USER MOD reduce.3.24.130724 H: found=0, std=0, add=1781, rem=0, adj=53 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER FLUORESCENT PROTEIN 09-DEC-15 5F9G TITLE PNGFP1.5-Y.CRO: CIRCULARLY PERMUTED GREEN FLUORESCENT PROTEIN (WITH A TITLE 2 TYROSINE-DERIVED CHROMOPHORE) COMPND MOL_ID: 1; COMPND 2 MOLECULE: PNGFP1.5-Y.CRO,GREEN FLUORESCENT PROTEIN; COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: UNP RESIDUES 145-238, UNP RESIDUES 2-144; COMPND 5 SYNONYM: CIRCULARLY PERMUTED GREEN FLUORESCENT PROTEIN; COMPND 6 ENGINEERED: YES; COMPND 7 MUTATION: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: AEQUOREA VICTORIA; SOURCE 3 ORGANISM_COMMON: JELLYFISH; SOURCE 4 ORGANISM_TAXID: 6100; SOURCE 5 GENE: GFP; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS GREEN FLUORESCENT PROTEIN, CIRCULARLY PERMUTED, FLUORESCENT PROTEIN EXPDTA X-RAY DIFFRACTION AUTHOR S.J.REMINGTON REVDAT 1 03-FEB-16 5F9G 0 JRNL AUTH S.J.REMINGTON JRNL TITL PNGFP: CIRCULARLY PERMUTED GREEN FLUORESCENT PROTEIN JRNL REF TO BE PUBLISHED JRNL REFN REMARK 2 REMARK 2 RESOLUTION. 2.77 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PHENIX 1.9_1692 REMARK 3 AUTHORS : PAUL ADAMS,PAVEL AFONINE,VINCENT CHEN,IAN REMARK 3 : DAVIS,KRESHNA GOPAL,RALF GROSSE-KUNSTLEVE, REMARK 3 : LI-WEI HUNG,ROBERT IMMORMINO,TOM IOERGER, REMARK 3 : AIRLIE MCCOY,ERIK MCKEE,NIGEL MORIARTY, REMARK 3 : REETAL PAI,RANDY READ,JANE RICHARDSON, REMARK 3 : DAVID RICHARDSON,TOD ROMO,JIM SACCHETTINI, REMARK 3 : NICHOLAS SAUTER,JACOB SMITH,LAURENT REMARK 3 : STORONI,TOM TERWILLIGER,PETER ZWART REMARK 3 REMARK 3 REFINEMENT TARGET : NULL REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.77 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 24.68 REMARK 3 MIN(FOBS/SIGMA_FOBS) : 1.340 REMARK 3 COMPLETENESS FOR RANGE (%) : 97.9 REMARK 3 NUMBER OF REFLECTIONS : 8260 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 R VALUE (WORKING + TEST SET) : 0.208 REMARK 3 R VALUE (WORKING SET) : 0.203 REMARK 3 FREE R VALUE : 0.295 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.960 REMARK 3 FREE R VALUE TEST SET COUNT : 410 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT (IN BINS). REMARK 3 BIN RESOLUTION RANGE COMPL. NWORK NFREE RWORK RFREE REMARK 3 1 24.6831 - 3.9939 0.99 2775 154 0.1765 0.2709 REMARK 3 2 3.9939 - 3.1722 0.98 2582 128 0.2443 0.3340 REMARK 3 3 3.1722 - 2.7719 0.96 2493 128 0.2477 0.3395 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : NULL REMARK 3 SOLVENT RADIUS : 1.11 REMARK 3 SHRINKAGE RADIUS : 0.90 REMARK 3 K_SOL : NULL REMARK 3 B_SOL : NULL REMARK 3 REMARK 3 ERROR ESTIMATES. REMARK 3 COORDINATE ERROR (MAXIMUM-LIKELIHOOD BASED) : 0.410 REMARK 3 PHASE ERROR (DEGREES, MAXIMUM-LIKELIHOOD BASED) : 32.160 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL 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 TWINNING INFORMATION. REMARK 3 FRACTION: NULL REMARK 3 OPERATOR: NULL REMARK 3 REMARK 3 DEVIATIONS FROM IDEAL VALUES. REMARK 3 RMSD COUNT REMARK 3 BOND : 0.010 1880 REMARK 3 ANGLE : 1.442 2537 REMARK 3 CHIRALITY : 0.049 274 REMARK 3 PLANARITY : 0.007 331 REMARK 3 DIHEDRAL : 17.380 687 REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : NULL REMARK 3 REMARK 3 NCS DETAILS REMARK 3 NUMBER OF NCS GROUPS : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 5F9G COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 10-DEC-15. REMARK 100 THE DEPOSITION ID IS D_1000214191. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 29-MAR-14 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 8.0 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : ALS REMARK 200 BEAMLINE : 5.0.1 REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 0.987 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : CRYO:24% PEG 3350, .25M KSCN, REMARK 200 .15M NACL, 50MM HEPES 7.5 PLUS REMARK 200 EITHER 20% ETHYLENE GLYCOL OR 60% REMARK 200 ETHYLENE GLYCOL AND .8M NDSB-201 REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : ADSC QUANTUM 315 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 14821 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.750 REMARK 200 RESOLUTION RANGE LOW (A) : 40.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.8 REMARK 200 DATA REDUNDANCY : 24.70 REMARK 200 R MERGE (I) : 0.08900 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 80.4000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.75 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.80 REMARK 200 COMPLETENESS FOR SHELL (%) : 100.0 REMARK 200 DATA REDUNDANCY IN SHELL : 27.10 REMARK 200 R MERGE FOR SHELL (I) : 0.92000 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 8.000 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHENIX REMARK 200 STARTING MODEL: 1EMB REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 53.14 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.62 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PNGFP1.5-Y.CRO IN BUFFER 50MM HEPES PH REMARK 280 7.5, 0.3M NACL, 1MM BETA-MERCAPTOETHANOL, A280=52; CRYSTALS WERE REMARK 280 GROWN IN DROPS OF 1UL PROTEIN SOLUTION: 1UL WELL SOLUTION REMARK 280 CONTAINING 20-22% PEG 3350, 0.25M POTASSIUM THIOCYANATE, 0.1M REMARK 280 TRIS PH 8.0, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 295K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 43 21 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -Y+1/2,X+1/2,Z+3/4 REMARK 290 4555 Y+1/2,-X+1/2,Z+1/4 REMARK 290 5555 -X+1/2,Y+1/2,-Z+3/4 REMARK 290 6555 X+1/2,-Y+1/2,-Z+1/4 REMARK 290 7555 Y,X,-Z REMARK 290 8555 -Y,-X,-Z+1/2 REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 92.69600 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 28.62900 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 28.62900 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 139.04400 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 28.62900 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 28.62900 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 46.34800 REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 28.62900 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 28.62900 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 139.04400 REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 28.62900 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 28.62900 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 46.34800 REMARK 290 SMTRY1 7 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 7 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 92.69600 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 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 MET A 1 REMARK 465 GLY A 2 REMARK 465 THR A 91 REMARK 465 LEU A 92 REMARK 465 GLY A 93 REMARK 465 MET A 94 REMARK 465 ASP A 95 REMARK 465 GLU A 96 REMARK 465 LEU A 97 REMARK 465 HIS A 98 REMARK 465 LYS A 99 REMARK 465 VAL A 100 REMARK 465 ASP A 101 REMARK 465 GLY A 102 REMARK 465 GLY A 103 REMARK 465 SER A 104 REMARK 465 GLY A 105 REMARK 465 GLY A 106 REMARK 465 THR A 107 REMARK 465 GLY A 108 REMARK 465 VAL A 109 REMARK 465 SER A 251 REMARK 465 HIS A 252 REMARK 465 HIS A 253 REMARK 465 HIS A 254 REMARK 465 HIS A 255 REMARK 465 HIS A 256 REMARK 465 HIS A 257 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 LYS A 23 CD CE NZ REMARK 470 ILE A 90 CG1 CG2 CD1 REMARK 470 SER A 110 OG REMARK 470 CRO A 173 CG1 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 O HOH A 314 O HOH A 316 2.17 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 SER A 36 -168.27 -78.78 REMARK 500 LEU A 55 96.50 -68.48 REMARK 500 ASN A 59 104.54 -56.93 REMARK 500 ASN A 73 -71.36 -64.47 REMARK 500 GLU A 74 128.05 -38.10 REMARK 500 LYS A 111 71.05 -153.18 REMARK 500 GLU A 113 -3.56 -59.74 REMARK 500 PHE A 116 41.93 -82.87 REMARK 500 LYS A 185 -19.54 -44.51 REMARK 500 ASP A 209 -155.44 -160.30 REMARK 500 GLU A 238 33.71 -63.59 REMARK 500 ASP A 239 -9.82 -167.46 REMARK 500 HIS A 245 58.54 33.60 REMARK 500 REMARK 500 REMARK: NULL DBREF 5F9G A 6 99 UNP P42212 GFP_AEQVI 145 238 DBREF 5F9G A 110 250 UNP P42212 GFP_AEQVI 2 144 SEQADV 5F9G MET A 1 UNP P42212 INITIATING METHIONINE SEQADV 5F9G GLY A 2 UNP P42212 EXPRESSION TAG SEQADV 5F9G SER A 3 UNP P42212 EXPRESSION TAG SEQADV 5F9G SER A 4 UNP P42212 EXPRESSION TAG SEQADV 5F9G LEU A 5 UNP P42212 EXPRESSION TAG SEQADV 5F9G LYS A 10 UNP P42212 ASN 149 CONFLICT SEQADV 5F9G THR A 14 UNP P42212 MET 153 CONFLICT SEQADV 5F9G ALA A 24 UNP P42212 VAL 163 CONFLICT SEQADV 5F9G GLN A 27 UNP P42212 LYS 166 CONFLICT SEQADV 5F9G VAL A 32 UNP P42212 ILE 171 CONFLICT SEQADV 5F9G VAL A 67 UNP P42212 ALA 206 CONFLICT SEQADV 5F9G LEU A 92 UNP P42212 HIS 231 CONFLICT SEQADV 5F9G HIS A 98 UNP P42212 TYR 237 CONFLICT SEQADV 5F9G VAL A 100 UNP P42212 LINKER SEQADV 5F9G ASP A 101 UNP P42212 LINKER SEQADV 5F9G GLY A 102 UNP P42212 LINKER SEQADV 5F9G GLY A 103 UNP P42212 LINKER SEQADV 5F9G SER A 104 UNP P42212 LINKER SEQADV 5F9G GLY A 105 UNP P42212 LINKER SEQADV 5F9G GLY A 106 UNP P42212 LINKER SEQADV 5F9G THR A 107 UNP P42212 LINKER SEQADV 5F9G GLY A 108 UNP P42212 LINKER SEQADV 5F9G VAL A 109 UNP P42212 LINKER SEQADV 5F9G ARG A 136 UNP P42212 SER 28 CONFLICT SEQADV 5F9G ARG A 138 UNP P42212 SER 30 CONFLICT SEQADV 5F9G ASN A 147 UNP P42212 TYR 39 CONFLICT SEQADV 5F9G LEU A 172 UNP P42212 PHE 64 CONFLICT SEQADV 5F9G CRO A 173 UNP P42212 SER 65 CHROMOPHORE SEQADV 5F9G CRO A 173 UNP P42212 TYR 66 CHROMOPHORE SEQADV 5F9G CRO A 173 UNP P42212 GLY 67 CHROMOPHORE SEQADV 5F9G THR A 211 UNP P42212 ASN 105 CONFLICT SEQADV 5F9G SER A 251 UNP P42212 EXPRESSION TAG SEQADV 5F9G HIS A 252 UNP P42212 EXPRESSION TAG SEQADV 5F9G HIS A 253 UNP P42212 EXPRESSION TAG SEQADV 5F9G HIS A 254 UNP P42212 EXPRESSION TAG SEQADV 5F9G HIS A 255 UNP P42212 EXPRESSION TAG SEQADV 5F9G HIS A 256 UNP P42212 EXPRESSION TAG SEQADV 5F9G HIS A 257 UNP P42212 EXPRESSION TAG SEQRES 1 A 257 MET GLY SER SER LEU TYR ASN SER HIS LYS VAL TYR ILE SEQRES 2 A 257 THR ALA ASP LYS GLN LYS ASN GLY ILE LYS ALA ASN PHE SEQRES 3 A 257 GLN ILE ARG HIS ASN VAL GLU ASP GLY SER VAL GLN LEU SEQRES 4 A 257 ALA ASP HIS TYR GLN GLN ASN THR PRO ILE GLY ASP GLY SEQRES 5 A 257 PRO VAL LEU LEU PRO ASP ASN HIS TYR LEU SER THR GLN SEQRES 6 A 257 SER VAL LEU SER LYS ASP PRO ASN GLU LYS ARG ASP HIS SEQRES 7 A 257 MET VAL LEU LEU GLU PHE VAL THR ALA ALA GLY ILE THR SEQRES 8 A 257 LEU GLY MET ASP GLU LEU HIS LYS VAL ASP GLY GLY SER SEQRES 9 A 257 GLY GLY THR GLY VAL SER LYS GLY GLU GLU LEU PHE THR SEQRES 10 A 257 GLY VAL VAL PRO ILE LEU VAL GLU LEU ASP GLY ASP VAL SEQRES 11 A 257 ASN GLY HIS LYS PHE ARG VAL ARG GLY GLU GLY GLU GLY SEQRES 12 A 257 ASP ALA THR ASN GLY LYS LEU THR LEU LYS PHE ILE CYS SEQRES 13 A 257 THR THR GLY LYS LEU PRO VAL PRO TRP PRO THR LEU VAL SEQRES 14 A 257 THR THR LEU CRO VAL GLN CYS PHE SER ARG TYR PRO ASP SEQRES 15 A 257 HIS MET LYS GLN HIS ASP PHE PHE LYS SER ALA MET PRO SEQRES 16 A 257 GLU GLY TYR VAL GLN GLU ARG THR ILE PHE PHE LYS ASP SEQRES 17 A 257 ASP GLY THR TYR LYS THR ARG ALA GLU VAL LYS PHE GLU SEQRES 18 A 257 GLY ASP THR LEU VAL ASN ARG ILE GLU LEU LYS GLY ILE SEQRES 19 A 257 ASP PHE LYS GLU ASP GLY ASN ILE LEU GLY HIS LYS LEU SEQRES 20 A 257 GLU TYR ASN SER HIS HIS HIS HIS HIS HIS MODRES 5F9G CRO A 173 GLY CHROMOPHORE HET CRO A 173 21 HETNAM CRO {2-[(1R,2R)-1-AMINO-2-HYDROXYPROPYL]-4-(4- HETNAM 2 CRO HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-1H-IMIDAZOL-1- HETNAM 3 CRO YL}ACETIC ACID HETSYN CRO PEPTIDE DERIVED CHROMOPHORE FORMUL 1 CRO C15 H17 N3 O5 FORMUL 2 HOH *16(H2 O) HELIX 1 AA1 PRO A 164 VAL A 169 5 6 HELIX 2 AA2 VAL A 174 SER A 178 5 5 HELIX 3 AA3 PRO A 181 HIS A 187 5 7 HELIX 4 AA4 ASP A 188 ALA A 193 1 6 SHEET 1 AA112 HIS A 9 ASP A 16 0 SHEET 2 AA112 GLY A 21 ASN A 31 -1 O GLY A 21 N ASP A 16 SHEET 3 AA112 VAL A 37 PRO A 48 -1 O HIS A 42 N PHE A 26 SHEET 4 AA112 TYR A 198 PHE A 206 -1 O GLU A 201 N GLN A 45 SHEET 5 AA112 THR A 211 GLU A 221 -1 O ALA A 216 N GLN A 200 SHEET 6 AA112 THR A 224 ILE A 234 -1 O GLU A 230 N ARG A 215 SHEET 7 AA112 VAL A 120 VAL A 130 1 N LEU A 123 O LEU A 225 SHEET 8 AA112 HIS A 133 ASP A 144 -1 O GLY A 139 N VAL A 124 SHEET 9 AA112 LYS A 149 ILE A 155 -1 O ILE A 155 N ARG A 138 SHEET 10 AA112 HIS A 78 ALA A 88 -1 N MET A 79 O PHE A 154 SHEET 11 AA112 HIS A 60 SER A 69 -1 N SER A 69 O VAL A 80 SHEET 12 AA112 HIS A 9 ASP A 16 -1 N VAL A 11 O LEU A 62 LINK C LEU A 172 N1 CRO A 173 1555 1555 1.44 LINK O2 CRO A 173 NH2 ARG A 202 1555 1555 1.35 LINK C3 CRO A 173 N VAL A 174 1555 1555 1.44 CISPEP 1 MET A 194 PRO A 195 0 3.48 CRYST1 57.258 57.258 185.392 90.00 90.00 90.00 P 43 21 2 8 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.017465 0.000000 0.000000 0.00000 SCALE2 0.000000 0.017465 0.000000 0.00000 SCALE3 0.000000 0.000000 0.005394 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 173 CROHN11 : A 173 CRO N1 : A 172 LEU C :(H bumps) USER MOD NoAdj-H: A 173 CRO HOH : A 173 CRO OH : A 173 CRO CZ :(short bond) USER MOD NoAdj-H: A 173 CRO H2 : A 173 CRO N1 : A 172 LEU C :(H bumps) USER MOD NoAdj-H: A 202 ARGHH22 : A 202 ARG NH2 : A 173 CRO O2 :(H bumps) USER MOD Set 1.1: A 70 LYS NZ :NH3+ -111:sc= -0.0558! (180deg=-2.19!) USER MOD Set 1.2: A 249 TYR OH : rot 150:sc= 0 USER MOD Set 2.1: A 186 GLN : amide:sc= -0.0634 X(o=-0.65,f=-0.62) USER MOD Set 2.2: A 187 HIS : no HD1:sc= -0.59 K(o=-0.65,f=-3.8!) USER MOD Set 3.1: A 176 CYS SG : rot -5:sc= -2.1! USER MOD Set 3.2: A 194 MET CE :methyl -128:sc= 0 (180deg=-1.27) USER MOD Set 4.1: A 167 THR OG1 : rot -64:sc= 0.815 USER MOD Set 4.2: A 212 TYR OH : rot 163:sc= 0.073 USER MOD Set 5.1: A 156 CYS SG : rot 36:sc= 0.0322 USER MOD Set 5.2: A 158 THR OG1 : rot 130:sc= 0 USER MOD Set 6.1: A 60 HIS : no HE2:sc= 1.63 K(o=3,f=-7.5!) USER MOD Set 6.2: A 180 TYR OH : rot -165:sc= 1.36 USER MOD Set 7.1: A 14 THR OG1 : rot 180:sc= 0 USER MOD Set 7.2: A 59 ASN : amide:sc=-0.00344 K(o=-0.0034,f=-1.2) USER MOD Set 8.1: A 44 GLN : amide:sc= 0.622 K(o=-0.35,f=-7.6!) USER MOD Set 8.2: A 46 ASN : amide:sc= -1.29! C(o=-0.35!,f=-10!) USER MOD Set 8.3: A 175 GLN : amide:sc= 0.128 K(o=-0.35,f=-5.9!) USER MOD Set 8.4: A 200 GLN : amide:sc= 0.19 K(o=-0.35,f=-7.8!) USER MOD Set 9.1: A 42 HIS : no HE2:sc= 0.782 K(o=1.6,f=-4.6) USER MOD Set 9.2: A 170 THR OG1 : rot 175:sc= 0.79 USER MOD Set10.1: A 38 GLN : amide:sc= 0.98 K(o=1.5,f=-1.1) USER MOD Set10.2: A 241 ASN : amide:sc= 0.507 K(o=1.5,f=-0.39) USER MOD Set11.1: A 8 SER OG : rot 180:sc= 0 USER MOD Set11.2: A 10 LYS NZ :NH3+ 152:sc= -0.254 (180deg=-1.11!) USER MOD Single : A 3 SER OG : rot 38:sc= 0.19 USER MOD Single : A 4 SER OG : rot 180:sc= -0.15 USER MOD Single : A 6 TYR OH : rot 180:sc= 0 USER MOD Single : A 7 ASN : amide:sc=-0.000352 K(o=-0.00035,f=-1) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=-0.0016) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 GLN : amide:sc= -0.193 X(o=-0.19,f=-0.4) USER MOD Single : A 19 LYS NZ :NH3+ -171:sc= -0.0037 (180deg=-0.0329) USER MOD Single : A 20 ASN : amide:sc= -1.12 K(o=-1.1,f=-2.8!) USER MOD Single : A 25 ASN : amide:sc= -0.521 X(o=-0.52,f=-0.51) USER MOD Single : A 27 GLN : amide:sc= -1.54! C(o=-1.5!,f=-3.8!) USER MOD Single : A 30 HIS : no HD1:sc= -0.223 X(o=-0.22,f=0) USER MOD Single : A 31 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 SER OG : rot 180:sc= -1.01 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -1.78 X(o=-1.8,f=-1.6) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc=-0.00389 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 SER OG : rot -77:sc= 0.645 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 73 ASN : amide:sc= -0.0985 X(o=-0.098,f=-0.015) USER MOD Single : A 75 LYS NZ :NH3+ 175:sc= 0.414 (180deg=0.397) USER MOD Single : A 78 HIS : no HE2:sc= 1.01 K(o=1,f=-6!) USER MOD Single : A 79 MET CE :methyl 142:sc= -0.181 (180deg=-0.393) USER MOD Single : A 86 THR OG1 : rot 16:sc= 0.424 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -99:sc= 0.18 USER MOD Single : A 131 ASN : amide:sc= -0.459 K(o=-0.46,f=-1.5) USER MOD Single : A 133 HIS : no HD1:sc= -0.079 X(o=-0.079,f=-0.5) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 THR OG1 : rot -60:sc= 0.751 USER MOD Single : A 147 ASN : amide:sc= -2.02! X(o=-2!,f=-1.9) USER MOD Single : A 149 LYS NZ :NH3+ -166:sc= 0.801 (180deg=0.784) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0 USER MOD Single : A 153 LYS NZ :NH3+ -105:sc= -0.0966 (180deg=-2.21!) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 171 THR OG1 : rot 180:sc=-0.00605 USER MOD Single : A 173 CRO OG1 : rot 180:sc= 0 USER MOD Single : A 178 SER OG : rot 77:sc= 1.08 USER MOD Single : A 183 HIS : no HD1:sc= -0.0584 K(o=-0.058,f=-1) USER MOD Single : A 184 MET CE :methyl 137:sc= -0.12 (180deg=-0.518) USER MOD Single : A 185 LYS NZ :NH3+ -138:sc= 0.724 (180deg=0.04) USER MOD Single : A 191 LYS NZ :NH3+ 151:sc= 2.26 (180deg=0.122!) USER MOD Single : A 192 SER OG : rot 30:sc= -0.436 USER MOD Single : A 198 TYR OH : rot 180:sc= 0 USER MOD Single : A 203 THR OG1 : rot 170:sc= -0.0798 USER MOD Single : A 207 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 211 THR OG1 : rot 180:sc= 0 USER MOD Single : A 213 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.00368) USER MOD Single : A 214 THR OG1 : rot 180:sc= 0 USER MOD Single : A 219 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 224 THR OG1 : rot 180:sc= 0 USER MOD Single : A 227 ASN : amide:sc= -2.44! C(o=-2.4!,f=-2.8!) USER MOD Single : A 232 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 237 LYS NZ :NH3+ 168:sc= 0.011 (180deg=0.00163) USER MOD Single : A 245 HIS : no HD1:sc= 0 X(o=0,f=-0.0025) USER MOD Single : A 246 LYS NZ :NH3+ -117:sc= 0.111 (180deg=0) USER MOD Single : A 250 ASN : amide:sc= -0.641 X(o=-0.64,f=-0.34) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 3 -12.620 -16.131 -2.437 1.00 94.43 N ATOM 2 CA SER A 3 -11.827 -15.009 -2.932 1.00 99.24 C ATOM 3 C SER A 3 -12.679 -14.007 -3.729 1.00 93.28 C ATOM 4 O SER A 3 -13.142 -14.315 -4.826 1.00 98.31 O ATOM 5 CB SER A 3 -10.643 -15.510 -3.791 1.00 99.88 C ATOM 6 OG SER A 3 -11.049 -16.285 -4.913 1.00 85.95 O ATOM 0 HA SER A 3 -11.477 -14.544 -2.156 1.00 99.24 H new ATOM 0 HB2 SER A 3 -10.131 -14.747 -4.101 1.00 99.88 H new ATOM 0 HB3 SER A 3 -10.051 -16.042 -3.236 1.00 99.88 H new ATOM 0 HG SER A 3 -11.753 -15.961 -5.238 1.00 85.95 H new ATOM 7 N SER A 4 -12.882 -12.818 -3.153 1.00 90.92 N ATOM 8 CA SER A 4 -13.509 -11.670 -3.825 1.00 82.49 C ATOM 9 C SER A 4 -12.467 -10.603 -4.142 1.00 75.97 C ATOM 10 O SER A 4 -11.428 -10.556 -3.499 1.00 84.72 O ATOM 11 CB SER A 4 -14.608 -11.059 -2.957 1.00 87.21 C ATOM 12 OG SER A 4 -14.820 -9.693 -3.302 1.00 89.40 O ATOM 0 H SER A 4 -12.654 -12.651 -2.341 1.00 90.92 H new ATOM 0 HA SER A 4 -13.903 -11.992 -4.650 1.00 82.49 H new ATOM 0 HB2 SER A 4 -15.432 -11.558 -3.071 1.00 87.21 H new ATOM 0 HB3 SER A 4 -14.363 -11.127 -2.021 1.00 87.21 H new ATOM 0 HG SER A 4 -15.427 -9.372 -2.818 1.00 89.40 H new ATOM 13 N LEU A 5 -12.740 -9.735 -5.111 1.00 75.21 N ATOM 14 CA LEU A 5 -11.733 -8.768 -5.544 1.00 72.47 C ATOM 15 C LEU A 5 -11.665 -7.544 -4.619 1.00 67.39 C ATOM 16 O LEU A 5 -10.574 -7.159 -4.184 1.00 63.44 O ATOM 17 CB LEU A 5 -11.988 -8.335 -6.989 1.00 69.61 C ATOM 18 CG LEU A 5 -10.886 -7.451 -7.588 1.00 62.95 C ATOM 19 CD1 LEU A 5 -9.563 -8.183 -7.601 1.00 57.31 C ATOM 20 CD2 LEU A 5 -11.264 -6.993 -8.981 1.00 63.27 C ATOM 0 H LEU A 5 -13.491 -9.688 -5.527 1.00 75.21 H new ATOM 0 HA LEU A 5 -10.872 -9.212 -5.495 1.00 72.47 H new ATOM 0 HB2 LEU A 5 -12.088 -9.127 -7.540 1.00 69.61 H new ATOM 0 HB3 LEU A 5 -12.830 -7.855 -7.028 1.00 69.61 H new ATOM 0 HG LEU A 5 -10.790 -6.664 -7.029 1.00 62.95 H new ATOM 0 HD11 LEU A 5 -8.880 -7.610 -7.982 1.00 57.31 H new ATOM 0 HD12 LEU A 5 -9.316 -8.421 -6.694 1.00 57.31 H new ATOM 0 HD13 LEU A 5 -9.644 -8.989 -8.135 1.00 57.31 H new ATOM 0 HD21 LEU A 5 -10.556 -6.437 -9.342 1.00 63.27 H new ATOM 0 HD22 LEU A 5 -11.390 -7.766 -9.553 1.00 63.27 H new ATOM 0 HD23 LEU A 5 -12.088 -6.482 -8.942 1.00 63.27 H new ATOM 21 N TYR A 6 -12.818 -6.934 -4.338 1.00 67.84 N ATOM 22 CA TYR A 6 -12.915 -5.869 -3.335 1.00 70.15 C ATOM 23 C TYR A 6 -13.367 -6.466 -2.012 1.00 77.37 C ATOM 24 O TYR A 6 -14.537 -6.827 -1.845 1.00 83.15 O ATOM 25 CB TYR A 6 -13.885 -4.760 -3.764 1.00 72.60 C ATOM 26 CG TYR A 6 -14.248 -3.826 -2.625 1.00 73.77 C ATOM 27 CD1 TYR A 6 -13.326 -2.907 -2.131 1.00 69.53 C ATOM 28 CD2 TYR A 6 -15.503 -3.877 -2.029 1.00 75.87 C ATOM 29 CE1 TYR A 6 -13.651 -2.058 -1.085 1.00 71.84 C ATOM 30 CE2 TYR A 6 -15.834 -3.037 -0.982 1.00 74.18 C ATOM 31 CZ TYR A 6 -14.909 -2.128 -0.513 1.00 73.57 C ATOM 32 OH TYR A 6 -15.236 -1.292 0.536 1.00 67.70 O ATOM 0 H TYR A 6 -13.564 -7.125 -4.722 1.00 67.84 H new ATOM 0 HA TYR A 6 -12.038 -5.466 -3.240 1.00 70.15 H new ATOM 0 HB2 TYR A 6 -13.485 -4.246 -4.483 1.00 72.60 H new ATOM 0 HB3 TYR A 6 -14.694 -5.162 -4.118 1.00 72.60 H new ATOM 0 HD1 TYR A 6 -12.478 -2.862 -2.509 1.00 69.53 H new ATOM 0 HD2 TYR A 6 -16.132 -4.488 -2.340 1.00 75.87 H new ATOM 0 HE1 TYR A 6 -13.027 -1.445 -0.769 1.00 71.84 H new ATOM 0 HE2 TYR A 6 -16.678 -3.085 -0.595 1.00 74.18 H new ATOM 0 HH TYR A 6 -16.025 -1.444 0.780 1.00 67.70 H new ATOM 33 N ASN A 7 -12.440 -6.561 -1.067 1.00 79.99 N ATOM 34 CA ASN A 7 -12.667 -7.367 0.125 1.00 81.74 C ATOM 35 C ASN A 7 -12.697 -6.571 1.432 1.00 78.66 C ATOM 36 O ASN A 7 -11.711 -6.525 2.171 1.00 74.57 O ATOM 37 CB ASN A 7 -11.595 -8.452 0.202 1.00 83.51 C ATOM 38 CG ASN A 7 -11.947 -9.547 1.186 1.00 92.22 C ATOM 39 OD1 ASN A 7 -13.097 -9.669 1.628 1.00 88.89 O ATOM 40 ND2 ASN A 7 -10.955 -10.361 1.530 1.00 88.14 N ATOM 0 H ASN A 7 -11.675 -6.168 -1.096 1.00 79.99 H new ATOM 0 HA ASN A 7 -13.553 -7.751 0.034 1.00 81.74 H new ATOM 0 HB2 ASN A 7 -11.469 -8.840 -0.678 1.00 83.51 H new ATOM 0 HB3 ASN A 7 -10.750 -8.050 0.459 1.00 83.51 H new ATOM 0 HD21 ASN A 7 -11.099 -11.005 2.081 1.00 88.14 H new ATOM 0 HD22 ASN A 7 -10.169 -10.244 1.201 1.00 88.14 H new ATOM 41 N SER A 8 -13.838 -5.955 1.716 1.00 82.59 N ATOM 42 CA SER A 8 -13.988 -5.183 2.942 1.00 83.40 C ATOM 43 C SER A 8 -14.534 -6.040 4.085 1.00 71.66 C ATOM 44 O SER A 8 -15.541 -6.732 3.939 1.00 71.56 O ATOM 45 CB SER A 8 -14.905 -3.971 2.712 1.00 83.69 C ATOM 46 OG SER A 8 -16.278 -4.336 2.747 1.00 87.70 O ATOM 0 H SER A 8 -14.536 -5.971 1.213 1.00 82.59 H new ATOM 0 HA SER A 8 -13.106 -4.870 3.195 1.00 83.40 H new ATOM 0 HB2 SER A 8 -14.731 -3.300 3.390 1.00 83.69 H new ATOM 0 HB3 SER A 8 -14.699 -3.567 1.854 1.00 83.69 H new ATOM 0 HG SER A 8 -16.753 -3.655 2.620 1.00 87.70 H new ATOM 47 N HIS A 9 -13.847 -5.992 5.220 1.00 75.88 N ATOM 48 CA HIS A 9 -14.376 -6.533 6.467 1.00 72.30 C ATOM 49 C HIS A 9 -14.950 -5.389 7.278 1.00 72.50 C ATOM 50 O HIS A 9 -14.266 -4.388 7.506 1.00 80.09 O ATOM 51 CB HIS A 9 -13.293 -7.256 7.260 1.00 69.65 C ATOM 52 CG HIS A 9 -13.144 -8.697 6.895 1.00 82.89 C ATOM 53 ND1 HIS A 9 -12.080 -9.173 6.158 1.00 81.65 N ATOM 54 CD2 HIS A 9 -13.934 -9.768 7.159 1.00 84.85 C ATOM 55 CE1 HIS A 9 -12.216 -10.478 5.995 1.00 87.81 C ATOM 56 NE2 HIS A 9 -13.330 -10.864 6.593 1.00 88.41 N ATOM 0 H HIS A 9 -13.063 -5.646 5.290 1.00 75.88 H new ATOM 0 HA HIS A 9 -15.068 -7.183 6.267 1.00 72.30 H new ATOM 0 HB2 HIS A 9 -12.445 -6.806 7.120 1.00 69.65 H new ATOM 0 HB3 HIS A 9 -13.497 -7.189 8.206 1.00 69.65 H new ATOM 0 HD2 HIS A 9 -14.734 -9.761 7.634 1.00 84.85 H new ATOM 0 HE1 HIS A 9 -11.626 -11.032 5.536 1.00 87.81 H new ATOM 0 HE2 HIS A 9 -13.628 -11.670 6.623 1.00 88.41 H new ATOM 57 N LYS A 10 -16.200 -5.519 7.707 1.00 67.71 N ATOM 58 CA LYS A 10 -16.830 -4.448 8.470 1.00 65.06 C ATOM 59 C LYS A 10 -16.786 -4.666 9.995 1.00 68.63 C ATOM 60 O LYS A 10 -17.310 -5.646 10.535 1.00 69.42 O ATOM 61 CB LYS A 10 -18.272 -4.261 8.006 1.00 75.83 C ATOM 62 CG LYS A 10 -18.392 -3.604 6.647 1.00 77.60 C ATOM 63 CD LYS A 10 -19.818 -3.199 6.347 1.00 74.62 C ATOM 64 CE LYS A 10 -19.925 -2.716 4.925 1.00 82.85 C ATOM 65 NZ LYS A 10 -19.299 -3.699 3.980 1.00 94.27 N ATOM 0 H LYS A 10 -16.695 -6.209 7.570 1.00 67.71 H new ATOM 0 HA LYS A 10 -16.314 -3.645 8.297 1.00 65.06 H new ATOM 0 HB2 LYS A 10 -18.709 -5.126 7.978 1.00 75.83 H new ATOM 0 HB3 LYS A 10 -18.747 -3.724 8.659 1.00 75.83 H new ATOM 0 HG2 LYS A 10 -17.819 -2.822 6.613 1.00 77.60 H new ATOM 0 HG3 LYS A 10 -18.078 -4.215 5.963 1.00 77.60 H new ATOM 0 HD2 LYS A 10 -20.413 -3.952 6.487 1.00 74.62 H new ATOM 0 HD3 LYS A 10 -20.099 -2.499 6.957 1.00 74.62 H new ATOM 0 HE2 LYS A 10 -20.858 -2.586 4.692 1.00 82.85 H new ATOM 0 HE3 LYS A 10 -19.488 -1.854 4.838 1.00 82.85 H new ATOM 0 HZ1 LYS A 10 -19.695 -3.640 3.185 1.00 94.27 H new ATOM 0 HZ2 LYS A 10 -18.432 -3.517 3.894 1.00 94.27 H new ATOM 0 HZ3 LYS A 10 -19.399 -4.523 4.300 1.00 94.27 H new ATOM 66 N VAL A 11 -16.152 -3.728 10.682 1.00 63.18 N ATOM 67 CA VAL A 11 -16.089 -3.760 12.127 1.00 69.89 C ATOM 68 C VAL A 11 -17.204 -2.889 12.711 1.00 67.61 C ATOM 69 O VAL A 11 -17.130 -1.665 12.668 1.00 64.63 O ATOM 70 CB VAL A 11 -14.709 -3.287 12.620 1.00 67.79 C ATOM 71 CG1 VAL A 11 -14.718 -3.067 14.118 1.00 66.70 C ATOM 72 CG2 VAL A 11 -13.652 -4.295 12.233 1.00 62.15 C ATOM 0 H VAL A 11 -15.749 -3.059 10.323 1.00 63.18 H new ATOM 0 HA VAL A 11 -16.215 -4.673 12.429 1.00 69.89 H new ATOM 0 HB VAL A 11 -14.502 -2.439 12.197 1.00 67.79 H new ATOM 0 HG11 VAL A 11 -13.841 -2.770 14.407 1.00 66.70 H new ATOM 0 HG12 VAL A 11 -15.378 -2.392 14.342 1.00 66.70 H new ATOM 0 HG13 VAL A 11 -14.941 -3.898 14.566 1.00 66.70 H new ATOM 0 HG21 VAL A 11 -12.785 -3.992 12.546 1.00 62.15 H new ATOM 0 HG22 VAL A 11 -13.859 -5.152 12.636 1.00 62.15 H new ATOM 0 HG23 VAL A 11 -13.632 -4.389 11.268 1.00 62.15 H new ATOM 73 N TYR A 12 -18.238 -3.532 13.246 1.00 67.86 N ATOM 74 CA TYR A 12 -19.403 -2.822 13.785 1.00 73.72 C ATOM 75 C TYR A 12 -19.197 -2.244 15.197 1.00 73.61 C ATOM 76 O TYR A 12 -19.017 -2.983 16.173 1.00 65.58 O ATOM 77 CB TYR A 12 -20.611 -3.755 13.767 1.00 63.61 C ATOM 78 CG TYR A 12 -20.969 -4.173 12.362 1.00 77.94 C ATOM 79 CD1 TYR A 12 -21.413 -3.236 11.436 1.00 81.08 C ATOM 80 CD2 TYR A 12 -20.845 -5.491 11.948 1.00 78.48 C ATOM 81 CE1 TYR A 12 -21.732 -3.597 10.142 1.00 72.10 C ATOM 82 CE2 TYR A 12 -21.168 -5.866 10.653 1.00 77.43 C ATOM 83 CZ TYR A 12 -21.611 -4.912 9.750 1.00 83.03 C ATOM 84 OH TYR A 12 -21.935 -5.265 8.449 1.00 89.44 O ATOM 0 H TYR A 12 -18.287 -4.388 13.308 1.00 67.86 H new ATOM 0 HA TYR A 12 -19.549 -2.054 13.211 1.00 73.72 H new ATOM 0 HB2 TYR A 12 -20.421 -4.542 14.301 1.00 63.61 H new ATOM 0 HB3 TYR A 12 -21.370 -3.311 14.177 1.00 63.61 H new ATOM 0 HD1 TYR A 12 -21.497 -2.346 11.694 1.00 81.08 H new ATOM 0 HD2 TYR A 12 -20.541 -6.133 12.548 1.00 78.48 H new ATOM 0 HE1 TYR A 12 -22.027 -2.955 9.538 1.00 72.10 H new ATOM 0 HE2 TYR A 12 -21.088 -6.755 10.391 1.00 77.43 H new ATOM 0 HH TYR A 12 -21.816 -6.090 8.344 1.00 89.44 H new ATOM 85 N ILE A 13 -19.243 -0.915 15.289 1.00 65.70 N ATOM 86 CA ILE A 13 -18.952 -0.203 16.532 1.00 73.67 C ATOM 87 C ILE A 13 -20.214 0.386 17.194 1.00 82.46 C ATOM 88 O ILE A 13 -20.867 1.258 16.625 1.00 87.01 O ATOM 89 CB ILE A 13 -17.923 0.955 16.291 1.00 70.08 C ATOM 90 CG1 ILE A 13 -16.692 0.455 15.526 1.00 71.81 C ATOM 91 CG2 ILE A 13 -17.496 1.577 17.597 1.00 68.95 C ATOM 92 CD1 ILE A 13 -15.497 1.415 15.531 1.00 63.69 C ATOM 0 H ILE A 13 -19.444 -0.400 14.630 1.00 65.70 H new ATOM 0 HA ILE A 13 -18.575 -0.865 17.132 1.00 73.67 H new ATOM 0 HB ILE A 13 -18.367 1.629 15.753 1.00 70.08 H new ATOM 0 HG12 ILE A 13 -16.412 -0.392 15.908 1.00 71.81 H new ATOM 0 HG13 ILE A 13 -16.947 0.281 14.606 1.00 71.81 H new ATOM 0 HG21 ILE A 13 -16.861 2.289 17.424 1.00 68.95 H new ATOM 0 HG22 ILE A 13 -18.272 1.940 18.052 1.00 68.95 H new ATOM 0 HG23 ILE A 13 -17.080 0.902 18.156 1.00 68.95 H new ATOM 0 HD11 ILE A 13 -14.766 1.024 15.028 1.00 63.69 H new ATOM 0 HD12 ILE A 13 -15.756 2.256 15.124 1.00 63.69 H new ATOM 0 HD13 ILE A 13 -15.212 1.573 16.445 1.00 63.69 H new ATOM 93 N THR A 14 -20.550 -0.097 18.390 1.00 78.61 N ATOM 94 CA THR A 14 -21.616 0.482 19.216 1.00 86.42 C ATOM 95 C THR A 14 -21.017 1.104 20.484 1.00 91.00 C ATOM 96 O THR A 14 -20.077 0.562 21.060 1.00 91.12 O ATOM 97 CB THR A 14 -22.699 -0.579 19.620 1.00 91.34 C ATOM 98 OG1 THR A 14 -23.627 -0.007 20.556 1.00 94.33 O ATOM 99 CG2 THR A 14 -22.061 -1.823 20.242 1.00 80.43 C ATOM 0 H THR A 14 -20.163 -0.776 18.750 1.00 78.61 H new ATOM 0 HA THR A 14 -22.053 1.164 18.682 1.00 86.42 H new ATOM 0 HB THR A 14 -23.165 -0.843 18.811 1.00 91.34 H new ATOM 0 HG1 THR A 14 -24.203 -0.581 20.766 1.00 94.33 H new ATOM 0 HG21 THR A 14 -22.755 -2.458 20.480 1.00 80.43 H new ATOM 0 HG22 THR A 14 -21.456 -2.231 19.603 1.00 80.43 H new ATOM 0 HG23 THR A 14 -21.567 -1.570 21.038 1.00 80.43 H new ATOM 100 N ALA A 15 -21.550 2.236 20.926 1.00 89.73 N ATOM 101 CA ALA A 15 -21.017 2.866 22.123 1.00 88.34 C ATOM 102 C ALA A 15 -21.447 2.103 23.383 1.00 99.29 C ATOM 103 O ALA A 15 -22.497 1.448 23.416 1.00 90.79 O ATOM 104 CB ALA A 15 -21.450 4.321 22.202 1.00 82.55 C ATOM 0 H ALA A 15 -22.208 2.648 20.555 1.00 89.73 H new ATOM 0 HA ALA A 15 -20.049 2.838 22.071 1.00 88.34 H new ATOM 0 HB1 ALA A 15 -21.086 4.724 23.006 1.00 82.55 H new ATOM 0 HB2 ALA A 15 -21.123 4.799 21.424 1.00 82.55 H new ATOM 0 HB3 ALA A 15 -22.418 4.370 22.227 1.00 82.55 H new ATOM 105 N ASP A 16 -20.603 2.178 24.408 1.00103.17 N ATOM 106 CA ASP A 16 -20.894 1.604 25.715 1.00108.26 C ATOM 107 C ASP A 16 -20.877 2.719 26.750 1.00109.50 C ATOM 108 O ASP A 16 -19.828 3.004 27.340 1.00106.46 O ATOM 109 CB ASP A 16 -19.871 0.524 26.083 1.00108.27 C ATOM 110 CG ASP A 16 -20.482 -0.627 26.865 1.00115.38 C ATOM 111 OD1 ASP A 16 -21.474 -1.223 26.381 1.00115.21 O ATOM 112 OD2 ASP A 16 -19.960 -0.937 27.960 1.00117.50 O ATOM 0 H ASP A 16 -19.838 2.568 24.362 1.00103.17 H new ATOM 0 HA ASP A 16 -21.768 1.184 25.692 1.00108.26 H new ATOM 0 HB2 ASP A 16 -19.466 0.179 25.272 1.00108.27 H new ATOM 0 HB3 ASP A 16 -19.160 0.924 26.608 1.00108.27 H new ATOM 113 N LYS A 17 -22.029 3.361 26.944 1.00109.01 N ATOM 114 CA LYS A 17 -22.165 4.433 27.927 1.00107.56 C ATOM 115 C LYS A 17 -21.661 3.953 29.286 1.00 98.26 C ATOM 116 O LYS A 17 -20.970 4.674 30.002 1.00 85.58 O ATOM 117 CB LYS A 17 -23.624 4.890 28.033 1.00104.47 C ATOM 118 CG LYS A 17 -24.302 5.220 26.707 1.00106.22 C ATOM 119 CD LYS A 17 -25.630 5.932 26.944 1.00106.08 C ATOM 120 CE LYS A 17 -25.441 7.105 27.910 1.00111.67 C ATOM 121 NZ LYS A 17 -26.726 7.730 28.331 1.00109.83 N ATOM 0 H LYS A 17 -22.751 3.187 26.510 1.00109.01 H new ATOM 0 HA LYS A 17 -21.631 5.190 27.638 1.00107.56 H new ATOM 0 HB2 LYS A 17 -24.134 4.194 28.476 1.00104.47 H new ATOM 0 HB3 LYS A 17 -23.661 5.674 28.602 1.00104.47 H new ATOM 0 HG2 LYS A 17 -23.720 5.781 26.171 1.00106.22 H new ATOM 0 HG3 LYS A 17 -24.452 4.405 26.203 1.00106.22 H new ATOM 0 HD2 LYS A 17 -25.986 6.254 26.101 1.00106.08 H new ATOM 0 HD3 LYS A 17 -26.278 5.308 27.306 1.00106.08 H new ATOM 0 HE2 LYS A 17 -24.965 6.795 28.697 1.00111.67 H new ATOM 0 HE3 LYS A 17 -24.884 7.778 27.488 1.00111.67 H new ATOM 0 HZ1 LYS A 17 -26.560 8.403 28.889 1.00109.83 H new ATOM 0 HZ2 LYS A 17 -27.155 8.038 27.615 1.00109.83 H new ATOM 0 HZ3 LYS A 17 -27.231 7.123 28.741 1.00109.83 H new ATOM 122 N GLN A 18 -22.008 2.706 29.593 1.00107.60 N ATOM 123 CA GLN A 18 -21.654 2.012 30.831 1.00113.59 C ATOM 124 C GLN A 18 -20.204 2.225 31.294 1.00109.34 C ATOM 125 O GLN A 18 -19.963 2.741 32.386 1.00107.26 O ATOM 126 CB GLN A 18 -21.924 0.506 30.651 1.00119.77 C ATOM 127 CG GLN A 18 -23.293 0.177 30.026 1.00121.44 C ATOM 128 CD GLN A 18 -23.212 -0.757 28.810 1.00121.39 C ATOM 129 OE1 GLN A 18 -23.767 -0.459 27.748 1.00116.67 O ATOM 130 NE2 GLN A 18 -22.535 -1.895 28.971 1.00120.66 N ATOM 0 H GLN A 18 -22.477 2.219 29.062 1.00107.60 H new ATOM 0 HA GLN A 18 -22.208 2.396 31.528 1.00113.59 H new ATOM 0 HB2 GLN A 18 -21.226 0.128 30.093 1.00119.77 H new ATOM 0 HB3 GLN A 18 -21.862 0.072 31.516 1.00119.77 H new ATOM 0 HG2 GLN A 18 -23.857 -0.233 30.701 1.00121.44 H new ATOM 0 HG3 GLN A 18 -23.724 1.004 29.760 1.00121.44 H new ATOM 0 HE21 GLN A 18 -22.161 -2.070 29.725 1.00120.66 H new ATOM 0 HE22 GLN A 18 -22.473 -2.454 28.320 1.00120.66 H new ATOM 131 N LYS A 19 -19.247 1.826 30.459 1.00112.39 N ATOM 132 CA LYS A 19 -17.834 1.875 30.824 1.00107.45 C ATOM 133 C LYS A 19 -17.139 3.073 30.181 1.00 99.34 C ATOM 134 O LYS A 19 -15.911 3.141 30.143 1.00 98.77 O ATOM 135 CB LYS A 19 -17.134 0.567 30.422 1.00106.73 C ATOM 136 CG LYS A 19 -18.011 -0.686 30.584 1.00111.77 C ATOM 137 CD LYS A 19 -17.186 -1.965 30.774 1.00111.50 C ATOM 138 CE LYS A 19 -17.575 -3.069 29.776 1.00112.36 C ATOM 139 NZ LYS A 19 -19.010 -3.479 29.829 1.00 93.78 N ATOM 0 H LYS A 19 -19.398 1.521 29.669 1.00112.39 H new ATOM 0 HA LYS A 19 -17.775 1.978 31.787 1.00107.45 H new ATOM 0 HB2 LYS A 19 -16.849 0.634 29.497 1.00106.73 H new ATOM 0 HB3 LYS A 19 -16.333 0.461 30.958 1.00106.73 H new ATOM 0 HG2 LYS A 19 -18.599 -0.568 31.347 1.00111.77 H new ATOM 0 HG3 LYS A 19 -18.577 -0.784 29.802 1.00111.77 H new ATOM 0 HD2 LYS A 19 -16.244 -1.757 30.671 1.00111.50 H new ATOM 0 HD3 LYS A 19 -17.307 -2.293 31.679 1.00111.50 H new ATOM 0 HE2 LYS A 19 -17.371 -2.763 28.878 1.00112.36 H new ATOM 0 HE3 LYS A 19 -17.022 -3.848 29.942 1.00112.36 H new ATOM 0 HZ1 LYS A 19 -19.131 -4.202 29.324 1.00 93.78 H new ATOM 0 HZ2 LYS A 19 -19.235 -3.664 30.670 1.00 93.78 H new ATOM 0 HZ3 LYS A 19 -19.520 -2.816 29.524 1.00 93.78 H new ATOM 140 N ASN A 20 -17.941 4.009 29.679 1.00 98.03 N ATOM 141 CA ASN A 20 -17.450 5.213 29.014 1.00 96.92 C ATOM 142 C ASN A 20 -16.577 4.896 27.809 1.00101.04 C ATOM 143 O ASN A 20 -15.660 5.647 27.479 1.00101.51 O ATOM 144 CB ASN A 20 -16.669 6.095 29.992 1.00 96.68 C ATOM 145 CG ASN A 20 -16.439 7.485 29.453 1.00 93.15 C ATOM 146 OD1 ASN A 20 -17.285 8.023 28.745 1.00 97.64 O ATOM 147 ND2 ASN A 20 -15.280 8.064 29.754 1.00 90.75 N ATOM 0 H ASN A 20 -18.799 3.961 29.716 1.00 98.03 H new ATOM 0 HA ASN A 20 -18.233 5.691 28.698 1.00 96.92 H new ATOM 0 HB2 ASN A 20 -17.153 6.152 30.830 1.00 96.68 H new ATOM 0 HB3 ASN A 20 -15.814 5.680 30.186 1.00 96.68 H new ATOM 0 HD21 ASN A 20 -15.099 8.847 29.449 1.00 90.75 H new ATOM 0 HD22 ASN A 20 -14.712 7.655 30.254 1.00 90.75 H new ATOM 148 N GLY A 21 -16.858 3.781 27.149 1.00100.99 N ATOM 149 CA GLY A 21 -16.069 3.376 25.996 1.00 97.35 C ATOM 150 C GLY A 21 -16.908 2.914 24.819 1.00100.00 C ATOM 151 O GLY A 21 -18.005 3.433 24.586 1.00101.37 O ATOM 0 H GLY A 21 -17.500 3.246 27.352 1.00100.99 H new ATOM 0 HA2 GLY A 21 -15.514 4.120 25.716 1.00 97.35 H new ATOM 0 HA3 GLY A 21 -15.471 2.659 26.258 1.00 97.35 H new ATOM 152 N ILE A 22 -16.386 1.942 24.070 1.00 92.00 N ATOM 153 CA ILE A 22 -17.130 1.315 22.978 1.00 85.84 C ATOM 154 C ILE A 22 -16.936 -0.192 23.002 1.00 82.44 C ATOM 155 O ILE A 22 -15.904 -0.670 23.463 1.00 88.96 O ATOM 156 CB ILE A 22 -16.697 1.849 21.603 1.00 85.02 C ATOM 157 CG1 ILE A 22 -15.184 1.695 21.437 1.00 86.89 C ATOM 158 CG2 ILE A 22 -17.128 3.305 21.417 1.00 91.69 C ATOM 159 CD1 ILE A 22 -14.624 2.306 20.161 1.00 82.62 C ATOM 0 H ILE A 22 -15.593 1.629 24.181 1.00 92.00 H new ATOM 0 HA ILE A 22 -18.065 1.535 23.112 1.00 85.84 H new ATOM 0 HB ILE A 22 -17.138 1.327 20.915 1.00 85.02 H new ATOM 0 HG12 ILE A 22 -14.743 2.104 22.198 1.00 86.89 H new ATOM 0 HG13 ILE A 22 -14.963 0.751 21.454 1.00 86.89 H new ATOM 0 HG21 ILE A 22 -16.844 3.618 20.544 1.00 91.69 H new ATOM 0 HG22 ILE A 22 -18.094 3.368 21.484 1.00 91.69 H new ATOM 0 HG23 ILE A 22 -16.720 3.854 22.105 1.00 91.69 H new ATOM 0 HD11 ILE A 22 -13.664 2.168 20.130 1.00 82.62 H new ATOM 0 HD12 ILE A 22 -15.036 1.883 19.391 1.00 82.62 H new ATOM 0 HD13 ILE A 22 -14.814 3.257 20.147 1.00 82.62 H new ATOM 160 N LYS A 23 -17.936 -0.937 22.537 1.00 76.29 N ATOM 161 CA LYS A 23 -17.782 -2.370 22.307 1.00 78.65 C ATOM 162 C LYS A 23 -17.950 -2.624 20.805 1.00 82.87 C ATOM 163 O LYS A 23 -18.424 -1.749 20.085 1.00 83.98 O ATOM 164 CB LYS A 23 -18.777 -3.196 23.147 1.00 75.68 C ATOM 165 CG LYS A 23 -20.206 -2.680 23.184 1.00 83.37 C ATOM 0 H LYS A 23 -18.716 -0.629 22.348 1.00 76.29 H new ATOM 0 HA LYS A 23 -16.900 -2.657 22.592 1.00 78.65 H new ATOM 0 HB2 LYS A 23 -18.788 -4.103 22.803 1.00 75.68 H new ATOM 0 HB3 LYS A 23 -18.445 -3.242 24.057 1.00 75.68 H new ATOM 166 N ALA A 24 -17.538 -3.795 20.321 1.00 76.21 N ATOM 167 CA ALA A 24 -17.601 -4.073 18.889 1.00 61.17 C ATOM 168 C ALA A 24 -17.675 -5.556 18.603 1.00 65.05 C ATOM 169 O ALA A 24 -17.274 -6.376 19.425 1.00 62.42 O ATOM 170 CB ALA A 24 -16.420 -3.473 18.185 1.00 61.54 C ATOM 0 H ALA A 24 -17.222 -4.435 20.800 1.00 76.21 H new ATOM 0 HA ALA A 24 -18.415 -3.666 18.553 1.00 61.17 H new ATOM 0 HB1 ALA A 24 -16.476 -3.666 17.236 1.00 61.54 H new ATOM 0 HB2 ALA A 24 -16.417 -2.512 18.319 1.00 61.54 H new ATOM 0 HB3 ALA A 24 -15.602 -3.852 18.544 1.00 61.54 H new ATOM 171 N ASN A 25 -18.207 -5.886 17.426 1.00 68.24 N ATOM 172 CA ASN A 25 -18.524 -7.259 17.056 1.00 63.06 C ATOM 173 C ASN A 25 -18.332 -7.435 15.574 1.00 59.96 C ATOM 174 O ASN A 25 -18.805 -6.628 14.778 1.00 67.63 O ATOM 175 CB ASN A 25 -19.962 -7.617 17.440 1.00 61.33 C ATOM 176 CG ASN A 25 -20.349 -7.064 18.792 1.00 70.27 C ATOM 177 OD1 ASN A 25 -20.144 -7.712 19.823 1.00 78.56 O ATOM 178 ND2 ASN A 25 -20.884 -5.844 18.805 1.00 72.38 N ATOM 0 H ASN A 25 -18.395 -5.310 16.815 1.00 68.24 H new ATOM 0 HA ASN A 25 -17.927 -7.853 17.538 1.00 63.06 H new ATOM 0 HB2 ASN A 25 -20.570 -7.273 16.766 1.00 61.33 H new ATOM 0 HB3 ASN A 25 -20.062 -8.582 17.447 1.00 61.33 H new ATOM 0 HD21 ASN A 25 -21.101 -5.478 19.552 1.00 72.38 H new ATOM 0 HD22 ASN A 25 -21.012 -5.423 18.066 1.00 72.38 H new ATOM 179 N PHE A 26 -17.616 -8.481 15.206 1.00 58.22 N ATOM 180 CA PHE A 26 -17.417 -8.782 13.807 1.00 58.66 C ATOM 181 C PHE A 26 -16.873 -10.178 13.654 1.00 58.26 C ATOM 182 O PHE A 26 -16.392 -10.780 14.608 1.00 61.96 O ATOM 183 CB PHE A 26 -16.492 -7.759 13.131 1.00 60.42 C ATOM 184 CG PHE A 26 -15.143 -7.596 13.775 1.00 54.38 C ATOM 185 CD1 PHE A 26 -14.960 -6.718 14.831 1.00 61.43 C ATOM 186 CD2 PHE A 26 -14.039 -8.264 13.277 1.00 55.57 C ATOM 187 CE1 PHE A 26 -13.700 -6.540 15.413 1.00 61.36 C ATOM 188 CE2 PHE A 26 -12.779 -8.089 13.854 1.00 58.26 C ATOM 189 CZ PHE A 26 -12.610 -7.228 14.923 1.00 53.48 C ATOM 0 H PHE A 26 -17.238 -9.028 15.751 1.00 58.22 H new ATOM 0 HA PHE A 26 -18.277 -8.727 13.362 1.00 58.66 H new ATOM 0 HB2 PHE A 26 -16.364 -8.021 12.206 1.00 60.42 H new ATOM 0 HB3 PHE A 26 -16.937 -6.897 13.122 1.00 60.42 H new ATOM 0 HD1 PHE A 26 -15.687 -6.239 15.159 1.00 61.43 H new ATOM 0 HD2 PHE A 26 -14.137 -8.836 12.550 1.00 55.57 H new ATOM 0 HE1 PHE A 26 -13.598 -5.957 16.131 1.00 61.36 H new ATOM 0 HE2 PHE A 26 -12.048 -8.555 13.517 1.00 58.26 H new ATOM 0 HZ PHE A 26 -11.771 -7.114 15.307 1.00 53.48 H new ATOM 190 N GLN A 27 -16.975 -10.697 12.446 1.00 51.25 N ATOM 191 CA GLN A 27 -16.511 -12.031 12.170 1.00 53.55 C ATOM 192 C GLN A 27 -15.338 -11.967 11.195 1.00 62.32 C ATOM 193 O GLN A 27 -15.300 -11.133 10.284 1.00 64.89 O ATOM 194 CB GLN A 27 -17.652 -12.855 11.619 1.00 52.64 C ATOM 195 CG GLN A 27 -17.435 -14.337 11.550 1.00 66.16 C ATOM 196 CD GLN A 27 -18.722 -15.047 11.161 1.00 76.93 C ATOM 197 OE1 GLN A 27 -18.848 -15.569 10.056 1.00 82.82 O ATOM 198 NE2 GLN A 27 -19.696 -15.047 12.067 1.00 84.90 N ATOM 0 H GLN A 27 -17.313 -10.287 11.770 1.00 51.25 H new ATOM 0 HA GLN A 27 -16.201 -12.456 12.985 1.00 53.55 H new ATOM 0 HB2 GLN A 27 -18.437 -12.688 12.163 1.00 52.64 H new ATOM 0 HB3 GLN A 27 -17.853 -12.536 10.725 1.00 52.64 H new ATOM 0 HG2 GLN A 27 -16.740 -14.538 10.903 1.00 66.16 H new ATOM 0 HG3 GLN A 27 -17.126 -14.664 12.409 1.00 66.16 H new ATOM 0 HE21 GLN A 27 -19.573 -14.672 12.831 1.00 84.90 H new ATOM 0 HE22 GLN A 27 -20.449 -15.422 11.889 1.00 84.90 H new ATOM 199 N ILE A 28 -14.358 -12.826 11.401 1.00 60.68 N ATOM 200 CA ILE A 28 -13.236 -12.868 10.486 1.00 67.61 C ATOM 201 C ILE A 28 -13.317 -14.227 9.860 1.00 59.64 C ATOM 202 O ILE A 28 -13.781 -15.164 10.506 1.00 55.66 O ATOM 203 CB ILE A 28 -11.867 -12.614 11.196 1.00 63.82 C ATOM 204 CG1 ILE A 28 -11.685 -11.118 11.443 1.00 54.18 C ATOM 205 CG2 ILE A 28 -10.700 -13.083 10.346 1.00 53.78 C ATOM 206 CD1 ILE A 28 -11.721 -10.321 10.152 1.00 64.73 C ATOM 0 H ILE A 28 -14.322 -13.385 12.053 1.00 60.68 H new ATOM 0 HA ILE A 28 -13.283 -12.160 9.825 1.00 67.61 H new ATOM 0 HB ILE A 28 -11.879 -13.111 12.029 1.00 63.82 H new ATOM 0 HG12 ILE A 28 -12.383 -10.802 12.037 1.00 54.18 H new ATOM 0 HG13 ILE A 28 -10.839 -10.966 11.893 1.00 54.18 H new ATOM 0 HG21 ILE A 28 -9.868 -12.911 10.815 1.00 53.78 H new ATOM 0 HG22 ILE A 28 -10.785 -14.034 10.177 1.00 53.78 H new ATOM 0 HG23 ILE A 28 -10.700 -12.604 9.503 1.00 53.78 H new ATOM 0 HD11 ILE A 28 -11.602 -9.379 10.350 1.00 64.73 H new ATOM 0 HD12 ILE A 28 -11.008 -10.620 9.567 1.00 64.73 H new ATOM 0 HD13 ILE A 28 -12.576 -10.454 9.713 1.00 64.73 H new ATOM 207 N ARG A 29 -12.932 -14.307 8.588 1.00 63.56 N ATOM 208 CA ARG A 29 -12.841 -15.574 7.875 1.00 67.96 C ATOM 209 C ARG A 29 -11.418 -15.869 7.387 1.00 70.73 C ATOM 210 O ARG A 29 -10.788 -15.030 6.741 1.00 77.57 O ATOM 211 CB ARG A 29 -13.804 -15.574 6.695 1.00 66.55 C ATOM 212 CG ARG A 29 -15.179 -16.068 7.045 1.00 78.48 C ATOM 213 CD ARG A 29 -16.281 -15.209 6.444 1.00 89.34 C ATOM 214 NE ARG A 29 -17.593 -15.664 6.900 1.00 92.44 N ATOM 215 CZ ARG A 29 -18.359 -16.529 6.239 1.00103.57 C ATOM 216 NH1 ARG A 29 -17.948 -17.034 5.073 1.00102.18 N ATOM 217 NH2 ARG A 29 -19.542 -16.882 6.741 1.00100.53 N ATOM 0 H ARG A 29 -12.716 -13.623 8.114 1.00 63.56 H new ATOM 0 HA ARG A 29 -13.083 -16.275 8.500 1.00 67.96 H new ATOM 0 HB2 ARG A 29 -13.872 -14.673 6.342 1.00 66.55 H new ATOM 0 HB3 ARG A 29 -13.439 -16.129 5.988 1.00 66.55 H new ATOM 0 HG2 ARG A 29 -15.280 -16.981 6.734 1.00 78.48 H new ATOM 0 HG3 ARG A 29 -15.277 -16.085 8.010 1.00 78.48 H new ATOM 0 HD2 ARG A 29 -16.149 -14.282 6.696 1.00 89.34 H new ATOM 0 HD3 ARG A 29 -16.238 -15.249 5.476 1.00 89.34 H new ATOM 0 HE ARG A 29 -17.890 -15.352 7.645 1.00 92.44 H new ATOM 0 HH11 ARG A 29 -17.187 -16.800 4.748 1.00102.18 H new ATOM 0 HH12 ARG A 29 -18.444 -17.593 4.648 1.00102.18 H new ATOM 0 HH21 ARG A 29 -19.808 -16.551 7.489 1.00100.53 H new ATOM 0 HH22 ARG A 29 -20.040 -17.441 6.317 1.00100.53 H new ATOM 218 N HIS A 30 -10.912 -17.056 7.698 1.00 54.52 N ATOM 219 CA HIS A 30 -9.623 -17.479 7.166 1.00 67.91 C ATOM 220 C HIS A 30 -9.803 -18.652 6.180 1.00 75.83 C ATOM 221 O HIS A 30 -10.489 -19.625 6.505 1.00 70.70 O ATOM 222 CB HIS A 30 -8.676 -17.894 8.295 1.00 64.11 C ATOM 223 CG HIS A 30 -8.520 -16.875 9.379 1.00 56.37 C ATOM 224 ND1 HIS A 30 -8.032 -15.609 9.150 1.00 67.44 N ATOM 225 CD2 HIS A 30 -8.759 -16.946 10.710 1.00 56.97 C ATOM 226 CE1 HIS A 30 -7.984 -14.940 10.290 1.00 57.38 C ATOM 227 NE2 HIS A 30 -8.426 -15.726 11.251 1.00 50.55 N ATOM 0 H HIS A 30 -11.296 -17.628 8.212 1.00 54.52 H new ATOM 0 HA HIS A 30 -9.234 -16.726 6.695 1.00 67.91 H new ATOM 0 HB2 HIS A 30 -9.001 -18.720 8.687 1.00 64.11 H new ATOM 0 HB3 HIS A 30 -7.803 -18.083 7.917 1.00 64.11 H new ATOM 0 HD2 HIS A 30 -9.087 -17.683 11.173 1.00 56.97 H new ATOM 0 HE1 HIS A 30 -7.689 -14.064 10.395 1.00 57.38 H new ATOM 0 HE2 HIS A 30 -8.495 -15.511 12.081 1.00 50.55 H new ATOM 228 N ASN A 31 -9.205 -18.566 4.987 1.00 75.17 N ATOM 229 CA ASN A 31 -9.254 -19.700 4.057 1.00 83.14 C ATOM 230 C ASN A 31 -8.345 -20.807 4.555 1.00 81.36 C ATOM 231 O ASN A 31 -7.224 -20.544 4.986 1.00 81.58 O ATOM 232 CB ASN A 31 -8.820 -19.324 2.627 1.00 93.09 C ATOM 233 CG ASN A 31 -9.508 -18.082 2.094 1.00 93.12 C ATOM 234 OD1 ASN A 31 -10.590 -18.153 1.495 1.00 86.19 O ATOM 235 ND2 ASN A 31 -8.864 -16.932 2.282 1.00 94.37 N ATOM 0 H ASN A 31 -8.776 -17.877 4.702 1.00 75.17 H new ATOM 0 HA ASN A 31 -10.179 -19.990 4.022 1.00 83.14 H new ATOM 0 HB2 ASN A 31 -7.860 -19.184 2.614 1.00 93.09 H new ATOM 0 HB3 ASN A 31 -9.006 -20.068 2.034 1.00 93.09 H new ATOM 0 HD21 ASN A 31 -9.198 -16.198 1.982 1.00 94.37 H new ATOM 0 HD22 ASN A 31 -8.114 -16.923 2.703 1.00 94.37 H new ATOM 236 N VAL A 32 -8.806 -22.046 4.482 1.00 81.40 N ATOM 237 CA VAL A 32 -7.913 -23.155 4.767 1.00 87.87 C ATOM 238 C VAL A 32 -7.381 -23.712 3.449 1.00 87.59 C ATOM 239 O VAL A 32 -7.951 -23.448 2.384 1.00 88.37 O ATOM 240 CB VAL A 32 -8.606 -24.256 5.564 1.00 84.88 C ATOM 241 CG1 VAL A 32 -9.532 -23.644 6.606 1.00 71.13 C ATOM 242 CG2 VAL A 32 -9.366 -25.132 4.629 1.00 87.27 C ATOM 0 H VAL A 32 -9.612 -22.263 4.275 1.00 81.40 H new ATOM 0 HA VAL A 32 -7.181 -22.827 5.313 1.00 87.87 H new ATOM 0 HB VAL A 32 -7.943 -24.790 6.029 1.00 84.88 H new ATOM 0 HG11 VAL A 32 -9.968 -24.351 7.107 1.00 71.13 H new ATOM 0 HG12 VAL A 32 -9.016 -23.089 7.212 1.00 71.13 H new ATOM 0 HG13 VAL A 32 -10.203 -23.101 6.164 1.00 71.13 H new ATOM 0 HG21 VAL A 32 -9.809 -25.834 5.131 1.00 87.27 H new ATOM 0 HG22 VAL A 32 -10.030 -24.604 4.158 1.00 87.27 H new ATOM 0 HG23 VAL A 32 -8.755 -25.529 3.989 1.00 87.27 H new ATOM 243 N GLU A 33 -6.279 -24.457 3.530 1.00 88.71 N ATOM 244 CA GLU A 33 -5.623 -25.045 2.357 1.00 93.85 C ATOM 245 C GLU A 33 -6.578 -25.908 1.523 1.00 94.63 C ATOM 246 O GLU A 33 -6.552 -25.854 0.287 1.00 83.72 O ATOM 247 CB GLU A 33 -4.406 -25.887 2.787 1.00 96.11 C ATOM 248 CG GLU A 33 -3.156 -25.082 3.159 1.00 98.68 C ATOM 249 CD GLU A 33 -2.134 -25.888 3.971 1.00106.94 C ATOM 250 OE1 GLU A 33 -1.108 -25.297 4.395 1.00100.91 O ATOM 251 OE2 GLU A 33 -2.361 -27.106 4.187 1.00107.11 O ATOM 0 H GLU A 33 -5.886 -24.638 4.273 1.00 88.71 H new ATOM 0 HA GLU A 33 -5.331 -24.307 1.800 1.00 93.85 H new ATOM 0 HB2 GLU A 33 -4.660 -26.433 3.548 1.00 96.11 H new ATOM 0 HB3 GLU A 33 -4.179 -26.494 2.065 1.00 96.11 H new ATOM 0 HG2 GLU A 33 -2.733 -24.760 2.348 1.00 98.68 H new ATOM 0 HG3 GLU A 33 -3.422 -24.301 3.670 1.00 98.68 H new ATOM 252 N ASP A 34 -7.424 -26.688 2.201 1.00 90.16 N ATOM 253 CA ASP A 34 -8.343 -27.590 1.516 1.00 85.89 C ATOM 254 C ASP A 34 -9.559 -26.853 0.961 1.00 92.10 C ATOM 255 O ASP A 34 -10.527 -27.478 0.541 1.00104.42 O ATOM 256 CB ASP A 34 -8.785 -28.740 2.443 1.00 87.04 C ATOM 257 CG ASP A 34 -9.690 -28.289 3.600 1.00 99.10 C ATOM 258 OD1 ASP A 34 -10.731 -27.639 3.362 1.00 97.81 O ATOM 259 OD2 ASP A 34 -9.372 -28.614 4.768 1.00105.49 O ATOM 0 H ASP A 34 -7.479 -26.707 3.059 1.00 90.16 H new ATOM 0 HA ASP A 34 -7.861 -27.968 0.764 1.00 85.89 H new ATOM 0 HB2 ASP A 34 -9.254 -29.406 1.917 1.00 87.04 H new ATOM 0 HB3 ASP A 34 -7.997 -29.171 2.809 1.00 87.04 H new ATOM 260 N GLY A 35 -9.517 -25.527 0.967 1.00 87.66 N ATOM 261 CA GLY A 35 -10.597 -24.745 0.397 1.00 91.02 C ATOM 262 C GLY A 35 -11.800 -24.455 1.288 1.00 88.76 C ATOM 263 O GLY A 35 -12.689 -23.697 0.882 1.00 74.89 O ATOM 0 H GLY A 35 -8.872 -25.064 1.296 1.00 87.66 H new ATOM 0 HA2 GLY A 35 -10.230 -23.896 0.103 1.00 91.02 H new ATOM 0 HA3 GLY A 35 -10.915 -25.206 -0.395 1.00 91.02 H new ATOM 264 N SER A 36 -11.854 -25.031 2.490 1.00 80.48 N ATOM 265 CA SER A 36 -12.933 -24.649 3.398 1.00 85.20 C ATOM 266 C SER A 36 -12.610 -23.308 4.059 1.00 77.85 C ATOM 267 O SER A 36 -11.698 -22.586 3.637 1.00 75.49 O ATOM 268 CB SER A 36 -13.213 -25.729 4.454 1.00 75.96 C ATOM 269 OG SER A 36 -12.101 -25.980 5.282 1.00 74.14 O ATOM 0 H SER A 36 -11.302 -25.619 2.788 1.00 80.48 H new ATOM 0 HA SER A 36 -13.743 -24.556 2.872 1.00 85.20 H new ATOM 0 HB2 SER A 36 -13.964 -25.453 5.002 1.00 75.96 H new ATOM 0 HB3 SER A 36 -13.473 -26.551 4.010 1.00 75.96 H new ATOM 0 HG SER A 36 -12.298 -26.573 5.843 1.00 74.14 H new ATOM 270 N VAL A 37 -13.385 -22.965 5.080 1.00 76.71 N ATOM 271 CA VAL A 37 -13.271 -21.660 5.717 1.00 76.42 C ATOM 272 C VAL A 37 -13.415 -21.739 7.229 1.00 64.12 C ATOM 273 O VAL A 37 -14.309 -22.394 7.744 1.00 66.40 O ATOM 274 CB VAL A 37 -14.323 -20.675 5.154 1.00 77.53 C ATOM 275 CG1 VAL A 37 -14.605 -19.545 6.141 1.00 69.53 C ATOM 276 CG2 VAL A 37 -13.869 -20.129 3.805 1.00 72.68 C ATOM 0 H VAL A 37 -13.986 -23.477 5.421 1.00 76.71 H new ATOM 0 HA VAL A 37 -12.380 -21.335 5.515 1.00 76.42 H new ATOM 0 HB VAL A 37 -15.154 -21.159 5.023 1.00 77.53 H new ATOM 0 HG11 VAL A 37 -15.266 -18.943 5.764 1.00 69.53 H new ATOM 0 HG12 VAL A 37 -14.942 -19.917 6.971 1.00 69.53 H new ATOM 0 HG13 VAL A 37 -13.786 -19.056 6.316 1.00 69.53 H new ATOM 0 HG21 VAL A 37 -14.537 -19.514 3.464 1.00 72.68 H new ATOM 0 HG22 VAL A 37 -13.025 -19.663 3.912 1.00 72.68 H new ATOM 0 HG23 VAL A 37 -13.756 -20.862 3.180 1.00 72.68 H new ATOM 277 N GLN A 38 -12.518 -21.047 7.921 1.00 67.79 N ATOM 278 CA GLN A 38 -12.498 -20.958 9.380 1.00 62.15 C ATOM 279 C GLN A 38 -13.109 -19.675 9.937 1.00 60.71 C ATOM 280 O GLN A 38 -12.522 -18.601 9.818 1.00 67.00 O ATOM 281 CB GLN A 38 -11.057 -21.045 9.857 1.00 61.11 C ATOM 282 CG GLN A 38 -10.902 -20.824 11.305 1.00 55.58 C ATOM 283 CD GLN A 38 -11.358 -22.020 12.086 1.00 61.34 C ATOM 284 OE1 GLN A 38 -10.937 -23.142 11.800 1.00 63.16 O ATOM 285 NE2 GLN A 38 -12.235 -21.801 13.070 1.00 58.44 N ATOM 0 H GLN A 38 -11.885 -20.602 7.546 1.00 67.79 H new ATOM 0 HA GLN A 38 -13.041 -21.693 9.705 1.00 62.15 H new ATOM 0 HB2 GLN A 38 -10.701 -21.919 9.631 1.00 61.11 H new ATOM 0 HB3 GLN A 38 -10.525 -20.390 9.379 1.00 61.11 H new ATOM 0 HG2 GLN A 38 -9.972 -20.636 11.509 1.00 55.58 H new ATOM 0 HG3 GLN A 38 -11.414 -20.045 11.573 1.00 55.58 H new ATOM 0 HE21 GLN A 38 -12.503 -21.001 13.237 1.00 58.44 H new ATOM 0 HE22 GLN A 38 -12.531 -22.460 13.537 1.00 58.44 H new ATOM 286 N LEU A 39 -14.262 -19.757 10.571 1.00 62.23 N ATOM 287 CA LEU A 39 -14.790 -18.549 11.201 1.00 59.27 C ATOM 288 C LEU A 39 -13.993 -18.161 12.441 1.00 55.49 C ATOM 289 O LEU A 39 -13.519 -19.016 13.191 1.00 53.93 O ATOM 290 CB LEU A 39 -16.262 -18.736 11.563 1.00 65.24 C ATOM 291 CG LEU A 39 -17.077 -19.126 10.333 1.00 73.12 C ATOM 292 CD1 LEU A 39 -18.485 -19.526 10.722 1.00 89.41 C ATOM 293 CD2 LEU A 39 -17.092 -17.992 9.336 1.00 71.22 C ATOM 0 H LEU A 39 -14.742 -20.466 10.651 1.00 62.23 H new ATOM 0 HA LEU A 39 -14.707 -17.828 10.558 1.00 59.27 H new ATOM 0 HB2 LEU A 39 -16.347 -19.422 12.244 1.00 65.24 H new ATOM 0 HB3 LEU A 39 -16.613 -17.915 11.942 1.00 65.24 H new ATOM 0 HG LEU A 39 -16.657 -19.895 9.916 1.00 73.12 H new ATOM 0 HD11 LEU A 39 -18.984 -19.769 9.927 1.00 89.41 H new ATOM 0 HD12 LEU A 39 -18.451 -20.284 11.326 1.00 89.41 H new ATOM 0 HD13 LEU A 39 -18.923 -18.781 11.163 1.00 89.41 H new ATOM 0 HD21 LEU A 39 -17.612 -18.251 8.559 1.00 71.22 H new ATOM 0 HD22 LEU A 39 -17.490 -17.207 9.744 1.00 71.22 H new ATOM 0 HD23 LEU A 39 -16.184 -17.789 9.063 1.00 71.22 H new ATOM 294 N ALA A 40 -13.851 -16.864 12.659 1.00 56.95 N ATOM 295 CA ALA A 40 -13.261 -16.367 13.892 1.00 53.35 C ATOM 296 C ALA A 40 -14.071 -15.201 14.430 1.00 55.72 C ATOM 297 O ALA A 40 -13.907 -14.071 13.984 1.00 58.39 O ATOM 298 CB ALA A 40 -11.810 -15.946 13.663 1.00 63.21 C ATOM 0 H ALA A 40 -14.090 -16.252 12.104 1.00 56.95 H new ATOM 0 HA ALA A 40 -13.272 -17.082 14.547 1.00 53.35 H new ATOM 0 HB1 ALA A 40 -11.433 -15.618 14.494 1.00 63.21 H new ATOM 0 HB2 ALA A 40 -11.296 -16.709 13.355 1.00 63.21 H new ATOM 0 HB3 ALA A 40 -11.778 -15.244 12.995 1.00 63.21 H new ATOM 299 N ASP A 41 -14.932 -15.467 15.403 1.00 58.91 N ATOM 300 CA ASP A 41 -15.819 -14.431 15.915 1.00 54.80 C ATOM 301 C ASP A 41 -15.151 -13.539 16.927 1.00 50.66 C ATOM 302 O ASP A 41 -14.607 -14.008 17.921 1.00 59.15 O ATOM 303 CB ASP A 41 -17.069 -15.053 16.527 1.00 58.04 C ATOM 304 CG ASP A 41 -17.970 -15.679 15.484 1.00 69.73 C ATOM 305 OD1 ASP A 41 -18.486 -14.930 14.629 1.00 63.62 O ATOM 306 OD2 ASP A 41 -18.163 -16.914 15.520 1.00 70.94 O ATOM 0 H ASP A 41 -15.019 -16.236 15.779 1.00 58.91 H new ATOM 0 HA ASP A 41 -16.063 -13.878 15.156 1.00 54.80 H new ATOM 0 HB2 ASP A 41 -16.808 -15.728 17.173 1.00 58.04 H new ATOM 0 HB3 ASP A 41 -17.562 -14.372 17.011 1.00 58.04 H new ATOM 307 N HIS A 42 -15.225 -12.242 16.671 1.00 53.13 N ATOM 308 CA HIS A 42 -14.594 -11.235 17.504 1.00 51.21 C ATOM 309 C HIS A 42 -15.608 -10.505 18.371 1.00 51.45 C ATOM 310 O HIS A 42 -16.688 -10.135 17.907 1.00 59.32 O ATOM 311 CB HIS A 42 -13.839 -10.226 16.622 1.00 53.33 C ATOM 312 CG HIS A 42 -12.545 -10.741 16.066 1.00 49.22 C ATOM 313 ND1 HIS A 42 -12.444 -11.942 15.396 1.00 51.12 N ATOM 314 CD2 HIS A 42 -11.299 -10.209 16.073 1.00 50.68 C ATOM 315 CE1 HIS A 42 -11.191 -12.131 15.021 1.00 51.83 C ATOM 316 NE2 HIS A 42 -10.476 -11.093 15.415 1.00 50.31 N ATOM 0 H HIS A 42 -15.650 -11.918 15.997 1.00 53.13 H new ATOM 0 HA HIS A 42 -13.970 -11.687 18.094 1.00 51.21 H new ATOM 0 HB2 HIS A 42 -14.413 -9.962 15.886 1.00 53.33 H new ATOM 0 HB3 HIS A 42 -13.660 -9.427 17.143 1.00 53.33 H new ATOM 0 HD1 HIS A 42 -13.095 -12.484 15.246 1.00 51.12 H new ATOM 0 HD2 HIS A 42 -11.047 -9.398 16.452 1.00 50.68 H new ATOM 0 HE1 HIS A 42 -10.868 -12.870 14.558 1.00 51.83 H new ATOM 317 N TYR A 43 -15.252 -10.313 19.635 1.00 55.13 N ATOM 318 CA TYR A 43 -16.016 -9.509 20.597 1.00 52.34 C ATOM 319 C TYR A 43 -15.011 -8.583 21.234 1.00 53.52 C ATOM 320 O TYR A 43 -13.999 -9.049 21.754 1.00 51.29 O ATOM 321 CB TYR A 43 -16.688 -10.361 21.677 1.00 45.86 C ATOM 322 CG TYR A 43 -17.734 -11.348 21.191 1.00 51.88 C ATOM 323 CD1 TYR A 43 -17.365 -12.453 20.430 1.00 51.34 C ATOM 324 CD2 TYR A 43 -19.090 -11.204 21.533 1.00 54.67 C ATOM 325 CE1 TYR A 43 -18.305 -13.379 19.990 1.00 56.17 C ATOM 326 CE2 TYR A 43 -20.043 -12.130 21.099 1.00 55.04 C ATOM 327 CZ TYR A 43 -19.636 -13.220 20.324 1.00 59.46 C ATOM 328 OH TYR A 43 -20.529 -14.166 19.871 1.00 58.39 O ATOM 0 H TYR A 43 -14.539 -10.655 19.972 1.00 55.13 H new ATOM 0 HA TYR A 43 -16.733 -9.039 20.144 1.00 52.34 H new ATOM 0 HB2 TYR A 43 -15.999 -10.854 22.150 1.00 45.86 H new ATOM 0 HB3 TYR A 43 -17.104 -9.766 22.320 1.00 45.86 H new ATOM 0 HD1 TYR A 43 -16.470 -12.575 20.211 1.00 51.34 H new ATOM 0 HD2 TYR A 43 -19.357 -10.482 22.055 1.00 54.67 H new ATOM 0 HE1 TYR A 43 -18.038 -14.104 19.472 1.00 56.17 H new ATOM 0 HE2 TYR A 43 -20.939 -12.022 21.324 1.00 55.04 H new ATOM 0 HH TYR A 43 -21.303 -13.970 20.133 1.00 58.39 H new ATOM 329 N GLN A 44 -15.274 -7.284 21.194 1.00 49.55 N ATOM 330 CA GLN A 44 -14.255 -6.306 21.532 1.00 54.02 C ATOM 331 C GLN A 44 -14.783 -5.306 22.576 1.00 70.68 C ATOM 332 O GLN A 44 -15.980 -5.025 22.639 1.00 69.87 O ATOM 333 CB GLN A 44 -13.776 -5.601 20.246 1.00 56.85 C ATOM 334 CG GLN A 44 -12.653 -4.565 20.410 1.00 58.33 C ATOM 335 CD GLN A 44 -12.202 -3.951 19.087 1.00 63.73 C ATOM 336 OE1 GLN A 44 -12.113 -4.635 18.064 1.00 75.15 O ATOM 337 NE2 GLN A 44 -11.904 -2.658 19.105 1.00 64.31 N ATOM 0 H GLN A 44 -16.035 -6.950 20.974 1.00 49.55 H new ATOM 0 HA GLN A 44 -13.495 -6.755 21.934 1.00 54.02 H new ATOM 0 HB2 GLN A 44 -13.474 -6.280 19.622 1.00 56.85 H new ATOM 0 HB3 GLN A 44 -14.538 -5.161 19.839 1.00 56.85 H new ATOM 0 HG2 GLN A 44 -12.957 -3.858 21.001 1.00 58.33 H new ATOM 0 HG3 GLN A 44 -11.893 -4.987 20.840 1.00 58.33 H new ATOM 0 HE21 GLN A 44 -11.977 -2.210 19.835 1.00 64.31 H new ATOM 0 HE22 GLN A 44 -11.638 -2.268 18.386 1.00 64.31 H new ATOM 338 N GLN A 45 -13.882 -4.803 23.416 1.00 68.59 N ATOM 339 CA GLN A 45 -14.223 -3.825 24.434 1.00 65.95 C ATOM 340 C GLN A 45 -13.083 -2.817 24.474 1.00 63.41 C ATOM 341 O GLN A 45 -11.925 -3.204 24.481 1.00 72.43 O ATOM 342 CB GLN A 45 -14.442 -4.523 25.789 1.00 84.38 C ATOM 343 CG GLN A 45 -14.854 -3.630 26.966 1.00 87.40 C ATOM 344 CD GLN A 45 -16.114 -2.826 26.682 1.00 95.28 C ATOM 345 OE1 GLN A 45 -16.094 -1.591 26.724 1.00 97.03 O ATOM 346 NE2 GLN A 45 -17.218 -3.519 26.396 1.00 91.40 N ATOM 0 H GLN A 45 -13.051 -5.024 23.408 1.00 68.59 H new ATOM 0 HA GLN A 45 -15.053 -3.367 24.231 1.00 65.95 H new ATOM 0 HB2 GLN A 45 -15.123 -5.203 25.672 1.00 84.38 H new ATOM 0 HB3 GLN A 45 -13.622 -4.981 26.029 1.00 84.38 H new ATOM 0 HG2 GLN A 45 -14.997 -4.182 27.751 1.00 87.40 H new ATOM 0 HG3 GLN A 45 -14.128 -3.022 27.175 1.00 87.40 H new ATOM 0 HE21 GLN A 45 -17.193 -4.378 26.376 1.00 91.40 H new ATOM 0 HE22 GLN A 45 -17.954 -3.106 26.232 1.00 91.40 H new ATOM 347 N ASN A 46 -13.407 -1.530 24.442 1.00 65.01 N ATOM 348 CA ASN A 46 -12.405 -0.465 24.434 1.00 63.46 C ATOM 349 C ASN A 46 -12.694 0.605 25.481 1.00 75.41 C ATOM 350 O ASN A 46 -13.736 1.250 25.449 1.00 82.72 O ATOM 351 CB ASN A 46 -12.328 0.202 23.055 1.00 74.53 C ATOM 352 CG ASN A 46 -11.494 -0.583 22.063 1.00 72.20 C ATOM 353 OD1 ASN A 46 -11.702 -1.779 21.882 1.00 69.10 O ATOM 354 ND2 ASN A 46 -10.533 0.089 21.421 1.00 64.93 N ATOM 0 H ASN A 46 -14.219 -1.246 24.424 1.00 65.01 H new ATOM 0 HA ASN A 46 -11.557 -0.885 24.647 1.00 63.46 H new ATOM 0 HB2 ASN A 46 -13.225 0.309 22.702 1.00 74.53 H new ATOM 0 HB3 ASN A 46 -11.954 1.092 23.152 1.00 74.53 H new ATOM 0 HD21 ASN A 46 -10.030 -0.317 20.854 1.00 64.93 H new ATOM 0 HD22 ASN A 46 -10.418 0.927 21.575 1.00 64.93 H new ATOM 355 N THR A 47 -11.762 0.815 26.397 1.00 82.34 N ATOM 356 CA THR A 47 -11.989 1.730 27.513 1.00 84.06 C ATOM 357 C THR A 47 -10.902 2.801 27.574 1.00 85.70 C ATOM 358 O THR A 47 -9.727 2.488 27.379 1.00 80.12 O ATOM 359 CB THR A 47 -12.054 0.944 28.826 1.00 74.41 C ATOM 360 OG1 THR A 47 -13.324 0.292 28.901 1.00 86.40 O ATOM 361 CG2 THR A 47 -11.887 1.855 30.027 1.00 81.85 C ATOM 0 H THR A 47 -10.989 0.439 26.394 1.00 82.34 H new ATOM 0 HA THR A 47 -12.837 2.181 27.376 1.00 84.06 H new ATOM 0 HB THR A 47 -11.331 0.298 28.839 1.00 74.41 H new ATOM 0 HG1 THR A 47 -13.373 -0.145 29.617 1.00 86.40 H new ATOM 0 HG21 THR A 47 -11.933 1.329 30.841 1.00 81.85 H new ATOM 0 HG22 THR A 47 -11.027 2.301 29.978 1.00 81.85 H new ATOM 0 HG23 THR A 47 -12.595 2.518 30.031 1.00 81.85 H new ATOM 362 N PRO A 48 -11.290 4.073 27.813 1.00 88.48 N ATOM 363 CA PRO A 48 -10.290 5.149 27.850 1.00 87.80 C ATOM 364 C PRO A 48 -9.398 5.004 29.070 1.00 93.35 C ATOM 365 O PRO A 48 -9.843 4.453 30.081 1.00 94.52 O ATOM 366 CB PRO A 48 -11.135 6.427 27.930 1.00 88.34 C ATOM 367 CG PRO A 48 -12.523 6.013 27.557 1.00 92.50 C ATOM 368 CD PRO A 48 -12.652 4.593 28.013 1.00 90.35 C ATOM 0 HA PRO A 48 -9.696 5.144 27.083 1.00 87.80 H new ATOM 0 HB2 PRO A 48 -11.112 6.806 28.823 1.00 88.34 H new ATOM 0 HB3 PRO A 48 -10.799 7.106 27.325 1.00 88.34 H new ATOM 0 HG2 PRO A 48 -13.184 6.579 27.986 1.00 92.50 H new ATOM 0 HG3 PRO A 48 -12.664 6.087 26.600 1.00 92.50 H new ATOM 0 HD2 PRO A 48 -12.929 4.535 28.941 1.00 90.35 H new ATOM 0 HD3 PRO A 48 -13.306 4.103 27.491 1.00 90.35 H new ATOM 369 N ILE A 49 -8.158 5.470 28.981 1.00 89.38 N ATOM 370 CA ILE A 49 -7.223 5.270 30.080 1.00 94.28 C ATOM 371 C ILE A 49 -7.302 6.427 31.066 1.00104.74 C ATOM 372 O ILE A 49 -7.452 6.213 32.275 1.00106.29 O ATOM 373 CB ILE A 49 -5.788 5.087 29.565 1.00 96.63 C ATOM 374 CG1 ILE A 49 -5.604 3.632 29.111 1.00 93.26 C ATOM 375 CG2 ILE A 49 -4.775 5.452 30.645 1.00 84.32 C ATOM 376 CD1 ILE A 49 -4.258 3.324 28.493 1.00 89.56 C ATOM 0 H ILE A 49 -7.842 5.898 28.305 1.00 89.38 H new ATOM 0 HA ILE A 49 -7.475 4.456 30.543 1.00 94.28 H new ATOM 0 HB ILE A 49 -5.637 5.680 28.812 1.00 96.63 H new ATOM 0 HG12 ILE A 49 -5.736 3.049 29.875 1.00 93.26 H new ATOM 0 HG13 ILE A 49 -6.298 3.417 28.468 1.00 93.26 H new ATOM 0 HG21 ILE A 49 -3.876 5.330 30.301 1.00 84.32 H new ATOM 0 HG22 ILE A 49 -4.898 6.378 30.905 1.00 84.32 H new ATOM 0 HG23 ILE A 49 -4.905 4.880 31.418 1.00 84.32 H new ATOM 0 HD11 ILE A 49 -4.226 2.389 28.236 1.00 89.56 H new ATOM 0 HD12 ILE A 49 -4.127 3.879 27.709 1.00 89.56 H new ATOM 0 HD13 ILE A 49 -3.556 3.506 29.138 1.00 89.56 H new ATOM 377 N GLY A 50 -7.236 7.649 30.543 1.00106.24 N ATOM 378 CA GLY A 50 -7.454 8.835 31.349 1.00105.55 C ATOM 379 C GLY A 50 -8.908 8.977 31.769 1.00107.63 C ATOM 380 O GLY A 50 -9.649 7.989 31.862 1.00 96.71 O ATOM 0 H GLY A 50 -7.064 7.808 29.716 1.00106.24 H new ATOM 0 HA2 GLY A 50 -6.892 8.796 32.139 1.00105.55 H new ATOM 0 HA3 GLY A 50 -7.185 9.620 30.847 1.00105.55 H new ATOM 381 N ASP A 51 -9.319 10.212 32.035 1.00107.58 N ATOM 382 CA ASP A 51 -10.685 10.471 32.468 1.00105.65 C ATOM 383 C ASP A 51 -11.216 11.689 31.757 1.00104.31 C ATOM 384 O ASP A 51 -12.335 12.133 32.008 1.00110.24 O ATOM 385 CB ASP A 51 -10.751 10.658 33.983 1.00102.67 C ATOM 386 CG ASP A 51 -10.362 9.402 34.733 1.00108.15 C ATOM 387 OD1 ASP A 51 -11.232 8.518 34.898 1.00113.16 O ATOM 388 OD2 ASP A 51 -9.184 9.293 35.142 1.00104.09 O ATOM 0 H ASP A 51 -8.823 10.912 31.971 1.00107.58 H new ATOM 0 HA ASP A 51 -11.237 9.706 32.242 1.00105.65 H new ATOM 0 HB2 ASP A 51 -10.162 11.383 34.243 1.00102.67 H new ATOM 0 HB3 ASP A 51 -11.651 10.918 34.236 1.00102.67 H new ATOM 389 N GLY A 52 -10.397 12.218 30.857 1.00103.79 N ATOM 390 CA GLY A 52 -10.774 13.365 30.062 1.00 99.64 C ATOM 391 C GLY A 52 -11.990 13.131 29.188 1.00100.55 C ATOM 392 O GLY A 52 -12.515 12.020 29.083 1.00 92.19 O ATOM 0 H GLY A 52 -9.608 11.918 30.694 1.00103.79 H new ATOM 0 HA2 GLY A 52 -10.950 14.114 30.653 1.00 99.64 H new ATOM 0 HA3 GLY A 52 -10.026 13.618 29.499 1.00 99.64 H new ATOM 393 N PRO A 53 -12.451 14.197 28.544 1.00101.20 N ATOM 394 CA PRO A 53 -13.612 14.093 27.667 1.00103.46 C ATOM 395 C PRO A 53 -13.285 13.253 26.433 1.00109.78 C ATOM 396 O PRO A 53 -12.323 13.556 25.716 1.00102.67 O ATOM 397 CB PRO A 53 -13.896 15.550 27.295 1.00102.23 C ATOM 398 CG PRO A 53 -12.560 16.220 27.383 1.00101.96 C ATOM 399 CD PRO A 53 -11.813 15.524 28.485 1.00100.64 C ATOM 0 HA PRO A 53 -14.372 13.656 28.082 1.00103.46 H new ATOM 0 HB2 PRO A 53 -14.270 15.621 26.403 1.00102.23 H new ATOM 0 HB3 PRO A 53 -14.535 15.953 27.903 1.00102.23 H new ATOM 0 HG2 PRO A 53 -12.081 16.150 26.542 1.00101.96 H new ATOM 0 HG3 PRO A 53 -12.659 17.166 27.575 1.00101.96 H new ATOM 0 HD2 PRO A 53 -10.866 15.457 28.288 1.00100.64 H new ATOM 0 HD3 PRO A 53 -11.895 15.998 29.327 1.00100.64 H new ATOM 400 N VAL A 54 -14.070 12.204 26.193 1.00116.37 N ATOM 401 CA VAL A 54 -13.839 11.340 25.034 1.00109.42 C ATOM 402 C VAL A 54 -15.109 11.107 24.198 1.00104.13 C ATOM 403 O VAL A 54 -16.196 10.855 24.726 1.00101.62 O ATOM 404 CB VAL A 54 -13.225 9.978 25.462 1.00100.04 C ATOM 405 CG1 VAL A 54 -14.254 9.085 26.176 1.00 89.19 C ATOM 406 CG2 VAL A 54 -12.625 9.283 24.253 1.00105.36 C ATOM 0 H VAL A 54 -14.738 11.976 26.685 1.00116.37 H new ATOM 0 HA VAL A 54 -13.206 11.811 24.470 1.00109.42 H new ATOM 0 HB VAL A 54 -12.518 10.149 26.104 1.00100.04 H new ATOM 0 HG11 VAL A 54 -13.836 8.247 26.427 1.00 89.19 H new ATOM 0 HG12 VAL A 54 -14.577 9.536 26.972 1.00 89.19 H new ATOM 0 HG13 VAL A 54 -14.999 8.909 25.580 1.00 89.19 H new ATOM 0 HG21 VAL A 54 -12.243 8.434 24.524 1.00105.36 H new ATOM 0 HG22 VAL A 54 -13.317 9.129 23.591 1.00105.36 H new ATOM 0 HG23 VAL A 54 -11.931 9.842 23.870 1.00105.36 H new ATOM 407 N LEU A 55 -14.950 11.204 22.880 1.00102.28 N ATOM 408 CA LEU A 55 -16.071 11.181 21.946 1.00 99.52 C ATOM 409 C LEU A 55 -16.760 9.824 21.874 1.00101.04 C ATOM 410 O LEU A 55 -16.306 8.937 21.153 1.00102.40 O ATOM 411 CB LEU A 55 -15.593 11.585 20.547 1.00100.52 C ATOM 412 CG LEU A 55 -14.943 12.963 20.384 1.00107.08 C ATOM 413 CD1 LEU A 55 -14.048 13.024 19.139 1.00 98.93 C ATOM 414 CD2 LEU A 55 -16.021 14.035 20.341 1.00102.57 C ATOM 0 H LEU A 55 -14.182 11.286 22.501 1.00102.28 H new ATOM 0 HA LEU A 55 -16.724 11.817 22.279 1.00 99.52 H new ATOM 0 HB2 LEU A 55 -14.957 10.918 20.245 1.00100.52 H new ATOM 0 HB3 LEU A 55 -16.355 11.542 19.948 1.00100.52 H new ATOM 0 HG LEU A 55 -14.369 13.124 21.149 1.00107.08 H new ATOM 0 HD11 LEU A 55 -13.654 13.907 19.067 1.00 98.93 H new ATOM 0 HD12 LEU A 55 -13.344 12.361 19.214 1.00 98.93 H new ATOM 0 HD13 LEU A 55 -14.580 12.842 18.349 1.00 98.93 H new ATOM 0 HD21 LEU A 55 -15.607 14.906 20.238 1.00102.57 H new ATOM 0 HD22 LEU A 55 -16.614 13.868 19.592 1.00102.57 H new ATOM 0 HD23 LEU A 55 -16.530 14.015 21.166 1.00102.57 H new ATOM 415 N LEU A 56 -17.848 9.658 22.621 1.00 99.61 N ATOM 416 CA LEU A 56 -18.701 8.492 22.440 1.00 94.99 C ATOM 417 C LEU A 56 -19.528 8.717 21.177 1.00 94.88 C ATOM 418 O LEU A 56 -19.982 9.829 20.911 1.00 89.28 O ATOM 419 CB LEU A 56 -19.591 8.237 23.659 1.00 98.00 C ATOM 420 CG LEU A 56 -18.946 7.541 24.869 1.00101.99 C ATOM 421 CD1 LEU A 56 -18.094 8.506 25.671 1.00105.66 C ATOM 422 CD2 LEU A 56 -19.984 6.873 25.770 1.00 95.04 C ATOM 0 H LEU A 56 -18.107 10.205 23.232 1.00 99.61 H new ATOM 0 HA LEU A 56 -18.154 7.697 22.345 1.00 94.99 H new ATOM 0 HB2 LEU A 56 -19.944 9.090 23.956 1.00 98.00 H new ATOM 0 HB3 LEU A 56 -20.347 7.701 23.372 1.00 98.00 H new ATOM 0 HG LEU A 56 -18.372 6.844 24.515 1.00101.99 H new ATOM 0 HD11 LEU A 56 -17.701 8.041 26.426 1.00105.66 H new ATOM 0 HD12 LEU A 56 -17.389 8.861 25.107 1.00105.66 H new ATOM 0 HD13 LEU A 56 -18.647 9.235 25.993 1.00105.66 H new ATOM 0 HD21 LEU A 56 -19.537 6.447 26.518 1.00 95.04 H new ATOM 0 HD22 LEU A 56 -20.603 7.542 26.102 1.00 95.04 H new ATOM 0 HD23 LEU A 56 -20.471 6.205 25.263 1.00 95.04 H new ATOM 423 N PRO A 57 -19.689 7.657 20.375 1.00100.10 N ATOM 424 CA PRO A 57 -20.207 7.737 19.014 1.00 89.03 C ATOM 425 C PRO A 57 -21.543 7.057 18.824 1.00 94.90 C ATOM 426 O PRO A 57 -22.009 6.315 19.692 1.00 94.81 O ATOM 427 CB PRO A 57 -19.156 6.972 18.239 1.00 97.56 C ATOM 428 CG PRO A 57 -18.894 5.798 19.181 1.00 94.82 C ATOM 429 CD PRO A 57 -19.034 6.356 20.600 1.00 95.57 C ATOM 0 HA PRO A 57 -20.358 8.657 18.745 1.00 89.03 H new ATOM 0 HB2 PRO A 57 -19.479 6.681 17.372 1.00 97.56 H new ATOM 0 HB3 PRO A 57 -18.358 7.501 18.082 1.00 97.56 H new ATOM 0 HG2 PRO A 57 -19.528 5.080 19.026 1.00 94.82 H new ATOM 0 HG3 PRO A 57 -18.008 5.430 19.039 1.00 94.82 H new ATOM 0 HD2 PRO A 57 -19.569 5.776 21.164 1.00 95.57 H new ATOM 0 HD3 PRO A 57 -18.172 6.457 21.034 1.00 95.57 H new ATOM 430 N ASP A 58 -22.137 7.276 17.659 1.00 95.57 N ATOM 431 CA ASP A 58 -23.342 6.554 17.287 1.00 95.24 C ATOM 432 C ASP A 58 -22.956 5.377 16.411 1.00 88.19 C ATOM 433 O ASP A 58 -21.844 5.327 15.892 1.00 88.92 O ATOM 434 CB ASP A 58 -24.330 7.478 16.576 1.00 99.15 C ATOM 435 CG ASP A 58 -24.685 8.695 17.411 1.00105.92 C ATOM 436 OD1 ASP A 58 -24.261 9.813 17.040 1.00 96.29 O ATOM 437 OD2 ASP A 58 -25.370 8.525 18.449 1.00102.30 O ATOM 0 H ASP A 58 -21.858 7.838 17.071 1.00 95.57 H new ATOM 0 HA ASP A 58 -23.785 6.224 18.084 1.00 95.24 H new ATOM 0 HB2 ASP A 58 -23.949 7.767 15.732 1.00 99.15 H new ATOM 0 HB3 ASP A 58 -25.139 6.984 16.368 1.00 99.15 H new ATOM 438 N ASN A 59 -23.876 4.431 16.260 1.00 87.39 N ATOM 439 CA ASN A 59 -23.595 3.176 15.570 1.00 82.25 C ATOM 440 C ASN A 59 -23.090 3.330 14.141 1.00 93.13 C ATOM 441 O ASN A 59 -23.857 3.623 13.225 1.00100.82 O ATOM 442 CB ASN A 59 -24.842 2.297 15.558 1.00 84.06 C ATOM 443 CG ASN A 59 -25.166 1.726 16.922 1.00 85.46 C ATOM 444 OD1 ASN A 59 -24.633 2.174 17.943 1.00 78.08 O ATOM 445 ND2 ASN A 59 -26.046 0.727 16.947 1.00 82.62 N ATOM 0 H ASN A 59 -24.681 4.498 16.554 1.00 87.39 H new ATOM 0 HA ASN A 59 -22.874 2.767 16.073 1.00 82.25 H new ATOM 0 HB2 ASN A 59 -25.597 2.817 15.241 1.00 84.06 H new ATOM 0 HB3 ASN A 59 -24.715 1.570 14.929 1.00 84.06 H new ATOM 0 HD21 ASN A 59 -26.265 0.366 17.696 1.00 82.62 H new ATOM 0 HD22 ASN A 59 -26.395 0.443 16.214 1.00 82.62 H new ATOM 446 N HIS A 60 -21.793 3.122 13.954 1.00 89.19 N ATOM 447 CA HIS A 60 -21.225 3.086 12.619 1.00 84.66 C ATOM 448 C HIS A 60 -20.364 1.843 12.479 1.00 88.76 C ATOM 449 O HIS A 60 -20.373 0.964 13.352 1.00 78.68 O ATOM 450 CB HIS A 60 -20.410 4.350 12.333 1.00 82.56 C ATOM 451 CG HIS A 60 -19.209 4.521 13.212 1.00 77.94 C ATOM 452 ND1 HIS A 60 -19.302 4.806 14.557 1.00 84.41 N ATOM 453 CD2 HIS A 60 -17.886 4.473 12.930 1.00 80.31 C ATOM 454 CE1 HIS A 60 -18.088 4.913 15.068 1.00 85.33 C ATOM 455 NE2 HIS A 60 -17.210 4.718 14.101 1.00 74.92 N ATOM 0 H HIS A 60 -21.226 3.000 14.589 1.00 89.19 H new ATOM 0 HA HIS A 60 -21.944 3.054 11.968 1.00 84.66 H new ATOM 0 HB2 HIS A 60 -20.121 4.333 11.407 1.00 82.56 H new ATOM 0 HB3 HIS A 60 -20.986 5.124 12.436 1.00 82.56 H new ATOM 0 HD1 HIS A 60 -20.036 4.900 14.996 1.00 84.41 H new ATOM 0 HD2 HIS A 60 -17.505 4.305 12.098 1.00 80.31 H new ATOM 0 HE1 HIS A 60 -17.886 5.095 15.957 1.00 85.33 H new ATOM 456 N TYR A 61 -19.624 1.761 11.377 1.00 85.43 N ATOM 457 CA TYR A 61 -18.679 0.674 11.223 1.00 78.50 C ATOM 458 C TYR A 61 -17.369 1.147 10.614 1.00 80.58 C ATOM 459 O TYR A 61 -17.306 2.193 9.962 1.00 75.95 O ATOM 460 CB TYR A 61 -19.282 -0.448 10.379 1.00 73.52 C ATOM 461 CG TYR A 61 -19.579 -0.070 8.950 1.00 89.66 C ATOM 462 CD1 TYR A 61 -18.563 -0.025 7.996 1.00 86.84 C ATOM 463 CD2 TYR A 61 -20.879 0.220 8.541 1.00 88.97 C ATOM 464 CE1 TYR A 61 -18.827 0.320 6.688 1.00 87.64 C ATOM 465 CE2 TYR A 61 -21.157 0.561 7.224 1.00 81.30 C ATOM 466 CZ TYR A 61 -20.126 0.607 6.302 1.00 92.69 C ATOM 467 OH TYR A 61 -20.378 0.942 4.983 1.00 99.32 O ATOM 0 H TYR A 61 -19.656 2.316 10.721 1.00 85.43 H new ATOM 0 HA TYR A 61 -18.485 0.331 12.109 1.00 78.50 H new ATOM 0 HB2 TYR A 61 -18.672 -1.202 10.381 1.00 73.52 H new ATOM 0 HB3 TYR A 61 -20.104 -0.747 10.799 1.00 73.52 H new ATOM 0 HD1 TYR A 61 -17.692 -0.231 8.247 1.00 86.84 H new ATOM 0 HD2 TYR A 61 -21.572 0.185 9.160 1.00 88.97 H new ATOM 0 HE1 TYR A 61 -18.136 0.360 6.067 1.00 87.64 H new ATOM 0 HE2 TYR A 61 -22.028 0.757 6.964 1.00 81.30 H new ATOM 0 HH TYR A 61 -21.199 1.090 4.883 1.00 99.32 H new ATOM 468 N LEU A 62 -16.321 0.366 10.844 1.00 75.26 N ATOM 469 CA LEU A 62 -15.061 0.577 10.160 1.00 70.59 C ATOM 470 C LEU A 62 -14.993 -0.372 8.975 1.00 71.48 C ATOM 471 O LEU A 62 -15.544 -1.476 9.018 1.00 72.36 O ATOM 472 CB LEU A 62 -13.879 0.352 11.099 1.00 70.02 C ATOM 473 CG LEU A 62 -13.768 1.295 12.293 1.00 65.31 C ATOM 474 CD1 LEU A 62 -12.634 0.858 13.201 1.00 61.09 C ATOM 475 CD2 LEU A 62 -13.564 2.731 11.816 1.00 72.72 C ATOM 0 H LEU A 62 -16.323 -0.294 11.396 1.00 75.26 H new ATOM 0 HA LEU A 62 -15.011 1.495 9.852 1.00 70.59 H new ATOM 0 HB2 LEU A 62 -13.926 -0.557 11.434 1.00 70.02 H new ATOM 0 HB3 LEU A 62 -13.062 0.421 10.581 1.00 70.02 H new ATOM 0 HG LEU A 62 -14.594 1.260 12.800 1.00 65.31 H new ATOM 0 HD11 LEU A 62 -12.572 1.464 13.956 1.00 61.09 H new ATOM 0 HD12 LEU A 62 -12.804 -0.042 13.522 1.00 61.09 H new ATOM 0 HD13 LEU A 62 -11.800 0.872 12.707 1.00 61.09 H new ATOM 0 HD21 LEU A 62 -13.495 3.320 12.583 1.00 72.72 H new ATOM 0 HD22 LEU A 62 -12.749 2.786 11.293 1.00 72.72 H new ATOM 0 HD23 LEU A 62 -14.318 3.001 11.269 1.00 72.72 H new ATOM 476 N SER A 63 -14.336 0.072 7.912 1.00 64.89 N ATOM 477 CA SER A 63 -14.179 -0.750 6.724 1.00 65.09 C ATOM 478 C SER A 63 -12.702 -1.029 6.472 1.00 66.92 C ATOM 479 O SER A 63 -11.907 -0.112 6.221 1.00 66.17 O ATOM 480 CB SER A 63 -14.810 -0.077 5.512 1.00 60.99 C ATOM 481 OG SER A 63 -14.644 -0.897 4.369 1.00 78.53 O ATOM 0 H SER A 63 -13.973 0.850 7.859 1.00 64.89 H new ATOM 0 HA SER A 63 -14.636 -1.593 6.871 1.00 65.09 H new ATOM 0 HB2 SER A 63 -15.753 0.080 5.673 1.00 60.99 H new ATOM 0 HB3 SER A 63 -14.399 0.789 5.362 1.00 60.99 H new ATOM 0 HG SER A 63 -14.994 -0.524 3.703 1.00 78.53 H new ATOM 482 N THR A 64 -12.342 -2.306 6.530 1.00 59.26 N ATOM 483 CA THR A 64 -10.946 -2.685 6.586 1.00 59.80 C ATOM 484 C THR A 64 -10.536 -3.609 5.446 1.00 58.35 C ATOM 485 O THR A 64 -11.228 -4.579 5.136 1.00 56.62 O ATOM 486 CB THR A 64 -10.616 -3.394 7.932 1.00 68.19 C ATOM 487 OG1 THR A 64 -11.430 -2.859 8.991 1.00 66.08 O ATOM 488 CG2 THR A 64 -9.127 -3.251 8.267 1.00 56.16 C ATOM 0 H THR A 64 -12.894 -2.965 6.538 1.00 59.26 H new ATOM 0 HA THR A 64 -10.446 -1.858 6.506 1.00 59.80 H new ATOM 0 HB THR A 64 -10.815 -4.339 7.840 1.00 68.19 H new ATOM 0 HG1 THR A 64 -11.245 -3.249 9.711 1.00 66.08 H new ATOM 0 HG21 THR A 64 -8.940 -3.698 9.107 1.00 56.16 H new ATOM 0 HG22 THR A 64 -8.596 -3.654 7.562 1.00 56.16 H new ATOM 0 HG23 THR A 64 -8.901 -2.311 8.344 1.00 56.16 H new ATOM 489 N GLN A 65 -9.390 -3.299 4.851 1.00 51.21 N ATOM 490 CA GLN A 65 -8.772 -4.141 3.856 1.00 51.00 C ATOM 491 C GLN A 65 -7.351 -4.407 4.284 1.00 57.87 C ATOM 492 O GLN A 65 -6.645 -3.483 4.692 1.00 62.48 O ATOM 493 CB GLN A 65 -8.775 -3.480 2.480 1.00 57.00 C ATOM 494 CG GLN A 65 -10.121 -3.373 1.784 1.00 55.50 C ATOM 495 CD GLN A 65 -9.991 -2.715 0.411 1.00 64.33 C ATOM 496 OE1 GLN A 65 -10.061 -1.494 0.287 1.00 61.96 O ATOM 497 NE2 GLN A 65 -9.794 -3.533 -0.629 1.00 75.53 N ATOM 0 H GLN A 65 -8.948 -2.581 5.021 1.00 51.21 H new ATOM 0 HA GLN A 65 -9.275 -4.967 3.785 1.00 51.00 H new ATOM 0 HB2 GLN A 65 -8.408 -2.587 2.571 1.00 57.00 H new ATOM 0 HB3 GLN A 65 -8.173 -3.976 1.903 1.00 57.00 H new ATOM 0 HG2 GLN A 65 -10.506 -4.258 1.685 1.00 55.50 H new ATOM 0 HG3 GLN A 65 -10.731 -2.858 2.335 1.00 55.50 H new ATOM 0 HE21 GLN A 65 -9.750 -4.383 -0.505 1.00 75.53 H new ATOM 0 HE22 GLN A 65 -9.711 -3.209 -1.421 1.00 75.53 H new ATOM 498 N SER A 66 -6.917 -5.656 4.155 1.00 55.80 N ATOM 499 CA SER A 66 -5.591 -6.050 4.601 1.00 51.15 C ATOM 500 C SER A 66 -4.807 -6.685 3.467 1.00 58.08 C ATOM 501 O SER A 66 -5.362 -7.463 2.682 1.00 63.11 O ATOM 502 CB SER A 66 -5.688 -7.035 5.778 1.00 56.43 C ATOM 503 OG SER A 66 -6.762 -6.698 6.647 1.00 55.53 O ATOM 0 H SER A 66 -7.380 -6.293 3.809 1.00 55.80 H new ATOM 0 HA SER A 66 -5.126 -5.251 4.894 1.00 51.15 H new ATOM 0 HB2 SER A 66 -5.814 -7.935 5.439 1.00 56.43 H new ATOM 0 HB3 SER A 66 -4.855 -7.032 6.274 1.00 56.43 H new ATOM 0 HG SER A 66 -6.537 -6.050 7.132 1.00 55.53 H new ATOM 504 N VAL A 67 -3.519 -6.353 3.388 1.00 51.25 N ATOM 505 CA VAL A 67 -2.598 -7.011 2.472 1.00 49.69 C ATOM 506 C VAL A 67 -1.466 -7.624 3.262 1.00 52.30 C ATOM 507 O VAL A 67 -0.828 -6.938 4.066 1.00 49.15 O ATOM 508 CB VAL A 67 -1.987 -6.038 1.439 1.00 55.40 C ATOM 509 CG1 VAL A 67 -1.052 -6.782 0.516 1.00 51.90 C ATOM 510 CG2 VAL A 67 -3.053 -5.348 0.669 1.00 51.66 C ATOM 0 H VAL A 67 -3.157 -5.737 3.867 1.00 51.25 H new ATOM 0 HA VAL A 67 -3.107 -7.682 1.992 1.00 49.69 H new ATOM 0 HB VAL A 67 -1.479 -5.361 1.913 1.00 55.40 H new ATOM 0 HG11 VAL A 67 -0.673 -6.164 -0.129 1.00 51.90 H new ATOM 0 HG12 VAL A 67 -0.338 -7.185 1.034 1.00 51.90 H new ATOM 0 HG13 VAL A 67 -1.543 -7.476 0.048 1.00 51.90 H new ATOM 0 HG21 VAL A 67 -2.649 -4.743 0.027 1.00 51.66 H new ATOM 0 HG22 VAL A 67 -3.590 -6.005 0.199 1.00 51.66 H new ATOM 0 HG23 VAL A 67 -3.617 -4.845 1.277 1.00 51.66 H new ATOM 511 N LEU A 68 -1.204 -8.903 3.015 1.00 50.77 N ATOM 512 CA LEU A 68 -0.159 -9.628 3.724 1.00 55.30 C ATOM 513 C LEU A 68 0.944 -10.108 2.794 1.00 61.05 C ATOM 514 O LEU A 68 0.708 -10.916 1.892 1.00 75.25 O ATOM 515 CB LEU A 68 -0.757 -10.827 4.461 1.00 60.27 C ATOM 516 CG LEU A 68 -1.500 -10.650 5.781 1.00 52.58 C ATOM 517 CD1 LEU A 68 -2.768 -9.817 5.630 1.00 50.81 C ATOM 518 CD2 LEU A 68 -1.820 -12.031 6.299 1.00 54.77 C ATOM 0 H LEU A 68 -1.627 -9.373 2.432 1.00 50.77 H new ATOM 0 HA LEU A 68 0.235 -9.009 4.358 1.00 55.30 H new ATOM 0 HB2 LEU A 68 -1.370 -11.261 3.847 1.00 60.27 H new ATOM 0 HB3 LEU A 68 -0.032 -11.450 4.625 1.00 60.27 H new ATOM 0 HG LEU A 68 -0.940 -10.163 6.406 1.00 52.58 H new ATOM 0 HD11 LEU A 68 -3.204 -9.732 6.492 1.00 50.81 H new ATOM 0 HD12 LEU A 68 -2.539 -8.936 5.296 1.00 50.81 H new ATOM 0 HD13 LEU A 68 -3.369 -10.252 5.005 1.00 50.81 H new ATOM 0 HD21 LEU A 68 -2.295 -11.959 7.142 1.00 54.77 H new ATOM 0 HD22 LEU A 68 -2.375 -12.498 5.655 1.00 54.77 H new ATOM 0 HD23 LEU A 68 -0.996 -12.525 6.434 1.00 54.77 H new ATOM 519 N SER A 69 2.158 -9.636 3.015 1.00 59.35 N ATOM 520 CA SER A 69 3.257 -10.019 2.140 1.00 62.86 C ATOM 521 C SER A 69 4.483 -10.446 2.923 1.00 69.47 C ATOM 522 O SER A 69 4.515 -10.374 4.150 1.00 69.41 O ATOM 523 CB SER A 69 3.622 -8.868 1.190 1.00 62.84 C ATOM 524 OG SER A 69 3.628 -7.608 1.856 1.00 72.21 O ATOM 0 H SER A 69 2.368 -9.101 3.655 1.00 59.35 H new ATOM 0 HA SER A 69 2.954 -10.780 1.620 1.00 62.86 H new ATOM 0 HB2 SER A 69 4.496 -9.033 0.804 1.00 62.84 H new ATOM 0 HB3 SER A 69 2.988 -8.842 0.456 1.00 62.84 H new ATOM 0 HG SER A 69 3.832 -7.003 1.310 1.00 72.21 H new ATOM 525 N LYS A 70 5.494 -10.891 2.191 1.00 75.11 N ATOM 526 CA LYS A 70 6.782 -11.205 2.768 1.00 60.48 C ATOM 527 C LYS A 70 7.842 -10.244 2.253 1.00 75.54 C ATOM 528 O LYS A 70 7.629 -9.537 1.262 1.00 74.03 O ATOM 529 CB LYS A 70 7.177 -12.637 2.448 1.00 55.20 C ATOM 530 CG LYS A 70 6.268 -13.692 3.058 1.00 67.44 C ATOM 531 CD LYS A 70 6.353 -13.706 4.572 1.00 65.28 C ATOM 532 CE LYS A 70 5.656 -14.921 5.177 1.00 63.30 C ATOM 533 NZ LYS A 70 5.501 -14.753 6.667 1.00 60.64 N ATOM 0 H LYS A 70 5.448 -11.019 1.342 1.00 75.11 H new ATOM 0 HA LYS A 70 6.715 -11.110 3.731 1.00 60.48 H new ATOM 0 HB2 LYS A 70 7.185 -12.751 1.485 1.00 55.20 H new ATOM 0 HB3 LYS A 70 8.083 -12.788 2.759 1.00 55.20 H new ATOM 0 HG2 LYS A 70 5.352 -13.524 2.788 1.00 67.44 H new ATOM 0 HG3 LYS A 70 6.510 -14.566 2.713 1.00 67.44 H new ATOM 0 HD2 LYS A 70 7.285 -13.702 4.842 1.00 65.28 H new ATOM 0 HD3 LYS A 70 5.952 -12.896 4.924 1.00 65.28 H new ATOM 0 HE2 LYS A 70 4.785 -15.038 4.767 1.00 63.30 H new ATOM 0 HE3 LYS A 70 6.169 -15.722 4.988 1.00 63.30 H new ATOM 0 HZ1 LYS A 70 6.031 -15.331 7.088 1.00 60.64 H new ATOM 0 HZ2 LYS A 70 5.726 -13.923 6.897 1.00 60.64 H new ATOM 0 HZ3 LYS A 70 4.655 -14.905 6.897 1.00 60.64 H new ATOM 534 N ASP A 71 8.972 -10.229 2.963 1.00 83.55 N ATOM 535 CA ASP A 71 10.192 -9.491 2.622 1.00 77.89 C ATOM 536 C ASP A 71 11.228 -10.543 2.250 1.00 76.23 C ATOM 537 O ASP A 71 11.702 -11.262 3.123 1.00 78.93 O ATOM 538 CB ASP A 71 10.643 -8.635 3.816 1.00 74.20 C ATOM 539 CG ASP A 71 12.030 -8.010 3.644 1.00 86.86 C ATOM 540 OD1 ASP A 71 12.753 -8.307 2.659 1.00 85.17 O ATOM 541 OD2 ASP A 71 12.393 -7.201 4.536 1.00 82.31 O ATOM 0 H ASP A 71 9.052 -10.673 3.695 1.00 83.55 H new ATOM 0 HA ASP A 71 10.055 -8.876 1.884 1.00 77.89 H new ATOM 0 HB2 ASP A 71 9.995 -7.928 3.958 1.00 74.20 H new ATOM 0 HB3 ASP A 71 10.643 -9.185 4.615 1.00 74.20 H new ATOM 542 N PRO A 72 11.587 -10.628 0.957 1.00 84.55 N ATOM 543 CA PRO A 72 12.370 -11.755 0.415 1.00 86.80 C ATOM 544 C PRO A 72 13.769 -11.857 1.033 1.00 76.52 C ATOM 545 O PRO A 72 14.340 -12.946 1.131 1.00 71.05 O ATOM 546 CB PRO A 72 12.458 -11.443 -1.088 1.00 74.77 C ATOM 547 CG PRO A 72 11.496 -10.303 -1.328 1.00 87.29 C ATOM 548 CD PRO A 72 11.411 -9.556 -0.036 1.00 82.77 C ATOM 0 HA PRO A 72 11.953 -12.609 0.611 1.00 86.80 H new ATOM 0 HB2 PRO A 72 13.361 -11.195 -1.340 1.00 74.77 H new ATOM 0 HB3 PRO A 72 12.218 -12.218 -1.619 1.00 74.77 H new ATOM 0 HG2 PRO A 72 11.811 -9.727 -2.042 1.00 87.29 H new ATOM 0 HG3 PRO A 72 10.625 -10.635 -1.595 1.00 87.29 H new ATOM 0 HD2 PRO A 72 12.101 -8.878 0.037 1.00 82.77 H new ATOM 0 HD3 PRO A 72 10.559 -9.105 0.066 1.00 82.77 H new ATOM 549 N ASN A 73 14.308 -10.717 1.441 1.00 69.81 N ATOM 550 CA ASN A 73 15.545 -10.689 2.198 1.00 78.97 C ATOM 551 C ASN A 73 15.399 -11.364 3.565 1.00 88.25 C ATOM 552 O ASN A 73 15.933 -12.455 3.779 1.00 86.41 O ATOM 553 CB ASN A 73 16.013 -9.249 2.381 1.00 86.60 C ATOM 554 CG ASN A 73 16.147 -8.509 1.066 1.00 89.75 C ATOM 555 OD1 ASN A 73 15.647 -7.397 0.922 1.00 93.86 O ATOM 556 ND2 ASN A 73 16.823 -9.125 0.097 1.00 84.26 N ATOM 0 H ASN A 73 13.968 -9.942 1.287 1.00 69.81 H new ATOM 0 HA ASN A 73 16.206 -11.188 1.692 1.00 78.97 H new ATOM 0 HB2 ASN A 73 15.385 -8.778 2.951 1.00 86.60 H new ATOM 0 HB3 ASN A 73 16.868 -9.246 2.839 1.00 86.60 H new ATOM 0 HD21 ASN A 73 16.923 -8.743 -0.667 1.00 84.26 H new ATOM 0 HD22 ASN A 73 17.159 -9.904 0.236 1.00 84.26 H new ATOM 557 N GLU A 74 14.670 -10.700 4.469 1.00 84.55 N ATOM 558 CA GLU A 74 14.424 -11.145 5.849 1.00 80.15 C ATOM 559 C GLU A 74 14.210 -12.653 6.038 1.00 78.26 C ATOM 560 O GLU A 74 13.368 -13.259 5.374 1.00 71.90 O ATOM 561 CB GLU A 74 13.213 -10.393 6.400 1.00 82.68 C ATOM 562 CG GLU A 74 12.751 -10.847 7.762 1.00 73.12 C ATOM 563 CD GLU A 74 13.845 -10.770 8.791 1.00 72.24 C ATOM 564 OE1 GLU A 74 14.131 -9.650 9.271 1.00 64.46 O ATOM 565 OE2 GLU A 74 14.411 -11.835 9.117 1.00 72.28 O ATOM 0 H GLU A 74 14.291 -9.950 4.289 1.00 84.55 H new ATOM 0 HA GLU A 74 15.240 -10.945 6.334 1.00 80.15 H new ATOM 0 HB2 GLU A 74 13.428 -9.448 6.444 1.00 82.68 H new ATOM 0 HB3 GLU A 74 12.477 -10.488 5.775 1.00 82.68 H new ATOM 0 HG2 GLU A 74 12.003 -10.299 8.047 1.00 73.12 H new ATOM 0 HG3 GLU A 74 12.428 -11.760 7.704 1.00 73.12 H new ATOM 566 N LYS A 75 14.973 -13.234 6.967 1.00 79.40 N ATOM 567 CA LYS A 75 15.063 -14.687 7.144 1.00 74.58 C ATOM 568 C LYS A 75 14.310 -15.179 8.380 1.00 81.61 C ATOM 569 O LYS A 75 13.912 -16.350 8.455 1.00 81.20 O ATOM 570 CB LYS A 75 16.535 -15.117 7.244 1.00 78.80 C ATOM 571 CG LYS A 75 17.323 -15.049 5.949 1.00 89.08 C ATOM 572 CD LYS A 75 17.035 -16.262 5.055 1.00 95.95 C ATOM 573 CE LYS A 75 17.574 -16.078 3.637 1.00 90.29 C ATOM 574 NZ LYS A 75 16.799 -15.064 2.862 1.00 84.25 N ATOM 0 H LYS A 75 15.459 -12.789 7.520 1.00 79.40 H new ATOM 0 HA LYS A 75 14.646 -15.089 6.366 1.00 74.58 H new ATOM 0 HB2 LYS A 75 16.975 -14.557 7.903 1.00 78.80 H new ATOM 0 HB3 LYS A 75 16.568 -16.027 7.578 1.00 78.80 H new ATOM 0 HG2 LYS A 75 17.098 -14.234 5.474 1.00 89.08 H new ATOM 0 HG3 LYS A 75 18.272 -15.009 6.147 1.00 89.08 H new ATOM 0 HD2 LYS A 75 17.433 -17.054 5.450 1.00 95.95 H new ATOM 0 HD3 LYS A 75 16.078 -16.414 5.018 1.00 95.95 H new ATOM 0 HE2 LYS A 75 18.504 -15.807 3.680 1.00 90.29 H new ATOM 0 HE3 LYS A 75 17.547 -16.928 3.170 1.00 90.29 H new ATOM 0 HZ1 LYS A 75 17.187 -14.934 2.072 1.00 84.25 H new ATOM 0 HZ2 LYS A 75 15.967 -15.356 2.740 1.00 84.25 H new ATOM 0 HZ3 LYS A 75 16.780 -14.297 3.312 1.00 84.25 H new ATOM 575 N ARG A 76 14.137 -14.297 9.362 1.00 77.29 N ATOM 576 CA ARG A 76 13.326 -14.628 10.531 1.00 77.90 C ATOM 577 C ARG A 76 11.876 -14.837 10.110 1.00 69.05 C ATOM 578 O ARG A 76 11.486 -14.450 9.008 1.00 67.28 O ATOM 579 CB ARG A 76 13.411 -13.530 11.585 1.00 72.57 C ATOM 580 CG ARG A 76 14.818 -13.255 12.078 1.00 63.29 C ATOM 581 CD ARG A 76 14.893 -11.951 12.864 1.00 58.82 C ATOM 582 NE ARG A 76 14.942 -10.800 11.970 1.00 65.46 N ATOM 583 CZ ARG A 76 14.815 -9.543 12.379 1.00 75.99 C ATOM 584 NH1 ARG A 76 14.625 -9.287 13.672 1.00 77.09 N ATOM 585 NH2 ARG A 76 14.874 -8.543 11.503 1.00 70.51 N ATOM 0 H ARG A 76 14.478 -13.507 9.371 1.00 77.29 H new ATOM 0 HA ARG A 76 13.670 -15.447 10.920 1.00 77.90 H new ATOM 0 HB2 ARG A 76 13.042 -12.712 11.217 1.00 72.57 H new ATOM 0 HB3 ARG A 76 12.856 -13.777 12.341 1.00 72.57 H new ATOM 0 HG2 ARG A 76 15.114 -13.989 12.639 1.00 63.29 H new ATOM 0 HG3 ARG A 76 15.424 -13.213 11.322 1.00 63.29 H new ATOM 0 HD2 ARG A 76 14.122 -11.878 13.448 1.00 58.82 H new ATOM 0 HD3 ARG A 76 15.680 -11.957 13.431 1.00 58.82 H new ATOM 0 HE ARG A 76 15.060 -10.943 11.130 1.00 65.46 H new ATOM 0 HH11 ARG A 76 14.585 -9.934 14.237 1.00 77.09 H new ATOM 0 HH12 ARG A 76 14.542 -8.475 13.942 1.00 77.09 H new ATOM 0 HH21 ARG A 76 14.995 -8.709 10.668 1.00 70.51 H new ATOM 0 HH22 ARG A 76 14.791 -7.730 11.772 1.00 70.51 H new ATOM 586 N ASP A 77 11.088 -15.458 10.983 1.00 70.64 N ATOM 587 CA ASP A 77 9.656 -15.614 10.742 1.00 60.07 C ATOM 588 C ASP A 77 9.025 -14.254 10.868 1.00 56.24 C ATOM 589 O ASP A 77 9.194 -13.575 11.884 1.00 61.47 O ATOM 590 CB ASP A 77 9.023 -16.587 11.721 1.00 62.81 C ATOM 591 CG ASP A 77 7.706 -17.123 11.223 1.00 75.06 C ATOM 592 OD1 ASP A 77 7.134 -16.495 10.300 1.00 67.26 O ATOM 593 OD2 ASP A 77 7.247 -18.168 11.752 1.00 78.18 O ATOM 0 H ASP A 77 11.364 -15.797 11.724 1.00 70.64 H new ATOM 0 HA ASP A 77 9.513 -15.981 9.856 1.00 60.07 H new ATOM 0 HB2 ASP A 77 9.632 -17.326 11.879 1.00 62.81 H new ATOM 0 HB3 ASP A 77 8.888 -16.144 12.573 1.00 62.81 H new ATOM 594 N HIS A 78 8.321 -13.829 9.829 1.00 57.05 N ATOM 595 CA HIS A 78 7.843 -12.451 9.805 1.00 57.51 C ATOM 596 C HIS A 78 6.567 -12.260 8.977 1.00 60.72 C ATOM 597 O HIS A 78 6.108 -13.172 8.265 1.00 58.96 O ATOM 598 CB HIS A 78 8.938 -11.533 9.270 1.00 59.71 C ATOM 599 CG HIS A 78 9.126 -11.643 7.791 1.00 66.49 C ATOM 600 ND1 HIS A 78 9.714 -12.741 7.199 1.00 66.45 N ATOM 601 CD2 HIS A 78 8.765 -10.815 6.782 1.00 59.87 C ATOM 602 CE1 HIS A 78 9.718 -12.578 5.889 1.00 67.83 C ATOM 603 NE2 HIS A 78 9.150 -11.419 5.610 1.00 68.76 N ATOM 0 H HIS A 78 8.112 -14.305 9.144 1.00 57.05 H new ATOM 0 HA HIS A 78 7.620 -12.222 10.721 1.00 57.51 H new ATOM 0 HB2 HIS A 78 8.721 -10.615 9.495 1.00 59.71 H new ATOM 0 HB3 HIS A 78 9.775 -11.744 9.713 1.00 59.71 H new ATOM 0 HD1 HIS A 78 10.028 -13.424 7.617 1.00 66.45 H new ATOM 0 HD2 HIS A 78 8.338 -9.993 6.867 1.00 59.87 H new ATOM 0 HE1 HIS A 78 10.063 -13.178 5.268 1.00 67.83 H new ATOM 604 N MET A 79 5.996 -11.064 9.080 1.00 59.60 N ATOM 605 CA MET A 79 4.842 -10.700 8.263 1.00 57.40 C ATOM 606 C MET A 79 4.897 -9.235 7.907 1.00 54.03 C ATOM 607 O MET A 79 5.044 -8.395 8.781 1.00 57.61 O ATOM 608 CB MET A 79 3.533 -11.001 8.991 1.00 57.81 C ATOM 609 CG MET A 79 2.277 -10.713 8.175 1.00 57.85 C ATOM 610 SD MET A 79 0.776 -11.003 9.131 1.00 55.18 S ATOM 611 CE MET A 79 0.805 -9.586 10.194 1.00 51.40 C ATOM 0 H MET A 79 6.262 -10.448 9.618 1.00 59.60 H new ATOM 0 HA MET A 79 4.872 -11.232 7.452 1.00 57.40 H new ATOM 0 HB2 MET A 79 3.528 -11.935 9.252 1.00 57.81 H new ATOM 0 HB3 MET A 79 3.502 -10.478 9.807 1.00 57.81 H new ATOM 0 HG2 MET A 79 2.293 -9.792 7.870 1.00 57.85 H new ATOM 0 HG3 MET A 79 2.270 -11.274 7.384 1.00 57.85 H new ATOM 0 HE1 MET A 79 -0.099 -9.257 10.320 1.00 51.40 H new ATOM 0 HE2 MET A 79 1.181 -9.833 11.053 1.00 51.40 H new ATOM 0 HE3 MET A 79 1.349 -8.891 9.792 1.00 51.40 H new ATOM 612 N VAL A 80 4.786 -8.919 6.621 1.00 61.82 N ATOM 613 CA VAL A 80 4.606 -7.528 6.232 1.00 59.56 C ATOM 614 C VAL A 80 3.131 -7.295 5.996 1.00 56.78 C ATOM 615 O VAL A 80 2.450 -8.139 5.418 1.00 60.89 O ATOM 616 CB VAL A 80 5.412 -7.149 4.989 1.00 60.28 C ATOM 617 CG1 VAL A 80 5.482 -5.625 4.872 1.00 53.94 C ATOM 618 CG2 VAL A 80 6.817 -7.732 5.076 1.00 59.33 C ATOM 0 H VAL A 80 4.812 -9.482 5.972 1.00 61.82 H new ATOM 0 HA VAL A 80 4.937 -6.963 6.948 1.00 59.56 H new ATOM 0 HB VAL A 80 4.975 -7.511 4.202 1.00 60.28 H new ATOM 0 HG11 VAL A 80 5.993 -5.384 4.084 1.00 53.94 H new ATOM 0 HG12 VAL A 80 4.585 -5.264 4.798 1.00 53.94 H new ATOM 0 HG13 VAL A 80 5.913 -5.259 5.660 1.00 53.94 H new ATOM 0 HG21 VAL A 80 7.319 -7.486 4.283 1.00 59.33 H new ATOM 0 HG22 VAL A 80 7.264 -7.383 5.863 1.00 59.33 H new ATOM 0 HG23 VAL A 80 6.763 -8.699 5.137 1.00 59.33 H new ATOM 619 N LEU A 81 2.636 -6.158 6.468 1.00 52.54 N ATOM 620 CA LEU A 81 1.208 -5.891 6.451 1.00 52.81 C ATOM 621 C LEU A 81 0.899 -4.449 6.034 1.00 58.04 C ATOM 622 O LEU A 81 1.520 -3.505 6.520 1.00 57.80 O ATOM 623 CB LEU A 81 0.623 -6.191 7.835 1.00 51.04 C ATOM 624 CG LEU A 81 -0.845 -5.931 8.171 1.00 56.47 C ATOM 625 CD1 LEU A 81 -1.761 -6.856 7.374 1.00 56.65 C ATOM 626 CD2 LEU A 81 -1.088 -6.104 9.665 1.00 55.87 C ATOM 0 H LEU A 81 3.114 -5.526 6.804 1.00 52.54 H new ATOM 0 HA LEU A 81 0.797 -6.469 5.789 1.00 52.81 H new ATOM 0 HB2 LEU A 81 0.787 -7.131 8.010 1.00 51.04 H new ATOM 0 HB3 LEU A 81 1.149 -5.688 8.476 1.00 51.04 H new ATOM 0 HG LEU A 81 -1.052 -5.016 7.925 1.00 56.47 H new ATOM 0 HD11 LEU A 81 -2.685 -6.673 7.604 1.00 56.65 H new ATOM 0 HD12 LEU A 81 -1.628 -6.705 6.425 1.00 56.65 H new ATOM 0 HD13 LEU A 81 -1.553 -7.779 7.586 1.00 56.65 H new ATOM 0 HD21 LEU A 81 -2.023 -5.936 9.863 1.00 55.87 H new ATOM 0 HD22 LEU A 81 -0.860 -7.010 9.927 1.00 55.87 H new ATOM 0 HD23 LEU A 81 -0.536 -5.477 10.158 1.00 55.87 H new ATOM 627 N LEU A 82 -0.043 -4.285 5.109 1.00 55.62 N ATOM 628 CA LEU A 82 -0.623 -2.975 4.850 1.00 51.31 C ATOM 629 C LEU A 82 -2.094 -3.004 5.212 1.00 53.91 C ATOM 630 O LEU A 82 -2.806 -3.937 4.845 1.00 58.28 O ATOM 631 CB LEU A 82 -0.455 -2.564 3.389 1.00 51.43 C ATOM 632 CG LEU A 82 0.976 -2.354 2.910 1.00 65.09 C ATOM 633 CD1 LEU A 82 1.656 -3.671 2.479 1.00 69.17 C ATOM 634 CD2 LEU A 82 0.986 -1.333 1.785 1.00 73.63 C ATOM 0 H LEU A 82 -0.358 -4.920 4.622 1.00 55.62 H new ATOM 0 HA LEU A 82 -0.157 -2.321 5.394 1.00 51.31 H new ATOM 0 HB2 LEU A 82 -0.866 -3.243 2.832 1.00 51.43 H new ATOM 0 HB3 LEU A 82 -0.949 -1.742 3.245 1.00 51.43 H new ATOM 0 HG LEU A 82 1.496 -2.017 3.656 1.00 65.09 H new ATOM 0 HD11 LEU A 82 2.561 -3.486 2.183 1.00 69.17 H new ATOM 0 HD12 LEU A 82 1.680 -4.284 3.230 1.00 69.17 H new ATOM 0 HD13 LEU A 82 1.154 -4.072 1.752 1.00 69.17 H new ATOM 0 HD21 LEU A 82 1.896 -1.198 1.479 1.00 73.63 H new ATOM 0 HD22 LEU A 82 0.442 -1.656 1.050 1.00 73.63 H new ATOM 0 HD23 LEU A 82 0.626 -0.492 2.108 1.00 73.63 H new ATOM 635 N GLU A 83 -2.553 -1.994 5.934 1.00 49.65 N ATOM 636 CA GLU A 83 -3.971 -1.896 6.248 1.00 55.57 C ATOM 637 C GLU A 83 -4.518 -0.637 5.652 1.00 59.53 C ATOM 638 O GLU A 83 -3.824 0.381 5.577 1.00 55.62 O ATOM 639 CB GLU A 83 -4.232 -1.872 7.758 1.00 53.24 C ATOM 640 CG GLU A 83 -3.676 -3.030 8.503 1.00 54.67 C ATOM 641 CD GLU A 83 -4.680 -4.132 8.671 1.00 65.62 C ATOM 642 OE1 GLU A 83 -5.012 -4.440 9.834 1.00 78.91 O ATOM 643 OE2 GLU A 83 -5.133 -4.698 7.656 1.00 57.33 O ATOM 0 H GLU A 83 -2.066 -1.359 6.250 1.00 49.65 H new ATOM 0 HA GLU A 83 -4.406 -2.680 5.879 1.00 55.57 H new ATOM 0 HB2 GLU A 83 -3.857 -1.056 8.126 1.00 53.24 H new ATOM 0 HB3 GLU A 83 -5.190 -1.837 7.908 1.00 53.24 H new ATOM 0 HG2 GLU A 83 -2.899 -3.372 8.033 1.00 54.67 H new ATOM 0 HG3 GLU A 83 -3.373 -2.735 9.376 1.00 54.67 H new ATOM 644 N APHE A 84 -5.798 -0.687 5.316 0.50 60.40 N ATOM 645 N BPHE A 84 -5.731 -0.718 5.118 0.50 60.42 N ATOM 646 CA APHE A 84 -6.495 0.458 4.772 0.50 58.35 C ATOM 647 CA BPHE A 84 -6.486 0.486 4.810 0.50 58.24 C ATOM 648 C APHE A 84 -7.875 0.528 5.425 0.50 58.24 C ATOM 649 C BPHE A 84 -7.791 0.429 5.572 0.50 58.18 C ATOM 650 O APHE A 84 -8.758 -0.273 5.110 0.50 62.02 O ATOM 651 O BPHE A 84 -8.552 -0.532 5.451 0.50 61.60 O ATOM 652 CB APHE A 84 -6.563 0.346 3.243 0.50 58.03 C ATOM 653 CB BPHE A 84 -6.767 0.668 3.313 0.50 58.59 C ATOM 654 CG APHE A 84 -5.206 0.222 2.595 0.50 53.73 C ATOM 655 CG BPHE A 84 -7.812 1.729 3.037 0.50 62.75 C ATOM 656 CD1APHE A 84 -4.571 1.330 2.074 0.50 55.46 C ATOM 657 CD1BPHE A 84 -7.483 3.071 3.089 0.50 60.61 C ATOM 658 CD2APHE A 84 -4.556 -1.003 2.534 0.50 53.43 C ATOM 659 CD2BPHE A 84 -9.137 1.379 2.787 0.50 62.15 C ATOM 660 CE1APHE A 84 -3.318 1.217 1.497 0.50 59.38 C ATOM 661 CE1BPHE A 84 -8.438 4.033 2.876 0.50 64.23 C ATOM 662 CE2APHE A 84 -3.296 -1.119 1.966 0.50 52.42 C ATOM 663 CE2BPHE A 84 -10.095 2.345 2.573 0.50 54.97 C ATOM 664 CZ APHE A 84 -2.680 -0.014 1.446 0.50 54.24 C ATOM 665 CZ BPHE A 84 -9.745 3.668 2.614 0.50 63.06 C ATOM 0 H APHE A 84 -6.286 -1.390 5.399 0.50 60.42 H new ATOM 0 H BPHE A 84 -6.131 -1.455 4.928 0.50 60.42 H new ATOM 0 HA APHE A 84 -6.025 1.284 4.967 0.50 58.24 H new ATOM 0 HA BPHE A 84 -5.948 1.248 5.076 0.50 58.24 H new ATOM 0 HB2APHE A 84 -7.100 -0.426 3.005 0.50 58.59 H new ATOM 0 HB2BPHE A 84 -5.943 0.906 2.860 0.50 58.59 H new ATOM 0 HB3APHE A 84 -7.015 1.127 2.887 0.50 58.59 H new ATOM 0 HB3BPHE A 84 -7.063 -0.177 2.939 0.50 58.59 H new ATOM 0 HD1APHE A 84 -4.988 2.160 2.111 0.50 60.61 H new ATOM 0 HD1BPHE A 84 -6.607 3.324 3.270 0.50 60.61 H new ATOM 0 HD2APHE A 84 -4.973 -1.759 2.880 0.50 62.15 H new ATOM 0 HD2BPHE A 84 -9.378 0.481 2.764 0.50 62.15 H new ATOM 0 HE1APHE A 84 -2.902 1.969 1.142 0.50 64.23 H new ATOM 0 HE1BPHE A 84 -8.205 4.933 2.908 0.50 64.23 H new ATOM 0 HE2APHE A 84 -2.871 -1.946 1.939 0.50 54.97 H new ATOM 0 HE2BPHE A 84 -10.976 2.100 2.401 0.50 54.97 H new ATOM 0 HZ APHE A 84 -1.837 -0.088 1.060 0.50 63.06 H new ATOM 0 HZ BPHE A 84 -10.388 4.323 2.465 0.50 63.06 H new ATOM 666 N VAL A 85 -8.038 1.466 6.360 1.00 56.53 N ATOM 667 CA VAL A 85 -9.248 1.561 7.178 1.00 61.76 C ATOM 668 C VAL A 85 -9.932 2.895 7.000 1.00 66.68 C ATOM 669 O VAL A 85 -9.257 3.932 7.017 1.00 66.76 O ATOM 670 CB VAL A 85 -8.953 1.420 8.693 1.00 59.41 C ATOM 671 CG1 VAL A 85 -10.247 1.109 9.459 1.00 55.47 C ATOM 672 CG2 VAL A 85 -7.892 0.383 8.948 1.00 53.33 C ATOM 0 H AVAL A 85 -7.448 2.066 6.538 0.50 56.53 H new ATOM 0 H BVAL A 85 -7.509 2.139 6.439 0.50 56.53 H new ATOM 0 HA VAL A 85 -9.813 0.832 6.877 1.00 61.76 H new ATOM 0 HB VAL A 85 -8.606 2.265 9.020 1.00 59.41 H new ATOM 0 HG11 VAL A 85 -10.051 1.023 10.405 1.00 55.47 H new ATOM 0 HG12 VAL A 85 -10.883 1.829 9.325 1.00 55.47 H new ATOM 0 HG13 VAL A 85 -10.626 0.278 9.131 1.00 55.47 H new ATOM 0 HG21 VAL A 85 -7.728 0.316 9.902 1.00 53.33 H new ATOM 0 HG22 VAL A 85 -8.191 -0.476 8.610 1.00 53.33 H new ATOM 0 HG23 VAL A 85 -7.073 0.640 8.497 1.00 53.33 H new ATOM 673 N THR A 86 -11.261 2.881 6.893 1.00 61.46 N ATOM 674 CA THR A 86 -12.015 4.123 6.757 1.00 67.27 C ATOM 675 C THR A 86 -13.430 3.937 7.331 1.00 63.99 C ATOM 676 O THR A 86 -13.977 2.844 7.255 1.00 71.36 O ATOM 677 CB THR A 86 -12.021 4.579 5.264 1.00 63.73 C ATOM 678 OG1 THR A 86 -12.404 5.949 5.169 1.00 77.27 O ATOM 679 CG2 THR A 86 -12.948 3.749 4.431 1.00 57.51 C ATOM 0 H THR A 86 -11.740 2.167 6.897 1.00 61.46 H new ATOM 0 HA THR A 86 -11.591 4.831 7.267 1.00 67.27 H new ATOM 0 HB THR A 86 -11.120 4.462 4.924 1.00 63.73 H new ATOM 0 HG1 THR A 86 -12.344 6.310 5.925 1.00 77.27 H new ATOM 0 HG21 THR A 86 -12.925 4.061 3.513 1.00 57.51 H new ATOM 0 HG22 THR A 86 -12.669 2.821 4.464 1.00 57.51 H new ATOM 0 HG23 THR A 86 -13.851 3.827 4.776 1.00 57.51 H new ATOM 680 N ALA A 87 -14.012 4.973 7.942 1.00 68.50 N ATOM 681 CA ALA A 87 -15.298 4.804 8.664 1.00 76.30 C ATOM 682 C ALA A 87 -16.540 5.147 7.820 1.00 79.62 C ATOM 683 O ALA A 87 -16.427 5.820 6.799 1.00 80.24 O ATOM 684 CB ALA A 87 -15.296 5.634 9.942 1.00 69.69 C ATOM 0 H ALA A 87 -13.692 5.771 7.956 1.00 68.50 H new ATOM 0 HA ALA A 87 -15.364 3.859 8.874 1.00 76.30 H new ATOM 0 HB1 ALA A 87 -16.140 5.517 10.406 1.00 69.69 H new ATOM 0 HB2 ALA A 87 -14.569 5.344 10.515 1.00 69.69 H new ATOM 0 HB3 ALA A 87 -15.177 6.571 9.720 1.00 69.69 H new ATOM 685 N ALA A 88 -17.722 4.709 8.260 1.00 82.24 N ATOM 686 CA ALA A 88 -18.929 4.825 7.426 1.00 82.88 C ATOM 687 C ALA A 88 -20.271 4.549 8.146 1.00 92.52 C ATOM 688 O ALA A 88 -20.431 3.528 8.824 1.00 88.08 O ATOM 689 CB ALA A 88 -18.800 3.897 6.222 1.00 73.01 C ATOM 0 H ALA A 88 -17.849 4.345 9.029 1.00 82.24 H new ATOM 0 HA ALA A 88 -18.970 5.758 7.164 1.00 82.88 H new ATOM 0 HB1 ALA A 88 -19.594 3.971 5.670 1.00 73.01 H new ATOM 0 HB2 ALA A 88 -18.021 4.148 5.702 1.00 73.01 H new ATOM 0 HB3 ALA A 88 -18.703 2.982 6.528 1.00 73.01 H new ATOM 690 N GLY A 89 -21.232 5.462 7.960 1.00 98.24 N ATOM 691 CA GLY A 89 -22.558 5.376 8.562 1.00 86.04 C ATOM 692 C GLY A 89 -23.186 6.732 8.889 1.00 95.04 C ATOM 693 O GLY A 89 -23.094 7.190 10.033 1.00 77.96 O ATOM 0 H GLY A 89 -21.124 6.160 7.470 1.00 98.24 H new ATOM 0 HA2 GLY A 89 -23.146 4.896 7.958 1.00 86.04 H new ATOM 0 HA3 GLY A 89 -22.499 4.853 9.377 1.00 86.04 H new ATOM 694 N ILE A 90 -23.805 7.368 7.882 1.00100.43 N ATOM 695 CA ILE A 90 -24.608 8.593 8.050 1.00 97.12 C ATOM 696 C ILE A 90 -25.256 9.062 6.736 1.00109.49 C ATOM 697 O ILE A 90 -25.364 10.267 6.460 1.00105.08 O ATOM 698 CB ILE A 90 -23.780 9.753 8.605 1.00 98.89 C ATOM 0 H ILE A 90 -23.769 7.094 7.068 1.00100.43 H new ATOM 0 HA ILE A 90 -25.302 8.350 8.682 1.00 97.12 H new ATOM 699 N SER A 110 -13.611 16.188 19.701 1.00120.24 N ATOM 700 CA SER A 110 -12.426 16.480 20.496 1.00122.04 C ATOM 701 C SER A 110 -11.243 16.740 19.581 1.00119.66 C ATOM 702 O SER A 110 -11.412 17.044 18.397 1.00109.35 O ATOM 703 CB SER A 110 -12.114 15.329 21.461 1.00114.56 C ATOM 0 HA SER A 110 -12.598 17.274 21.025 1.00122.04 H new ATOM 704 N LYS A 111 -10.046 16.626 20.140 1.00116.69 N ATOM 705 CA LYS A 111 -8.837 16.836 19.368 1.00112.58 C ATOM 706 C LYS A 111 -7.700 16.048 19.977 1.00115.69 C ATOM 707 O LYS A 111 -6.812 16.608 20.608 1.00116.05 O ATOM 708 CB LYS A 111 -8.484 18.323 19.300 1.00118.68 C ATOM 709 CG LYS A 111 -7.357 18.678 18.337 1.00116.85 C ATOM 710 CD LYS A 111 -6.960 20.136 18.521 1.00124.05 C ATOM 711 CE LYS A 111 -5.830 20.548 17.594 1.00120.97 C ATOM 712 NZ LYS A 111 -5.304 21.894 17.960 1.00112.14 N ATOM 0 H LYS A 111 -9.915 16.427 20.966 1.00116.69 H new ATOM 0 HA LYS A 111 -8.989 16.525 18.462 1.00112.58 H new ATOM 0 HB2 LYS A 111 -9.278 18.818 19.043 1.00118.68 H new ATOM 0 HB3 LYS A 111 -8.238 18.623 20.189 1.00118.68 H new ATOM 0 HG2 LYS A 111 -6.592 18.103 18.496 1.00116.85 H new ATOM 0 HG3 LYS A 111 -7.642 18.525 17.422 1.00116.85 H new ATOM 0 HD2 LYS A 111 -7.731 20.702 18.359 1.00124.05 H new ATOM 0 HD3 LYS A 111 -6.690 20.282 19.441 1.00124.05 H new ATOM 0 HE2 LYS A 111 -5.115 19.894 17.639 1.00120.97 H new ATOM 0 HE3 LYS A 111 -6.147 20.559 16.677 1.00120.97 H new ATOM 0 HZ1 LYS A 111 -4.644 22.116 17.406 1.00112.14 H new ATOM 0 HZ2 LYS A 111 -5.957 22.495 17.898 1.00112.14 H new ATOM 0 HZ3 LYS A 111 -4.996 21.876 18.795 1.00112.14 H new ATOM 713 N GLY A 112 -7.767 14.731 19.833 1.00111.83 N ATOM 714 CA GLY A 112 -6.586 13.905 19.972 1.00106.56 C ATOM 715 C GLY A 112 -6.124 13.763 18.540 1.00104.11 C ATOM 716 O GLY A 112 -4.982 13.405 18.243 1.00100.01 O ATOM 0 H GLY A 112 -8.489 14.299 19.655 1.00111.83 H new ATOM 0 HA2 GLY A 112 -5.913 14.326 20.530 1.00106.56 H new ATOM 0 HA3 GLY A 112 -6.790 13.046 20.374 1.00106.56 H new ATOM 717 N GLU A 113 -7.059 14.099 17.654 1.00107.41 N ATOM 718 CA GLU A 113 -6.893 14.103 16.204 1.00106.28 C ATOM 719 C GLU A 113 -5.788 15.038 15.737 1.00101.64 C ATOM 720 O GLU A 113 -5.481 15.107 14.552 1.00 94.00 O ATOM 721 CB GLU A 113 -8.219 14.504 15.558 1.00103.07 C ATOM 722 CG GLU A 113 -9.408 14.183 16.455 1.00112.94 C ATOM 723 CD GLU A 113 -10.683 14.908 16.063 1.00123.79 C ATOM 724 OE1 GLU A 113 -10.721 15.503 14.962 1.00117.99 O ATOM 725 OE2 GLU A 113 -11.648 14.875 16.864 1.00123.67 O ATOM 0 H GLU A 113 -7.847 14.343 17.896 1.00107.41 H new ATOM 0 HA GLU A 113 -6.632 13.208 15.934 1.00106.28 H new ATOM 0 HB2 GLU A 113 -8.209 15.454 15.363 1.00103.07 H new ATOM 0 HB3 GLU A 113 -8.319 14.041 14.711 1.00103.07 H new ATOM 0 HG2 GLU A 113 -9.570 13.227 16.434 1.00112.94 H new ATOM 0 HG3 GLU A 113 -9.183 14.413 17.370 1.00112.94 H new ATOM 726 N GLU A 114 -5.201 15.753 16.688 1.00108.61 N ATOM 727 CA GLU A 114 -4.173 16.737 16.411 1.00110.16 C ATOM 728 C GLU A 114 -2.870 16.103 15.953 1.00107.63 C ATOM 729 O GLU A 114 -2.237 16.593 15.016 1.00107.26 O ATOM 730 CB GLU A 114 -3.937 17.593 17.652 1.00118.99 C ATOM 731 CG GLU A 114 -4.058 16.826 18.962 1.00120.25 C ATOM 732 CD GLU A 114 -4.247 17.749 20.161 1.00131.50 C ATOM 733 OE1 GLU A 114 -4.238 17.254 21.312 1.00124.76 O ATOM 734 OE2 GLU A 114 -4.422 18.969 19.950 1.00136.77 O ATOM 0 H GLU A 114 -5.393 15.677 17.523 1.00108.61 H new ATOM 0 HA GLU A 114 -4.488 17.293 15.681 1.00110.16 H new ATOM 0 HB2 GLU A 114 -3.052 17.987 17.599 1.00118.99 H new ATOM 0 HB3 GLU A 114 -4.574 18.325 17.656 1.00118.99 H new ATOM 0 HG2 GLU A 114 -4.808 16.214 18.907 1.00120.25 H new ATOM 0 HG3 GLU A 114 -3.262 16.288 19.094 1.00120.25 H new ATOM 735 N LEU A 115 -2.461 15.017 16.604 1.00104.13 N ATOM 736 CA LEU A 115 -1.213 14.379 16.206 1.00112.14 C ATOM 737 C LEU A 115 -1.400 13.454 14.994 1.00118.04 C ATOM 738 O LEU A 115 -0.434 13.135 14.292 1.00122.23 O ATOM 739 CB LEU A 115 -0.589 13.607 17.373 1.00108.58 C ATOM 740 CG LEU A 115 0.904 13.282 17.152 1.00113.46 C ATOM 741 CD1 LEU A 115 1.631 14.437 16.446 1.00104.26 C ATOM 742 CD2 LEU A 115 1.621 12.926 18.458 1.00105.74 C ATOM 0 H LEU A 115 -2.877 14.644 17.258 1.00104.13 H new ATOM 0 HA LEU A 115 -0.606 15.089 15.945 1.00112.14 H new ATOM 0 HB2 LEU A 115 -0.685 14.127 18.186 1.00108.58 H new ATOM 0 HB3 LEU A 115 -1.079 12.780 17.506 1.00108.58 H new ATOM 0 HG LEU A 115 0.932 12.501 16.578 1.00113.46 H new ATOM 0 HD11 LEU A 115 2.564 14.204 16.321 1.00104.26 H new ATOM 0 HD12 LEU A 115 1.220 14.598 15.582 1.00104.26 H new ATOM 0 HD13 LEU A 115 1.568 15.239 16.988 1.00104.26 H new ATOM 0 HD21 LEU A 115 2.553 12.730 18.273 1.00105.74 H new ATOM 0 HD22 LEU A 115 1.565 13.674 19.073 1.00105.74 H new ATOM 0 HD23 LEU A 115 1.200 12.148 18.857 1.00105.74 H new ATOM 743 N PHE A 116 -2.638 13.046 14.725 1.00112.77 N ATOM 744 CA PHE A 116 -2.923 12.189 13.570 1.00107.93 C ATOM 745 C PHE A 116 -3.064 13.009 12.287 1.00112.19 C ATOM 746 O PHE A 116 -3.950 12.767 11.454 1.00106.17 O ATOM 747 CB PHE A 116 -4.181 11.359 13.823 1.00105.52 C ATOM 748 CG PHE A 116 -4.004 10.320 14.894 1.00105.02 C ATOM 749 CD1 PHE A 116 -3.462 9.079 14.589 1.00 95.17 C ATOM 750 CD2 PHE A 116 -4.358 10.591 16.209 1.00 99.08 C ATOM 751 CE1 PHE A 116 -3.289 8.129 15.571 1.00 91.78 C ATOM 752 CE2 PHE A 116 -4.185 9.645 17.198 1.00 88.21 C ATOM 753 CZ PHE A 116 -3.648 8.414 16.882 1.00 91.41 C ATOM 0 H PHE A 116 -3.327 13.252 15.196 1.00112.77 H new ATOM 0 HA PHE A 116 -2.172 11.587 13.451 1.00107.93 H new ATOM 0 HB2 PHE A 116 -4.907 11.952 14.073 1.00105.52 H new ATOM 0 HB3 PHE A 116 -4.444 10.922 12.998 1.00105.52 H new ATOM 0 HD1 PHE A 116 -3.213 8.887 13.714 1.00 95.17 H new ATOM 0 HD2 PHE A 116 -4.716 11.421 16.426 1.00 99.08 H new ATOM 0 HE1 PHE A 116 -2.932 7.297 15.356 1.00 91.78 H new ATOM 0 HE2 PHE A 116 -4.429 9.836 18.075 1.00 88.21 H new ATOM 0 HZ PHE A 116 -3.526 7.775 17.547 1.00 91.41 H new ATOM 754 N THR A 117 -2.173 13.983 12.141 1.00108.51 N ATOM 755 CA THR A 117 -2.163 14.849 10.980 1.00105.49 C ATOM 756 C THR A 117 -1.114 14.346 9.998 1.00100.82 C ATOM 757 O THR A 117 -1.300 14.415 8.779 1.00 93.62 O ATOM 758 CB THR A 117 -1.888 16.314 11.377 1.00107.80 C ATOM 759 OG1 THR A 117 -0.808 16.368 12.319 1.00105.60 O ATOM 760 CG2 THR A 117 -3.135 16.933 12.010 1.00104.64 C ATOM 0 H THR A 117 -1.558 14.157 12.716 1.00108.51 H new ATOM 0 HA THR A 117 -3.037 14.827 10.560 1.00105.49 H new ATOM 0 HB THR A 117 -1.652 16.812 10.579 1.00107.80 H new ATOM 0 HG1 THR A 117 -1.118 16.433 13.097 1.00105.60 H new ATOM 0 HG21 THR A 117 -2.951 17.853 12.255 1.00104.64 H new ATOM 0 HG22 THR A 117 -3.867 16.909 11.374 1.00104.64 H new ATOM 0 HG23 THR A 117 -3.379 16.430 12.803 1.00104.64 H new ATOM 761 N GLY A 118 -0.025 13.805 10.531 1.00 94.26 N ATOM 762 CA GLY A 118 1.051 13.331 9.683 1.00 97.59 C ATOM 763 C GLY A 118 1.299 11.836 9.749 1.00 93.81 C ATOM 764 O GLY A 118 0.510 11.087 10.324 1.00 97.63 O ATOM 0 H GLY A 118 0.107 13.705 11.375 1.00 94.26 H new ATOM 0 HA2 GLY A 118 0.853 13.573 8.765 1.00 97.59 H new ATOM 0 HA3 GLY A 118 1.868 13.793 9.929 1.00 97.59 H new ATOM 765 N VAL A 119 2.401 11.415 9.135 1.00 77.59 N ATOM 766 CA VAL A 119 2.890 10.045 9.205 1.00 84.46 C ATOM 767 C VAL A 119 3.486 9.736 10.590 1.00 89.80 C ATOM 768 O VAL A 119 4.563 10.234 10.933 1.00 96.84 O ATOM 769 CB VAL A 119 3.960 9.783 8.102 1.00 83.59 C ATOM 770 CG1 VAL A 119 4.664 8.437 8.321 1.00 79.09 C ATOM 771 CG2 VAL A 119 3.329 9.848 6.716 1.00 67.23 C ATOM 0 H VAL A 119 2.895 11.931 8.656 1.00 77.59 H new ATOM 0 HA VAL A 119 2.132 9.458 9.057 1.00 84.46 H new ATOM 0 HB VAL A 119 4.631 10.480 8.164 1.00 83.59 H new ATOM 0 HG11 VAL A 119 5.323 8.299 7.623 1.00 79.09 H new ATOM 0 HG12 VAL A 119 5.105 8.439 9.185 1.00 79.09 H new ATOM 0 HG13 VAL A 119 4.010 7.721 8.294 1.00 79.09 H new ATOM 0 HG21 VAL A 119 4.008 9.683 6.043 1.00 67.23 H new ATOM 0 HG22 VAL A 119 2.634 9.175 6.645 1.00 67.23 H new ATOM 0 HG23 VAL A 119 2.943 10.727 6.577 1.00 67.23 H new ATOM 772 N VAL A 120 2.790 8.907 11.371 1.00 84.34 N ATOM 773 CA VAL A 120 3.172 8.608 12.761 1.00 85.36 C ATOM 774 C VAL A 120 3.869 7.248 12.931 1.00 85.29 C ATOM 775 O VAL A 120 3.383 6.228 12.439 1.00 84.73 O ATOM 776 CB VAL A 120 1.935 8.632 13.688 1.00 83.63 C ATOM 777 CG1 VAL A 120 2.347 8.532 15.153 1.00 75.32 C ATOM 778 CG2 VAL A 120 1.109 9.888 13.438 1.00 88.30 C ATOM 0 H VAL A 120 2.079 8.499 11.111 1.00 84.34 H new ATOM 0 HA VAL A 120 3.804 9.302 13.005 1.00 85.36 H new ATOM 0 HB VAL A 120 1.386 7.859 13.483 1.00 83.63 H new ATOM 0 HG11 VAL A 120 1.556 8.549 15.714 1.00 75.32 H new ATOM 0 HG12 VAL A 120 2.828 7.702 15.298 1.00 75.32 H new ATOM 0 HG13 VAL A 120 2.920 9.281 15.380 1.00 75.32 H new ATOM 0 HG21 VAL A 120 0.337 9.890 14.025 1.00 88.30 H new ATOM 0 HG22 VAL A 120 1.651 10.673 13.615 1.00 88.30 H new ATOM 0 HG23 VAL A 120 0.812 9.902 12.515 1.00 88.30 H new ATOM 779 N PRO A 121 5.011 7.228 13.636 1.00 84.77 N ATOM 780 CA PRO A 121 5.705 5.961 13.893 1.00 81.03 C ATOM 781 C PRO A 121 4.872 5.029 14.767 1.00 79.50 C ATOM 782 O PRO A 121 4.107 5.505 15.619 1.00 65.34 O ATOM 783 CB PRO A 121 6.978 6.390 14.626 1.00 82.87 C ATOM 784 CG PRO A 121 7.115 7.845 14.352 1.00 86.45 C ATOM 785 CD PRO A 121 5.736 8.378 14.199 1.00 80.84 C ATOM 0 HA PRO A 121 5.879 5.465 13.077 1.00 81.03 H new ATOM 0 HB2 PRO A 121 6.909 6.218 15.578 1.00 82.87 H new ATOM 0 HB3 PRO A 121 7.750 5.899 14.304 1.00 82.87 H new ATOM 0 HG2 PRO A 121 7.579 8.291 15.078 1.00 86.45 H new ATOM 0 HG3 PRO A 121 7.635 7.997 13.547 1.00 86.45 H new ATOM 0 HD2 PRO A 121 5.362 8.660 15.048 1.00 80.84 H new ATOM 0 HD3 PRO A 121 5.709 9.146 13.608 1.00 80.84 H new ATOM 786 N ILE A 122 5.020 3.721 14.543 1.00 72.97 N ATOM 787 CA ILE A 122 4.271 2.721 15.294 1.00 71.27 C ATOM 788 C ILE A 122 5.156 1.597 15.827 1.00 66.59 C ATOM 789 O ILE A 122 5.910 0.987 15.070 1.00 65.69 O ATOM 790 CB ILE A 122 3.163 2.066 14.441 1.00 74.25 C ATOM 791 CG1 ILE A 122 2.532 3.056 13.471 1.00 69.77 C ATOM 792 CG2 ILE A 122 2.094 1.475 15.332 1.00 74.45 C ATOM 793 CD1 ILE A 122 1.428 2.443 12.665 1.00 65.24 C ATOM 0 H ILE A 122 5.555 3.394 13.954 1.00 72.97 H new ATOM 0 HA ILE A 122 3.883 3.211 16.036 1.00 71.27 H new ATOM 0 HB ILE A 122 3.579 1.361 13.920 1.00 74.25 H new ATOM 0 HG12 ILE A 122 2.184 3.814 13.967 1.00 69.77 H new ATOM 0 HG13 ILE A 122 3.214 3.398 12.872 1.00 69.77 H new ATOM 0 HG21 ILE A 122 1.405 1.067 14.784 1.00 74.45 H new ATOM 0 HG22 ILE A 122 2.489 0.802 15.908 1.00 74.45 H new ATOM 0 HG23 ILE A 122 1.702 2.176 15.876 1.00 74.45 H new ATOM 0 HD11 ILE A 122 1.058 3.108 12.064 1.00 65.24 H new ATOM 0 HD12 ILE A 122 1.778 1.700 12.148 1.00 65.24 H new ATOM 0 HD13 ILE A 122 0.732 2.123 13.260 1.00 65.24 H new ATOM 794 N LEU A 123 5.056 1.322 17.126 1.00 65.24 N ATOM 795 CA LEU A 123 5.657 0.114 17.692 1.00 66.06 C ATOM 796 C LEU A 123 4.599 -0.817 18.258 1.00 67.99 C ATOM 797 O LEU A 123 3.677 -0.382 18.966 1.00 62.56 O ATOM 798 CB LEU A 123 6.664 0.441 18.792 1.00 71.98 C ATOM 799 CG LEU A 123 7.234 -0.821 19.464 1.00 72.58 C ATOM 800 CD1 LEU A 123 8.307 -1.526 18.602 1.00 65.73 C ATOM 801 CD2 LEU A 123 7.744 -0.530 20.873 1.00 70.28 C ATOM 0 H LEU A 123 4.646 1.819 17.695 1.00 65.24 H new ATOM 0 HA LEU A 123 6.120 -0.327 16.962 1.00 66.06 H new ATOM 0 HB2 LEU A 123 7.392 0.960 18.416 1.00 71.98 H new ATOM 0 HB3 LEU A 123 6.237 0.996 19.463 1.00 71.98 H new ATOM 0 HG LEU A 123 6.495 -1.444 19.544 1.00 72.58 H new ATOM 0 HD11 LEU A 123 8.632 -2.312 19.069 1.00 65.73 H new ATOM 0 HD12 LEU A 123 7.918 -1.792 17.754 1.00 65.73 H new ATOM 0 HD13 LEU A 123 9.045 -0.917 18.442 1.00 65.73 H new ATOM 0 HD21 LEU A 123 8.095 -1.345 21.265 1.00 70.28 H new ATOM 0 HD22 LEU A 123 8.447 0.137 20.832 1.00 70.28 H new ATOM 0 HD23 LEU A 123 7.015 -0.197 21.419 1.00 70.28 H new ATOM 802 N VAL A 124 4.735 -2.103 17.949 1.00 57.90 N ATOM 803 CA VAL A 124 3.773 -3.074 18.433 1.00 62.95 C ATOM 804 C VAL A 124 4.476 -4.214 19.125 1.00 57.58 C ATOM 805 O VAL A 124 5.327 -4.884 18.541 1.00 59.99 O ATOM 806 CB VAL A 124 2.886 -3.612 17.286 1.00 59.98 C ATOM 807 CG1 VAL A 124 1.814 -4.557 17.822 1.00 52.13 C ATOM 808 CG2 VAL A 124 2.228 -2.454 16.591 1.00 55.19 C ATOM 0 H VAL A 124 5.369 -2.427 17.467 1.00 57.90 H new ATOM 0 HA VAL A 124 3.197 -2.624 19.071 1.00 62.95 H new ATOM 0 HB VAL A 124 3.445 -4.104 16.665 1.00 59.98 H new ATOM 0 HG11 VAL A 124 1.271 -4.881 17.086 1.00 52.13 H new ATOM 0 HG12 VAL A 124 2.237 -5.308 18.266 1.00 52.13 H new ATOM 0 HG13 VAL A 124 1.251 -4.083 18.454 1.00 52.13 H new ATOM 0 HG21 VAL A 124 1.670 -2.784 15.870 1.00 55.19 H new ATOM 0 HG22 VAL A 124 1.681 -1.964 17.225 1.00 55.19 H new ATOM 0 HG23 VAL A 124 2.908 -1.865 16.229 1.00 55.19 H new ATOM 809 N GLU A 125 4.112 -4.434 20.383 1.00 61.18 N ATOM 810 CA GLU A 125 4.700 -5.524 21.155 1.00 62.05 C ATOM 811 C GLU A 125 3.633 -6.485 21.649 1.00 54.48 C ATOM 812 O GLU A 125 2.610 -6.069 22.177 1.00 65.46 O ATOM 813 CB GLU A 125 5.500 -4.978 22.337 1.00 58.67 C ATOM 814 CG GLU A 125 6.902 -5.552 22.408 1.00 68.64 C ATOM 815 CD GLU A 125 7.973 -4.517 22.107 1.00 86.79 C ATOM 816 OE1 GLU A 125 9.002 -4.878 21.490 1.00 83.34 O ATOM 817 OE2 GLU A 125 7.784 -3.340 22.498 1.00 94.97 O ATOM 0 H GLU A 125 3.529 -3.966 20.808 1.00 61.18 H new ATOM 0 HA GLU A 125 5.300 -6.010 20.568 1.00 62.05 H new ATOM 0 HB2 GLU A 125 5.553 -4.012 22.269 1.00 58.67 H new ATOM 0 HB3 GLU A 125 5.030 -5.179 23.161 1.00 58.67 H new ATOM 0 HG2 GLU A 125 7.053 -5.920 23.293 1.00 68.64 H new ATOM 0 HG3 GLU A 125 6.980 -6.286 21.778 1.00 68.64 H new ATOM 818 N LEU A 126 3.886 -7.770 21.476 1.00 47.15 N ATOM 819 CA LEU A 126 2.929 -8.795 21.831 1.00 56.66 C ATOM 820 C LEU A 126 3.556 -9.947 22.598 1.00 56.62 C ATOM 821 O LEU A 126 4.472 -10.609 22.118 1.00 56.62 O ATOM 822 CB LEU A 126 2.248 -9.343 20.583 1.00 52.34 C ATOM 823 CG LEU A 126 1.332 -10.538 20.858 1.00 57.19 C ATOM 824 CD1 LEU A 126 0.041 -10.409 20.058 1.00 64.97 C ATOM 825 CD2 LEU A 126 2.023 -11.853 20.529 1.00 51.16 C ATOM 0 H LEU A 126 4.621 -8.072 21.148 1.00 47.15 H new ATOM 0 HA LEU A 126 2.278 -8.370 22.412 1.00 56.66 H new ATOM 0 HB2 LEU A 126 1.728 -8.635 20.170 1.00 52.34 H new ATOM 0 HB3 LEU A 126 2.927 -9.607 19.943 1.00 52.34 H new ATOM 0 HG LEU A 126 1.121 -10.539 21.805 1.00 57.19 H new ATOM 0 HD11 LEU A 126 -0.531 -11.171 20.240 1.00 64.97 H new ATOM 0 HD12 LEU A 126 -0.418 -9.593 20.313 1.00 64.97 H new ATOM 0 HD13 LEU A 126 0.248 -10.380 19.111 1.00 64.97 H new ATOM 0 HD21 LEU A 126 1.420 -12.590 20.713 1.00 51.16 H new ATOM 0 HD22 LEU A 126 2.269 -11.863 19.591 1.00 51.16 H new ATOM 0 HD23 LEU A 126 2.821 -11.945 21.073 1.00 51.16 H new ATOM 826 N ASP A 127 3.021 -10.193 23.785 1.00 61.63 N ATOM 827 CA ASP A 127 3.414 -11.316 24.620 1.00 57.93 C ATOM 828 C ASP A 127 2.300 -12.355 24.542 1.00 57.76 C ATOM 829 O ASP A 127 1.137 -12.023 24.776 1.00 61.31 O ATOM 830 CB ASP A 127 3.641 -10.841 26.062 1.00 59.01 C ATOM 831 CG ASP A 127 4.615 -11.724 26.831 1.00 79.50 C ATOM 832 OD1 ASP A 127 4.490 -12.977 26.733 1.00 68.89 O ATOM 833 OD2 ASP A 127 5.504 -11.152 27.528 1.00 77.85 O ATOM 0 H ASP A 127 2.407 -9.702 24.134 1.00 61.63 H new ATOM 0 HA ASP A 127 4.247 -11.707 24.314 1.00 57.93 H new ATOM 0 HB2 ASP A 127 3.978 -9.931 26.049 1.00 59.01 H new ATOM 0 HB3 ASP A 127 2.791 -10.822 26.529 1.00 59.01 H new ATOM 834 N GLY A 128 2.623 -13.597 24.202 1.00 49.16 N ATOM 835 CA GLY A 128 1.566 -14.547 23.917 1.00 50.55 C ATOM 836 C GLY A 128 1.786 -15.987 24.321 1.00 62.25 C ATOM 837 O GLY A 128 2.880 -16.532 24.162 1.00 63.70 O ATOM 0 H GLY A 128 3.425 -13.900 24.133 1.00 49.16 H new ATOM 0 HA2 GLY A 128 0.758 -14.235 24.354 1.00 50.55 H new ATOM 0 HA3 GLY A 128 1.397 -14.528 22.962 1.00 50.55 H new ATOM 838 N ASP A 129 0.713 -16.602 24.819 1.00 68.01 N ATOM 839 CA ASP A 129 0.697 -17.982 25.305 1.00 64.19 C ATOM 840 C ASP A 129 -0.487 -18.720 24.677 1.00 63.85 C ATOM 841 O ASP A 129 -1.643 -18.363 24.888 1.00 66.39 O ATOM 842 CB ASP A 129 0.607 -18.003 26.843 1.00 63.41 C ATOM 843 CG ASP A 129 0.774 -19.411 27.451 1.00 76.06 C ATOM 844 OD1 ASP A 129 0.654 -20.432 26.724 1.00 71.77 O ATOM 845 OD2 ASP A 129 1.012 -19.485 28.686 1.00 75.67 O ATOM 0 H ASP A 129 -0.051 -16.214 24.885 1.00 68.01 H new ATOM 0 HA ASP A 129 1.519 -18.429 25.049 1.00 64.19 H new ATOM 0 HB2 ASP A 129 1.290 -17.418 27.208 1.00 63.41 H new ATOM 0 HB3 ASP A 129 -0.251 -17.641 27.114 1.00 63.41 H new ATOM 846 N VAL A 130 -0.198 -19.749 23.899 1.00 59.87 N ATOM 847 CA VAL A 130 -1.254 -20.503 23.257 1.00 58.55 C ATOM 848 C VAL A 130 -1.069 -21.977 23.531 1.00 64.77 C ATOM 849 O VAL A 130 -0.158 -22.606 22.975 1.00 62.04 O ATOM 850 CB VAL A 130 -1.278 -20.254 21.737 1.00 61.40 C ATOM 851 CG1 VAL A 130 -2.257 -21.207 21.041 1.00 52.89 C ATOM 852 CG2 VAL A 130 -1.647 -18.806 21.447 1.00 52.98 C ATOM 0 H VAL A 130 0.599 -20.025 23.731 1.00 59.87 H new ATOM 0 HA VAL A 130 -2.101 -20.206 23.624 1.00 58.55 H new ATOM 0 HB VAL A 130 -0.390 -20.426 21.386 1.00 61.40 H new ATOM 0 HG11 VAL A 130 -2.256 -21.033 20.087 1.00 52.89 H new ATOM 0 HG12 VAL A 130 -1.986 -22.124 21.202 1.00 52.89 H new ATOM 0 HG13 VAL A 130 -3.150 -21.068 21.393 1.00 52.89 H new ATOM 0 HG21 VAL A 130 -1.659 -18.661 20.488 1.00 52.98 H new ATOM 0 HG22 VAL A 130 -2.525 -18.616 21.813 1.00 52.98 H new ATOM 0 HG23 VAL A 130 -0.993 -18.217 21.855 1.00 52.98 H new ATOM 853 N ASN A 131 -1.932 -22.518 24.395 1.00 69.55 N ATOM 854 CA ASN A 131 -1.838 -23.914 24.856 1.00 66.85 C ATOM 855 C ASN A 131 -0.454 -24.246 25.424 1.00 63.63 C ATOM 856 O ASN A 131 0.054 -25.350 25.244 1.00 64.20 O ATOM 857 CB ASN A 131 -2.190 -24.886 23.716 1.00 57.39 C ATOM 858 CG ASN A 131 -3.692 -24.930 23.419 1.00 67.29 C ATOM 859 OD1 ASN A 131 -4.430 -23.985 23.719 1.00 64.85 O ATOM 860 ND2 ASN A 131 -4.148 -26.034 22.836 1.00 56.77 N ATOM 0 H ASN A 131 -2.593 -22.085 24.734 1.00 69.55 H new ATOM 0 HA ASN A 131 -2.481 -24.019 25.575 1.00 66.85 H new ATOM 0 HB2 ASN A 131 -1.713 -24.623 22.913 1.00 57.39 H new ATOM 0 HB3 ASN A 131 -1.884 -25.776 23.949 1.00 57.39 H new ATOM 0 HD21 ASN A 131 -4.985 -26.110 22.654 1.00 56.77 H new ATOM 0 HD22 ASN A 131 -3.606 -26.673 22.641 1.00 56.77 H new ATOM 861 N GLY A 132 0.168 -23.273 26.083 1.00 62.58 N ATOM 862 CA GLY A 132 1.513 -23.455 26.603 1.00 72.71 C ATOM 863 C GLY A 132 2.669 -23.002 25.714 1.00 75.34 C ATOM 864 O GLY A 132 3.724 -22.604 26.226 1.00 78.95 O ATOM 0 H GLY A 132 -0.174 -22.500 26.238 1.00 62.58 H new ATOM 0 HA2 GLY A 132 1.577 -22.979 27.446 1.00 72.71 H new ATOM 0 HA3 GLY A 132 1.635 -24.397 26.799 1.00 72.71 H new ATOM 865 N HIS A 133 2.493 -23.081 24.395 1.00 68.51 N ATOM 866 CA HIS A 133 3.482 -22.564 23.452 1.00 61.72 C ATOM 867 C HIS A 133 3.666 -21.047 23.585 1.00 59.95 C ATOM 868 O HIS A 133 2.838 -20.272 23.120 1.00 66.14 O ATOM 869 CB HIS A 133 3.079 -22.911 22.022 1.00 66.83 C ATOM 870 CG HIS A 133 3.278 -24.346 21.671 1.00 63.78 C ATOM 871 ND1 HIS A 133 3.311 -25.342 22.619 1.00 77.40 N ATOM 872 CD2 HIS A 133 3.471 -24.951 20.477 1.00 82.81 C ATOM 873 CE1 HIS A 133 3.511 -26.505 22.025 1.00 84.70 C ATOM 874 NE2 HIS A 133 3.609 -26.295 20.724 1.00 95.87 N ATOM 0 H HIS A 133 1.801 -23.433 24.025 1.00 68.51 H new ATOM 0 HA HIS A 133 4.330 -22.985 23.664 1.00 61.72 H new ATOM 0 HB2 HIS A 133 2.145 -22.682 21.894 1.00 66.83 H new ATOM 0 HB3 HIS A 133 3.592 -22.363 21.408 1.00 66.83 H new ATOM 0 HD2 HIS A 133 3.504 -24.535 19.646 1.00 82.81 H new ATOM 0 HE1 HIS A 133 3.572 -27.330 22.450 1.00 84.70 H new ATOM 0 HE2 HIS A 133 3.738 -26.902 20.128 1.00 95.87 H new ATOM 875 N LYS A 134 4.751 -20.614 24.213 1.00 63.85 N ATOM 876 CA LYS A 134 4.921 -19.188 24.465 1.00 65.06 C ATOM 877 C LYS A 134 5.815 -18.523 23.406 1.00 63.51 C ATOM 878 O LYS A 134 6.692 -19.170 22.837 1.00 63.65 O ATOM 879 CB LYS A 134 5.468 -18.968 25.873 1.00 60.36 C ATOM 880 CG LYS A 134 4.521 -19.473 26.976 1.00 64.41 C ATOM 881 CD LYS A 134 4.795 -18.812 28.345 1.00 70.71 C ATOM 882 CE LYS A 134 4.561 -17.286 28.290 1.00 68.15 C ATOM 883 NZ LYS A 134 5.097 -16.530 29.468 1.00 70.89 N ATOM 0 H LYS A 134 5.389 -21.116 24.497 1.00 63.85 H new ATOM 0 HA LYS A 134 4.051 -18.764 24.401 1.00 65.06 H new ATOM 0 HB2 LYS A 134 6.322 -19.420 25.956 1.00 60.36 H new ATOM 0 HB3 LYS A 134 5.634 -18.021 26.005 1.00 60.36 H new ATOM 0 HG2 LYS A 134 3.603 -19.298 26.714 1.00 64.41 H new ATOM 0 HG3 LYS A 134 4.613 -20.435 27.061 1.00 64.41 H new ATOM 0 HD2 LYS A 134 4.217 -19.206 29.018 1.00 70.71 H new ATOM 0 HD3 LYS A 134 5.709 -18.991 28.616 1.00 70.71 H new ATOM 0 HE2 LYS A 134 4.970 -16.937 27.483 1.00 68.15 H new ATOM 0 HE3 LYS A 134 3.608 -17.119 28.220 1.00 68.15 H new ATOM 0 HZ1 LYS A 134 4.926 -15.662 29.367 1.00 70.89 H new ATOM 0 HZ2 LYS A 134 4.707 -16.824 30.212 1.00 70.89 H new ATOM 0 HZ3 LYS A 134 5.976 -16.654 29.525 1.00 70.89 H new ATOM 884 N PHE A 135 5.557 -17.243 23.131 1.00 51.69 N ATOM 885 CA PHE A 135 6.217 -16.522 22.050 1.00 45.54 C ATOM 886 C PHE A 135 6.059 -15.014 22.195 1.00 47.96 C ATOM 887 O PHE A 135 5.229 -14.534 22.950 1.00 50.46 O ATOM 888 CB PHE A 135 5.661 -16.952 20.691 1.00 54.32 C ATOM 889 CG PHE A 135 4.189 -16.653 20.520 1.00 62.28 C ATOM 890 CD1 PHE A 135 3.762 -15.439 19.989 1.00 54.03 C ATOM 891 CD2 PHE A 135 3.226 -17.583 20.906 1.00 56.47 C ATOM 892 CE1 PHE A 135 2.418 -15.167 19.859 1.00 52.93 C ATOM 893 CE2 PHE A 135 1.873 -17.314 20.760 1.00 56.51 C ATOM 894 CZ PHE A 135 1.466 -16.108 20.241 1.00 47.43 C ATOM 0 H PHE A 135 4.990 -16.769 23.571 1.00 51.69 H new ATOM 0 HA PHE A 135 7.160 -16.742 22.103 1.00 45.54 H new ATOM 0 HB2 PHE A 135 6.158 -16.503 19.989 1.00 54.32 H new ATOM 0 HB3 PHE A 135 5.806 -17.904 20.577 1.00 54.32 H new ATOM 0 HD1 PHE A 135 4.389 -14.807 19.720 1.00 54.03 H new ATOM 0 HD2 PHE A 135 3.494 -18.397 21.267 1.00 56.47 H new ATOM 0 HE1 PHE A 135 2.144 -14.348 19.513 1.00 52.93 H new ATOM 0 HE2 PHE A 135 1.242 -17.949 21.013 1.00 56.51 H new ATOM 0 HZ PHE A 135 0.560 -15.922 20.146 1.00 47.43 H new ATOM 895 N ARG A 136 6.852 -14.266 21.444 1.00 48.51 N ATOM 896 CA ARG A 136 6.606 -12.838 21.299 1.00 48.46 C ATOM 897 C ARG A 136 6.668 -12.368 19.850 1.00 52.45 C ATOM 898 O ARG A 136 7.144 -13.072 18.943 1.00 56.61 O ATOM 899 CB ARG A 136 7.597 -12.033 22.124 1.00 55.06 C ATOM 900 CG ARG A 136 7.531 -12.312 23.603 1.00 61.83 C ATOM 901 CD ARG A 136 8.587 -11.513 24.336 1.00 57.61 C ATOM 902 NE ARG A 136 8.570 -11.816 25.758 1.00 59.89 N ATOM 903 CZ ARG A 136 9.228 -11.112 26.664 1.00 56.82 C ATOM 904 NH1 ARG A 136 9.953 -10.074 26.271 1.00 56.25 N ATOM 905 NH2 ARG A 136 9.156 -11.445 27.949 1.00 56.91 N ATOM 0 H ARG A 136 7.534 -14.562 21.012 1.00 48.51 H new ATOM 0 HA ARG A 136 5.704 -12.688 21.622 1.00 48.46 H new ATOM 0 HB2 ARG A 136 8.495 -12.221 21.808 1.00 55.06 H new ATOM 0 HB3 ARG A 136 7.436 -11.088 21.975 1.00 55.06 H new ATOM 0 HG2 ARG A 136 6.651 -12.085 23.942 1.00 61.83 H new ATOM 0 HG3 ARG A 136 7.662 -13.259 23.766 1.00 61.83 H new ATOM 0 HD2 ARG A 136 9.462 -11.713 23.969 1.00 57.61 H new ATOM 0 HD3 ARG A 136 8.433 -10.565 24.201 1.00 57.61 H new ATOM 0 HE ARG A 136 8.107 -12.490 26.025 1.00 59.89 H new ATOM 0 HH11 ARG A 136 9.991 -9.867 25.437 1.00 56.25 H new ATOM 0 HH12 ARG A 136 10.386 -9.608 26.850 1.00 56.25 H new ATOM 0 HH21 ARG A 136 8.681 -12.119 28.192 1.00 56.91 H new ATOM 0 HH22 ARG A 136 9.584 -10.986 28.537 1.00 56.91 H new ATOM 906 N VAL A 137 6.176 -11.161 19.639 1.00 47.56 N ATOM 907 CA VAL A 137 6.195 -10.571 18.317 1.00 53.13 C ATOM 908 C VAL A 137 6.498 -9.103 18.492 1.00 54.26 C ATOM 909 O VAL A 137 5.947 -8.464 19.384 1.00 57.11 O ATOM 910 CB VAL A 137 4.858 -10.764 17.570 1.00 45.13 C ATOM 911 CG1 VAL A 137 4.856 -9.983 16.298 1.00 47.10 C ATOM 912 CG2 VAL A 137 4.617 -12.244 17.267 1.00 42.84 C ATOM 0 H VAL A 137 5.826 -10.666 20.249 1.00 47.56 H new ATOM 0 HA VAL A 137 6.870 -11.009 17.775 1.00 53.13 H new ATOM 0 HB VAL A 137 4.144 -10.442 18.142 1.00 45.13 H new ATOM 0 HG11 VAL A 137 4.011 -10.113 15.839 1.00 47.10 H new ATOM 0 HG12 VAL A 137 4.974 -9.041 16.496 1.00 47.10 H new ATOM 0 HG13 VAL A 137 5.582 -10.287 15.730 1.00 47.10 H new ATOM 0 HG21 VAL A 137 3.774 -12.345 16.798 1.00 42.84 H new ATOM 0 HG22 VAL A 137 5.337 -12.582 16.713 1.00 42.84 H new ATOM 0 HG23 VAL A 137 4.587 -12.744 18.098 1.00 42.84 H new ATOM 913 N ARG A 138 7.420 -8.576 17.690 1.00 53.03 N ATOM 914 CA ARG A 138 7.631 -7.129 17.661 1.00 47.38 C ATOM 915 C ARG A 138 7.303 -6.585 16.268 1.00 53.56 C ATOM 916 O ARG A 138 7.467 -7.271 15.242 1.00 51.80 O ATOM 917 CB ARG A 138 9.066 -6.781 18.054 1.00 44.95 C ATOM 918 CG ARG A 138 9.295 -5.306 18.272 1.00 58.16 C ATOM 919 CD ARG A 138 10.614 -5.060 18.966 1.00 75.31 C ATOM 920 NE ARG A 138 11.078 -3.696 18.765 1.00 76.18 N ATOM 921 CZ ARG A 138 11.780 -3.331 17.703 1.00 76.93 C ATOM 922 NH1 ARG A 138 12.078 -4.238 16.783 1.00 85.11 N ATOM 923 NH2 ARG A 138 12.183 -2.078 17.558 1.00 83.38 N ATOM 0 H ARG A 138 7.927 -9.029 17.163 1.00 53.03 H new ATOM 0 HA ARG A 138 7.038 -6.714 18.307 1.00 47.38 H new ATOM 0 HB2 ARG A 138 9.295 -7.259 18.866 1.00 44.95 H new ATOM 0 HB3 ARG A 138 9.668 -7.095 17.361 1.00 44.95 H new ATOM 0 HG2 ARG A 138 9.283 -4.844 17.419 1.00 58.16 H new ATOM 0 HG3 ARG A 138 8.572 -4.938 18.804 1.00 58.16 H new ATOM 0 HD2 ARG A 138 10.518 -5.233 19.916 1.00 75.31 H new ATOM 0 HD3 ARG A 138 11.278 -5.682 18.630 1.00 75.31 H new ATOM 0 HE ARG A 138 10.889 -3.104 19.359 1.00 76.18 H new ATOM 0 HH11 ARG A 138 11.816 -5.051 16.880 1.00 85.11 H new ATOM 0 HH12 ARG A 138 12.533 -4.013 16.089 1.00 85.11 H new ATOM 0 HH21 ARG A 138 11.989 -1.492 18.157 1.00 83.38 H new ATOM 0 HH22 ARG A 138 12.638 -1.850 16.865 1.00 83.38 H new ATOM 924 N GLY A 139 6.828 -5.356 16.219 1.00 49.47 N ATOM 925 CA GLY A 139 6.458 -4.803 14.937 1.00 59.13 C ATOM 926 C GLY A 139 6.674 -3.314 14.891 1.00 62.99 C ATOM 927 O GLY A 139 6.386 -2.604 15.863 1.00 68.04 O ATOM 0 H GLY A 139 6.714 -4.838 16.896 1.00 49.47 H new ATOM 0 HA2 GLY A 139 6.980 -5.228 14.238 1.00 59.13 H new ATOM 0 HA3 GLY A 139 5.526 -5.001 14.755 1.00 59.13 H new ATOM 928 N GLU A 140 7.191 -2.841 13.764 1.00 60.24 N ATOM 929 CA GLU A 140 7.398 -1.418 13.586 1.00 61.32 C ATOM 930 C GLU A 140 7.076 -0.995 12.165 1.00 67.50 C ATOM 931 O GLU A 140 7.136 -1.786 11.201 1.00 63.11 O ATOM 932 CB GLU A 140 8.822 -1.029 13.951 1.00 58.94 C ATOM 933 CG GLU A 140 9.896 -1.940 13.376 1.00 76.04 C ATOM 934 CD GLU A 140 11.210 -1.827 14.145 1.00 92.53 C ATOM 935 OE1 GLU A 140 11.180 -1.334 15.301 1.00 74.68 O ATOM 936 OE2 GLU A 140 12.267 -2.224 13.596 1.00104.71 O ATOM 0 H GLU A 140 7.427 -3.327 13.095 1.00 60.24 H new ATOM 0 HA GLU A 140 6.793 -0.952 14.184 1.00 61.32 H new ATOM 0 HB2 GLU A 140 8.986 -0.123 13.645 1.00 58.94 H new ATOM 0 HB3 GLU A 140 8.905 -1.021 14.917 1.00 58.94 H new ATOM 0 HG2 GLU A 140 9.586 -2.859 13.399 1.00 76.04 H new ATOM 0 HG3 GLU A 140 10.046 -1.714 12.445 1.00 76.04 H new ATOM 937 N GLY A 141 6.706 0.269 12.060 1.00 58.53 N ATOM 938 CA GLY A 141 6.287 0.842 10.808 1.00 66.71 C ATOM 939 C GLY A 141 5.673 2.178 11.131 1.00 73.25 C ATOM 940 O GLY A 141 6.002 2.787 12.152 1.00 79.76 O ATOM 0 H GLY A 141 6.693 0.819 12.721 1.00 58.53 H new ATOM 0 HA2 GLY A 141 7.041 0.945 10.207 1.00 66.71 H new ATOM 0 HA3 GLY A 141 5.646 0.266 10.363 1.00 66.71 H new ATOM 941 N GLU A 142 4.761 2.614 10.276 1.00 69.62 N ATOM 942 CA GLU A 142 4.206 3.950 10.356 1.00 70.44 C ATOM 943 C GLU A 142 2.777 3.934 9.834 1.00 74.51 C ATOM 944 O GLU A 142 2.419 3.098 8.996 1.00 76.95 O ATOM 945 CB GLU A 142 5.074 4.919 9.551 1.00 80.08 C ATOM 946 CG GLU A 142 5.502 4.350 8.193 1.00 84.14 C ATOM 947 CD GLU A 142 6.469 5.247 7.428 1.00 98.22 C ATOM 948 OE1 GLU A 142 6.892 6.290 7.978 1.00 97.92 O ATOM 949 OE2 GLU A 142 6.806 4.901 6.269 1.00 93.17 O ATOM 0 H GLU A 142 4.446 2.140 9.631 1.00 69.62 H new ATOM 0 HA GLU A 142 4.195 4.249 11.279 1.00 70.44 H new ATOM 0 HB2 GLU A 142 4.584 5.744 9.411 1.00 80.08 H new ATOM 0 HB3 GLU A 142 5.865 5.142 10.067 1.00 80.08 H new ATOM 0 HG2 GLU A 142 5.917 3.484 8.331 1.00 84.14 H new ATOM 0 HG3 GLU A 142 4.712 4.203 7.650 1.00 84.14 H new ATOM 950 N GLY A 143 1.956 4.845 10.332 1.00 61.04 N ATOM 951 CA GLY A 143 0.588 4.953 9.869 1.00 65.00 C ATOM 952 C GLY A 143 0.254 6.383 9.478 1.00 83.64 C ATOM 953 O GLY A 143 1.003 7.315 9.785 1.00 81.96 O ATOM 0 H GLY A 143 2.174 5.411 10.941 1.00 61.04 H new ATOM 0 HA2 GLY A 143 0.454 4.367 9.108 1.00 65.00 H new ATOM 0 HA3 GLY A 143 -0.017 4.656 10.566 1.00 65.00 H new ATOM 954 N ASP A 144 -0.886 6.563 8.818 1.00 83.18 N ATOM 955 CA ASP A 144 -1.255 7.849 8.238 1.00 76.83 C ATOM 956 C ASP A 144 -2.759 8.014 8.315 1.00 76.83 C ATOM 957 O ASP A 144 -3.468 7.739 7.349 1.00 76.33 O ATOM 958 CB ASP A 144 -0.763 7.929 6.785 1.00 77.08 C ATOM 959 CG ASP A 144 -1.046 9.269 6.133 1.00 87.56 C ATOM 960 OD1 ASP A 144 -1.552 10.193 6.814 1.00 88.49 O ATOM 961 OD2 ASP A 144 -0.745 9.395 4.926 1.00 92.93 O ATOM 0 H ASP A 144 -1.468 5.942 8.694 1.00 83.18 H new ATOM 0 HA ASP A 144 -0.836 8.569 8.735 1.00 76.83 H new ATOM 0 HB2 ASP A 144 0.192 7.760 6.763 1.00 77.08 H new ATOM 0 HB3 ASP A 144 -1.187 7.227 6.267 1.00 77.08 H new ATOM 962 N ALA A 145 -3.240 8.459 9.471 1.00 77.91 N ATOM 963 CA ALA A 145 -4.671 8.457 9.756 1.00 78.44 C ATOM 964 C ALA A 145 -5.497 9.196 8.697 1.00 83.56 C ATOM 965 O ALA A 145 -6.640 8.828 8.414 1.00 85.06 O ATOM 966 CB ALA A 145 -4.925 9.048 11.133 1.00 73.78 C ATOM 0 H ALA A 145 -2.751 8.768 10.107 1.00 77.91 H new ATOM 0 HA ALA A 145 -4.962 7.532 9.735 1.00 78.44 H new ATOM 0 HB1 ALA A 145 -5.877 9.044 11.316 1.00 73.78 H new ATOM 0 HB2 ALA A 145 -4.465 8.518 11.803 1.00 73.78 H new ATOM 0 HB3 ALA A 145 -4.595 9.960 11.160 1.00 73.78 H new ATOM 967 N THR A 146 -4.911 10.226 8.104 1.00 84.45 N ATOM 968 CA THR A 146 -5.617 11.046 7.129 1.00 88.36 C ATOM 969 C THR A 146 -5.960 10.256 5.864 1.00 86.16 C ATOM 970 O THR A 146 -7.033 10.424 5.293 1.00 85.75 O ATOM 971 CB THR A 146 -4.782 12.281 6.770 1.00 96.78 C ATOM 972 OG1 THR A 146 -3.557 11.861 6.156 1.00 96.28 O ATOM 973 CG2 THR A 146 -4.459 13.080 8.039 1.00 94.45 C ATOM 0 H THR A 146 -4.100 10.469 8.253 1.00 84.45 H new ATOM 0 HA THR A 146 -6.451 11.330 7.534 1.00 88.36 H new ATOM 0 HB THR A 146 -5.286 12.840 6.158 1.00 96.78 H new ATOM 0 HG1 THR A 146 -3.125 11.380 6.692 1.00 96.28 H new ATOM 0 HG21 THR A 146 -3.931 13.859 7.805 1.00 94.45 H new ATOM 0 HG22 THR A 146 -5.285 13.364 8.462 1.00 94.45 H new ATOM 0 HG23 THR A 146 -3.957 12.522 8.654 1.00 94.45 H new ATOM 974 N ASN A 147 -5.042 9.389 5.441 1.00 86.63 N ATOM 975 CA ASN A 147 -5.275 8.483 4.317 1.00 86.79 C ATOM 976 C ASN A 147 -5.880 7.146 4.743 1.00 86.24 C ATOM 977 O ASN A 147 -6.237 6.319 3.900 1.00 87.19 O ATOM 978 CB ASN A 147 -3.970 8.219 3.567 1.00 89.09 C ATOM 979 CG ASN A 147 -3.369 9.484 2.970 1.00 96.32 C ATOM 980 OD1 ASN A 147 -4.092 10.403 2.575 1.00 91.71 O ATOM 981 ND2 ASN A 147 -2.037 9.533 2.899 1.00 86.04 N ATOM 0 H ASN A 147 -4.264 9.309 5.799 1.00 86.63 H new ATOM 0 HA ASN A 147 -5.915 8.927 3.740 1.00 86.79 H new ATOM 0 HB2 ASN A 147 -3.329 7.816 4.173 1.00 89.09 H new ATOM 0 HB3 ASN A 147 -4.133 7.577 2.858 1.00 89.09 H new ATOM 0 HD21 ASN A 147 -1.649 10.225 2.567 1.00 86.04 H new ATOM 0 HD22 ASN A 147 -1.567 8.872 3.185 1.00 86.04 H new ATOM 982 N GLY A 148 -5.984 6.935 6.051 1.00 79.09 N ATOM 983 CA GLY A 148 -6.491 5.684 6.589 1.00 77.92 C ATOM 984 C GLY A 148 -5.667 4.468 6.206 1.00 66.91 C ATOM 985 O GLY A 148 -6.214 3.447 5.834 1.00 66.04 O ATOM 0 H GLY A 148 -5.763 7.513 6.648 1.00 79.09 H new ATOM 0 HA2 GLY A 148 -6.525 5.749 7.556 1.00 77.92 H new ATOM 0 HA3 GLY A 148 -7.402 5.556 6.281 1.00 77.92 H new ATOM 986 N LYS A 149 -4.348 4.581 6.294 1.00 65.08 N ATOM 987 CA LYS A 149 -3.454 3.541 5.813 1.00 64.48 C ATOM 988 C LYS A 149 -2.312 3.323 6.793 1.00 68.96 C ATOM 989 O LYS A 149 -1.920 4.250 7.495 1.00 66.59 O ATOM 990 CB LYS A 149 -2.897 3.911 4.431 1.00 70.59 C ATOM 991 CG LYS A 149 -3.974 4.373 3.435 1.00 82.95 C ATOM 992 CD LYS A 149 -3.429 4.757 2.055 1.00 92.74 C ATOM 993 CE LYS A 149 -4.551 5.272 1.125 1.00 92.83 C ATOM 994 NZ LYS A 149 -5.586 4.237 0.774 1.00 76.08 N ATOM 0 H LYS A 149 -3.948 5.262 6.634 1.00 65.08 H new ATOM 0 HA LYS A 149 -3.960 2.717 5.737 1.00 64.48 H new ATOM 0 HB2 LYS A 149 -2.239 4.616 4.534 1.00 70.59 H new ATOM 0 HB3 LYS A 149 -2.434 3.143 4.061 1.00 70.59 H new ATOM 0 HG2 LYS A 149 -4.627 3.664 3.328 1.00 82.95 H new ATOM 0 HG3 LYS A 149 -4.442 5.135 3.810 1.00 82.95 H new ATOM 0 HD2 LYS A 149 -2.749 5.442 2.154 1.00 92.74 H new ATOM 0 HD3 LYS A 149 -2.999 3.987 1.650 1.00 92.74 H new ATOM 0 HE2 LYS A 149 -4.992 6.023 1.552 1.00 92.83 H new ATOM 0 HE3 LYS A 149 -4.151 5.605 0.307 1.00 92.83 H new ATOM 0 HZ1 LYS A 149 -6.077 4.528 0.091 1.00 76.08 H new ATOM 0 HZ2 LYS A 149 -5.181 3.478 0.546 1.00 76.08 H new ATOM 0 HZ3 LYS A 149 -6.112 4.093 1.477 1.00 76.08 H new ATOM 995 N LEU A 150 -1.785 2.103 6.853 1.00 62.80 N ATOM 996 CA LEU A 150 -0.557 1.880 7.594 1.00 61.57 C ATOM 997 C LEU A 150 0.238 0.708 7.073 1.00 59.71 C ATOM 998 O LEU A 150 -0.311 -0.226 6.509 1.00 64.18 O ATOM 999 CB LEU A 150 -0.849 1.686 9.074 1.00 64.15 C ATOM 1000 CG LEU A 150 -2.065 0.876 9.480 1.00 61.90 C ATOM 1001 CD1 LEU A 150 -1.629 -0.495 9.904 1.00 56.79 C ATOM 1002 CD2 LEU A 150 -2.750 1.586 10.625 1.00 63.42 C ATOM 0 H LEU A 150 -2.119 1.405 6.478 1.00 62.80 H new ATOM 0 HA LEU A 150 -0.015 2.675 7.470 1.00 61.57 H new ATOM 0 HB2 LEU A 150 -0.071 1.268 9.474 1.00 64.15 H new ATOM 0 HB3 LEU A 150 -0.935 2.566 9.474 1.00 64.15 H new ATOM 0 HG LEU A 150 -2.681 0.789 8.736 1.00 61.90 H new ATOM 0 HD11 LEU A 150 -2.405 -1.015 10.164 1.00 56.79 H new ATOM 0 HD12 LEU A 150 -1.178 -0.934 9.166 1.00 56.79 H new ATOM 0 HD13 LEU A 150 -1.021 -0.423 10.657 1.00 56.79 H new ATOM 0 HD21 LEU A 150 -3.532 1.081 10.898 1.00 63.42 H new ATOM 0 HD22 LEU A 150 -2.137 1.661 11.373 1.00 63.42 H new ATOM 0 HD23 LEU A 150 -3.022 2.472 10.340 1.00 63.42 H new ATOM 1003 N THR A 151 1.548 0.792 7.264 1.00 63.69 N ATOM 1004 CA THR A 151 2.487 -0.272 6.924 1.00 70.76 C ATOM 1005 C THR A 151 3.225 -0.718 8.172 1.00 69.20 C ATOM 1006 O THR A 151 3.550 0.113 9.024 1.00 70.20 O ATOM 1007 CB THR A 151 3.539 0.180 5.904 1.00 62.60 C ATOM 1008 OG1 THR A 151 3.230 1.506 5.469 1.00 71.95 O ATOM 1009 CG2 THR A 151 3.579 -0.765 4.731 1.00 63.48 C ATOM 0 H THR A 151 1.926 1.486 7.603 1.00 63.69 H new ATOM 0 HA THR A 151 1.965 -0.993 6.538 1.00 70.76 H new ATOM 0 HB THR A 151 4.415 0.174 6.322 1.00 62.60 H new ATOM 0 HG1 THR A 151 3.805 1.759 4.911 1.00 71.95 H new ATOM 0 HG21 THR A 151 4.248 -0.465 4.096 1.00 63.48 H new ATOM 0 HG22 THR A 151 3.804 -1.656 5.041 1.00 63.48 H new ATOM 0 HG23 THR A 151 2.710 -0.783 4.300 1.00 63.48 H new ATOM 1010 N LEU A 152 3.520 -2.012 8.251 1.00 55.08 N ATOM 1011 CA LEU A 152 4.178 -2.595 9.405 1.00 50.71 C ATOM 1012 C LEU A 152 4.900 -3.875 9.034 1.00 60.18 C ATOM 1013 O LEU A 152 4.391 -4.712 8.271 1.00 55.39 O ATOM 1014 CB LEU A 152 3.165 -2.873 10.512 1.00 52.74 C ATOM 1015 CG LEU A 152 2.856 -1.654 11.385 1.00 64.74 C ATOM 1016 CD1 LEU A 152 1.375 -1.464 11.573 1.00 54.75 C ATOM 1017 CD2 LEU A 152 3.584 -1.741 12.727 1.00 69.72 C ATOM 0 H LEU A 152 3.341 -2.578 7.629 1.00 55.08 H new ATOM 0 HA LEU A 152 4.833 -1.956 9.727 1.00 50.71 H new ATOM 0 HB2 LEU A 152 2.341 -3.192 10.112 1.00 52.74 H new ATOM 0 HB3 LEU A 152 3.502 -3.587 11.075 1.00 52.74 H new ATOM 0 HG LEU A 152 3.186 -0.870 10.919 1.00 64.74 H new ATOM 0 HD11 LEU A 152 1.216 -0.685 12.129 1.00 54.75 H new ATOM 0 HD12 LEU A 152 0.953 -1.335 10.709 1.00 54.75 H new ATOM 0 HD13 LEU A 152 1.000 -2.249 12.002 1.00 54.75 H new ATOM 0 HD21 LEU A 152 3.373 -0.959 13.261 1.00 69.72 H new ATOM 0 HD22 LEU A 152 3.300 -2.540 13.198 1.00 69.72 H new ATOM 0 HD23 LEU A 152 4.541 -1.779 12.574 1.00 69.72 H new ATOM 1018 N LYS A 153 6.107 -4.022 9.552 1.00 58.44 N ATOM 1019 CA LYS A 153 6.775 -5.299 9.430 1.00 61.77 C ATOM 1020 C LYS A 153 6.754 -5.934 10.833 1.00 60.21 C ATOM 1021 O LYS A 153 7.026 -5.262 11.835 1.00 60.05 O ATOM 1022 CB LYS A 153 8.196 -5.133 8.869 1.00 48.88 C ATOM 1023 CG LYS A 153 8.949 -6.448 8.708 1.00 53.15 C ATOM 1024 CD LYS A 153 10.448 -6.243 8.505 1.00 51.57 C ATOM 1025 CE LYS A 153 11.136 -7.539 8.049 1.00 62.99 C ATOM 1026 NZ LYS A 153 12.561 -7.309 7.648 1.00 70.39 N ATOM 0 H LYS A 153 6.546 -3.411 9.968 1.00 58.44 H new ATOM 0 HA LYS A 153 6.324 -5.880 8.797 1.00 61.77 H new ATOM 0 HB2 LYS A 153 8.145 -4.691 8.007 1.00 48.88 H new ATOM 0 HB3 LYS A 153 8.701 -4.550 9.457 1.00 48.88 H new ATOM 0 HG2 LYS A 153 8.804 -6.998 9.494 1.00 53.15 H new ATOM 0 HG3 LYS A 153 8.587 -6.934 7.951 1.00 53.15 H new ATOM 0 HD2 LYS A 153 10.594 -5.548 7.845 1.00 51.57 H new ATOM 0 HD3 LYS A 153 10.849 -5.936 9.333 1.00 51.57 H new ATOM 0 HE2 LYS A 153 11.104 -8.191 8.767 1.00 62.99 H new ATOM 0 HE3 LYS A 153 10.648 -7.917 7.301 1.00 62.99 H new ATOM 0 HZ1 LYS A 153 12.627 -7.332 6.761 1.00 70.39 H new ATOM 0 HZ2 LYS A 153 12.828 -6.513 7.944 1.00 70.39 H new ATOM 0 HZ3 LYS A 153 13.075 -7.944 8.000 1.00 70.39 H new ATOM 1027 N PHE A 154 6.383 -7.208 10.898 1.00 58.69 N ATOM 1028 CA PHE A 154 6.283 -7.931 12.161 1.00 56.24 C ATOM 1029 C PHE A 154 7.254 -9.060 12.153 1.00 60.50 C ATOM 1030 O PHE A 154 7.264 -9.843 11.208 1.00 61.50 O ATOM 1031 CB PHE A 154 4.884 -8.495 12.394 1.00 52.81 C ATOM 1032 CG PHE A 154 3.854 -7.453 12.670 1.00 59.05 C ATOM 1033 CD1 PHE A 154 3.744 -6.894 13.934 1.00 48.15 C ATOM 1034 CD2 PHE A 154 2.995 -7.020 11.662 1.00 56.41 C ATOM 1035 CE1 PHE A 154 2.785 -5.924 14.196 1.00 51.54 C ATOM 1036 CE2 PHE A 154 2.037 -6.048 11.913 1.00 54.18 C ATOM 1037 CZ PHE A 154 1.930 -5.502 13.185 1.00 54.59 C ATOM 0 H PHE A 154 6.181 -7.680 10.208 1.00 58.69 H new ATOM 0 HA PHE A 154 6.478 -7.303 12.875 1.00 56.24 H new ATOM 0 HB2 PHE A 154 4.616 -9.004 11.613 1.00 52.81 H new ATOM 0 HB3 PHE A 154 4.914 -9.114 13.140 1.00 52.81 H new ATOM 0 HD1 PHE A 154 4.317 -7.171 14.612 1.00 48.15 H new ATOM 0 HD2 PHE A 154 3.065 -7.387 10.810 1.00 56.41 H new ATOM 0 HE1 PHE A 154 2.715 -5.557 15.048 1.00 51.54 H new ATOM 0 HE2 PHE A 154 1.470 -5.764 11.233 1.00 54.18 H new ATOM 0 HZ PHE A 154 1.286 -4.854 13.360 1.00 54.59 H new ATOM 1038 N ILE A 155 8.051 -9.149 13.215 1.00 62.99 N ATOM 1039 CA ILE A 155 9.014 -10.228 13.392 1.00 57.93 C ATOM 1040 C ILE A 155 8.615 -11.043 14.620 1.00 57.98 C ATOM 1041 O ILE A 155 8.235 -10.465 15.658 1.00 53.21 O ATOM 1042 CB ILE A 155 10.462 -9.667 13.542 1.00 59.89 C ATOM 1043 CG1 ILE A 155 11.119 -9.494 12.171 1.00 61.60 C ATOM 1044 CG2 ILE A 155 11.324 -10.580 14.376 1.00 60.53 C ATOM 1045 CD1 ILE A 155 11.183 -8.071 11.698 1.00 62.67 C ATOM 0 H ILE A 155 8.046 -8.578 13.858 1.00 62.99 H new ATOM 0 HA ILE A 155 9.008 -10.798 12.607 1.00 57.93 H new ATOM 0 HB ILE A 155 10.388 -8.807 13.985 1.00 59.89 H new ATOM 0 HG12 ILE A 155 12.019 -9.854 12.207 1.00 61.60 H new ATOM 0 HG13 ILE A 155 10.629 -10.020 11.519 1.00 61.60 H new ATOM 0 HG21 ILE A 155 12.215 -10.205 14.451 1.00 60.53 H new ATOM 0 HG22 ILE A 155 10.937 -10.672 15.261 1.00 60.53 H new ATOM 0 HG23 ILE A 155 11.375 -11.452 13.954 1.00 60.53 H new ATOM 0 HD11 ILE A 155 11.609 -8.038 10.827 1.00 62.67 H new ATOM 0 HD12 ILE A 155 10.285 -7.711 11.631 1.00 62.67 H new ATOM 0 HD13 ILE A 155 11.696 -7.543 12.329 1.00 62.67 H new ATOM 1046 N CYS A 156 8.647 -12.373 14.497 1.00 52.64 N ATOM 1047 CA CYS A 156 8.529 -13.231 15.680 1.00 51.77 C ATOM 1048 C CYS A 156 9.881 -13.352 16.349 1.00 59.61 C ATOM 1049 O CYS A 156 10.689 -14.208 15.975 1.00 62.33 O ATOM 1050 CB CYS A 156 8.018 -14.624 15.346 1.00 52.54 C ATOM 1051 SG CYS A 156 8.014 -15.689 16.817 1.00 58.94 S ATOM 0 H CYS A 156 8.735 -12.792 13.751 1.00 52.64 H new ATOM 0 HA CYS A 156 7.883 -12.815 16.272 1.00 51.77 H new ATOM 0 HB2 CYS A 156 7.120 -14.564 14.984 1.00 52.54 H new ATOM 0 HB3 CYS A 156 8.575 -15.020 14.658 1.00 52.54 H new ATOM 0 HG CYS A 156 7.731 -15.036 17.783 1.00 58.94 H new ATOM 1052 N THR A 157 10.106 -12.501 17.345 1.00 57.46 N ATOM 1053 CA THR A 157 11.393 -12.360 18.011 1.00 39.84 C ATOM 1054 C THR A 157 11.799 -13.516 18.915 1.00 47.22 C ATOM 1055 O THR A 157 12.824 -13.435 19.571 1.00 59.47 O ATOM 1056 CB THR A 157 11.420 -11.086 18.859 1.00 46.02 C ATOM 1057 OG1 THR A 157 10.513 -11.211 19.971 1.00 54.79 O ATOM 1058 CG2 THR A 157 11.032 -9.891 18.009 1.00 47.97 C ATOM 0 H THR A 157 9.500 -11.978 17.659 1.00 57.46 H new ATOM 0 HA THR A 157 12.029 -12.335 17.279 1.00 39.84 H new ATOM 0 HB THR A 157 12.319 -10.955 19.200 1.00 46.02 H new ATOM 0 HG1 THR A 157 10.535 -10.509 20.431 1.00 54.79 H new ATOM 0 HG21 THR A 157 11.051 -9.088 18.552 1.00 47.97 H new ATOM 0 HG22 THR A 157 11.659 -9.799 17.274 1.00 47.97 H new ATOM 0 HG23 THR A 157 10.138 -10.021 17.656 1.00 47.97 H new ATOM 1059 N THR A 158 11.019 -14.586 18.962 1.00 53.04 N ATOM 1060 CA THR A 158 11.414 -15.761 19.745 1.00 55.61 C ATOM 1061 C THR A 158 11.618 -16.953 18.837 1.00 56.99 C ATOM 1062 O THR A 158 11.920 -18.050 19.311 1.00 64.04 O ATOM 1063 CB THR A 158 10.359 -16.159 20.852 1.00 58.64 C ATOM 1064 OG1 THR A 158 9.091 -16.464 20.253 1.00 61.83 O ATOM 1065 CG2 THR A 158 10.169 -15.052 21.877 1.00 53.99 C ATOM 0 H THR A 158 10.265 -14.658 18.555 1.00 53.04 H new ATOM 0 HA THR A 158 12.239 -15.515 20.191 1.00 55.61 H new ATOM 0 HB THR A 158 10.707 -16.943 21.305 1.00 58.64 H new ATOM 0 HG1 THR A 158 8.814 -17.202 20.543 1.00 61.83 H new ATOM 0 HG21 THR A 158 9.517 -15.331 22.538 1.00 53.99 H new ATOM 0 HG22 THR A 158 11.015 -14.868 22.315 1.00 53.99 H new ATOM 0 HG23 THR A 158 9.854 -14.249 21.432 1.00 53.99 H new ATOM 1066 N GLY A 159 11.407 -16.761 17.537 1.00 50.58 N ATOM 1067 CA GLY A 159 11.668 -17.827 16.584 1.00 52.85 C ATOM 1068 C GLY A 159 10.548 -18.165 15.626 1.00 63.50 C ATOM 1069 O GLY A 159 10.093 -17.299 14.867 1.00 73.88 O ATOM 0 H GLY A 159 11.116 -16.029 17.193 1.00 50.58 H new ATOM 0 HA2 GLY A 159 12.450 -17.584 16.064 1.00 52.85 H new ATOM 0 HA3 GLY A 159 11.895 -18.629 17.080 1.00 52.85 H new ATOM 1070 N LYS A 160 10.127 -19.432 15.631 1.00 59.70 N ATOM 1071 CA LYS A 160 8.932 -19.840 14.891 1.00 66.14 C ATOM 1072 C LYS A 160 7.684 -19.354 15.622 1.00 63.81 C ATOM 1073 O LYS A 160 7.662 -19.282 16.842 1.00 65.77 O ATOM 1074 CB LYS A 160 8.883 -21.364 14.696 1.00 63.41 C ATOM 1075 CG LYS A 160 7.670 -21.879 13.883 1.00 74.77 C ATOM 1076 CD LYS A 160 7.567 -21.216 12.481 1.00 80.36 C ATOM 1077 CE LYS A 160 6.151 -21.312 11.839 1.00 78.10 C ATOM 1078 NZ LYS A 160 5.865 -22.618 11.137 1.00 70.05 N ATOM 0 H LYS A 160 10.519 -20.069 16.056 1.00 59.70 H new ATOM 0 HA LYS A 160 8.966 -19.435 14.010 1.00 66.14 H new ATOM 0 HB2 LYS A 160 9.697 -21.646 14.251 1.00 63.41 H new ATOM 0 HB3 LYS A 160 8.875 -21.788 15.568 1.00 63.41 H new ATOM 0 HG2 LYS A 160 7.740 -22.841 13.778 1.00 74.77 H new ATOM 0 HG3 LYS A 160 6.855 -21.706 14.380 1.00 74.77 H new ATOM 0 HD2 LYS A 160 7.816 -20.281 12.556 1.00 80.36 H new ATOM 0 HD3 LYS A 160 8.210 -21.634 11.887 1.00 80.36 H new ATOM 0 HE2 LYS A 160 5.485 -21.178 12.532 1.00 78.10 H new ATOM 0 HE3 LYS A 160 6.048 -20.587 11.203 1.00 78.10 H new ATOM 0 HZ1 LYS A 160 5.043 -22.599 10.797 1.00 70.05 H new ATOM 0 HZ2 LYS A 160 6.454 -22.738 10.481 1.00 70.05 H new ATOM 0 HZ3 LYS A 160 5.930 -23.288 11.719 1.00 70.05 H new ATOM 1079 N LEU A 161 6.668 -18.982 14.855 1.00 72.14 N ATOM 1080 CA LEU A 161 5.347 -18.667 15.390 1.00 62.49 C ATOM 1081 C LEU A 161 4.565 -19.967 15.509 1.00 61.87 C ATOM 1082 O LEU A 161 4.552 -20.778 14.584 1.00 64.99 O ATOM 1083 CB LEU A 161 4.621 -17.670 14.481 1.00 55.29 C ATOM 1084 CG LEU A 161 3.541 -16.801 15.116 1.00 58.00 C ATOM 1085 CD1 LEU A 161 4.167 -15.841 16.116 1.00 52.87 C ATOM 1086 CD2 LEU A 161 2.700 -16.049 14.059 1.00 49.70 C ATOM 0 H LEU A 161 6.725 -18.904 14.000 1.00 72.14 H new ATOM 0 HA LEU A 161 5.429 -18.252 16.263 1.00 62.49 H new ATOM 0 HB2 LEU A 161 5.286 -17.083 14.088 1.00 55.29 H new ATOM 0 HB3 LEU A 161 4.216 -18.167 13.753 1.00 55.29 H new ATOM 0 HG LEU A 161 2.927 -17.385 15.588 1.00 58.00 H new ATOM 0 HD11 LEU A 161 3.474 -15.292 16.515 1.00 52.87 H new ATOM 0 HD12 LEU A 161 4.619 -16.346 16.810 1.00 52.87 H new ATOM 0 HD13 LEU A 161 4.808 -15.272 15.661 1.00 52.87 H new ATOM 0 HD21 LEU A 161 2.027 -15.510 14.504 1.00 49.70 H new ATOM 0 HD22 LEU A 161 3.279 -15.474 13.534 1.00 49.70 H new ATOM 0 HD23 LEU A 161 2.266 -16.690 13.475 1.00 49.70 H new ATOM 1087 N PRO A 162 3.942 -20.201 16.666 1.00 65.38 N ATOM 1088 CA PRO A 162 3.220 -21.471 16.827 1.00 63.76 C ATOM 1089 C PRO A 162 1.810 -21.465 16.220 1.00 64.22 C ATOM 1090 O PRO A 162 1.218 -22.538 16.037 1.00 64.01 O ATOM 1091 CB PRO A 162 3.176 -21.657 18.346 1.00 58.00 C ATOM 1092 CG PRO A 162 3.388 -20.311 18.910 1.00 57.30 C ATOM 1093 CD PRO A 162 4.182 -19.517 17.947 1.00 58.61 C ATOM 0 HA PRO A 162 3.662 -22.194 16.355 1.00 63.76 H new ATOM 0 HB2 PRO A 162 2.324 -22.025 18.629 1.00 58.00 H new ATOM 0 HB3 PRO A 162 3.864 -22.273 18.643 1.00 58.00 H new ATOM 0 HG2 PRO A 162 2.536 -19.879 19.081 1.00 57.30 H new ATOM 0 HG3 PRO A 162 3.851 -20.371 19.760 1.00 57.30 H new ATOM 0 HD2 PRO A 162 3.891 -18.592 17.919 1.00 58.61 H new ATOM 0 HD3 PRO A 162 5.124 -19.511 18.179 1.00 58.61 H new ATOM 1094 N VAL A 163 1.301 -20.277 15.887 1.00 67.22 N ATOM 1095 CA VAL A 163 -0.006 -20.120 15.227 1.00 65.19 C ATOM 1096 C VAL A 163 0.183 -19.421 13.872 1.00 63.06 C ATOM 1097 O VAL A 163 1.242 -18.851 13.625 1.00 66.87 O ATOM 1098 CB VAL A 163 -1.001 -19.318 16.113 1.00 56.36 C ATOM 1099 CG1 VAL A 163 -1.029 -19.883 17.503 1.00 51.54 C ATOM 1100 CG2 VAL A 163 -0.634 -17.845 16.154 1.00 56.23 C ATOM 0 H VAL A 163 1.705 -19.533 16.037 1.00 67.22 H new ATOM 0 HA VAL A 163 -0.385 -21.002 15.088 1.00 65.19 H new ATOM 0 HB VAL A 163 -1.884 -19.398 15.720 1.00 56.36 H new ATOM 0 HG11 VAL A 163 -1.652 -19.376 18.046 1.00 51.54 H new ATOM 0 HG12 VAL A 163 -1.311 -20.811 17.470 1.00 51.54 H new ATOM 0 HG13 VAL A 163 -0.142 -19.828 17.893 1.00 51.54 H new ATOM 0 HG21 VAL A 163 -1.269 -17.369 16.712 1.00 56.23 H new ATOM 0 HG22 VAL A 163 0.258 -17.744 16.521 1.00 56.23 H new ATOM 0 HG23 VAL A 163 -0.657 -17.481 15.255 1.00 56.23 H new ATOM 1101 N PRO A 164 -0.829 -19.467 12.983 1.00 61.47 N ATOM 1102 CA PRO A 164 -0.653 -18.800 11.687 1.00 51.95 C ATOM 1103 C PRO A 164 -0.645 -17.294 11.799 1.00 47.09 C ATOM 1104 O PRO A 164 -1.513 -16.774 12.473 1.00 56.38 O ATOM 1105 CB PRO A 164 -1.877 -19.255 10.892 1.00 59.89 C ATOM 1106 CG PRO A 164 -2.358 -20.483 11.594 1.00 59.95 C ATOM 1107 CD PRO A 164 -2.094 -20.216 13.031 1.00 59.17 C ATOM 0 HA PRO A 164 0.198 -19.028 11.281 1.00 51.95 H new ATOM 0 HB2 PRO A 164 -2.562 -18.568 10.877 1.00 59.89 H new ATOM 0 HB3 PRO A 164 -1.646 -19.445 9.969 1.00 59.89 H new ATOM 0 HG2 PRO A 164 -3.302 -20.637 11.431 1.00 59.95 H new ATOM 0 HG3 PRO A 164 -1.885 -21.273 11.289 1.00 59.95 H new ATOM 0 HD2 PRO A 164 -2.806 -19.699 13.440 1.00 59.17 H new ATOM 0 HD3 PRO A 164 -2.010 -21.036 13.542 1.00 59.17 H new ATOM 1108 N TRP A 165 0.287 -16.610 11.142 1.00 57.06 N ATOM 1109 CA TRP A 165 0.321 -15.138 11.168 1.00 52.23 C ATOM 1110 C TRP A 165 -1.039 -14.478 10.951 1.00 49.45 C ATOM 1111 O TRP A 165 -1.364 -13.532 11.662 1.00 49.72 O ATOM 1112 CB TRP A 165 1.307 -14.581 10.132 1.00 48.31 C ATOM 1113 CG TRP A 165 2.735 -14.577 10.561 1.00 48.00 C ATOM 1114 CD1 TRP A 165 3.717 -15.421 10.135 1.00 58.57 C ATOM 1115 CD2 TRP A 165 3.358 -13.676 11.491 1.00 51.51 C ATOM 1116 NE1 TRP A 165 4.914 -15.107 10.747 1.00 57.03 N ATOM 1117 CE2 TRP A 165 4.716 -14.043 11.587 1.00 51.90 C ATOM 1118 CE3 TRP A 165 2.898 -12.607 12.259 1.00 52.93 C ATOM 1119 CZ2 TRP A 165 5.611 -13.376 12.415 1.00 45.65 C ATOM 1120 CZ3 TRP A 165 3.793 -11.953 13.093 1.00 50.13 C ATOM 1121 CH2 TRP A 165 5.136 -12.337 13.156 1.00 48.13 C ATOM 0 H TRP A 165 0.911 -16.973 10.674 1.00 57.06 H new ATOM 0 HA TRP A 165 0.613 -14.918 12.066 1.00 52.23 H new ATOM 0 HB2 TRP A 165 1.229 -15.103 9.318 1.00 48.31 H new ATOM 0 HB3 TRP A 165 1.046 -13.673 9.913 1.00 48.31 H new ATOM 0 HD1 TRP A 165 3.598 -16.109 9.521 1.00 58.57 H new ATOM 0 HE1 TRP A 165 5.662 -15.513 10.621 1.00 57.03 H new ATOM 0 HE3 TRP A 165 2.009 -12.338 12.213 1.00 52.93 H new ATOM 0 HZ2 TRP A 165 6.504 -13.631 12.461 1.00 45.65 H new ATOM 0 HZ3 TRP A 165 3.495 -11.247 13.619 1.00 50.13 H new ATOM 0 HH2 TRP A 165 5.717 -11.873 13.715 1.00 48.13 H new ATOM 1122 N PRO A 166 -1.837 -14.960 9.972 1.00 52.87 N ATOM 1123 CA PRO A 166 -3.150 -14.344 9.732 1.00 47.63 C ATOM 1124 C PRO A 166 -4.068 -14.197 10.946 1.00 52.20 C ATOM 1125 O PRO A 166 -4.875 -13.265 10.986 1.00 54.73 O ATOM 1126 CB PRO A 166 -3.782 -15.294 8.733 1.00 52.21 C ATOM 1127 CG PRO A 166 -2.642 -15.816 7.968 1.00 56.09 C ATOM 1128 CD PRO A 166 -1.519 -15.947 8.918 1.00 53.52 C ATOM 0 HA PRO A 166 -3.030 -13.426 9.443 1.00 47.63 H new ATOM 0 HB2 PRO A 166 -4.267 -16.006 9.178 1.00 52.21 H new ATOM 0 HB3 PRO A 166 -4.415 -14.836 8.159 1.00 52.21 H new ATOM 0 HG2 PRO A 166 -2.858 -16.674 7.570 1.00 56.09 H new ATOM 0 HG3 PRO A 166 -2.411 -15.216 7.242 1.00 56.09 H new ATOM 0 HD2 PRO A 166 -1.459 -16.846 9.278 1.00 53.52 H new ATOM 0 HD3 PRO A 166 -0.668 -15.754 8.494 1.00 53.52 H new ATOM 1129 N THR A 167 -3.944 -15.091 11.918 1.00 47.28 N ATOM 1130 CA THR A 167 -4.833 -15.086 13.068 1.00 42.33 C ATOM 1131 C THR A 167 -4.471 -14.011 14.099 1.00 48.62 C ATOM 1132 O THR A 167 -5.160 -13.835 15.116 1.00 49.73 O ATOM 1133 CB THR A 167 -4.827 -16.462 13.744 1.00 54.34 C ATOM 1134 OG1 THR A 167 -3.572 -16.679 14.404 1.00 61.48 O ATOM 1135 CG2 THR A 167 -5.004 -17.534 12.709 1.00 52.21 C ATOM 0 H THR A 167 -3.348 -15.711 11.930 1.00 47.28 H new ATOM 0 HA THR A 167 -5.719 -14.878 12.733 1.00 42.33 H new ATOM 0 HB THR A 167 -5.551 -16.493 14.389 1.00 54.34 H new ATOM 0 HG1 THR A 167 -2.955 -16.696 13.834 1.00 61.48 H new ATOM 0 HG21 THR A 167 -5.000 -18.403 13.139 1.00 52.21 H new ATOM 0 HG22 THR A 167 -5.849 -17.405 12.250 1.00 52.21 H new ATOM 0 HG23 THR A 167 -4.278 -17.488 12.068 1.00 52.21 H new ATOM 1136 N LEU A 168 -3.396 -13.281 13.836 1.00 48.30 N ATOM 1137 CA LEU A 168 -2.855 -12.358 14.821 1.00 41.83 C ATOM 1138 C LEU A 168 -3.067 -10.921 14.410 1.00 44.96 C ATOM 1139 O LEU A 168 -2.802 -9.991 15.182 1.00 46.94 O ATOM 1140 CB LEU A 168 -1.368 -12.630 15.027 1.00 41.59 C ATOM 1141 CG LEU A 168 -1.101 -13.712 16.064 1.00 48.46 C ATOM 1142 CD1 LEU A 168 0.399 -13.912 16.308 1.00 45.77 C ATOM 1143 CD2 LEU A 168 -1.803 -13.308 17.347 1.00 46.26 C ATOM 0 H LEU A 168 -2.965 -13.306 13.092 1.00 48.30 H new ATOM 0 HA LEU A 168 -3.329 -12.500 15.656 1.00 41.83 H new ATOM 0 HB2 LEU A 168 -0.972 -12.894 14.182 1.00 41.59 H new ATOM 0 HB3 LEU A 168 -0.929 -11.810 15.302 1.00 41.59 H new ATOM 0 HG LEU A 168 -1.442 -14.560 15.740 1.00 48.46 H new ATOM 0 HD11 LEU A 168 0.529 -14.607 16.972 1.00 45.77 H new ATOM 0 HD12 LEU A 168 0.830 -14.173 15.479 1.00 45.77 H new ATOM 0 HD13 LEU A 168 0.788 -13.083 16.627 1.00 45.77 H new ATOM 0 HD21 LEU A 168 -1.649 -13.983 18.027 1.00 46.26 H new ATOM 0 HD22 LEU A 168 -1.454 -12.456 17.652 1.00 46.26 H new ATOM 0 HD23 LEU A 168 -2.756 -13.227 17.183 1.00 46.26 H new ATOM 1144 N VAL A 169 -3.556 -10.768 13.189 1.00 38.44 N ATOM 1145 CA VAL A 169 -3.607 -9.498 12.498 1.00 42.25 C ATOM 1146 C VAL A 169 -4.509 -8.489 13.209 1.00 43.09 C ATOM 1147 O VAL A 169 -4.126 -7.324 13.405 1.00 42.83 O ATOM 1148 CB VAL A 169 -4.070 -9.740 11.018 1.00 48.85 C ATOM 1149 CG1 VAL A 169 -4.258 -8.431 10.231 1.00 45.02 C ATOM 1150 CG2 VAL A 169 -3.072 -10.644 10.313 1.00 44.75 C ATOM 0 H VAL A 169 -3.876 -11.421 12.729 1.00 38.44 H new ATOM 0 HA VAL A 169 -2.718 -9.109 12.498 1.00 42.25 H new ATOM 0 HB VAL A 169 -4.939 -10.170 11.052 1.00 48.85 H new ATOM 0 HG11 VAL A 169 -4.543 -8.635 9.327 1.00 45.02 H new ATOM 0 HG12 VAL A 169 -4.931 -7.885 10.667 1.00 45.02 H new ATOM 0 HG13 VAL A 169 -3.418 -7.946 10.203 1.00 45.02 H new ATOM 0 HG21 VAL A 169 -3.359 -10.793 9.399 1.00 44.75 H new ATOM 0 HG22 VAL A 169 -2.198 -10.223 10.312 1.00 44.75 H new ATOM 0 HG23 VAL A 169 -3.021 -11.494 10.778 1.00 44.75 H new ATOM 1151 N THR A 170 -5.701 -8.943 13.593 1.00 46.43 N ATOM 1152 CA THR A 170 -6.648 -8.126 14.353 1.00 50.26 C ATOM 1153 C THR A 170 -6.074 -7.719 15.697 1.00 46.97 C ATOM 1154 O THR A 170 -6.269 -6.601 16.159 1.00 42.68 O ATOM 1155 CB THR A 170 -7.966 -8.866 14.604 1.00 58.56 C ATOM 1156 OG1 THR A 170 -7.690 -10.165 15.155 1.00 50.66 O ATOM 1157 CG2 THR A 170 -8.772 -8.997 13.306 1.00 49.81 C ATOM 0 H THR A 170 -5.985 -9.736 13.420 1.00 46.43 H new ATOM 0 HA THR A 170 -6.816 -7.338 13.812 1.00 50.26 H new ATOM 0 HB THR A 170 -8.497 -8.356 15.236 1.00 58.56 H new ATOM 0 HG1 THR A 170 -8.412 -10.542 15.360 1.00 50.66 H new ATOM 0 HG21 THR A 170 -9.601 -9.467 13.486 1.00 49.81 H new ATOM 0 HG22 THR A 170 -8.971 -8.114 12.958 1.00 49.81 H new ATOM 0 HG23 THR A 170 -8.255 -9.493 12.652 1.00 49.81 H new ATOM 1158 N THR A 171 -5.344 -8.632 16.317 1.00 39.94 N ATOM 1159 CA THR A 171 -4.723 -8.323 17.591 1.00 40.58 C ATOM 1160 C THR A 171 -3.529 -7.395 17.407 1.00 48.45 C ATOM 1161 O THR A 171 -3.341 -6.459 18.197 1.00 51.62 O ATOM 1162 CB THR A 171 -4.323 -9.610 18.330 1.00 43.95 C ATOM 1163 OG1 THR A 171 -5.509 -10.347 18.663 1.00 46.89 O ATOM 1164 CG2 THR A 171 -3.562 -9.288 19.603 1.00 42.55 C ATOM 0 H THR A 171 -5.197 -9.426 16.022 1.00 39.94 H new ATOM 0 HA THR A 171 -5.374 -7.857 18.139 1.00 40.58 H new ATOM 0 HB THR A 171 -3.749 -10.136 17.751 1.00 43.95 H new ATOM 0 HG1 THR A 171 -5.297 -11.053 19.066 1.00 46.89 H new ATOM 0 HG21 THR A 171 -3.320 -10.113 20.053 1.00 42.55 H new ATOM 0 HG22 THR A 171 -2.758 -8.792 19.383 1.00 42.55 H new ATOM 0 HG23 THR A 171 -4.121 -8.753 20.188 1.00 42.55 H new ATOM 1165 N LEU A 172 -2.741 -7.648 16.361 1.00 49.70 N ATOM 1166 CA LEU A 172 -1.629 -6.778 15.977 1.00 47.14 C ATOM 1167 C LEU A 172 -2.103 -5.454 15.406 1.00 50.78 C ATOM 1168 O LEU A 172 -1.655 -4.394 15.850 1.00 56.67 O ATOM 1169 CB LEU A 172 -0.736 -7.466 14.953 1.00 54.49 C ATOM 1170 CG LEU A 172 0.448 -8.312 15.436 1.00 51.09 C ATOM 1171 CD1 LEU A 172 0.266 -8.724 16.860 1.00 50.53 C ATOM 1172 CD2 LEU A 172 0.653 -9.530 14.539 1.00 43.88 C ATOM 0 H LEU A 172 -2.838 -8.334 15.851 1.00 49.70 H new ATOM 0 HA LEU A 172 -1.128 -6.598 16.788 1.00 47.14 H new ATOM 0 HB2 LEU A 172 -1.301 -8.039 14.411 1.00 54.49 H new ATOM 0 HB3 LEU A 172 -0.383 -6.779 14.366 1.00 54.49 H new ATOM 0 HG LEU A 172 1.246 -7.764 15.383 1.00 51.09 H new ATOM 0 HD11 LEU A 172 1.026 -9.257 17.143 1.00 50.53 H new ATOM 0 HD12 LEU A 172 0.199 -7.934 17.420 1.00 50.53 H new ATOM 0 HD13 LEU A 172 -0.546 -9.249 16.944 1.00 50.53 H new ATOM 0 HD21 LEU A 172 1.406 -10.048 14.864 1.00 43.88 H new ATOM 0 HD22 LEU A 172 -0.146 -10.079 14.551 1.00 43.88 H new ATOM 0 HD23 LEU A 172 0.830 -9.237 13.631 1.00 43.88 H new HETATM 1173 N1 CRO A 173 -3.174 -4.840 14.672 1.00 56.65 N HETATM 1174 CA1 CRO A 173 -3.951 -3.751 14.116 1.00 51.08 C HETATM 1175 CB1 CRO A 173 -3.882 -3.987 12.624 1.00 51.96 C HETATM 1176 OG1 CRO A 173 -2.511 -4.110 12.246 1.00 52.82 O HETATM 1177 C1 CRO A 173 -5.367 -3.900 14.494 1.00 56.64 C HETATM 1178 N2 CRO A 173 -6.297 -4.298 13.576 1.00 56.16 N HETATM 1179 N3 CRO A 173 -5.914 -3.673 15.731 1.00 56.98 N HETATM 1180 C2 CRO A 173 -7.227 -3.938 15.615 1.00 59.23 C HETATM 1181 O2 CRO A 173 -8.187 -3.920 16.513 1.00 70.62 O HETATM 1182 CA2 CRO A 173 -7.465 -4.353 14.236 1.00 56.53 C HETATM 1183 CA3 CRO A 173 -5.173 -3.249 16.918 1.00 56.31 C HETATM 1184 C3 CRO A 173 -5.039 -1.757 17.072 1.00 63.49 C HETATM 1185 O3 CRO A 173 -4.810 -1.337 18.229 1.00 60.70 O HETATM 1186 CB2 CRO A 173 -8.766 -4.692 13.621 1.00 59.43 C HETATM 1187 CG2 CRO A 173 -9.015 -5.224 12.267 1.00 62.16 C HETATM 1188 CD1 CRO A 173 -7.991 -5.517 11.374 1.00 56.12 C HETATM 1189 CD2 CRO A 173 -10.312 -5.644 11.998 1.00 56.39 C HETATM 1190 CE1 CRO A 173 -8.303 -6.137 10.173 1.00 60.43 C HETATM 1191 CE2 CRO A 173 -10.626 -6.259 10.807 1.00 55.21 C HETATM 1192 CZ CRO A 173 -9.619 -6.505 9.892 1.00 59.90 C HETATM 1193 OH CRO A 173 -9.941 -7.104 8.714 1.00 64.50 O HETATM 0 HOG1 CRO A 173 -2.459 -4.243 11.418 1.00 52.82 H new HETATM 0 HA32 CRO A 173 -5.614 -3.605 17.705 1.00 56.31 H new HETATM 0 HA31 CRO A 173 -4.286 -3.640 16.888 1.00 56.31 H new HETATM 0 HE2 CRO A 173 -11.541 -6.516 10.612 1.00 55.21 H new HETATM 0 HE1 CRO A 173 -7.603 -6.315 9.526 1.00 60.43 H new HETATM 0 HD2 CRO A 173 -11.007 -5.502 12.660 1.00 56.39 H new HETATM 0 HD1 CRO A 173 -7.072 -5.291 11.587 1.00 56.12 H new HETATM 0 HB2 CRO A 173 -9.550 -4.547 14.174 1.00 59.43 H new HETATM 0 HA1 CRO A 173 -3.626 -2.887 14.413 1.00 51.08 H new ATOM 1194 N VAL A 174 -4.780 -0.986 15.890 1.00 65.80 N ATOM 1195 CA VAL A 174 -4.495 0.430 16.116 1.00 59.42 C ATOM 1196 C VAL A 174 -5.522 1.296 15.392 1.00 63.92 C ATOM 1197 O VAL A 174 -5.193 2.147 14.568 1.00 61.96 O ATOM 1198 CB VAL A 174 -3.057 0.821 15.670 1.00 57.34 C ATOM 1199 CG1 VAL A 174 -2.019 0.189 16.587 1.00 55.11 C ATOM 1200 CG2 VAL A 174 -2.794 0.436 14.226 1.00 62.98 C ATOM 0 HA VAL A 174 -4.554 0.586 17.072 1.00 59.42 H new ATOM 0 HB VAL A 174 -2.984 1.786 15.736 1.00 57.34 H new ATOM 0 HG11 VAL A 174 -1.130 0.444 16.294 1.00 55.11 H new ATOM 0 HG12 VAL A 174 -2.160 0.497 17.496 1.00 55.11 H new ATOM 0 HG13 VAL A 174 -2.105 -0.777 16.556 1.00 55.11 H new ATOM 0 HG21 VAL A 174 -1.891 0.693 13.982 1.00 62.98 H new ATOM 0 HG22 VAL A 174 -2.895 -0.523 14.123 1.00 62.98 H new ATOM 0 HG23 VAL A 174 -3.427 0.891 13.649 1.00 62.98 H new ATOM 1201 N GLN A 175 -6.779 1.104 15.758 1.00 65.72 N ATOM 1202 CA GLN A 175 -7.891 1.683 15.030 1.00 65.77 C ATOM 1203 C GLN A 175 -7.998 3.190 15.111 1.00 66.07 C ATOM 1204 O GLN A 175 -8.838 3.813 14.452 1.00 71.14 O ATOM 1205 CB GLN A 175 -9.151 1.026 15.525 1.00 65.47 C ATOM 1206 CG GLN A 175 -9.096 -0.424 15.193 1.00 59.06 C ATOM 1207 CD GLN A 175 -10.232 -1.175 15.754 1.00 63.51 C ATOM 1208 OE1 GLN A 175 -10.672 -0.914 16.876 1.00 67.13 O ATOM 1209 NE2 GLN A 175 -10.735 -2.123 14.984 1.00 66.58 N ATOM 0 H GLN A 175 -7.011 0.632 16.439 1.00 65.72 H new ATOM 0 HA GLN A 175 -7.741 1.512 14.087 1.00 65.77 H new ATOM 0 HB2 GLN A 175 -9.240 1.148 16.483 1.00 65.47 H new ATOM 0 HB3 GLN A 175 -9.928 1.436 15.113 1.00 65.47 H new ATOM 0 HG2 GLN A 175 -9.085 -0.532 14.229 1.00 59.06 H new ATOM 0 HG3 GLN A 175 -8.267 -0.799 15.529 1.00 59.06 H new ATOM 0 HE21 GLN A 175 -10.396 -2.271 14.207 1.00 66.58 H new ATOM 0 HE22 GLN A 175 -11.401 -2.592 15.259 1.00 66.58 H new ATOM 1210 N CYS A 176 -7.119 3.784 15.898 1.00 71.46 N ATOM 1211 CA CYS A 176 -7.010 5.229 15.928 1.00 73.85 C ATOM 1212 C CYS A 176 -6.601 5.752 14.556 1.00 74.04 C ATOM 1213 O CYS A 176 -6.794 6.918 14.251 1.00 81.45 O ATOM 1214 CB CYS A 176 -6.019 5.680 17.014 1.00 75.25 C ATOM 1215 SG CYS A 176 -4.446 4.770 17.121 1.00 72.19 S ATOM 0 H CYS A 176 -6.577 3.370 16.422 1.00 71.46 H new ATOM 0 HA CYS A 176 -7.877 5.602 16.150 1.00 73.85 H new ATOM 0 HB2 CYS A 176 -5.816 6.617 16.868 1.00 75.25 H new ATOM 0 HB3 CYS A 176 -6.464 5.617 17.874 1.00 75.25 H new ATOM 0 HG CYS A 176 -4.465 3.846 16.356 1.00 72.19 H new ATOM 1216 N PHE A 177 -6.062 4.880 13.717 1.00 62.22 N ATOM 1217 CA PHE A 177 -5.610 5.308 12.412 1.00 70.90 C ATOM 1218 C PHE A 177 -6.682 5.298 11.314 1.00 69.84 C ATOM 1219 O PHE A 177 -6.370 5.574 10.163 1.00 69.70 O ATOM 1220 CB PHE A 177 -4.440 4.446 11.972 1.00 69.53 C ATOM 1221 CG PHE A 177 -3.142 4.831 12.592 1.00 76.63 C ATOM 1222 CD1 PHE A 177 -2.446 5.940 12.137 1.00 78.55 C ATOM 1223 CD2 PHE A 177 -2.599 4.073 13.613 1.00 74.39 C ATOM 1224 CE1 PHE A 177 -1.237 6.292 12.698 1.00 78.64 C ATOM 1225 CE2 PHE A 177 -1.386 4.414 14.176 1.00 74.53 C ATOM 1226 CZ PHE A 177 -0.706 5.528 13.721 1.00 82.70 C ATOM 0 H PHE A 177 -5.951 4.044 13.885 1.00 62.22 H new ATOM 0 HA PHE A 177 -5.353 6.237 12.522 1.00 70.90 H new ATOM 0 HB2 PHE A 177 -4.631 3.520 12.191 1.00 69.53 H new ATOM 0 HB3 PHE A 177 -4.356 4.498 11.007 1.00 69.53 H new ATOM 0 HD1 PHE A 177 -2.799 6.452 11.446 1.00 78.55 H new ATOM 0 HD2 PHE A 177 -3.056 3.325 13.924 1.00 74.39 H new ATOM 0 HE1 PHE A 177 -0.780 7.041 12.389 1.00 78.64 H new ATOM 0 HE2 PHE A 177 -1.027 3.896 14.860 1.00 74.53 H new ATOM 0 HZ PHE A 177 0.109 5.764 14.103 1.00 82.70 H new ATOM 1227 N SER A 178 -7.929 4.991 11.653 1.00 66.52 N ATOM 1228 CA SER A 178 -9.001 5.012 10.658 1.00 70.76 C ATOM 1229 C SER A 178 -9.166 6.406 10.059 1.00 78.82 C ATOM 1230 O SER A 178 -8.986 7.409 10.759 1.00 76.66 O ATOM 1231 CB SER A 178 -10.333 4.566 11.272 1.00 74.23 C ATOM 1232 OG SER A 178 -10.171 3.450 12.137 1.00 78.91 O ATOM 0 H SER A 178 -8.177 4.769 12.446 1.00 66.52 H new ATOM 0 HA SER A 178 -8.752 4.391 9.955 1.00 70.76 H new ATOM 0 HB2 SER A 178 -10.724 5.304 11.766 1.00 74.23 H new ATOM 0 HB3 SER A 178 -10.955 4.338 10.563 1.00 74.23 H new ATOM 0 HG SER A 178 -9.853 3.708 12.871 1.00 78.91 H new ATOM 1233 N ARG A 179 -9.503 6.462 8.768 1.00 78.23 N ATOM 1234 CA ARG A 179 -9.856 7.722 8.102 1.00 75.54 C ATOM 1235 C ARG A 179 -11.338 8.017 8.329 1.00 79.02 C ATOM 1236 O ARG A 179 -12.206 7.393 7.720 1.00 81.21 O ATOM 1237 CB ARG A 179 -9.532 7.660 6.599 1.00 81.55 C ATOM 1238 CG ARG A 179 -9.940 8.894 5.771 1.00 87.01 C ATOM 1239 CD ARG A 179 -9.471 8.804 4.290 1.00 90.26 C ATOM 1240 NE ARG A 179 -10.334 7.988 3.421 1.00 93.77 N ATOM 1241 CZ ARG A 179 -9.898 7.240 2.401 1.00 90.69 C ATOM 1242 NH1 ARG A 179 -8.602 7.191 2.110 1.00 87.16 N ATOM 1243 NH2 ARG A 179 -10.756 6.533 1.666 1.00 79.31 N ATOM 0 H ARG A 179 -9.534 5.773 8.254 1.00 78.23 H new ATOM 0 HA ARG A 179 -9.328 8.440 8.483 1.00 75.54 H new ATOM 0 HB2 ARG A 179 -8.577 7.525 6.497 1.00 81.55 H new ATOM 0 HB3 ARG A 179 -9.970 6.881 6.223 1.00 81.55 H new ATOM 0 HG2 ARG A 179 -10.905 8.991 5.796 1.00 87.01 H new ATOM 0 HG3 ARG A 179 -9.564 9.691 6.178 1.00 87.01 H new ATOM 0 HD2 ARG A 179 -9.420 9.701 3.924 1.00 90.26 H new ATOM 0 HD3 ARG A 179 -8.573 8.438 4.269 1.00 90.26 H new ATOM 0 HE ARG A 179 -11.179 7.992 3.580 1.00 93.77 H new ATOM 0 HH11 ARG A 179 -8.039 7.642 2.578 1.00 87.16 H new ATOM 0 HH12 ARG A 179 -8.327 6.709 1.453 1.00 87.16 H new ATOM 0 HH21 ARG A 179 -11.597 6.556 1.846 1.00 79.31 H new ATOM 0 HH22 ARG A 179 -10.469 6.054 1.012 1.00 79.31 H new ATOM 1244 N TYR A 180 -11.620 8.947 9.239 1.00 84.11 N ATOM 1245 CA TYR A 180 -12.994 9.352 9.548 1.00 87.28 C ATOM 1246 C TYR A 180 -13.432 10.539 8.673 1.00 94.80 C ATOM 1247 O TYR A 180 -12.851 11.625 8.750 1.00 93.46 O ATOM 1248 CB TYR A 180 -13.125 9.711 11.042 1.00 90.79 C ATOM 1249 CG TYR A 180 -13.492 8.546 11.950 1.00 85.84 C ATOM 1250 CD1 TYR A 180 -12.525 7.665 12.418 1.00 74.91 C ATOM 1251 CD2 TYR A 180 -14.811 8.331 12.335 1.00 90.22 C ATOM 1252 CE1 TYR A 180 -12.861 6.603 13.238 1.00 71.14 C ATOM 1253 CE2 TYR A 180 -15.156 7.268 13.159 1.00 82.08 C ATOM 1254 CZ TYR A 180 -14.178 6.409 13.606 1.00 75.68 C ATOM 1255 OH TYR A 180 -14.528 5.354 14.420 1.00 71.38 O ATOM 0 H TYR A 180 -11.021 9.362 9.696 1.00 84.11 H new ATOM 0 HA TYR A 180 -13.578 8.603 9.353 1.00 87.28 H new ATOM 0 HB2 TYR A 180 -12.285 10.089 11.346 1.00 90.79 H new ATOM 0 HB3 TYR A 180 -13.798 10.403 11.137 1.00 90.79 H new ATOM 0 HD1 TYR A 180 -11.636 7.792 12.176 1.00 74.91 H new ATOM 0 HD2 TYR A 180 -15.474 8.910 12.035 1.00 90.22 H new ATOM 0 HE1 TYR A 180 -12.202 6.021 13.541 1.00 71.14 H new ATOM 0 HE2 TYR A 180 -16.043 7.137 13.407 1.00 82.08 H new ATOM 0 HH TYR A 180 -15.361 5.245 14.395 1.00 71.38 H new ATOM 1256 N PRO A 181 -14.456 10.334 7.827 1.00 98.98 N ATOM 1257 CA PRO A 181 -15.014 11.433 7.027 1.00 95.40 C ATOM 1258 C PRO A 181 -15.398 12.637 7.883 1.00100.52 C ATOM 1259 O PRO A 181 -15.521 12.529 9.106 1.00 99.28 O ATOM 1260 CB PRO A 181 -16.251 10.805 6.384 1.00 82.28 C ATOM 1261 CG PRO A 181 -15.930 9.371 6.305 1.00 93.12 C ATOM 1262 CD PRO A 181 -15.125 9.056 7.539 1.00 94.69 C ATOM 0 HA PRO A 181 -14.375 11.780 6.385 1.00 95.40 H new ATOM 0 HB2 PRO A 181 -17.046 10.961 6.918 1.00 82.28 H new ATOM 0 HB3 PRO A 181 -16.422 11.179 5.505 1.00 82.28 H new ATOM 0 HG2 PRO A 181 -16.738 8.836 6.272 1.00 93.12 H new ATOM 0 HG3 PRO A 181 -15.425 9.172 5.501 1.00 93.12 H new ATOM 0 HD2 PRO A 181 -15.690 8.772 8.274 1.00 94.69 H new ATOM 0 HD3 PRO A 181 -14.486 8.343 7.380 1.00 94.69 H new ATOM 1263 N ASP A 182 -15.595 13.778 7.237 1.00103.25 N ATOM 1264 CA ASP A 182 -15.764 15.030 7.959 1.00105.84 C ATOM 1265 C ASP A 182 -17.002 15.048 8.836 1.00102.24 C ATOM 1266 O ASP A 182 -16.977 15.594 9.941 1.00 99.61 O ATOM 1267 CB ASP A 182 -15.808 16.186 6.973 1.00106.46 C ATOM 1268 CG ASP A 182 -14.579 16.237 6.107 1.00111.60 C ATOM 1269 OD1 ASP A 182 -14.561 15.536 5.069 1.00117.87 O ATOM 1270 OD2 ASP A 182 -13.625 16.956 6.479 1.00110.10 O ATOM 0 H ASP A 182 -15.634 13.849 6.381 1.00103.25 H new ATOM 0 HA ASP A 182 -15.002 15.122 8.552 1.00105.84 H new ATOM 0 HB2 ASP A 182 -16.595 16.101 6.412 1.00106.46 H new ATOM 0 HB3 ASP A 182 -15.895 17.021 7.459 1.00106.46 H new ATOM 1271 N HIS A 183 -18.074 14.435 8.346 1.00103.23 N ATOM 1272 CA HIS A 183 -19.358 14.453 9.047 1.00108.14 C ATOM 1273 C HIS A 183 -19.461 13.387 10.132 1.00105.89 C ATOM 1274 O HIS A 183 -20.524 13.198 10.725 1.00111.50 O ATOM 1275 CB HIS A 183 -20.507 14.274 8.052 1.00110.01 C ATOM 1276 CG HIS A 183 -20.598 12.898 7.472 1.00102.22 C ATOM 1277 ND1 HIS A 183 -19.611 12.357 6.678 1.00100.66 N ATOM 1278 CD2 HIS A 183 -21.566 11.955 7.563 1.00110.56 C ATOM 1279 CE1 HIS A 183 -19.963 11.137 6.312 1.00104.00 C ATOM 1280 NE2 HIS A 183 -21.146 10.869 6.834 1.00109.08 N ATOM 0 H HIS A 183 -18.081 14.000 7.604 1.00103.23 H new ATOM 0 HA HIS A 183 -19.420 15.317 9.483 1.00108.14 H new ATOM 0 HB2 HIS A 183 -21.343 14.484 8.496 1.00110.01 H new ATOM 0 HB3 HIS A 183 -20.401 14.913 7.330 1.00110.01 H new ATOM 0 HD2 HIS A 183 -22.366 12.029 8.032 1.00110.56 H new ATOM 0 HE1 HIS A 183 -19.462 10.564 5.777 1.00104.00 H new ATOM 0 HE2 HIS A 183 -21.582 10.135 6.734 1.00109.08 H new ATOM 1281 N MET A 184 -18.364 12.685 10.383 1.00101.72 N ATOM 1282 CA MET A 184 -18.364 11.648 11.398 1.00100.19 C ATOM 1283 C MET A 184 -17.267 11.912 12.402 1.00104.21 C ATOM 1284 O MET A 184 -17.158 11.210 13.407 1.00106.28 O ATOM 1285 CB MET A 184 -18.188 10.274 10.767 1.00 95.98 C ATOM 1286 CG MET A 184 -19.283 9.933 9.790 1.00 97.39 C ATOM 1287 SD MET A 184 -19.059 8.307 9.072 1.00 88.52 S ATOM 1288 CE MET A 184 -19.328 7.270 10.514 1.00 83.14 C ATOM 0 H MET A 184 -17.613 12.794 9.978 1.00101.72 H new ATOM 0 HA MET A 184 -19.220 11.661 11.855 1.00100.19 H new ATOM 0 HB2 MET A 184 -17.332 10.240 10.312 1.00 95.98 H new ATOM 0 HB3 MET A 184 -18.164 9.602 11.467 1.00 95.98 H new ATOM 0 HG2 MET A 184 -20.141 9.971 10.241 1.00 97.39 H new ATOM 0 HG3 MET A 184 -19.304 10.598 9.084 1.00 97.39 H new ATOM 0 HE1 MET A 184 -19.882 6.512 10.269 1.00 83.14 H new ATOM 0 HE2 MET A 184 -18.475 6.952 10.848 1.00 83.14 H new ATOM 0 HE3 MET A 184 -19.773 7.785 11.205 1.00 83.14 H new ATOM 1289 N LYS A 185 -16.483 12.951 12.133 1.00 97.99 N ATOM 1290 CA LYS A 185 -15.312 13.303 12.929 1.00 94.87 C ATOM 1291 C LYS A 185 -15.523 13.254 14.450 1.00102.02 C ATOM 1292 O LYS A 185 -14.551 13.171 15.208 1.00104.36 O ATOM 1293 CB LYS A 185 -14.839 14.698 12.532 1.00100.64 C ATOM 1294 CG LYS A 185 -13.412 15.002 12.928 1.00103.90 C ATOM 1295 CD LYS A 185 -12.450 14.253 12.029 1.00107.16 C ATOM 1296 CE LYS A 185 -12.779 14.511 10.569 1.00100.40 C ATOM 1297 NZ LYS A 185 -11.686 14.066 9.678 1.00102.07 N ATOM 0 H LYS A 185 -16.619 13.481 11.470 1.00 97.99 H new ATOM 0 HA LYS A 185 -14.646 12.625 12.734 1.00 94.87 H new ATOM 0 HB2 LYS A 185 -14.926 14.797 11.571 1.00100.64 H new ATOM 0 HB3 LYS A 185 -15.425 15.356 12.939 1.00100.64 H new ATOM 0 HG2 LYS A 185 -13.248 15.956 12.865 1.00103.90 H new ATOM 0 HG3 LYS A 185 -13.265 14.749 13.853 1.00103.90 H new ATOM 0 HD2 LYS A 185 -11.540 14.532 12.216 1.00107.16 H new ATOM 0 HD3 LYS A 185 -12.499 13.302 12.214 1.00107.16 H new ATOM 0 HE2 LYS A 185 -13.598 14.047 10.334 1.00100.40 H new ATOM 0 HE3 LYS A 185 -12.941 15.458 10.435 1.00100.40 H new ATOM 0 HZ1 LYS A 185 -11.558 14.673 9.040 1.00102.07 H new ATOM 0 HZ2 LYS A 185 -10.938 13.970 10.151 1.00102.07 H new ATOM 0 HZ3 LYS A 185 -11.904 13.287 9.307 1.00102.07 H new ATOM 1298 N GLN A 186 -16.780 13.301 14.893 1.00 95.75 N ATOM 1299 CA GLN A 186 -17.092 13.268 16.322 1.00101.41 C ATOM 1300 C GLN A 186 -17.377 11.862 16.827 1.00 98.69 C ATOM 1301 O GLN A 186 -17.721 11.675 17.990 1.00101.16 O ATOM 1302 CB GLN A 186 -18.286 14.173 16.640 1.00103.03 C ATOM 1303 CG GLN A 186 -18.920 14.814 15.422 1.00112.25 C ATOM 1304 CD GLN A 186 -20.104 14.034 14.897 1.00109.88 C ATOM 1305 OE1 GLN A 186 -21.054 13.762 15.633 1.00112.01 O ATOM 1306 NE2 GLN A 186 -20.060 13.675 13.617 1.00103.51 N ATOM 0 H GLN A 186 -17.468 13.352 14.380 1.00 95.75 H new ATOM 0 HA GLN A 186 -16.302 13.594 16.780 1.00101.41 H new ATOM 0 HB2 GLN A 186 -18.959 13.652 17.106 1.00103.03 H new ATOM 0 HB3 GLN A 186 -17.997 14.872 17.247 1.00103.03 H new ATOM 0 HG2 GLN A 186 -19.205 15.714 15.647 1.00112.25 H new ATOM 0 HG3 GLN A 186 -18.255 14.894 14.721 1.00112.25 H new ATOM 0 HE21 GLN A 186 -19.379 13.884 13.135 1.00103.51 H new ATOM 0 HE22 GLN A 186 -20.713 13.234 13.271 1.00103.51 H new ATOM 1307 N HIS A 187 -17.232 10.876 15.951 1.00 99.34 N ATOM 1308 CA HIS A 187 -17.431 9.481 16.331 1.00 99.34 C ATOM 1309 C HIS A 187 -16.105 8.747 16.425 1.00 95.76 C ATOM 1310 O HIS A 187 -16.065 7.528 16.601 1.00 92.68 O ATOM 1311 CB HIS A 187 -18.343 8.789 15.330 1.00 98.52 C ATOM 1312 CG HIS A 187 -19.659 9.472 15.163 1.00101.57 C ATOM 1313 ND1 HIS A 187 -20.827 8.973 15.695 1.00101.76 N ATOM 1314 CD2 HIS A 187 -19.988 10.630 14.545 1.00101.68 C ATOM 1315 CE1 HIS A 187 -21.823 9.788 15.398 1.00103.08 C ATOM 1316 NE2 HIS A 187 -21.340 10.801 14.701 1.00104.36 N ATOM 0 H HIS A 187 -17.017 10.993 15.126 1.00 99.34 H new ATOM 0 HA HIS A 187 -17.850 9.463 17.206 1.00 99.34 H new ATOM 0 HB2 HIS A 187 -17.896 8.746 14.470 1.00 98.52 H new ATOM 0 HB3 HIS A 187 -18.494 7.875 15.617 1.00 98.52 H new ATOM 0 HD2 HIS A 187 -19.407 11.202 14.098 1.00101.68 H new ATOM 0 HE1 HIS A 187 -22.713 9.669 15.639 1.00103.08 H new ATOM 0 HE2 HIS A 187 -21.799 11.461 14.395 1.00104.36 H new ATOM 1317 N ASP A 188 -15.024 9.508 16.295 1.00 86.70 N ATOM 1318 CA ASP A 188 -13.693 8.968 16.431 1.00 77.55 C ATOM 1319 C ASP A 188 -13.283 8.940 17.896 1.00 90.02 C ATOM 1320 O ASP A 188 -12.528 9.792 18.376 1.00 89.20 O ATOM 1321 CB ASP A 188 -12.709 9.782 15.617 1.00 86.12 C ATOM 1322 CG ASP A 188 -11.449 9.024 15.326 1.00 81.84 C ATOM 1323 OD1 ASP A 188 -11.139 8.076 16.079 1.00 74.56 O ATOM 1324 OD2 ASP A 188 -10.775 9.377 14.339 1.00 84.71 O ATOM 0 H ASP A 188 -15.049 10.351 16.126 1.00 86.70 H new ATOM 0 HA ASP A 188 -13.690 8.058 16.094 1.00 77.55 H new ATOM 0 HB2 ASP A 188 -13.125 10.048 14.782 1.00 86.12 H new ATOM 0 HB3 ASP A 188 -12.491 10.596 16.097 1.00 86.12 H new ATOM 1325 N PHE A 189 -13.813 7.947 18.598 1.00 92.14 N ATOM 1326 CA PHE A 189 -13.450 7.676 19.974 1.00 89.05 C ATOM 1327 C PHE A 189 -11.956 7.436 20.104 1.00 82.22 C ATOM 1328 O PHE A 189 -11.298 8.013 20.963 1.00 92.05 O ATOM 1329 CB PHE A 189 -14.225 6.458 20.486 1.00 97.96 C ATOM 1330 CG PHE A 189 -13.622 5.821 21.710 1.00 96.45 C ATOM 1331 CD1 PHE A 189 -14.048 6.190 22.973 1.00 96.01 C ATOM 1332 CD2 PHE A 189 -12.632 4.853 21.596 1.00 88.95 C ATOM 1333 CE1 PHE A 189 -13.498 5.612 24.101 1.00 97.41 C ATOM 1334 CE2 PHE A 189 -12.074 4.275 22.718 1.00 90.62 C ATOM 1335 CZ PHE A 189 -12.509 4.653 23.974 1.00 94.88 C ATOM 0 H PHE A 189 -14.402 7.406 18.281 1.00 92.14 H new ATOM 0 HA PHE A 189 -13.680 8.451 20.510 1.00 89.05 H new ATOM 0 HB2 PHE A 189 -15.135 6.726 20.687 1.00 97.96 H new ATOM 0 HB3 PHE A 189 -14.274 5.796 19.779 1.00 97.96 H new ATOM 0 HD1 PHE A 189 -14.712 6.835 23.064 1.00 96.01 H new ATOM 0 HD2 PHE A 189 -12.341 4.591 20.752 1.00 88.95 H new ATOM 0 HE1 PHE A 189 -13.793 5.868 24.945 1.00 97.41 H new ATOM 0 HE2 PHE A 189 -11.407 3.633 22.629 1.00 90.62 H new ATOM 0 HZ PHE A 189 -12.138 4.263 24.732 1.00 94.88 H new ATOM 1336 N PHE A 190 -11.442 6.557 19.253 1.00 77.03 N ATOM 1337 CA PHE A 190 -10.038 6.161 19.273 1.00 84.12 C ATOM 1338 C PHE A 190 -9.062 7.333 19.344 1.00 83.07 C ATOM 1339 O PHE A 190 -8.157 7.327 20.172 1.00 79.42 O ATOM 1340 CB PHE A 190 -9.705 5.323 18.037 1.00 72.66 C ATOM 1341 CG PHE A 190 -10.600 4.152 17.843 1.00 69.15 C ATOM 1342 CD1 PHE A 190 -10.492 3.042 18.656 1.00 68.83 C ATOM 1343 CD2 PHE A 190 -11.547 4.157 16.846 1.00 68.00 C ATOM 1344 CE1 PHE A 190 -11.315 1.975 18.477 1.00 66.59 C ATOM 1345 CE2 PHE A 190 -12.371 3.079 16.663 1.00 66.35 C ATOM 1346 CZ PHE A 190 -12.255 1.994 17.473 1.00 64.54 C ATOM 0 H PHE A 190 -11.903 6.168 18.640 1.00 77.03 H new ATOM 0 HA PHE A 190 -9.927 5.645 20.087 1.00 84.12 H new ATOM 0 HB2 PHE A 190 -9.753 5.889 17.251 1.00 72.66 H new ATOM 0 HB3 PHE A 190 -8.789 5.011 18.106 1.00 72.66 H new ATOM 0 HD1 PHE A 190 -9.852 3.024 19.331 1.00 68.83 H new ATOM 0 HD2 PHE A 190 -11.628 4.899 16.291 1.00 68.00 H new ATOM 0 HE1 PHE A 190 -11.243 1.233 19.033 1.00 66.59 H new ATOM 0 HE2 PHE A 190 -13.009 3.089 15.986 1.00 66.35 H new ATOM 0 HZ PHE A 190 -12.814 1.261 17.348 1.00 64.54 H new ATOM 1347 N LYS A 191 -9.233 8.321 18.468 1.00 78.95 N ATOM 1348 CA LYS A 191 -8.355 9.488 18.469 1.00 85.10 C ATOM 1349 C LYS A 191 -8.647 10.395 19.665 1.00 94.54 C ATOM 1350 O LYS A 191 -7.733 10.937 20.281 1.00 90.13 O ATOM 1351 CB LYS A 191 -8.495 10.280 17.168 1.00 87.77 C ATOM 1352 CG LYS A 191 -7.727 9.715 15.984 1.00 87.64 C ATOM 1353 CD LYS A 191 -7.888 10.589 14.737 1.00 93.13 C ATOM 1354 CE LYS A 191 -7.766 9.761 13.462 1.00 92.48 C ATOM 1355 NZ LYS A 191 -8.601 8.510 13.520 1.00 82.10 N ATOM 0 H LYS A 191 -9.849 8.335 17.868 1.00 78.95 H new ATOM 0 HA LYS A 191 -7.443 9.166 18.540 1.00 85.10 H new ATOM 0 HB2 LYS A 191 -9.435 10.327 16.934 1.00 87.77 H new ATOM 0 HB3 LYS A 191 -8.196 11.189 17.325 1.00 87.77 H new ATOM 0 HG2 LYS A 191 -6.787 9.645 16.211 1.00 87.64 H new ATOM 0 HG3 LYS A 191 -8.040 8.817 15.793 1.00 87.64 H new ATOM 0 HD2 LYS A 191 -8.752 11.030 14.758 1.00 93.13 H new ATOM 0 HD3 LYS A 191 -7.213 11.286 14.738 1.00 93.13 H new ATOM 0 HE2 LYS A 191 -8.041 10.297 12.702 1.00 92.48 H new ATOM 0 HE3 LYS A 191 -6.837 9.522 13.320 1.00 92.48 H new ATOM 0 HZ1 LYS A 191 -8.852 8.282 12.697 1.00 82.10 H new ATOM 0 HZ2 LYS A 191 -8.123 7.850 13.878 1.00 82.10 H new ATOM 0 HZ3 LYS A 191 -9.323 8.657 14.020 1.00 82.10 H new ATOM 1356 N SER A 192 -9.928 10.549 19.984 1.00 94.14 N ATOM 1357 CA SER A 192 -10.350 11.378 21.101 1.00 97.45 C ATOM 1358 C SER A 192 -9.622 11.049 22.403 1.00100.33 C ATOM 1359 O SER A 192 -9.240 11.952 23.155 1.00108.25 O ATOM 1360 CB SER A 192 -11.853 11.238 21.320 1.00 98.10 C ATOM 1361 OG SER A 192 -12.274 12.078 22.378 1.00104.49 O ATOM 0 H SER A 192 -10.575 10.175 19.558 1.00 94.14 H new ATOM 0 HA SER A 192 -10.123 12.291 20.864 1.00 97.45 H new ATOM 0 HB2 SER A 192 -12.328 11.469 20.506 1.00 98.10 H new ATOM 0 HB3 SER A 192 -12.072 10.315 21.524 1.00 98.10 H new ATOM 0 HG SER A 192 -11.777 12.754 22.414 1.00104.49 H new ATOM 1362 N ALA A 193 -9.425 9.760 22.662 1.00 94.63 N ATOM 1363 CA ALA A 193 -8.860 9.317 23.934 1.00 97.12 C ATOM 1364 C ALA A 193 -7.333 9.344 23.962 1.00 94.58 C ATOM 1365 O ALA A 193 -6.715 8.828 24.899 1.00 93.76 O ATOM 1366 CB ALA A 193 -9.354 7.921 24.264 1.00 92.53 C ATOM 0 H ALA A 193 -9.612 9.124 22.114 1.00 94.63 H new ATOM 0 HA ALA A 193 -9.163 9.949 24.604 1.00 97.12 H new ATOM 0 HB1 ALA A 193 -8.974 7.635 25.109 1.00 92.53 H new ATOM 0 HB2 ALA A 193 -10.322 7.927 24.330 1.00 92.53 H new ATOM 0 HB3 ALA A 193 -9.082 7.307 23.564 1.00 92.53 H new ATOM 1367 N MET A 194 -6.725 9.942 22.944 1.00 89.15 N ATOM 1368 CA MET A 194 -5.268 10.044 22.898 1.00 94.31 C ATOM 1369 C MET A 194 -4.803 11.358 23.522 1.00 93.98 C ATOM 1370 O MET A 194 -5.544 12.341 23.513 1.00 96.59 O ATOM 1371 CB MET A 194 -4.772 9.916 21.454 1.00 90.99 C ATOM 1372 CG MET A 194 -4.880 8.498 20.888 1.00 89.52 C ATOM 1373 SD MET A 194 -3.833 7.295 21.757 1.00 83.45 S ATOM 1374 CE MET A 194 -4.381 5.740 21.066 1.00 83.02 C ATOM 0 H MET A 194 -7.133 10.294 22.273 1.00 89.15 H new ATOM 0 HA MET A 194 -4.888 9.316 23.415 1.00 94.31 H new ATOM 0 HB2 MET A 194 -5.281 10.520 20.891 1.00 90.99 H new ATOM 0 HB3 MET A 194 -3.846 10.202 21.412 1.00 90.99 H new ATOM 0 HG2 MET A 194 -5.804 8.207 20.936 1.00 89.52 H new ATOM 0 HG3 MET A 194 -4.635 8.512 19.949 1.00 89.52 H new ATOM 0 HE1 MET A 194 -4.606 5.128 21.784 1.00 83.02 H new ATOM 0 HE2 MET A 194 -5.163 5.890 20.512 1.00 83.02 H new ATOM 0 HE3 MET A 194 -3.672 5.358 20.526 1.00 83.02 H new ATOM 1375 N PRO A 195 -3.574 11.389 24.064 1.00 89.90 N ATOM 1376 CA PRO A 195 -2.530 10.363 24.109 1.00 82.02 C ATOM 1377 C PRO A 195 -2.486 9.606 25.422 1.00 91.35 C ATOM 1378 O PRO A 195 -1.525 8.860 25.652 1.00 89.02 O ATOM 1379 CB PRO A 195 -1.247 11.172 23.933 1.00 84.77 C ATOM 1380 CG PRO A 195 -1.663 12.655 24.140 1.00 84.59 C ATOM 1381 CD PRO A 195 -3.073 12.653 24.615 1.00 88.44 C ATOM 0 HA PRO A 195 -2.676 9.680 23.436 1.00 82.02 H new ATOM 0 HB2 PRO A 195 -0.574 10.904 24.578 1.00 84.77 H new ATOM 0 HB3 PRO A 195 -0.866 11.036 23.052 1.00 84.77 H new ATOM 0 HG2 PRO A 195 -1.084 13.086 24.788 1.00 84.59 H new ATOM 0 HG3 PRO A 195 -1.581 13.153 23.311 1.00 84.59 H new ATOM 0 HD2 PRO A 195 -3.131 12.676 25.583 1.00 88.44 H new ATOM 0 HD3 PRO A 195 -3.570 13.417 24.283 1.00 88.44 H new ATOM 1382 N GLU A 196 -3.482 9.821 26.281 1.00 94.30 N ATOM 1383 CA GLU A 196 -3.655 8.978 27.461 1.00102.07 C ATOM 1384 C GLU A 196 -3.894 7.555 26.979 1.00 98.28 C ATOM 1385 O GLU A 196 -3.466 6.588 27.607 1.00 95.57 O ATOM 1386 CB GLU A 196 -4.830 9.438 28.330 1.00107.77 C ATOM 1387 CG GLU A 196 -4.769 10.870 28.840 1.00108.11 C ATOM 1388 CD GLU A 196 -6.130 11.364 29.313 1.00111.22 C ATOM 1389 OE1 GLU A 196 -6.292 11.628 30.526 1.00108.80 O ATOM 1390 OE2 GLU A 196 -7.041 11.481 28.463 1.00111.94 O ATOM 0 H GLU A 196 -4.066 10.447 26.198 1.00 94.30 H new ATOM 0 HA GLU A 196 -2.859 9.035 28.012 1.00102.07 H new ATOM 0 HB2 GLU A 196 -5.647 9.331 27.819 1.00107.77 H new ATOM 0 HB3 GLU A 196 -4.894 8.845 29.095 1.00107.77 H new ATOM 0 HG2 GLU A 196 -4.133 10.926 29.571 1.00108.11 H new ATOM 0 HG3 GLU A 196 -4.442 11.450 28.135 1.00108.11 H new ATOM 1391 N GLY A 197 -4.601 7.450 25.857 1.00 93.36 N ATOM 1392 CA GLY A 197 -4.807 6.187 25.179 1.00 88.78 C ATOM 1393 C GLY A 197 -6.030 5.419 25.637 1.00 92.70 C ATOM 1394 O GLY A 197 -6.908 5.954 26.328 1.00 92.25 O ATOM 0 H GLY A 197 -4.976 8.120 25.469 1.00 93.36 H new ATOM 0 HA2 GLY A 197 -4.882 6.353 24.226 1.00 88.78 H new ATOM 0 HA3 GLY A 197 -4.023 5.631 25.310 1.00 88.78 H new ATOM 1395 N TYR A 198 -6.089 4.151 25.242 1.00 83.41 N ATOM 1396 CA TYR A 198 -7.183 3.290 25.656 1.00 82.27 C ATOM 1397 C TYR A 198 -6.721 1.857 25.816 1.00 72.36 C ATOM 1398 O TYR A 198 -5.634 1.488 25.381 1.00 71.66 O ATOM 1399 CB TYR A 198 -8.356 3.355 24.658 1.00 86.18 C ATOM 1400 CG TYR A 198 -7.985 3.084 23.214 1.00 78.22 C ATOM 1401 CD1 TYR A 198 -7.989 1.791 22.694 1.00 70.83 C ATOM 1402 CD2 TYR A 198 -7.634 4.126 22.372 1.00 79.29 C ATOM 1403 CE1 TYR A 198 -7.639 1.555 21.376 1.00 76.42 C ATOM 1404 CE2 TYR A 198 -7.293 3.899 21.055 1.00 80.27 C ATOM 1405 CZ TYR A 198 -7.294 2.621 20.560 1.00 74.65 C ATOM 1406 OH TYR A 198 -6.943 2.433 19.245 1.00 65.49 O ATOM 0 H TYR A 198 -5.506 3.773 24.735 1.00 83.41 H new ATOM 0 HA TYR A 198 -7.492 3.614 26.516 1.00 82.27 H new ATOM 0 HB2 TYR A 198 -9.030 2.713 24.930 1.00 86.18 H new ATOM 0 HB3 TYR A 198 -8.762 4.234 24.714 1.00 86.18 H new ATOM 0 HD1 TYR A 198 -8.230 1.078 23.240 1.00 70.83 H new ATOM 0 HD2 TYR A 198 -7.628 4.996 22.701 1.00 79.29 H new ATOM 0 HE1 TYR A 198 -7.635 0.688 21.040 1.00 76.42 H new ATOM 0 HE2 TYR A 198 -7.063 4.612 20.504 1.00 80.27 H new ATOM 0 HH TYR A 198 -6.765 3.175 18.893 1.00 65.49 H new ATOM 1407 N VAL A 199 -7.577 1.068 26.450 1.00 73.13 N ATOM 1408 CA VAL A 199 -7.384 -0.358 26.630 1.00 67.57 C ATOM 1409 C VAL A 199 -8.282 -1.115 25.674 1.00 69.93 C ATOM 1410 O VAL A 199 -9.491 -0.892 25.651 1.00 75.12 O ATOM 1411 CB VAL A 199 -7.722 -0.790 28.067 1.00 62.54 C ATOM 1412 CG1 VAL A 199 -7.673 -2.313 28.207 1.00 62.07 C ATOM 1413 CG2 VAL A 199 -6.794 -0.128 29.030 1.00 62.85 C ATOM 0 H VAL A 199 -8.308 1.359 26.797 1.00 73.13 H new ATOM 0 HA VAL A 199 -6.451 -0.558 26.454 1.00 67.57 H new ATOM 0 HB VAL A 199 -8.628 -0.509 28.272 1.00 62.54 H new ATOM 0 HG11 VAL A 199 -7.889 -2.561 29.119 1.00 62.07 H new ATOM 0 HG12 VAL A 199 -8.316 -2.715 27.602 1.00 62.07 H new ATOM 0 HG13 VAL A 199 -6.783 -2.630 27.988 1.00 62.07 H new ATOM 0 HG21 VAL A 199 -7.013 -0.405 29.933 1.00 62.85 H new ATOM 0 HG22 VAL A 199 -5.880 -0.383 28.827 1.00 62.85 H new ATOM 0 HG23 VAL A 199 -6.884 0.835 28.957 1.00 62.85 H new ATOM 1414 N GLN A 200 -7.708 -2.016 24.890 1.00 67.15 N ATOM 1415 CA GLN A 200 -8.511 -2.804 23.968 1.00 60.06 C ATOM 1416 C GLN A 200 -8.535 -4.247 24.430 1.00 61.79 C ATOM 1417 O GLN A 200 -7.475 -4.864 24.592 1.00 65.34 O ATOM 1418 CB GLN A 200 -7.953 -2.690 22.545 1.00 63.68 C ATOM 1419 CG GLN A 200 -8.916 -3.128 21.452 1.00 63.26 C ATOM 1420 CD GLN A 200 -8.495 -2.686 20.062 1.00 58.81 C ATOM 1421 OE1 GLN A 200 -8.662 -1.528 19.674 1.00 58.97 O ATOM 1422 NE2 GLN A 200 -7.960 -3.615 19.304 1.00 61.23 N ATOM 0 H GLN A 200 -6.865 -2.186 24.876 1.00 67.15 H new ATOM 0 HA GLN A 200 -9.420 -2.465 23.958 1.00 60.06 H new ATOM 0 HB2 GLN A 200 -7.696 -1.769 22.384 1.00 63.68 H new ATOM 0 HB3 GLN A 200 -7.146 -3.225 22.483 1.00 63.68 H new ATOM 0 HG2 GLN A 200 -8.993 -4.095 21.467 1.00 63.26 H new ATOM 0 HG3 GLN A 200 -9.797 -2.770 21.644 1.00 63.26 H new ATOM 0 HE21 GLN A 200 -7.859 -4.413 19.608 1.00 61.23 H new ATOM 0 HE22 GLN A 200 -7.711 -3.426 18.503 1.00 61.23 H new ATOM 1423 N GLU A 201 -9.733 -4.788 24.648 1.00 57.44 N ATOM 1424 CA GLU A 201 -9.875 -6.201 25.001 1.00 59.17 C ATOM 1425 C GLU A 201 -10.790 -6.933 24.031 1.00 54.60 C ATOM 1426 O GLU A 201 -11.886 -6.476 23.744 1.00 60.66 O ATOM 1427 CB GLU A 201 -10.407 -6.351 26.425 1.00 64.36 C ATOM 1428 CG GLU A 201 -9.725 -5.443 27.438 1.00 69.88 C ATOM 1429 CD GLU A 201 -9.442 -6.118 28.783 1.00 75.26 C ATOM 1430 OE1 GLU A 201 -9.186 -7.347 28.808 1.00 68.78 O ATOM 1431 OE2 GLU A 201 -9.464 -5.407 29.820 1.00 85.46 O ATOM 0 H GLU A 201 -10.475 -4.356 24.597 1.00 57.44 H new ATOM 0 HA GLU A 201 -8.993 -6.601 24.946 1.00 59.17 H new ATOM 0 HB2 GLU A 201 -11.359 -6.164 26.426 1.00 64.36 H new ATOM 0 HB3 GLU A 201 -10.298 -7.273 26.706 1.00 64.36 H new ATOM 0 HG2 GLU A 201 -8.889 -5.125 27.063 1.00 69.88 H new ATOM 0 HG3 GLU A 201 -10.283 -4.664 27.588 1.00 69.88 H new ATOM 1432 N ARG A 202 -10.330 -8.063 23.515 1.00 51.16 N ATOM 1433 CA ARG A 202 -11.133 -8.867 22.586 1.00 55.77 C ATOM 1434 C ARG A 202 -11.197 -10.295 23.131 1.00 58.84 C ATOM 1435 O ARG A 202 -10.238 -10.785 23.738 1.00 55.85 O ATOM 1436 CB ARG A 202 -10.562 -8.876 21.115 1.00 48.56 C ATOM 1437 CG ARG A 202 -10.720 -7.546 20.276 1.00 50.27 C ATOM 1438 CD ARG A 202 -10.779 -7.707 18.706 1.00 50.61 C ATOM 1439 NE ARG A 202 -10.480 -6.456 17.963 1.00 55.30 N ATOM 1440 CZ ARG A 202 -9.251 -6.066 17.600 1.00 57.13 C ATOM 1441 NH1 ARG A 202 -8.224 -6.848 17.909 1.00 54.15 N ATOM 1442 NH2 ARG A 202 -9.019 -4.896 16.943 1.00 71.70 N ATOM 0 H ARG A 202 -9.553 -8.388 23.687 1.00 51.16 H new ATOM 0 HA ARG A 202 -12.016 -8.469 22.528 1.00 55.77 H new ATOM 0 HB2 ARG A 202 -9.618 -9.094 21.159 1.00 48.56 H new ATOM 0 HB3 ARG A 202 -10.996 -9.593 20.627 1.00 48.56 H new ATOM 0 HG2 ARG A 202 -11.530 -7.098 20.566 1.00 50.27 H new ATOM 0 HG3 ARG A 202 -9.978 -6.960 20.494 1.00 50.27 H new ATOM 0 HD2 ARG A 202 -10.148 -8.392 18.436 1.00 50.61 H new ATOM 0 HD3 ARG A 202 -11.662 -8.019 18.454 1.00 50.61 H new ATOM 0 HE ARG A 202 -11.141 -5.948 17.752 1.00 55.30 H new ATOM 0 HH11 ARG A 202 -8.357 -7.585 18.332 1.00 54.15 H new ATOM 0 HH12 ARG A 202 -7.426 -6.618 17.686 1.00 54.15 H new ATOM 0 HH21 ARG A 202 -9.675 -4.376 16.746 1.00 71.70 H new ATOM 1443 N THR A 203 -12.331 -10.957 22.929 1.00 56.73 N ATOM 1444 CA THR A 203 -12.387 -12.416 23.021 1.00 54.35 C ATOM 1445 C THR A 203 -12.577 -12.925 21.605 1.00 49.26 C ATOM 1446 O THR A 203 -13.401 -12.396 20.881 1.00 54.58 O ATOM 1447 CB THR A 203 -13.541 -12.915 23.911 1.00 54.62 C ATOM 1448 OG1 THR A 203 -13.474 -12.278 25.190 1.00 53.34 O ATOM 1449 CG2 THR A 203 -13.480 -14.421 24.081 1.00 48.21 C ATOM 0 H THR A 203 -13.081 -10.582 22.737 1.00 56.73 H new ATOM 0 HA THR A 203 -11.571 -12.745 23.430 1.00 54.35 H new ATOM 0 HB THR A 203 -14.381 -12.690 23.481 1.00 54.62 H new ATOM 0 HG1 THR A 203 -14.175 -12.443 25.622 1.00 53.34 H new ATOM 0 HG21 THR A 203 -14.214 -14.713 24.644 1.00 48.21 H new ATOM 0 HG22 THR A 203 -13.549 -14.848 23.213 1.00 48.21 H new ATOM 0 HG23 THR A 203 -12.638 -14.666 24.496 1.00 48.21 H new ATOM 1450 N ILE A 204 -11.817 -13.926 21.185 1.00 50.72 N ATOM 1451 CA ILE A 204 -11.956 -14.390 19.808 1.00 50.81 C ATOM 1452 C ILE A 204 -12.201 -15.867 19.738 1.00 53.53 C ATOM 1453 O ILE A 204 -11.297 -16.659 20.046 1.00 51.69 O ATOM 1454 CB ILE A 204 -10.715 -14.083 18.947 1.00 47.93 C ATOM 1455 CG1 ILE A 204 -10.391 -12.591 18.976 1.00 47.20 C ATOM 1456 CG2 ILE A 204 -10.954 -14.522 17.515 1.00 43.71 C ATOM 1457 CD1 ILE A 204 -9.034 -12.280 18.395 1.00 48.33 C ATOM 0 H ILE A 204 -11.233 -14.340 21.661 1.00 50.72 H new ATOM 0 HA ILE A 204 -12.719 -13.905 19.458 1.00 50.81 H new ATOM 0 HB ILE A 204 -9.963 -14.573 19.314 1.00 47.93 H new ATOM 0 HG12 ILE A 204 -11.070 -12.107 18.481 1.00 47.20 H new ATOM 0 HG13 ILE A 204 -10.427 -12.273 19.892 1.00 47.20 H new ATOM 0 HG21 ILE A 204 -10.169 -14.325 16.981 1.00 43.71 H new ATOM 0 HG22 ILE A 204 -11.128 -15.476 17.494 1.00 43.71 H new ATOM 0 HG23 ILE A 204 -11.718 -14.046 17.154 1.00 43.71 H new ATOM 0 HD11 ILE A 204 -8.876 -11.324 18.436 1.00 48.33 H new ATOM 0 HD12 ILE A 204 -8.350 -12.743 18.904 1.00 48.33 H new ATOM 0 HD13 ILE A 204 -9.003 -12.573 17.471 1.00 48.33 H new ATOM 1458 N PHE A 205 -13.409 -16.234 19.307 1.00 47.78 N ATOM 1459 CA PHE A 205 -13.792 -17.647 19.222 1.00 54.00 C ATOM 1460 C PHE A 205 -13.573 -18.226 17.846 1.00 54.14 C ATOM 1461 O PHE A 205 -14.190 -17.804 16.867 1.00 61.84 O ATOM 1462 CB PHE A 205 -15.263 -17.861 19.581 1.00 57.20 C ATOM 1463 CG PHE A 205 -15.667 -17.301 20.911 1.00 52.44 C ATOM 1464 CD1 PHE A 205 -16.143 -15.998 21.016 1.00 51.85 C ATOM 1465 CD2 PHE A 205 -15.613 -18.088 22.048 1.00 48.49 C ATOM 1466 CE1 PHE A 205 -16.535 -15.487 22.242 1.00 60.35 C ATOM 1467 CE2 PHE A 205 -16.009 -17.582 23.279 1.00 55.54 C ATOM 1468 CZ PHE A 205 -16.465 -16.283 23.382 1.00 54.91 C ATOM 0 H PHE A 205 -14.021 -15.682 19.059 1.00 47.78 H new ATOM 0 HA PHE A 205 -13.219 -18.100 19.860 1.00 54.00 H new ATOM 0 HB2 PHE A 205 -15.814 -17.457 18.892 1.00 57.20 H new ATOM 0 HB3 PHE A 205 -15.451 -18.813 19.573 1.00 57.20 H new ATOM 0 HD1 PHE A 205 -16.198 -15.465 20.256 1.00 51.85 H new ATOM 0 HD2 PHE A 205 -15.308 -18.965 21.987 1.00 48.49 H new ATOM 0 HE1 PHE A 205 -16.845 -14.612 22.304 1.00 60.35 H new ATOM 0 HE2 PHE A 205 -15.967 -18.120 24.036 1.00 55.54 H new ATOM 0 HZ PHE A 205 -16.724 -15.942 24.208 1.00 54.91 H new ATOM 1469 N PHE A 206 -12.714 -19.224 17.776 1.00 60.30 N ATOM 1470 CA PHE A 206 -12.524 -19.955 16.536 1.00 61.33 C ATOM 1471 C PHE A 206 -13.509 -21.109 16.500 1.00 62.33 C ATOM 1472 O PHE A 206 -13.513 -21.944 17.402 1.00 67.74 O ATOM 1473 CB PHE A 206 -11.075 -20.439 16.419 1.00 52.92 C ATOM 1474 CG PHE A 206 -10.075 -19.310 16.299 1.00 62.10 C ATOM 1475 CD1 PHE A 206 -9.527 -18.722 17.447 1.00 53.67 C ATOM 1476 CD2 PHE A 206 -9.697 -18.826 15.040 1.00 53.27 C ATOM 1477 CE1 PHE A 206 -8.612 -17.686 17.353 1.00 50.65 C ATOM 1478 CE2 PHE A 206 -8.792 -17.775 14.924 1.00 54.64 C ATOM 1479 CZ PHE A 206 -8.241 -17.205 16.081 1.00 61.13 C ATOM 0 H PHE A 206 -12.230 -19.496 18.433 1.00 60.30 H new ATOM 0 HA PHE A 206 -12.691 -19.377 15.775 1.00 61.33 H new ATOM 0 HB2 PHE A 206 -10.856 -20.975 17.197 1.00 52.92 H new ATOM 0 HB3 PHE A 206 -10.995 -21.017 15.644 1.00 52.92 H new ATOM 0 HD1 PHE A 206 -9.782 -19.032 18.286 1.00 53.67 H new ATOM 0 HD2 PHE A 206 -10.055 -19.211 14.273 1.00 53.27 H new ATOM 0 HE1 PHE A 206 -8.246 -17.312 18.122 1.00 50.65 H new ATOM 0 HE2 PHE A 206 -8.554 -17.453 14.085 1.00 54.64 H new ATOM 0 HZ PHE A 206 -7.629 -16.508 16.009 1.00 61.13 H new ATOM 1480 N LYS A 207 -14.363 -21.136 15.481 1.00 60.97 N ATOM 1481 CA LYS A 207 -15.351 -22.203 15.341 1.00 64.74 C ATOM 1482 C LYS A 207 -14.685 -23.562 15.403 1.00 62.96 C ATOM 1483 O LYS A 207 -13.734 -23.817 14.663 1.00 57.97 O ATOM 1484 CB LYS A 207 -16.131 -22.067 14.029 1.00 73.42 C ATOM 1485 CG LYS A 207 -17.584 -21.618 14.208 1.00 86.73 C ATOM 1486 CD LYS A 207 -18.569 -22.718 13.813 1.00 84.35 C ATOM 1487 CE LYS A 207 -18.468 -23.029 12.319 1.00 97.05 C ATOM 1488 NZ LYS A 207 -19.174 -24.284 11.922 1.00 94.54 N ATOM 0 H LYS A 207 -14.387 -20.544 14.858 1.00 60.97 H new ATOM 0 HA LYS A 207 -15.974 -22.123 16.080 1.00 64.74 H new ATOM 0 HB2 LYS A 207 -15.674 -21.430 13.457 1.00 73.42 H new ATOM 0 HB3 LYS A 207 -16.121 -22.921 13.568 1.00 73.42 H new ATOM 0 HG2 LYS A 207 -17.733 -21.366 15.133 1.00 86.73 H new ATOM 0 HG3 LYS A 207 -17.748 -20.828 13.669 1.00 86.73 H new ATOM 0 HD2 LYS A 207 -18.387 -23.520 14.327 1.00 84.35 H new ATOM 0 HD3 LYS A 207 -19.473 -22.441 14.029 1.00 84.35 H new ATOM 0 HE2 LYS A 207 -18.837 -22.286 11.816 1.00 97.05 H new ATOM 0 HE3 LYS A 207 -17.532 -23.101 12.074 1.00 97.05 H new ATOM 0 HZ1 LYS A 207 -19.081 -24.413 11.046 1.00 94.54 H new ATOM 0 HZ2 LYS A 207 -18.823 -24.974 12.362 1.00 94.54 H new ATOM 0 HZ3 LYS A 207 -20.039 -24.214 12.121 1.00 94.54 H new ATOM 1489 N ASP A 208 -15.175 -24.404 16.315 1.00 62.49 N ATOM 1490 CA ASP A 208 -14.716 -25.781 16.470 1.00 56.76 C ATOM 1491 C ASP A 208 -13.231 -25.890 16.831 1.00 70.51 C ATOM 1492 O ASP A 208 -12.562 -26.859 16.463 1.00 77.18 O ATOM 1493 CB ASP A 208 -14.970 -26.580 15.190 1.00 66.58 C ATOM 1494 CG ASP A 208 -16.427 -26.589 14.777 1.00 76.85 C ATOM 1495 OD1 ASP A 208 -17.311 -26.427 15.658 1.00 74.43 O ATOM 1496 OD2 ASP A 208 -16.673 -26.767 13.560 1.00 72.59 O ATOM 0 H ASP A 208 -15.795 -24.184 16.870 1.00 62.49 H new ATOM 0 HA ASP A 208 -15.227 -26.147 17.209 1.00 56.76 H new ATOM 0 HB2 ASP A 208 -14.437 -26.206 14.471 1.00 66.58 H new ATOM 0 HB3 ASP A 208 -14.670 -27.493 15.320 1.00 66.58 H new ATOM 1497 N ASP A 209 -12.713 -24.906 17.549 1.00 63.65 N ATOM 1498 CA ASP A 209 -11.314 -24.918 17.943 1.00 59.82 C ATOM 1499 C ASP A 209 -11.212 -23.952 19.122 1.00 60.81 C ATOM 1500 O ASP A 209 -12.213 -23.698 19.803 1.00 59.14 O ATOM 1501 CB ASP A 209 -10.403 -24.522 16.763 1.00 63.27 C ATOM 1502 CG ASP A 209 -9.005 -25.176 16.821 1.00 73.73 C ATOM 1503 OD1 ASP A 209 -8.453 -25.310 17.933 1.00 74.79 O ATOM 1504 OD2 ASP A 209 -8.445 -25.544 15.751 1.00 74.22 O ATOM 0 H ASP A 209 -13.156 -24.220 17.819 1.00 63.65 H new ATOM 0 HA ASP A 209 -11.013 -25.803 18.204 1.00 59.82 H new ATOM 0 HB2 ASP A 209 -10.835 -24.772 15.931 1.00 63.27 H new ATOM 0 HB3 ASP A 209 -10.301 -23.557 16.751 1.00 63.27 H new ATOM 1505 N GLY A 210 -10.028 -23.397 19.352 1.00 57.83 N ATOM 1506 CA GLY A 210 -9.763 -22.639 20.562 1.00 56.25 C ATOM 1507 C GLY A 210 -10.262 -21.202 20.641 1.00 58.08 C ATOM 1508 O GLY A 210 -11.115 -20.774 19.866 1.00 64.23 O ATOM 0 H GLY A 210 -9.360 -23.450 18.813 1.00 57.83 H new ATOM 0 HA2 GLY A 210 -10.148 -23.127 21.307 1.00 56.25 H new ATOM 0 HA3 GLY A 210 -8.803 -22.626 20.698 1.00 56.25 H new ATOM 1509 N THR A 211 -9.713 -20.457 21.594 1.00 50.99 N ATOM 1510 CA THR A 211 -10.156 -19.111 21.886 1.00 48.27 C ATOM 1511 C THR A 211 -8.923 -18.311 22.221 1.00 50.84 C ATOM 1512 O THR A 211 -7.994 -18.839 22.804 1.00 60.90 O ATOM 1513 CB THR A 211 -11.177 -19.076 23.073 1.00 50.02 C ATOM 1514 OG1 THR A 211 -12.398 -19.702 22.683 1.00 53.23 O ATOM 1515 CG2 THR A 211 -11.521 -17.661 23.480 1.00 51.63 C ATOM 0 H THR A 211 -9.066 -20.727 22.092 1.00 50.99 H new ATOM 0 HA THR A 211 -10.621 -18.740 21.120 1.00 48.27 H new ATOM 0 HB THR A 211 -10.757 -19.538 23.815 1.00 50.02 H new ATOM 0 HG1 THR A 211 -12.941 -19.681 23.324 1.00 53.23 H new ATOM 0 HG21 THR A 211 -12.154 -17.680 24.215 1.00 51.63 H new ATOM 0 HG22 THR A 211 -10.715 -17.199 23.760 1.00 51.63 H new ATOM 0 HG23 THR A 211 -11.916 -17.194 22.727 1.00 51.63 H new ATOM 1516 N TYR A 212 -8.902 -17.052 21.814 1.00 50.93 N ATOM 1517 CA TYR A 212 -7.897 -16.100 22.258 1.00 49.25 C ATOM 1518 C TYR A 212 -8.571 -15.151 23.228 1.00 54.95 C ATOM 1519 O TYR A 212 -9.744 -14.826 23.063 1.00 57.27 O ATOM 1520 CB TYR A 212 -7.318 -15.267 21.103 1.00 51.54 C ATOM 1521 CG TYR A 212 -6.420 -15.956 20.101 1.00 48.91 C ATOM 1522 CD1 TYR A 212 -5.978 -17.262 20.288 1.00 48.72 C ATOM 1523 CD2 TYR A 212 -5.987 -15.271 18.969 1.00 44.37 C ATOM 1524 CE1 TYR A 212 -5.134 -17.877 19.356 1.00 41.68 C ATOM 1525 CE2 TYR A 212 -5.158 -15.876 18.025 1.00 45.02 C ATOM 1526 CZ TYR A 212 -4.733 -17.177 18.229 1.00 48.99 C ATOM 1527 OH TYR A 212 -3.908 -17.776 17.308 1.00 50.89 O ATOM 0 H TYR A 212 -9.477 -16.722 21.266 1.00 50.93 H new ATOM 0 HA TYR A 212 -7.165 -16.595 22.659 1.00 49.25 H new ATOM 0 HB2 TYR A 212 -8.062 -14.880 20.616 1.00 51.54 H new ATOM 0 HB3 TYR A 212 -6.819 -14.531 21.490 1.00 51.54 H new ATOM 0 HD1 TYR A 212 -6.247 -17.733 21.043 1.00 48.72 H new ATOM 0 HD2 TYR A 212 -6.257 -14.390 18.840 1.00 44.37 H new ATOM 0 HE1 TYR A 212 -4.844 -18.750 19.492 1.00 41.68 H new ATOM 0 HE2 TYR A 212 -4.893 -15.409 17.265 1.00 45.02 H new ATOM 0 HH TYR A 212 -3.934 -17.346 16.587 1.00 50.89 H new ATOM 1528 N LYS A 213 -7.836 -14.691 24.227 1.00 53.25 N ATOM 1529 CA LYS A 213 -8.270 -13.549 25.007 1.00 45.75 C ATOM 1530 C LYS A 213 -7.124 -12.572 24.852 1.00 51.38 C ATOM 1531 O LYS A 213 -5.952 -12.974 24.854 1.00 50.69 O ATOM 1532 CB LYS A 213 -8.551 -13.910 26.490 1.00 48.87 C ATOM 1533 CG LYS A 213 -9.880 -14.700 26.803 1.00 53.61 C ATOM 1534 CD LYS A 213 -11.149 -13.777 26.732 1.00 61.58 C ATOM 1535 CE LYS A 213 -12.417 -14.284 27.494 1.00 56.02 C ATOM 1536 NZ LYS A 213 -12.811 -15.731 27.241 1.00 56.24 N ATOM 0 H LYS A 213 -7.082 -15.027 24.469 1.00 53.25 H new ATOM 0 HA LYS A 213 -9.116 -13.186 24.702 1.00 45.75 H new ATOM 0 HB2 LYS A 213 -7.805 -14.436 26.817 1.00 48.87 H new ATOM 0 HB3 LYS A 213 -8.564 -13.086 27.002 1.00 48.87 H new ATOM 0 HG2 LYS A 213 -9.977 -15.430 26.171 1.00 53.61 H new ATOM 0 HG3 LYS A 213 -9.819 -15.096 27.686 1.00 53.61 H new ATOM 0 HD2 LYS A 213 -10.911 -12.905 27.083 1.00 61.58 H new ATOM 0 HD3 LYS A 213 -11.384 -13.653 25.799 1.00 61.58 H new ATOM 0 HE2 LYS A 213 -12.268 -14.169 28.446 1.00 56.02 H new ATOM 0 HE3 LYS A 213 -13.166 -13.716 27.253 1.00 56.02 H new ATOM 0 HZ1 LYS A 213 -13.669 -15.846 27.449 1.00 56.24 H new ATOM 0 HZ2 LYS A 213 -12.686 -15.927 26.382 1.00 56.24 H new ATOM 0 HZ3 LYS A 213 -12.309 -16.268 27.743 1.00 56.24 H new ATOM 1537 N THR A 214 -7.445 -11.298 24.666 1.00 47.16 N ATOM 1538 CA THR A 214 -6.413 -10.286 24.546 1.00 45.85 C ATOM 1539 C THR A 214 -6.712 -9.083 25.417 1.00 49.63 C ATOM 1540 O THR A 214 -7.846 -8.603 25.471 1.00 50.34 O ATOM 1541 CB THR A 214 -6.232 -9.786 23.060 1.00 48.59 C ATOM 1542 OG1 THR A 214 -7.338 -8.961 22.665 1.00 51.87 O ATOM 1543 CG2 THR A 214 -6.090 -10.946 22.105 1.00 34.57 C ATOM 0 H THR A 214 -8.250 -11.002 24.607 1.00 47.16 H new ATOM 0 HA THR A 214 -5.593 -10.713 24.839 1.00 45.85 H new ATOM 0 HB THR A 214 -5.417 -9.260 23.025 1.00 48.59 H new ATOM 0 HG1 THR A 214 -7.226 -8.702 21.874 1.00 51.87 H new ATOM 0 HG21 THR A 214 -5.981 -10.610 21.202 1.00 34.57 H new ATOM 0 HG22 THR A 214 -5.314 -11.474 22.350 1.00 34.57 H new ATOM 0 HG23 THR A 214 -6.884 -11.501 22.149 1.00 34.57 H new ATOM 1544 N ARG A 215 -5.678 -8.595 26.094 1.00 55.65 N ATOM 1545 CA ARG A 215 -5.717 -7.266 26.688 1.00 52.46 C ATOM 1546 C ARG A 215 -4.613 -6.451 26.039 1.00 51.74 C ATOM 1547 O ARG A 215 -3.477 -6.918 25.905 1.00 55.56 O ATOM 1548 CB ARG A 215 -5.537 -7.311 28.216 1.00 55.83 C ATOM 1549 CG ARG A 215 -5.640 -5.934 28.876 1.00 60.49 C ATOM 1550 CD ARG A 215 -5.411 -5.949 30.385 1.00 59.16 C ATOM 1551 NE ARG A 215 -5.993 -4.752 30.987 1.00 60.30 N ATOM 1552 CZ ARG A 215 -5.346 -3.602 31.150 1.00 70.27 C ATOM 1553 NH1 ARG A 215 -4.073 -3.504 30.785 1.00 67.27 N ATOM 1554 NH2 ARG A 215 -5.966 -2.550 31.686 1.00 70.53 N ATOM 0 H ARG A 215 -4.942 -9.021 26.221 1.00 55.65 H new ATOM 0 HA ARG A 215 -6.585 -6.862 26.531 1.00 52.46 H new ATOM 0 HB2 ARG A 215 -6.209 -7.897 28.598 1.00 55.83 H new ATOM 0 HB3 ARG A 215 -4.672 -7.698 28.423 1.00 55.83 H new ATOM 0 HG2 ARG A 215 -4.992 -5.340 28.466 1.00 60.49 H new ATOM 0 HG3 ARG A 215 -6.518 -5.564 28.695 1.00 60.49 H new ATOM 0 HD2 ARG A 215 -5.811 -6.743 30.773 1.00 59.16 H new ATOM 0 HD3 ARG A 215 -4.461 -5.988 30.576 1.00 59.16 H new ATOM 0 HE ARG A 215 -6.809 -4.794 31.254 1.00 60.30 H new ATOM 0 HH11 ARG A 215 -3.670 -4.183 30.444 1.00 67.27 H new ATOM 0 HH12 ARG A 215 -3.652 -2.761 30.889 1.00 67.27 H new ATOM 0 HH21 ARG A 215 -6.789 -2.613 31.928 1.00 70.53 H new ATOM 0 HH22 ARG A 215 -5.543 -1.808 31.789 1.00 70.53 H new ATOM 1555 N ALA A 216 -4.934 -5.241 25.609 1.00 53.00 N ATOM 1556 CA ALA A 216 -3.896 -4.400 25.050 1.00 54.71 C ATOM 1557 C ALA A 216 -4.099 -2.952 25.410 1.00 58.77 C ATOM 1558 O ALA A 216 -5.223 -2.474 25.540 1.00 65.62 O ATOM 1559 CB ALA A 216 -3.831 -4.562 23.542 1.00 56.10 C ATOM 0 H ALA A 216 -5.722 -4.897 25.631 1.00 53.00 H new ATOM 0 HA ALA A 216 -3.052 -4.686 25.434 1.00 54.71 H new ATOM 0 HB1 ALA A 216 -3.132 -3.992 23.185 1.00 56.10 H new ATOM 0 HB2 ALA A 216 -3.637 -5.487 23.324 1.00 56.10 H new ATOM 0 HB3 ALA A 216 -4.683 -4.310 23.152 1.00 56.10 H new ATOM 1560 N GLU A 217 -2.988 -2.255 25.569 1.00 65.25 N ATOM 1561 CA GLU A 217 -3.014 -0.826 25.791 1.00 69.96 C ATOM 1562 C GLU A 217 -2.374 -0.147 24.605 1.00 67.52 C ATOM 1563 O GLU A 217 -1.296 -0.540 24.156 1.00 70.03 O ATOM 1564 CB GLU A 217 -2.291 -0.456 27.088 1.00 75.80 C ATOM 1565 CG GLU A 217 -3.064 -0.800 28.357 1.00 76.95 C ATOM 1566 CD GLU A 217 -2.234 -0.624 29.624 1.00 93.71 C ATOM 1567 OE1 GLU A 217 -2.575 -1.246 30.668 1.00 85.77 O ATOM 1568 OE2 GLU A 217 -1.240 0.141 29.568 1.00 96.17 O ATOM 0 H GLU A 217 -2.199 -2.598 25.551 1.00 65.25 H new ATOM 0 HA GLU A 217 -3.933 -0.528 25.883 1.00 69.96 H new ATOM 0 HB2 GLU A 217 -1.435 -0.911 27.110 1.00 75.80 H new ATOM 0 HB3 GLU A 217 -2.106 0.496 27.083 1.00 75.80 H new ATOM 0 HG2 GLU A 217 -3.853 -0.238 28.412 1.00 76.95 H new ATOM 0 HG3 GLU A 217 -3.373 -1.718 28.303 1.00 76.95 H new ATOM 1569 N VAL A 218 -3.073 0.850 24.086 1.00 73.21 N ATOM 1570 CA VAL A 218 -2.588 1.656 22.975 1.00 81.63 C ATOM 1571 C VAL A 218 -2.411 3.086 23.464 1.00 84.45 C ATOM 1572 O VAL A 218 -3.374 3.711 23.925 1.00 83.60 O ATOM 1573 CB VAL A 218 -3.573 1.656 21.767 1.00 79.78 C ATOM 1574 CG1 VAL A 218 -2.855 2.052 20.494 1.00 70.91 C ATOM 1575 CG2 VAL A 218 -4.242 0.303 21.602 1.00 75.61 C ATOM 0 H VAL A 218 -3.851 1.081 24.371 1.00 73.21 H new ATOM 0 HA VAL A 218 -1.750 1.275 22.669 1.00 81.63 H new ATOM 0 HB VAL A 218 -4.265 2.311 21.948 1.00 79.78 H new ATOM 0 HG11 VAL A 218 -3.482 2.047 19.754 1.00 70.91 H new ATOM 0 HG12 VAL A 218 -2.483 2.942 20.596 1.00 70.91 H new ATOM 0 HG13 VAL A 218 -2.140 1.421 20.316 1.00 70.91 H new ATOM 0 HG21 VAL A 218 -4.848 0.332 20.845 1.00 75.61 H new ATOM 0 HG22 VAL A 218 -3.566 -0.376 21.449 1.00 75.61 H new ATOM 0 HG23 VAL A 218 -4.740 0.088 22.406 1.00 75.61 H new ATOM 1576 N LYS A 219 -1.191 3.604 23.377 1.00 79.44 N ATOM 1577 CA LYS A 219 -0.954 4.986 23.781 1.00 89.64 C ATOM 1578 C LYS A 219 0.280 5.567 23.120 1.00 85.89 C ATOM 1579 O LYS A 219 1.038 4.865 22.437 1.00 79.20 O ATOM 1580 CB LYS A 219 -0.819 5.108 25.314 1.00 92.96 C ATOM 1581 CG LYS A 219 0.353 4.349 25.942 1.00 77.68 C ATOM 1582 CD LYS A 219 0.481 4.710 27.420 1.00 96.89 C ATOM 1583 CE LYS A 219 1.293 3.683 28.213 1.00 96.58 C ATOM 1584 NZ LYS A 219 0.535 2.416 28.477 1.00 75.24 N ATOM 0 H LYS A 219 -0.498 3.182 23.092 1.00 79.44 H new ATOM 0 HA LYS A 219 -1.727 5.493 23.488 1.00 89.64 H new ATOM 0 HB2 LYS A 219 -0.733 6.047 25.540 1.00 92.96 H new ATOM 0 HB3 LYS A 219 -1.641 4.793 25.720 1.00 92.96 H new ATOM 0 HG2 LYS A 219 0.217 3.393 25.846 1.00 77.68 H new ATOM 0 HG3 LYS A 219 1.175 4.567 25.476 1.00 77.68 H new ATOM 0 HD2 LYS A 219 0.901 5.581 27.501 1.00 96.89 H new ATOM 0 HD3 LYS A 219 -0.405 4.785 27.808 1.00 96.89 H new ATOM 0 HE2 LYS A 219 2.105 3.473 27.725 1.00 96.58 H new ATOM 0 HE3 LYS A 219 1.563 4.075 29.058 1.00 96.58 H new ATOM 0 HZ1 LYS A 219 1.048 1.854 28.939 1.00 75.24 H new ATOM 0 HZ2 LYS A 219 -0.199 2.601 28.946 1.00 75.24 H new ATOM 0 HZ3 LYS A 219 0.306 2.040 27.703 1.00 75.24 H new ATOM 1585 N PHE A 220 0.477 6.859 23.348 1.00 83.45 N ATOM 1586 CA PHE A 220 1.665 7.523 22.873 1.00 86.12 C ATOM 1587 C PHE A 220 2.808 7.399 23.858 1.00 82.50 C ATOM 1588 O PHE A 220 2.649 7.666 25.041 1.00 89.12 O ATOM 1589 CB PHE A 220 1.359 8.982 22.582 1.00 86.56 C ATOM 1590 CG PHE A 220 0.798 9.191 21.224 1.00 85.26 C ATOM 1591 CD1 PHE A 220 1.616 9.073 20.103 1.00 90.45 C ATOM 1592 CD2 PHE A 220 -0.545 9.458 21.047 1.00 81.43 C ATOM 1593 CE1 PHE A 220 1.102 9.247 18.823 1.00 92.59 C ATOM 1594 CE2 PHE A 220 -1.067 9.633 19.768 1.00 91.15 C ATOM 1595 CZ PHE A 220 -0.242 9.527 18.655 1.00 85.22 C ATOM 0 H PHE A 220 -0.070 7.364 23.777 1.00 83.45 H new ATOM 0 HA PHE A 220 1.946 7.088 22.053 1.00 86.12 H new ATOM 0 HB2 PHE A 220 0.731 9.314 23.242 1.00 86.56 H new ATOM 0 HB3 PHE A 220 2.171 9.504 22.676 1.00 86.56 H new ATOM 0 HD1 PHE A 220 2.518 8.875 20.212 1.00 90.45 H new ATOM 0 HD2 PHE A 220 -1.105 9.521 21.787 1.00 81.43 H new ATOM 0 HE1 PHE A 220 1.660 9.175 18.082 1.00 92.59 H new ATOM 0 HE2 PHE A 220 -1.971 9.822 19.658 1.00 91.15 H new ATOM 0 HZ PHE A 220 -0.592 9.644 17.801 1.00 85.22 H new ATOM 1596 N GLU A 221 3.951 6.950 23.355 1.00 86.37 N ATOM 1597 CA GLU A 221 5.200 6.975 24.107 1.00 87.22 C ATOM 1598 C GLU A 221 6.199 7.795 23.294 1.00 89.83 C ATOM 1599 O GLU A 221 6.854 7.305 22.369 1.00 85.49 O ATOM 1600 CB GLU A 221 5.708 5.561 24.393 1.00 69.97 C ATOM 1601 CG GLU A 221 4.779 4.763 25.315 1.00 76.08 C ATOM 1602 CD GLU A 221 5.199 3.302 25.464 1.00 81.86 C ATOM 1603 OE1 GLU A 221 6.215 2.906 24.844 1.00 74.93 O ATOM 1604 OE2 GLU A 221 4.511 2.547 26.198 1.00 77.82 O ATOM 0 H GLU A 221 4.025 6.621 22.564 1.00 86.37 H new ATOM 0 HA GLU A 221 5.069 7.384 24.977 1.00 87.22 H new ATOM 0 HB2 GLU A 221 5.810 5.084 23.554 1.00 69.97 H new ATOM 0 HB3 GLU A 221 6.588 5.615 24.798 1.00 69.97 H new ATOM 0 HG2 GLU A 221 4.763 5.181 26.190 1.00 76.08 H new ATOM 0 HG3 GLU A 221 3.875 4.801 24.966 1.00 76.08 H new ATOM 1605 N GLY A 222 6.292 9.068 23.646 1.00 90.30 N ATOM 1606 CA GLY A 222 6.958 10.020 22.796 1.00 89.03 C ATOM 1607 C GLY A 222 5.903 10.401 21.789 1.00 93.84 C ATOM 1608 O GLY A 222 4.750 10.664 22.144 1.00 87.64 O ATOM 0 H GLY A 222 5.974 9.395 24.375 1.00 90.30 H new ATOM 0 HA2 GLY A 222 7.266 10.791 23.298 1.00 89.03 H new ATOM 0 HA3 GLY A 222 7.736 9.631 22.367 1.00 89.03 H new ATOM 1609 N ASP A 223 6.286 10.413 20.524 1.00100.68 N ATOM 1610 CA ASP A 223 5.317 10.639 19.468 1.00105.91 C ATOM 1611 C ASP A 223 5.075 9.342 18.706 1.00 97.69 C ATOM 1612 O ASP A 223 4.140 9.259 17.905 1.00 91.79 O ATOM 1613 CB ASP A 223 5.784 11.746 18.524 1.00107.44 C ATOM 1614 CG ASP A 223 7.073 12.387 18.981 1.00112.75 C ATOM 1615 OD1 ASP A 223 7.938 11.653 19.512 1.00112.04 O ATOM 1616 OD2 ASP A 223 7.216 13.619 18.821 1.00114.77 O ATOM 0 H ASP A 223 7.095 10.294 20.257 1.00100.68 H new ATOM 0 HA ASP A 223 4.482 10.929 19.868 1.00105.91 H new ATOM 0 HB2 ASP A 223 5.906 11.379 17.634 1.00107.44 H new ATOM 0 HB3 ASP A 223 5.094 12.424 18.459 1.00107.44 H new ATOM 1617 N THR A 224 5.908 8.329 18.953 1.00 90.55 N ATOM 1618 CA THR A 224 5.653 7.022 18.358 1.00 88.88 C ATOM 1619 C THR A 224 4.429 6.413 19.035 1.00 83.43 C ATOM 1620 O THR A 224 4.145 6.692 20.200 1.00 85.93 O ATOM 1621 CB THR A 224 6.837 6.049 18.480 1.00 81.26 C ATOM 1622 OG1 THR A 224 6.558 5.109 19.518 1.00 80.70 O ATOM 1623 CG2 THR A 224 8.148 6.780 18.760 1.00 79.74 C ATOM 0 H THR A 224 6.608 8.377 19.450 1.00 90.55 H new ATOM 0 HA THR A 224 5.508 7.161 17.409 1.00 88.88 H new ATOM 0 HB THR A 224 6.946 5.587 17.634 1.00 81.26 H new ATOM 0 HG1 THR A 224 7.200 4.572 19.590 1.00 80.70 H new ATOM 0 HG21 THR A 224 8.869 6.135 18.830 1.00 79.74 H new ATOM 0 HG22 THR A 224 8.336 7.397 18.036 1.00 79.74 H new ATOM 0 HG23 THR A 224 8.073 7.272 19.592 1.00 79.74 H new ATOM 1624 N LEU A 225 3.691 5.597 18.295 1.00 79.45 N ATOM 1625 CA LEU A 225 2.450 5.043 18.815 1.00 81.98 C ATOM 1626 C LEU A 225 2.624 3.568 19.121 1.00 76.21 C ATOM 1627 O LEU A 225 3.163 2.811 18.308 1.00 70.38 O ATOM 1628 CB LEU A 225 1.308 5.256 17.833 1.00 78.88 C ATOM 1629 CG LEU A 225 -0.060 4.815 18.337 1.00 79.61 C ATOM 1630 CD1 LEU A 225 -0.300 5.349 19.711 1.00 82.42 C ATOM 1631 CD2 LEU A 225 -1.112 5.354 17.409 1.00 89.29 C ATOM 0 H LEU A 225 3.889 5.353 17.495 1.00 79.45 H new ATOM 0 HA LEU A 225 2.227 5.507 19.637 1.00 81.98 H new ATOM 0 HB2 LEU A 225 1.266 6.198 17.605 1.00 78.88 H new ATOM 0 HB3 LEU A 225 1.508 4.774 17.015 1.00 78.88 H new ATOM 0 HG LEU A 225 -0.096 3.846 18.364 1.00 79.61 H new ATOM 0 HD11 LEU A 225 -1.173 5.062 20.022 1.00 82.42 H new ATOM 0 HD12 LEU A 225 0.383 5.014 20.313 1.00 82.42 H new ATOM 0 HD13 LEU A 225 -0.266 6.318 19.692 1.00 82.42 H new ATOM 0 HD21 LEU A 225 -1.989 5.080 17.720 1.00 89.29 H new ATOM 0 HD22 LEU A 225 -1.064 6.323 17.393 1.00 89.29 H new ATOM 0 HD23 LEU A 225 -0.963 5.008 16.515 1.00 89.29 H new ATOM 1632 N VAL A 226 2.176 3.169 20.307 1.00 70.47 N ATOM 1633 CA VAL A 226 2.535 1.866 20.835 1.00 66.82 C ATOM 1634 C VAL A 226 1.331 1.020 21.194 1.00 69.57 C ATOM 1635 O VAL A 226 0.466 1.444 21.964 1.00 75.38 O ATOM 1636 CB VAL A 226 3.412 2.002 22.078 1.00 68.18 C ATOM 1637 CG1 VAL A 226 4.339 0.813 22.192 1.00 69.29 C ATOM 1638 CG2 VAL A 226 4.217 3.281 22.005 1.00 77.96 C ATOM 0 H VAL A 226 1.666 3.637 20.817 1.00 70.47 H new ATOM 0 HA VAL A 226 3.020 1.422 20.122 1.00 66.82 H new ATOM 0 HB VAL A 226 2.843 2.032 22.863 1.00 68.18 H new ATOM 0 HG11 VAL A 226 4.892 0.908 22.984 1.00 69.29 H new ATOM 0 HG12 VAL A 226 3.815 -0.001 22.260 1.00 69.29 H new ATOM 0 HG13 VAL A 226 4.906 0.768 21.406 1.00 69.29 H new ATOM 0 HG21 VAL A 226 4.771 3.360 22.797 1.00 77.96 H new ATOM 0 HG22 VAL A 226 4.782 3.264 21.216 1.00 77.96 H new ATOM 0 HG23 VAL A 226 3.615 4.040 21.955 1.00 77.96 H new ATOM 1639 N ASN A 227 1.290 -0.184 20.639 1.00 56.69 N ATOM 1640 CA ASN A 227 0.269 -1.150 20.994 1.00 57.20 C ATOM 1641 C ASN A 227 0.897 -2.312 21.732 1.00 55.06 C ATOM 1642 O ASN A 227 1.537 -3.167 21.115 1.00 55.94 O ATOM 1643 CB ASN A 227 -0.469 -1.618 19.734 1.00 57.78 C ATOM 1644 CG ASN A 227 -1.418 -2.766 19.989 1.00 52.57 C ATOM 1645 OD1 ASN A 227 -1.553 -3.648 19.148 1.00 58.76 O ATOM 1646 ND2 ASN A 227 -2.091 -2.757 21.134 1.00 53.61 N ATOM 0 H ASN A 227 1.851 -0.461 20.049 1.00 56.69 H new ATOM 0 HA ASN A 227 -0.381 -0.736 21.583 1.00 57.20 H new ATOM 0 HB2 ASN A 227 -0.966 -0.872 19.362 1.00 57.78 H new ATOM 0 HB3 ASN A 227 0.182 -1.887 19.067 1.00 57.78 H new ATOM 0 HD21 ASN A 227 -2.649 -3.388 21.310 1.00 53.61 H new ATOM 0 HD22 ASN A 227 -1.969 -2.121 21.699 1.00 53.61 H new ATOM 1647 N ARG A 228 0.743 -2.330 23.057 1.00 60.25 N ATOM 1648 CA ARG A 228 1.336 -3.407 23.866 1.00 68.46 C ATOM 1649 C ARG A 228 0.260 -4.363 24.343 1.00 60.72 C ATOM 1650 O ARG A 228 -0.736 -3.945 24.926 1.00 60.63 O ATOM 1651 CB ARG A 228 2.115 -2.858 25.063 1.00 60.68 C ATOM 1652 CG ARG A 228 2.758 -1.506 24.810 1.00 68.87 C ATOM 1653 CD ARG A 228 3.642 -1.118 25.973 1.00 71.96 C ATOM 1654 NE ARG A 228 4.948 -1.743 25.828 1.00 73.22 N ATOM 1655 CZ ARG A 228 6.053 -1.080 25.513 1.00 73.26 C ATOM 1656 NH1 ARG A 228 6.015 0.237 25.336 1.00 65.34 N ATOM 1657 NH2 ARG A 228 7.197 -1.736 25.383 1.00 77.15 N ATOM 0 H ARG A 228 0.306 -1.739 23.504 1.00 60.25 H new ATOM 0 HA ARG A 228 1.962 -3.884 23.299 1.00 68.46 H new ATOM 0 HB2 ARG A 228 1.515 -2.784 25.822 1.00 60.68 H new ATOM 0 HB3 ARG A 228 2.805 -3.494 25.308 1.00 60.68 H new ATOM 0 HG2 ARG A 228 3.282 -1.538 23.994 1.00 68.87 H new ATOM 0 HG3 ARG A 228 2.071 -0.834 24.680 1.00 68.87 H new ATOM 0 HD2 ARG A 228 3.738 -0.153 26.010 1.00 71.96 H new ATOM 0 HD3 ARG A 228 3.233 -1.394 26.808 1.00 71.96 H new ATOM 0 HE ARG A 228 5.007 -2.592 25.954 1.00 73.22 H new ATOM 0 HH11 ARG A 228 5.273 0.662 25.426 1.00 65.34 H new ATOM 0 HH12 ARG A 228 6.733 0.664 25.132 1.00 65.34 H new ATOM 0 HH21 ARG A 228 7.221 -2.587 25.503 1.00 77.15 H new ATOM 0 HH22 ARG A 228 7.916 -1.310 25.179 1.00 77.15 H new ATOM 1658 N ILE A 229 0.501 -5.649 24.110 1.00 51.41 N ATOM 1659 CA ILE A 229 -0.530 -6.668 24.124 1.00 56.05 C ATOM 1660 C ILE A 229 -0.120 -7.901 24.897 1.00 52.71 C ATOM 1661 O ILE A 229 0.988 -8.392 24.734 1.00 56.91 O ATOM 1662 CB ILE A 229 -0.874 -7.144 22.652 1.00 64.22 C ATOM 1663 CG1 ILE A 229 -0.931 -5.977 21.659 1.00 53.43 C ATOM 1664 CG2 ILE A 229 -2.156 -7.982 22.603 1.00 48.07 C ATOM 1665 CD1 ILE A 229 -0.778 -6.442 20.212 1.00 58.07 C ATOM 0 H ILE A 229 1.286 -5.955 23.936 1.00 51.41 H new ATOM 0 HA ILE A 229 -1.296 -6.255 24.552 1.00 56.05 H new ATOM 0 HB ILE A 229 -0.142 -7.717 22.374 1.00 64.22 H new ATOM 0 HG12 ILE A 229 -1.775 -5.510 21.759 1.00 53.43 H new ATOM 0 HG13 ILE A 229 -0.229 -5.342 21.869 1.00 53.43 H new ATOM 0 HG21 ILE A 229 -2.331 -8.253 21.688 1.00 48.07 H new ATOM 0 HG22 ILE A 229 -2.049 -8.770 23.158 1.00 48.07 H new ATOM 0 HG23 ILE A 229 -2.901 -7.454 22.932 1.00 48.07 H new ATOM 0 HD11 ILE A 229 -0.820 -5.675 19.619 1.00 58.07 H new ATOM 0 HD12 ILE A 229 0.077 -6.888 20.104 1.00 58.07 H new ATOM 0 HD13 ILE A 229 -1.494 -7.059 19.993 1.00 58.07 H new ATOM 1666 N GLU A 230 -1.033 -8.432 25.696 1.00 56.97 N ATOM 1667 CA GLU A 230 -0.917 -9.802 26.195 1.00 55.51 C ATOM 1668 C GLU A 230 -1.985 -10.663 25.532 1.00 58.46 C ATOM 1669 O GLU A 230 -3.095 -10.180 25.301 1.00 57.59 O ATOM 1670 CB GLU A 230 -1.106 -9.865 27.704 1.00 64.70 C ATOM 1671 CG GLU A 230 0.085 -9.512 28.544 1.00 82.18 C ATOM 1672 CD GLU A 230 -0.140 -9.894 29.992 1.00 89.77 C ATOM 1673 OE1 GLU A 230 -1.035 -9.292 30.633 1.00 93.17 O ATOM 1674 OE2 GLU A 230 0.556 -10.816 30.472 1.00 87.11 O ATOM 0 H GLU A 230 -1.735 -8.015 25.966 1.00 56.97 H new ATOM 0 HA GLU A 230 -0.028 -10.127 25.984 1.00 55.51 H new ATOM 0 HB2 GLU A 230 -1.833 -9.270 27.944 1.00 64.70 H new ATOM 0 HB3 GLU A 230 -1.386 -10.764 27.937 1.00 64.70 H new ATOM 0 HG2 GLU A 230 0.871 -9.967 28.204 1.00 82.18 H new ATOM 0 HG3 GLU A 230 0.259 -8.560 28.480 1.00 82.18 H new ATOM 1675 N LEU A 231 -1.682 -11.939 25.287 1.00 47.69 N ATOM 1676 CA LEU A 231 -2.606 -12.811 24.573 1.00 54.28 C ATOM 1677 C LEU A 231 -2.573 -14.259 25.058 1.00 55.86 C ATOM 1678 O LEU A 231 -1.557 -14.922 24.944 1.00 60.91 O ATOM 1679 CB LEU A 231 -2.291 -12.767 23.063 1.00 56.41 C ATOM 1680 CG LEU A 231 -3.165 -13.504 22.037 1.00 45.49 C ATOM 1681 CD1 LEU A 231 -2.984 -12.859 20.696 1.00 57.98 C ATOM 1682 CD2 LEU A 231 -2.884 -14.988 21.915 1.00 43.19 C ATOM 0 H LEU A 231 -0.947 -12.316 25.527 1.00 47.69 H new ATOM 0 HA LEU A 231 -3.499 -12.477 24.751 1.00 54.28 H new ATOM 0 HB2 LEU A 231 -2.281 -11.832 22.805 1.00 56.41 H new ATOM 0 HB3 LEU A 231 -1.387 -13.101 22.954 1.00 56.41 H new ATOM 0 HG LEU A 231 -4.078 -13.432 22.357 1.00 45.49 H new ATOM 0 HD11 LEU A 231 -3.532 -13.317 20.040 1.00 57.98 H new ATOM 0 HD12 LEU A 231 -3.251 -11.928 20.746 1.00 57.98 H new ATOM 0 HD13 LEU A 231 -2.052 -12.914 20.433 1.00 57.98 H new ATOM 0 HD21 LEU A 231 -3.475 -15.376 21.251 1.00 43.19 H new ATOM 0 HD22 LEU A 231 -1.962 -15.122 21.645 1.00 43.19 H new ATOM 0 HD23 LEU A 231 -3.035 -15.418 22.771 1.00 43.19 H new ATOM 1683 N LYS A 232 -3.704 -14.769 25.538 1.00 63.12 N ATOM 1684 CA LYS A 232 -3.770 -16.153 26.018 1.00 64.16 C ATOM 1685 C LYS A 232 -4.656 -16.992 25.091 1.00 66.00 C ATOM 1686 O LYS A 232 -5.706 -16.531 24.647 1.00 67.84 O ATOM 1687 CB LYS A 232 -4.287 -16.200 27.463 1.00 54.05 C ATOM 1688 CG LYS A 232 -3.534 -17.175 28.373 1.00 77.17 C ATOM 1689 CD LYS A 232 -3.834 -18.651 28.034 1.00 79.23 C ATOM 1690 CE LYS A 232 -2.897 -19.641 28.774 1.00 79.21 C ATOM 1691 NZ LYS A 232 -2.504 -20.829 27.904 1.00 66.32 N ATOM 0 H LYS A 232 -4.444 -14.334 25.596 1.00 63.12 H new ATOM 0 HA LYS A 232 -2.876 -16.529 26.009 1.00 64.16 H new ATOM 0 HB2 LYS A 232 -4.231 -15.310 27.844 1.00 54.05 H new ATOM 0 HB3 LYS A 232 -5.226 -16.445 27.451 1.00 54.05 H new ATOM 0 HG2 LYS A 232 -2.580 -17.015 28.294 1.00 77.17 H new ATOM 0 HG3 LYS A 232 -3.775 -17.003 29.297 1.00 77.17 H new ATOM 0 HD2 LYS A 232 -4.755 -18.851 28.264 1.00 79.23 H new ATOM 0 HD3 LYS A 232 -3.746 -18.783 27.077 1.00 79.23 H new ATOM 0 HE2 LYS A 232 -2.097 -19.173 29.059 1.00 79.21 H new ATOM 0 HE3 LYS A 232 -3.338 -19.962 29.576 1.00 79.21 H new ATOM 0 HZ1 LYS A 232 -1.968 -21.370 28.365 1.00 66.32 H new ATOM 0 HZ2 LYS A 232 -3.235 -21.273 27.660 1.00 66.32 H new ATOM 0 HZ3 LYS A 232 -2.078 -20.538 27.179 1.00 66.32 H new ATOM 1692 N GLY A 233 -4.229 -18.215 24.798 1.00 60.19 N ATOM 1693 CA GLY A 233 -4.910 -19.041 23.822 1.00 57.39 C ATOM 1694 C GLY A 233 -5.321 -20.389 24.366 1.00 66.21 C ATOM 1695 O GLY A 233 -4.477 -21.236 24.671 1.00 63.78 O ATOM 0 H GLY A 233 -3.541 -18.584 25.159 1.00 60.19 H new ATOM 0 HA2 GLY A 233 -5.698 -18.573 23.504 1.00 57.39 H new ATOM 0 HA3 GLY A 233 -4.330 -19.171 23.056 1.00 57.39 H new ATOM 1696 N ILE A 234 -6.632 -20.599 24.452 1.00 68.16 N ATOM 1697 CA ILE A 234 -7.184 -21.703 25.231 1.00 68.26 C ATOM 1698 C ILE A 234 -7.821 -22.779 24.365 1.00 62.83 C ATOM 1699 O ILE A 234 -8.361 -22.493 23.312 1.00 67.92 O ATOM 1700 CB ILE A 234 -8.244 -21.192 26.245 1.00 73.98 C ATOM 1701 CG1 ILE A 234 -7.971 -19.737 26.664 1.00 86.53 C ATOM 1702 CG2 ILE A 234 -8.248 -22.055 27.467 1.00 72.51 C ATOM 1703 CD1 ILE A 234 -8.876 -18.676 25.979 1.00 75.53 C ATOM 0 H ILE A 234 -7.222 -20.109 24.063 1.00 68.16 H new ATOM 0 HA ILE A 234 -6.431 -22.096 25.700 1.00 68.26 H new ATOM 0 HB ILE A 234 -9.108 -21.232 25.805 1.00 73.98 H new ATOM 0 HG12 ILE A 234 -8.082 -19.665 27.625 1.00 86.53 H new ATOM 0 HG13 ILE A 234 -7.044 -19.527 26.469 1.00 86.53 H new ATOM 0 HG21 ILE A 234 -8.913 -21.727 28.093 1.00 72.51 H new ATOM 0 HG22 ILE A 234 -8.461 -22.968 27.218 1.00 72.51 H new ATOM 0 HG23 ILE A 234 -7.372 -22.030 27.884 1.00 72.51 H new ATOM 0 HD11 ILE A 234 -8.637 -17.792 26.299 1.00 75.53 H new ATOM 0 HD12 ILE A 234 -8.752 -18.716 25.018 1.00 75.53 H new ATOM 0 HD13 ILE A 234 -9.805 -18.857 26.192 1.00 75.53 H new ATOM 1704 N ASP A 235 -7.732 -24.022 24.808 1.00 56.80 N ATOM 1705 CA ASP A 235 -8.484 -25.125 24.212 1.00 63.50 C ATOM 1706 C ASP A 235 -8.321 -25.386 22.704 1.00 60.31 C ATOM 1707 O ASP A 235 -9.274 -25.813 22.056 1.00 62.97 O ATOM 1708 CB ASP A 235 -9.973 -24.920 24.498 1.00 65.31 C ATOM 1709 CG ASP A 235 -10.249 -24.518 25.944 1.00 70.98 C ATOM 1710 OD1 ASP A 235 -9.624 -25.069 26.884 1.00 73.52 O ATOM 1711 OD2 ASP A 235 -11.110 -23.634 26.133 1.00 78.19 O ATOM 0 H ASP A 235 -7.232 -24.256 25.467 1.00 56.80 H new ATOM 0 HA ASP A 235 -8.099 -25.910 24.632 1.00 63.50 H new ATOM 0 HB2 ASP A 235 -10.321 -24.236 23.905 1.00 65.31 H new ATOM 0 HB3 ASP A 235 -10.452 -25.739 24.298 1.00 65.31 H new ATOM 1712 N PHE A 236 -7.133 -25.175 22.145 1.00 60.66 N ATOM 1713 CA PHE A 236 -6.937 -25.436 20.714 1.00 65.46 C ATOM 1714 C PHE A 236 -6.625 -26.904 20.435 1.00 68.68 C ATOM 1715 O PHE A 236 -6.015 -27.596 21.245 1.00 71.23 O ATOM 1716 CB PHE A 236 -5.820 -24.549 20.131 1.00 64.65 C ATOM 1717 CG PHE A 236 -6.211 -23.101 19.965 1.00 57.67 C ATOM 1718 CD1 PHE A 236 -6.721 -22.642 18.765 1.00 57.32 C ATOM 1719 CD2 PHE A 236 -6.073 -22.203 21.017 1.00 59.25 C ATOM 1720 CE1 PHE A 236 -7.085 -21.319 18.617 1.00 56.55 C ATOM 1721 CE2 PHE A 236 -6.435 -20.885 20.880 1.00 52.29 C ATOM 1722 CZ PHE A 236 -6.945 -20.443 19.678 1.00 54.40 C ATOM 0 H PHE A 236 -6.439 -24.887 22.563 1.00 60.66 H new ATOM 0 HA PHE A 236 -7.775 -25.217 20.278 1.00 65.46 H new ATOM 0 HB2 PHE A 236 -5.043 -24.601 20.710 1.00 64.65 H new ATOM 0 HB3 PHE A 236 -5.555 -24.904 19.268 1.00 64.65 H new ATOM 0 HD1 PHE A 236 -6.820 -23.230 18.051 1.00 57.32 H new ATOM 0 HD2 PHE A 236 -5.729 -22.500 21.829 1.00 59.25 H new ATOM 0 HE1 PHE A 236 -7.424 -21.017 17.805 1.00 56.55 H new ATOM 0 HE2 PHE A 236 -6.337 -20.296 21.593 1.00 52.29 H new ATOM 0 HZ PHE A 236 -7.196 -19.553 19.580 1.00 54.40 H new ATOM 1723 N LYS A 237 -7.057 -27.375 19.278 1.00 66.08 N ATOM 1724 CA LYS A 237 -6.778 -28.735 18.868 1.00 72.03 C ATOM 1725 C LYS A 237 -5.433 -28.802 18.179 1.00 79.93 C ATOM 1726 O LYS A 237 -5.267 -28.262 17.091 1.00 82.91 O ATOM 1727 CB LYS A 237 -7.877 -29.239 17.945 1.00 68.04 C ATOM 1728 CG LYS A 237 -9.230 -29.144 18.583 1.00 73.43 C ATOM 1729 CD LYS A 237 -10.333 -29.569 17.637 1.00 80.89 C ATOM 1730 CE LYS A 237 -11.664 -29.678 18.380 1.00 81.24 C ATOM 1731 NZ LYS A 237 -12.802 -29.911 17.440 1.00 79.34 N ATOM 0 H LYS A 237 -7.517 -26.918 18.713 1.00 66.08 H new ATOM 0 HA LYS A 237 -6.752 -29.304 19.653 1.00 72.03 H new ATOM 0 HB2 LYS A 237 -7.870 -28.724 17.123 1.00 68.04 H new ATOM 0 HB3 LYS A 237 -7.698 -30.161 17.703 1.00 68.04 H new ATOM 0 HG2 LYS A 237 -9.253 -29.702 19.376 1.00 73.43 H new ATOM 0 HG3 LYS A 237 -9.387 -28.232 18.873 1.00 73.43 H new ATOM 0 HD2 LYS A 237 -10.412 -28.927 16.914 1.00 80.89 H new ATOM 0 HD3 LYS A 237 -10.110 -30.423 17.235 1.00 80.89 H new ATOM 0 HE2 LYS A 237 -11.619 -30.405 19.021 1.00 81.24 H new ATOM 0 HE3 LYS A 237 -11.821 -28.864 18.884 1.00 81.24 H new ATOM 0 HZ1 LYS A 237 -13.527 -30.142 17.902 1.00 79.34 H new ATOM 0 HZ2 LYS A 237 -12.967 -29.165 16.983 1.00 79.34 H new ATOM 0 HZ3 LYS A 237 -12.591 -30.565 16.874 1.00 79.34 H new ATOM 1732 N GLU A 238 -4.478 -29.490 18.799 1.00 90.87 N ATOM 1733 CA GLU A 238 -3.089 -29.531 18.318 1.00 95.37 C ATOM 1734 C GLU A 238 -2.929 -30.181 16.945 1.00 86.73 C ATOM 1735 O GLU A 238 -1.917 -30.809 16.649 1.00102.26 O ATOM 1736 CB GLU A 238 -2.213 -30.263 19.337 1.00 91.76 C ATOM 1737 CG GLU A 238 -2.768 -31.604 19.762 1.00 89.59 C ATOM 1738 CD GLU A 238 -1.828 -32.343 20.685 1.00108.00 C ATOM 1739 OE1 GLU A 238 -0.652 -32.522 20.304 1.00106.93 O ATOM 1740 OE2 GLU A 238 -2.257 -32.734 21.795 1.00115.32 O ATOM 0 H GLU A 238 -4.613 -29.949 19.513 1.00 90.87 H new ATOM 0 HA GLU A 238 -2.807 -28.608 18.219 1.00 95.37 H new ATOM 0 HB2 GLU A 238 -1.329 -30.393 18.958 1.00 91.76 H new ATOM 0 HB3 GLU A 238 -2.106 -29.703 20.122 1.00 91.76 H new ATOM 0 HG2 GLU A 238 -3.620 -31.473 20.207 1.00 89.59 H new ATOM 0 HG3 GLU A 238 -2.939 -32.146 18.976 1.00 89.59 H new ATOM 1741 N ASP A 239 -3.930 -29.990 16.106 1.00 84.14 N ATOM 1742 CA ASP A 239 -4.068 -30.682 14.842 1.00 81.29 C ATOM 1743 C ASP A 239 -5.149 -29.957 14.071 1.00 85.72 C ATOM 1744 O ASP A 239 -5.379 -30.224 12.892 1.00 87.87 O ATOM 1745 CB ASP A 239 -4.450 -32.134 15.073 1.00 91.29 C ATOM 1746 CG ASP A 239 -5.430 -32.294 16.235 1.00 99.48 C ATOM 1747 OD1 ASP A 239 -6.645 -32.488 15.976 1.00 92.31 O ATOM 1748 OD2 ASP A 239 -4.983 -32.205 17.408 1.00 96.96 O ATOM 0 H ASP A 239 -4.569 -29.436 16.262 1.00 84.14 H new ATOM 0 HA ASP A 239 -3.233 -30.683 14.348 1.00 81.29 H new ATOM 0 HB2 ASP A 239 -4.847 -32.495 14.265 1.00 91.29 H new ATOM 0 HB3 ASP A 239 -3.650 -32.653 15.252 1.00 91.29 H new ATOM 1749 N GLY A 240 -5.827 -29.047 14.776 1.00 84.25 N ATOM 1750 CA GLY A 240 -6.811 -28.159 14.183 1.00 80.62 C ATOM 1751 C GLY A 240 -6.186 -27.236 13.153 1.00 78.07 C ATOM 1752 O GLY A 240 -4.995 -27.344 12.848 1.00 79.92 O ATOM 0 H GLY A 240 -5.722 -28.932 15.622 1.00 84.25 H new ATOM 0 HA2 GLY A 240 -7.511 -28.684 13.765 1.00 80.62 H new ATOM 0 HA3 GLY A 240 -7.231 -27.630 14.879 1.00 80.62 H new ATOM 1753 N ASN A 241 -6.979 -26.320 12.611 1.00 73.48 N ATOM 1754 CA ASN A 241 -6.478 -25.430 11.560 1.00 77.49 C ATOM 1755 C ASN A 241 -5.408 -24.452 12.032 1.00 72.31 C ATOM 1756 O ASN A 241 -4.606 -23.973 11.221 1.00 70.52 O ATOM 1757 CB ASN A 241 -7.622 -24.632 10.931 1.00 71.24 C ATOM 1758 CG ASN A 241 -8.507 -25.482 10.061 1.00 76.53 C ATOM 1759 OD1 ASN A 241 -8.018 -26.303 9.279 1.00 80.46 O ATOM 1760 ND2 ASN A 241 -9.823 -25.312 10.204 1.00 62.97 N ATOM 0 H ASN A 241 -7.801 -26.195 12.831 1.00 73.48 H new ATOM 0 HA ASN A 241 -6.067 -26.019 10.908 1.00 77.49 H new ATOM 0 HB2 ASN A 241 -8.155 -24.229 11.634 1.00 71.24 H new ATOM 0 HB3 ASN A 241 -7.254 -23.907 10.402 1.00 71.24 H new ATOM 0 HD21 ASN A 241 -10.371 -25.786 9.740 1.00 62.97 H new ATOM 0 HD22 ASN A 241 -10.123 -24.729 10.760 1.00 62.97 H new ATOM 1761 N ILE A 242 -5.394 -24.167 13.333 1.00 66.90 N ATOM 1762 CA ILE A 242 -4.520 -23.140 13.880 1.00 57.61 C ATOM 1763 C ILE A 242 -3.199 -23.744 14.326 1.00 63.58 C ATOM 1764 O ILE A 242 -2.144 -23.312 13.879 1.00 66.97 O ATOM 1765 CB ILE A 242 -5.190 -22.397 15.050 1.00 61.15 C ATOM 1766 CG1 ILE A 242 -6.347 -21.539 14.548 1.00 60.27 C ATOM 1767 CG2 ILE A 242 -4.207 -21.508 15.769 1.00 64.19 C ATOM 1768 CD1 ILE A 242 -7.640 -22.309 14.295 1.00 62.19 C ATOM 0 H ILE A 242 -5.888 -24.561 13.916 1.00 66.90 H new ATOM 0 HA ILE A 242 -4.347 -22.495 13.176 1.00 57.61 H new ATOM 0 HB ILE A 242 -5.520 -23.070 15.666 1.00 61.15 H new ATOM 0 HG12 ILE A 242 -6.522 -20.840 15.197 1.00 60.27 H new ATOM 0 HG13 ILE A 242 -6.078 -21.102 13.725 1.00 60.27 H new ATOM 0 HG21 ILE A 242 -4.655 -21.054 16.499 1.00 64.19 H new ATOM 0 HG22 ILE A 242 -3.481 -22.046 16.121 1.00 64.19 H new ATOM 0 HG23 ILE A 242 -3.851 -20.851 15.150 1.00 64.19 H new ATOM 0 HD11 ILE A 242 -8.324 -21.698 13.980 1.00 62.19 H new ATOM 0 HD12 ILE A 242 -7.484 -22.993 13.625 1.00 62.19 H new ATOM 0 HD13 ILE A 242 -7.935 -22.726 15.119 1.00 62.19 H new ATOM 1769 N LEU A 243 -3.248 -24.752 15.194 1.00 73.47 N ATOM 1770 CA LEU A 243 -2.017 -25.377 15.672 1.00 68.33 C ATOM 1771 C LEU A 243 -1.398 -26.202 14.561 1.00 67.01 C ATOM 1772 O LEU A 243 -0.198 -26.479 14.583 1.00 66.49 O ATOM 1773 CB LEU A 243 -2.266 -26.236 16.914 1.00 63.95 C ATOM 1774 CG LEU A 243 -2.499 -25.393 18.172 1.00 69.97 C ATOM 1775 CD1 LEU A 243 -2.438 -26.209 19.467 1.00 73.64 C ATOM 1776 CD2 LEU A 243 -1.516 -24.247 18.227 1.00 61.30 C ATOM 0 H LEU A 243 -3.973 -25.085 15.515 1.00 73.47 H new ATOM 0 HA LEU A 243 -1.399 -24.675 15.929 1.00 68.33 H new ATOM 0 HB2 LEU A 243 -3.037 -26.804 16.761 1.00 63.95 H new ATOM 0 HB3 LEU A 243 -1.506 -26.822 17.057 1.00 63.95 H new ATOM 0 HG LEU A 243 -3.402 -25.045 18.107 1.00 69.97 H new ATOM 0 HD11 LEU A 243 -2.592 -25.624 20.226 1.00 73.64 H new ATOM 0 HD12 LEU A 243 -3.119 -26.899 19.447 1.00 73.64 H new ATOM 0 HD13 LEU A 243 -1.564 -26.621 19.549 1.00 73.64 H new ATOM 0 HD21 LEU A 243 -1.675 -23.722 19.027 1.00 61.30 H new ATOM 0 HD22 LEU A 243 -0.611 -24.597 18.244 1.00 61.30 H new ATOM 0 HD23 LEU A 243 -1.630 -23.685 17.445 1.00 61.30 H new ATOM 1777 N GLY A 244 -2.213 -26.560 13.576 1.00 65.03 N ATOM 1778 CA GLY A 244 -1.735 -27.321 12.438 1.00 72.09 C ATOM 1779 C GLY A 244 -1.283 -26.528 11.221 1.00 77.32 C ATOM 1780 O GLY A 244 -1.074 -27.114 10.155 1.00 80.91 O ATOM 0 H GLY A 244 -3.051 -26.369 13.551 1.00 65.03 H new ATOM 0 HA2 GLY A 244 -0.992 -27.871 12.733 1.00 72.09 H new ATOM 0 HA3 GLY A 244 -2.442 -27.924 12.160 1.00 72.09 H new ATOM 1781 N HIS A 245 -1.118 -25.214 11.381 1.00 74.59 N ATOM 1782 CA HIS A 245 -0.781 -24.307 10.278 1.00 71.43 C ATOM 1783 C HIS A 245 -1.405 -24.745 8.958 1.00 79.28 C ATOM 1784 O HIS A 245 -0.698 -25.018 7.987 1.00 84.04 O ATOM 1785 CB HIS A 245 0.735 -24.192 10.126 1.00 72.66 C ATOM 1786 CG HIS A 245 1.415 -23.616 11.328 1.00 75.79 C ATOM 1787 ND1 HIS A 245 1.661 -22.267 11.470 1.00 73.98 N ATOM 1788 CD2 HIS A 245 1.888 -24.205 12.451 1.00 71.54 C ATOM 1789 CE1 HIS A 245 2.262 -22.051 12.626 1.00 66.52 C ATOM 1790 NE2 HIS A 245 2.412 -23.209 13.240 1.00 70.74 N ATOM 0 H HIS A 245 -1.199 -24.819 12.141 1.00 74.59 H new ATOM 0 HA HIS A 245 -1.150 -23.438 10.502 1.00 71.43 H new ATOM 0 HB2 HIS A 245 1.102 -25.072 9.946 1.00 72.66 H new ATOM 0 HB3 HIS A 245 0.934 -23.639 9.355 1.00 72.66 H new ATOM 0 HD2 HIS A 245 1.863 -25.113 12.651 1.00 71.54 H new ATOM 0 HE1 HIS A 245 2.533 -21.223 12.952 1.00 66.52 H new ATOM 0 HE2 HIS A 245 2.778 -23.322 14.010 1.00 70.74 H new ATOM 1791 N LYS A 246 -2.732 -24.843 8.950 1.00 80.95 N ATOM 1792 CA LYS A 246 -3.478 -25.276 7.771 1.00 84.87 C ATOM 1793 C LYS A 246 -4.167 -24.120 7.035 1.00 80.60 C ATOM 1794 O LYS A 246 -5.250 -24.303 6.487 1.00 78.85 O ATOM 1795 CB LYS A 246 -4.546 -26.310 8.151 1.00 80.97 C ATOM 1796 CG LYS A 246 -4.084 -27.505 8.967 1.00 79.61 C ATOM 1797 CD LYS A 246 -5.247 -28.493 9.101 1.00 83.15 C ATOM 1798 CE LYS A 246 -4.851 -29.797 9.793 1.00 80.21 C ATOM 1799 NZ LYS A 246 -6.043 -30.682 9.978 1.00 74.68 N ATOM 0 H LYS A 246 -3.226 -24.660 9.630 1.00 80.95 H new ATOM 0 HA LYS A 246 -2.820 -25.666 7.175 1.00 84.87 H new ATOM 0 HB2 LYS A 246 -5.243 -25.855 8.649 1.00 80.97 H new ATOM 0 HB3 LYS A 246 -4.951 -26.640 7.334 1.00 80.97 H new ATOM 0 HG2 LYS A 246 -3.328 -27.933 8.536 1.00 79.61 H new ATOM 0 HG3 LYS A 246 -3.785 -27.217 9.844 1.00 79.61 H new ATOM 0 HD2 LYS A 246 -5.965 -28.073 9.601 1.00 83.15 H new ATOM 0 HD3 LYS A 246 -5.596 -28.695 8.219 1.00 83.15 H new ATOM 0 HE2 LYS A 246 -4.180 -30.257 9.265 1.00 80.21 H new ATOM 0 HE3 LYS A 246 -4.450 -29.602 10.655 1.00 80.21 H new ATOM 0 HZ1 LYS A 246 -6.189 -30.806 10.847 1.00 74.68 H new ATOM 0 HZ2 LYS A 246 -6.757 -30.300 9.609 1.00 74.68 H new ATOM 0 HZ3 LYS A 246 -5.893 -31.468 9.588 1.00 74.68 H new ATOM 1800 N LEU A 247 -3.558 -22.938 7.018 1.00 85.13 N ATOM 1801 CA LEU A 247 -4.175 -21.796 6.333 1.00 86.52 C ATOM 1802 C LEU A 247 -3.481 -21.416 5.023 1.00 88.01 C ATOM 1803 O LEU A 247 -2.294 -21.706 4.828 1.00 87.78 O ATOM 1804 CB LEU A 247 -4.210 -20.575 7.247 1.00 82.73 C ATOM 1805 CG LEU A 247 -5.156 -20.612 8.445 1.00 73.07 C ATOM 1806 CD1 LEU A 247 -5.152 -19.252 9.096 1.00 61.04 C ATOM 1807 CD2 LEU A 247 -6.564 -20.998 8.025 1.00 69.09 C ATOM 0 H LEU A 247 -2.800 -22.774 7.389 1.00 85.13 H new ATOM 0 HA LEU A 247 -5.075 -22.082 6.111 1.00 86.52 H new ATOM 0 HB2 LEU A 247 -3.311 -20.426 7.581 1.00 82.73 H new ATOM 0 HB3 LEU A 247 -4.443 -19.804 6.706 1.00 82.73 H new ATOM 0 HG LEU A 247 -4.851 -21.284 9.074 1.00 73.07 H new ATOM 0 HD11 LEU A 247 -5.749 -19.257 9.861 1.00 61.04 H new ATOM 0 HD12 LEU A 247 -4.253 -19.036 9.390 1.00 61.04 H new ATOM 0 HD13 LEU A 247 -5.452 -18.586 8.457 1.00 61.04 H new ATOM 0 HD21 LEU A 247 -7.142 -21.013 8.804 1.00 69.09 H new ATOM 0 HD22 LEU A 247 -6.900 -20.350 7.386 1.00 69.09 H new ATOM 0 HD23 LEU A 247 -6.550 -21.877 7.616 1.00 69.09 H new ATOM 1808 N GLU A 248 -4.240 -20.748 4.151 1.00 87.43 N ATOM 1809 CA GLU A 248 -3.796 -20.369 2.806 1.00 91.30 C ATOM 1810 C GLU A 248 -2.470 -19.601 2.814 1.00 85.77 C ATOM 1811 O GLU A 248 -1.544 -19.935 2.074 1.00 94.81 O ATOM 1812 CB GLU A 248 -4.879 -19.536 2.106 1.00 93.16 C ATOM 1813 CG GLU A 248 -5.398 -20.138 0.797 1.00 97.70 C ATOM 1814 CD GLU A 248 -6.186 -19.134 -0.046 1.00110.73 C ATOM 1815 OE1 GLU A 248 -6.614 -18.085 0.498 1.00103.36 O ATOM 1816 OE2 GLU A 248 -6.372 -19.395 -1.258 1.00116.16 O ATOM 0 H GLU A 248 -5.043 -20.498 4.328 1.00 87.43 H new ATOM 0 HA GLU A 248 -3.646 -21.193 2.317 1.00 91.30 H new ATOM 0 HB2 GLU A 248 -5.626 -19.421 2.714 1.00 93.16 H new ATOM 0 HB3 GLU A 248 -4.523 -18.652 1.923 1.00 93.16 H new ATOM 0 HG2 GLU A 248 -4.648 -20.471 0.279 1.00 97.70 H new ATOM 0 HG3 GLU A 248 -5.964 -20.900 0.998 1.00 97.70 H new ATOM 1817 N TYR A 249 -2.379 -18.575 3.650 1.00 77.18 N ATOM 1818 CA TYR A 249 -1.115 -17.883 3.864 1.00 77.33 C ATOM 1819 C TYR A 249 -0.196 -18.786 4.664 1.00 90.29 C ATOM 1820 O TYR A 249 -0.356 -18.919 5.883 1.00 89.75 O ATOM 1821 CB TYR A 249 -1.345 -16.569 4.599 1.00 66.12 C ATOM 1822 CG TYR A 249 -0.132 -15.694 4.844 1.00 70.36 C ATOM 1823 CD1 TYR A 249 0.139 -14.607 4.009 1.00 77.89 C ATOM 1824 CD2 TYR A 249 0.714 -15.907 5.941 1.00 71.41 C ATOM 1825 CE1 TYR A 249 1.239 -13.763 4.235 1.00 71.73 C ATOM 1826 CE2 TYR A 249 1.822 -15.069 6.179 1.00 67.23 C ATOM 1827 CZ TYR A 249 2.072 -14.000 5.318 1.00 69.94 C ATOM 1828 OH TYR A 249 3.132 -13.152 5.526 1.00 68.14 O ATOM 0 H TYR A 249 -3.039 -18.263 4.104 1.00 77.18 H new ATOM 0 HA TYR A 249 -0.706 -17.677 3.009 1.00 77.33 H new ATOM 0 HB2 TYR A 249 -1.993 -16.052 4.095 1.00 66.12 H new ATOM 0 HB3 TYR A 249 -1.749 -16.771 5.457 1.00 66.12 H new ATOM 0 HD1 TYR A 249 -0.422 -14.438 3.287 1.00 77.89 H new ATOM 0 HD2 TYR A 249 0.541 -16.613 6.521 1.00 71.41 H new ATOM 0 HE1 TYR A 249 1.407 -13.050 3.662 1.00 71.73 H new ATOM 0 HE2 TYR A 249 2.382 -15.227 6.904 1.00 67.23 H new ATOM 0 HH TYR A 249 3.301 -13.110 6.348 1.00 68.14 H new ATOM 1829 N ASN A 250 0.757 -19.413 3.978 1.00 94.39 N ATOM 1830 CA ASN A 250 1.705 -20.300 4.638 1.00 99.86 C ATOM 1831 C ASN A 250 3.141 -19.967 4.244 1.00106.77 C ATOM 1832 O ASN A 250 3.593 -18.833 4.414 1.00 98.00 O ATOM 1833 CB ASN A 250 1.378 -21.765 4.313 1.00104.14 C ATOM 1834 CG ASN A 250 1.120 -22.601 5.566 1.00 94.31 C ATOM 1835 OD1 ASN A 250 1.957 -22.657 6.469 1.00 84.52 O ATOM 1836 ND2 ASN A 250 -0.048 -23.242 5.625 1.00 86.27 N ATOM 0 H ASN A 250 0.870 -19.337 3.129 1.00 94.39 H new ATOM 0 HA ASN A 250 1.625 -20.169 5.596 1.00 99.86 H new ATOM 0 HB2 ASN A 250 0.597 -21.799 3.739 1.00104.14 H new ATOM 0 HB3 ASN A 250 2.113 -22.154 3.814 1.00104.14 H new ATOM 0 HD21 ASN A 250 -0.242 -23.719 6.314 1.00 86.27 H new ATOM 0 HD22 ASN A 250 -0.607 -23.178 4.974 1.00 86.27 H new TER 1837 ASN A 250 HETATM 1838 O HOH A 301 -7.807 0.019 18.269 1.00 62.57 O HETATM 1839 O HOH A 302 -5.731 -11.001 15.994 1.00 47.02 O HETATM 1840 O HOH A 303 -14.362 -10.021 25.090 1.00 46.03 O HETATM 1841 O HOH A 304 5.185 -15.242 25.982 1.00 53.69 O HETATM 1842 O HOH A 305 1.330 -17.657 9.041 1.00 50.38 O HETATM 1843 O HOH A 306 -4.940 -2.910 20.267 1.00 56.90 O HETATM 1844 O HOH A 307 -9.453 -6.823 6.136 1.00 65.91 O HETATM 1845 O HOH A 308 -6.875 -11.481 13.000 1.00 45.79 O HETATM 1846 O HOH A 309 -20.730 -18.247 14.843 1.00 58.70 O HETATM 1847 O HOH A 310 -14.178 -16.769 29.702 1.00 52.18 O HETATM 1848 O HOH A 311 -8.248 -13.530 13.386 1.00 45.99 O HETATM 1849 O HOH A 312 -1.193 -21.426 8.287 1.00 66.93 O HETATM 1850 O HOH A 313 3.865 -13.312 29.843 1.00 70.11 O HETATM 1851 O HOH A 314 -6.612 -15.648 6.162 1.00 51.05 O HETATM 1852 O HOH A 315 -6.118 -1.151 12.554 1.00 57.46 O HETATM 1853 O HOH A 316 -5.694 -17.428 5.316 1.00 68.66 O CONECT 1167 1173 CONECT 1173 1167 1174 CONECT 1174 1173 1175 1177 CONECT 1175 1174 1176 CONECT 1176 1175 CONECT 1177 1174 1178 1179 CONECT 1178 1177 1182 CONECT 1179 1177 1180 1183 CONECT 1180 1179 1181 1182 CONECT 1181 1180 1442 CONECT 1182 1178 1180 1186 CONECT 1183 1179 1184 CONECT 1184 1183 1185 1194 CONECT 1185 1184 CONECT 1186 1182 1187 CONECT 1187 1186 1188 1189 CONECT 1188 1187 1190 CONECT 1189 1187 1191 CONECT 1190 1188 1192 CONECT 1191 1189 1192 CONECT 1192 1190 1191 1193 CONECT 1193 1192 CONECT 1194 1184 CONECT 1442 1181 END