB2 SER A 44 26.396 -9.693 20.080 1.00 48.39 H new ATOM 0 HB3 SER A 44 25.270 -9.494 21.140 1.00 48.39 H new ATOM 0 HG SER A 44 25.592 -8.092 19.128 1.00 46.70 H new ATOM 351 N GLN A 45 29.018 -8.470 20.287 1.00 35.95 N ATOM 352 CA GLN A 45 30.079 -7.764 19.582 1.00 38.06 C ATOM 353 C GLN A 45 29.440 -6.904 18.501 1.00 41.74 C ATOM 354 O GLN A 45 29.827 -5.753 18.295 1.00 37.45 O ATOM 355 CB GLN A 45 31.044 -8.757 18.938 1.00 34.78 C ATOM 356 CG GLN A 45 32.289 -8.123 18.335 1.00 36.27 C ATOM 357 CD GLN A 45 33.152 -7.389 19.355 1.00 44.15 C ATOM 358 OE1 GLN A 45 33.524 -7.942 20.391 1.00 37.98 O ATOM 359 NE2 GLN A 45 33.486 -6.139 19.053 1.00 32.18 N ATOM 0 H GLN A 45 29.018 -9.324 20.188 1.00 35.95 H new ATOM 0 HA GLN A 45 30.577 -7.214 20.207 1.00 38.06 H new ATOM 0 HB2 GLN A 45 31.316 -9.406 19.605 1.00 34.78 H new ATOM 0 HB3 GLN A 45 30.574 -9.244 18.243 1.00 34.78 H new ATOM 0 HG2 GLN A 45 32.821 -8.813 17.909 1.00 36.27 H new ATOM 0 HG3 GLN A 45 32.022 -7.501 17.640 1.00 36.27 H new ATOM 0 HE21 GLN A 45 33.208 -5.785 18.320 1.00 32.18 H new ATOM 0 HE22 GLN A 45 33.980 -5.684 19.590 1.00 32.18 H new ATOM 360 N ALA A 46 28.454 -7.478 17.819 1.00 38.70 N ATOM 361 CA ALA A 46 27.747 -6.793 16.746 1.00 41.52 C ATOM 362 C ALA A 46 27.141 -5.479 17.224 1.00 35.75 C ATOM 363 O ALA A 46 27.233 -4.460 16.544 1.00 38.18 O ATOM 364 CB ALA A 46 26.656 -7.703 16.173 1.00 38.06 C ATOM 0 H ALA A 46 28.176 -8.278 17.967 1.00 38.70 H new ATOM 0 HA ALA A 46 28.390 -6.585 16.050 1.00 41.52 H new ATOM 0 HB1 ALA A 46 26.190 -7.240 15.459 1.00 38.06 H new ATOM 0 HB2 ALA A 46 27.060 -8.512 15.823 1.00 38.06 H new ATOM 0 HB3 ALA A 46 26.026 -7.934 16.874 1.00 38.06 H new ATOM 365 N GLN A 47 26.524 -5.505 18.398 1.00 33.16 N ATOM 366 CA GLN A 47 25.910 -4.309 18.953 1.00 38.08 C ATOM 367 C GLN A 47 26.949 -3.297 19.425 1.00 36.00 C ATOM 368 O GLN A 47 26.744 -2.087 19.302 1.00 33.11 O ATOM 369 CB GLN A 47 24.954 -4.684 20.089 1.00 45.67 C ATOM 370 CG GLN A 47 23.568 -5.074 19.579 1.00 70.52 C ATOM 371 CD GLN A 47 22.659 -5.627 20.660 1.00 83.37 C ATOM 372 OE1 GLN A 47 22.591 -5.093 21.768 1.00 90.07 O ATOM 373 NE2 GLN A 47 21.943 -6.699 20.335 1.00 84.07 N ATOM 0 H GLN A 47 26.450 -6.207 18.889 1.00 33.16 H new ATOM 0 HA GLN A 47 25.403 -3.882 18.245 1.00 38.08 H new ATOM 0 HB2 GLN A 47 25.330 -5.422 20.594 1.00 45.67 H new ATOM 0 HB3 GLN A 47 24.872 -3.935 20.700 1.00 45.67 H new ATOM 0 HG2 GLN A 47 23.148 -4.296 19.180 1.00 70.52 H new ATOM 0 HG3 GLN A 47 23.664 -5.737 18.877 1.00 70.52 H new ATOM 0 HE21 GLN A 47 22.017 -7.044 19.551 1.00 84.07 H new ATOM 0 HE22 GLN A 47 21.405 -7.047 20.909 1.00 84.07 H new HETATM 374 N MSE A 48 28.067 -3.792 19.951 1.00 31.90 N HETATM 375 CA MSE A 48 29.140 -2.916 20.406 1.00 32.00 C HETATM 376 C MSE A 48 29.752 -2.225 19.186 1.00 27.10 C HETATM 377 O MSE A 48 30.001 -1.019 19.202 1.00 27.41 O HETATM 378 CB MSE A 48 30.215 -3.727 21.130 1.00 32.42 C HETATM 379 CG MSE A 48 31.359 -2.901 21.683 1.00 36.02 C HETATM 380 SE MSE A 48 30.724 -1.582 22.938 1.00 56.53 SE HETATM 381 CE MSE A 48 31.977 -0.192 22.610 1.00 68.64 C HETATM 0 H MSE A 48 28.223 -4.632 20.053 1.00 31.90 H new HETATM 0 HA MSE A 48 28.784 -2.257 21.023 1.00 32.00 H new HETATM 0 HB2 MSE A 48 29.800 -4.214 21.859 1.00 32.42 H new HETATM 0 HB3 MSE A 48 30.574 -4.387 20.517 1.00 32.42 H new HETATM 0 HG2 MSE A 48 32.001 -3.483 22.119 1.00 36.02 H new HETATM 0 HG3 MSE A 48 31.825 -2.461 20.955 1.00 36.02 H new HETATM 0 HE1 MSE A 48 31.780 0.564 23.185 1.00 68.64 H new HETATM 0 HE2 MSE A 48 32.873 -0.514 22.795 1.00 68.64 H new HETATM 0 HE3 MSE A 48 31.918 0.085 21.682 1.00 68.64 H new ATOM 382 N ASN A 49 29.995 -3.005 18.134 1.00 24.67 N ATOM 383 CA ASN A 49 30.569 -2.483 16.900 1.00 28.47 C ATOM 384 C ASN A 49 29.717 -1.345 16.346 1.00 28.65 C ATOM 385 O ASN A 49 30.232 -0.302 15.926 1.00 26.05 O ATOM 386 CB ASN A 49 30.650 -3.580 15.835 1.00 32.85 C ATOM 387 CG ASN A 49 31.744 -4.586 16.105 1.00 27.16 C ATOM 388 OD1 ASN A 49 32.582 -4.400 16.988 1.00 33.91 O ATOM 389 ND2 ASN A 49 31.751 -5.654 15.331 1.00 23.68 N ATOM 0 H ASN A 49 29.832 -3.849 18.117 1.00 24.67 H new ATOM 0 HA ASN A 49 31.458 -2.158 17.110 1.00 28.47 H new ATOM 0 HB2 ASN A 49 29.798 -4.041 15.788 1.00 32.85 H new ATOM 0 HB3 ASN A 49 30.800 -3.172 14.968 1.00 32.85 H new ATOM 0 HD21 ASN A 49 32.358 -6.255 15.433 1.00 23.68 H new ATOM 0 HD22 ASN A 49 31.149 -5.749 14.724 1.00 23.68 H new ATOM 390 N LYS A 50 28.410 -1.565 16.333 1.00 26.45 N ATOM 391 CA LYS A 50 27.461 -0.583 15.818 1.00 29.05 C ATOM 392 C LYS A 50 27.479 0.708 16.622 1.00 25.51 C ATOM 393 O LYS A 50 27.490 1.807 16.055 1.00 25.56 O ATOM 394 CB LYS A 50 26.058 -1.183 15.837 1.00 39.48 C ATOM 395 CG LYS A 50 24.970 -0.300 15.265 1.00 44.69 C ATOM 396 CD LYS A 50 23.615 -1.000 15.346 1.00 45.41 C ATOM 397 CE LYS A 50 23.639 -2.342 14.620 1.00 55.09 C ATOM 398 NZ LYS A 50 22.339 -3.062 14.711 1.00 62.94 N ATOM 0 H LYS A 50 28.046 -2.288 16.622 1.00 26.45 H new ATOM 0 HA LYS A 50 27.722 -0.362 14.910 1.00 29.05 H new ATOM 0 HB2 LYS A 50 26.072 -2.017 15.341 1.00 39.48 H new ATOM 0 HB3 LYS A 50 25.828 -1.402 16.754 1.00 39.48 H new ATOM 0 HG2 LYS A 50 24.937 0.538 15.752 1.00 44.69 H new ATOM 0 HG3 LYS A 50 25.174 -0.084 14.342 1.00 44.69 H new ATOM 0 HD2 LYS A 50 23.375 -1.137 16.276 1.00 45.41 H new ATOM 0 HD3 LYS A 50 22.932 -0.432 14.957 1.00 45.41 H new ATOM 0 HE2 LYS A 50 23.861 -2.198 13.687 1.00 55.09 H new ATOM 0 HE3 LYS A 50 24.340 -2.897 14.996 1.00 55.09 H new ATOM 0 HZ1 LYS A 50 22.397 -3.836 14.276 1.00 62.94 H new ATOM 0 HZ2 LYS A 50 22.144 -3.216 15.566 1.00 62.94 H new ATOM 0 HZ3 LYS A 50 21.698 -2.564 14.346 1.00 62.94 H new ATOM 399 N GLN A 51 27.485 0.580 17.945 1.00 24.22 N ATOM 400 CA GLN A 51 27.488 1.752 18.804 1.00 29.57 C ATOM 401 C GLN A 51 28.815 2.498 18.772 1.00 26.62 C ATOM 402 O GLN A 51 28.837 3.720 18.899 1.00 30.50 O ATOM 403 CB GLN A 51 27.092 1.366 20.233 1.00 29.11 C ATOM 404 CG GLN A 51 25.615 0.960 20.324 1.00 27.58 C ATOM 405 CD GLN A 51 25.119 0.787 21.747 1.00 40.19 C ATOM 406 OE1 GLN A 51 25.412 1.599 22.621 1.00 40.68 O ATOM 407 NE2 GLN A 51 24.341 -0.265 21.979 1.00 43.20 N ATOM 0 H GLN A 51 27.487 -0.173 18.361 1.00 24.22 H new ATOM 0 HA GLN A 51 26.825 2.369 18.456 1.00 29.57 H new ATOM 0 HB2 GLN A 51 27.649 0.632 20.536 1.00 29.11 H new ATOM 0 HB3 GLN A 51 27.259 2.113 20.828 1.00 29.11 H new ATOM 0 HG2 GLN A 51 25.075 1.633 19.881 1.00 27.58 H new ATOM 0 HG3 GLN A 51 25.486 0.129 19.841 1.00 27.58 H new ATOM 0 HE21 GLN A 51 24.157 -0.813 21.342 1.00 43.20 H new ATOM 0 HE22 GLN A 51 24.021 -0.398 22.766 1.00 43.20 H new ATOM 408 N VAL A 52 29.917 1.776 18.586 1.00 22.72 N ATOM 409 CA VAL A 52 31.225 2.431 18.505 1.00 27.41 C ATOM 410 C VAL A 52 31.288 3.254 17.214 1.00 22.94 C ATOM 411 O VAL A 52 31.756 4.391 17.207 1.00 26.55 O ATOM 412 CB VAL A 52 32.381 1.403 18.503 1.00 28.31 C ATOM 413 CG1 VAL A 52 33.682 2.061 18.051 1.00 23.41 C ATOM 414 CG2 VAL A 52 32.563 0.842 19.895 1.00 29.77 C ATOM 0 H VAL A 52 29.933 0.920 18.505 1.00 22.72 H new ATOM 0 HA VAL A 52 31.328 2.999 19.285 1.00 27.41 H new ATOM 0 HB VAL A 52 32.159 0.689 17.886 1.00 28.31 H new ATOM 0 HG11 VAL A 52 34.396 1.404 18.055 1.00 23.41 H new ATOM 0 HG12 VAL A 52 33.572 2.413 17.154 1.00 23.41 H new ATOM 0 HG13 VAL A 52 33.906 2.785 18.656 1.00 23.41 H new ATOM 0 HG21 VAL A 52 33.288 0.198 19.892 1.00 29.77 H new ATOM 0 HG22 VAL A 52 32.774 1.562 20.509 1.00 29.77 H new ATOM 0 HG23 VAL A 52 31.744 0.405 20.178 1.00 29.77 H new ATOM 415 N PHE A 53 30.800 2.677 16.124 1.00 21.60 N ATOM 416 CA PHE A 53 30.792 3.366 14.842 1.00 28.21 C ATOM 417 C PHE A 53 29.943 4.629 14.934 1.00 26.00 C ATOM 418 O PHE A 53 30.316 5.689 14.429 1.00 21.90 O ATOM 419 CB PHE A 53 30.248 2.434 13.754 1.00 25.34 C ATOM 420 CG PHE A 53 30.159 3.071 12.386 1.00 27.42 C ATOM 421 CD1 PHE A 53 31.222 3.812 11.870 1.00 29.55 C ATOM 422 CD2 PHE A 53 29.019 2.907 11.607 1.00 28.87 C ATOM 423 CE1 PHE A 53 31.146 4.381 10.593 1.00 28.12 C ATOM 424 CE2 PHE A 53 28.930 3.469 10.333 1.00 28.38 C ATOM 425 CZ PHE A 53 29.996 4.208 9.825 1.00 35.57 C ATOM 0 H PHE A 53 30.468 1.884 16.106 1.00 21.60 H new ATOM 0 HA PHE A 53 31.699 3.619 14.611 1.00 28.21 H new ATOM 0 HB2 PHE A 53 30.816 1.650 13.699 1.00 25.34 H new ATOM 0 HB3 PHE A 53 29.366 2.127 14.016 1.00 25.34 H new ATOM 0 HD1 PHE A 53 31.991 3.930 12.380 1.00 29.55 H new ATOM 0 HD2 PHE A 53 28.304 2.415 11.941 1.00 28.87 H new ATOM 0 HE1 PHE A 53 31.861 4.873 10.258 1.00 28.12 H new ATOM 0 HE2 PHE A 53 28.161 3.350 9.824 1.00 28.38 H new ATOM 0 HZ PHE A 53 29.940 4.585 8.976 1.00 35.57 H new ATOM 426 N GLU A 54 28.794 4.514 15.586 1.00 28.44 N ATOM 427 CA GLU A 54 27.912 5.656 15.731 1.00 24.63 C ATOM 428 C GLU A 54 28.556 6.742 16.575 1.00 27.83 C ATOM 429 O GLU A 54 28.389 7.928 16.291 1.00 28.93 O ATOM 430 CB GLU A 54 26.565 5.214 16.316 1.00 24.32 C ATOM 431 CG GLU A 54 25.613 4.744 15.217 1.00 33.30 C ATOM 432 CD GLU A 54 24.322 4.148 15.736 1.00 51.88 C ATOM 433 OE1 GLU A 54 23.835 4.601 16.792 1.00 70.72 O ATOM 434 OE2 GLU A 54 23.783 3.237 15.071 1.00 64.87 O ATOM 0 H GLU A 54 28.510 3.788 15.949 1.00 28.44 H new ATOM 0 HA GLU A 54 27.750 6.034 14.853 1.00 24.63 H new ATOM 0 HB2 GLU A 54 26.706 4.497 16.954 1.00 24.32 H new ATOM 0 HB3 GLU A 54 26.163 5.951 16.802 1.00 24.32 H new ATOM 0 HG2 GLU A 54 25.403 5.495 14.640 1.00 33.30 H new ATOM 0 HG3 GLU A 54 26.066 4.084 14.669 1.00 33.30 H new ATOM 435 N GLN A 55 29.297 6.345 17.605 1.00 24.64 N ATOM 436 CA GLN A 55 29.968 7.330 18.441 1.00 23.54 C ATOM 437 C GLN A 55 31.016 8.036 17.583 1.00 26.09 C ATOM 438 O GLN A 55 31.168 9.252 17.657 1.00 23.31 O ATOM 439 CB GLN A 55 30.625 6.664 19.655 1.00 35.59 C ATOM 440 CG GLN A 55 29.633 6.264 20.748 1.00 44.03 C ATOM 441 CD GLN A 55 28.743 7.424 21.163 1.00 47.60 C ATOM 442 OE1 GLN A 55 29.230 8.515 21.447 1.00 43.59 O ATOM 443 NE2 GLN A 55 27.432 7.192 21.195 1.00 51.03 N ATOM 0 H GLN A 55 29.422 5.525 17.833 1.00 24.64 H new ATOM 0 HA GLN A 55 29.323 7.970 18.780 1.00 23.54 H new ATOM 0 HB2 GLN A 55 31.105 5.874 19.360 1.00 35.59 H new ATOM 0 HB3 GLN A 55 31.281 7.271 20.031 1.00 35.59 H new ATOM 0 HG2 GLN A 55 29.081 5.532 20.431 1.00 44.03 H new ATOM 0 HG3 GLN A 55 30.119 5.938 21.521 1.00 44.03 H new ATOM 0 HE21 GLN A 55 27.128 6.414 20.989 1.00 51.03 H new ATOM 0 HE22 GLN A 55 26.890 7.820 21.421 1.00 51.03 H new ATOM 444 N TRP A 56 31.715 7.271 16.748 1.00 18.28 N ATOM 445 CA TRP A 56 32.737 7.838 15.874 1.00 25.42 C ATOM 446 C TRP A 56 32.138 8.880 14.923 1.00 27.23 C ATOM 447 O TRP A 56 32.704 9.963 14.734 1.00 24.58 O ATOM 448 CB TRP A 56 33.422 6.727 15.074 1.00 29.60 C ATOM 449 CG TRP A 56 34.528 7.225 14.167 1.00 25.59 C ATOM 450 CD1 TRP A 56 35.829 7.493 14.511 1.00 22.82 C ATOM 451 CD2 TRP A 56 34.399 7.572 12.787 1.00 23.26 C ATOM 452 NE1 TRP A 56 36.516 7.993 13.423 1.00 26.77 N ATOM 453 CE2 TRP A 56 35.657 8.057 12.349 1.00 21.30 C ATOM 454 CE3 TRP A 56 33.337 7.532 11.870 1.00 18.11 C ATOM 455 CZ2 TRP A 56 35.887 8.492 11.038 1.00 22.45 C ATOM 456 CZ3 TRP A 56 33.563 7.969 10.553 1.00 25.79 C ATOM 457 CH2 TRP A 56 34.828 8.444 10.157 1.00 23.27 C ATOM 0 H TRP A 56 31.612 6.421 16.673 1.00 18.28 H new ATOM 0 HA TRP A 56 33.395 8.282 16.431 1.00 25.42 H new ATOM 0 HB2 TRP A 56 33.789 6.074 15.691 1.00 29.60 H new ATOM 0 HB3 TRP A 56 32.757 6.268 14.538 1.00 29.60 H new ATOM 0 HD1 TRP A 56 36.195 7.357 15.355 1.00 22.82 H new ATOM 0 HE1 TRP A 56 37.344 8.226 13.417 1.00 26.77 H new ATOM 0 HE3 TRP A 56 32.499 7.222 12.129 1.00 18.11 H new ATOM 0 HZ2 TRP A 56 36.723 8.802 10.772 1.00 22.45 H new ATOM 0 HZ3 TRP A 56 32.868 7.944 9.935 1.00 25.79 H new ATOM 0 HH2 TRP A 56 34.952 8.732 9.281 1.00 23.27 H new ATOM 458 N LEU A 57 30.986 8.553 14.340 1.00 20.11 N ATOM 459 CA LEU A 57 30.300 9.447 13.410 1.00 25.39 C ATOM 460 C LEU A 57 29.954 10.785 14.054 1.00 26.22 C ATOM 461 O LEU A 57 29.896 11.812 13.380 1.00 25.52 O ATOM 462 CB LEU A 57 29.012 8.788 12.895 1.00 20.48 C ATOM 463 CG LEU A 57 29.203 7.644 11.895 1.00 21.72 C ATOM 464 CD1 LEU A 57 27.872 6.933 11.654 1.00 26.36 C ATOM 465 CD2 LEU A 57 29.754 8.208 10.592 1.00 19.65 C ATOM 0 H LEU A 57 30.580 7.806 14.473 1.00 20.11 H new ATOM 0 HA LEU A 57 30.908 9.614 12.672 1.00 25.39 H new ATOM 0 HB2 LEU A 57 28.515 8.450 13.656 1.00 20.48 H new ATOM 0 HB3 LEU A 57 28.463 9.471 12.479 1.00 20.48 H new ATOM 0 HG LEU A 57 29.832 6.997 12.252 1.00 21.72 H new ATOM 0 HD11 LEU A 57 28.001 6.210 11.020 1.00 26.36 H new ATOM 0 HD12 LEU A 57 27.541 6.573 12.492 1.00 26.36 H new ATOM 0 HD13 LEU A 57 27.228 7.564 11.297 1.00 26.36 H new ATOM 0 HD21 LEU A 57 29.877 7.488 9.954 1.00 19.65 H new ATOM 0 HD22 LEU A 57 29.130 8.857 10.230 1.00 19.65 H new ATOM 0 HD23 LEU A 57 30.606 8.639 10.761 1.00 19.65 H new ATOM 466 N LEU A 58 29.721 10.760 15.360 1.00 20.38 N ATOM 467 CA LEU A 58 29.370 11.956 16.110 1.00 23.88 C ATOM 468 C LEU A 58 30.589 12.589 16.780 1.00 25.30 C ATOM 469 O LEU A 58 30.466 13.588 17.474 1.00 22.79 O ATOM 470 CB LEU A 58 28.329 11.606 17.178 1.00 31.87 C ATOM 471 CG LEU A 58 27.038 10.966 16.663 1.00 33.16 C ATOM 472 CD1 LEU A 58 26.169 10.529 17.838 1.00 42.58 C ATOM 473 CD2 LEU A 58 26.297 11.962 15.785 1.00 40.34 C ATOM 0 H LEU A 58 29.762 10.046 15.837 1.00 20.38 H new ATOM 0 HA LEU A 58 29.006 12.600 15.483 1.00 23.88 H new ATOM 0 HB2 LEU A 58 28.737 11.002 17.818 1.00 31.87 H new ATOM 0 HB3 LEU A 58 28.099 12.416 17.660 1.00 31.87 H new ATOM 0 HG LEU A 58 27.251 10.181 16.135 1.00 33.16 H new ATOM 0 HD11 LEU A 58 25.353 10.125 17.504 1.00 42.58 H new ATOM 0 HD12 LEU A 58 26.653 9.883 18.376 1.00 42.58 H new ATOM 0 HD13 LEU A 58 25.948 11.301 18.382 1.00 42.58 H new ATOM 0 HD21 LEU A 58 25.478 11.558 15.457 1.00 40.34 H new ATOM 0 HD22 LEU A 58 26.082 12.753 16.303 1.00 40.34 H new ATOM 0 HD23 LEU A 58 26.857 12.211 15.033 1.00 40.34 H new ATOM 474 N THR A 59 31.768 12.021 16.556 1.00 26.19 N ATOM 475 CA THR A 59 32.982 12.544 17.177 1.00 30.52 C ATOM 476 C THR A 59 33.766 13.536 16.323 1.00 29.60 C ATOM 477 O THR A 59 33.858 13.384 15.107 1.00 21.10 O ATOM 478 CB THR A 59 33.933 11.395 17.558 1.00 31.53 C ATOM 479 OG1 THR A 59 33.240 10.470 18.408 1.00 30.42 O ATOM 480 CG2 THR A 59 35.162 11.932 18.284 1.00 27.88 C ATOM 0 H THR A 59 31.888 11.336 16.051 1.00 26.19 H new ATOM 0 HA THR A 59 32.664 13.025 17.957 1.00 30.52 H new ATOM 0 HB THR A 59 34.224 10.947 16.748 1.00 31.53 H new ATOM 0 HG1 THR A 59 32.802 9.930 17.937 1.00 30.42 H new ATOM 0 HG21 THR A 59 35.749 11.195 18.516 1.00 27.88 H new ATOM 0 HG22 THR A 59 35.634 12.552 17.706 1.00 27.88 H new ATOM 0 HG23 THR A 59 34.886 12.391 19.092 1.00 27.88 H new ATOM 481 N ASP A 60 34.330 14.557 16.967 1.00 26.13 N ATOM 482 CA ASP A 60 35.149 15.544 16.262 1.00 23.61 C ATOM 483 C ASP A 60 36.508 14.876 16.106 1.00 26.91 C ATOM 484 O ASP A 60 37.180 14.590 17.098 1.00 29.04 O ATOM 485 CB ASP A 60 35.317 16.823 17.088 1.00 28.72 C ATOM 486 CG ASP A 60 36.033 17.931 16.317 1.00 30.79 C ATOM 487 OD1 ASP A 60 36.908 17.629 15.471 1.00 26.52 O ATOM 488 OD2 ASP A 60 35.723 19.111 16.565 1.00 38.37 O ATOM 0 H ASP A 60 34.251 14.697 17.812 1.00 26.13 H new ATOM 0 HA ASP A 60 34.743 15.799 15.419 1.00 23.61 H new ATOM 0 HB2 ASP A 60 34.444 17.140 17.368 1.00 28.72 H new ATOM 0 HB3 ASP A 60 35.817 16.620 17.894 1.00 28.72 H new ATOM 489 N LEU A 61 36.920 14.628 14.870 1.00 20.83 N ATOM 490 CA LEU A 61 38.189 13.952 14.641 1.00 23.13 C ATOM 491 C LEU A 61 39.389 14.593 15.354 1.00 29.71 C ATOM 492 O LEU A 61 40.396 13.927 15.598 1.00 26.12 O ATOM 493 CB LEU A 61 38.452 13.816 13.137 1.00 25.59 C ATOM 494 CG LEU A 61 37.467 12.906 12.381 1.00 24.21 C ATOM 495 CD1 LEU A 61 38.020 12.584 10.995 1.00 16.02 C ATOM 496 CD2 LEU A 61 37.260 11.603 13.143 1.00 25.56 C ATOM 0 H LEU A 61 36.486 14.840 14.158 1.00 20.83 H new ATOM 0 HA LEU A 61 38.099 13.072 15.040 1.00 23.13 H new ATOM 0 HB2 LEU A 61 38.426 14.699 12.737 1.00 25.59 H new ATOM 0 HB3 LEU A 61 39.350 13.473 13.010 1.00 25.59 H new ATOM 0 HG LEU A 61 36.619 13.371 12.299 1.00 24.21 H new ATOM 0 HD11 LEU A 61 37.396 12.011 10.523 1.00 16.02 H new ATOM 0 HD12 LEU A 61 38.143 13.407 10.496 1.00 16.02 H new ATOM 0 HD13 LEU A 61 38.872 12.130 11.084 1.00 16.02 H new ATOM 0 HD21 LEU A 61 36.638 11.039 12.657 1.00 25.56 H new ATOM 0 HD22 LEU A 61 38.109 11.143 13.235 1.00 25.56 H new ATOM 0 HD23 LEU A 61 36.901 11.796 14.023 1.00 25.56 H new ATOM 497 N ARG A 62 39.294 15.873 15.695 1.00 31.37 N ATOM 498 CA ARG A 62 40.402 16.513 16.406 1.00 42.80 C ATOM 499 C ARG A 62 40.638 15.864 17.777 1.00 39.24 C ATOM 500 O ARG A 62 41.759 15.866 18.286 1.00 44.48 O ATOM 501 CB ARG A 62 40.145 18.011 16.596 1.00 38.44 C ATOM 502 CG ARG A 62 40.715 18.890 15.493 1.00 49.72 C ATOM 503 CD ARG A 62 39.674 19.248 14.451 1.00 61.04 C ATOM 504 NE ARG A 62 38.647 20.130 14.998 1.00 60.24 N ATOM 505 CZ ARG A 62 37.690 20.698 14.274 1.00 69.21 C ATOM 506 NH1 ARG A 62 37.629 20.477 12.969 1.00 74.29 N ATOM 507 NH2 ARG A 62 36.793 21.485 14.853 1.00 71.63 N ATOM 0 H ARG A 62 38.618 16.379 15.531 1.00 31.37 H new ATOM 0 HA ARG A 62 41.194 16.392 15.860 1.00 42.80 H new ATOM 0 HB2 ARG A 62 39.188 18.160 16.651 1.00 38.44 H new ATOM 0 HB3 ARG A 62 40.525 18.288 17.444 1.00 38.44 H new ATOM 0 HG2 ARG A 62 41.074 19.703 15.882 1.00 49.72 H new ATOM 0 HG3 ARG A 62 41.454 18.430 15.065 1.00 49.72 H new ATOM 0 HD2 ARG A 62 40.105 19.681 13.697 1.00 61.04 H new ATOM 0 HD3 ARG A 62 39.260 18.438 14.114 1.00 61.04 H new ATOM 0 HE ARG A 62 38.663 20.292 15.842 1.00 60.24 H new ATOM 0 HH11 ARG A 62 38.209 19.966 12.592 1.00 74.29 H new ATOM 0 HH12 ARG A 62 37.009 20.844 12.499 1.00 74.29 H new ATOM 0 HH21 ARG A 62 36.830 21.629 15.700 1.00 71.63 H new ATOM 0 HH22 ARG A 62 36.174 21.852 14.381 1.00 71.63 H new ATOM 508 N ASP A 63 39.585 15.308 18.372 1.00 33.25 N ATOM 509 CA ASP A 63 39.705 14.661 19.682 1.00 33.86 C ATOM 510 C ASP A 63 40.598 13.431 19.636 1.00 40.00 C ATOM 511 O ASP A 63 41.267 13.105 20.614 1.00 36.76 O ATOM 512 CB ASP A 63 38.338 14.214 20.208 1.00 31.00 C ATOM 513 CG ASP A 63 37.408 15.368 20.494 1.00 35.02 C ATOM 514 OD1 ASP A 63 37.845 16.530 20.392 1.00 40.97 O ATOM 515 OD2 ASP A 63 36.232 15.104 20.830 1.00 42.93 O ATOM 0 H ASP A 63 38.793 15.293 18.037 1.00 33.25 H new ATOM 0 HA ASP A 63 40.096 15.327 20.268 1.00 33.86 H new ATOM 0 HB2 ASP A 63 37.924 13.625 19.558 1.00 31.00 H new ATOM 0 HB3 ASP A 63 38.463 13.697 21.019 1.00 31.00 H new ATOM 516 N LEU A 64 40.599 12.745 18.500 1.00 31.59 N ATOM 517 CA LEU A 64 41.382 11.529 18.357 1.00 37.08 C ATOM 518 C LEU A 64 42.885 11.725 18.217 1.00 35.10 C ATOM 519 O LEU A 64 43.654 10.834 18.577 1.00 33.86 O ATOM 520 CB LEU A 64 40.862 10.713 17.170 1.00 37.15 C ATOM 521 CG LEU A 64 39.546 9.953 17.362 1.00 40.87 C ATOM 522 CD1 LEU A 64 38.415 10.906 17.718 1.00 43.98 C ATOM 523 CD2 LEU A 64 39.228 9.201 16.077 1.00 42.30 C ATOM 0 H LEU A 64 40.152 12.968 17.800 1.00 31.59 H new ATOM 0 HA LEU A 64 41.263 11.057 19.196 1.00 37.08 H new ATOM 0 HB2 LEU A 64 40.754 11.314 16.417 1.00 37.15 H new ATOM 0 HB3 LEU A 64 41.546 10.071 16.924 1.00 37.15 H new ATOM 0 HG LEU A 64 39.639 9.326 18.096 1.00 40.87 H new ATOM 0 HD11 LEU A 64 37.593 10.404 17.835 1.00 43.98 H new ATOM 0 HD12 LEU A 64 38.630 11.370 18.542 1.00 43.98 H new ATOM 0 HD13 LEU A 64 38.300 11.553 17.004 1.00 43.98 H new ATOM 0 HD21 LEU A 64 38.396 8.714 16.184 1.00 42.30 H new ATOM 0 HD22 LEU A 64 39.141 9.832 15.346 1.00 42.30 H new ATOM 0 HD23 LEU A 64 39.944 8.577 15.881 1.00 42.30 H new ATOM 524 N GLU A 65 43.308 12.874 17.696 1.00 31.85 N ATOM 525 CA GLU A 65 44.735 13.130 17.518 1.00 43.14 C ATOM 526 C GLU A 65 45.346 11.909 16.833 1.00 41.69 C ATOM 527 O GLU A 65 46.378 11.386 17.259 1.00 31.32 O ATOM 528 CB GLU A 65 45.400 13.356 18.879 1.00 50.48 C ATOM 529 CG GLU A 65 45.049 14.688 19.529 1.00 63.50 C ATOM 530 CD GLU A 65 45.493 14.770 20.980 1.00 72.54 C ATOM 531 OE1 GLU A 65 46.649 14.398 21.278 1.00 73.62 O ATOM 532 OE2 GLU A 65 44.685 15.214 21.823 1.00 80.41 O ATOM 0 H GLU A 65 42.791 13.513 17.441 1.00 31.85 H new ATOM 0 HA GLU A 65 44.872 13.924 16.978 1.00 43.14 H new ATOM 0 HB2 GLU A 65 45.142 12.637 19.477 1.00 50.48 H new ATOM 0 HB3 GLU A 65 46.362 13.304 18.771 1.00 50.48 H new ATOM 0 HG2 GLU A 65 45.463 15.407 19.027 1.00 63.50 H new ATOM 0 HG3 GLU A 65 44.090 14.824 19.480 1.00 63.50 H new ATOM 533 N HIS A 66 44.692 11.465 15.764 1.00 29.31 N ATOM 534 CA HIS A 66 45.120 10.287 15.026 1.00 31.16 C ATOM 535 C HIS A 66 45.235 10.612 13.538 1.00 31.15 C ATOM 536 O HIS A 66 44.230 10.661 12.826 1.00 29.48 O ATOM 537 CB HIS A 66 44.095 9.179 15.248 1.00 31.15 C ATOM 538 CG HIS A 66 44.541 7.834 14.775 1.00 29.93 C ATOM 539 ND1 HIS A 66 45.642 7.190 15.305 1.00 34.36 N ATOM 540 CD2 HIS A 66 44.036 7.004 13.837 1.00 29.45 C ATOM 541 CE1 HIS A 66 45.791 6.024 14.711 1.00 43.49 C ATOM 542 NE2 HIS A 66 44.829 5.882 13.813 1.00 38.46 N ATOM 0 H HIS A 66 43.986 11.841 15.447 1.00 29.31 H new ATOM 0 HA HIS A 66 45.991 9.997 15.340 1.00 31.16 H new ATOM 0 HB2 HIS A 66 43.889 9.127 16.194 1.00 31.15 H new ATOM 0 HB3 HIS A 66 43.273 9.416 14.791 1.00 31.15 H new ATOM 0 HD2 HIS A 66 43.289 7.162 13.305 1.00 29.45 H new ATOM 0 HE1 HIS A 66 46.460 5.404 14.892 1.00 43.49 H new ATOM 0 HE2 HIS A 66 44.719 5.201 13.300 1.00 38.46 H new ATOM 543 N PRO A 67 46.466 10.831 13.048 1.00 28.51 N ATOM 544 CA PRO A 67 46.672 11.159 11.634 1.00 33.71 C ATOM 545 C PRO A 67 46.212 10.083 10.662 1.00 31.92 C ATOM 546 O PRO A 67 46.455 8.897 10.870 1.00 27.78 O ATOM 547 CB PRO A 67 48.179 11.426 11.553 1.00 33.74 C ATOM 548 CG PRO A 67 48.737 10.566 12.636 1.00 41.22 C ATOM 549 CD PRO A 67 47.753 10.781 13.767 1.00 37.77 C ATOM 0 HA PRO A 67 46.131 11.917 11.361 1.00 33.71 H new ATOM 0 HB2 PRO A 67 48.539 11.187 10.685 1.00 33.74 H new ATOM 0 HB3 PRO A 67 48.385 12.363 11.697 1.00 33.74 H new ATOM 0 HG2 PRO A 67 48.783 9.634 12.370 1.00 41.22 H new ATOM 0 HG3 PRO A 67 49.636 10.835 12.883 1.00 41.22 H new ATOM 0 HD2 PRO A 67 47.780 10.059 14.414 1.00 37.77 H new ATOM 0 HD3 PRO A 67 47.930 11.602 14.252 1.00 37.77 H new ATOM 550 N LEU A 68 45.537 10.513 9.604 1.00 25.45 N ATOM 551 CA LEU A 68 45.042 9.598 8.588 1.00 25.88 C ATOM 552 C LEU A 68 45.738 9.863 7.266 1.00 29.00 C ATOM 553 O LEU A 68 46.233 8.945 6.624 1.00 25.73 O ATOM 554 CB LEU A 68 43.538 9.779 8.400 1.00 22.67 C ATOM 555 CG LEU A 68 42.654 9.505 9.617 1.00 22.52 C ATOM 556 CD1 LEU A 68 41.198 9.778 9.264 1.00 19.34 C ATOM 557 CD2 LEU A 68 42.849 8.067 10.071 1.00 21.47 C ATOM 0 H LEU A 68 45.354 11.340 9.456 1.00 25.45 H new ATOM 0 HA LEU A 68 45.225 8.691 8.879 1.00 25.88 H new ATOM 0 HB2 LEU A 68 43.377 10.690 8.108 1.00 22.67 H new ATOM 0 HB3 LEU A 68 43.251 9.196 7.680 1.00 22.67 H new ATOM 0 HG LEU A 68 42.904 10.093 10.347 1.00 22.52 H new ATOM 0 HD11 LEU A 68 40.639 9.604 10.037 1.00 19.34 H new ATOM 0 HD12 LEU A 68 41.098 10.705 8.996 1.00 19.34 H new ATOM 0 HD13 LEU A 68 40.928 9.200 8.534 1.00 19.34 H new ATOM 0 HD21 LEU A 68 42.288 7.892 10.843 1.00 21.47 H new ATOM 0 HD22 LEU A 68 42.604 7.464 9.351 1.00 21.47 H new ATOM 0 HD23 LEU A 68 43.779 7.926 10.308 1.00 21.47 H new ATOM 558 N LEU A 69 45.767 11.132 6.872 1.00 31.49 N ATOM 559 CA LEU A 69 46.375 11.540 5.615 1.00 29.06 C ATOM 560 C LEU A 69 47.886 11.384 5.603 1.00 30.68 C ATOM 561 O LEU A 69 48.552 11.595 6.613 1.00 24.50 O ATOM 562 CB LEU A 69 45.987 12.986 5.309 1.00 21.91 C ATOM 563 CG LEU A 69 44.495 13.094 4.993 1.00 19.66 C ATOM 564 CD1 LEU A 69 44.025 14.541 5.052 1.00 20.69 C ATOM 565 CD2 LEU A 69 44.239 12.478 3.623 1.00 22.45 C ATOM 0 H LEU A 69 45.434 11.780 7.328 1.00 31.49 H new ATOM 0 HA LEU A 69 46.036 10.948 4.926 1.00 29.06 H new ATOM 0 HB2 LEU A 69 46.203 13.550 6.068 1.00 21.91 H new ATOM 0 HB3 LEU A 69 46.505 13.312 4.557 1.00 21.91 H new ATOM 0 HG LEU A 69 43.985 12.609 5.660 1.00 19.66 H new ATOM 0 HD11 LEU A 69 43.078 14.582 4.848 1.00 20.69 H new ATOM 0 HD12 LEU A 69 44.180 14.896 5.941 1.00 20.69 H new ATOM 0 HD13 LEU A 69 44.518 15.068 4.404 1.00 20.69 H new ATOM 0 HD21 LEU A 69 43.294 12.541 3.411 1.00 22.45 H new ATOM 0 HD22 LEU A 69 44.753 12.955 2.952 1.00 22.45 H new ATOM 0 HD23 LEU A 69 44.507 11.546 3.632 1.00 22.45 H new ATOM 566 N PRO A 70 48.450 11.038 4.437 1.00 37.47 N ATOM 567 CA PRO A 70 49.899 10.858 4.318 1.00 43.87 C ATOM 568 C PRO A 70 50.631 12.147 4.638 1.00 45.36 C ATOM 569 O PRO A 70 50.168 13.240 4.300 1.00 36.20 O ATOM 570 CB PRO A 70 50.107 10.453 2.854 1.00 45.14 C ATOM 571 CG PRO A 70 48.745 10.512 2.209 1.00 45.95 C ATOM 572 CD PRO A 70 47.835 11.259 3.121 1.00 41.65 C ATOM 0 HA PRO A 70 50.245 10.196 4.937 1.00 43.87 H new ATOM 0 HB2 PRO A 70 50.727 11.054 2.412 1.00 45.14 H new ATOM 0 HB3 PRO A 70 50.483 9.561 2.790 1.00 45.14 H new ATOM 0 HG2 PRO A 70 48.797 10.953 1.347 1.00 45.95 H new ATOM 0 HG3 PRO A 70 48.406 9.617 2.050 1.00 45.95 H new ATOM 0 HD2 PRO A 70 47.793 12.202 2.896 1.00 41.65 H new ATOM 0 HD3 PRO A 70 46.928 10.918 3.085 1.00 41.65 H new ATOM 573 N ASP A 71 51.777 12.004 5.291 1.00 48.65 N ATOM 574 CA ASP A 71 52.610 13.133 5.666 1.00 52.82 C ATOM 575 C ASP A 71 53.196 13.759 4.404 1.00 49.34 C ATOM 576 O ASP A 71 53.913 13.100 3.658 1.00 55.35 O ATOM 577 CB ASP A 71 53.742 12.644 6.577 1.00 63.71 C ATOM 578 CG ASP A 71 54.662 13.759 7.028 1.00 73.60 C ATOM 579 OD1 ASP A 71 54.543 14.888 6.506 1.00 82.60 O ATOM 580 OD2 ASP A 71 55.512 13.503 7.907 1.00 79.88 O ATOM 0 H ASP A 71 52.094 11.241 5.530 1.00 48.65 H new ATOM 0 HA ASP A 71 52.081 13.794 6.139 1.00 52.82 H new ATOM 0 HB2 ASP A 71 53.359 12.212 7.357 1.00 63.71 H new ATOM 0 HB3 ASP A 71 54.261 11.973 6.107 1.00 63.71 H new ATOM 581 N GLY A 72 52.877 15.025 4.158 1.00 55.40 N ATOM 582 CA GLY A 72 53.419 15.697 2.992 1.00 55.13 C ATOM 583 C GLY A 72 52.452 16.010 1.867 1.00 58.78 C ATOM 584 O GLY A 72 52.874 16.426 0.786 1.00 61.73 O ATOM 0 H GLY A 72 52.356 15.504 4.647 1.00 55.40 H new ATOM 0 HA2 GLY A 72 53.822 16.530 3.284 1.00 55.13 H new ATOM 0 HA3 GLY A 72 54.133 15.148 2.632 1.00 55.13 H new ATOM 585 N ILE A 73 51.159 15.823 2.106 1.00 47.10 N ATOM 586 CA ILE A 73 50.168 16.101 1.073 1.00 43.56 C ATOM 587 C ILE A 73 50.030 17.610 0.844 1.00 38.78 C ATOM 588 O ILE A 73 49.744 18.058 -0.264 1.00 43.07 O ATOM 589 CB ILE A 73 48.793 15.519 1.459 1.00 35.50 C ATOM 590 CG1 ILE A 73 47.835 15.619 0.275 1.00 32.98 C ATOM 591 CG2 ILE A 73 48.229 16.265 2.660 1.00 42.82 C ATOM 592 CD1 ILE A 73 46.494 14.950 0.516 1.00 49.39 C ATOM 0 H ILE A 73 50.837 15.539 2.851 1.00 47.10 H new ATOM 0 HA ILE A 73 50.474 15.680 0.254 1.00 43.56 H new ATOM 0 HB ILE A 73 48.900 14.585 1.696 1.00 35.50 H new ATOM 0 HG12 ILE A 73 47.688 16.555 0.067 1.00 32.98 H new ATOM 0 HG13 ILE A 73 48.252 15.218 -0.503 1.00 32.98 H new ATOM 0 HG21 ILE A 73 47.365 15.893 2.896 1.00 42.82 H new ATOM 0 HG22 ILE A 73 48.836 16.174 3.412 1.00 42.82 H new ATOM 0 HG23 ILE A 73 48.127 17.204 2.439 1.00 42.82 H new ATOM 0 HD11 ILE A 73 45.936 15.050 -0.271 1.00 49.39 H new ATOM 0 HD12 ILE A 73 46.631 14.007 0.697 1.00 49.39 H new ATOM 0 HD13 ILE A 73 46.057 15.365 1.276 1.00 49.39 H new ATOM 593 N LEU A 74 50.236 18.390 1.898 1.00 32.88 N ATOM 594 CA LEU A 74 50.132 19.841 1.794 1.00 33.19 C ATOM 595 C LEU A 74 51.397 20.486 1.222 1.00 36.71 C ATOM 596 O LEU A 74 51.375 21.641 0.796 1.00 43.07 O ATOM 597 CB LEU A 74 49.822 20.437 3.169 1.00 41.44 C ATOM 598 CG LEU A 74 48.453 20.076 3.753 1.00 44.36 C ATOM 599 CD1 LEU A 74 48.328 20.623 5.174 1.00 40.12 C ATOM 600 CD2 LEU A 74 47.359 20.644 2.856 1.00 33.17 C ATOM 0 H LEU A 74 50.437 18.100 2.682 1.00 32.88 H new ATOM 0 HA LEU A 74 49.410 20.032 1.175 1.00 33.19 H new ATOM 0 HB2 LEU A 74 50.508 20.148 3.791 1.00 41.44 H new ATOM 0 HB3 LEU A 74 49.885 21.403 3.107 1.00 41.44 H new ATOM 0 HG LEU A 74 48.359 19.111 3.793 1.00 44.36 H new ATOM 0 HD11 LEU A 74 47.459 20.390 5.535 1.00 40.12 H new ATOM 0 HD12 LEU A 74 49.023 20.239 5.731 1.00 40.12 H new ATOM 0 HD13 LEU A 74 48.423 21.588 5.159 1.00 40.12 H new ATOM 0 HD21 LEU A 74 46.490 20.418 3.222 1.00 33.17 H new ATOM 0 HD22 LEU A 74 47.448 21.609 2.808 1.00 33.17 H new ATOM 0 HD23 LEU A 74 47.442 20.268 1.966 1.00 33.17 H new ATOM 601 N GLU A 75 52.493 19.738 1.202 1.00 38.66 N ATOM 602 CA GLU A 75 53.759 20.264 0.700 1.00 48.74 C ATOM 603 C GLU A 75 54.008 19.999 -0.787 1.00 45.09 C ATOM 604 O GLU A 75 54.786 20.704 -1.423 1.00 48.01 O ATOM 605 CB GLU A 75 54.910 19.698 1.530 1.00 55.22 C ATOM 606 CG GLU A 75 54.723 19.901 3.025 1.00 70.05 C ATOM 607 CD GLU A 75 55.905 19.413 3.831 1.00 79.31 C ATOM 608 OE1 GLU A 75 56.296 18.237 3.664 1.00 83.68 O ATOM 609 OE2 GLU A 75 56.439 20.205 4.635 1.00 83.96 O ATOM 0 H GLU A 75 52.527 18.923 1.474 1.00 38.66 H new ATOM 0 HA GLU A 75 53.707 21.228 0.790 1.00 48.74 H new ATOM 0 HB2 GLU A 75 54.998 18.750 1.346 1.00 55.22 H new ATOM 0 HB3 GLU A 75 55.739 20.119 1.253 1.00 55.22 H new ATOM 0 HG2 GLU A 75 54.581 20.844 3.205 1.00 70.05 H new ATOM 0 HG3 GLU A 75 53.924 19.433 3.314 1.00 70.05 H new ATOM 610 N ILE A 76 53.353 18.982 -1.336 1.00 40.94 N ATOM 611 CA ILE A 76 53.507 18.649 -2.751 1.00 31.94 C ATOM 612 C ILE A 76 52.560 19.521 -3.577 1.00 31.85 C ATOM 613 O ILE A 76 51.341 19.449 -3.421 1.00 30.81 O ATOM 614 CB ILE A 76 53.207 17.151 -2.981 1.00 37.48 C ATOM 615 CG1 ILE A 76 54.167 16.315 -2.131 1.00 42.03 C ATOM 616 CG2 ILE A 76 53.359 16.800 -4.449 1.00 37.38 C ATOM 617 CD1 ILE A 76 53.811 14.854 -2.041 1.00 47.12 C ATOM 0 H ILE A 76 52.812 18.470 -0.906 1.00 40.94 H new ATOM 0 HA ILE A 76 54.421 18.820 -3.029 1.00 31.94 H new ATOM 0 HB ILE A 76 52.293 16.960 -2.720 1.00 37.48 H new ATOM 0 HG12 ILE A 76 55.061 16.396 -2.499 1.00 42.03 H new ATOM 0 HG13 ILE A 76 54.194 16.685 -1.235 1.00 42.03 H new ATOM 0 HG21 ILE A 76 53.168 15.858 -4.578 1.00 37.38 H new ATOM 0 HG22 ILE A 76 52.740 17.330 -4.974 1.00 37.38 H new ATOM 0 HG23 ILE A 76 54.267 16.987 -4.734 1.00 37.38 H new ATOM 0 HD11 ILE A 76 54.463 14.395 -1.489 1.00 47.12 H new ATOM 0 HD12 ILE A 76 52.930 14.759 -1.647 1.00 47.12 H new ATOM 0 HD13 ILE A 76 53.810 14.466 -2.930 1.00 47.12 H new ATOM 618 N PRO A 77 53.117 20.367 -4.465 1.00 33.10 N ATOM 619 CA PRO A 77 52.337 21.269 -5.320 1.00 25.76 C ATOM 620 C PRO A 77 51.292 20.580 -6.184 1.00 22.93 C ATOM 621 O PRO A 77 50.185 21.081 -6.347 1.00 23.77 O ATOM 622 CB PRO A 77 53.407 21.968 -6.159 1.00 35.50 C ATOM 623 CG PRO A 77 54.600 21.961 -5.261 1.00 36.34 C ATOM 624 CD PRO A 77 54.560 20.568 -4.685 1.00 36.92 C ATOM 0 HA PRO A 77 51.796 21.875 -4.790 1.00 25.76 H new ATOM 0 HB2 PRO A 77 53.579 21.494 -6.988 1.00 35.50 H new ATOM 0 HB3 PRO A 77 53.143 22.870 -6.398 1.00 35.50 H new ATOM 0 HG2 PRO A 77 55.422 22.127 -5.749 1.00 36.34 H new ATOM 0 HG3 PRO A 77 54.538 22.640 -4.571 1.00 36.34 H new ATOM 0 HD2 PRO A 77 54.929 19.912 -5.297 1.00 36.92 H new ATOM 0 HD3 PRO A 77 55.066 20.502 -3.860 1.00 36.92 H new ATOM 625 N LYS A 78 51.650 19.432 -6.743 1.00 22.98 N ATOM 626 CA LYS A 78 50.729 18.692 -7.592 1.00 27.00 C ATOM 627 C LYS A 78 51.037 17.211 -7.502 1.00 25.91 C ATOM 628 O LYS A 78 52.198 16.805 -7.546 1.00 29.10 O ATOM 629 CB LYS A 78 50.843 19.155 -9.046 1.00 24.67 C ATOM 630 CG LYS A 78 49.861 18.447 -9.973 1.00 26.23 C ATOM 631 CD LYS A 78 49.866 19.047 -11.380 1.00 34.80 C ATOM 632 CE LYS A 78 48.716 18.484 -12.211 1.00 40.30 C ATOM 633 NZ LYS A 78 48.719 18.978 -13.621 1.00 51.46 N ATOM 0 H LYS A 78 52.421 19.065 -6.643 1.00 22.98 H new ATOM 0 HA LYS A 78 49.823 18.857 -7.286 1.00 27.00 H new ATOM 0 HB2 LYS A 78 50.689 20.112 -9.089 1.00 24.67 H new ATOM 0 HB3 LYS A 78 51.747 18.999 -9.360 1.00 24.67 H new ATOM 0 HG2 LYS A 78 50.087 17.505 -10.023 1.00 26.23 H new ATOM 0 HG3 LYS A 78 48.967 18.505 -9.601 1.00 26.23 H new ATOM 0 HD2 LYS A 78 49.789 20.012 -11.325 1.00 34.80 H new ATOM 0 HD3 LYS A 78 50.711 18.854 -11.816 1.00 34.80 H new ATOM 0 HE2 LYS A 78 48.769 17.515 -12.213 1.00 40.30 H new ATOM 0 HE3 LYS A 78 47.874 18.722 -11.792 1.00 40.30 H new ATOM 0 HZ1 LYS A 78 48.032 18.623 -14.062 1.00 51.46 H new ATOM 0 HZ2 LYS A 78 48.647 19.865 -13.625 1.00 51.46 H new ATOM 0 HZ3 LYS A 78 49.480 18.741 -14.017 1.00 51.46 H new ATOM 634 N GLY A 79 50.000 16.397 -7.368 1.00 23.67 N ATOM 635 CA GLY A 79 50.233 14.972 -7.260 1.00 22.79 C ATOM 636 C GLY A 79 48.962 14.154 -7.230 1.00 22.21 C ATOM 637 O GLY A 79 47.895 14.596 -7.664 1.00 20.99 O ATOM 0 H GLY A 79 49.176 16.643 -7.338 1.00 23.67 H new ATOM 0 HA2 GLY A 79 50.778 14.683 -8.009 1.00 22.79 H new ATOM 0 HA3 GLY A 79 50.742 14.795 -6.454 1.00 22.79 H new ATOM 638 N GLU A 80 49.092 12.940 -6.716 1.00 26.61 N ATOM 639 CA GLU A 80 47.977 12.022 -6.616 1.00 24.73 C ATOM 640 C GLU A 80 47.980 11.357 -5.265 1.00 23.07 C ATOM 641 O GLU A 80 49.031 11.001 -4.733 1.00 25.74 O ATOM 642 CB GLU A 80 48.070 10.954 -7.709 1.00 35.21 C ATOM 643 CG GLU A 80 47.482 11.383 -9.037 1.00 36.78 C ATOM 644 CD GLU A 80 47.789 10.404 -10.161 1.00 48.22 C ATOM 645 OE1 GLU A 80 47.982 9.203 -9.881 1.00 35.36 O ATOM 646 OE2 GLU A 80 47.824 10.834 -11.330 1.00 41.45 O ATOM 0 H GLU A 80 49.834 12.627 -6.415 1.00 26.61 H new ATOM 0 HA GLU A 80 47.153 12.522 -6.729 1.00 24.73 H new ATOM 0 HB2 GLU A 80 49.002 10.717 -7.839 1.00 35.21 H new ATOM 0 HB3 GLU A 80 47.613 10.153 -7.406 1.00 35.21 H new ATOM 0 HG2 GLU A 80 46.521 11.474 -8.946 1.00 36.78 H new ATOM 0 HG3 GLU A 80 47.829 12.258 -9.272 1.00 36.78 H new ATOM 647 N LEU A 81 46.788 11.210 -4.706 1.00 25.51 N ATOM 648 CA LEU A 81 46.616 10.566 -3.416 1.00 20.64 C ATOM 649 C LEU A 81 45.924 9.231 -3.655 1.00 20.37 C ATOM 650 O LEU A 81 44.935 9.168 -4.379 1.00 22.71 O ATOM 651 CB LEU A 81 45.736 11.429 -2.505 1.00 24.13 C ATOM 652 CG LEU A 81 45.289 10.824 -1.170 1.00 25.25 C ATOM 653 CD1 LEU A 81 46.494 10.665 -0.251 1.00 24.19 C ATOM 654 CD2 LEU A 81 44.247 11.733 -0.514 1.00 25.42 C ATOM 0 H LEU A 81 46.055 11.482 -5.065 1.00 25.51 H new ATOM 0 HA LEU A 81 47.478 10.443 -2.989 1.00 20.64 H new ATOM 0 HB2 LEU A 81 46.217 12.250 -2.315 1.00 24.13 H new ATOM 0 HB3 LEU A 81 44.941 11.675 -3.003 1.00 24.13 H new ATOM 0 HG LEU A 81 44.893 9.953 -1.328 1.00 25.25 H new ATOM 0 HD11 LEU A 81 46.209 10.282 0.593 1.00 24.19 H new ATOM 0 HD12 LEU A 81 47.144 10.079 -0.668 1.00 24.19 H new ATOM 0 HD13 LEU A 81 46.897 11.533 -0.092 1.00 24.19 H new ATOM 0 HD21 LEU A 81 43.966 11.347 0.331 1.00 25.42 H new ATOM 0 HD22 LEU A 81 44.634 12.608 -0.356 1.00 25.42 H new ATOM 0 HD23 LEU A 81 43.479 11.821 -1.100 1.00 25.42 H new ATOM 655 N ASN A 82 46.441 8.172 -3.041 1.00 21.24 N ATOM 656 CA ASN A 82 45.847 6.845 -3.165 1.00 22.70 C ATOM 657 C ASN A 82 45.506 6.310 -1.779 1.00 21.04 C ATOM 658 O ASN A 82 46.236 6.576 -0.820 1.00 26.17 O ATOM 659 CB ASN A 82 46.827 5.887 -3.842 1.00 31.11 C ATOM 660 CG ASN A 82 47.064 6.232 -5.286 1.00 27.08 C ATOM 661 OD1 ASN A 82 46.158 6.132 -6.113 1.00 29.24 O ATOM 662 ND2 ASN A 82 48.281 6.656 -5.600 1.00 41.05 N ATOM 0 H ASN A 82 47.142 8.201 -2.543 1.00 21.24 H new ATOM 0 HA ASN A 82 45.043 6.912 -3.703 1.00 22.70 H new ATOM 0 HB2 ASN A 82 47.672 5.903 -3.366 1.00 31.11 H new ATOM 0 HB3 ASN A 82 46.484 4.982 -3.781 1.00 31.11 H new ATOM 0 HD21 ASN A 82 48.464 6.875 -6.411 1.00 41.05 H new ATOM 0 HD22 ASN A 82 48.887 6.712 -4.992 1.00 41.05 H new ATOM 663 N GLY A 83 44.407 5.562 -1.680 1.00 26.78 N ATOM 664 CA GLY A 83 44.008 4.987 -0.404 1.00 27.59 C ATOM 665 C GLY A 83 42.586 5.269 0.037 1.00 20.64 C ATOM 666 O GLY A 83 41.815 5.908 -0.678 1.00 28.18 O ATOM 0 H GLY A 83 43.884 5.378 -2.338 1.00 26.78 H new ATOM 0 HA2 GLY A 83 44.128 4.026 -0.451 1.00 27.59 H new ATOM 0 HA3 GLY A 83 44.611 5.315 0.281 1.00 27.59 H new ATOM 667 N PHE A 84 42.249 4.784 1.231 1.00 22.85 N ATOM 668 CA PHE A 84 40.922 4.967 1.820 1.00 18.07 C ATOM 669 C PHE A 84 41.051 5.838 3.071 1.00 20.31 C ATOM 670 O PHE A 84 41.757 5.477 4.012 1.00 26.61 O ATOM 671 CB PHE A 84 40.324 3.613 2.209 1.00 22.99 C ATOM 672 CG PHE A 84 39.943 2.753 1.034 1.00 24.42 C ATOM 673 CD1 PHE A 84 38.643 2.755 0.555 1.00 28.99 C ATOM 674 CD2 PHE A 84 40.890 1.953 0.401 1.00 38.36 C ATOM 675 CE1 PHE A 84 38.282 1.970 -0.540 1.00 37.59 C ATOM 676 CE2 PHE A 84 40.539 1.163 -0.697 1.00 39.79 C ATOM 677 CZ PHE A 84 39.230 1.177 -1.165 1.00 33.89 C ATOM 0 H PHE A 84 42.789 4.335 1.727 1.00 22.85 H new ATOM 0 HA PHE A 84 40.340 5.394 1.172 1.00 18.07 H new ATOM 0 HB2 PHE A 84 40.964 3.132 2.756 1.00 22.99 H new ATOM 0 HB3 PHE A 84 39.538 3.762 2.757 1.00 22.99 H new ATOM 0 HD1 PHE A 84 38.002 3.287 0.969 1.00 28.99 H new ATOM 0 HD2 PHE A 84 41.766 1.944 0.712 1.00 38.36 H new ATOM 0 HE1 PHE A 84 37.405 1.979 -0.850 1.00 37.59 H new ATOM 0 HE2 PHE A 84 41.178 0.630 -1.113 1.00 39.79 H new ATOM 0 HZ PHE A 84 38.991 0.655 -1.897 1.00 33.89 H new ATOM 678 N TYR A 85 40.355 6.968 3.086 1.00 22.13 N ATOM 679 CA TYR A 85 40.417 7.887 4.222 1.00 21.66 C ATOM 680 C TYR A 85 39.032 8.298 4.690 1.00 21.55 C ATOM 681 O TYR A 85 38.302 8.980 3.963 1.00 21.19 O ATOM 682 CB TYR A 85 41.198 9.140 3.830 1.00 21.11 C ATOM 683 CG TYR A 85 42.541 8.817 3.267 1.00 20.58 C ATOM 684 CD1 TYR A 85 43.628 8.541 4.097 1.00 24.24 C ATOM 685 CD2 TYR A 85 42.704 8.697 1.895 1.00 23.24 C ATOM 686 CE1 TYR A 85 44.836 8.150 3.551 1.00 27.08 C ATOM 687 CE2 TYR A 85 43.877 8.314 1.359 1.00 19.93 C ATOM 688 CZ TYR A 85 44.935 8.039 2.167 1.00 19.44 C ATOM 689 OH TYR A 85 46.065 7.634 1.512 1.00 25.02 O ATOM 0 H TYR A 85 39.839 7.224 2.448 1.00 22.13 H new ATOM 0 HA TYR A 85 40.861 7.423 4.949 1.00 21.66 H new ATOM 0 HB2 TYR A 85 40.689 9.645 3.177 1.00 21.11 H new ATOM 0 HB3 TYR A 85 41.304 9.709 4.608 1.00 21.11 H new ATOM 0 HD1 TYR A 85 43.540 8.620 5.019 1.00 24.24 H new ATOM 0 HD2 TYR A 85 41.987 8.885 1.333 1.00 23.24 H new ATOM 0 HE1 TYR A 85 45.566 7.965 4.096 1.00 27.08 H new ATOM 0 HE2 TYR A 85 43.964 8.237 0.436 1.00 19.93 H new ATOM 0 HH TYR A 85 45.852 7.257 0.792 1.00 25.02 H new ATOM 690 N ALA A 86 38.670 7.871 5.896 1.00 20.64 N ATOM 691 CA ALA A 86 37.371 8.210 6.471 1.00 22.39 C ATOM 692 C ALA A 86 37.611 9.525 7.198 1.00 21.61 C ATOM 693 O ALA A 86 38.023 9.536 8.358 1.00 19.75 O ATOM 694 CB ALA A 86 36.920 7.124 7.451 1.00 19.07 C ATOM 0 H ALA A 86 39.165 7.381 6.400 1.00 20.64 H new ATOM 0 HA ALA A 86 36.674 8.282 5.800 1.00 22.39 H new ATOM 0 HB1 ALA A 86 36.057 7.363 7.824 1.00 19.07 H new ATOM 0 HB2 ALA A 86 36.847 6.277 6.984 1.00 19.07 H new ATOM 0 HB3 ALA A 86 37.570 7.043 8.166 1.00 19.07 H new ATOM 695 N LEU A 87 37.354 10.625 6.501 1.00 26.63 N ATOM 696 CA LEU A 87 37.594 11.963 7.033 1.00 27.31 C ATOM 697 C LEU A 87 36.360 12.720 7.521 1.00 26.19 C ATOM 698 O LEU A 87 35.246 12.192 7.547 1.00 20.66 O ATOM 699 CB LEU A 87 38.302 12.805 5.971 1.00 26.46 C ATOM 700 CG LEU A 87 39.604 12.235 5.416 1.00 23.75 C ATOM 701 CD1 LEU A 87 40.157 13.149 4.324 1.00 34.61 C ATOM 702 CD2 LEU A 87 40.594 12.089 6.546 1.00 24.07 C ATOM 0 H LEU A 87 37.034 10.618 5.703 1.00 26.63 H new ATOM 0 HA LEU A 87 38.138 11.824 7.824 1.00 27.31 H new ATOM 0 HB2 LEU A 87 37.689 12.941 5.231 1.00 26.46 H new ATOM 0 HB3 LEU A 87 38.488 13.679 6.349 1.00 26.46 H new ATOM 0 HG LEU A 87 39.440 11.365 5.021 1.00 23.75 H new ATOM 0 HD11 LEU A 87 40.984 12.777 3.979 1.00 34.61 H new ATOM 0 HD12 LEU A 87 39.510 13.222 3.605 1.00 34.61 H new ATOM 0 HD13 LEU A 87 40.328 14.029 4.694 1.00 34.61 H new ATOM 0 HD21 LEU A 87 41.426 11.727 6.203 1.00 24.07 H new ATOM 0 HD22 LEU A 87 40.760 12.957 6.945 1.00 24.07 H new ATOM 0 HD23 LEU A 87 40.233 11.489 7.217 1.00 24.07 H new ATOM 703 N GLN A 88 36.572 13.985 7.866 1.00 19.00 N ATOM 704 CA GLN A 88 35.520 14.841 8.406 1.00 21.71 C ATOM 705 C GLN A 88 35.385 16.148 7.641 1.00 24.59 C ATOM 706 O GLN A 88 36.388 16.772 7.282 1.00 22.67 O ATOM 707 CB GLN A 88 35.846 15.149 9.877 1.00 21.86 C ATOM 708 CG GLN A 88 35.020 16.228 10.493 1.00 22.28 C ATOM 709 CD GLN A 88 35.310 16.380 11.981 1.00 27.71 C ATOM 710 OE1 GLN A 88 35.146 15.446 12.743 1.00 19.18 O ATOM 711 NE2 GLN A 88 35.759 17.556 12.388 1.00 24.57 N ATOM 0 H GLN A 88 37.335 14.374 7.793 1.00 19.00 H new ATOM 0 HA GLN A 88 34.677 14.368 8.323 1.00 21.71 H new ATOM 0 HB2 GLN A 88 35.733 14.337 10.396 1.00 21.86 H new ATOM 0 HB3 GLN A 88 36.781 15.399 9.942 1.00 21.86 H new ATOM 0 HG2 GLN A 88 35.196 17.068 10.041 1.00 22.28 H new ATOM 0 HG3 GLN A 88 34.079 16.029 10.365 1.00 22.28 H new ATOM 0 HE21 GLN A 88 35.864 18.195 11.823 1.00 24.57 H new ATOM 0 HE22 GLN A 88 35.946 17.681 13.218 1.00 24.57 H new ATOM 712 N ILE A 89 34.142 16.555 7.396 1.00 19.47 N ATOM 713 CA ILE A 89 33.857 17.814 6.725 1.00 22.24 C ATOM 714 C ILE A 89 33.553 18.826 7.823 1.00 29.78 C ATOM 715 O ILE A 89 32.520 18.729 8.488 1.00 23.69 O ATOM 716 CB ILE A 89 32.621 17.697 5.816 1.00 24.15 C ATOM 717 CG1 ILE A 89 32.871 16.650 4.727 1.00 30.34 C ATOM 718 CG2 ILE A 89 32.331 19.025 5.168 1.00 24.94 C ATOM 719 CD1 ILE A 89 31.679 16.368 3.830 1.00 29.01 C ATOM 0 H ILE A 89 33.442 16.107 7.615 1.00 19.47 H new ATOM 0 HA ILE A 89 34.611 18.073 6.173 1.00 22.24 H new ATOM 0 HB ILE A 89 31.862 17.428 6.356 1.00 24.15 H new ATOM 0 HG12 ILE A 89 33.612 16.946 4.175 1.00 30.34 H new ATOM 0 HG13 ILE A 89 33.145 15.821 5.150 1.00 30.34 H new ATOM 0 HG21 ILE A 89 31.551 18.943 4.597 1.00 24.94 H new ATOM 0 HG22 ILE A 89 32.161 19.690 5.854 1.00 24.94 H new ATOM 0 HG23 ILE A 89 33.094 19.299 4.635 1.00 24.94 H new ATOM 0 HD11 ILE A 89 31.920 15.698 3.172 1.00 29.01 H new ATOM 0 HD12 ILE A 89 30.940 16.042 4.367 1.00 29.01 H new ATOM 0 HD13 ILE A 89 31.414 17.184 3.378 1.00 29.01 H new ATOM 720 N ASN A 90 34.463 19.773 8.042 1.00 20.54 N ATOM 721 CA ASN A 90 34.234 20.806 9.054 1.00 20.68 C ATOM 722 C ASN A 90 33.151 21.753 8.530 1.00 19.74 C ATOM 723 O ASN A 90 32.322 22.252 9.291 1.00 29.49 O ATOM 724 CB ASN A 90 35.518 21.598 9.328 1.00 26.15 C ATOM 725 CG ASN A 90 36.512 20.817 10.148 1.00 32.15 C ATOM 726 OD1 ASN A 90 36.133 19.922 10.896 1.00 24.69 O ATOM 727 ND2 ASN A 90 37.789 21.167 10.036 1.00 28.71 N ATOM 0 H ASN A 90 35.211 19.837 7.622 1.00 20.54 H new ATOM 0 HA ASN A 90 33.956 20.389 9.884 1.00 20.68 H new ATOM 0 HB2 ASN A 90 35.926 21.850 8.485 1.00 26.15 H new ATOM 0 HB3 ASN A 90 35.295 22.420 9.792 1.00 26.15 H new ATOM 0 HD21 ASN A 90 38.389 20.760 10.499 1.00 28.71 H new ATOM 0 HD22 ASN A 90 38.016 21.800 9.500 1.00 28.71 H new ATOM 728 N SER A 91 33.166 21.996 7.224 1.00 23.63 N ATOM 729 CA SER A 91 32.180 22.867 6.594 1.00 20.77 C ATOM 730 C SER A 91 32.338 22.801 5.082 1.00 24.16 C ATOM 731 O SER A 91 33.369 22.366 4.578 1.00 24.72 O ATOM 732 CB SER A 91 32.374 24.329 7.040 1.00 31.64 C ATOM 733 OG SER A 91 33.564 24.877 6.479 1.00 25.48 O ATOM 0 H SER A 91 33.744 21.663 6.681 1.00 23.63 H new ATOM 0 HA SER A 91 31.297 22.566 6.860 1.00 20.77 H new ATOM 0 HB2 SER A 91 31.609 24.859 6.767 1.00 31.64 H new ATOM 0 HB3 SER A 91 32.418 24.373 8.008 1.00 31.64 H new ATOM 0 HG SER A 91 33.369 25.343 5.808 1.00 25.48 H new ATOM 734 N LEU A 92 31.312 23.241 4.365 1.00 20.83 N ATOM 735 CA LEU A 92 31.353 23.290 2.908 1.00 25.75 C ATOM 736 C LEU A 92 30.428 24.391 2.413 1.00 25.36 C ATOM 737 O LEU A 92 29.498 24.792 3.119 1.00 28.73 O ATOM 738 CB LEU A 92 30.947 21.945 2.280 1.00 25.60 C ATOM 739 CG LEU A 92 29.675 21.170 2.655 1.00 30.38 C ATOM 740 CD1 LEU A 92 28.451 22.051 2.704 1.00 42.39 C ATOM 741 CD2 LEU A 92 29.501 20.069 1.619 1.00 21.27 C ATOM 0 H LEU A 92 30.574 23.519 4.707 1.00 20.83 H new ATOM 0 HA LEU A 92 32.266 23.476 2.639 1.00 25.75 H new ATOM 0 HB2 LEU A 92 30.899 22.096 1.323 1.00 25.60 H new ATOM 0 HB3 LEU A 92 31.689 21.339 2.435 1.00 25.60 H new ATOM 0 HG LEU A 92 29.772 20.805 3.548 1.00 30.38 H new ATOM 0 HD11 LEU A 92 27.677 21.517 2.944 1.00 42.39 H new ATOM 0 HD12 LEU A 92 28.580 22.748 3.366 1.00 42.39 H new ATOM 0 HD13 LEU A 92 28.307 22.455 1.834 1.00 42.39 H new ATOM 0 HD21 LEU A 92 28.704 19.555 1.823 1.00 21.27 H new ATOM 0 HD22 LEU A 92 29.413 20.465 0.738 1.00 21.27 H new ATOM 0 HD23 LEU A 92 30.275 19.484 1.635 1.00 21.27 H new ATOM 742 N VAL A 93 30.697 24.880 1.207 1.00 22.71 N ATOM 743 CA VAL A 93 29.897 25.939 0.595 1.00 28.04 C ATOM 744 C VAL A 93 30.150 25.931 -0.910 1.00 28.12 C ATOM 745 O VAL A 93 31.222 25.514 -1.355 1.00 19.79 O ATOM 746 CB VAL A 93 30.291 27.330 1.155 1.00 36.13 C ATOM 747 CG1 VAL A 93 31.707 27.710 0.691 1.00 24.68 C ATOM 748 CG2 VAL A 93 29.285 28.373 0.704 1.00 36.37 C ATOM 0 H VAL A 93 31.350 24.607 0.718 1.00 22.71 H new ATOM 0 HA VAL A 93 28.962 25.777 0.794 1.00 28.04 H new ATOM 0 HB VAL A 93 30.287 27.292 2.124 1.00 36.13 H new ATOM 0 HG11 VAL A 93 31.942 28.581 1.047 1.00 24.68 H new ATOM 0 HG12 VAL A 93 32.341 27.049 1.011 1.00 24.68 H new ATOM 0 HG13 VAL A 93 31.733 27.740 -0.278 1.00 24.68 H new ATOM 0 HG21 VAL A 93 29.537 29.240 1.058 1.00 36.37 H new ATOM 0 HG22 VAL A 93 29.271 28.411 -0.265 1.00 36.37 H new ATOM 0 HG23 VAL A 93 28.403 28.135 1.031 1.00 36.37 H new ATOM 749 N ASP A 94 29.171 26.371 -1.700 1.00 28.53 N ATOM 750 CA ASP A 94 29.361 26.415 -3.145 1.00 31.99 C ATOM 751 C ASP A 94 30.150 27.673 -3.461 1.00 29.53 C ATOM 752 O ASP A 94 29.746 28.766 -3.077 1.00 28.79 O ATOM 753 CB ASP A 94 28.015 26.455 -3.877 1.00 36.51 C ATOM 754 CG ASP A 94 28.173 26.665 -5.382 1.00 37.91 C ATOM 755 OD1 ASP A 94 29.081 26.054 -5.987 1.00 32.42 O ATOM 756 OD2 ASP A 94 27.387 27.439 -5.965 1.00 29.40 O ATOM 0 H ASP A 94 28.403 26.643 -1.424 1.00 28.53 H new ATOM 0 HA ASP A 94 29.832 25.620 -3.439 1.00 31.99 H new ATOM 0 HB2 ASP A 94 27.539 25.625 -3.718 1.00 36.51 H new ATOM 0 HB3 ASP A 94 27.471 27.169 -3.509 1.00 36.51 H new ATOM 757 N VAL A 95 31.284 27.527 -4.139 1.00 29.72 N ATOM 758 CA VAL A 95 32.082 28.698 -4.481 1.00 27.86 C ATOM 759 C VAL A 95 31.800 29.154 -5.899 1.00 27.20 C ATOM 760 O VAL A 95 32.204 30.239 -6.296 1.00 24.58 O ATOM 761 CB VAL A 95 33.607 28.441 -4.322 1.00 29.24 C ATOM 762 CG1 VAL A 95 33.951 28.309 -2.850 1.00 27.10 C ATOM 763 CG2 VAL A 95 34.025 27.190 -5.089 1.00 22.47 C ATOM 0 H VAL A 95 31.604 26.775 -4.406 1.00 29.72 H new ATOM 0 HA VAL A 95 31.824 29.394 -3.857 1.00 27.86 H new ATOM 0 HB VAL A 95 34.094 29.193 -4.692 1.00 29.24 H new ATOM 0 HG11 VAL A 95 34.903 28.149 -2.753 1.00 27.10 H new ATOM 0 HG12 VAL A 95 33.713 29.127 -2.387 1.00 27.10 H new ATOM 0 HG13 VAL A 95 33.458 27.566 -2.468 1.00 27.10 H new ATOM 0 HG21 VAL A 95 34.978 27.046 -4.979 1.00 22.47 H new ATOM 0 HG22 VAL A 95 33.540 26.423 -4.746 1.00 22.47 H new ATOM 0 HG23 VAL A 95 33.823 27.305 -6.031 1.00 22.47 H new ATOM 764 N SER A 96 31.080 28.333 -6.656 1.00 26.93 N ATOM 765 CA SER A 96 30.771 28.676 -8.035 1.00 29.71 C ATOM 766 C SER A 96 29.782 29.830 -8.172 1.00 32.90 C ATOM 767 O SER A 96 30.069 30.826 -8.842 1.00 33.48 O ATOM 768 CB SER A 96 30.227 27.455 -8.778 1.00 29.85 C ATOM 769 OG SER A 96 29.927 27.781 -10.123 1.00 44.43 O ATOM 0 H SER A 96 30.764 27.578 -6.391 1.00 26.93 H new ATOM 0 HA SER A 96 31.607 28.970 -8.429 1.00 29.71 H new ATOM 0 HB2 SER A 96 30.879 26.738 -8.752 1.00 29.85 H new ATOM 0 HB3 SER A 96 29.429 27.129 -8.333 1.00 29.85 H new ATOM 0 HG SER A 96 29.727 27.082 -10.543 1.00 44.43 H new ATOM 770 N GLN A 97 28.618 29.690 -7.547 1.00 34.60 N ATOM 771 CA GLN A 97 27.581 30.714 -7.612 1.00 38.40 C ATOM 772 C GLN A 97 28.082 32.106 -7.191 1.00 37.88 C ATOM 773 O GLN A 97 27.810 33.098 -7.868 1.00 37.55 O ATOM 774 CB GLN A 97 26.371 30.261 -6.778 1.00 43.87 C ATOM 775 CG GLN A 97 25.756 31.302 -5.863 1.00 58.52 C ATOM 776 CD GLN A 97 25.268 32.533 -6.588 1.00 60.63 C ATOM 777 OE1 GLN A 97 24.583 32.440 -7.606 1.00 66.29 O ATOM 778 NE2 GLN A 97 25.609 33.703 -6.058 1.00 66.92 N ATOM 0 H GLN A 97 28.407 29.002 -7.075 1.00 34.60 H new ATOM 0 HA GLN A 97 27.312 30.813 -8.539 1.00 38.40 H new ATOM 0 HB2 GLN A 97 25.684 29.946 -7.386 1.00 43.87 H new ATOM 0 HB3 GLN A 97 26.641 29.502 -6.237 1.00 43.87 H new ATOM 0 HG2 GLN A 97 25.013 30.902 -5.384 1.00 58.52 H new ATOM 0 HG3 GLN A 97 26.412 31.566 -5.199 1.00 58.52 H new ATOM 0 HE21 GLN A 97 26.089 33.728 -5.345 1.00 66.92 H new ATOM 0 HE22 GLN A 97 25.349 34.435 -6.428 1.00 66.92 H new ATOM 779 N PRO A 98 28.808 32.202 -6.067 1.00 33.44 N ATOM 780 CA PRO A 98 29.313 33.515 -5.638 1.00 33.59 C ATOM 781 C PRO A 98 30.282 34.139 -6.659 1.00 33.44 C ATOM 782 O PRO A 98 30.220 35.336 -6.939 1.00 31.38 O ATOM 783 CB PRO A 98 29.999 33.199 -4.311 1.00 35.55 C ATOM 784 CG PRO A 98 29.172 32.073 -3.775 1.00 39.14 C ATOM 785 CD PRO A 98 28.976 31.202 -4.995 1.00 30.66 C ATOM 0 HA PRO A 98 28.610 34.179 -5.556 1.00 33.59 H new ATOM 0 HB2 PRO A 98 30.925 32.938 -4.437 1.00 35.55 H new ATOM 0 HB3 PRO A 98 29.998 33.963 -3.714 1.00 35.55 H new ATOM 0 HG2 PRO A 98 29.627 31.598 -3.062 1.00 39.14 H new ATOM 0 HG3 PRO A 98 28.327 32.385 -3.414 1.00 39.14 H new ATOM 0 HD2 PRO A 98 29.739 30.624 -5.154 1.00 30.66 H new ATOM 0 HD3 PRO A 98 28.199 30.628 -4.910 1.00 30.66 H new ATOM 786 N ALA A 99 31.177 33.329 -7.219 1.00 27.19 N ATOM 787 CA ALA A 99 32.130 33.839 -8.204 1.00 27.05 C ATOM 788 C ALA A 99 31.387 34.265 -9.471 1.00 33.96 C ATOM 789 O ALA A 99 31.600 35.356 -10.002 1.00 27.02 O ATOM 790 CB ALA A 99 33.163 32.776 -8.534 1.00 24.02 C ATOM 0 H ALA A 99 31.250 32.490 -7.046 1.00 27.19 H new ATOM 0 HA ALA A 99 32.587 34.609 -7.832 1.00 27.05 H new ATOM 0 HB1 ALA A 99 33.789 33.125 -9.188 1.00 24.02 H new ATOM 0 HB2 ALA A 99 33.642 32.529 -7.728 1.00 24.02 H new ATOM 0 HB3 ALA A 99 32.718 31.994 -8.898 1.00 24.02 H new ATOM 791 N TYR A 100 30.505 33.398 -9.947 1.00 34.36 N ATOM 792 CA TYR A 100 29.726 33.692 -11.139 1.00 35.09 C ATOM 793 C TYR A 100 28.991 35.016 -10.960 1.00 37.70 C ATOM 794 O TYR A 100 28.990 35.867 -11.849 1.00 38.06 O ATOM 795 CB TYR A 100 28.704 32.583 -11.394 1.00 38.76 C ATOM 796 CG TYR A 100 27.894 32.810 -12.645 1.00 46.10 C ATOM 797 CD1 TYR A 100 28.501 32.780 -13.900 1.00 49.18 C ATOM 798 CD2 TYR A 100 26.527 33.081 -12.578 1.00 48.96 C ATOM 799 CE1 TYR A 100 27.770 33.015 -15.060 1.00 61.52 C ATOM 800 CE2 TYR A 100 25.783 33.318 -13.734 1.00 58.67 C ATOM 801 CZ TYR A 100 26.413 33.284 -14.970 1.00 65.52 C ATOM 802 OH TYR A 100 25.693 33.527 -16.118 1.00 72.69 O ATOM 0 H TYR A 100 30.342 32.631 -9.593 1.00 34.36 H new ATOM 0 HA TYR A 100 30.330 33.750 -11.896 1.00 35.09 H new ATOM 0 HB2 TYR A 100 29.166 31.733 -11.463 1.00 38.76 H new ATOM 0 HB3 TYR A 100 28.105 32.520 -10.633 1.00 38.76 H new ATOM 0 HD1 TYR A 100 29.411 32.600 -13.963 1.00 49.18 H new ATOM 0 HD2 TYR A 100 26.105 33.104 -11.750 1.00 48.96 H new ATOM 0 HE1 TYR A 100 28.189 32.992 -15.890 1.00 61.52 H new ATOM 0 HE2 TYR A 100 24.872 33.497 -13.677 1.00 58.67 H new ATOM 0 HH TYR A 100 24.890 33.673 -15.920 1.00 72.69 H new ATOM 803 N SER A 101 28.361 35.175 -9.803 1.00 36.36 N ATOM 804 CA SER A 101 27.619 36.390 -9.493 1.00 42.06 C ATOM 805 C SER A 101 28.490 37.629 -9.658 1.00 46.34 C ATOM 806 O SER A 101 28.112 38.585 -10.340 1.00 41.21 O ATOM 807 CB SER A 101 27.094 36.328 -8.061 1.00 40.49 C ATOM 808 OG SER A 101 26.589 37.588 -7.655 1.00 57.98 O ATOM 0 H SER A 101 28.351 34.585 -9.178 1.00 36.36 H new ATOM 0 HA SER A 101 26.877 36.452 -10.114 1.00 42.06 H new ATOM 0 HB2 SER A 101 26.395 35.659 -7.997 1.00 40.49 H new ATOM 0 HB3 SER A 101 27.806 36.052 -7.463 1.00 40.49 H new ATOM 0 HG SER A 101 26.304 37.535 -6.867 1.00 57.98 H new ATOM 809 N GLN A 102 29.660 37.605 -9.027 1.00 49.03 N ATOM 810 CA GLN A 102 30.587 38.724 -9.092 1.00 44.52 C ATOM 811 C GLN A 102 30.946 39.039 -10.540 1.00 48.21 C ATOM 812 O GLN A 102 30.955 40.201 -10.944 1.00 42.68 O ATOM 813 CB GLN A 102 31.853 38.397 -8.301 1.00 51.90 C ATOM 814 CG GLN A 102 32.659 39.613 -7.885 1.00 57.01 C ATOM 815 CD GLN A 102 33.841 39.246 -7.010 1.00 66.69 C ATOM 816 OE1 GLN A 102 33.699 38.508 -6.034 1.00 66.35 O ATOM 817 NE2 GLN A 102 35.015 39.766 -7.351 1.00 67.28 N ATOM 0 H GLN A 102 29.936 36.943 -8.552 1.00 49.03 H new ATOM 0 HA GLN A 102 30.159 39.503 -8.703 1.00 44.52 H new ATOM 0 HB2 GLN A 102 31.606 37.898 -7.507 1.00 51.90 H new ATOM 0 HB3 GLN A 102 32.416 37.816 -8.837 1.00 51.90 H new ATOM 0 HG2 GLN A 102 32.976 40.075 -8.677 1.00 57.01 H new ATOM 0 HG3 GLN A 102 32.085 40.231 -7.407 1.00 57.01 H new ATOM 0 HE21 GLN A 102 35.075 40.277 -8.040 1.00 67.28 H new ATOM 0 HE22 GLN A 102 35.715 39.591 -6.883 1.00 67.28 H new ATOM 818 N ILE A 103 31.234 37.999 -11.317 1.00 45.45 N ATOM 819 CA ILE A 103 31.594 38.168 -12.720 1.00 43.01 C ATOM 820 C ILE A 103 30.461 38.808 -13.515 1.00 47.90 C ATOM 821 O ILE A 103 30.705 39.661 -14.367 1.00 44.71 O ATOM 822 CB ILE A 103 31.969 36.811 -13.362 1.00 39.24 C ATOM 823 CG1 ILE A 103 33.240 36.271 -12.701 1.00 39.46 C ATOM 824 CG2 ILE A 103 32.188 36.977 -14.861 1.00 42.54 C ATOM 825 CD1 ILE A 103 33.581 34.849 -13.085 1.00 32.46 C ATOM 0 H ILE A 103 31.226 37.182 -11.048 1.00 45.45 H new ATOM 0 HA ILE A 103 32.363 38.758 -12.747 1.00 43.01 H new ATOM 0 HB ILE A 103 31.243 36.182 -13.226 1.00 39.24 H new ATOM 0 HG12 ILE A 103 33.985 36.846 -12.936 1.00 39.46 H new ATOM 0 HG13 ILE A 103 33.137 36.320 -11.738 1.00 39.46 H new ATOM 0 HG21 ILE A 103 32.422 36.120 -15.251 1.00 42.54 H new ATOM 0 HG22 ILE A 103 31.374 37.307 -15.273 1.00 42.54 H new ATOM 0 HG23 ILE A 103 32.907 37.609 -15.015 1.00 42.54 H new ATOM 0 HD11 ILE A 103 34.393 34.577 -12.630 1.00 32.46 H new ATOM 0 HD12 ILE A 103 32.854 34.261 -12.827 1.00 32.46 H new ATOM 0 HD13 ILE A 103 33.714 34.796 -14.044 1.00 32.46 H new ATOM 826 N GLN A 104 29.226 38.397 -13.235 1.00 51.06 N ATOM 827 CA GLN A 104 28.062 38.948 -13.927 1.00 58.50 C ATOM 828 C GLN A 104 27.997 40.460 -13.769 1.00 60.32 C ATOM 829 O GLN A 104 27.821 41.188 -14.743 1.00 57.07 O ATOM 830 CB GLN A 104 26.772 38.322 -13.394 1.00 58.13 C ATOM 831 CG GLN A 104 26.543 36.898 -13.861 1.00 65.03 C ATOM 832 CD GLN A 104 26.516 36.788 -15.375 1.00 71.76 C ATOM 833 OE1 GLN A 104 25.693 37.417 -16.039 1.00 74.37 O ATOM 834 NE2 GLN A 104 27.422 35.991 -15.927 1.00 73.60 N ATOM 0 H GLN A 104 29.040 37.798 -12.646 1.00 51.06 H new ATOM 0 HA GLN A 104 28.153 38.737 -14.869 1.00 58.50 H new ATOM 0 HB2 GLN A 104 26.793 38.336 -12.424 1.00 58.13 H new ATOM 0 HB3 GLN A 104 26.020 38.869 -13.670 1.00 58.13 H new ATOM 0 HG2 GLN A 104 27.244 36.327 -13.509 1.00 65.03 H new ATOM 0 HG3 GLN A 104 25.704 36.572 -13.500 1.00 65.03 H new ATOM 0 HE21 GLN A 104 27.982 35.567 -15.430 1.00 73.60 H new ATOM 0 HE22 GLN A 104 27.450 35.898 -16.782 1.00 73.60 H new ATOM 835 N LYS A 105 28.137 40.930 -12.535 1.00 67.02 N ATOM 836 CA LYS A 105 28.107 42.361 -12.275 1.00 73.58 C ATOM 837 C LYS A 105 29.244 43.046 -13.029 1.00 78.62 C ATOM 838 O LYS A 105 29.054 44.105 -13.626 1.00 85.31 O ATOM 839 CB LYS A 105 28.229 42.629 -10.775 1.00 73.42 C ATOM 840 CG LYS A 105 27.017 42.176 -9.971 1.00 82.50 C ATOM 841 CD LYS A 105 27.172 42.499 -8.493 1.00 86.39 C ATOM 842 CE LYS A 105 25.886 42.215 -7.727 1.00 89.56 C ATOM 843 NZ LYS A 105 25.458 40.793 -7.843 1.00 90.33 N ATOM 0 H LYS A 105 28.250 40.439 -11.838 1.00 67.02 H new ATOM 0 HA LYS A 105 27.261 42.721 -12.584 1.00 73.58 H new ATOM 0 HB2 LYS A 105 29.018 42.178 -10.437 1.00 73.42 H new ATOM 0 HB3 LYS A 105 28.364 43.579 -10.634 1.00 73.42 H new ATOM 0 HG2 LYS A 105 26.220 42.608 -10.315 1.00 82.50 H new ATOM 0 HG3 LYS A 105 26.893 41.221 -10.083 1.00 82.50 H new ATOM 0 HD2 LYS A 105 27.897 41.973 -8.119 1.00 86.39 H new ATOM 0 HD3 LYS A 105 27.415 43.432 -8.387 1.00 86.39 H new ATOM 0 HE2 LYS A 105 26.014 42.436 -6.791 1.00 89.56 H new ATOM 0 HE3 LYS A 105 25.180 42.791 -8.060 1.00 89.56 H new ATOM 0 HZ1 LYS A 105 24.766 40.646 -7.303 1.00 90.33 H new ATOM 0 HZ2 LYS A 105 25.220 40.622 -8.683 1.00 90.33 H new ATOM 0 HZ3 LYS A 105 26.132 40.260 -7.612 1.00 90.33 H new ATOM 844 N LEU A 106 30.422 42.431 -13.011 1.00 78.60 N ATOM 845 CA LEU A 106 31.581 42.983 -13.702 1.00 80.32 C ATOM 846 C LEU A 106 31.405 42.850 -15.210 1.00 84.37 C ATOM 847 O LEU A 106 32.009 43.592 -15.983 1.00 89.26 O ATOM 848 CB LEU A 106 32.853 42.246 -13.277 1.00 81.73 C ATOM 849 CG LEU A 106 33.207 42.245 -11.789 1.00 85.14 C ATOM 850 CD1 LEU A 106 34.476 41.437 -11.569 1.00 85.04 C ATOM 851 CD2 LEU A 106 33.388 43.674 -11.304 1.00 89.68 C ATOM 0 H LEU A 106 30.571 41.689 -12.602 1.00 78.60 H new ATOM 0 HA LEU A 106 31.659 43.921 -13.467 1.00 80.32 H new ATOM 0 HB2 LEU A 106 32.775 41.323 -13.566 1.00 81.73 H new ATOM 0 HB3 LEU A 106 33.599 42.633 -13.762 1.00 81.73 H new ATOM 0 HG LEU A 106 32.488 41.837 -11.282 1.00 85.14 H new ATOM 0 HD11 LEU A 106 34.700 41.437 -10.625 1.00 85.04 H new ATOM 0 HD12 LEU A 106 34.335 40.525 -11.868 1.00 85.04 H new ATOM 0 HD13 LEU A 106 35.204 41.833 -12.073 1.00 85.04 H new ATOM 0 HD21 LEU A 106 33.612 43.670 -10.360 1.00 89.68 H new ATOM 0 HD22 LEU A 106 34.103 44.097 -11.804 1.00 89.68 H new ATOM 0 HD23 LEU A 106 32.564 44.168 -11.438 1.00 89.68 H new ATOM 852 N ARG A 107 30.575 41.896 -15.618 1.00 87.14 N ATOM 853 CA ARG A 107 30.312 41.648 -17.030 1.00 90.61 C ATOM 854 C ARG A 107 29.641 42.866 -17.654 1.00 91.31 C ATOM 855 O ARG A 107 30.146 43.437 -18.619 1.00 96.26 O ATOM 856 CB ARG A 107 29.413 40.416 -17.187 1.00 92.12 C ATOM 857 CG ARG A 107 29.121 40.008 -18.625 1.00 95.39 C ATOM 858 CD ARG A 107 30.373 39.548 -19.356 1.00 98.71 C ATOM 859 NE ARG A 107 30.057 39.021 -20.681 1.00105.19 N ATOM 860 CZ ARG A 107 30.963 38.615 -21.564 1.00107.21 C ATOM 861 NH1 ARG A 107 32.255 38.673 -21.268 1.00110.28 N ATOM 862 NH2 ARG A 107 30.578 38.149 -22.745 1.00105.98 N ATOM 0 H ARG A 107 30.149 41.374 -15.084 1.00 87.14 H new ATOM 0 HA ARG A 107 31.153 41.483 -17.484 1.00 90.61 H new ATOM 0 HB2 ARG A 107 29.831 39.668 -16.732 1.00 92.12 H new ATOM 0 HB3 ARG A 107 28.571 40.588 -16.737 1.00 92.12 H new ATOM 0 HG2 ARG A 107 28.464 39.294 -18.630 1.00 95.39 H new ATOM 0 HG3 ARG A 107 28.728 40.758 -19.099 1.00 95.39 H new ATOM 0 HD2 ARG A 107 30.991 40.291 -19.441 1.00 98.71 H new ATOM 0 HD3 ARG A 107 30.821 38.865 -18.833 1.00 98.71 H new ATOM 0 HE ARG A 107 29.228 38.970 -20.905 1.00105.19 H new ATOM 0 HH11 ARG A 107 32.508 38.974 -20.503 1.00110.28 H new ATOM 0 HH12 ARG A 107 32.840 38.410 -21.841 1.00110.28 H new ATOM 0 HH21 ARG A 107 29.741 38.110 -22.940 1.00105.98 H new ATOM 0 HH22 ARG A 107 31.165 37.886 -23.316 1.00105.98 H new ATOM 863 N GLY A 108 28.502 43.261 -17.093 1.00 89.87 N ATOM 864 CA GLY A 108 27.787 44.413 -17.607 1.00 87.68 C ATOM 865 C GLY A 108 28.592 45.688 -17.446 1.00 89.55 C ATOM 866 O GLY A 108 28.987 46.314 -18.430 1.00 87.70 O ATOM 0 H GLY A 108 28.132 42.876 -16.419 1.00 89.87 H new ATOM 0 HA2 GLY A 108 27.582 44.275 -18.545 1.00 87.68 H new ATOM 0 HA3 GLY A 108 26.941 44.503 -17.142 1.00 87.68 H new ATOM 867 N LYS A 109 28.837 46.069 -16.196 1.00 90.18 N ATOM 868 CA LYS A 109 29.596 47.276 -15.884 1.00 91.51 C ATOM 869 C LYS A 109 30.901 47.319 -16.670 1.00 93.11 C ATOM 870 O LYS A 109 31.113 48.208 -17.493 1.00 96.18 O ATOM 871 CB LYS A 109 29.898 47.326 -14.385 1.00 90.84 C ATOM 872 CG LYS A 109 28.667 47.169 -13.508 1.00 94.37 C ATOM 873 CD LYS A 109 29.049 46.821 -12.077 1.00 97.12 C ATOM 874 CE LYS A 109 27.831 46.397 -11.271 1.00 97.33 C ATOM 875 NZ LYS A 109 28.211 45.855 -9.938 1.00 96.71 N ATOM 0 H LYS A 109 28.568 45.635 -15.504 1.00 90.18 H new ATOM 0 HA LYS A 109 29.060 48.045 -16.135 1.00 91.51 H new ATOM 0 HB2 LYS A 109 30.532 46.625 -14.167 1.00 90.84 H new ATOM 0 HB3 LYS A 109 30.327 48.171 -14.178 1.00 90.84 H new ATOM 0 HG2 LYS A 109 28.154 47.992 -13.517 1.00 94.37 H new ATOM 0 HG3 LYS A 109 28.095 46.474 -13.871 1.00 94.37 H new ATOM 0 HD2 LYS A 109 29.704 46.105 -12.079 1.00 97.12 H new ATOM 0 HD3 LYS A 109 29.468 47.588 -11.656 1.00 97.12 H new ATOM 0 HE2 LYS A 109 27.240 47.157 -11.154 1.00 97.33 H new ATOM 0 HE3 LYS A 109 27.335 45.725 -11.764 1.00 97.33 H new ATOM 0 HZ1 LYS A 109 27.582 45.292 -9.656 1.00 96.71 H new ATOM 0 HZ2 LYS A 109 28.987 45.424 -10.003 1.00 96.71 H new ATOM 0 HZ3 LYS A 109 28.292 46.524 -9.357 1.00 96.71 H new ATOM 876 N ALA A 120 19.996 43.894 -43.462 1.00 88.85 N ATOM 877 CA ALA A 120 19.707 43.672 -42.056 1.00 81.88 C ATOM 878 C ALA A 120 20.930 43.746 -41.152 1.00 76.37 C ATOM 879 O ALA A 120 21.986 44.220 -41.550 1.00 80.45 O ATOM 880 CB ALA A 120 19.128 42.370 -41.914 1.00 86.29 C ATOM 0 HA ALA A 120 19.107 44.382 -41.780 1.00 81.88 H new ATOM 0 HB1 ALA A 120 18.928 42.205 -40.979 1.00 86.29 H new ATOM 0 HB2 ALA A 120 18.310 42.321 -42.433 1.00 86.29 H new ATOM 0 HB3 ALA A 120 19.753 41.701 -42.234 1.00 86.29 H new ATOM 881 N GLN A 121 20.723 43.281 -39.917 1.00 63.71 N ATOM 882 CA GLN A 121 21.733 43.192 -38.857 1.00 57.25 C ATOM 883 C GLN A 121 21.445 41.996 -37.945 1.00 56.82 C ATOM 884 O GLN A 121 20.347 41.881 -37.401 1.00 34.01 O ATOM 885 CB GLN A 121 21.810 44.478 -37.988 1.00 60.32 C ATOM 886 CG GLN A 121 22.227 44.193 -36.515 1.00 71.88 C ATOM 887 CD GLN A 121 22.518 45.469 -35.648 1.00 83.89 C ATOM 888 OE1 GLN A 121 23.514 46.133 -35.809 1.00 84.42 O ATOM 889 NE2 GLN A 121 21.623 45.763 -34.737 1.00 86.80 N ATOM 0 H GLN A 121 19.953 42.995 -39.663 1.00 63.71 H new ATOM 0 HA GLN A 121 22.587 43.081 -39.303 1.00 57.25 H new ATOM 0 HB2 GLN A 121 22.446 45.093 -38.386 1.00 60.32 H new ATOM 0 HB3 GLN A 121 20.946 44.919 -37.995 1.00 60.32 H new ATOM 0 HG2 GLN A 121 21.523 43.682 -36.087 1.00 71.88 H new ATOM 0 HG3 GLN A 121 23.020 43.634 -36.520 1.00 71.88 H new ATOM 0 HE21 GLN A 121 20.924 45.271 -34.647 1.00 86.80 H new ATOM 0 HE22 GLN A 121 21.735 46.448 -34.230 1.00 86.80 H new ATOM 890 N VAL A 122 22.434 41.118 -37.775 1.00 49.20 N ATOM 891 CA VAL A 122 22.290 39.957 -36.894 1.00 48.53 C ATOM 892 C VAL A 122 23.381 39.964 -35.819 1.00 50.86 C ATOM 893 O VAL A 122 24.544 40.198 -36.122 1.00 53.87 O ATOM 894 CB VAL A 122 22.406 38.634 -37.682 1.00 44.15 C ATOM 895 CG1 VAL A 122 22.510 37.459 -36.731 1.00 49.72 C ATOM 896 CG2 VAL A 122 21.208 38.458 -38.568 1.00 41.77 C ATOM 0 H VAL A 122 23.200 41.177 -38.162 1.00 49.20 H new ATOM 0 HA VAL A 122 21.411 40.016 -36.487 1.00 48.53 H new ATOM 0 HB VAL A 122 23.208 38.670 -38.227 1.00 44.15 H new ATOM 0 HG11 VAL A 122 22.582 36.636 -37.240 1.00 49.72 H new ATOM 0 HG12 VAL A 122 23.296 37.563 -36.172 1.00 49.72 H new ATOM 0 HG13 VAL A 122 21.718 37.424 -36.171 1.00 49.72 H new ATOM 0 HG21 VAL A 122 21.288 37.625 -39.059 1.00 41.77 H new ATOM 0 HG22 VAL A 122 20.404 38.437 -38.025 1.00 41.77 H new ATOM 0 HG23 VAL A 122 21.156 39.198 -39.193 1.00 41.77 H new ATOM 897 N THR A 123 23.012 39.713 -34.566 1.00 51.27 N ATOM 898 CA THR A 123 23.987 39.698 -33.480 1.00 47.57 C ATOM 899 C THR A 123 24.010 38.356 -32.767 1.00 44.70 C ATOM 900 O THR A 123 22.992 37.891 -32.250 1.00 39.61 O ATOM 901 CB THR A 123 23.683 40.807 -32.440 1.00 46.97 C ATOM 902 OG1 THR A 123 22.415 40.546 -31.831 1.00 58.81 O ATOM 903 CG2 THR A 123 23.632 42.173 -33.100 1.00 52.96 C ATOM 0 H THR A 123 22.203 39.549 -34.324 1.00 51.27 H new ATOM 0 HA THR A 123 24.854 39.859 -33.884 1.00 47.57 H new ATOM 0 HB THR A 123 24.390 40.805 -31.776 1.00 46.97 H new ATOM 0 HG1 THR A 123 22.211 39.739 -31.942 1.00 58.81 H new ATOM 0 HG21 THR A 123 23.441 42.849 -32.431 1.00 52.96 H new ATOM 0 HG22 THR A 123 24.487 42.364 -33.516 1.00 52.96 H new ATOM 0 HG23 THR A 123 22.935 42.181 -33.775 1.00 52.96 H new ATOM 904 N PRO A 124 25.176 37.698 -32.763 1.00 50.76 N ATOM 905 CA PRO A 124 25.330 36.405 -32.103 1.00 40.09 C ATOM 906 C PRO A 124 24.944 36.514 -30.630 1.00 38.32 C ATOM 907 O PRO A 124 25.385 37.417 -29.922 1.00 44.69 O ATOM 908 CB PRO A 124 26.816 36.123 -32.259 1.00 49.46 C ATOM 909 CG PRO A 124 27.123 36.726 -33.629 1.00 48.52 C ATOM 910 CD PRO A 124 26.398 38.060 -33.508 1.00 48.32 C ATOM 0 HA PRO A 124 24.769 35.706 -32.475 1.00 40.09 H new ATOM 0 HB2 PRO A 124 27.339 36.539 -31.556 1.00 49.46 H new ATOM 0 HB3 PRO A 124 27.008 35.173 -32.231 1.00 49.46 H new ATOM 0 HG2 PRO A 124 28.075 36.835 -33.780 1.00 48.52 H new ATOM 0 HG3 PRO A 124 26.781 36.184 -34.357 1.00 48.52 H new ATOM 0 HD2 PRO A 124 26.929 38.717 -33.032 1.00 48.32 H new ATOM 0 HD3 PRO A 124 26.192 38.438 -34.377 1.00 48.32 H new ATOM 911 N LYS A 125 24.087 35.611 -30.168 1.00 31.10 N ATOM 912 CA LYS A 125 23.716 35.559 -28.749 1.00 37.76 C ATOM 913 C LYS A 125 24.105 34.171 -28.173 1.00 39.62 C ATOM 914 O LYS A 125 23.289 33.439 -27.671 1.00 35.03 O ATOM 915 CB LYS A 125 22.233 35.857 -28.602 1.00 42.78 C ATOM 916 CG LYS A 125 21.932 37.330 -28.801 1.00 59.60 C ATOM 917 CD LYS A 125 22.338 38.134 -27.569 1.00 64.24 C ATOM 918 CE LYS A 125 22.073 39.612 -27.792 1.00 74.55 C ATOM 919 NZ LYS A 125 22.195 40.421 -26.549 1.00 76.52 N ATOM 0 H LYS A 125 23.705 35.016 -30.658 1.00 31.10 H new ATOM 0 HA LYS A 125 24.196 36.232 -28.242 1.00 37.76 H new ATOM 0 HB2 LYS A 125 21.733 35.334 -29.248 1.00 42.78 H new ATOM 0 HB3 LYS A 125 21.934 35.582 -27.721 1.00 42.78 H new ATOM 0 HG2 LYS A 125 22.408 37.660 -29.579 1.00 59.60 H new ATOM 0 HG3 LYS A 125 20.985 37.451 -28.975 1.00 59.60 H new ATOM 0 HD2 LYS A 125 21.842 37.824 -26.795 1.00 64.24 H new ATOM 0 HD3 LYS A 125 23.279 37.993 -27.379 1.00 64.24 H new ATOM 0 HE2 LYS A 125 22.696 39.950 -28.454 1.00 74.55 H new ATOM 0 HE3 LYS A 125 21.182 39.724 -28.158 1.00 74.55 H new ATOM 0 HZ1 LYS A 125 22.031 41.276 -26.734 1.00 76.52 H new ATOM 0 HZ2 LYS A 125 21.608 40.130 -25.946 1.00 76.52 H new ATOM 0 HZ3 LYS A 125 23.019 40.341 -26.222 1.00 76.52 H new ATOM 920 N PRO A 126 25.388 33.793 -28.263 1.00 45.54 N ATOM 921 CA PRO A 126 26.138 32.592 -27.843 1.00 57.20 C ATOM 922 C PRO A 126 25.853 32.086 -26.436 1.00 62.11 C ATOM 923 O PRO A 126 26.369 32.579 -25.426 1.00 71.96 O ATOM 924 CB PRO A 126 27.612 33.013 -28.038 1.00 58.03 C ATOM 925 CG PRO A 126 27.482 34.515 -28.348 1.00 53.20 C ATOM 926 CD PRO A 126 26.257 34.621 -29.086 1.00 52.32 C ATOM 0 HA PRO A 126 25.873 31.821 -28.369 1.00 57.20 H new ATOM 0 HB2 PRO A 126 28.143 32.852 -27.243 1.00 58.03 H new ATOM 0 HB3 PRO A 126 28.034 32.528 -28.764 1.00 58.03 H new ATOM 0 HG2 PRO A 126 27.452 35.043 -27.535 1.00 53.20 H new ATOM 0 HG3 PRO A 126 28.236 34.836 -28.867 1.00 53.20 H new ATOM 0 HD2 PRO A 126 25.943 35.536 -29.152 1.00 52.32 H new ATOM 0 HD3 PRO A 126 26.340 34.284 -29.992 1.00 52.32 H new ATOM 927 N TRP A 127 24.942 31.135 -26.412 1.00 59.74 N ATOM 928 CA TRP A 127 24.498 30.429 -25.251 1.00 60.06 C ATOM 929 C TRP A 127 25.627 30.294 -24.231 1.00 59.28 C ATOM 930 O TRP A 127 26.757 30.000 -24.590 1.00 50.71 O ATOM 931 CB TRP A 127 23.966 29.097 -25.783 1.00 61.11 C ATOM 932 CG TRP A 127 23.941 28.021 -24.874 1.00 60.50 C ATOM 933 CD1 TRP A 127 23.977 28.083 -23.518 1.00 65.80 C ATOM 934 CD2 TRP A 127 23.795 26.645 -25.222 1.00 66.08 C ATOM 935 NE1 TRP A 127 23.860 26.827 -22.999 1.00 68.96 N ATOM 936 CE2 TRP A 127 23.745 25.928 -24.019 1.00 68.79 C ATOM 937 CE3 TRP A 127 23.699 25.960 -26.442 1.00 52.57 C ATOM 938 CZ2 TRP A 127 23.599 24.529 -23.994 1.00 61.83 C ATOM 939 CZ3 TRP A 127 23.556 24.587 -26.420 1.00 62.00 C ATOM 940 CH2 TRP A 127 23.506 23.880 -25.198 1.00 65.86 C ATOM 0 H TRP A 127 24.543 30.872 -27.127 1.00 59.74 H new ATOM 0 HA TRP A 127 23.800 30.892 -24.762 1.00 60.06 H new ATOM 0 HB2 TRP A 127 23.064 29.239 -26.110 1.00 61.11 H new ATOM 0 HB3 TRP A 127 24.506 28.837 -26.546 1.00 61.11 H new ATOM 0 HD1 TRP A 127 24.068 28.863 -23.019 1.00 65.80 H new ATOM 0 HE1 TRP A 127 23.859 26.632 -22.161 1.00 68.96 H new ATOM 0 HE3 TRP A 127 23.731 26.421 -27.249 1.00 52.57 H new ATOM 0 HZ2 TRP A 127 23.567 24.062 -23.191 1.00 61.83 H new ATOM 0 HZ3 TRP A 127 23.492 24.120 -27.222 1.00 62.00 H new ATOM 0 HH2 TRP A 127 23.408 22.955 -25.211 1.00 65.86 H new ATOM 941 N GLU A 128 25.310 30.576 -22.969 1.00 65.46 N ATOM 942 CA GLU A 128 26.282 30.495 -21.859 1.00 78.14 C ATOM 943 C GLU A 128 25.556 29.917 -20.671 1.00 80.68 C ATOM 944 O GLU A 128 24.923 30.652 -19.919 1.00 85.45 O ATOM 945 CB GLU A 128 26.769 31.871 -21.435 1.00 80.46 C ATOM 946 CG GLU A 128 26.633 32.902 -22.495 1.00 89.25 C ATOM 947 CD GLU A 128 27.970 33.267 -23.034 1.00 91.97 C ATOM 948 OE1 GLU A 128 28.597 34.194 -22.478 1.00 93.44 O ATOM 949 OE2 GLU A 128 28.406 32.616 -24.004 1.00 91.44 O ATOM 0 H GLU A 128 24.523 30.822 -22.724 1.00 65.46 H new ATOM 0 HA GLU A 128 27.038 29.962 -22.151 1.00 78.14 H new ATOM 0 HB2 GLU A 128 26.271 32.155 -20.652 1.00 80.46 H new ATOM 0 HB3 GLU A 128 27.701 31.809 -21.172 1.00 80.46 H new ATOM 0 HG2 GLU A 128 26.069 32.567 -23.210 1.00 89.25 H new ATOM 0 HG3 GLU A 128 26.196 33.690 -22.135 1.00 89.25 H new ATOM 950 N ALA A 129 25.592 28.605 -20.516 1.00 78.72 N ATOM 951 CA ALA A 129 24.896 27.983 -19.399 1.00 77.42 C ATOM 952 C ALA A 129 25.566 28.324 -18.076 1.00 73.34 C ATOM 953 O ALA A 129 26.736 28.695 -18.027 1.00 75.63 O ATOM 954 CB ALA A 129 24.874 26.495 -19.578 1.00 81.18 C ATOM 0 H ALA A 129 26.007 28.061 -21.037 1.00 78.72 H new ATOM 0 HA ALA A 129 23.989 28.326 -19.382 1.00 77.42 H new ATOM 0 HB1 ALA A 129 24.409 26.086 -18.831 1.00 81.18 H new ATOM 0 HB2 ALA A 129 24.415 26.275 -20.404 1.00 81.18 H new ATOM 0 HB3 ALA A 129 25.784 26.160 -19.615 1.00 81.18 H new ATOM 955 N LYS A 130 24.794 28.191 -17.007 1.00 71.50 N ATOM 956 CA LYS A 130 25.232 28.434 -15.650 1.00 64.78 C ATOM 957 C LYS A 130 26.389 27.506 -15.312 1.00 55.39 C ATOM 958 O LYS A 130 26.284 26.292 -15.501 1.00 47.84 O ATOM 959 CB LYS A 130 24.044 28.154 -14.716 1.00 72.51 C ATOM 960 CG LYS A 130 24.395 27.938 -13.270 1.00 78.68 C ATOM 961 CD LYS A 130 24.521 29.249 -12.543 1.00 75.74 C ATOM 962 CE LYS A 130 24.408 29.008 -11.049 1.00 73.89 C ATOM 963 NZ LYS A 130 24.364 30.292 -10.308 1.00 72.98 N ATOM 0 H LYS A 130 23.971 27.948 -17.058 1.00 71.50 H new ATOM 0 HA LYS A 130 25.533 29.350 -15.547 1.00 64.78 H new ATOM 0 HB2 LYS A 130 23.424 28.898 -14.775 1.00 72.51 H new ATOM 0 HB3 LYS A 130 23.576 27.369 -15.040 1.00 72.51 H new ATOM 0 HG2 LYS A 130 23.713 27.394 -12.846 1.00 78.68 H new ATOM 0 HG3 LYS A 130 25.229 27.448 -13.206 1.00 78.68 H new ATOM 0 HD2 LYS A 130 25.372 29.665 -12.750 1.00 75.74 H new ATOM 0 HD3 LYS A 130 23.828 29.861 -12.836 1.00 75.74 H new ATOM 0 HE2 LYS A 130 23.608 28.494 -10.860 1.00 73.89 H new ATOM 0 HE3 LYS A 130 25.163 28.480 -10.745 1.00 73.89 H new ATOM 0 HZ1 LYS A 130 24.298 30.129 -9.435 1.00 72.98 H new ATOM 0 HZ2 LYS A 130 25.108 30.753 -10.468 1.00 72.98 H new ATOM 0 HZ3 LYS A 130 23.659 30.765 -10.575 1.00 72.98 H new ATOM 964 N PRO A 131 27.523 28.069 -14.858 1.00 54.20 N ATOM 965 CA PRO A 131 28.656 27.210 -14.501 1.00 47.67 C ATOM 966 C PRO A 131 28.136 26.256 -13.426 1.00 37.31 C ATOM 967 O PRO A 131 27.438 26.686 -12.516 1.00 37.19 O ATOM 968 CB PRO A 131 29.666 28.205 -13.952 1.00 51.98 C ATOM 969 CG PRO A 131 29.469 29.390 -14.866 1.00 52.54 C ATOM 970 CD PRO A 131 27.936 29.487 -14.941 1.00 54.85 C ATOM 0 HA PRO A 131 29.045 26.676 -15.212 1.00 47.67 H new ATOM 0 HB2 PRO A 131 29.488 28.428 -13.025 1.00 51.98 H new ATOM 0 HB3 PRO A 131 30.572 27.862 -13.993 1.00 51.98 H new ATOM 0 HG2 PRO A 131 29.866 30.197 -14.504 1.00 52.54 H new ATOM 0 HG3 PRO A 131 29.867 29.245 -15.739 1.00 52.54 H new ATOM 0 HD2 PRO A 131 27.571 30.013 -14.212 1.00 54.85 H new ATOM 0 HD3 PRO A 131 27.640 29.902 -15.766 1.00 54.85 H new ATOM 971 N SER A 132 28.467 24.973 -13.526 1.00 42.77 N ATOM 972 CA SER A 132 27.982 23.992 -12.559 1.00 44.09 C ATOM 973 C SER A 132 28.429 24.228 -11.116 1.00 39.79 C ATOM 974 O SER A 132 29.411 24.929 -10.857 1.00 31.56 O ATOM 975 CB SER A 132 28.376 22.581 -12.996 1.00 46.60 C ATOM 976 OG SER A 132 29.768 22.487 -13.225 1.00 63.01 O ATOM 0 H SER A 132 28.970 24.650 -14.144 1.00 42.77 H new ATOM 0 HA SER A 132 27.018 24.098 -12.554 1.00 44.09 H new ATOM 0 HB2 SER A 132 28.114 21.943 -12.314 1.00 46.60 H new ATOM 0 HB3 SER A 132 27.896 22.344 -13.805 1.00 46.60 H new ATOM 0 HG SER A 132 29.961 21.705 -13.462 1.00 63.01 H new ATOM 977 N ARG A 133 27.692 23.635 -10.181 1.00 38.02 N ATOM 978 CA ARG A 133 27.992 23.772 -8.762 1.00 32.61 C ATOM 979 C ARG A 133 29.435 23.376 -8.469 1.00 29.31 C ATOM 980 O ARG A 133 29.970 22.445 -9.068 1.00 29.00 O ATOM 981 CB ARG A 133 27.044 22.908 -7.924 1.00 35.42 C ATOM 982 CG ARG A 133 27.183 23.145 -6.424 1.00 35.09 C ATOM 983 CD ARG A 133 26.387 22.134 -5.625 1.00 34.65 C ATOM 984 NE ARG A 133 26.860 20.769 -5.861 1.00 26.29 N ATOM 985 CZ ARG A 133 26.228 19.685 -5.424 1.00 26.46 C ATOM 986 NH1 ARG A 133 25.104 19.813 -4.728 1.00 30.25 N ATOM 987 NH2 ARG A 133 26.704 18.480 -5.699 1.00 24.03 N ATOM 0 H ARG A 133 27.007 23.144 -10.352 1.00 38.02 H new ATOM 0 HA ARG A 133 27.868 24.704 -8.523 1.00 32.61 H new ATOM 0 HB2 ARG A 133 26.129 23.090 -8.191 1.00 35.42 H new ATOM 0 HB3 ARG A 133 27.215 21.972 -8.115 1.00 35.42 H new ATOM 0 HG2 ARG A 133 28.118 23.093 -6.173 1.00 35.09 H new ATOM 0 HG3 ARG A 133 26.880 24.041 -6.208 1.00 35.09 H new ATOM 0 HD2 ARG A 133 26.454 22.342 -4.680 1.00 34.65 H new ATOM 0 HD3 ARG A 133 25.449 22.198 -5.863 1.00 34.65 H new ATOM 0 HE ARG A 133 27.587 20.663 -6.307 1.00 26.29 H new ATOM 0 HH11 ARG A 133 24.788 20.595 -4.562 1.00 30.25 H new ATOM 0 HH12 ARG A 133 24.692 19.114 -4.444 1.00 30.25 H new ATOM 0 HH21 ARG A 133 27.424 18.397 -6.162 1.00 24.03 H new ATOM 0 HH22 ARG A 133 26.293 17.780 -5.415 1.00 24.03 H new HETATM 988 N MSE A 134 30.058 24.101 -7.548 1.00 23.90 N HETATM 989 CA MSE A 134 31.438 23.852 -7.150 1.00 32.87 C HETATM 990 C MSE A 134 31.511 23.828 -5.635 1.00 28.71 C HETATM 991 O MSE A 134 31.828 24.847 -5.016 1.00 25.21 O HETATM 992 CB MSE A 134 32.357 24.974 -7.650 1.00 35.34 C HETATM 993 CG MSE A 134 33.144 24.676 -8.908 1.00 63.27 C HETATM 994 SE MSE A 134 35.057 24.621 -8.550 1.00 87.39 SE HETATM 995 CE MSE A 134 35.450 22.994 -9.501 1.00 67.74 C HETATM 0 H MSE A 134 29.689 24.757 -7.133 1.00 23.90 H new HETATM 0 HA MSE A 134 31.724 23.007 -7.531 1.00 32.87 H new HETATM 0 HB2 MSE A 134 31.817 25.764 -7.807 1.00 35.34 H new HETATM 0 HB3 MSE A 134 32.983 25.194 -6.943 1.00 35.34 H new HETATM 0 HG2 MSE A 134 32.857 23.826 -9.277 1.00 63.27 H new HETATM 0 HG3 MSE A 134 32.957 25.353 -9.577 1.00 63.27 H new HETATM 0 HE1 MSE A 134 36.397 22.798 -9.430 1.00 67.74 H new HETATM 0 HE2 MSE A 134 34.940 22.263 -9.117 1.00 67.74 H new HETATM 0 HE3 MSE A 134 35.211 23.099 -10.435 1.00 67.74 H new ATOM 996 N LEU A 135 31.220 22.684 -5.027 1.00 25.17 N ATOM 997 CA LEU A 135 31.283 22.609 -3.578 1.00 26.60 C ATOM 998 C LEU A 135 32.739 22.557 -3.154 1.00 28.03 C ATOM 999 O LEU A 135 33.537 21.825 -3.739 1.00 28.33 O ATOM 1000 CB LEU A 135 30.547 21.369 -3.063 1.00 25.02 C ATOM 1001 CG LEU A 135 29.019 21.420 -3.111 1.00 27.13 C ATOM 1002 CD1 LEU A 135 28.427 20.080 -2.640 1.00 27.66 C ATOM 1003 CD2 LEU A 135 28.536 22.571 -2.223 1.00 21.87 C ATOM 0 H LEU A 135 30.989 21.957 -5.425 1.00 25.17 H new ATOM 0 HA LEU A 135 30.853 23.392 -3.201 1.00 26.60 H new ATOM 0 HB2 LEU A 135 30.843 20.603 -3.579 1.00 25.02 H new ATOM 0 HB3 LEU A 135 30.818 21.214 -2.145 1.00 25.02 H new ATOM 0 HG LEU A 135 28.722 21.572 -4.022 1.00 27.13 H new ATOM 0 HD11 LEU A 135 27.459 20.124 -2.675 1.00 27.66 H new ATOM 0 HD12 LEU A 135 28.739 19.367 -3.219 1.00 27.66 H new ATOM 0 HD13 LEU A 135 28.710 19.903 -1.729 1.00 27.66 H new ATOM 0 HD21 LEU A 135 27.567 22.613 -2.246 1.00 21.87 H new ATOM 0 HD22 LEU A 135 28.831 22.422 -1.311 1.00 21.87 H new ATOM 0 HD23 LEU A 135 28.903 23.408 -2.549 1.00 21.87 H new HETATM 1004 N MSE A 136 33.089 23.361 -2.154 1.00 25.79 N HETATM 1005 CA MSE A 136 34.453 23.379 -1.639 1.00 27.88 C HETATM 1006 C MSE A 136 34.346 22.903 -0.207 1.00 22.46 C HETATM 1007 O MSE A 136 33.705 23.550 0.620 1.00 21.86 O HETATM 1008 CB MSE A 136 35.048 24.794 -1.679 1.00 25.19 C HETATM 1009 CG MSE A 136 36.528 24.854 -1.290 1.00 32.80 C HETATM 1010 SE MSE A 136 37.698 23.796 -2.452 1.00 42.09 SE HETATM 1011 CE MSE A 136 37.490 24.832 -4.076 1.00 44.01 C HETATM 0 H MSE A 136 32.551 23.904 -1.760 1.00 25.79 H new HETATM 0 HA MSE A 136 35.036 22.818 -2.174 1.00 27.88 H new HETATM 0 HB2 MSE A 136 34.942 25.155 -2.573 1.00 25.19 H new HETATM 0 HB3 MSE A 136 34.542 25.366 -1.081 1.00 25.19 H new HETATM 0 HG2 MSE A 136 36.821 25.779 -1.307 1.00 32.80 H new HETATM 0 HG3 MSE A 136 36.626 24.542 -0.377 1.00 32.80 H new HETATM 0 HE1 MSE A 136 38.021 24.435 -4.784 1.00 44.01 H new HETATM 0 HE2 MSE A 136 36.556 24.839 -4.338 1.00 44.01 H new HETATM 0 HE3 MSE A 136 37.788 25.742 -3.920 1.00 44.01 H new ATOM 1012 N LEU A 137 34.969 21.767 0.081 1.00 22.90 N ATOM 1013 CA LEU A 137 34.919 21.196 1.416 1.00 20.02 C ATOM 1014 C LEU A 137 36.175 21.481 2.229 1.00 25.11 C ATOM 1015 O LEU A 137 37.291 21.392 1.721 1.00 24.32 O ATOM 1016 CB LEU A 137 34.717 19.671 1.334 1.00 16.96 C ATOM 1017 CG LEU A 137 33.363 19.083 0.896 1.00 18.83 C ATOM 1018 CD1 LEU A 137 32.874 19.736 -0.386 1.00 23.32 C ATOM 1019 CD2 LEU A 137 33.512 17.554 0.725 1.00 17.48 C ATOM 0 H LEU A 137 35.427 21.311 -0.486 1.00 22.90 H new ATOM 0 HA LEU A 137 34.171 21.617 1.867 1.00 20.02 H new ATOM 0 HB2 LEU A 137 35.389 19.326 0.726 1.00 16.96 H new ATOM 0 HB3 LEU A 137 34.916 19.309 2.211 1.00 16.96 H new ATOM 0 HG LEU A 137 32.697 19.264 1.578 1.00 18.83 H new ATOM 0 HD11 LEU A 137 32.022 19.350 -0.641 1.00 23.32 H new ATOM 0 HD12 LEU A 137 32.767 20.689 -0.243 1.00 23.32 H new ATOM 0 HD13 LEU A 137 33.521 19.586 -1.093 1.00 23.32 H new ATOM 0 HD21 LEU A 137 32.663 17.175 0.449 1.00 17.48 H new ATOM 0 HD22 LEU A 137 34.184 17.368 0.050 1.00 17.48 H new ATOM 0 HD23 LEU A 137 33.783 17.159 1.568 1.00 17.48 H new ATOM 1020 N GLN A 138 35.980 21.833 3.494 1.00 20.89 N ATOM 1021 CA GLN A 138 37.097 22.065 4.392 1.00 23.58 C ATOM 1022 C GLN A 138 37.188 20.728 5.125 1.00 24.98 C ATOM 1023 O GLN A 138 36.371 20.423 5.989 1.00 25.03 O ATOM 1024 CB GLN A 138 36.776 23.209 5.355 1.00 27.76 C ATOM 1025 CG GLN A 138 36.520 24.541 4.643 1.00 26.19 C ATOM 1026 CD GLN A 138 37.720 24.993 3.823 1.00 25.07 C ATOM 1027 OE1 GLN A 138 38.850 24.962 4.298 1.00 25.13 O ATOM 1028 NE2 GLN A 138 37.476 25.415 2.591 1.00 23.07 N ATOM 0 H GLN A 138 35.205 21.943 3.851 1.00 20.89 H new ATOM 0 HA GLN A 138 37.922 22.323 3.952 1.00 23.58 H new ATOM 0 HB2 GLN A 138 35.995 22.973 5.879 1.00 27.76 H new ATOM 0 HB3 GLN A 138 37.513 23.317 5.977 1.00 27.76 H new ATOM 0 HG2 GLN A 138 35.748 24.453 4.062 1.00 26.19 H new ATOM 0 HG3 GLN A 138 36.304 25.221 5.300 1.00 26.19 H new ATOM 0 HE21 GLN A 138 36.670 25.423 2.291 1.00 23.07 H new ATOM 0 HE22 GLN A 138 38.124 25.681 2.091 1.00 23.07 H new ATOM 1029 N LEU A 139 38.173 19.924 4.743 1.00 22.10 N ATOM 1030 CA LEU A 139 38.361 18.590 5.300 1.00 18.06 C ATOM 1031 C LEU A 139 39.473 18.505 6.328 1.00 23.34 C ATOM 1032 O LEU A 139 40.382 19.340 6.361 1.00 28.05 O ATOM 1033 CB LEU A 139 38.686 17.614 4.163 1.00 19.32 C ATOM 1034 CG LEU A 139 37.677 17.492 3.021 1.00 27.96 C ATOM 1035 CD1 LEU A 139 38.288 16.681 1.885 1.00 34.58 C ATOM 1036 CD2 LEU A 139 36.402 16.832 3.532 1.00 23.38 C ATOM 0 H LEU A 139 38.756 20.139 4.148 1.00 22.10 H new ATOM 0 HA LEU A 139 37.533 18.364 5.752 1.00 18.06 H new ATOM 0 HB2 LEU A 139 39.539 17.874 3.781 1.00 19.32 H new ATOM 0 HB3 LEU A 139 38.806 16.733 4.551 1.00 19.32 H new ATOM 0 HG LEU A 139 37.453 18.374 2.686 1.00 27.96 H new ATOM 0 HD11 LEU A 139 37.647 16.604 1.161 1.00 34.58 H new ATOM 0 HD12 LEU A 139 39.087 17.126 1.563 1.00 34.58 H new ATOM 0 HD13 LEU A 139 38.519 15.796 2.207 1.00 34.58 H new ATOM 0 HD21 LEU A 139 35.763 16.756 2.806 1.00 23.38 H new ATOM 0 HD22 LEU A 139 36.609 15.948 3.874 1.00 23.38 H new ATOM 0 HD23 LEU A 139 36.020 17.371 4.242 1.00 23.38 H new ATOM 1037 N THR A 140 39.408 17.469 7.154 1.00 21.48 N ATOM 1038 CA THR A 140 40.424 17.241 8.168 1.00 19.07 C ATOM 1039 C THR A 140 40.372 15.803 8.628 1.00 23.84 C ATOM 1040 O THR A 140 39.322 15.161 8.564 1.00 21.89 O ATOM 1041 CB THR A 140 40.216 18.130 9.421 1.00 21.50 C ATOM 1042 OG1 THR A 140 41.309 17.933 10.326 1.00 25.37 O ATOM 1043 CG2 THR A 140 38.923 17.757 10.146 1.00 20.77 C ATOM 0 H THR A 140 38.779 16.883 7.142 1.00 21.48 H new ATOM 0 HA THR A 140 41.277 17.459 7.760 1.00 19.07 H new ATOM 0 HB THR A 140 40.166 19.055 9.133 1.00 21.50 H new ATOM 0 HG1 THR A 140 42.032 17.935 9.898 1.00 25.37 H new ATOM 0 HG21 THR A 140 38.813 18.324 10.925 1.00 20.77 H new ATOM 0 HG22 THR A 140 38.169 17.880 9.548 1.00 20.77 H new ATOM 0 HG23 THR A 140 38.965 16.829 10.426 1.00 20.77 H new ATOM 1044 N ASP A 141 41.519 15.294 9.058 1.00 22.00 N ATOM 1045 CA ASP A 141 41.590 13.953 9.612 1.00 23.38 C ATOM 1046 C ASP A 141 41.786 14.190 11.108 1.00 23.38 C ATOM 1047 O ASP A 141 42.028 13.264 11.882 1.00 30.90 O ATOM 1048 CB ASP A 141 42.767 13.170 9.027 1.00 21.06 C ATOM 1049 CG ASP A 141 44.108 13.829 9.295 1.00 28.47 C ATOM 1050 OD1 ASP A 141 44.154 14.911 9.923 1.00 26.98 O ATOM 1051 OD2 ASP A 141 45.121 13.252 8.867 1.00 21.54 O ATOM 0 H ASP A 141 42.270 15.712 9.037 1.00 22.00 H new ATOM 0 HA ASP A 141 40.801 13.426 9.411 1.00 23.38 H new ATOM 0 HB2 ASP A 141 42.771 12.275 9.401 1.00 21.06 H new ATOM 0 HB3 ASP A 141 42.643 13.077 8.069 1.00 21.06 H new ATOM 1052 N GLY A 142 41.672 15.459 11.499 1.00 26.79 N ATOM 1053 CA GLY A 142 41.827 15.831 12.896 1.00 33.23 C ATOM 1054 C GLY A 142 43.198 16.393 13.229 1.00 32.15 C ATOM 1055 O GLY A 142 43.378 17.010 14.278 1.00 30.52 O ATOM 0 H GLY A 142 41.505 16.115 10.969 1.00 26.79 H new ATOM 0 HA2 GLY A 142 41.152 16.489 13.124 1.00 33.23 H new ATOM 0 HA3 GLY A 142 41.662 15.052 13.450 1.00 33.23 H new ATOM 1056 N ILE A 143 44.157 16.173 12.331 1.00 27.98 N ATOM 1057 CA ILE A 143 45.532 16.641 12.499 1.00 33.29 C ATOM 1058 C ILE A 143 45.849 17.712 11.463 1.00 34.54 C ATOM 1059 O ILE A 143 46.329 18.784 11.807 1.00 29.75 O ATOM 1060 CB ILE A 143 46.551 15.487 12.325 1.00 33.69 C ATOM 1061 CG1 ILE A 143 46.344 14.430 13.415 1.00 37.42 C ATOM 1062 CG2 ILE A 143 47.976 16.035 12.366 1.00 39.41 C ATOM 1063 CD1 ILE A 143 46.571 14.942 14.837 1.00 36.97 C ATOM 0 H ILE A 143 44.026 15.742 11.598 1.00 27.98 H new ATOM 0 HA ILE A 143 45.606 16.999 13.397 1.00 33.29 H new ATOM 0 HB ILE A 143 46.409 15.067 11.462 1.00 33.69 H new ATOM 0 HG12 ILE A 143 45.441 14.083 13.347 1.00 37.42 H new ATOM 0 HG13 ILE A 143 46.946 13.688 13.250 1.00 37.42 H new ATOM 0 HG21 ILE A 143 48.607 15.306 12.256 1.00 39.41 H new ATOM 0 HG22 ILE A 143 48.097 16.677 11.649 1.00 39.41 H new ATOM 0 HG23 ILE A 143 48.131 16.470 13.219 1.00 39.41 H new ATOM 0 HD11 ILE A 143 46.422 14.221 15.468 1.00 36.97 H new ATOM 0 HD12 ILE A 143 47.482 15.264 14.924 1.00 36.97 H new ATOM 0 HD13 ILE A 143 45.953 15.666 15.023 1.00 36.97 H new ATOM 1064 N VAL A 144 45.595 17.414 10.192 1.00 27.25 N ATOM 1065 CA VAL A 144 45.845 18.387 9.133 1.00 25.68 C ATOM 1066 C VAL A 144 44.525 18.778 8.497 1.00 31.96 C ATOM 1067 O VAL A 144 43.567 18.006 8.512 1.00 29.62 O ATOM 1068 CB VAL A 144 46.769 17.817 8.019 1.00 33.00 C ATOM 1069 CG1 VAL A 144 48.068 17.308 8.630 1.00 32.23 C ATOM 1070 CG2 VAL A 144 46.057 16.697 7.258 1.00 25.82 C ATOM 0 H VAL A 144 45.280 16.660 9.923 1.00 27.25 H new ATOM 0 HA VAL A 144 46.286 19.151 9.537 1.00 25.68 H new ATOM 0 HB VAL A 144 46.978 18.526 7.391 1.00 33.00 H new ATOM 0 HG11 VAL A 144 48.638 16.954 7.930 1.00 32.23 H new ATOM 0 HG12 VAL A 144 48.522 18.038 9.079 1.00 32.23 H new ATOM 0 HG13 VAL A 144 47.871 16.607 9.271 1.00 32.23 H new ATOM 0 HG21 VAL A 144 46.644 16.351 6.567 1.00 25.82 H new ATOM 0 HG22 VAL A 144 45.826 15.983 7.873 1.00 25.82 H new ATOM 0 HG23 VAL A 144 45.249 17.046 6.850 1.00 25.82 H new ATOM 1071 N GLN A 145 44.474 19.987 7.954 1.00 22.95 N ATOM 1072 CA GLN A 145 43.280 20.465 7.286 1.00 30.59 C ATOM 1073 C GLN A 145 43.640 20.585 5.817 1.00 33.02 C ATOM 1074 O GLN A 145 44.737 21.018 5.480 1.00 29.12 O ATOM 1075 CB GLN A 145 42.865 21.824 7.840 1.00 30.74 C ATOM 1076 CG GLN A 145 42.730 21.843 9.350 1.00 42.27 C ATOM 1077 CD GLN A 145 41.944 23.039 9.841 1.00 55.11 C ATOM 1078 OE1 GLN A 145 42.215 24.176 9.455 1.00 53.57 O ATOM 1079 NE2 GLN A 145 40.962 22.789 10.702 1.00 62.74 N ATOM 0 H GLN A 145 45.126 20.547 7.963 1.00 22.95 H new ATOM 0 HA GLN A 145 42.534 19.860 7.422 1.00 30.59 H new ATOM 0 HB2 GLN A 145 43.519 22.488 7.572 1.00 30.74 H new ATOM 0 HB3 GLN A 145 42.019 22.083 7.443 1.00 30.74 H new ATOM 0 HG2 GLN A 145 42.293 21.028 9.644 1.00 42.27 H new ATOM 0 HG3 GLN A 145 43.613 21.852 9.752 1.00 42.27 H new ATOM 0 HE21 GLN A 145 40.802 21.981 10.949 1.00 62.74 H new ATOM 0 HE22 GLN A 145 40.487 23.435 11.012 1.00 62.74 H new ATOM 1080 N ILE A 146 42.729 20.173 4.944 1.00 21.93 N ATOM 1081 CA ILE A 146 42.977 20.248 3.519 1.00 23.15 C ATOM 1082 C ILE A 146 41.637 20.537 2.858 1.00 29.17 C ATOM 1083 O ILE A 146 40.591 20.388 3.485 1.00 30.44 O ATOM 1084 CB ILE A 146 43.593 18.917 2.990 1.00 25.75 C ATOM 1085 CG1 ILE A 146 44.087 19.109 1.555 1.00 37.76 C ATOM 1086 CG2 ILE A 146 42.565 17.786 3.048 1.00 20.89 C ATOM 1087 CD1 ILE A 146 44.806 17.908 0.992 1.00 45.07 C ATOM 0 H ILE A 146 41.963 19.848 5.160 1.00 21.93 H new ATOM 0 HA ILE A 146 43.618 20.947 3.314 1.00 23.15 H new ATOM 0 HB ILE A 146 44.343 18.675 3.555 1.00 25.75 H new ATOM 0 HG12 ILE A 146 43.329 19.318 0.986 1.00 37.76 H new ATOM 0 HG13 ILE A 146 44.682 19.874 1.527 1.00 37.76 H new ATOM 0 HG21 ILE A 146 42.965 16.967 2.716 1.00 20.89 H new ATOM 0 HG22 ILE A 146 42.278 17.656 3.965 1.00 20.89 H new ATOM 0 HG23 ILE A 146 41.799 18.017 2.500 1.00 20.89 H new ATOM 0 HD11 ILE A 146 45.091 18.097 0.084 1.00 45.07 H new ATOM 0 HD12 ILE A 146 45.582 17.709 1.539 1.00 45.07 H new ATOM 0 HD13 ILE A 146 44.208 17.144 0.990 1.00 45.07 H new ATOM 1088 N GLN A 147 41.660 20.977 1.609 1.00 23.29 N ATOM 1089 CA GLN A 147 40.413 21.281 0.921 1.00 26.64 C ATOM 1090 C GLN A 147 40.020 20.204 -0.075 1.00 21.42 C ATOM 1091 O GLN A 147 40.866 19.489 -0.596 1.00 20.57 O ATOM 1092 CB GLN A 147 40.507 22.641 0.221 1.00 27.77 C ATOM 1093 CG GLN A 147 40.599 23.814 1.197 1.00 32.77 C ATOM 1094 CD GLN A 147 40.542 25.152 0.497 1.00 28.94 C ATOM 1095 OE1 GLN A 147 41.472 25.536 -0.215 1.00 41.59 O ATOM 1096 NE2 GLN A 147 39.441 25.866 0.682 1.00 24.81 N ATOM 0 H GLN A 147 42.374 21.105 1.147 1.00 23.29 H new ATOM 0 HA GLN A 147 39.718 21.313 1.597 1.00 26.64 H new ATOM 0 HB2 GLN A 147 41.285 22.647 -0.358 1.00 27.77 H new ATOM 0 HB3 GLN A 147 39.730 22.760 -0.347 1.00 27.77 H new ATOM 0 HG2 GLN A 147 39.873 23.756 1.838 1.00 32.77 H new ATOM 0 HG3 GLN A 147 41.426 23.750 1.699 1.00 32.77 H new ATOM 0 HE21 GLN A 147 38.813 25.565 1.186 1.00 24.81 H new ATOM 0 HE22 GLN A 147 39.355 26.630 0.298 1.00 24.81 H new ATOM 1097 N GLY A 148 38.717 20.095 -0.313 1.00 21.68 N ATOM 1098 CA GLY A 148 38.200 19.117 -1.249 1.00 24.61 C ATOM 1099 C GLY A 148 37.243 19.809 -2.194 1.00 20.88 C ATOM 1100 O GLY A 148 36.175 20.260 -1.794 1.00 28.82 O ATOM 0 H GLY A 148 38.116 20.583 0.062 1.00 21.68 H new ATOM 0 HA2 GLY A 148 38.927 18.709 -1.745 1.00 24.61 H new ATOM 0 HA3 GLY A 148 37.746 18.404 -0.774 1.00 24.61 H new HETATM 1101 N MSE A 149 37.633 19.899 -3.456 1.00 20.66 N HETATM 1102 CA MSE A 149 36.815 20.548 -4.463 1.00 17.78 C HETATM 1103 C MSE A 149 35.981 19.549 -5.255 1.00 22.35 C HETATM 1104 O MSE A 149 36.452 18.458 -5.591 1.00 24.07 O HETATM 1105 CB MSE A 149 37.721 21.319 -5.432 1.00 19.68 C HETATM 1106 CG MSE A 149 37.008 21.967 -6.607 1.00 35.36 C HETATM 1107 SE MSE A 149 38.248 22.216 -8.091 1.00 67.26 SE HETATM 1108 CE MSE A 149 39.286 23.661 -7.348 1.00 60.36 C HETATM 0 H MSE A 149 38.378 19.586 -3.751 1.00 20.66 H new HETATM 0 HA MSE A 149 36.207 21.150 -4.005 1.00 17.78 H new HETATM 0 HB2 MSE A 149 38.189 22.009 -4.936 1.00 19.68 H new HETATM 0 HB3 MSE A 149 38.394 20.711 -5.776 1.00 19.68 H new HETATM 0 HG2 MSE A 149 36.264 21.412 -6.888 1.00 35.36 H new HETATM 0 HG3 MSE A 149 36.639 22.823 -6.338 1.00 35.36 H new HETATM 0 HE1 MSE A 149 39.976 23.921 -7.978 1.00 60.36 H new HETATM 0 HE2 MSE A 149 38.707 24.419 -7.172 1.00 60.36 H new HETATM 0 HE3 MSE A 149 39.698 23.371 -6.519 1.00 60.36 H new ATOM 1109 N GLU A 150 34.738 19.918 -5.542 1.00 20.52 N ATOM 1110 CA GLU A 150 33.874 19.062 -6.347 1.00 26.23 C ATOM 1111 C GLU A 150 34.367 19.295 -7.779 1.00 29.37 C ATOM 1112 O GLU A 150 33.871 20.173 -8.476 1.00 28.34 O ATOM 1113 CB GLU A 150 32.411 19.493 -6.187 1.00 27.33 C ATOM 1114 CG GLU A 150 31.433 18.861 -7.176 1.00 37.45 C ATOM 1115 CD GLU A 150 29.982 19.210 -6.864 1.00 26.55 C ATOM 1116 OE1 GLU A 150 29.725 20.335 -6.390 1.00 28.22 O ATOM 1117 OE2 GLU A 150 29.097 18.366 -7.101 1.00 27.69 O ATOM 0 H GLU A 150 34.377 20.654 -5.283 1.00 20.52 H new ATOM 0 HA GLU A 150 33.911 18.127 -6.092 1.00 26.23 H new ATOM 0 HB2 GLU A 150 32.122 19.277 -5.286 1.00 27.33 H new ATOM 0 HB3 GLU A 150 32.362 20.458 -6.277 1.00 27.33 H new ATOM 0 HG2 GLU A 150 31.648 19.158 -8.074 1.00 37.45 H new ATOM 0 HG3 GLU A 150 31.541 17.897 -7.162 1.00 37.45 H new ATOM 1118 N TYR A 151 35.361 18.507 -8.188 1.00 27.89 N ATOM 1119 CA TYR A 151 35.987 18.609 -9.507 1.00 36.59 C ATOM 1120 C TYR A 151 35.046 18.199 -10.639 1.00 39.15 C ATOM 1121 O TYR A 151 35.142 18.700 -11.762 1.00 31.51 O ATOM 1122 CB TYR A 151 37.251 17.749 -9.519 1.00 31.11 C ATOM 1123 CG TYR A 151 38.049 17.802 -10.796 1.00 38.18 C ATOM 1124 CD1 TYR A 151 38.590 19.000 -11.257 1.00 35.61 C ATOM 1125 CD2 TYR A 151 38.301 16.643 -11.521 1.00 38.60 C ATOM 1126 CE1 TYR A 151 39.371 19.040 -12.417 1.00 34.02 C ATOM 1127 CE2 TYR A 151 39.075 16.669 -12.678 1.00 42.95 C ATOM 1128 CZ TYR A 151 39.608 17.868 -13.117 1.00 43.08 C ATOM 1129 OH TYR A 151 40.381 17.890 -14.255 1.00 58.06 O ATOM 0 H TYR A 151 35.697 17.886 -7.697 1.00 27.89 H new ATOM 0 HA TYR A 151 36.211 19.540 -9.665 1.00 36.59 H new ATOM 0 HB2 TYR A 151 37.822 18.027 -8.786 1.00 31.11 H new ATOM 0 HB3 TYR A 151 37.000 16.828 -9.349 1.00 31.11 H new ATOM 0 HD1 TYR A 151 38.429 19.786 -10.786 1.00 35.61 H new ATOM 0 HD2 TYR A 151 37.946 15.835 -11.228 1.00 38.60 H new ATOM 0 HE1 TYR A 151 39.728 19.845 -12.715 1.00 34.02 H new ATOM 0 HE2 TYR A 151 39.233 15.885 -13.153 1.00 42.95 H new ATOM 0 HH TYR A 151 40.439 17.113 -14.570 1.00 58.06 H new ATOM 1130 N GLN A 152 34.151 17.271 -10.329 1.00 36.25 N ATOM 1131 CA GLN A 152 33.146 16.790 -11.268 1.00 35.31 C ATOM 1132 C GLN A 152 31.886 16.698 -10.428 1.00 32.03 C ATOM 1133 O GLN A 152 31.968 16.606 -9.204 1.00 33.56 O ATOM 1134 CB GLN A 152 33.528 15.416 -11.814 1.00 34.54 C ATOM 1135 CG GLN A 152 34.830 15.429 -12.582 1.00 46.56 C ATOM 1136 CD GLN A 152 34.684 14.856 -13.966 1.00 65.72 C ATOM 1137 OE1 GLN A 152 34.426 13.665 -14.131 1.00 77.94 O ATOM 1138 NE2 GLN A 152 34.842 15.704 -14.978 1.00 70.88 N ATOM 0 H GLN A 152 34.109 16.897 -9.556 1.00 36.25 H new ATOM 0 HA GLN A 152 33.046 17.369 -12.040 1.00 35.31 H new ATOM 0 HB2 GLN A 152 33.599 14.789 -11.078 1.00 34.54 H new ATOM 0 HB3 GLN A 152 32.819 15.095 -12.393 1.00 34.54 H new ATOM 0 HG2 GLN A 152 35.157 16.340 -12.644 1.00 46.56 H new ATOM 0 HG3 GLN A 152 35.496 14.921 -12.093 1.00 46.56 H new ATOM 0 HE21 GLN A 152 35.022 16.530 -14.822 1.00 70.88 H new ATOM 0 HE22 GLN A 152 34.764 15.426 -15.788 1.00 70.88 H new ATOM 1139 N PRO A 153 30.705 16.730 -11.061 1.00 36.84 N ATOM 1140 CA PRO A 153 29.480 16.648 -10.261 1.00 31.71 C ATOM 1141 C PRO A 153 29.467 15.470 -9.289 1.00 29.60 C ATOM 1142 O PRO A 153 29.790 14.348 -9.665 1.00 23.35 O ATOM 1143 CB PRO A 153 28.386 16.543 -11.321 1.00 41.88 C ATOM 1144 CG PRO A 153 28.950 17.373 -12.449 1.00 37.78 C ATOM 1145 CD PRO A 153 30.389 16.895 -12.493 1.00 32.59 C ATOM 0 HA PRO A 153 29.372 17.412 -9.673 1.00 31.71 H new ATOM 0 HB2 PRO A 153 28.230 15.624 -11.591 1.00 41.88 H new ATOM 0 HB3 PRO A 153 27.539 16.893 -11.003 1.00 41.88 H new ATOM 0 HG2 PRO A 153 28.487 17.212 -13.286 1.00 37.78 H new ATOM 0 HG3 PRO A 153 28.887 18.324 -12.268 1.00 37.78 H new ATOM 0 HD2 PRO A 153 30.480 16.063 -12.983 1.00 32.59 H new ATOM 0 HD3 PRO A 153 30.973 17.541 -12.921 1.00 32.59 H new ATOM 1146 N ILE A 154 29.126 15.747 -8.035 1.00 25.77 N ATOM 1147 CA ILE A 154 29.033 14.717 -6.999 1.00 24.04 C ATOM 1148 C ILE A 154 27.695 14.973 -6.299 1.00 21.24 C ATOM 1149 O ILE A 154 27.626 15.641 -5.266 1.00 28.27 O ATOM 1150 CB ILE A 154 30.197 14.815 -5.968 1.00 24.37 C ATOM 1151 CG1 ILE A 154 31.550 14.754 -6.691 1.00 21.77 C ATOM 1152 CG2 ILE A 154 30.100 13.662 -4.961 1.00 23.60 C ATOM 1153 CD1 ILE A 154 32.754 14.914 -5.765 1.00 18.28 C ATOM 0 H ILE A 154 28.941 16.540 -7.758 1.00 25.77 H new ATOM 0 HA ILE A 154 29.093 13.831 -7.389 1.00 24.04 H new ATOM 0 HB ILE A 154 30.127 15.660 -5.497 1.00 24.37 H new ATOM 0 HG12 ILE A 154 31.621 13.905 -7.155 1.00 21.77 H new ATOM 0 HG13 ILE A 154 31.578 15.450 -7.366 1.00 21.77 H new ATOM 0 HG21 ILE A 154 30.827 13.728 -4.322 1.00 23.60 H new ATOM 0 HG22 ILE A 154 29.252 13.712 -4.492 1.00 23.60 H new ATOM 0 HG23 ILE A 154 30.159 12.816 -5.431 1.00 23.60 H new ATOM 0 HD11 ILE A 154 33.571 14.866 -6.285 1.00 18.28 H new ATOM 0 HD12 ILE A 154 32.706 15.773 -5.317 1.00 18.28 H new ATOM 0 HD13 ILE A 154 32.750 14.205 -5.103 1.00 18.28 H new ATOM 1154 N PRO A 155 26.602 14.468 -6.888 1.00 27.41 N ATOM 1155 CA PRO A 155 25.257 14.643 -6.334 1.00 26.11 C ATOM 1156 C PRO A 155 25.063 14.274 -4.865 1.00 27.41 C ATOM 1157 O PRO A 155 24.309 14.943 -4.150 1.00 30.53 O ATOM 1158 CB PRO A 155 24.371 13.824 -7.288 1.00 30.77 C ATOM 1159 CG PRO A 155 25.329 12.857 -7.946 1.00 41.66 C ATOM 1160 CD PRO A 155 26.563 13.692 -8.140 1.00 32.45 C ATOM 0 HA PRO A 155 25.030 15.585 -6.296 1.00 26.11 H new ATOM 0 HB2 PRO A 155 23.670 13.357 -6.807 1.00 30.77 H new ATOM 0 HB3 PRO A 155 23.936 14.392 -7.943 1.00 30.77 H new ATOM 0 HG2 PRO A 155 25.502 12.084 -7.386 1.00 41.66 H new ATOM 0 HG3 PRO A 155 24.983 12.525 -8.789 1.00 41.66 H new ATOM 0 HD2 PRO A 155 27.357 13.147 -8.255 1.00 32.45 H new ATOM 0 HD3 PRO A 155 26.496 14.264 -8.921 1.00 32.45 H new ATOM 1161 N ILE A 156 25.748 13.241 -4.392 1.00 27.05 N ATOM 1162 CA ILE A 156 25.575 12.861 -2.997 1.00 31.87 C ATOM 1163 C ILE A 156 26.008 13.971 -2.042 1.00 31.03 C ATOM 1164 O ILE A 156 25.594 13.991 -0.887 1.00 24.30 O ATOM 1165 CB ILE A 156 26.315 11.546 -2.659 1.00 39.54 C ATOM 1166 CG1 ILE A 156 27.818 11.700 -2.877 1.00 32.45 C ATOM 1167 CG2 ILE A 156 25.762 10.417 -3.523 1.00 43.80 C ATOM 1168 CD1 ILE A 156 28.615 10.489 -2.431 1.00 45.92 C ATOM 0 H ILE A 156 26.300 12.761 -4.844 1.00 27.05 H new ATOM 0 HA ILE A 156 24.624 12.713 -2.874 1.00 31.87 H new ATOM 0 HB ILE A 156 26.170 11.333 -1.724 1.00 39.54 H new ATOM 0 HG12 ILE A 156 27.987 11.862 -3.818 1.00 32.45 H new ATOM 0 HG13 ILE A 156 28.130 12.481 -2.394 1.00 32.45 H new ATOM 0 HG21 ILE A 156 26.225 9.591 -3.312 1.00 43.80 H new ATOM 0 HG22 ILE A 156 24.814 10.309 -3.347 1.00 43.80 H new ATOM 0 HG23 ILE A 156 25.895 10.631 -4.460 1.00 43.80 H new ATOM 0 HD11 ILE A 156 29.559 10.645 -2.593 1.00 45.92 H new ATOM 0 HD12 ILE A 156 28.471 10.338 -1.484 1.00 45.92 H new ATOM 0 HD13 ILE A 156 28.326 9.709 -2.930 1.00 45.92 H new ATOM 1169 N LEU A 157 26.828 14.906 -2.514 1.00 24.22 N ATOM 1170 CA LEU A 157 27.243 16.016 -1.652 1.00 23.69 C ATOM 1171 C LEU A 157 26.309 17.212 -1.877 1.00 29.24 C ATOM 1172 O LEU A 157 25.790 17.408 -2.980 1.00 29.96 O ATOM 1173 CB LEU A 157 28.696 16.426 -1.950 1.00 26.84 C ATOM 1174 CG LEU A 157 29.818 15.417 -1.677 1.00 29.67 C ATOM 1175 CD1 LEU A 157 31.147 15.970 -2.174 1.00 25.48 C ATOM 1176 CD2 LEU A 157 29.902 15.124 -0.198 1.00 29.18 C ATOM 0 H LEU A 157 27.151 14.920 -3.311 1.00 24.22 H new ATOM 0 HA LEU A 157 27.191 15.729 -0.727 1.00 23.69 H new ATOM 0 HB2 LEU A 157 28.745 16.674 -2.886 1.00 26.84 H new ATOM 0 HB3 LEU A 157 28.888 17.225 -1.435 1.00 26.84 H new ATOM 0 HG LEU A 157 29.622 14.593 -2.150 1.00 29.67 H new ATOM 0 HD11 LEU A 157 31.851 15.327 -1.998 1.00 25.48 H new ATOM 0 HD12 LEU A 157 31.092 16.136 -3.128 1.00 25.48 H new ATOM 0 HD13 LEU A 157 31.345 16.800 -1.713 1.00 25.48 H new ATOM 0 HD21 LEU A 157 30.614 14.485 -0.034 1.00 29.18 H new ATOM 0 HD22 LEU A 157 30.087 15.945 0.285 1.00 29.18 H new ATOM 0 HD23 LEU A 157 29.059 14.753 0.107 1.00 29.18 H new ATOM 1177 N HIS A 158 26.078 18.000 -0.832 1.00 27.87 N ATOM 1178 CA HIS A 158 25.227 19.182 -0.946 1.00 32.14 C ATOM 1179 C HIS A 158 25.555 20.191 0.147 1.00 31.99 C ATOM 1180 O HIS A 158 26.099 19.833 1.195 1.00 30.44 O ATOM 1181 CB HIS A 158 23.736 18.796 -0.924 1.00 35.26 C ATOM 1182 CG HIS A 158 23.284 18.143 0.344 1.00 32.44 C ATOM 1183 ND1 HIS A 158 22.970 18.859 1.481 1.00 32.12 N ATOM 1184 CD2 HIS A 158 23.066 16.843 0.648 1.00 38.50 C ATOM 1185 CE1 HIS A 158 22.578 18.027 2.427 1.00 36.60 C ATOM 1186 NE2 HIS A 158 22.626 16.796 1.948 1.00 38.86 N ATOM 0 H HIS A 158 26.404 17.869 -0.047 1.00 27.87 H new ATOM 0 HA HIS A 158 25.407 19.602 -1.802 1.00 32.14 H new ATOM 0 HB2 HIS A 158 23.205 19.594 -1.071 1.00 35.26 H new ATOM 0 HB3 HIS A 158 23.558 18.196 -1.665 1.00 35.26 H new ATOM 0 HD2 HIS A 158 23.191 16.116 0.082 1.00 38.50 H new ATOM 0 HE1 HIS A 158 22.313 18.266 3.286 1.00 36.60 H new ATOM 0 HE2 HIS A 158 22.416 16.082 2.380 1.00 38.86 H new ATOM 1187 N SER A 159 25.221 21.453 -0.105 1.00 26.63 N ATOM 1188 CA SER A 159 25.529 22.533 0.823 1.00 27.59 C ATOM 1189 C SER A 159 24.906 22.443 2.208 1.00 32.31 C ATOM 1190 O SER A 159 25.307 23.175 3.102 1.00 31.22 O ATOM 1191 CB SER A 159 25.171 23.890 0.197 1.00 29.50 C ATOM 1192 OG SER A 159 23.771 24.096 0.172 1.00 42.00 O ATOM 0 H SER A 159 24.811 21.706 -0.817 1.00 26.63 H new ATOM 0 HA SER A 159 26.483 22.441 0.973 1.00 27.59 H new ATOM 0 HB2 SER A 159 25.595 24.602 0.701 1.00 29.50 H new ATOM 0 HB3 SER A 159 25.522 23.934 -0.706 1.00 29.50 H new ATOM 0 HG SER A 159 23.604 24.844 -0.173 1.00 42.00 H new ATOM 1193 N ASP A 160 23.939 21.555 2.404 1.00 31.45 N ATOM 1194 CA ASP A 160 23.317 21.451 3.717 1.00 33.37 C ATOM 1195 C ASP A 160 23.877 20.364 4.631 1.00 34.10 C ATOM 1196 O ASP A 160 23.415 20.202 5.761 1.00 36.77 O ATOM 1197 CB ASP A 160 21.804 21.294 3.577 1.00 43.79 C ATOM 1198 CG ASP A 160 21.129 22.585 3.152 1.00 48.22 C ATOM 1199 OD1 ASP A 160 21.505 23.649 3.688 1.00 50.22 O ATOM 1200 OD2 ASP A 160 20.224 22.540 2.294 1.00 57.10 O ATOM 0 H ASP A 160 23.634 21.016 1.807 1.00 31.45 H new ATOM 0 HA ASP A 160 23.538 22.285 4.160 1.00 33.37 H new ATOM 0 HB2 ASP A 160 21.612 20.601 2.926 1.00 43.79 H new ATOM 0 HB3 ASP A 160 21.432 21.000 4.423 1.00 43.79 H new ATOM 1201 N LEU A 161 24.871 19.621 4.154 1.00 27.24 N ATOM 1202 CA LEU A 161 25.486 18.591 4.982 1.00 30.18 C ATOM 1203 C LEU A 161 25.981 19.293 6.240 1.00 28.42 C ATOM 1204 O LEU A 161 26.671 20.308 6.172 1.00 27.14 O ATOM 1205 CB LEU A 161 26.649 17.920 4.243 1.00 28.54 C ATOM 1206 CG LEU A 161 26.223 16.951 3.135 1.00 25.93 C ATOM 1207 CD1 LEU A 161 27.450 16.457 2.384 1.00 30.75 C ATOM 1208 CD2 LEU A 161 25.455 15.772 3.742 1.00 27.38 C ATOM 0 H LEU A 161 25.200 19.696 3.363 1.00 27.24 H new ATOM 0 HA LEU A 161 24.851 17.890 5.197 1.00 30.18 H new ATOM 0 HB2 LEU A 161 27.212 18.609 3.856 1.00 28.54 H new ATOM 0 HB3 LEU A 161 27.192 17.439 4.887 1.00 28.54 H new ATOM 0 HG LEU A 161 25.641 17.412 2.511 1.00 25.93 H new ATOM 0 HD11 LEU A 161 27.176 15.844 1.684 1.00 30.75 H new ATOM 0 HD12 LEU A 161 27.914 17.212 1.989 1.00 30.75 H new ATOM 0 HD13 LEU A 161 28.044 15.999 2.999 1.00 30.75 H new ATOM 0 HD21 LEU A 161 25.188 15.162 3.037 1.00 27.38 H new ATOM 0 HD22 LEU A 161 26.024 15.306 4.374 1.00 27.38 H new ATOM 0 HD23 LEU A 161 24.666 16.101 4.200 1.00 27.38 H new ATOM 1209 N PRO A 162 25.628 18.762 7.414 1.00 28.67 N ATOM 1210 CA PRO A 162 26.065 19.402 8.653 1.00 27.76 C ATOM 1211 C PRO A 162 27.553 19.346 8.954 1.00 27.82 C ATOM 1212 O PRO A 162 28.241 18.392 8.596 1.00 28.41 O ATOM 1213 CB PRO A 162 25.244 18.677 9.714 1.00 31.85 C ATOM 1214 CG PRO A 162 25.135 17.286 9.140 1.00 22.94 C ATOM 1215 CD PRO A 162 24.804 17.570 7.694 1.00 26.66 C ATOM 0 HA PRO A 162 25.922 20.360 8.607 1.00 27.76 H new ATOM 0 HB2 PRO A 162 25.686 18.679 10.577 1.00 31.85 H new ATOM 0 HB3 PRO A 162 24.373 19.086 9.840 1.00 31.85 H new ATOM 0 HG2 PRO A 162 25.963 16.789 9.232 1.00 22.94 H new ATOM 0 HG3 PRO A 162 24.442 16.766 9.576 1.00 22.94 H new ATOM 0 HD2 PRO A 162 25.035 16.826 7.116 1.00 26.66 H new ATOM 0 HD3 PRO A 162 23.858 17.745 7.566 1.00 26.66 H new ATOM 1216 N PRO A 163 28.075 20.391 9.610 1.00 26.61 N ATOM 1217 CA PRO A 163 29.498 20.421 9.960 1.00 25.33 C ATOM 1218 C PRO A 163 29.777 19.183 10.820 1.00 27.24 C ATOM 1219 O PRO A 163 28.996 18.851 11.714 1.00 25.33 O ATOM 1220 CB PRO A 163 29.625 21.719 10.749 1.00 27.35 C ATOM 1221 CG PRO A 163 28.621 22.610 10.071 1.00 29.75 C ATOM 1222 CD PRO A 163 27.431 21.687 9.892 1.00 33.81 C ATOM 0 HA PRO A 163 30.122 20.400 9.217 1.00 25.33 H new ATOM 0 HB2 PRO A 163 29.419 21.592 11.688 1.00 27.35 H new ATOM 0 HB3 PRO A 163 30.522 22.084 10.702 1.00 27.35 H new ATOM 0 HG2 PRO A 163 28.400 23.383 10.613 1.00 29.75 H new ATOM 0 HG3 PRO A 163 28.950 22.944 9.222 1.00 29.75 H new ATOM 0 HD2 PRO A 163 26.879 21.651 10.689 1.00 33.81 H new ATOM 0 HD3 PRO A 163 26.859 21.972 9.163 1.00 33.81 H new ATOM 1223 N GLY A 164 30.869 18.488 10.534 1.00 22.18 N ATOM 1224 CA GLY A 164 31.190 17.292 11.289 1.00 21.29 C ATOM 1225 C GLY A 164 30.868 16.022 10.510 1.00 22.43 C ATOM 1226 O GLY A 164 31.278 14.933 10.907 1.00 24.88 O ATOM 0 H GLY A 164 31.430 18.690 9.914 1.00 22.18 H new ATOM 0 HA2 GLY A 164 32.132 17.299 11.519 1.00 21.29 H new ATOM 0 HA3 GLY A 164 30.694 17.294 12.123 1.00 21.29 H new ATOM 1227 N THR A 165 30.125 16.170 9.414 1.00 17.73 N ATOM 1228 CA THR A 165 29.758 15.046 8.552 1.00 16.84 C ATOM 1229 C THR A 165 31.015 14.241 8.239 1.00 23.49 C ATOM 1230 O THR A 165 32.065 14.810 7.947 1.00 24.33 O ATOM 1231 CB THR A 165 29.143 15.542 7.215 1.00 24.13 C ATOM 1232 OG1 THR A 165 27.879 16.165 7.468 1.00 23.50 O ATOM 1233 CG2 THR A 165 28.932 14.380 6.244 1.00 24.14 C ATOM 0 H THR A 165 29.818 16.928 9.148 1.00 17.73 H new ATOM 0 HA THR A 165 29.100 14.504 9.014 1.00 16.84 H new ATOM 0 HB THR A 165 29.759 16.177 6.818 1.00 24.13 H new ATOM 0 HG1 THR A 165 27.936 16.646 8.155 1.00 23.50 H new ATOM 0 HG21 THR A 165 28.548 14.714 5.418 1.00 24.14 H new ATOM 0 HG22 THR A 165 29.784 13.957 6.056 1.00 24.14 H new ATOM 0 HG23 THR A 165 28.330 13.731 6.641 1.00 24.14 H new ATOM 1234 N LYS A 166 30.912 12.918 8.320 1.00 21.08 N ATOM 1235 CA LYS A 166 32.046 12.056 8.024 1.00 16.81 C ATOM 1236 C LYS A 166 31.903 11.605 6.574 1.00 22.81 C ATOM 1237 O LYS A 166 30.817 11.244 6.118 1.00 22.35 O ATOM 1238 CB LYS A 166 32.076 10.847 8.964 1.00 19.55 C ATOM 1239 CG LYS A 166 32.136 11.198 10.459 1.00 19.64 C ATOM 1240 CD LYS A 166 33.382 12.005 10.815 1.00 25.43 C ATOM 1241 CE LYS A 166 33.462 12.299 12.330 1.00 20.02 C ATOM 1242 NZ LYS A 166 32.253 13.001 12.842 1.00 24.71 N ATOM 0 H LYS A 166 30.194 12.502 8.545 1.00 21.08 H new ATOM 0 HA LYS A 166 32.879 12.536 8.154 1.00 16.81 H new ATOM 0 HB2 LYS A 166 31.286 10.307 8.802 1.00 19.55 H new ATOM 0 HB3 LYS A 166 32.845 10.299 8.742 1.00 19.55 H new ATOM 0 HG2 LYS A 166 31.345 11.704 10.702 1.00 19.64 H new ATOM 0 HG3 LYS A 166 32.122 10.381 10.982 1.00 19.64 H new ATOM 0 HD2 LYS A 166 34.173 11.517 10.538 1.00 25.43 H new ATOM 0 HD3 LYS A 166 33.377 12.841 10.323 1.00 25.43 H new ATOM 0 HE2 LYS A 166 33.576 11.465 12.812 1.00 20.02 H new ATOM 0 HE3 LYS A 166 34.247 12.840 12.510 1.00 20.02 H new ATOM 0 HZ1 LYS A 166 32.434 13.365 13.634 1.00 24.71 H new ATOM 0 HZ2 LYS A 166 32.016 13.640 12.269 1.00 24.71 H new ATOM 0 HZ3 LYS A 166 31.586 12.418 12.929 1.00 24.71 H new ATOM 1243 N ILE A 167 33.014 11.617 5.855 1.00 21.25 N ATOM 1244 CA ILE A 167 33.004 11.261 4.449 1.00 21.79 C ATOM 1245 C ILE A 167 34.160 10.338 4.114 1.00 23.80 C ATOM 1246 O ILE A 167 35.268 10.521 4.616 1.00 24.63 O ATOM 1247 CB ILE A 167 33.097 12.560 3.614 1.00 30.44 C ATOM 1248 CG1 ILE A 167 33.186 12.251 2.126 1.00 32.49 C ATOM 1249 CG2 ILE A 167 34.315 13.376 4.064 1.00 27.98 C ATOM 1250 CD1 ILE A 167 33.210 13.512 1.270 1.00 38.94 C ATOM 0 H ILE A 167 33.787 11.830 6.165 1.00 21.25 H new ATOM 0 HA ILE A 167 32.182 10.789 4.242 1.00 21.79 H new ATOM 0 HB ILE A 167 32.291 13.079 3.761 1.00 30.44 H new ATOM 0 HG12 ILE A 167 33.987 11.731 1.954 1.00 32.49 H new ATOM 0 HG13 ILE A 167 32.430 11.702 1.867 1.00 32.49 H new ATOM 0 HG21 ILE A 167 34.371 14.190 3.539 1.00 27.98 H new ATOM 0 HG22 ILE A 167 34.224 13.603 5.003 1.00 27.98 H new ATOM 0 HG23 ILE A 167 35.121 12.852 3.935 1.00 27.98 H new ATOM 0 HD11 ILE A 167 33.267 13.266 0.333 1.00 38.94 H new ATOM 0 HD12 ILE A 167 32.399 14.022 1.421 1.00 38.94 H new ATOM 0 HD13 ILE A 167 33.980 14.051 1.510 1.00 38.94 H new ATOM 1251 N LEU A 168 33.903 9.326 3.291 1.00 22.87 N ATOM 1252 CA LEU A 168 34.969 8.422 2.887 1.00 20.24 C ATOM 1253 C LEU A 168 35.564 8.945 1.580 1.00 24.10 C ATOM 1254 O LEU A 168 34.853 9.133 0.602 1.00 21.36 O ATOM 1255 CB LEU A 168 34.444 6.997 2.655 1.00 25.19 C ATOM 1256 CG LEU A 168 35.507 6.027 2.103 1.00 26.67 C ATOM 1257 CD1 LEU A 168 36.571 5.752 3.177 1.00 21.70 C ATOM 1258 CD2 LEU A 168 34.847 4.716 1.656 1.00 25.28 C ATOM 0 H LEU A 168 33.129 9.148 2.960 1.00 22.87 H new ATOM 0 HA LEU A 168 35.633 8.387 3.593 1.00 20.24 H new ATOM 0 HB2 LEU A 168 34.102 6.647 3.492 1.00 25.19 H new ATOM 0 HB3 LEU A 168 33.698 7.033 2.036 1.00 25.19 H new ATOM 0 HG LEU A 168 35.936 6.433 1.334 1.00 26.67 H new ATOM 0 HD11 LEU A 168 37.237 5.141 2.824 1.00 21.70 H new ATOM 0 HD12 LEU A 168 36.999 6.585 3.430 1.00 21.70 H new ATOM 0 HD13 LEU A 168 36.150 5.356 3.956 1.00 21.70 H new ATOM 0 HD21 LEU A 168 35.524 4.114 1.311 1.00 25.28 H new ATOM 0 HD22 LEU A 168 34.403 4.303 2.413 1.00 25.28 H new ATOM 0 HD23 LEU A 168 34.196 4.902 0.961 1.00 25.28 H new ATOM 1259 N ILE A 169 36.868 9.192 1.584 1.00 27.21 N ATOM 1260 CA ILE A 169 37.585 9.667 0.403 1.00 28.15 C ATOM 1261 C ILE A 169 38.438 8.477 -0.025 1.00 19.27 C ATOM 1262 O ILE A 169 39.245 7.982 0.764 1.00 22.38 O ATOM 1263 CB ILE A 169 38.495 10.869 0.767 1.00 36.13 C ATOM 1264 CG1 ILE A 169 37.637 12.034 1.270 1.00 39.29 C ATOM 1265 CG2 ILE A 169 39.306 11.299 -0.432 1.00 42.00 C ATOM 1266 CD1 ILE A 169 36.656 12.559 0.243 1.00 28.65 C ATOM 0 H ILE A 169 37.367 9.088 2.277 1.00 27.21 H new ATOM 0 HA ILE A 169 36.984 9.970 -0.296 1.00 28.15 H new ATOM 0 HB ILE A 169 39.107 10.598 1.469 1.00 36.13 H new ATOM 0 HG12 ILE A 169 37.147 11.747 2.056 1.00 39.29 H new ATOM 0 HG13 ILE A 169 38.220 12.758 1.547 1.00 39.29 H new ATOM 0 HG21 ILE A 169 39.869 12.050 -0.189 1.00 42.00 H new ATOM 0 HG22 ILE A 169 39.862 10.561 -0.728 1.00 42.00 H new ATOM 0 HG23 ILE A 169 38.709 11.562 -1.150 1.00 42.00 H new ATOM 0 HD11 ILE A 169 36.148 13.291 0.625 1.00 28.65 H new ATOM 0 HD12 ILE A 169 37.140 12.874 -0.536 1.00 28.65 H new ATOM 0 HD13 ILE A 169 36.050 11.848 -0.019 1.00 28.65 H new ATOM 1267 N TYR A 170 38.270 8.010 -1.262 1.00 20.85 N ATOM 1268 CA TYR A 170 39.024 6.836 -1.692 1.00 22.03 C ATOM 1269 C TYR A 170 39.349 6.747 -3.174 1.00 21.52 C ATOM 1270 O TYR A 170 38.790 7.470 -3.996 1.00 23.82 O ATOM 1271 CB TYR A 170 38.258 5.570 -1.278 1.00 22.58 C ATOM 1272 CG TYR A 170 36.974 5.355 -2.053 1.00 25.91 C ATOM 1273 CD1 TYR A 170 36.920 4.440 -3.101 1.00 26.83 C ATOM 1274 CD2 TYR A 170 35.819 6.078 -1.751 1.00 19.23 C ATOM 1275 CE1 TYR A 170 35.744 4.242 -3.830 1.00 28.58 C ATOM 1276 CE2 TYR A 170 34.640 5.889 -2.475 1.00 26.81 C ATOM 1277 CZ TYR A 170 34.614 4.969 -3.513 1.00 33.66 C ATOM 1278 OH TYR A 170 33.459 4.770 -4.237 1.00 28.30 O ATOM 0 H TYR A 170 37.741 8.347 -1.851 1.00 20.85 H new ATOM 0 HA TYR A 170 39.884 6.920 -1.251 1.00 22.03 H new ATOM 0 HB2 TYR A 170 38.833 4.799 -1.400 1.00 22.58 H new ATOM 0 HB3 TYR A 170 38.051 5.622 -0.332 1.00 22.58 H new ATOM 0 HD1 TYR A 170 37.680 3.952 -3.320 1.00 26.83 H new ATOM 0 HD2 TYR A 170 35.835 6.696 -1.056 1.00 19.23 H new ATOM 0 HE1 TYR A 170 35.723 3.624 -4.525 1.00 28.58 H new ATOM 0 HE2 TYR A 170 33.877 6.377 -2.263 1.00 26.81 H new ATOM 0 HH TYR A 170 32.853 5.271 -3.942 1.00 28.30 H new ATOM 1279 N GLY A 171 40.254 5.828 -3.498 1.00 25.32 N ATOM 1280 CA GLY A 171 40.654 5.619 -4.874 1.00 27.45 C ATOM 1281 C GLY A 171 41.889 6.420 -5.234 1.00 33.07 C ATOM 1282 O GLY A 171 42.764 6.645 -4.399 1.00 32.12 O ATOM 0 H GLY A 171 40.647 5.316 -2.930 1.00 25.32 H new ATOM 0 HA2 GLY A 171 40.827 4.676 -5.020 1.00 27.45 H new ATOM 0 HA3 GLY A 171 39.925 5.868 -5.463 1.00 27.45 H new ATOM 1283 N ASN A 172 41.965 6.833 -6.492 1.00 28.49 N ATOM 1284 CA ASN A 172 43.087 7.633 -6.972 1.00 33.90 C ATOM 1285 C ASN A 172 42.555 9.055 -7.069 1.00 32.92 C ATOM 1286 O ASN A 172 41.637 9.314 -7.837 1.00 26.47 O ATOM 1287 CB ASN A 172 43.534 7.154 -8.352 1.00 35.37 C ATOM 1288 CG ASN A 172 44.626 8.022 -8.941 1.00 33.08 C ATOM 1289 OD1 ASN A 172 45.747 8.055 -8.440 1.00 40.37 O ATOM 1290 ND2 ASN A 172 44.300 8.733 -10.008 1.00 41.39 N ATOM 0 H ASN A 172 41.372 6.660 -7.090 1.00 28.49 H new ATOM 0 HA ASN A 172 43.853 7.565 -6.380 1.00 33.90 H new ATOM 0 HB2 ASN A 172 43.851 6.240 -8.287 1.00 35.37 H new ATOM 0 HB3 ASN A 172 42.771 7.147 -8.952 1.00 35.37 H new ATOM 0 HD21 ASN A 172 44.884 9.244 -10.379 1.00 41.39 H new ATOM 0 HD22 ASN A 172 43.504 8.684 -10.331 1.00 41.39 H new ATOM 1291 N ILE A 173 43.123 9.971 -6.291 1.00 27.71 N ATOM 1292 CA ILE A 173 42.648 11.352 -6.293 1.00 26.14 C ATOM 1293 C ILE A 173 43.743 12.368 -6.587 1.00 16.93 C ATOM 1294 O ILE A 173 44.745 12.435 -5.873 1.00 19.74 O ATOM 1295 CB ILE A 173 41.999 11.695 -4.934 1.00 24.40 C ATOM 1296 CG1 ILE A 173 40.846 10.732 -4.675 1.00 26.70 C ATOM 1297 CG2 ILE A 173 41.487 13.137 -4.925 1.00 25.25 C ATOM 1298 CD1 ILE A 173 40.121 10.986 -3.392 1.00 25.76 C ATOM 0 H ILE A 173 43.780 9.816 -5.758 1.00 27.71 H new ATOM 0 HA ILE A 173 41.997 11.411 -7.010 1.00 26.14 H new ATOM 0 HB ILE A 173 42.665 11.607 -4.235 1.00 24.40 H new ATOM 0 HG12 ILE A 173 40.215 10.791 -5.410 1.00 26.70 H new ATOM 0 HG13 ILE A 173 41.189 9.825 -4.668 1.00 26.70 H new ATOM 0 HG21 ILE A 173 41.084 13.332 -4.065 1.00 25.25 H new ATOM 0 HG22 ILE A 173 42.227 13.744 -5.080 1.00 25.25 H new ATOM 0 HG23 ILE A 173 40.825 13.250 -5.625 1.00 25.25 H new ATOM 0 HD11 ILE A 173 39.404 10.340 -3.292 1.00 25.76 H new ATOM 0 HD12 ILE A 173 40.738 10.901 -2.649 1.00 25.76 H new ATOM 0 HD13 ILE A 173 39.750 11.882 -3.402 1.00 25.76 H new ATOM 1299 N SER A 174 43.549 13.150 -7.645 1.00 21.68 N ATOM 1300 CA SER A 174 44.524 14.167 -8.020 1.00 22.31 C ATOM 1301 C SER A 174 44.386 15.340 -7.057 1.00 26.07 C ATOM 1302 O SER A 174 43.294 15.633 -6.578 1.00 22.85 O ATOM 1303 CB SER A 174 44.274 14.652 -9.454 1.00 22.23 C ATOM 1304 OG SER A 174 44.459 13.607 -10.396 1.00 34.87 O ATOM 0 H SER A 174 42.860 13.107 -8.158 1.00 21.68 H new ATOM 0 HA SER A 174 45.417 13.791 -7.976 1.00 22.31 H new ATOM 0 HB2 SER A 174 43.371 14.999 -9.527 1.00 22.23 H new ATOM 0 HB3 SER A 174 44.876 15.384 -9.659 1.00 22.23 H new ATOM 0 HG SER A 174 45.241 13.640 -10.702 1.00 34.87 H new ATOM 1305 N PHE A 175 45.491 15.999 -6.750 1.00 21.81 N ATOM 1306 CA PHE A 175 45.407 17.139 -5.861 1.00 23.40 C ATOM 1307 C PHE A 175 46.319 18.250 -6.353 1.00 29.78 C ATOM 1308 O PHE A 175 47.332 17.999 -7.017 1.00 24.35 O ATOM 1309 CB PHE A 175 45.730 16.730 -4.419 1.00 19.05 C ATOM 1310 CG PHE A 175 47.151 16.298 -4.195 1.00 22.71 C ATOM 1311 CD1 PHE A 175 48.158 17.242 -3.992 1.00 26.70 C ATOM 1312 CD2 PHE A 175 47.475 14.941 -4.126 1.00 22.53 C ATOM 1313 CE1 PHE A 175 49.466 16.843 -3.721 1.00 24.31 C ATOM 1314 CE2 PHE A 175 48.780 14.533 -3.856 1.00 28.08 C ATOM 1315 CZ PHE A 175 49.776 15.486 -3.650 1.00 25.63 C ATOM 0 H PHE A 175 46.279 15.809 -7.037 1.00 21.81 H new ATOM 0 HA PHE A 175 44.498 17.477 -5.864 1.00 23.40 H new ATOM 0 HB2 PHE A 175 45.535 17.477 -3.832 1.00 19.05 H new ATOM 0 HB3 PHE A 175 45.139 16.005 -4.161 1.00 19.05 H new ATOM 0 HD1 PHE A 175 47.954 18.148 -4.038 1.00 26.70 H new ATOM 0 HD2 PHE A 175 46.812 14.303 -4.262 1.00 22.53 H new ATOM 0 HE1 PHE A 175 50.130 17.481 -3.588 1.00 24.31 H new ATOM 0 HE2 PHE A 175 48.986 13.627 -3.813 1.00 28.08 H new ATOM 0 HZ PHE A 175 50.647 15.217 -3.465 1.00 25.63 H new ATOM 1316 N ARG A 176 45.946 19.482 -6.036 1.00 24.78 N ATOM 1317 CA ARG A 176 46.712 20.636 -6.474 1.00 25.98 C ATOM 1318 C ARG A 176 46.700 21.714 -5.400 1.00 22.80 C ATOM 1319 O ARG A 176 45.643 22.109 -4.912 1.00 22.42 O ATOM 1320 CB ARG A 176 46.104 21.179 -7.778 1.00 25.84 C ATOM 1321 CG ARG A 176 46.955 22.221 -8.498 1.00 27.19 C ATOM 1322 CD ARG A 176 48.353 21.677 -8.779 1.00 34.43 C ATOM 1323 NE ARG A 176 49.272 22.711 -9.250 1.00 41.34 N ATOM 1324 CZ ARG A 176 49.212 23.262 -10.457 1.00 39.50 C ATOM 1325 NH1 ARG A 176 48.275 22.874 -11.312 1.00 52.03 N ATOM 1326 NH2 ARG A 176 50.090 24.194 -10.815 1.00 41.26 N ATOM 0 H ARG A 176 45.250 19.671 -5.567 1.00 24.78 H new ATOM 0 HA ARG A 176 47.632 20.372 -6.632 1.00 25.98 H new ATOM 0 HB2 ARG A 176 45.948 20.435 -8.381 1.00 25.84 H new ATOM 0 HB3 ARG A 176 45.239 21.569 -7.578 1.00 25.84 H new ATOM 0 HG2 ARG A 176 46.528 22.474 -9.331 1.00 27.19 H new ATOM 0 HG3 ARG A 176 47.018 23.023 -7.957 1.00 27.19 H new ATOM 0 HD2 ARG A 176 48.709 21.276 -7.971 1.00 34.43 H new ATOM 0 HD3 ARG A 176 48.295 20.973 -9.444 1.00 34.43 H new ATOM 0 HE ARG A 176 49.889 22.979 -8.714 1.00 41.34 H new ATOM 0 HH11 ARG A 176 47.709 22.268 -11.084 1.00 52.03 H new ATOM 0 HH12 ARG A 176 48.233 23.229 -12.094 1.00 52.03 H new ATOM 0 HH21 ARG A 176 50.701 24.443 -10.264 1.00 41.26 H new ATOM 0 HH22 ARG A 176 50.047 24.548 -11.598 1.00 41.26 H new ATOM 1327 N LEU A 177 47.882 22.169 -5.006 1.00 20.03 N ATOM 1328 CA LEU A 177 47.973 23.234 -4.015 1.00 21.97 C ATOM 1329 C LEU A 177 47.066 23.055 -2.788 1.00 25.43 C ATOM 1330 O LEU A 177 46.320 23.959 -2.412 1.00 22.20 O ATOM 1331 CB LEU A 177 47.676 24.565 -4.714 1.00 21.06 C ATOM 1332 CG LEU A 177 48.635 24.820 -5.885 1.00 21.35 C ATOM 1333 CD1 LEU A 177 48.198 26.047 -6.680 1.00 21.64 C ATOM 1334 CD2 LEU A 177 50.051 24.985 -5.353 1.00 29.39 C ATOM 0 H LEU A 177 48.638 21.878 -5.296 1.00 20.03 H new ATOM 0 HA LEU A 177 48.874 23.211 -3.656 1.00 21.97 H new ATOM 0 HB2 LEU A 177 46.762 24.563 -5.039 1.00 21.06 H new ATOM 0 HB3 LEU A 177 47.748 25.290 -4.073 1.00 21.06 H new ATOM 0 HG LEU A 177 48.615 24.060 -6.487 1.00 21.35 H new ATOM 0 HD11 LEU A 177 48.814 26.193 -7.415 1.00 21.64 H new ATOM 0 HD12 LEU A 177 47.305 25.904 -7.031 1.00 21.64 H new ATOM 0 HD13 LEU A 177 48.197 26.825 -6.100 1.00 21.64 H new ATOM 0 HD21 LEU A 177 50.658 25.146 -6.092 1.00 29.39 H new ATOM 0 HD22 LEU A 177 50.081 25.737 -4.741 1.00 29.39 H new ATOM 0 HD23 LEU A 177 50.318 24.177 -4.886 1.00 29.39 H new ATOM 1335 N GLY A 178 47.131 21.876 -2.177 1.00 24.42 N ATOM 1336 CA GLY A 178 46.345 21.605 -0.985 1.00 19.19 C ATOM 1337 C GLY A 178 44.862 21.393 -1.191 1.00 25.49 C ATOM 1338 O GLY A 178 44.083 21.476 -0.236 1.00 26.45 O ATOM 0 H GLY A 178 47.624 21.222 -2.438 1.00 24.42 H new ATOM 0 HA2 GLY A 178 46.708 20.815 -0.555 1.00 19.19 H new ATOM 0 HA3 GLY A 178 46.464 22.344 -0.368 1.00 19.19 H new ATOM 1339 N VAL A 179 44.462 21.122 -2.428 1.00 21.74 N ATOM 1340 CA VAL A 179 43.051 20.900 -2.724 1.00 21.54 C ATOM 1341 C VAL A 179 42.869 19.588 -3.477 1.00 22.05 C ATOM 1342 O VAL A 179 43.504 19.362 -4.503 1.00 19.65 O ATOM 1343 CB VAL A 179 42.454 22.029 -3.608 1.00 24.39 C ATOM 1344 CG1 VAL A 179 40.952 21.815 -3.766 1.00 27.35 C ATOM 1345 CG2 VAL A 179 42.752 23.420 -3.002 1.00 27.67 C ATOM 0 H VAL A 179 44.987 21.062 -3.106 1.00 21.74 H new ATOM 0 HA VAL A 179 42.591 20.882 -1.870 1.00 21.54 H new ATOM 0 HB VAL A 179 42.870 21.996 -4.484 1.00 24.39 H new ATOM 0 HG11 VAL A 179 40.581 22.521 -4.318 1.00 27.35 H new ATOM 0 HG12 VAL A 179 40.790 20.956 -4.187 1.00 27.35 H new ATOM 0 HG13 VAL A 179 40.529 21.832 -2.893 1.00 27.35 H new ATOM 0 HG21 VAL A 179 42.371 24.109 -3.569 1.00 27.67 H new ATOM 0 HG22 VAL A 179 42.361 23.478 -2.116 1.00 27.67 H new ATOM 0 HG23 VAL A 179 43.712 23.547 -2.940 1.00 27.67 H new ATOM 1346 N LEU A 180 42.003 18.727 -2.958 1.00 20.53 N ATOM 1347 CA LEU A 180 41.725 17.448 -3.597 1.00 23.44 C ATOM 1348 C LEU A 180 40.719 17.688 -4.713 1.00 19.93 C ATOM 1349 O LEU A 180 39.730 18.395 -4.514 1.00 24.23 O ATOM 1350 CB LEU A 180 41.129 16.460 -2.587 1.00 24.67 C ATOM 1351 CG LEU A 180 41.987 16.118 -1.367 1.00 26.88 C ATOM 1352 CD1 LEU A 180 41.216 15.187 -0.446 1.00 26.68 C ATOM 1353 CD2 LEU A 180 43.275 15.472 -1.815 1.00 22.74 C ATOM 0 H LEU A 180 41.563 18.865 -2.232 1.00 20.53 H new ATOM 0 HA LEU A 180 42.549 17.073 -3.946 1.00 23.44 H new ATOM 0 HB2 LEU A 180 40.286 16.822 -2.272 1.00 24.67 H new ATOM 0 HB3 LEU A 180 40.926 15.635 -3.055 1.00 24.67 H new ATOM 0 HG LEU A 180 42.200 16.930 -0.882 1.00 26.88 H new ATOM 0 HD11 LEU A 180 41.761 14.971 0.327 1.00 26.68 H new ATOM 0 HD12 LEU A 180 40.400 15.623 -0.154 1.00 26.68 H new ATOM 0 HD13 LEU A 180 40.994 14.372 -0.922 1.00 26.68 H new ATOM 0 HD21 LEU A 180 43.816 15.257 -1.039 1.00 22.74 H new ATOM 0 HD22 LEU A 180 43.076 14.659 -2.306 1.00 22.74 H new ATOM 0 HD23 LEU A 180 43.762 16.084 -2.388 1.00 22.74 H new ATOM 1354 N LEU A 181 40.977 17.119 -5.889 1.00 20.60 N ATOM 1355 CA LEU A 181 40.053 17.272 -7.013 1.00 25.85 C ATOM 1356 C LEU A 181 39.155 16.040 -6.956 1.00 29.86 C ATOM 1357 O LEU A 181 39.446 15.001 -7.545 1.00 21.18 O ATOM 1358 CB LEU A 181 40.833 17.344 -8.328 1.00 30.67 C ATOM 1359 CG LEU A 181 41.887 18.464 -8.332 1.00 43.59 C ATOM 1360 CD1 LEU A 181 42.641 18.474 -9.661 1.00 46.78 C ATOM 1361 CD2 LEU A 181 41.212 19.811 -8.091 1.00 43.77 C ATOM 0 H LEU A 181 41.674 16.645 -6.057 1.00 20.60 H new ATOM 0 HA LEU A 181 39.532 18.088 -6.962 1.00 25.85 H new ATOM 0 HB2 LEU A 181 41.270 16.493 -8.487 1.00 30.67 H new ATOM 0 HB3 LEU A 181 40.213 17.486 -9.060 1.00 30.67 H new ATOM 0 HG LEU A 181 42.525 18.302 -7.619 1.00 43.59 H new ATOM 0 HD11 LEU A 181 43.302 19.183 -9.653 1.00 46.78 H new ATOM 0 HD12 LEU A 181 43.084 17.621 -9.788 1.00 46.78 H new ATOM 0 HD13 LEU A 181 42.016 18.624 -10.387 1.00 46.78 H new ATOM 0 HD21 LEU A 181 41.881 20.514 -8.094 1.00 43.77 H new ATOM 0 HD22 LEU A 181 40.564 19.979 -8.793 1.00 43.77 H new ATOM 0 HD23 LEU A 181 40.761 19.798 -7.232 1.00 43.77 H new ATOM 1362 N LEU A 182 38.060 16.164 -6.216 1.00 21.67 N ATOM 1363 CA LEU A 182 37.149 15.046 -6.025 1.00 30.79 C ATOM 1364 C LEU A 182 36.200 14.756 -7.181 1.00 22.61 C ATOM 1365 O LEU A 182 35.666 15.671 -7.805 1.00 26.84 O ATOM 1366 CB LEU A 182 36.337 15.268 -4.747 1.00 22.65 C ATOM 1367 CG LEU A 182 37.165 15.492 -3.476 1.00 30.14 C ATOM 1368 CD1 LEU A 182 36.236 15.836 -2.333 1.00 26.40 C ATOM 1369 CD2 LEU A 182 37.980 14.249 -3.151 1.00 17.25 C ATOM 0 H LEU A 182 37.827 16.889 -5.816 1.00 21.67 H new ATOM 0 HA LEU A 182 37.719 14.264 -5.966 1.00 30.79 H new ATOM 0 HB2 LEU A 182 35.759 16.036 -4.878 1.00 22.65 H new ATOM 0 HB3 LEU A 182 35.762 14.499 -4.609 1.00 22.65 H new ATOM 0 HG LEU A 182 37.783 16.227 -3.616 1.00 30.14 H new ATOM 0 HD11 LEU A 182 36.755 15.979 -1.526 1.00 26.40 H new ATOM 0 HD12 LEU A 182 35.744 16.644 -2.548 1.00 26.40 H new ATOM 0 HD13 LEU A 182 35.613 15.106 -2.191 1.00 26.40 H new ATOM 0 HD21 LEU A 182 38.499 14.403 -2.346 1.00 17.25 H new ATOM 0 HD22 LEU A 182 37.383 13.498 -3.011 1.00 17.25 H new ATOM 0 HD23 LEU A 182 38.579 14.053 -3.888 1.00 17.25 H new ATOM 1370 N LYS A 183 36.008 13.467 -7.452 1.00 23.05 N ATOM 1371 CA LYS A 183 35.096 12.998 -8.494 1.00 25.82 C ATOM 1372 C LYS A 183 34.102 12.058 -7.801 1.00 30.97 C ATOM 1373 O LYS A 183 34.394 11.516 -6.737 1.00 23.47 O ATOM 1374 CB LYS A 183 35.862 12.248 -9.592 1.00 25.70 C ATOM 1375 CG LYS A 183 36.895 13.101 -10.321 1.00 27.86 C ATOM 1376 CD LYS A 183 37.716 12.285 -11.315 1.00 35.41 C ATOM 1377 CE LYS A 183 36.982 12.095 -12.634 1.00 61.22 C ATOM 1378 NZ LYS A 183 36.912 13.360 -13.417 1.00 63.12 N ATOM 0 H LYS A 183 36.408 12.833 -7.031 1.00 23.05 H new ATOM 0 HA LYS A 183 34.644 13.742 -8.922 1.00 25.82 H new ATOM 0 HB2 LYS A 183 36.309 11.483 -9.197 1.00 25.70 H new ATOM 0 HB3 LYS A 183 35.227 11.903 -10.239 1.00 25.70 H new ATOM 0 HG2 LYS A 183 36.445 13.821 -10.790 1.00 27.86 H new ATOM 0 HG3 LYS A 183 37.489 13.511 -9.673 1.00 27.86 H new ATOM 0 HD2 LYS A 183 38.563 12.730 -11.477 1.00 35.41 H new ATOM 0 HD3 LYS A 183 37.920 11.418 -10.931 1.00 35.41 H new ATOM 0 HE2 LYS A 183 37.432 11.414 -13.159 1.00 61.22 H new ATOM 0 HE3 LYS A 183 36.084 11.772 -12.461 1.00 61.22 H new ATOM 0 HZ1 LYS A 183 36.187 13.351 -13.932 1.00 63.12 H new ATOM 0 HZ2 LYS A 183 36.870 14.053 -12.860 1.00 63.12 H new ATOM 0 HZ3 LYS A 183 37.637 13.434 -13.928 1.00 63.12 H new ATOM 1379 N PRO A 184 32.917 11.855 -8.392 1.00 33.64 N ATOM 1380 CA PRO A 184 31.909 10.975 -7.788 1.00 31.65 C ATOM 1381 C PRO A 184 32.441 9.632 -7.305 1.00 26.82 C ATOM 1382 O PRO A 184 32.028 9.137 -6.258 1.00 26.25 O ATOM 1383 CB PRO A 184 30.883 10.787 -8.909 1.00 38.88 C ATOM 1384 CG PRO A 184 31.024 12.008 -9.726 1.00 43.46 C ATOM 1385 CD PRO A 184 32.506 12.274 -9.744 1.00 34.70 C ATOM 0 HA PRO A 184 31.551 11.372 -6.979 1.00 31.65 H new ATOM 0 HB2 PRO A 184 31.066 9.988 -9.428 1.00 38.88 H new ATOM 0 HB3 PRO A 184 29.984 10.697 -8.557 1.00 38.88 H new ATOM 0 HG2 PRO A 184 30.677 11.876 -10.622 1.00 43.46 H new ATOM 0 HG3 PRO A 184 30.536 12.751 -9.339 1.00 43.46 H new ATOM 0 HD2 PRO A 184 32.957 11.763 -10.434 1.00 34.70 H new ATOM 0 HD3 PRO A 184 32.704 13.209 -9.909 1.00 34.70 H new ATOM 1386 N GLU A 185 33.353 9.034 -8.067 1.00 26.09 N ATOM 1387 CA GLU A 185 33.879 7.726 -7.687 1.00 30.82 C ATOM 1388 C GLU A 185 34.871 7.740 -6.523 1.00 30.73 C ATOM 1389 O GLU A 185 35.369 6.690 -6.135 1.00 25.98 O ATOM 1390 CB GLU A 185 34.527 7.034 -8.894 1.00 32.63 C ATOM 1391 CG GLU A 185 35.733 7.762 -9.448 1.00 36.02 C ATOM 1392 CD GLU A 185 35.411 8.604 -10.670 1.00 49.14 C ATOM 1393 OE1 GLU A 185 34.383 9.320 -10.673 1.00 34.26 O ATOM 1394 OE2 GLU A 185 36.207 8.553 -11.630 1.00 46.61 O ATOM 0 H GLU A 185 33.675 9.361 -8.794 1.00 26.09 H new ATOM 0 HA GLU A 185 33.105 7.231 -7.376 1.00 30.82 H new ATOM 0 HB2 GLU A 185 34.792 6.137 -8.637 1.00 32.63 H new ATOM 0 HB3 GLU A 185 33.865 6.943 -9.597 1.00 32.63 H new ATOM 0 HG2 GLU A 185 36.105 8.333 -8.757 1.00 36.02 H new ATOM 0 HG3 GLU A 185 36.417 7.114 -9.679 1.00 36.02 H new ATOM 1395 N ASN A 186 35.154 8.914 -5.962 1.00 26.40 N ATOM 1396 CA ASN A 186 36.096 9.006 -4.842 1.00 31.42 C ATOM 1397 C ASN A 186 35.402 9.351 -3.536 1.00 26.59 C ATOM 1398 O ASN A 186 36.059 9.477 -2.502 1.00 20.07 O ATOM 1399 CB ASN A 186 37.149 10.094 -5.097 1.00 23.56 C ATOM 1400 CG ASN A 186 37.893 9.898 -6.386 1.00 32.24 C ATOM 1401 OD1 ASN A 186 38.496 8.844 -6.621 1.00 31.52 O ATOM 1402 ND2 ASN A 186 37.868 10.918 -7.235 1.00 24.06 N ATOM 0 H ASN A 186 34.816 9.665 -6.211 1.00 26.40 H new ATOM 0 HA ASN A 186 36.510 8.132 -4.772 1.00 31.42 H new ATOM 0 HB2 ASN A 186 36.715 10.961 -5.108 1.00 23.56 H new ATOM 0 HB3 ASN A 186 37.782 10.103 -4.362 1.00 23.56 H new ATOM 0 HD21 ASN A 186 38.283 10.863 -7.986 1.00 24.06 H new ATOM 0 HD22 ASN A 186 37.437 11.634 -7.034 1.00 24.06 H new ATOM 1403 N VAL A 187 34.082 9.493 -3.574 1.00 24.94 N ATOM 1404 CA VAL A 187 33.347 9.900 -2.386 1.00 26.31 C ATOM 1405 C VAL A 187 32.149 9.053 -1.962 1.00 29.31 C ATOM 1406 O VAL A 187 31.362 8.601 -2.789 1.00 19.40 O ATOM 1407 CB VAL A 187 32.842 11.366 -2.556 1.00 23.82 C ATOM 1408 CG1 VAL A 187 32.066 11.814 -1.326 1.00 25.54 C ATOM 1409 CG2 VAL A 187 34.018 12.296 -2.827 1.00 19.56 C ATOM 0 H VAL A 187 33.598 9.360 -4.272 1.00 24.94 H new ATOM 0 HA VAL A 187 34.003 9.785 -1.681 1.00 26.31 H new ATOM 0 HB VAL A 187 32.240 11.402 -3.316 1.00 23.82 H new ATOM 0 HG11 VAL A 187 31.761 12.726 -1.450 1.00 25.54 H new ATOM 0 HG12 VAL A 187 31.301 11.232 -1.196 1.00 25.54 H new ATOM 0 HG13 VAL A 187 32.641 11.769 -0.546 1.00 25.54 H new ATOM 0 HG21 VAL A 187 33.695 13.205 -2.931 1.00 19.56 H new ATOM 0 HG22 VAL A 187 34.639 12.258 -2.083 1.00 19.56 H new ATOM 0 HG23 VAL A 187 34.470 12.019 -3.639 1.00 19.56 H new ATOM 1410 N LYS A 188 32.027 8.853 -0.655 1.00 22.90 N ATOM 1411 CA LYS A 188 30.896 8.137 -0.072 1.00 28.69 C ATOM 1412 C LYS A 188 30.612 8.872 1.234 1.00 18.73 C ATOM 1413 O LYS A 188 31.506 9.061 2.045 1.00 25.91 O ATOM 1414 CB LYS A 188 31.236 6.672 0.211 1.00 20.50 C ATOM 1415 CG LYS A 188 30.123 5.932 0.948 1.00 32.27 C ATOM 1416 CD LYS A 188 30.442 4.447 1.124 1.00 37.35 C ATOM 1417 CE LYS A 188 29.281 3.703 1.775 1.00 29.05 C ATOM 1418 NZ LYS A 188 29.620 2.286 2.052 1.00 46.89 N ATOM 0 H LYS A 188 32.601 9.130 -0.077 1.00 22.90 H new ATOM 0 HA LYS A 188 30.136 8.123 -0.674 1.00 28.69 H new ATOM 0 HB2 LYS A 188 31.418 6.220 -0.628 1.00 20.50 H new ATOM 0 HB3 LYS A 188 32.049 6.630 0.738 1.00 20.50 H new ATOM 0 HG2 LYS A 188 29.987 6.338 1.818 1.00 32.27 H new ATOM 0 HG3 LYS A 188 29.292 6.028 0.457 1.00 32.27 H new ATOM 0 HD2 LYS A 188 30.638 4.052 0.260 1.00 37.35 H new ATOM 0 HD3 LYS A 188 31.238 4.348 1.669 1.00 37.35 H new ATOM 0 HE2 LYS A 188 29.038 4.145 2.603 1.00 29.05 H new ATOM 0 HE3 LYS A 188 28.505 3.742 1.194 1.00 29.05 H new ATOM 0 HZ1 LYS A 188 28.923 1.882 2.431 1.00 46.89 H new ATOM 0 HZ2 LYS A 188 29.822 1.874 1.289 1.00 46.89 H new ATOM 0 HZ3 LYS A 188 30.318 2.250 2.603 1.00 46.89 H new ATOM 1419 N VAL A 189 29.378 9.313 1.429 1.00 20.22 N ATOM 1420 CA VAL A 189 29.040 10.040 2.645 1.00 21.89 C ATOM 1421 C VAL A 189 28.673 9.055 3.746 1.00 27.72 C ATOM 1422 O VAL A 189 27.767 8.245 3.577 1.00 22.55 O ATOM 1423 CB VAL A 189 27.866 11.005 2.399 1.00 30.78 C ATOM 1424 CG1 VAL A 189 27.428 11.651 3.718 1.00 28.51 C ATOM 1425 CG2 VAL A 189 28.280 12.072 1.374 1.00 24.01 C ATOM 0 H VAL A 189 28.727 9.204 0.877 1.00 20.22 H new ATOM 0 HA VAL A 189 29.812 10.560 2.917 1.00 21.89 H new ATOM 0 HB VAL A 189 27.112 10.511 2.042 1.00 30.78 H new ATOM 0 HG11 VAL A 189 26.689 12.257 3.552 1.00 28.51 H new ATOM 0 HG12 VAL A 189 27.147 10.961 4.339 1.00 28.51 H new ATOM 0 HG13 VAL A 189 28.171 12.145 4.099 1.00 28.51 H new ATOM 0 HG21 VAL A 189 27.539 12.679 1.221 1.00 24.01 H new ATOM 0 HG22 VAL A 189 29.040 12.570 1.714 1.00 24.01 H new ATOM 0 HG23 VAL A 189 28.523 11.642 0.539 1.00 24.01 H new ATOM 1426 N LEU A 190 29.384 9.118 4.870 1.00 18.65 N ATOM 1427 CA LEU A 190 29.111 8.211 5.984 1.00 20.50 C ATOM 1428 C LEU A 190 28.096 8.797 6.955 1.00 24.17 C ATOM 1429 O LEU A 190 27.466 8.065 7.724 1.00 26.27 O ATOM 1430 CB LEU A 190 30.409 7.876 6.727 1.00 21.81 C ATOM 1431 CG LEU A 190 31.529 7.310 5.845 1.00 26.00 C ATOM 1432 CD1 LEU A 190 32.783 7.079 6.681 1.00 24.43 C ATOM 1433 CD2 LEU A 190 31.067 6.000 5.212 1.00 30.65 C ATOM 0 H LEU A 190 30.025 9.675 5.008 1.00 18.65 H new ATOM 0 HA LEU A 190 28.733 7.399 5.612 1.00 20.50 H new ATOM 0 HB2 LEU A 190 30.733 8.679 7.163 1.00 21.81 H new ATOM 0 HB3 LEU A 190 30.210 7.234 7.426 1.00 21.81 H new ATOM 0 HG LEU A 190 31.738 7.945 5.142 1.00 26.00 H new ATOM 0 HD11 LEU A 190 33.487 6.721 6.117 1.00 24.43 H new ATOM 0 HD12 LEU A 190 33.074 7.920 7.067 1.00 24.43 H new ATOM 0 HD13 LEU A 190 32.587 6.449 7.392 1.00 24.43 H new ATOM 0 HD21 LEU A 190 31.775 5.642 4.654 1.00 30.65 H new ATOM 0 HD22 LEU A 190 30.852 5.361 5.910 1.00 30.65 H new ATOM 0 HD23 LEU A 190 30.280 6.163 4.669 1.00 30.65 H new ATOM 1434 N GLY A 191 27.953 10.118 6.929 1.00 22.70 N ATOM 1435 CA GLY A 191 26.993 10.778 7.800 1.00 21.95 C ATOM 1436 C GLY A 191 27.529 11.288 9.131 1.00 27.01 C ATOM 1437 O GLY A 191 28.726 11.504 9.305 1.00 24.13 O ATOM 0 H GLY A 191 28.400 10.646 6.417 1.00 22.70 H new ATOM 0 HA2 GLY A 191 26.610 11.528 7.318 1.00 21.95 H new ATOM 0 HA3 GLY A 191 26.269 10.158 7.981 1.00 21.95 H new ATOM 1438 N GLY A 192 26.630 11.471 10.090 1.00 25.51 N ATOM 1439 CA GLY A 192 27.044 11.974 11.382 1.00 28.45 C ATOM 1440 C GLY A 192 27.106 13.494 11.396 1.00 27.55 C ATOM 1441 O GLY A 192 26.782 14.166 10.416 1.00 21.01 O ATOM 0 H GLY A 192 25.789 11.312 10.011 1.00 25.51 H new ATOM 0 HA2 GLY A 192 26.425 11.668 12.063 1.00 28.45 H new ATOM 0 HA3 GLY A 192 27.915 11.612 11.607 1.00 28.45 H new ATOM 1442 N GLU A 193 27.533 14.036 12.523 1.00 29.04 N ATOM 1443 CA GLU A 193 27.643 15.476 12.696 1.00 31.81 C ATOM 1444 C GLU A 193 28.334 15.701 14.024 1.00 27.72 C ATOM 1445 O GLU A 193 28.345 14.816 14.876 1.00 29.66 O ATOM 1446 CB GLU A 193 26.251 16.121 12.727 1.00 31.19 C ATOM 1447 CG GLU A 193 25.321 15.540 13.792 1.00 48.38 C ATOM 1448 CD GLU A 193 23.932 16.169 13.782 1.00 55.80 C ATOM 1449 OE1 GLU A 193 23.261 16.139 12.728 1.00 58.87 O ATOM 1450 OE2 GLU A 193 23.505 16.687 14.835 1.00 65.73 O ATOM 0 H GLU A 193 27.768 13.579 13.213 1.00 29.04 H new ATOM 0 HA GLU A 193 28.139 15.873 11.963 1.00 31.81 H new ATOM 0 HB2 GLU A 193 26.349 17.074 12.881 1.00 31.19 H new ATOM 0 HB3 GLU A 193 25.836 16.016 11.856 1.00 31.19 H new ATOM 0 HG2 GLU A 193 25.238 14.584 13.654 1.00 48.38 H new ATOM 0 HG3 GLU A 193 25.721 15.667 14.667 1.00 48.38 H new ATOM 1451 N VAL A 194 28.931 16.871 14.200 1.00 26.49 N ATOM 1452 CA VAL A 194 29.582 17.166 15.464 1.00 21.43 C ATOM 1453 C VAL A 194 28.835 18.347 16.064 1.00 31.48 C ATOM 1454 O VAL A 194 28.954 19.487 15.605 1.00 24.00 O ATOM 1455 CB VAL A 194 31.081 17.498 15.286 1.00 28.41 C ATOM 1456 CG1 VAL A 194 31.706 17.819 16.648 1.00 31.17 C ATOM 1457 CG2 VAL A 194 31.805 16.308 14.664 1.00 25.15 C ATOM 0 H VAL A 194 28.970 17.497 13.612 1.00 26.49 H new ATOM 0 HA VAL A 194 29.552 16.390 16.046 1.00 21.43 H new ATOM 0 HB VAL A 194 31.167 18.268 14.702 1.00 28.41 H new ATOM 0 HG11 VAL A 194 32.646 18.027 16.532 1.00 31.17 H new ATOM 0 HG12 VAL A 194 31.253 18.582 17.040 1.00 31.17 H new ATOM 0 HG13 VAL A 194 31.615 17.052 17.235 1.00 31.17 H new ATOM 0 HG21 VAL A 194 32.745 16.522 14.555 1.00 25.15 H new ATOM 0 HG22 VAL A 194 31.715 15.535 15.243 1.00 25.15 H new ATOM 0 HG23 VAL A 194 31.416 16.109 13.798 1.00 25.15 H new ATOM 1458 N ASP A 195 28.040 18.053 17.084 1.00 30.62 N ATOM 1459 CA ASP A 195 27.235 19.063 17.755 1.00 32.96 C ATOM 1460 C ASP A 195 28.071 20.303 18.069 1.00 35.61 C ATOM 1461 O ASP A 195 27.667 21.433 17.786 1.00 34.98 O ATOM 1462 CB ASP A 195 26.650 18.468 19.042 1.00 35.67 C ATOM 1463 CG ASP A 195 25.415 19.205 19.514 1.00 46.56 C ATOM 1464 OD1 ASP A 195 24.412 19.217 18.769 1.00 37.31 O ATOM 1465 OD2 ASP A 195 25.447 19.774 20.626 1.00 61.68 O ATOM 0 H ASP A 195 27.952 17.261 17.407 1.00 30.62 H new ATOM 0 HA ASP A 195 26.512 19.335 17.168 1.00 32.96 H new ATOM 0 HB2 ASP A 195 26.429 17.536 18.892 1.00 35.67 H new ATOM 0 HB3 ASP A 195 27.323 18.491 19.740 1.00 35.67 H new ATOM 1466 N ALA A 196 29.247 20.078 18.641 1.00 35.70 N ATOM 1467 CA ALA A 196 30.162 21.154 19.000 1.00 42.61 C ATOM 1468 C ALA A 196 30.454 22.096 17.834 1.00 45.17 C ATOM 1469 O ALA A 196 30.624 23.295 18.039 1.00 53.54 O ATOM 1470 CB ALA A 196 31.462 20.568 19.531 1.00 44.14 C ATOM 0 H ALA A 196 29.539 19.292 18.833 1.00 35.70 H new ATOM 0 HA ALA A 196 29.727 21.681 19.688 1.00 42.61 H new ATOM 0 HB1 ALA A 196 32.068 21.287 19.769 1.00 44.14 H new ATOM 0 HB2 ALA A 196 31.277 20.029 20.316 1.00 44.14 H new ATOM 0 HB3 ALA A 196 31.871 20.014 18.847 1.00 44.14 H new ATOM 1471 N LEU A 197 30.517 21.554 16.618 1.00 39.08 N ATOM 1472 CA LEU A 197 30.781 22.354 15.420 1.00 40.36 C ATOM 1473 C LEU A 197 29.528 23.049 14.876 1.00 51.26 C ATOM 1474 O LEU A 197 29.605 24.153 14.332 1.00 45.52 O ATOM 1475 CB LEU A 197 31.375 21.474 14.313 1.00 42.13 C ATOM 1476 CG LEU A 197 32.823 21.006 14.466 1.00 47.43 C ATOM 1477 CD1 LEU A 197 33.149 19.995 13.378 1.00 42.17 C ATOM 1478 CD2 LEU A 197 33.757 22.205 14.383 1.00 54.76 C ATOM 0 H LEU A 197 30.408 20.715 16.464 1.00 39.08 H new ATOM 0 HA LEU A 197 31.411 23.042 15.687 1.00 40.36 H new ATOM 0 HB2 LEU A 197 30.816 20.686 14.228 1.00 42.13 H new ATOM 0 HB3 LEU A 197 31.307 21.962 13.477 1.00 42.13 H new ATOM 0 HG LEU A 197 32.941 20.580 15.330 1.00 47.43 H new ATOM 0 HD11 LEU A 197 34.067 19.699 13.476 1.00 42.17 H new ATOM 0 HD12 LEU A 197 32.554 19.233 13.455 1.00 42.17 H new ATOM 0 HD13 LEU A 197 33.034 20.407 12.508 1.00 42.17 H new ATOM 0 HD21 LEU A 197 34.675 21.908 14.480 1.00 54.76 H new ATOM 0 HD22 LEU A 197 33.648 22.641 13.524 1.00 54.76 H new ATOM 0 HD23 LEU A 197 33.544 22.831 15.092 1.00 54.76 H new ATOM 1479 N LEU A 198 28.381 22.392 15.008 1.00 49.31 N ATOM 1480 CA LEU A 198 27.124 22.954 14.525 1.00 56.06 C ATOM 1481 C LEU A 198 26.857 24.297 15.180 1.00 60.44 C ATOM 1482 O LEU A 198 26.176 25.153 14.613 1.00 63.29 O ATOM 1483 CB LEU A 198 25.966 21.996 14.814 1.00 47.79 C ATOM 1484 CG LEU A 198 25.713 20.870 13.805 1.00 49.60 C ATOM 1485 CD1 LEU A 198 26.991 20.097 13.523 1.00 59.63 C ATOM 1486 CD2 LEU A 198 24.641 19.950 14.363 1.00 46.50 C ATOM 0 H LEU A 198 28.308 21.618 15.375 1.00 49.31 H new ATOM 0 HA LEU A 198 27.196 23.081 13.566 1.00 56.06 H new ATOM 0 HB2 LEU A 198 26.121 21.591 15.682 1.00 47.79 H new ATOM 0 HB3 LEU A 198 25.154 22.521 14.887 1.00 47.79 H new ATOM 0 HG LEU A 198 25.413 21.250 12.965 1.00 49.60 H new ATOM 0 HD11 LEU A 198 26.808 19.391 12.883 1.00 59.63 H new ATOM 0 HD12 LEU A 198 27.659 20.698 13.158 1.00 59.63 H new ATOM 0 HD13 LEU A 198 27.323 19.708 14.347 1.00 59.63 H new ATOM 0 HD21 LEU A 198 24.471 19.232 13.733 1.00 46.50 H new ATOM 0 HD22 LEU A 198 24.942 19.576 15.206 1.00 46.50 H new ATOM 0 HD23 LEU A 198 23.825 20.454 14.506 1.00 46.50 H new ATOM 1487 N GLU A 199 27.399 24.478 16.378 1.00 66.88 N ATOM 1488 CA GLU A 199 27.227 25.724 17.107 1.00 79.17 C ATOM 1489 C GLU A 199 28.068 26.842 16.503 1.00 84.83 C ATOM 1490 O GLU A 199 27.719 28.013 16.617 1.00 87.91 O ATOM 1491 CB GLU A 199 27.609 25.533 18.576 1.00 85.71 C ATOM 1492 CG GLU A 199 26.533 24.869 19.416 1.00 91.18 C ATOM 1493 CD GLU A 199 26.964 24.664 20.855 1.00 95.31 C ATOM 1494 OE1 GLU A 199 27.550 25.600 21.438 1.00 95.37 O ATOM 1495 OE2 GLU A 199 26.709 23.572 21.404 1.00 97.62 O ATOM 0 H GLU A 199 27.872 23.888 16.787 1.00 66.88 H new ATOM 0 HA GLU A 199 26.292 25.976 17.044 1.00 79.17 H new ATOM 0 HB2 GLU A 199 28.418 24.999 18.623 1.00 85.71 H new ATOM 0 HB3 GLU A 199 27.818 26.399 18.961 1.00 85.71 H new ATOM 0 HG2 GLU A 199 25.730 25.413 19.396 1.00 91.18 H new ATOM 0 HG3 GLU A 199 26.305 24.011 19.025 1.00 91.18 H new ATOM 1496 N GLU A 200 29.171 26.477 15.857 1.00 86.60 N ATOM 1497 CA GLU A 200 30.065 27.457 15.246 1.00 86.45 C ATOM 1498 C GLU A 200 29.568 28.059 13.935 1.00 88.95 C ATOM 1499 O GLU A 200 29.483 29.278 13.795 1.00 91.56 O ATOM 1500 CB GLU A 200 31.444 26.837 15.001 1.00 85.41 C ATOM 1501 CG GLU A 200 32.388 26.887 16.189 1.00 85.98 C ATOM 1502 CD GLU A 200 33.772 26.372 15.842 1.00 85.40 C ATOM 1503 OE1 GLU A 200 34.335 26.826 14.824 1.00 89.16 O ATOM 1504 OE2 GLU A 200 34.299 25.520 16.587 1.00 82.48 O ATOM 0 H GLU A 200 29.422 25.660 15.760 1.00 86.60 H new ATOM 0 HA GLU A 200 30.105 28.184 15.887 1.00 86.45 H new ATOM 0 HB2 GLU A 200 31.326 25.911 14.737 1.00 85.41 H new ATOM 0 HB3 GLU A 200 31.861 27.293 14.254 1.00 85.41 H new ATOM 0 HG2 GLU A 200 32.455 27.800 16.509 1.00 85.98 H new ATOM 0 HG3 GLU A 200 32.020 26.359 16.915 1.00 85.98 H new ATOM 1505 N TYR A 201 29.240 27.202 12.977 1.00 91.09 N ATOM 1506 CA TYR A 201 28.803 27.658 11.664 1.00 94.06 C ATOM 1507 C TYR A 201 27.350 28.119 11.555 1.00 96.66 C ATOM 1508 O TYR A 201 26.981 28.780 10.583 1.00 97.35 O ATOM 1509 CB TYR A 201 29.085 26.563 10.631 1.00 92.13 C ATOM 1510 CG TYR A 201 30.470 25.966 10.768 1.00 92.20 C ATOM 1511 CD1 TYR A 201 30.718 24.934 11.674 1.00 91.96 C ATOM 1512 CD2 TYR A 201 31.542 26.460 10.026 1.00 92.43 C ATOM 1513 CE1 TYR A 201 32.001 24.408 11.838 1.00 89.43 C ATOM 1514 CE2 TYR A 201 32.829 25.943 10.184 1.00 86.90 C ATOM 1515 CZ TYR A 201 33.051 24.918 11.091 1.00 88.18 C ATOM 1516 OH TYR A 201 34.319 24.405 11.251 1.00 83.73 O ATOM 0 H TYR A 201 29.264 26.347 13.067 1.00 91.09 H new ATOM 0 HA TYR A 201 29.319 28.461 11.492 1.00 94.06 H new ATOM 0 HB2 TYR A 201 28.424 25.859 10.724 1.00 92.13 H new ATOM 0 HB3 TYR A 201 28.984 26.932 9.740 1.00 92.13 H new ATOM 0 HD1 TYR A 201 30.016 24.590 12.178 1.00 91.96 H new ATOM 0 HD2 TYR A 201 31.397 27.146 9.415 1.00 92.43 H new ATOM 0 HE1 TYR A 201 32.150 23.719 12.445 1.00 89.43 H new ATOM 0 HE2 TYR A 201 33.534 26.285 9.683 1.00 86.90 H new ATOM 0 HH TYR A 201 34.850 24.805 10.738 1.00 83.73 H new ATOM 1517 N ALA A 202 26.527 27.780 12.541 1.00 98.49 N ATOM 1518 CA ALA A 202 25.122 28.178 12.515 1.00103.08 C ATOM 1519 C ALA A 202 24.951 29.597 13.051 1.00106.09 C ATOM 1520 O ALA A 202 23.830 30.064 13.254 1.00109.69 O ATOM 1521 CB ALA A 202 24.287 27.203 13.337 1.00103.10 C ATOM 0 H ALA A 202 26.759 27.322 13.231 1.00 98.49 H new ATOM 0 HA ALA A 202 24.816 28.160 11.595 1.00103.08 H new ATOM 0 HB1 ALA A 202 23.356 27.475 13.314 1.00103.10 H new ATOM 0 HB2 ALA A 202 24.372 26.311 12.966 1.00103.10 H new ATOM 0 HB3 ALA A 202 24.601 27.202 14.255 1.00103.10 H new ATOM 1522 N GLN A 203 26.071 30.278 13.270 1.00109.43 N ATOM 1523 CA GLN A 203 26.062 31.641 13.793 1.00112.24 C ATOM 1524 C GLN A 203 26.246 32.649 12.666 1.00112.12 C ATOM 1525 O GLN A 203 25.524 33.643 12.588 1.00112.48 O ATOM 1526 CB GLN A 203 27.197 31.814 14.801 1.00116.55 C ATOM 1527 CG GLN A 203 27.438 30.596 15.667 1.00122.77 C ATOM 1528 CD GLN A 203 28.744 30.677 16.433 1.00125.71 C ATOM 1529 OE1 GLN A 203 29.799 30.942 15.856 1.00126.45 O ATOM 1530 NE2 GLN A 203 28.682 30.437 17.738 1.00124.85 N ATOM 0 H GLN A 203 26.857 29.964 13.120 1.00109.43 H new ATOM 0 HA GLN A 203 25.207 31.797 14.224 1.00112.24 H new ATOM 0 HB2 GLN A 203 28.013 32.026 14.322 1.00116.55 H new ATOM 0 HB3 GLN A 203 26.998 32.572 15.372 1.00116.55 H new ATOM 0 HG2 GLN A 203 26.704 30.498 16.294 1.00122.77 H new ATOM 0 HG3 GLN A 203 27.442 29.802 15.110 1.00122.77 H new ATOM 0 HE21 GLN A 203 27.926 30.255 18.106 1.00124.85 H new ATOM 0 HE22 GLN A 203 29.397 30.463 18.215 1.00124.85 H new ATOM 1531 N GLU A 204 27.230 32.380 11.811 1.00111.41 N ATOM 1532 CA GLU A 204 27.560 33.231 10.670 1.00112.57 C ATOM 1533 C GLU A 204 26.466 34.224 10.292 1.00114.92 C ATOM 1534 O GLU A 204 26.750 35.442 10.317 1.00117.40 O ATOM 1535 CB GLU A 204 27.899 32.360 9.459 1.00111.37 C ATOM 1536 CG GLU A 204 29.252 31.669 9.549 1.00113.07 C ATOM 1537 CD GLU A 204 29.474 30.671 8.429 1.00114.71 C ATOM 1538 OE1 GLU A 204 29.088 30.970 7.280 1.00113.92 O ATOM 1539 OE2 GLU A 204 30.044 29.591 8.696 1.00115.16 O ATOM 0 H GLU A 204 27.733 31.686 11.879 1.00111.41 H new ATOM 0 HA GLU A 204 28.325 33.761 10.944 1.00112.57 H new ATOM 0 HB2 GLU A 204 27.209 31.686 9.354 1.00111.37 H new ATOM 0 HB3 GLU A 204 27.881 32.911 8.661 1.00111.37 H new ATOM 0 HG2 GLU A 204 29.955 32.337 9.526 1.00113.07 H new ATOM 0 HG3 GLU A 204 29.322 31.213 10.402 1.00113.07 H new TER 1540 GLU A 204 HETATM 1541 O HOH A 214 41.461 10.448 12.873 1.00 24.07 O HETATM 1542 O HOH A 215 39.713 0.611 13.008 1.00 22.73 O HETATM 1543 O HOH A 216 27.394 8.045 -0.104 1.00 29.02 O HETATM 1544 O HOH A 217 38.978 7.260 10.126 1.00 24.71 O HETATM 1545 O HOH A 218 46.966 13.228 -11.714 1.00 39.89 O HETATM 1546 O HOH A 219 34.757 25.616 1.884 1.00 27.87 O HETATM 1547 O HOH A 220 41.071 13.490 -9.136 1.00 24.08 O HETATM 1548 O HOH A 221 44.015 3.094 2.593 1.00 39.05 O HETATM 1549 O HOH A 222 35.382 28.176 0.633 1.00 29.35 O HETATM 1550 O HOH A 223 33.168 26.400 4.256 1.00 31.58 O HETATM 1551 O HOH A 224 49.264 19.962 -2.100 1.00 32.37 O HETATM 1552 O HOH A 225 26.016 13.929 7.803 1.00 25.71 O HETATM 1553 O HOH A 226 24.154 21.881 -2.610 1.00 32.66 O HETATM 1554 O HOH A 227 37.602 4.766 -6.772 1.00 42.18 O HETATM 1555 O HOH A 228 54.406 18.297 -7.629 1.00 30.72 O HETATM 1556 O HOH A 229 46.698 21.600 8.372 1.00 34.57 O HETATM 1557 O HOH A 230 40.386 6.222 7.864 1.00 17.84 O HETATM 1558 O HOH A 231 27.746 11.387 -6.126 1.00 36.54 O HETATM 1559 O HOH A 232 29.020 24.054 6.392 1.00 36.06 O HETATM 1560 O HOH A 233 23.242 -2.005 19.593 1.00 50.26 O HETATM 1561 O HOH A 234 33.404 32.060 -4.543 1.00 30.37 O HETATM 1562 O HOH A 235 42.776 6.401 6.515 1.00 23.24 O HETATM 1563 O HOH A 236 46.364 17.585 -9.927 1.00 35.57 O HETATM 1564 O HOH A 237 21.116 18.359 11.786 1.00 55.06 O HETATM 1565 O HOH A 238 39.445 8.421 12.685 1.00 22.54 O HETATM 1566 O HOH A 239 45.560 6.429 7.112 1.00 25.45 O HETATM 1567 O HOH A 240 23.334 17.523 -4.812 1.00 35.68 O HETATM 1568 O HOH A 241 26.307 22.965 5.548 1.00 34.07 O HETATM 1569 O HOH A 242 44.178 23.678 1.366 1.00 32.51 O HETATM 1570 O HOH A 243 26.665 27.216 -0.497 1.00 32.16 O HETATM 1571 O HOH A 244 39.923 10.720 -9.134 1.00 38.24 O HETATM 1572 O HOH A 245 39.774 6.075 -8.332 1.00 35.32 O HETATM 1573 O HOH A 246 25.468 22.563 -11.348 1.00 40.04 O HETATM 1574 O HOH A 247 21.932 14.900 -2.383 1.00 54.99 O HETATM 1575 O HOH A 248 47.760 13.483 8.675 1.00 30.32 O HETATM 1576 O HOH A 249 42.494 1.474 13.714 1.00 32.16 O HETATM 1577 O HOH A 250 42.762 8.420 -1.889 1.00 30.47 O HETATM 1578 O HOH A 251 34.446 19.698 19.030 1.00 42.72 O HETATM 1579 O HOH A 252 50.402 14.197 10.250 1.00 42.43 O HETATM 1580 O HOH A 253 37.926 28.122 -0.924 1.00 43.90 O HETATM 1581 O HOH A 254 43.275 3.457 -3.486 1.00 57.62 O HETATM 1582 O HOH A 255 24.633 9.647 0.435 1.00 44.43 O HETATM 1583 O HOH A 256 49.139 15.192 6.117 1.00 35.91 O HETATM 1584 O HOH A 257 49.015 7.536 -8.217 1.00 39.73 O HETATM 1585 O HOH A 258 40.994 20.543 11.950 1.00 53.05 O HETATM 1586 O HOH A 259 22.040 3.879 18.480 1.00 69.25 O HETATM 1587 O HOH A 260 24.303 12.624 0.982 1.00 49.09 O HETATM 1588 O HOH A 261 41.199 0.660 4.075 1.00 46.01 O HETATM 1589 O HOH A 262 40.042 -1.903 5.105 1.00 43.78 O HETATM 1590 O HOH A 263 35.853 25.130 8.402 1.00 44.42 O HETATM 1591 O HOH A 264 45.528 -1.955 18.224 1.00 46.77 O HETATM 1592 O HOH A 265 24.958 7.589 8.697 1.00 32.56 O HETATM 1593 O HOH A 266 44.459 1.182 -1.648 1.00 55.82 O HETATM 1594 O HOH A 267 26.725 4.905 20.203 1.00 30.60 O HETATM 1595 O HOH A 268 41.410 3.138 5.862 1.00 29.16 O HETATM 1596 O HOH A 269 24.989 24.493 -3.779 1.00 47.88 O HETATM 1597 O HOH A 270 35.842 -0.803 -0.189 1.00 60.12 O HETATM 1598 O HOH A 271 36.186 24.506 18.299 1.00 64.27 O HETATM 1599 O HOH A 272 25.738 9.451 21.468 1.00 44.38 O HETATM 1600 O HOH A 273 40.668 1.787 -4.639 1.00 46.77 O HETATM 1601 O HOH A 274 46.141 4.366 4.295 1.00 60.45 O HETATM 1602 O HOH A 275 35.907 12.084 22.062 1.00 46.23 O HETATM 1603 O HOH A 276 26.307 6.248 1.877 1.00 53.57 O HETATM 1604 O HOH A 277 48.287 15.456 -10.330 1.00 45.69 O HETATM 1605 O HOH A 278 42.722 12.792 14.563 1.00 37.79 O HETATM 1606 O HOH A 279 24.909 28.216 -4.725 1.00 47.92 O HETATM 1607 O HOH A 280 24.656 8.834 3.734 1.00 47.45 O HETATM 1608 O HOH A 281 50.248 16.060 -12.762 1.00 56.16 O HETATM 1609 O HOH A 282 23.795 11.047 9.751 1.00 55.27 O HETATM 1610 O HOH A 283 24.228 26.828 -2.137 1.00 48.33 O HETATM 1611 O HOH A 284 23.385 5.785 2.441 1.00 57.99 O HETATM 1612 O HOH A 285 25.742 30.774 -3.081 1.00 49.95 O CONECT 178 183 CONECT 183 178 184 CONECT 184 183 185 187 CONECT 185 184 186 191 CONECT 186 185 CONECT 187 184 188 CONECT 188 187 189 CONECT 189 188 190 CONECT 190 189 CONECT 191 185 CONECT 367 374 CONECT 374 367 375 CONECT 375 374 376 378 CONECT 376 375 377 382 CONECT 377 376 CONECT 378 375 379 CONECT 379 378 380 CONECT 380 379 381 CONECT 381 380 CONECT 382 376 CONECT 979 988 CONECT 988 979 989 CONECT 989 988 990 992 CONECT 990 989 991 996 CONECT 991 990 CONECT 992 989 993 CONECT 993 992 994 CONECT 994 993 995 CONECT 995 994 CONECT 996 990 CONECT 998 1004 CONECT 1004 998 1005 CONECT 1005 1004 1006 1008 CONECT 1006 1005 1007 1012 CONECT 1007 1006 CONECT 1008 1005 1009 CONECT 1009 1008 1010 CONECT 1010 1009 1011 CONECT 1011 1010 CONECT 1012 1006 CONECT 1099 1101 CONECT 1101 1099 1102 CONECT 1102 1101 1103 1105 CONECT 1103 1102 1104 1109 CONECT 1104 1103 CONECT 1105 1102 1106 CONECT 1106 1105 1107 CONECT 1107 1106 1108 CONECT 1108 1107 CONECT 1109 1103 END