USER MOD reduce.3.24.130724 H: found=0, std=0, add=1664, rem=0, adj=67 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER COAGULATION FACTOR 08-SEP-95 2HFT TITLE THE CRYSTAL STRUCTURE OF THE EXTRACELLULAR DOMAIN OF HUMAN TITLE 2 TISSUE FACTOR AT 1.7 ANGSTROMS RESOLUTION COMPND MOL_ID: 1; COMPND 2 MOLECULE: HUMAN TISSUE FACTOR; COMPND 3 CHAIN: A; COMPND 4 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS COAGULATION FACTOR EXPDTA X-RAY DIFFRACTION AUTHOR Y.A.MULLER,A.M.DE VOS REVDAT 2 24-FEB-09 2HFT 1 VERSN REVDAT 1 29-JAN-96 2HFT 0 SPRSDE 29-JAN-96 2HFT 1HFT JRNL AUTH Y.A.MULLER,M.H.ULTSCH,A.M.DE VOS JRNL TITL THE CRYSTAL STRUCTURE OF THE EXTRACELLULAR DOMAIN JRNL TITL 2 OF HUMAN TISSUE FACTOR REFINED TO 1.7 A RESOLUTION. JRNL REF J.MOL.BIOL. V. 256 144 1996 JRNL REFN ISSN 0022-2836 JRNL PMID 8609606 JRNL DOI 10.1006/JMBI.1996.0073 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH R.F.KELLEY,K.E.COSTAS,E.M.O'CONNELL,R.A.LAZARUS REMARK 1 TITL ANALYSIS OF THE FACTOR VIIA BINDING SITE ON HUMAN REMARK 1 TITL 2 TISSUE FACTOR: EFFECTS OF TISSUE FACTOR MUTATIONS REMARK 1 TITL 3 ON THE KINETICS AND THERMODYNAMICS OF BINDING REMARK 1 REF BIOCHEMISTRY V. 34 10383 1995 REMARK 1 REFN ISSN 0006-2960 REMARK 1 REFERENCE 2 REMARK 1 AUTH Y.A.MULLER,M.H.ULTSCH,R.F.KELLEY,A.M.DE VOS REMARK 1 TITL STRUCTURE OF THE EXTRACELLULAR DOMAIN OF HUMAN REMARK 1 TITL 2 TISSUE FACTOR: LOCATION OF THE FACTOR VIIA BINDING REMARK 1 TITL 3 SITE REMARK 1 REF BIOCHEMISTRY V. 33 10864 1994 REMARK 1 REFN ISSN 0006-2960 REMARK 2 REMARK 2 RESOLUTION. 1.69 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : PROLSQ, X-PLOR REMARK 3 AUTHORS : KONNERT,HENDRICKSON REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 1.69 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 6.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 97.0 REMARK 3 NUMBER OF REFLECTIONS : 24199 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : NULL REMARK 3 FREE R VALUE TEST SET SELECTION : NULL REMARK 3 R VALUE (WORKING + TEST SET) : 0.204 REMARK 3 R VALUE (WORKING SET) : NULL REMARK 3 FREE R VALUE : 0.254 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 8.500 REMARK 3 FREE R VALUE TEST SET COUNT : NULL REMARK 3 REMARK 3 FIT/AGREEMENT OF MODEL WITH ALL DATA. REMARK 3 R VALUE (WORKING + TEST SET, NO CUTOFF) : NULL REMARK 3 R VALUE (WORKING SET, NO CUTOFF) : NULL REMARK 3 FREE R VALUE (NO CUTOFF) : NULL REMARK 3 FREE R VALUE TEST SET SIZE (%, NO CUTOFF) : NULL REMARK 3 FREE R VALUE TEST SET COUNT (NO CUTOFF) : NULL REMARK 3 TOTAL NUMBER OF REFLECTIONS (NO CUTOFF) : NULL REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1696 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 5 REMARK 3 SOLVENT ATOMS : 235 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 27.60 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.20 REMARK 3 ESD FROM SIGMAA (A) : NULL REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 DISTANCE RESTRAINTS. RMS SIGMA REMARK 3 BOND LENGTH (A) : 0.012 ; NULL REMARK 3 ANGLE DISTANCE (A) : 1.840 ; NULL REMARK 3 INTRAPLANAR 1-4 DISTANCE (A) : NULL ; NULL REMARK 3 H-BOND OR METAL COORDINATION (A) : NULL ; NULL REMARK 3 REMARK 3 PLANE RESTRAINT (A) : NULL ; NULL REMARK 3 CHIRAL-CENTER RESTRAINT (A**3) : NULL ; NULL REMARK 3 REMARK 3 NON-BONDED CONTACT RESTRAINTS. REMARK 3 SINGLE TORSION (A) : NULL ; NULL REMARK 3 MULTIPLE TORSION (A) : NULL ; NULL REMARK 3 H-BOND (X...Y) (A) : NULL ; NULL REMARK 3 H-BOND (X-H...Y) (A) : NULL ; NULL REMARK 3 REMARK 3 CONFORMATIONAL TORSION ANGLE RESTRAINTS. REMARK 3 SPECIFIED (DEGREES) : NULL ; NULL REMARK 3 PLANAR (DEGREES) : NULL ; NULL REMARK 3 STAGGERED (DEGREES) : NULL ; NULL REMARK 3 TRANSVERSE (DEGREES) : NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 2HFT COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY BNL. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : NULL REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 7.5 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : NULL REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : NULL REMARK 200 WAVELENGTH OR RANGE (A) : 0.908 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : FUJI FILM REMARK 200 INTENSITY-INTEGRATION SOFTWARE : DENZO REMARK 200 DATA SCALING SOFTWARE : NULL REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 24199 REMARK 200 RESOLUTION RANGE HIGH (A) : 1.690 REMARK 200 RESOLUTION RANGE LOW (A) : 6.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 97.0 REMARK 200 DATA REDUNDANCY : 4.500 REMARK 200 R MERGE (I) : 0.05800 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : NULL REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: NULL REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL REMARK 200 SOFTWARE USED: X-PLOR REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 48.44 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.39 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PH 7.5 REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 41 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+1/4 REMARK 290 4555 Y+1/2,-X+1/2,Z+3/4 REMARK 290 5555 -X+1/2,Y+1/2,-Z+1/4 REMARK 290 6555 X+1/2,-Y+1/2,-Z+3/4 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 115.40000 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 22.60000 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 22.60000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 57.70000 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 22.60000 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 22.60000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 173.10000 REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 22.60000 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 22.60000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 57.70000 REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 22.60000 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 22.60000 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 173.10000 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 115.40000 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: DIMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 350 BIOMT1 2 0.000000 -1.000000 0.000000 90.40000 REMARK 350 BIOMT2 2 -1.000000 0.000000 0.000000 90.40000 REMARK 350 BIOMT3 2 0.000000 0.000000 -1.000000 115.40000 REMARK 400 REMARK 400 COMPOUND REMARK 400 THE FACTOR VII BINDING SITE WAS IDENTIFIED BY REMARK 400 ALA-SCANNING MUTAGENESIS (KELLEY ET AL., 1995; SEE REMARK 400 REFERENCE 1 ABOVE). THIS SITE IS LISTED BELOW AND THE REMARK 400 SITE IDENTIFIER IS VII. REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY A 87 REMARK 465 SER A 88 REMARK 465 ALA A 89 REMARK 465 GLY A 90 REMARK 465 SER A 160A REMARK 465 SER A 160B REMARK 465 GLN A 160C REMARK 465 GLU A 160D REMARK 465 LYS A 160E REMARK 465 GLY A 160F REMARK 465 GLU A 160G REMARK 465 PHE A 160H REMARK 465 ARG A 160I 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 THR A 3 166.51 63.59 REMARK 500 PHE A 19 -8.03 74.44 REMARK 500 TYR A 51 63.63 32.93 REMARK 500 ASN A 137 -125.15 63.83 REMARK 500 ASN A 138 46.08 -109.98 REMARK 500 THR A 172 -161.26 -119.93 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A 342 DISTANCE = 6.70 ANGSTROMS REMARK 525 HOH A 501 DISTANCE = 5.27 ANGSTROMS REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: VII REMARK 800 EVIDENCE_CODE: AUTHOR REMARK 800 SITE_DESCRIPTION: FACTOR VII BINDING SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE SO4 A 850 DBREF 2HFT A 1 211 UNP P13726 TF_HUMAN 33 243 SEQADV 2HFT GLN A 160C UNP P13726 INSERTION SEQADV 2HFT GLU A 160D UNP P13726 INSERTION SEQADV 2HFT LYS A 160E UNP P13726 INSERTION SEQADV 2HFT GLY A 160F UNP P13726 INSERTION SEQADV 2HFT GLU A 160G UNP P13726 INSERTION SEQADV 2HFT PHE A 160H UNP P13726 INSERTION SEQADV 2HFT ARG A 160I UNP P13726 INSERTION SEQRES 1 A 218 SER GLY THR THR ASN THR VAL ALA ALA TYR ASN LEU THR SEQRES 2 A 218 TRP LYS SER THR ASN PHE LYS THR ILE LEU GLU TRP GLU SEQRES 3 A 218 PRO LYS PRO VAL ASN GLN VAL TYR THR VAL GLN ILE SER SEQRES 4 A 218 THR LYS SER GLY ASP TRP LYS SER LYS CYS PHE TYR THR SEQRES 5 A 218 THR ASP THR GLU CYS ASP LEU THR ASP GLU ILE VAL LYS SEQRES 6 A 218 ASP VAL LYS GLN THR TYR LEU ALA ARG VAL PHE SER TYR SEQRES 7 A 218 PRO ALA GLY ASN VAL GLU SER THR GLY SER ALA GLY GLU SEQRES 8 A 218 PRO LEU TYR GLU ASN SER PRO GLU PHE THR PRO TYR LEU SEQRES 9 A 218 GLU THR ASN LEU GLY GLN PRO THR ILE GLN SER PHE GLU SEQRES 10 A 218 GLN VAL GLY THR LYS VAL ASN VAL THR VAL GLU ASP GLU SEQRES 11 A 218 ARG THR LEU VAL ARG ARG ASN ASN THR PHE LEU SER LEU SEQRES 12 A 218 ARG ASP VAL PHE GLY LYS ASP LEU ILE TYR THR LEU TYR SEQRES 13 A 218 TYR TRP LYS SER SER SER GLN GLU LYS GLY GLU PHE ARG SEQRES 14 A 218 SER GLY LYS LYS THR ALA LYS THR ASN THR ASN GLU PHE SEQRES 15 A 218 LEU ILE ASP VAL ASP LYS GLY GLU ASN TYR CYS PHE SER SEQRES 16 A 218 VAL GLN ALA VAL ILE PRO SER ARG THR VAL ASN ARG LYS SEQRES 17 A 218 SER THR ASP SER PRO VAL GLU CYS MET GLY HET SO4 A 850 5 HETNAM SO4 SULFATE ION FORMUL 2 SO4 O4 S 2- FORMUL 3 HOH *235(H2 O) HELIX 1 1 THR A 60 ASP A 66 1 7 HELIX 2 2 PRO A 102 GLU A 105 1 4 HELIX 3 3 LEU A 143 ASP A 150 1 8 SHEET 1 A 3 THR A 13 THR A 17 0 SHEET 2 A 3 LYS A 20 GLU A 24 -1 N GLU A 24 O THR A 13 SHEET 3 A 3 GLU A 56 ASP A 58 -1 N CYS A 57 O LEU A 23 SHEET 1 B 4 TYR A 94 ASN A 96 0 SHEET 2 B 4 TYR A 71 PRO A 79 -1 N VAL A 75 O GLU A 95 SHEET 3 B 4 GLN A 32 THR A 40 -1 N SER A 39 O LEU A 72 SHEET 4 B 4 LYS A 46 CYS A 49 -1 N CYS A 49 O VAL A 36 SHEET 1 C 3 GLU A 174 ASP A 178 0 SHEET 2 C 3 LYS A 122 VAL A 127 -1 N VAL A 125 O PHE A 175 SHEET 3 C 3 ILE A 113 VAL A 119 -1 N VAL A 119 O LYS A 122 SHEET 1 D 3 CYS A 186 VAL A 192 0 SHEET 2 D 3 ILE A 152 TRP A 158 -1 N TRP A 158 O CYS A 186 SHEET 3 D 3 LYS A 166 THR A 170 -1 N THR A 170 O TYR A 153 SSBOND *** CYS A 49 CYS A 57 1555 1555 2.04 SSBOND *** CYS A 186 CYS A 209 1555 1555 2.06 CISPEP 1 GLU A 26 PRO A 27 0 1.72 SITE *** VII 5 LYS A 20 TRP A 45 ASP A 58 TYR A 94 SITE *** VII 5 PHE A 140 SITE *** AC1 8 THR A 3 THR A 4 ASN A 5 THR A 6 SITE *** AC1 8 PRO A 79 SER A 85 THR A 86 HOH A 463 CRYST1 45.200 45.200 230.800 90.00 90.00 90.00 P 41 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 0.022124 0.000000 0.000000 0.00000 SCALE2 0.000000 0.022124 0.000000 0.00000 SCALE3 0.000000 0.000000 0.004333 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 110 GLN : amide:sc= 1.04 K(o=1,f=0.37) USER MOD Set 1.2: A 203 THR OG1 : rot -104:sc= -0.0187 USER MOD Set 2.1: A 107 ASN : amide:sc= 1.11 X(o=-2.4,f=-2.7!) USER MOD Set 2.2: A 199 ASN B: amide:sc= -3.48! K(o=-2.4!,f=0.49) USER MOD Set 3.1: A 188 SER OG A: rot 83:sc= 0.322 USER MOD Set 3.2: A 205 SER OG : rot 150:sc= 0.465 USER MOD Set 4.1: A 170 THR OG1 : rot 73:sc= 1.49 USER MOD Set 4.2: A 172 THR OG1 : rot -55:sc= 0.426 USER MOD Set 5.1: A 16 SER OG : rot 99:sc= 1.52 USER MOD Set 5.2: A 21 THR OG1 : rot 72:sc= 0.994 USER MOD Set 5.3: A 106 THR OG1 : rot 76:sc= 1.51 USER MOD Set 6.1: A 70 THR OG1 : rot -64:sc= 1.45 USER MOD Set 6.2: A 101 THR OG1 : rot 81:sc= 0.652 USER MOD Set 7.1: A 37 GLN : amide:sc= 1.54 K(o=1.8,f=-2.9!) USER MOD Set 7.2: A 47 SER OG : rot -82:sc= 0.224 USER MOD Set 8.1: A 32 GLN : amide:sc= 0.238 K(o=1.4,f=-4.5!) USER MOD Set 8.2: A 34 TYR OH : rot -164:sc= 1.14 USER MOD Set 9.1: A 3 THR OG1 : rot -46:sc= 2.1 USER MOD Set 9.2: A 6 THR OG1 : rot -14:sc= 1.64 USER MOD Set10.1: A 4 THR OG1 : rot -92:sc= 1.73 USER MOD Set10.2: A 86 THR OG1 : rot 80:sc= -1.15! USER MOD Single : A 1 SER N :NH3+ -127:sc= 1.16 (180deg=-0.907!) USER MOD Single : A 1 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -1.2! K(o=-1.2!,f=-0.39) USER MOD Single : A 10 TYR OH : rot -24:sc= 1.35 USER MOD Single : A 11 ASN : amide:sc= -0.995 X(o=-0.99,f=-0.94) USER MOD Single : A 13 THR OG1 : rot 68:sc= 0.154 USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= 0.4 K(o=0.4,f=-3.2!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= 0.0102 K(o=0.01,f=-0.83) USER MOD Single : A 35 THR OG1 : rot 149:sc= 0.223 USER MOD Single : A 39 SER OG : rot -99:sc= 1.41 USER MOD Single : A 40 THR OG1 : rot 97:sc= 0.514 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 171:sc= 1.03 (180deg=0.992) USER MOD Single : A 48 LYS NZ :NH3+ 163:sc= -4.7! (180deg=-6.25!) USER MOD Single : A 49 CYS SG B: rot 82:sc= 0.3 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot 151:sc= 0.104 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 CYS SG B: rot 180:sc= -0.926 USER MOD Single : A 60 THR OG1 : rot 85:sc= 1.47 USER MOD Single : A 65 LYS NZ :NH3+ -110:sc= 0.243 (180deg=-0.304) USER MOD Single : A 68 LYS NZ :NH3+ -142:sc= 1.06 (180deg=0.198) USER MOD Single : A 69 GLN : amide:sc= 1.06 K(o=1.1,f=-2.3!) USER MOD Single : A 71 TYR OH : rot -6:sc= 1.2 USER MOD Single : A 77 SER OG : rot -174:sc= 1.32 USER MOD Single : A 78 TYR OH : rot 30:sc= 0.103 USER MOD Single : A 82 ASN : amide:sc= 1 K(o=1,f=-0.066) USER MOD Single : A 85 SER OG : rot 53:sc= 0.64 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= 0.892 K(o=0.89,f=-7.1!) USER MOD Single : A 97 SER OG : rot 112:sc= 0.71 USER MOD Single : A 103 TYR OH : rot -172:sc= 1.28 USER MOD Single : A 112 THR OG1 : rot -28:sc= 0.738 USER MOD Single : A 114 GLN : amide:sc= 2.09 K(o=2.1,f=-0.2) USER MOD Single : A 115 SER OG : rot 119:sc= 0.215 USER MOD Single : A 118 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 121 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ -130:sc= -0.0541 (180deg=-0.344) USER MOD Single : A 124 ASN : amide:sc= 0.0545 X(o=0.055,f=0) USER MOD Single : A 126 THR OG1 : rot 130:sc= 0.00498 USER MOD Single : A 132 THR OG1 : rot -63:sc= 1.32 USER MOD Single : A 137 ASN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 138 ASN : amide:sc= -0.288 K(o=-0.29,f=-2!) USER MOD Single : A 139 THR OG1 : rot 180:sc=-0.00227 USER MOD Single : A 142 SER OG : rot 153:sc= 1.09 USER MOD Single : A 149 LYS NZ :NH3+ 160:sc= -0.215 (180deg=-0.81) USER MOD Single : A 153 TYR OH : rot 174:sc= 2.66 USER MOD Single : A 154 THR OG1 : rot -9:sc= 0.719 USER MOD Single : A 156 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 TYR OH : rot 180:sc= 0.307 USER MOD Single : A 159 LYS NZ :NH3+ -133:sc= 0.781 (180deg=-0.16) USER MOD Single : A 160 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 30:sc= 0.02 USER MOD Single : A 165 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 167 THR OG1 : rot 180:sc= 0 USER MOD Single : A 169 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 171 ASN : amide:sc= 1.18 K(o=1.2,f=-1) USER MOD Single : A 173 ASN : amide:sc= 0.891 K(o=0.89,f=-0.49) USER MOD Single : A 181 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 184 ASN : amide:sc= -2.2! K(o=-2.2!,f=-0.33) USER MOD Single : A 185 TYR OH : rot 170:sc= -0.209 USER MOD Single : A 188 SER OG B: rot 180:sc= -0.334 USER MOD Single : A 190 GLN : amide:sc= 0.239 K(o=0.24,f=-0.35) USER MOD Single : A 195 SER OG : rot -83:sc= 1.85 USER MOD Single : A 197 THR OG1 : rot 180:sc= 0 USER MOD Single : A 199 ASN A: amide:sc= -2.03! K(o=-2!,f=-0.17) USER MOD Single : A 201 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 202 SER OG : rot 84:sc= 1.08 USER MOD Single : A 210 MET CE A:methyl -137:sc= -0.366 (180deg=-0.747) USER MOD Single : A 210 MET CE B:methyl -142:sc= -9.77! (180deg=-12!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 33.517 33.601 70.074 1.00 48.31 N ATOM 2 CA SER A 1 34.404 32.870 69.128 1.00 48.08 C ATOM 3 C SER A 1 34.425 33.596 67.813 1.00 48.55 C ATOM 4 O SER A 1 33.467 33.610 67.029 1.00 49.79 O ATOM 5 CB SER A 1 33.977 31.436 68.993 1.00 46.21 C ATOM 6 OG SER A 1 34.205 30.777 70.224 1.00 44.87 O ATOM 0 H1 SER A 1 33.959 33.766 70.828 1.00 48.31 H new ATOM 0 H2 SER A 1 33.260 34.370 69.707 1.00 48.31 H new ATOM 0 H3 SER A 1 32.801 33.104 70.253 1.00 48.31 H new ATOM 0 HA SER A 1 35.310 32.849 69.473 1.00 48.08 H new ATOM 0 HB2 SER A 1 33.038 31.386 68.754 1.00 46.21 H new ATOM 0 HB3 SER A 1 34.475 31.002 68.282 1.00 46.21 H new ATOM 0 HG SER A 1 33.968 29.974 70.160 1.00 44.87 H new ATOM 7 N GLY A 2 35.532 34.261 67.609 1.00 47.20 N ATOM 8 CA GLY A 2 35.640 35.104 66.476 1.00 45.26 C ATOM 9 C GLY A 2 35.327 36.488 66.986 1.00 44.80 C ATOM 10 O GLY A 2 34.198 36.960 66.795 1.00 45.02 O ATOM 0 H GLY A 2 36.226 34.234 68.117 1.00 47.20 H new ATOM 0 HA2 GLY A 2 36.530 35.064 66.093 1.00 45.26 H new ATOM 0 HA3 GLY A 2 35.019 34.838 65.780 1.00 45.26 H new ATOM 11 N THR A 3 36.220 37.002 67.834 1.00 42.93 N ATOM 12 CA THR A 3 36.052 38.350 68.320 1.00 39.25 C ATOM 13 C THR A 3 34.879 38.834 69.184 1.00 34.77 C ATOM 14 O THR A 3 33.861 38.193 69.387 1.00 33.07 O ATOM 15 CB THR A 3 36.117 39.275 67.068 1.00 41.51 C ATOM 16 OG1 THR A 3 34.787 39.535 66.575 1.00 42.58 O ATOM 17 CG2 THR A 3 36.962 38.689 65.929 1.00 39.80 C ATOM 0 H THR A 3 36.914 36.588 68.129 1.00 42.93 H new ATOM 0 HA THR A 3 36.754 38.379 68.989 1.00 39.25 H new ATOM 0 HB THR A 3 36.544 40.096 67.358 1.00 41.51 H new ATOM 0 HG1 THR A 3 34.354 38.816 66.545 1.00 42.58 H new ATOM 0 HG21 THR A 3 36.967 39.305 65.180 1.00 39.80 H new ATOM 0 HG22 THR A 3 37.871 38.550 66.238 1.00 39.80 H new ATOM 0 HG23 THR A 3 36.583 37.841 65.648 1.00 39.80 H new ATOM 18 N THR A 4 35.036 39.998 69.748 1.00 31.05 N ATOM 19 CA THR A 4 34.024 40.674 70.528 1.00 29.75 C ATOM 20 C THR A 4 33.504 41.892 69.749 1.00 29.66 C ATOM 21 O THR A 4 32.393 42.353 70.001 1.00 32.33 O ATOM 22 CB THR A 4 34.594 41.238 71.863 1.00 30.07 C ATOM 23 OG1 THR A 4 35.741 42.063 71.594 1.00 32.14 O ATOM 24 CG2 THR A 4 35.058 40.117 72.806 1.00 30.28 C ATOM 0 H THR A 4 35.769 40.444 69.688 1.00 31.05 H new ATOM 0 HA THR A 4 33.331 40.020 70.708 1.00 29.75 H new ATOM 0 HB THR A 4 33.880 41.743 72.282 1.00 30.07 H new ATOM 0 HG1 THR A 4 36.438 41.597 71.639 1.00 32.14 H new ATOM 0 HG21 THR A 4 35.406 40.505 73.624 1.00 30.28 H new ATOM 0 HG22 THR A 4 34.308 39.539 73.016 1.00 30.28 H new ATOM 0 HG23 THR A 4 35.754 39.598 72.374 1.00 30.28 H new ATOM 25 N ASN A 5 34.333 42.384 68.827 1.00 27.23 N ATOM 26 CA ASN A 5 34.011 43.573 68.041 1.00 28.67 C ATOM 27 C ASN A 5 33.377 43.362 66.677 1.00 27.98 C ATOM 28 O ASN A 5 32.654 44.225 66.188 1.00 28.57 O ATOM 29 CB ASN A 5 35.300 44.320 67.730 1.00 32.01 C ATOM 30 CG ASN A 5 35.840 45.078 68.891 1.00 35.08 C ATOM 31 OD1 ASN A 5 35.179 45.981 69.429 1.00 38.72 O ATOM 32 ND2 ASN A 5 37.086 44.784 69.249 1.00 33.66 N ATOM 0 H ASN A 5 35.097 42.037 68.641 1.00 27.23 H new ATOM 0 HA ASN A 5 33.366 44.032 68.602 1.00 28.67 H new ATOM 0 HB2 ASN A 5 35.968 43.685 67.428 1.00 32.01 H new ATOM 0 HB3 ASN A 5 35.141 44.935 66.997 1.00 32.01 H new ATOM 0 HD21 ASN A 5 37.468 45.227 69.879 1.00 33.66 H new ATOM 0 HD22 ASN A 5 37.510 44.150 68.851 1.00 33.66 H new ATOM 33 N THR A 6 33.802 42.309 65.994 1.00 27.77 N ATOM 34 CA THR A 6 33.364 42.082 64.636 1.00 27.12 C ATOM 35 C THR A 6 32.320 41.011 64.401 1.00 27.98 C ATOM 36 O THR A 6 32.209 40.037 65.150 1.00 25.56 O ATOM 37 CB THR A 6 34.582 41.836 63.718 1.00 25.07 C ATOM 38 OG1 THR A 6 35.242 40.626 64.111 1.00 24.70 O ATOM 39 CG2 THR A 6 35.573 43.006 63.810 1.00 23.47 C ATOM 0 H THR A 6 34.344 41.717 66.302 1.00 27.77 H new ATOM 0 HA THR A 6 32.898 42.904 64.415 1.00 27.12 H new ATOM 0 HB THR A 6 34.269 41.760 62.803 1.00 25.07 H new ATOM 0 HG1 THR A 6 34.963 40.387 64.866 1.00 24.70 H new ATOM 0 HG21 THR A 6 36.330 42.835 63.228 1.00 23.47 H new ATOM 0 HG22 THR A 6 35.133 43.826 63.535 1.00 23.47 H new ATOM 0 HG23 THR A 6 35.882 43.097 64.725 1.00 23.47 H new ATOM 40 N VAL A 7 31.584 41.215 63.304 1.00 28.48 N ATOM 41 CA VAL A 7 30.510 40.329 62.841 1.00 28.23 C ATOM 42 C VAL A 7 30.833 39.935 61.414 1.00 23.78 C ATOM 43 O VAL A 7 31.080 40.810 60.586 1.00 22.33 O ATOM 44 CB VAL A 7 29.130 41.065 62.785 1.00 28.53 C ATOM 45 CG1 VAL A 7 28.043 40.108 62.251 1.00 29.42 C ATOM 46 CG2 VAL A 7 28.754 41.603 64.162 1.00 31.50 C ATOM 0 H VAL A 7 31.701 41.896 62.792 1.00 28.48 H new ATOM 0 HA VAL A 7 30.452 39.578 63.452 1.00 28.23 H new ATOM 0 HB VAL A 7 29.200 41.819 62.179 1.00 28.53 H new ATOM 0 HG11 VAL A 7 27.191 40.571 62.219 1.00 29.42 H new ATOM 0 HG12 VAL A 7 28.283 39.811 61.359 1.00 29.42 H new ATOM 0 HG13 VAL A 7 27.971 39.340 62.839 1.00 29.42 H new ATOM 0 HG21 VAL A 7 27.898 42.056 64.110 1.00 31.50 H new ATOM 0 HG22 VAL A 7 28.693 40.867 64.791 1.00 31.50 H new ATOM 0 HG23 VAL A 7 29.432 42.229 64.461 1.00 31.50 H new ATOM 47 N ALA A 8 30.792 38.639 61.126 1.00 22.09 N ATOM 48 CA ALA A 8 31.063 38.146 59.785 1.00 22.86 C ATOM 49 C ALA A 8 29.952 38.591 58.811 1.00 22.51 C ATOM 50 O ALA A 8 28.770 38.644 59.169 1.00 21.91 O ATOM 51 CB ALA A 8 31.207 36.627 59.788 1.00 22.23 C ATOM 0 H ALA A 8 30.607 38.025 61.700 1.00 22.09 H new ATOM 0 HA ALA A 8 31.902 38.527 59.482 1.00 22.86 H new ATOM 0 HB1 ALA A 8 31.387 36.317 58.887 1.00 22.23 H new ATOM 0 HB2 ALA A 8 31.940 36.372 60.370 1.00 22.23 H new ATOM 0 HB3 ALA A 8 30.385 36.224 60.110 1.00 22.23 H new ATOM 52 N ALA A 9 30.351 38.990 57.608 1.00 21.07 N ATOM 53 CA ALA A 9 29.377 39.413 56.611 1.00 20.56 C ATOM 54 C ALA A 9 28.540 38.205 56.180 1.00 20.58 C ATOM 55 O ALA A 9 28.999 37.044 56.245 1.00 19.56 O ATOM 56 CB ALA A 9 30.090 40.019 55.391 1.00 19.36 C ATOM 0 H ALA A 9 31.171 39.023 57.352 1.00 21.07 H new ATOM 0 HA ALA A 9 28.798 40.089 56.997 1.00 20.56 H new ATOM 0 HB1 ALA A 9 29.431 40.296 54.735 1.00 19.36 H new ATOM 0 HB2 ALA A 9 30.612 40.788 55.670 1.00 19.36 H new ATOM 0 HB3 ALA A 9 30.678 39.356 54.997 1.00 19.36 H new ATOM 57 N TYR A 10 27.317 38.477 55.738 1.00 18.83 N ATOM 58 CA TYR A 10 26.456 37.412 55.261 1.00 20.26 C ATOM 59 C TYR A 10 25.549 37.888 54.097 1.00 20.19 C ATOM 60 O TYR A 10 25.473 39.092 53.787 1.00 19.61 O ATOM 61 CB TYR A 10 25.654 36.803 56.428 1.00 21.25 C ATOM 62 CG TYR A 10 24.736 37.773 57.132 1.00 21.06 C ATOM 63 CD1 TYR A 10 25.234 38.678 58.076 1.00 20.13 C ATOM 64 CD2 TYR A 10 23.378 37.798 56.852 1.00 20.11 C ATOM 65 CE1 TYR A 10 24.403 39.575 58.713 1.00 18.15 C ATOM 66 CE2 TYR A 10 22.540 38.695 57.491 1.00 22.83 C ATOM 67 CZ TYR A 10 23.064 39.577 58.420 1.00 21.09 C ATOM 68 OH TYR A 10 22.231 40.449 59.055 1.00 22.03 O ATOM 0 H TYR A 10 26.973 39.264 55.707 1.00 18.83 H new ATOM 0 HA TYR A 10 27.014 36.707 54.895 1.00 20.26 H new ATOM 0 HB2 TYR A 10 25.126 36.063 56.091 1.00 21.25 H new ATOM 0 HB3 TYR A 10 26.276 36.436 57.076 1.00 21.25 H new ATOM 0 HD1 TYR A 10 26.142 38.674 58.277 1.00 20.13 H new ATOM 0 HD2 TYR A 10 23.026 37.205 56.228 1.00 20.11 H new ATOM 0 HE1 TYR A 10 24.748 40.173 59.336 1.00 18.15 H new ATOM 0 HE2 TYR A 10 21.630 38.705 57.297 1.00 22.83 H new ATOM 0 HH TYR A 10 22.569 40.675 59.790 1.00 22.03 H new ATOM 69 N ASN A 11 24.875 36.928 53.459 1.00 21.12 N ATOM 70 CA ASN A 11 23.973 37.187 52.323 1.00 21.15 C ATOM 71 C ASN A 11 24.728 37.823 51.162 1.00 19.65 C ATOM 72 O ASN A 11 24.244 38.780 50.556 1.00 19.02 O ATOM 73 CB ASN A 11 22.776 38.067 52.720 1.00 22.42 C ATOM 74 CG ASN A 11 21.770 37.336 53.602 1.00 26.63 C ATOM 75 OD1 ASN A 11 21.878 36.132 53.833 1.00 27.22 O ATOM 76 ND2 ASN A 11 20.806 38.078 54.134 1.00 29.60 N ATOM 0 H ASN A 11 24.927 36.097 53.674 1.00 21.12 H new ATOM 0 HA ASN A 11 23.625 36.327 52.040 1.00 21.15 H new ATOM 0 HB2 ASN A 11 23.099 38.853 53.188 1.00 22.42 H new ATOM 0 HB3 ASN A 11 22.329 38.379 51.917 1.00 22.42 H new ATOM 0 HD21 ASN A 11 20.229 37.719 54.661 1.00 29.60 H new ATOM 0 HD22 ASN A 11 20.759 38.917 53.952 1.00 29.60 H new ATOM 77 N LEU A 12 25.942 37.327 50.908 1.00 19.30 N ATOM 78 CA LEU A 12 26.778 37.819 49.803 1.00 19.82 C ATOM 79 C LEU A 12 26.041 37.532 48.485 1.00 20.63 C ATOM 80 O LEU A 12 25.744 36.387 48.157 1.00 21.49 O ATOM 81 CB LEU A 12 28.179 37.185 49.823 1.00 17.44 C ATOM 82 CG LEU A 12 29.161 37.729 50.888 1.00 17.70 C ATOM 83 CD1 LEU A 12 28.756 37.313 52.316 1.00 16.88 C ATOM 84 CD2 LEU A 12 30.590 37.256 50.591 1.00 17.23 C ATOM 0 H LEU A 12 26.305 36.698 51.369 1.00 19.30 H new ATOM 0 HA LEU A 12 26.918 38.774 49.898 1.00 19.82 H new ATOM 0 HB2 LEU A 12 28.079 36.230 49.960 1.00 17.44 H new ATOM 0 HB3 LEU A 12 28.581 37.306 48.948 1.00 17.44 H new ATOM 0 HG LEU A 12 29.126 38.697 50.842 1.00 17.70 H new ATOM 0 HD11 LEU A 12 29.395 37.673 52.951 1.00 16.88 H new ATOM 0 HD12 LEU A 12 27.872 37.659 52.516 1.00 16.88 H new ATOM 0 HD13 LEU A 12 28.746 36.345 52.381 1.00 16.88 H new ATOM 0 HD21 LEU A 12 31.193 37.604 51.266 1.00 17.23 H new ATOM 0 HD22 LEU A 12 30.619 36.286 50.602 1.00 17.23 H new ATOM 0 HD23 LEU A 12 30.863 37.578 49.717 1.00 17.23 H new ATOM 85 N THR A 13 25.781 38.593 47.728 1.00 21.70 N ATOM 86 CA THR A 13 25.002 38.499 46.492 1.00 23.27 C ATOM 87 C THR A 13 25.606 39.292 45.338 1.00 21.96 C ATOM 88 O THR A 13 25.969 40.472 45.498 1.00 20.93 O ATOM 89 CB THR A 13 23.562 39.061 46.746 1.00 24.77 C ATOM 90 OG1 THR A 13 22.947 38.319 47.803 1.00 27.98 O ATOM 91 CG2 THR A 13 22.689 38.979 45.513 1.00 26.15 C ATOM 0 H THR A 13 26.050 39.388 47.914 1.00 21.70 H new ATOM 0 HA THR A 13 24.993 37.561 46.244 1.00 23.27 H new ATOM 0 HB THR A 13 23.650 39.997 46.985 1.00 24.77 H new ATOM 0 HG1 THR A 13 23.341 38.482 48.527 1.00 27.98 H new ATOM 0 HG21 THR A 13 21.810 39.336 45.714 1.00 26.15 H new ATOM 0 HG22 THR A 13 23.091 39.495 44.797 1.00 26.15 H new ATOM 0 HG23 THR A 13 22.606 38.053 45.236 1.00 26.15 H new ATOM 92 N TRP A 14 25.659 38.649 44.170 1.00 20.52 N ATOM 93 CA TRP A 14 26.161 39.284 42.956 1.00 19.71 C ATOM 94 C TRP A 14 25.017 39.949 42.201 1.00 18.71 C ATOM 95 O TRP A 14 23.998 39.318 41.948 1.00 19.85 O ATOM 96 CB TRP A 14 26.780 38.249 42.031 1.00 18.92 C ATOM 97 CG TRP A 14 27.998 37.609 42.558 1.00 18.13 C ATOM 98 CD1 TRP A 14 28.090 36.375 43.147 1.00 18.15 C ATOM 99 CD2 TRP A 14 29.330 38.114 42.458 1.00 17.27 C ATOM 100 NE1 TRP A 14 29.411 36.078 43.409 1.00 18.87 N ATOM 101 CE2 TRP A 14 30.194 37.123 42.995 1.00 17.32 C ATOM 102 CE3 TRP A 14 29.883 39.293 41.951 1.00 17.79 C ATOM 103 CZ2 TRP A 14 31.582 37.276 43.032 1.00 18.63 C ATOM 104 CZ3 TRP A 14 31.266 39.446 41.982 1.00 20.54 C ATOM 105 CH2 TRP A 14 32.103 38.437 42.521 1.00 19.95 C ATOM 0 H TRP A 14 25.405 37.834 44.062 1.00 20.52 H new ATOM 0 HA TRP A 14 26.825 39.940 43.219 1.00 19.71 H new ATOM 0 HB2 TRP A 14 26.121 37.561 41.847 1.00 18.92 H new ATOM 0 HB3 TRP A 14 26.992 38.673 41.185 1.00 18.92 H new ATOM 0 HD1 TRP A 14 27.369 35.821 43.341 1.00 18.15 H new ATOM 0 HE1 TRP A 14 29.697 35.354 43.774 1.00 18.87 H new ATOM 0 HE3 TRP A 14 29.339 39.961 41.601 1.00 17.79 H new ATOM 0 HZ2 TRP A 14 32.131 36.616 43.389 1.00 18.63 H new ATOM 0 HZ3 TRP A 14 31.648 40.224 41.643 1.00 20.54 H new ATOM 0 HH2 TRP A 14 33.024 38.565 42.528 1.00 19.95 H new ATOM 106 N LYS A 15 25.161 41.236 41.910 1.00 18.16 N ATOM 107 CA LYS A 15 24.179 41.988 41.133 1.00 18.24 C ATOM 108 C LYS A 15 24.936 42.336 39.834 1.00 19.13 C ATOM 109 O LYS A 15 25.949 43.052 39.863 1.00 20.25 O ATOM 110 CB LYS A 15 23.781 43.243 41.880 1.00 21.01 C ATOM 111 CG LYS A 15 23.137 42.964 43.219 1.00 26.76 C ATOM 112 CD LYS A 15 21.908 42.105 43.051 1.00 30.59 C ATOM 113 CE LYS A 15 20.892 42.385 44.142 1.00 35.85 C ATOM 114 NZ LYS A 15 19.532 41.852 43.755 1.00 40.46 N ATOM 0 H LYS A 15 25.838 41.704 42.160 1.00 18.16 H new ATOM 0 HA LYS A 15 23.360 41.497 40.966 1.00 18.24 H new ATOM 0 HB2 LYS A 15 24.568 43.794 42.015 1.00 21.01 H new ATOM 0 HB3 LYS A 15 23.166 43.756 41.333 1.00 21.01 H new ATOM 0 HG2 LYS A 15 23.772 42.518 43.802 1.00 26.76 H new ATOM 0 HG3 LYS A 15 22.897 43.800 43.648 1.00 26.76 H new ATOM 0 HD2 LYS A 15 21.509 42.273 42.183 1.00 30.59 H new ATOM 0 HD3 LYS A 15 22.159 41.168 43.072 1.00 30.59 H new ATOM 0 HE2 LYS A 15 21.181 41.975 44.972 1.00 35.85 H new ATOM 0 HE3 LYS A 15 20.837 43.340 44.301 1.00 35.85 H new ATOM 0 HZ1 LYS A 15 18.949 42.025 44.405 1.00 40.46 H new ATOM 0 HZ2 LYS A 15 19.262 42.244 43.003 1.00 40.46 H new ATOM 0 HZ3 LYS A 15 19.583 40.973 43.628 1.00 40.46 H new ATOM 115 N SER A 16 24.463 41.836 38.696 1.00 17.26 N ATOM 116 CA SER A 16 25.180 42.068 37.449 1.00 15.73 C ATOM 117 C SER A 16 24.275 42.184 36.235 1.00 14.97 C ATOM 118 O SER A 16 23.430 41.343 36.015 1.00 14.42 O ATOM 119 CB SER A 16 26.202 40.934 37.259 1.00 13.81 C ATOM 120 OG SER A 16 26.995 41.073 36.094 1.00 16.19 O ATOM 0 H SER A 16 23.744 41.370 38.625 1.00 17.26 H new ATOM 0 HA SER A 16 25.624 42.928 37.519 1.00 15.73 H new ATOM 0 HB2 SER A 16 26.784 40.900 38.035 1.00 13.81 H new ATOM 0 HB3 SER A 16 25.730 40.087 37.221 1.00 13.81 H new ATOM 0 HG SER A 16 27.741 41.399 36.300 1.00 16.19 H new ATOM 121 N THR A 17 24.476 43.251 35.458 1.00 16.10 N ATOM 122 CA THR A 17 23.702 43.497 34.231 1.00 16.69 C ATOM 123 C THR A 17 24.634 44.085 33.170 1.00 16.49 C ATOM 124 O THR A 17 25.321 45.060 33.434 1.00 16.28 O ATOM 125 CB THR A 17 22.541 44.481 34.465 1.00 19.06 C ATOM 126 OG1 THR A 17 21.637 43.935 35.440 1.00 20.66 O ATOM 127 CG2 THR A 17 21.784 44.725 33.142 1.00 20.77 C ATOM 0 H THR A 17 25.065 43.855 35.626 1.00 16.10 H new ATOM 0 HA THR A 17 23.325 42.651 33.942 1.00 16.69 H new ATOM 0 HB THR A 17 22.898 45.323 34.788 1.00 19.06 H new ATOM 0 HG1 THR A 17 21.005 44.473 35.568 1.00 20.66 H new ATOM 0 HG21 THR A 17 21.054 45.345 33.296 1.00 20.77 H new ATOM 0 HG22 THR A 17 22.392 45.099 32.485 1.00 20.77 H new ATOM 0 HG23 THR A 17 21.429 43.885 32.812 1.00 20.77 H new ATOM 128 N ASN A 18 24.636 43.489 31.976 1.00 16.26 N ATOM 129 CA ASN A 18 25.495 43.928 30.884 1.00 16.44 C ATOM 130 C ASN A 18 26.951 44.095 31.337 1.00 18.17 C ATOM 131 O ASN A 18 27.672 45.005 30.886 1.00 18.43 O ATOM 132 CB ASN A 18 24.955 45.204 30.241 1.00 16.52 C ATOM 133 CG ASN A 18 23.678 44.944 29.425 1.00 18.47 C ATOM 134 OD1 ASN A 18 23.194 43.817 29.345 1.00 17.79 O ATOM 135 ND2 ASN A 18 23.160 45.980 28.795 1.00 22.10 N ATOM 0 H ASN A 18 24.136 42.817 31.780 1.00 16.26 H new ATOM 0 HA ASN A 18 25.488 43.232 30.209 1.00 16.44 H new ATOM 0 HB2 ASN A 18 24.768 45.859 30.932 1.00 16.52 H new ATOM 0 HB3 ASN A 18 25.634 45.586 29.664 1.00 16.52 H new ATOM 0 HD21 ASN A 18 22.459 45.880 28.307 1.00 22.10 H new ATOM 0 HD22 ASN A 18 23.523 46.756 28.872 1.00 22.10 H new ATOM 136 N PHE A 19 27.363 43.153 32.194 1.00 17.28 N ATOM 137 CA PHE A 19 28.692 43.057 32.801 1.00 16.05 C ATOM 138 C PHE A 19 29.014 44.046 33.909 1.00 16.19 C ATOM 139 O PHE A 19 30.051 43.903 34.530 1.00 16.66 O ATOM 140 CB PHE A 19 29.787 43.014 31.746 1.00 14.82 C ATOM 141 CG PHE A 19 29.688 41.827 30.856 1.00 15.04 C ATOM 142 CD1 PHE A 19 30.187 40.600 31.261 1.00 15.41 C ATOM 143 CD2 PHE A 19 29.019 41.911 29.641 1.00 16.00 C ATOM 144 CE1 PHE A 19 30.027 39.455 30.467 1.00 16.17 C ATOM 145 CE2 PHE A 19 28.855 40.787 28.839 1.00 17.35 C ATOM 146 CZ PHE A 19 29.357 39.544 29.260 1.00 17.67 C ATOM 0 H PHE A 19 26.842 42.518 32.449 1.00 17.28 H new ATOM 0 HA PHE A 19 28.662 42.208 33.269 1.00 16.05 H new ATOM 0 HB2 PHE A 19 29.743 43.820 31.208 1.00 14.82 H new ATOM 0 HB3 PHE A 19 30.652 43.012 32.185 1.00 14.82 H new ATOM 0 HD1 PHE A 19 30.636 40.534 32.073 1.00 15.41 H new ATOM 0 HD2 PHE A 19 28.677 42.729 29.361 1.00 16.00 H new ATOM 0 HE1 PHE A 19 30.370 38.639 30.751 1.00 16.17 H new ATOM 0 HE2 PHE A 19 28.413 40.858 28.024 1.00 17.35 H new ATOM 0 HZ PHE A 19 29.240 38.788 28.732 1.00 17.67 H new ATOM 147 N LYS A 20 28.162 45.042 34.167 1.00 15.41 N ATOM 148 CA LYS A 20 28.450 45.950 35.276 1.00 17.83 C ATOM 149 C LYS A 20 28.073 45.092 36.483 1.00 17.95 C ATOM 150 O LYS A 20 26.902 44.691 36.651 1.00 18.53 O ATOM 151 CB LYS A 20 27.649 47.226 35.209 1.00 19.86 C ATOM 152 CG LYS A 20 28.048 48.200 36.302 1.00 24.07 C ATOM 153 CD LYS A 20 27.397 49.543 36.063 1.00 30.84 C ATOM 154 CE LYS A 20 27.732 50.550 37.147 1.00 35.42 C ATOM 155 NZ LYS A 20 26.848 51.773 37.027 1.00 38.71 N ATOM 0 H LYS A 20 27.439 45.204 33.730 1.00 15.41 H new ATOM 0 HA LYS A 20 29.367 46.266 35.288 1.00 17.83 H new ATOM 0 HB2 LYS A 20 27.776 47.643 34.342 1.00 19.86 H new ATOM 0 HB3 LYS A 20 26.705 47.020 35.289 1.00 19.86 H new ATOM 0 HG2 LYS A 20 27.782 47.853 37.168 1.00 24.07 H new ATOM 0 HG3 LYS A 20 29.013 48.299 36.321 1.00 24.07 H new ATOM 0 HD2 LYS A 20 27.683 49.890 35.203 1.00 30.84 H new ATOM 0 HD3 LYS A 20 26.435 49.429 36.017 1.00 30.84 H new ATOM 0 HE2 LYS A 20 27.615 50.144 38.020 1.00 35.42 H new ATOM 0 HE3 LYS A 20 28.664 50.810 37.078 1.00 35.42 H new ATOM 0 HZ1 LYS A 20 27.056 52.354 37.668 1.00 38.71 H new ATOM 0 HZ2 LYS A 20 26.973 52.153 36.232 1.00 38.71 H new ATOM 0 HZ3 LYS A 20 25.995 51.532 37.110 1.00 38.71 H new ATOM 156 N THR A 21 29.072 44.843 37.328 1.00 17.19 N ATOM 157 CA THR A 21 28.946 43.904 38.438 1.00 16.40 C ATOM 158 C THR A 21 29.293 44.432 39.831 1.00 16.62 C ATOM 159 O THR A 21 30.406 44.897 40.090 1.00 16.45 O ATOM 160 CB THR A 21 29.853 42.672 38.120 1.00 17.16 C ATOM 161 OG1 THR A 21 29.580 42.193 36.780 1.00 15.09 O ATOM 162 CG2 THR A 21 29.689 41.552 39.176 1.00 15.96 C ATOM 0 H THR A 21 29.845 45.216 37.272 1.00 17.19 H new ATOM 0 HA THR A 21 28.001 43.692 38.494 1.00 16.40 H new ATOM 0 HB THR A 21 30.780 42.954 38.161 1.00 17.16 H new ATOM 0 HG1 THR A 21 29.887 42.738 36.219 1.00 15.09 H new ATOM 0 HG21 THR A 21 30.265 40.805 38.948 1.00 15.96 H new ATOM 0 HG22 THR A 21 29.934 41.893 40.050 1.00 15.96 H new ATOM 0 HG23 THR A 21 28.766 41.255 39.192 1.00 15.96 H new ATOM 163 N ILE A 22 28.345 44.252 40.735 1.00 18.13 N ATOM 164 CA ILE A 22 28.455 44.710 42.124 1.00 19.27 C ATOM 165 C ILE A 22 28.164 43.571 43.101 1.00 18.45 C ATOM 166 O ILE A 22 27.218 42.786 42.915 1.00 18.46 O ATOM 167 CB ILE A 22 27.411 45.855 42.373 1.00 20.91 C ATOM 168 CG1 ILE A 22 27.771 47.077 41.523 1.00 23.27 C ATOM 169 CG2 ILE A 22 27.274 46.190 43.841 1.00 21.33 C ATOM 170 CD1 ILE A 22 26.784 48.213 41.662 1.00 28.18 C ATOM 0 H ILE A 22 27.603 43.853 40.562 1.00 18.13 H new ATOM 0 HA ILE A 22 29.360 45.029 42.269 1.00 19.27 H new ATOM 0 HB ILE A 22 26.536 45.542 42.095 1.00 20.91 H new ATOM 0 HG12 ILE A 22 28.653 47.391 41.776 1.00 23.27 H new ATOM 0 HG13 ILE A 22 27.820 46.812 40.591 1.00 23.27 H new ATOM 0 HG21 ILE A 22 26.622 46.899 43.952 1.00 21.33 H new ATOM 0 HG22 ILE A 22 26.981 45.403 44.327 1.00 21.33 H new ATOM 0 HG23 ILE A 22 28.131 46.483 44.188 1.00 21.33 H new ATOM 0 HD11 ILE A 22 27.063 48.955 41.103 1.00 28.18 H new ATOM 0 HD12 ILE A 22 25.904 47.913 41.385 1.00 28.18 H new ATOM 0 HD13 ILE A 22 26.750 48.501 42.588 1.00 28.18 H new ATOM 171 N LEU A 23 29.020 43.440 44.107 1.00 17.96 N ATOM 172 CA LEU A 23 28.790 42.444 45.153 1.00 17.09 C ATOM 173 C LEU A 23 28.099 43.195 46.315 1.00 17.88 C ATOM 174 O LEU A 23 28.474 44.319 46.633 1.00 18.18 O ATOM 175 CB LEU A 23 30.116 41.844 45.635 1.00 15.53 C ATOM 176 CG LEU A 23 29.910 40.875 46.788 1.00 15.57 C ATOM 177 CD1 LEU A 23 29.418 39.530 46.209 1.00 18.34 C ATOM 178 CD2 LEU A 23 31.182 40.697 47.580 1.00 14.97 C ATOM 0 H LEU A 23 29.733 43.911 44.205 1.00 17.96 H new ATOM 0 HA LEU A 23 28.247 41.712 44.822 1.00 17.09 H new ATOM 0 HB2 LEU A 23 30.549 41.384 44.899 1.00 15.53 H new ATOM 0 HB3 LEU A 23 30.711 42.557 45.914 1.00 15.53 H new ATOM 0 HG LEU A 23 29.246 41.228 47.400 1.00 15.57 H new ATOM 0 HD11 LEU A 23 29.281 38.897 46.931 1.00 18.34 H new ATOM 0 HD12 LEU A 23 28.582 39.667 45.737 1.00 18.34 H new ATOM 0 HD13 LEU A 23 30.082 39.180 45.595 1.00 18.34 H new ATOM 0 HD21 LEU A 23 31.026 40.076 48.308 1.00 14.97 H new ATOM 0 HD22 LEU A 23 31.878 40.348 47.001 1.00 14.97 H new ATOM 0 HD23 LEU A 23 31.462 41.553 47.940 1.00 14.97 H new ATOM 179 N GLU A 24 27.051 42.617 46.882 1.00 18.51 N ATOM 180 CA GLU A 24 26.368 43.230 48.018 1.00 20.22 C ATOM 181 C GLU A 24 26.370 42.213 49.170 1.00 20.66 C ATOM 182 O GLU A 24 26.505 41.004 48.943 1.00 19.40 O ATOM 183 CB GLU A 24 24.932 43.596 47.666 1.00 22.43 C ATOM 184 CG GLU A 24 24.813 44.595 46.523 1.00 28.91 C ATOM 185 CD GLU A 24 23.364 45.005 46.223 1.00 33.27 C ATOM 186 OE1 GLU A 24 22.429 44.291 46.664 1.00 35.91 O ATOM 187 OE2 GLU A 24 23.165 46.041 45.539 1.00 33.87 O ATOM 0 H GLU A 24 26.716 41.867 46.626 1.00 18.51 H new ATOM 0 HA GLU A 24 26.828 44.046 48.270 1.00 20.22 H new ATOM 0 HB2 GLU A 24 24.450 42.788 47.429 1.00 22.43 H new ATOM 0 HB3 GLU A 24 24.499 43.964 48.452 1.00 22.43 H new ATOM 0 HG2 GLU A 24 25.329 45.388 46.740 1.00 28.91 H new ATOM 0 HG3 GLU A 24 25.206 44.211 45.724 1.00 28.91 H new ATOM 188 N TRP A 25 26.315 42.720 50.405 1.00 21.12 N ATOM 189 CA TRP A 25 26.288 41.869 51.609 1.00 20.23 C ATOM 190 C TRP A 25 25.674 42.623 52.791 1.00 21.41 C ATOM 191 O TRP A 25 25.341 43.822 52.713 1.00 20.14 O ATOM 192 CB TRP A 25 27.694 41.381 51.999 1.00 18.17 C ATOM 193 CG TRP A 25 28.643 42.512 52.395 1.00 19.00 C ATOM 194 CD1 TRP A 25 28.864 42.994 53.657 1.00 18.89 C ATOM 195 CD2 TRP A 25 29.434 43.329 51.510 1.00 16.76 C ATOM 196 NE1 TRP A 25 29.728 44.066 53.613 1.00 17.39 N ATOM 197 CE2 TRP A 25 30.097 44.291 52.311 1.00 17.24 C ATOM 198 CE3 TRP A 25 29.642 43.350 50.124 1.00 15.80 C ATOM 199 CZ2 TRP A 25 30.952 45.255 51.766 1.00 16.01 C ATOM 200 CZ3 TRP A 25 30.487 44.308 49.588 1.00 16.13 C ATOM 201 CH2 TRP A 25 31.131 45.249 50.408 1.00 16.04 C ATOM 0 H TRP A 25 26.292 43.563 50.572 1.00 21.12 H new ATOM 0 HA TRP A 25 25.743 41.096 51.394 1.00 20.23 H new ATOM 0 HB2 TRP A 25 27.619 40.758 52.738 1.00 18.17 H new ATOM 0 HB3 TRP A 25 28.077 40.892 51.254 1.00 18.17 H new ATOM 0 HD1 TRP A 25 28.485 42.648 54.433 1.00 18.89 H new ATOM 0 HE1 TRP A 25 29.993 44.521 54.293 1.00 17.39 H new ATOM 0 HE3 TRP A 25 29.220 42.731 49.573 1.00 15.80 H new ATOM 0 HZ2 TRP A 25 31.383 45.877 52.306 1.00 16.01 H new ATOM 0 HZ3 TRP A 25 30.630 44.328 48.669 1.00 16.13 H new ATOM 0 HH2 TRP A 25 31.691 45.882 50.020 1.00 16.04 H new ATOM 202 N GLU A 26 25.517 41.873 53.874 1.00 23.54 N ATOM 203 CA GLU A 26 24.978 42.357 55.144 1.00 24.15 C ATOM 204 C GLU A 26 26.053 42.086 56.212 1.00 23.17 C ATOM 205 O GLU A 26 26.925 41.235 56.004 1.00 21.66 O ATOM 206 CB AGLU A 26 23.712 41.557 55.492 0.50 23.37 C ATOM 207 CB BGLU A 26 23.659 41.638 55.464 0.50 24.51 C ATOM 208 CG AGLU A 26 22.465 42.073 54.844 0.50 24.90 C ATOM 209 CG BGLU A 26 22.519 42.140 54.602 0.50 27.73 C ATOM 210 CD AGLU A 26 22.049 43.400 55.434 0.50 27.82 C ATOM 211 CD BGLU A 26 21.372 41.171 54.494 0.50 31.60 C ATOM 212 OE1AGLU A 26 21.543 43.389 56.569 0.50 29.31 O ATOM 213 OE1BGLU A 26 21.030 40.535 55.509 0.50 35.46 O ATOM 214 OE2AGLU A 26 22.243 44.451 54.781 0.50 30.17 O ATOM 215 OE2BGLU A 26 20.803 41.038 53.388 0.50 33.75 O ATOM 0 H GLU A 26 25.728 41.039 53.893 1.00 23.54 H new ATOM 0 HA GLU A 26 24.755 43.300 55.097 1.00 24.15 H new ATOM 0 HB2AGLU A 26 23.843 40.633 55.229 0.50 24.51 H new ATOM 0 HB2BGLU A 26 23.770 40.684 55.329 0.50 24.51 H new ATOM 0 HB3AGLU A 26 23.591 41.564 56.454 0.50 24.51 H new ATOM 0 HB3BGLU A 26 23.438 41.769 56.400 0.50 24.51 H new ATOM 0 HG2AGLU A 26 22.611 42.172 53.890 0.50 27.73 H new ATOM 0 HG2BGLU A 26 22.192 42.977 54.967 0.50 27.73 H new ATOM 0 HG3AGLU A 26 21.749 41.428 54.956 0.50 27.73 H new ATOM 0 HG3BGLU A 26 22.856 42.331 53.713 0.50 27.73 H new ATOM 216 N PRO A 27 26.023 42.814 57.351 1.00 22.81 N ATOM 217 CA PRO A 27 25.059 43.837 57.740 1.00 21.73 C ATOM 218 C PRO A 27 25.682 45.224 57.666 1.00 22.48 C ATOM 219 O PRO A 27 26.885 45.358 57.397 1.00 21.21 O ATOM 220 CB PRO A 27 24.788 43.485 59.189 1.00 22.02 C ATOM 221 CG PRO A 27 26.180 43.206 59.691 1.00 22.58 C ATOM 222 CD PRO A 27 26.828 42.407 58.527 1.00 23.94 C ATOM 0 HA PRO A 27 24.272 43.857 57.174 1.00 21.73 H new ATOM 0 HB2 PRO A 27 24.365 44.214 59.669 1.00 22.02 H new ATOM 0 HB3 PRO A 27 24.207 42.713 59.275 1.00 22.02 H new ATOM 0 HG2 PRO A 27 26.665 44.026 59.876 1.00 22.58 H new ATOM 0 HG3 PRO A 27 26.167 42.693 60.514 1.00 22.58 H new ATOM 0 HD2 PRO A 27 27.765 42.632 58.416 1.00 23.94 H new ATOM 0 HD3 PRO A 27 26.782 41.450 58.679 1.00 23.94 H new ATOM 223 N LYS A 28 24.845 46.249 57.855 1.00 24.21 N ATOM 224 CA LYS A 28 25.325 47.625 57.921 1.00 27.97 C ATOM 225 C LYS A 28 26.275 47.517 59.141 1.00 27.53 C ATOM 226 O LYS A 28 25.873 47.074 60.232 1.00 24.54 O ATOM 227 CB LYS A 28 24.175 48.591 58.184 1.00 31.41 C ATOM 228 CG LYS A 28 24.606 50.039 58.066 1.00 38.25 C ATOM 229 CD LYS A 28 23.431 50.987 58.188 1.00 43.22 C ATOM 230 CE LYS A 28 23.913 52.419 58.415 1.00 47.23 C ATOM 231 NZ LYS A 28 22.814 53.288 58.943 1.00 50.03 N ATOM 0 H LYS A 28 23.994 46.164 57.947 1.00 24.21 H new ATOM 0 HA LYS A 28 25.741 47.961 57.112 1.00 27.97 H new ATOM 0 HB2 LYS A 28 23.458 48.416 57.555 1.00 31.41 H new ATOM 0 HB3 LYS A 28 23.818 48.433 59.072 1.00 31.41 H new ATOM 0 HG2 LYS A 28 25.257 50.240 58.756 1.00 38.25 H new ATOM 0 HG3 LYS A 28 25.046 50.177 57.213 1.00 38.25 H new ATOM 0 HD2 LYS A 28 22.892 50.946 57.383 1.00 43.22 H new ATOM 0 HD3 LYS A 28 22.863 50.712 58.924 1.00 43.22 H new ATOM 0 HE2 LYS A 28 24.655 52.417 59.040 1.00 47.23 H new ATOM 0 HE3 LYS A 28 24.246 52.786 57.581 1.00 47.23 H new ATOM 0 HZ1 LYS A 28 23.121 54.114 59.066 1.00 50.03 H new ATOM 0 HZ2 LYS A 28 22.143 53.305 58.359 1.00 50.03 H new ATOM 0 HZ3 LYS A 28 22.524 52.962 59.719 1.00 50.03 H new ATOM 232 N PRO A 29 27.556 47.873 58.952 1.00 27.89 N ATOM 233 CA PRO A 29 28.568 47.785 60.009 1.00 26.84 C ATOM 234 C PRO A 29 28.396 48.609 61.260 1.00 27.46 C ATOM 235 O PRO A 29 28.111 49.798 61.196 1.00 27.07 O ATOM 236 CB PRO A 29 29.859 48.130 59.272 1.00 24.84 C ATOM 237 CG PRO A 29 29.410 49.144 58.313 1.00 26.17 C ATOM 238 CD PRO A 29 28.081 48.616 57.789 1.00 26.48 C ATOM 0 HA PRO A 29 28.524 46.901 60.406 1.00 26.84 H new ATOM 0 HB2 PRO A 29 30.537 48.476 59.873 1.00 24.84 H new ATOM 0 HB3 PRO A 29 30.240 47.356 58.829 1.00 24.84 H new ATOM 0 HG2 PRO A 29 29.303 50.009 58.739 1.00 26.17 H new ATOM 0 HG3 PRO A 29 30.052 49.259 57.595 1.00 26.17 H new ATOM 0 HD2 PRO A 29 27.487 49.334 57.520 1.00 26.48 H new ATOM 0 HD3 PRO A 29 28.199 48.042 57.016 1.00 26.48 H new ATOM 239 N VAL A 30 28.635 47.946 62.391 1.00 29.51 N ATOM 240 CA VAL A 30 28.561 48.547 63.727 1.00 31.39 C ATOM 241 C VAL A 30 29.975 48.424 64.241 1.00 30.15 C ATOM 242 O VAL A 30 30.455 47.313 64.501 1.00 29.32 O ATOM 243 CB VAL A 30 27.605 47.757 64.671 1.00 33.40 C ATOM 244 CG1 VAL A 30 27.853 48.137 66.141 1.00 33.10 C ATOM 245 CG2 VAL A 30 26.159 48.052 64.295 1.00 34.44 C ATOM 0 H VAL A 30 28.850 47.113 62.405 1.00 29.51 H new ATOM 0 HA VAL A 30 28.221 49.455 63.695 1.00 31.39 H new ATOM 0 HB VAL A 30 27.780 46.809 64.568 1.00 33.40 H new ATOM 0 HG11 VAL A 30 27.249 47.636 66.711 1.00 33.10 H new ATOM 0 HG12 VAL A 30 28.770 47.929 66.379 1.00 33.10 H new ATOM 0 HG13 VAL A 30 27.696 49.087 66.261 1.00 33.10 H new ATOM 0 HG21 VAL A 30 25.565 47.560 64.883 1.00 34.44 H new ATOM 0 HG22 VAL A 30 25.988 49.003 64.385 1.00 34.44 H new ATOM 0 HG23 VAL A 30 26.002 47.782 63.377 1.00 34.44 H new ATOM 246 N ASN A 31 30.663 49.555 64.308 1.00 30.75 N ATOM 247 CA ASN A 31 32.051 49.571 64.780 1.00 33.07 C ATOM 248 C ASN A 31 32.984 48.624 64.022 1.00 30.47 C ATOM 249 O ASN A 31 33.814 47.934 64.611 1.00 29.23 O ATOM 250 CB ASN A 31 32.137 49.269 66.281 1.00 39.19 C ATOM 251 CG ASN A 31 31.840 50.478 67.158 1.00 42.86 C ATOM 252 OD1 ASN A 31 31.654 51.612 66.685 1.00 46.46 O ATOM 253 ND2 ASN A 31 31.825 50.240 68.451 1.00 44.96 N ATOM 0 H ASN A 31 30.350 50.325 64.087 1.00 30.75 H new ATOM 0 HA ASN A 31 32.358 50.474 64.604 1.00 33.07 H new ATOM 0 HB2 ASN A 31 31.512 48.559 66.498 1.00 39.19 H new ATOM 0 HB3 ASN A 31 33.025 48.938 66.487 1.00 39.19 H new ATOM 0 HD21 ASN A 31 31.682 50.882 69.005 1.00 44.96 H new ATOM 0 HD22 ASN A 31 31.958 49.442 68.743 1.00 44.96 H new ATOM 254 N GLN A 32 32.780 48.523 62.714 1.00 29.53 N ATOM 255 CA GLN A 32 33.662 47.710 61.887 1.00 27.02 C ATOM 256 C GLN A 32 33.719 48.225 60.465 1.00 23.93 C ATOM 257 O GLN A 32 32.960 49.125 60.080 1.00 25.09 O ATOM 258 CB GLN A 32 33.301 46.216 61.920 1.00 25.87 C ATOM 259 CG GLN A 32 31.958 45.789 61.358 1.00 24.83 C ATOM 260 CD GLN A 32 31.858 44.255 61.306 1.00 27.17 C ATOM 261 OE1 GLN A 32 32.689 43.546 61.894 1.00 26.75 O ATOM 262 NE2 GLN A 32 30.875 43.738 60.566 1.00 27.07 N ATOM 0 H GLN A 32 32.143 48.913 62.289 1.00 29.53 H new ATOM 0 HA GLN A 32 34.548 47.791 62.274 1.00 27.02 H new ATOM 0 HB2 GLN A 32 33.991 45.734 61.437 1.00 25.87 H new ATOM 0 HB3 GLN A 32 33.343 45.922 62.843 1.00 25.87 H new ATOM 0 HG2 GLN A 32 31.243 46.147 61.907 1.00 24.83 H new ATOM 0 HG3 GLN A 32 31.842 46.156 60.468 1.00 24.83 H new ATOM 0 HE21 GLN A 32 30.315 44.258 60.171 1.00 27.07 H new ATOM 0 HE22 GLN A 32 30.802 42.885 60.484 1.00 27.07 H new ATOM 263 N VAL A 33 34.721 47.756 59.738 1.00 21.74 N ATOM 264 CA VAL A 33 34.875 48.099 58.333 1.00 19.74 C ATOM 265 C VAL A 33 35.108 46.797 57.562 1.00 18.68 C ATOM 266 O VAL A 33 35.401 45.767 58.154 1.00 19.69 O ATOM 267 CB VAL A 33 36.025 49.097 58.048 1.00 18.33 C ATOM 268 CG1 VAL A 33 35.636 50.487 58.491 1.00 18.95 C ATOM 269 CG2 VAL A 33 37.331 48.631 58.672 1.00 16.87 C ATOM 0 H VAL A 33 35.330 47.231 60.043 1.00 21.74 H new ATOM 0 HA VAL A 33 34.066 48.552 58.047 1.00 19.74 H new ATOM 0 HB VAL A 33 36.177 49.129 57.091 1.00 18.33 H new ATOM 0 HG11 VAL A 33 36.364 51.101 58.307 1.00 18.95 H new ATOM 0 HG12 VAL A 33 34.844 50.771 58.008 1.00 18.95 H new ATOM 0 HG13 VAL A 33 35.450 50.483 59.443 1.00 18.95 H new ATOM 0 HG21 VAL A 33 38.031 49.274 58.477 1.00 16.87 H new ATOM 0 HG22 VAL A 33 37.221 48.554 59.633 1.00 16.87 H new ATOM 0 HG23 VAL A 33 37.575 47.767 58.305 1.00 16.87 H new ATOM 270 N TYR A 34 34.976 46.859 56.240 1.00 18.49 N ATOM 271 CA TYR A 34 35.138 45.689 55.378 1.00 17.62 C ATOM 272 C TYR A 34 36.191 45.889 54.301 1.00 16.19 C ATOM 273 O TYR A 34 36.413 47.009 53.835 1.00 16.02 O ATOM 274 CB TYR A 34 33.826 45.406 54.636 1.00 17.49 C ATOM 275 CG TYR A 34 32.619 45.185 55.525 1.00 17.41 C ATOM 276 CD1 TYR A 34 32.493 44.028 56.286 1.00 17.34 C ATOM 277 CD2 TYR A 34 31.596 46.113 55.570 1.00 16.67 C ATOM 278 CE1 TYR A 34 31.385 43.809 57.052 1.00 16.67 C ATOM 279 CE2 TYR A 34 30.472 45.899 56.347 1.00 18.01 C ATOM 280 CZ TYR A 34 30.374 44.747 57.081 1.00 17.96 C ATOM 281 OH TYR A 34 29.255 44.533 57.866 1.00 20.46 O ATOM 0 H TYR A 34 34.789 47.583 55.815 1.00 18.49 H new ATOM 0 HA TYR A 34 35.403 44.963 55.964 1.00 17.62 H new ATOM 0 HB2 TYR A 34 33.640 46.149 54.041 1.00 17.49 H new ATOM 0 HB3 TYR A 34 33.948 44.621 54.079 1.00 17.49 H new ATOM 0 HD1 TYR A 34 33.174 43.394 56.273 1.00 17.34 H new ATOM 0 HD2 TYR A 34 31.664 46.894 55.070 1.00 16.67 H new ATOM 0 HE1 TYR A 34 31.312 43.029 57.553 1.00 16.67 H new ATOM 0 HE2 TYR A 34 29.790 46.531 56.371 1.00 18.01 H new ATOM 0 HH TYR A 34 28.643 45.058 57.631 1.00 20.46 H new ATOM 282 N THR A 35 36.867 44.801 53.961 1.00 16.05 N ATOM 283 CA THR A 35 37.824 44.796 52.859 1.00 17.84 C ATOM 284 C THR A 35 37.394 43.631 51.965 1.00 18.49 C ATOM 285 O THR A 35 37.274 42.496 52.421 1.00 18.48 O ATOM 286 CB THR A 35 39.286 44.652 53.313 1.00 18.57 C ATOM 287 OG1 THR A 35 39.690 45.888 53.907 1.00 20.03 O ATOM 288 CG2 THR A 35 40.213 44.338 52.098 1.00 17.29 C ATOM 0 H THR A 35 36.786 44.044 54.361 1.00 16.05 H new ATOM 0 HA THR A 35 37.810 45.647 52.393 1.00 17.84 H new ATOM 0 HB THR A 35 39.357 43.922 53.948 1.00 18.57 H new ATOM 0 HG1 THR A 35 40.256 45.738 54.510 1.00 20.03 H new ATOM 0 HG21 THR A 35 41.129 44.251 52.404 1.00 17.29 H new ATOM 0 HG22 THR A 35 39.931 43.508 51.682 1.00 17.29 H new ATOM 0 HG23 THR A 35 40.155 45.059 51.452 1.00 17.29 H new ATOM 289 N VAL A 36 37.099 43.937 50.708 1.00 18.90 N ATOM 290 CA VAL A 36 36.641 42.916 49.770 1.00 18.17 C ATOM 291 C VAL A 36 37.758 42.546 48.805 1.00 17.75 C ATOM 292 O VAL A 36 38.434 43.433 48.259 1.00 16.97 O ATOM 293 CB VAL A 36 35.437 43.434 48.949 1.00 17.60 C ATOM 294 CG1 VAL A 36 34.978 42.369 47.913 1.00 17.72 C ATOM 295 CG2 VAL A 36 34.314 43.886 49.874 1.00 15.79 C ATOM 0 H VAL A 36 37.157 44.729 50.377 1.00 18.90 H new ATOM 0 HA VAL A 36 36.376 42.137 50.284 1.00 18.17 H new ATOM 0 HB VAL A 36 35.711 44.213 48.440 1.00 17.60 H new ATOM 0 HG11 VAL A 36 34.223 42.712 47.409 1.00 17.72 H new ATOM 0 HG12 VAL A 36 35.709 42.171 47.306 1.00 17.72 H new ATOM 0 HG13 VAL A 36 34.715 41.559 48.377 1.00 17.72 H new ATOM 0 HG21 VAL A 36 33.568 44.207 49.344 1.00 15.79 H new ATOM 0 HG22 VAL A 36 34.024 43.139 50.420 1.00 15.79 H new ATOM 0 HG23 VAL A 36 34.634 44.600 50.447 1.00 15.79 H new ATOM 296 N GLN A 37 37.956 41.238 48.615 1.00 17.36 N ATOM 297 CA GLN A 37 38.965 40.742 47.673 1.00 17.20 C ATOM 298 C GLN A 37 38.293 39.905 46.610 1.00 17.39 C ATOM 299 O GLN A 37 37.226 39.328 46.835 1.00 17.03 O ATOM 300 CB GLN A 37 39.993 39.839 48.345 1.00 17.57 C ATOM 301 CG GLN A 37 40.710 40.432 49.520 1.00 18.84 C ATOM 302 CD GLN A 37 41.865 39.576 49.904 1.00 20.47 C ATOM 303 OE1 GLN A 37 41.671 38.422 50.265 1.00 22.05 O ATOM 304 NE2 GLN A 37 43.080 40.095 49.765 1.00 20.01 N ATOM 0 H GLN A 37 37.516 40.621 49.022 1.00 17.36 H new ATOM 0 HA GLN A 37 39.408 41.523 47.306 1.00 17.20 H new ATOM 0 HB2 GLN A 37 39.546 39.028 48.635 1.00 17.57 H new ATOM 0 HB3 GLN A 37 40.652 39.578 47.683 1.00 17.57 H new ATOM 0 HG2 GLN A 37 41.019 41.325 49.301 1.00 18.84 H new ATOM 0 HG3 GLN A 37 40.100 40.519 50.269 1.00 18.84 H new ATOM 0 HE21 GLN A 37 43.172 40.911 49.509 1.00 20.01 H new ATOM 0 HE22 GLN A 37 43.774 39.615 49.931 1.00 20.01 H new ATOM 305 N ILE A 38 38.952 39.819 45.464 1.00 17.88 N ATOM 306 CA ILE A 38 38.465 39.000 44.352 1.00 18.69 C ATOM 307 C ILE A 38 39.582 38.088 43.820 1.00 17.58 C ATOM 308 O ILE A 38 40.774 38.375 43.968 1.00 15.97 O ATOM 309 CB ILE A 38 37.825 39.881 43.198 1.00 18.80 C ATOM 310 CG1 ILE A 38 37.103 38.975 42.188 1.00 17.50 C ATOM 311 CG2 ILE A 38 38.875 40.764 42.526 1.00 14.65 C ATOM 312 CD1 ILE A 38 36.122 39.712 41.352 1.00 18.26 C ATOM 0 H ILE A 38 39.691 40.229 45.304 1.00 17.88 H new ATOM 0 HA ILE A 38 37.754 38.435 44.693 1.00 18.69 H new ATOM 0 HB ILE A 38 37.169 40.480 43.588 1.00 18.80 H new ATOM 0 HG12 ILE A 38 37.759 38.552 41.612 1.00 17.50 H new ATOM 0 HG13 ILE A 38 36.646 38.265 42.666 1.00 17.50 H new ATOM 0 HG21 ILE A 38 38.456 41.290 41.827 1.00 14.65 H new ATOM 0 HG22 ILE A 38 39.268 41.358 43.185 1.00 14.65 H new ATOM 0 HG23 ILE A 38 39.568 40.206 42.139 1.00 14.65 H new ATOM 0 HD11 ILE A 38 35.696 39.097 40.734 1.00 18.26 H new ATOM 0 HD12 ILE A 38 35.449 40.115 41.922 1.00 18.26 H new ATOM 0 HD13 ILE A 38 36.579 40.406 40.852 1.00 18.26 H new ATOM 313 N SER A 39 39.175 36.952 43.261 1.00 18.98 N ATOM 314 CA SER A 39 40.099 35.988 42.686 1.00 18.90 C ATOM 315 C SER A 39 39.349 35.114 41.683 1.00 19.28 C ATOM 316 O SER A 39 38.118 35.101 41.659 1.00 17.92 O ATOM 317 CB SER A 39 40.668 35.085 43.793 1.00 18.69 C ATOM 318 OG SER A 39 39.639 34.294 44.369 1.00 17.59 O ATOM 0 H SER A 39 38.349 36.720 43.206 1.00 18.98 H new ATOM 0 HA SER A 39 40.822 36.463 42.247 1.00 18.90 H new ATOM 0 HB2 SER A 39 41.358 34.510 43.426 1.00 18.69 H new ATOM 0 HB3 SER A 39 41.087 35.629 44.478 1.00 18.69 H new ATOM 0 HG SER A 39 39.382 34.647 45.087 1.00 17.59 H new ATOM 319 N THR A 40 40.086 34.485 40.770 1.00 20.72 N ATOM 320 CA THR A 40 39.456 33.527 39.877 1.00 22.46 C ATOM 321 C THR A 40 39.240 32.333 40.863 1.00 25.07 C ATOM 322 O THR A 40 39.891 32.268 41.924 1.00 25.08 O ATOM 323 CB THR A 40 40.377 33.120 38.696 1.00 22.61 C ATOM 324 OG1 THR A 40 41.603 32.577 39.203 1.00 24.45 O ATOM 325 CG2 THR A 40 40.670 34.314 37.781 1.00 19.15 C ATOM 0 H THR A 40 40.931 34.597 40.655 1.00 20.72 H new ATOM 0 HA THR A 40 38.655 33.857 39.441 1.00 22.46 H new ATOM 0 HB THR A 40 39.917 32.447 38.170 1.00 22.61 H new ATOM 0 HG1 THR A 40 41.555 31.738 39.215 1.00 24.45 H new ATOM 0 HG21 THR A 40 41.246 34.031 37.054 1.00 19.15 H new ATOM 0 HG22 THR A 40 39.838 34.656 37.419 1.00 19.15 H new ATOM 0 HG23 THR A 40 41.112 35.011 38.290 1.00 19.15 H new ATOM 326 N LYS A 41 38.331 31.416 40.534 1.00 25.80 N ATOM 327 CA LYS A 41 37.992 30.282 41.403 1.00 27.65 C ATOM 328 C LYS A 41 39.126 29.674 42.245 1.00 28.20 C ATOM 329 O LYS A 41 38.967 29.466 43.453 1.00 28.19 O ATOM 330 CB LYS A 41 37.284 29.208 40.583 1.00 30.87 C ATOM 331 CG LYS A 41 36.315 28.347 41.368 1.00 34.23 C ATOM 332 CD LYS A 41 37.067 27.290 42.120 1.00 39.10 C ATOM 333 CE LYS A 41 36.167 26.513 43.046 1.00 42.96 C ATOM 334 NZ LYS A 41 35.626 25.272 42.412 1.00 45.76 N ATOM 0 H LYS A 41 37.889 31.432 39.796 1.00 25.80 H new ATOM 0 HA LYS A 41 37.407 30.661 42.078 1.00 27.65 H new ATOM 0 HB2 LYS A 41 36.802 29.637 39.858 1.00 30.87 H new ATOM 0 HB3 LYS A 41 37.953 28.634 40.178 1.00 30.87 H new ATOM 0 HG2 LYS A 41 35.809 28.897 41.986 1.00 34.23 H new ATOM 0 HG3 LYS A 41 35.676 27.934 40.766 1.00 34.23 H new ATOM 0 HD2 LYS A 41 37.486 26.682 41.491 1.00 39.10 H new ATOM 0 HD3 LYS A 41 37.779 27.703 42.633 1.00 39.10 H new ATOM 0 HE2 LYS A 41 36.660 26.275 43.847 1.00 42.96 H new ATOM 0 HE3 LYS A 41 35.429 27.078 43.325 1.00 42.96 H new ATOM 0 HZ1 LYS A 41 35.102 24.846 42.992 1.00 45.76 H new ATOM 0 HZ2 LYS A 41 35.153 25.489 41.690 1.00 45.76 H new ATOM 0 HZ3 LYS A 41 36.300 24.741 42.176 1.00 45.76 H new ATOM 335 N SER A 42 40.259 29.379 41.619 1.00 27.14 N ATOM 336 CA SER A 42 41.396 28.834 42.356 1.00 26.49 C ATOM 337 C SER A 42 42.642 29.713 42.241 1.00 25.67 C ATOM 338 O SER A 42 43.758 29.249 42.473 1.00 24.28 O ATOM 339 CB SER A 42 41.706 27.410 41.891 1.00 26.49 C ATOM 340 OG SER A 42 40.646 26.545 42.260 1.00 26.44 O ATOM 0 H SER A 42 40.391 29.485 40.776 1.00 27.14 H new ATOM 0 HA SER A 42 41.143 28.816 43.292 1.00 26.49 H new ATOM 0 HB2 SER A 42 41.828 27.394 40.929 1.00 26.49 H new ATOM 0 HB3 SER A 42 42.537 27.105 42.287 1.00 26.49 H new ATOM 0 HG SER A 42 40.818 25.764 42.002 1.00 26.44 H new ATOM 341 N GLY A 43 42.456 30.982 41.888 1.00 24.89 N ATOM 342 CA GLY A 43 43.593 31.887 41.775 1.00 26.25 C ATOM 343 C GLY A 43 43.913 32.674 43.053 1.00 27.93 C ATOM 344 O GLY A 43 43.286 32.490 44.114 1.00 28.87 O ATOM 0 H GLY A 43 41.691 31.334 41.712 1.00 24.89 H new ATOM 0 HA2 GLY A 43 44.376 31.374 41.521 1.00 26.25 H new ATOM 0 HA3 GLY A 43 43.421 32.516 41.057 1.00 26.25 H new ATOM 345 N ASP A 44 44.895 33.562 42.956 1.00 26.58 N ATOM 346 CA ASP A 44 45.291 34.385 44.084 1.00 26.46 C ATOM 347 C ASP A 44 44.317 35.529 44.354 1.00 25.55 C ATOM 348 O ASP A 44 43.716 36.073 43.431 1.00 26.54 O ATOM 349 CB ASP A 44 46.678 34.929 43.834 1.00 28.16 C ATOM 350 CG ASP A 44 47.732 33.874 43.983 1.00 33.99 C ATOM 351 OD1 ASP A 44 47.668 33.129 44.991 1.00 36.25 O ATOM 352 OD2 ASP A 44 48.614 33.787 43.102 1.00 36.73 O ATOM 0 H ASP A 44 45.347 33.702 42.238 1.00 26.58 H new ATOM 0 HA ASP A 44 45.284 33.824 44.876 1.00 26.46 H new ATOM 0 HB2 ASP A 44 46.721 35.304 42.940 1.00 28.16 H new ATOM 0 HB3 ASP A 44 46.857 35.653 44.454 1.00 28.16 H new ATOM 353 N TRP A 45 44.197 35.919 45.617 1.00 24.39 N ATOM 354 CA TRP A 45 43.300 36.999 46.012 1.00 22.52 C ATOM 355 C TRP A 45 43.872 38.395 45.788 1.00 23.76 C ATOM 356 O TRP A 45 45.085 38.618 45.911 1.00 25.22 O ATOM 357 CB TRP A 45 42.911 36.845 47.477 1.00 20.62 C ATOM 358 CG TRP A 45 42.124 35.610 47.721 1.00 20.85 C ATOM 359 CD1 TRP A 45 42.598 34.400 48.163 1.00 19.40 C ATOM 360 CD2 TRP A 45 40.720 35.434 47.499 1.00 20.63 C ATOM 361 NE1 TRP A 45 41.578 33.490 48.225 1.00 20.51 N ATOM 362 CE2 TRP A 45 40.409 34.093 47.821 1.00 20.83 C ATOM 363 CE3 TRP A 45 39.688 36.285 47.064 1.00 18.73 C ATOM 364 CZ2 TRP A 45 39.103 33.570 47.721 1.00 18.55 C ATOM 365 CZ3 TRP A 45 38.391 35.767 46.968 1.00 18.56 C ATOM 366 CH2 TRP A 45 38.113 34.418 47.295 1.00 18.37 C ATOM 0 H TRP A 45 44.632 35.566 46.269 1.00 24.39 H new ATOM 0 HA TRP A 45 42.523 36.921 45.437 1.00 22.52 H new ATOM 0 HB2 TRP A 45 43.713 36.829 48.023 1.00 20.62 H new ATOM 0 HB3 TRP A 45 42.394 37.617 47.755 1.00 20.62 H new ATOM 0 HD1 TRP A 45 43.483 34.224 48.388 1.00 19.40 H new ATOM 0 HE1 TRP A 45 41.655 32.671 48.477 1.00 20.51 H new ATOM 0 HE3 TRP A 45 39.863 37.172 46.845 1.00 18.73 H new ATOM 0 HZ2 TRP A 45 38.920 32.684 47.936 1.00 18.55 H new ATOM 0 HZ3 TRP A 45 37.699 36.320 46.684 1.00 18.56 H new ATOM 0 HH2 TRP A 45 37.242 34.101 47.219 1.00 18.37 H new ATOM 367 N LYS A 46 42.986 39.326 45.438 1.00 22.25 N ATOM 368 CA LYS A 46 43.358 40.719 45.219 1.00 21.32 C ATOM 369 C LYS A 46 42.356 41.660 45.910 1.00 19.72 C ATOM 370 O LYS A 46 41.148 41.586 45.666 1.00 18.82 O ATOM 371 CB LYS A 46 43.401 41.034 43.727 1.00 22.44 C ATOM 372 CG LYS A 46 43.906 42.426 43.451 1.00 26.77 C ATOM 373 CD LYS A 46 43.702 42.808 42.013 1.00 31.51 C ATOM 374 CE LYS A 46 44.259 44.193 41.754 1.00 34.52 C ATOM 375 NZ LYS A 46 44.045 44.614 40.327 1.00 38.37 N ATOM 0 H LYS A 46 42.149 39.165 45.321 1.00 22.25 H new ATOM 0 HA LYS A 46 44.240 40.857 45.599 1.00 21.32 H new ATOM 0 HB2 LYS A 46 43.972 40.390 43.279 1.00 22.44 H new ATOM 0 HB3 LYS A 46 42.512 40.934 43.352 1.00 22.44 H new ATOM 0 HG2 LYS A 46 43.445 43.059 44.024 1.00 26.77 H new ATOM 0 HG3 LYS A 46 44.849 42.479 43.671 1.00 26.77 H new ATOM 0 HD2 LYS A 46 44.139 42.163 41.435 1.00 31.51 H new ATOM 0 HD3 LYS A 46 42.757 42.787 41.797 1.00 31.51 H new ATOM 0 HE2 LYS A 46 43.833 44.831 42.348 1.00 34.52 H new ATOM 0 HE3 LYS A 46 45.207 44.205 41.958 1.00 34.52 H new ATOM 0 HZ1 LYS A 46 44.261 45.473 40.235 1.00 38.37 H new ATOM 0 HZ2 LYS A 46 44.557 44.121 39.792 1.00 38.37 H new ATOM 0 HZ3 LYS A 46 43.190 44.498 40.108 1.00 38.37 H new ATOM 376 N SER A 47 42.853 42.537 46.778 1.00 19.38 N ATOM 377 CA SER A 47 41.981 43.487 47.464 1.00 19.15 C ATOM 378 C SER A 47 41.504 44.556 46.497 1.00 18.62 C ATOM 379 O SER A 47 42.282 45.058 45.690 1.00 18.54 O ATOM 380 CB SER A 47 42.704 44.114 48.642 1.00 20.30 C ATOM 381 OG SER A 47 43.202 43.102 49.502 1.00 20.86 O ATOM 0 H SER A 47 43.686 42.599 46.983 1.00 19.38 H new ATOM 0 HA SER A 47 41.206 43.011 47.801 1.00 19.15 H new ATOM 0 HB2 SER A 47 43.435 44.668 48.325 1.00 20.30 H new ATOM 0 HB3 SER A 47 42.099 44.695 49.130 1.00 20.30 H new ATOM 0 HG SER A 47 42.588 42.839 50.011 1.00 20.86 H new ATOM 382 N LYS A 48 40.218 44.901 46.599 1.00 18.80 N ATOM 383 CA LYS A 48 39.585 45.877 45.727 1.00 18.46 C ATOM 384 C LYS A 48 38.930 47.053 46.442 1.00 19.63 C ATOM 385 O LYS A 48 39.058 48.195 46.015 1.00 20.72 O ATOM 386 CB LYS A 48 38.608 45.144 44.826 1.00 20.46 C ATOM 387 CG LYS A 48 39.328 44.179 43.877 1.00 26.31 C ATOM 388 CD LYS A 48 40.311 44.890 42.949 1.00 30.81 C ATOM 389 CE LYS A 48 39.609 45.848 41.975 1.00 35.16 C ATOM 390 NZ LYS A 48 38.680 46.827 42.648 1.00 41.19 N ATOM 0 H LYS A 48 39.686 44.567 47.187 1.00 18.80 H new ATOM 0 HA LYS A 48 40.286 46.298 45.205 1.00 18.46 H new ATOM 0 HB2 LYS A 48 37.973 44.651 45.369 1.00 20.46 H new ATOM 0 HB3 LYS A 48 38.099 45.788 44.309 1.00 20.46 H new ATOM 0 HG2 LYS A 48 39.804 43.514 44.398 1.00 26.31 H new ATOM 0 HG3 LYS A 48 38.671 43.705 43.344 1.00 26.31 H new ATOM 0 HD2 LYS A 48 40.953 45.386 43.481 1.00 30.81 H new ATOM 0 HD3 LYS A 48 40.811 44.229 42.445 1.00 30.81 H new ATOM 0 HE2 LYS A 48 40.281 46.341 41.479 1.00 35.16 H new ATOM 0 HE3 LYS A 48 39.105 45.328 41.330 1.00 35.16 H new ATOM 0 HZ1 LYS A 48 38.499 47.496 42.090 1.00 41.19 H new ATOM 0 HZ2 LYS A 48 37.924 46.414 42.870 1.00 41.19 H new ATOM 0 HZ3 LYS A 48 39.068 47.149 43.381 1.00 41.19 H new ATOM 391 N ACYS A 49 38.166 46.756 47.496 0.50 19.37 N ATOM 392 N BCYS A 49 38.173 46.769 47.503 0.50 20.19 N ATOM 393 CA ACYS A 49 37.500 47.775 48.307 0.50 17.98 C ATOM 394 CA BCYS A 49 37.543 47.826 48.282 0.50 19.57 C ATOM 395 C ACYS A 49 38.137 47.673 49.683 0.50 17.72 C ATOM 396 C BCYS A 49 38.143 47.683 49.665 0.50 18.59 C ATOM 397 O ACYS A 49 38.061 46.625 50.317 0.50 17.35 O ATOM 398 O BCYS A 49 38.050 46.624 50.279 0.50 18.10 O ATOM 399 CB ACYS A 49 35.999 47.501 48.403 0.50 17.76 C ATOM 400 CB BCYS A 49 36.033 47.672 48.341 0.50 21.03 C ATOM 401 SG ACYS A 49 35.035 48.070 46.963 0.50 18.52 S ATOM 402 SG BCYS A 49 35.223 49.158 48.959 0.50 26.12 S ATOM 0 H ACYS A 49 38.020 45.951 47.761 0.50 20.19 H new ATOM 0 H BCYS A 49 38.014 45.972 47.785 0.50 20.19 H new ATOM 0 HA ACYS A 49 37.601 48.658 47.919 0.50 19.57 H new ATOM 0 HA BCYS A 49 37.699 48.698 47.887 0.50 19.57 H new ATOM 0 HB2ACYS A 49 35.862 46.547 48.514 0.50 21.03 H new ATOM 0 HB2BCYS A 49 35.695 47.466 47.455 0.50 21.03 H new ATOM 0 HB3ACYS A 49 35.653 47.932 49.200 0.50 21.03 H new ATOM 0 HB3BCYS A 49 35.808 46.921 48.912 0.50 21.03 H new ATOM 0 HG BCYS A 49 35.100 49.948 48.065 0.50 26.12 H new ATOM 403 N PHE A 50 38.812 48.741 50.108 1.00 18.25 N ATOM 404 CA PHE A 50 39.508 48.778 51.388 1.00 18.79 C ATOM 405 C PHE A 50 38.847 49.493 52.548 1.00 20.15 C ATOM 406 O PHE A 50 38.408 50.642 52.404 1.00 20.12 O ATOM 407 CB PHE A 50 40.862 49.462 51.207 1.00 18.83 C ATOM 408 CG PHE A 50 41.868 48.656 50.461 1.00 18.42 C ATOM 409 CD1 PHE A 50 41.971 48.761 49.077 1.00 20.26 C ATOM 410 CD2 PHE A 50 42.733 47.811 51.139 1.00 18.52 C ATOM 411 CE1 PHE A 50 42.929 48.036 48.388 1.00 20.36 C ATOM 412 CE2 PHE A 50 43.692 47.083 50.463 1.00 18.47 C ATOM 413 CZ PHE A 50 43.798 47.183 49.099 1.00 19.68 C ATOM 0 H APHE A 50 38.878 49.469 49.655 0.50 18.25 H new ATOM 0 H BPHE A 50 38.875 49.474 49.663 0.50 18.25 H new ATOM 0 HA PHE A 50 39.537 47.839 51.630 1.00 18.79 H new ATOM 0 HB2 PHE A 50 40.727 50.302 50.741 1.00 18.83 H new ATOM 0 HB3 PHE A 50 41.222 49.678 52.082 1.00 18.83 H new ATOM 0 HD1 PHE A 50 41.393 49.322 48.612 1.00 20.26 H new ATOM 0 HD2 PHE A 50 42.666 47.733 52.063 1.00 18.52 H new ATOM 0 HE1 PHE A 50 42.999 48.111 47.464 1.00 20.36 H new ATOM 0 HE2 PHE A 50 44.267 46.524 50.933 1.00 18.47 H new ATOM 0 HZ PHE A 50 44.442 46.689 48.644 1.00 19.68 H new ATOM 414 N TYR A 51 38.817 48.800 53.695 1.00 20.34 N ATOM 415 CA TYR A 51 38.309 49.321 54.970 1.00 19.47 C ATOM 416 C TYR A 51 37.173 50.290 54.803 1.00 19.64 C ATOM 417 O TYR A 51 37.281 51.447 55.184 1.00 20.36 O ATOM 418 CB TYR A 51 39.475 49.990 55.708 1.00 17.46 C ATOM 419 CG TYR A 51 40.682 49.090 55.738 1.00 17.00 C ATOM 420 CD1 TYR A 51 40.657 47.903 56.466 1.00 16.82 C ATOM 421 CD2 TYR A 51 41.833 49.391 55.001 1.00 16.62 C ATOM 422 CE1 TYR A 51 41.736 47.047 56.463 1.00 18.56 C ATOM 423 CE2 TYR A 51 42.916 48.535 54.990 1.00 16.39 C ATOM 424 CZ TYR A 51 42.861 47.369 55.725 1.00 19.03 C ATOM 425 OH TYR A 51 43.929 46.509 55.756 1.00 23.77 O ATOM 0 H TYR A 51 39.101 47.990 53.752 1.00 20.34 H new ATOM 0 HA TYR A 51 37.951 48.578 55.480 1.00 19.47 H new ATOM 0 HB2 TYR A 51 39.702 50.826 55.271 1.00 17.46 H new ATOM 0 HB3 TYR A 51 39.207 50.207 56.614 1.00 17.46 H new ATOM 0 HD1 TYR A 51 39.901 47.685 56.961 1.00 16.82 H new ATOM 0 HD2 TYR A 51 41.869 50.180 54.511 1.00 16.62 H new ATOM 0 HE1 TYR A 51 41.708 46.258 56.954 1.00 18.56 H new ATOM 0 HE2 TYR A 51 43.674 48.742 54.493 1.00 16.39 H new ATOM 0 HH TYR A 51 44.546 46.810 55.272 1.00 23.77 H new ATOM 426 N THR A 52 36.066 49.796 54.265 1.00 18.97 N ATOM 427 CA THR A 52 34.909 50.623 53.995 1.00 19.90 C ATOM 428 C THR A 52 33.710 50.308 54.904 1.00 19.67 C ATOM 429 O THR A 52 33.635 49.248 55.517 1.00 19.95 O ATOM 430 CB THR A 52 34.476 50.444 52.492 1.00 19.47 C ATOM 431 OG1 THR A 52 33.404 51.339 52.168 1.00 19.99 O ATOM 432 CG2 THR A 52 34.029 49.002 52.213 1.00 20.11 C ATOM 0 H THR A 52 35.968 48.970 54.047 1.00 18.97 H new ATOM 0 HA THR A 52 35.172 51.539 54.177 1.00 19.90 H new ATOM 0 HB THR A 52 35.247 50.647 51.940 1.00 19.47 H new ATOM 0 HG1 THR A 52 33.438 51.533 51.351 1.00 19.99 H new ATOM 0 HG21 THR A 52 33.768 48.918 51.283 1.00 20.11 H new ATOM 0 HG22 THR A 52 34.762 48.394 52.399 1.00 20.11 H new ATOM 0 HG23 THR A 52 33.274 48.781 52.781 1.00 20.11 H new ATOM 433 N THR A 53 32.786 51.257 54.987 1.00 20.42 N ATOM 434 CA THR A 53 31.554 51.078 55.743 1.00 21.42 C ATOM 435 C THR A 53 30.399 50.760 54.761 1.00 20.45 C ATOM 436 O THR A 53 29.311 50.405 55.170 1.00 21.01 O ATOM 437 CB THR A 53 31.235 52.315 56.639 1.00 22.63 C ATOM 438 OG1 THR A 53 31.106 53.490 55.835 1.00 21.11 O ATOM 439 CG2 THR A 53 32.353 52.525 57.653 1.00 21.83 C ATOM 0 H THR A 53 32.856 52.025 54.606 1.00 20.42 H new ATOM 0 HA THR A 53 31.664 50.331 56.352 1.00 21.42 H new ATOM 0 HB THR A 53 30.399 52.150 57.103 1.00 22.63 H new ATOM 0 HG1 THR A 53 30.933 54.149 56.327 1.00 21.11 H new ATOM 0 HG21 THR A 53 32.148 53.295 58.206 1.00 21.83 H new ATOM 0 HG22 THR A 53 32.434 51.737 58.213 1.00 21.83 H new ATOM 0 HG23 THR A 53 33.190 52.676 57.186 1.00 21.83 H new ATOM 440 N ASP A 54 30.639 50.890 53.463 1.00 20.72 N ATOM 441 CA ASP A 54 29.618 50.530 52.479 1.00 20.98 C ATOM 442 C ASP A 54 29.396 49.002 52.572 1.00 21.61 C ATOM 443 O ASP A 54 30.292 48.252 53.011 1.00 22.79 O ATOM 444 CB ASP A 54 30.113 50.789 51.056 1.00 24.00 C ATOM 445 CG ASP A 54 30.465 52.238 50.774 1.00 29.09 C ATOM 446 OD1 ASP A 54 30.284 53.122 51.625 1.00 32.05 O ATOM 447 OD2 ASP A 54 30.936 52.495 49.645 1.00 31.97 O ATOM 0 H ASP A 54 31.377 51.181 53.130 1.00 20.72 H new ATOM 0 HA ASP A 54 28.819 51.050 52.659 1.00 20.98 H new ATOM 0 HB2 ASP A 54 30.895 50.239 50.891 1.00 24.00 H new ATOM 0 HB3 ASP A 54 29.429 50.505 50.430 1.00 24.00 H new ATOM 448 N THR A 55 28.251 48.537 52.078 1.00 20.51 N ATOM 449 CA THR A 55 27.914 47.113 52.065 1.00 18.97 C ATOM 450 C THR A 55 27.744 46.621 50.597 1.00 20.75 C ATOM 451 O THR A 55 26.905 45.751 50.293 1.00 20.81 O ATOM 452 CB THR A 55 26.635 46.814 52.871 1.00 19.39 C ATOM 453 OG1 THR A 55 25.630 47.744 52.485 1.00 21.87 O ATOM 454 CG2 THR A 55 26.861 46.930 54.376 1.00 16.15 C ATOM 0 H THR A 55 27.643 49.042 51.738 1.00 20.51 H new ATOM 0 HA THR A 55 28.645 46.636 52.488 1.00 18.97 H new ATOM 0 HB THR A 55 26.367 45.901 52.682 1.00 19.39 H new ATOM 0 HG1 THR A 55 24.926 47.591 52.917 1.00 21.87 H new ATOM 0 HG21 THR A 55 26.034 46.735 54.844 1.00 16.15 H new ATOM 0 HG22 THR A 55 27.544 46.298 54.650 1.00 16.15 H new ATOM 0 HG23 THR A 55 27.149 47.831 54.592 1.00 16.15 H new ATOM 455 N GLU A 56 28.514 47.235 49.696 1.00 20.24 N ATOM 456 CA GLU A 56 28.553 46.860 48.272 1.00 20.84 C ATOM 457 C GLU A 56 29.920 47.219 47.686 1.00 18.74 C ATOM 458 O GLU A 56 30.582 48.132 48.183 1.00 20.95 O ATOM 459 CB GLU A 56 27.466 47.537 47.478 1.00 22.70 C ATOM 460 CG GLU A 56 27.640 48.994 47.329 1.00 28.46 C ATOM 461 CD GLU A 56 26.594 49.529 46.407 1.00 35.51 C ATOM 462 OE1 GLU A 56 25.399 49.462 46.774 1.00 37.96 O ATOM 463 OE2 GLU A 56 26.959 49.947 45.285 1.00 40.16 O ATOM 0 H GLU A 56 29.036 47.889 49.894 1.00 20.24 H new ATOM 0 HA GLU A 56 28.405 45.903 48.214 1.00 20.84 H new ATOM 0 HB2 GLU A 56 27.426 47.135 46.596 1.00 22.70 H new ATOM 0 HB3 GLU A 56 26.613 47.366 47.907 1.00 22.70 H new ATOM 0 HG2 GLU A 56 27.574 49.427 48.194 1.00 28.46 H new ATOM 0 HG3 GLU A 56 28.524 49.190 46.980 1.00 28.46 H new ATOM 464 N ACYS A 57 30.344 46.515 46.657 0.50 17.30 N ATOM 465 N BCYS A 57 30.324 46.499 46.658 0.50 17.09 N ATOM 466 CA ACYS A 57 31.634 46.802 46.034 0.50 17.55 C ATOM 467 CA BCYS A 57 31.622 46.708 46.030 0.50 17.16 C ATOM 468 C ACYS A 57 31.598 46.504 44.543 0.50 16.61 C ATOM 469 C BCYS A 57 31.568 46.490 44.520 0.50 16.40 C ATOM 470 O ACYS A 57 31.342 45.381 44.120 0.50 16.30 O ATOM 471 O BCYS A 57 31.269 45.392 44.059 0.50 16.25 O ATOM 472 CB ACYS A 57 32.765 46.018 46.705 0.50 17.81 C ATOM 473 CB BCYS A 57 32.640 45.742 46.645 0.50 16.70 C ATOM 474 SG ACYS A 57 34.419 46.376 46.011 0.50 20.05 S ATOM 475 SG BCYS A 57 34.275 45.774 45.870 0.50 18.73 S ATOM 0 H ACYS A 57 29.907 45.867 46.299 0.50 17.09 H new ATOM 0 H BCYS A 57 29.856 45.873 46.300 0.50 17.09 H new ATOM 0 HA ACYS A 57 31.810 47.748 46.155 0.50 17.16 H new ATOM 0 HA BCYS A 57 31.885 47.628 46.187 0.50 17.16 H new ATOM 0 HB2ACYS A 57 32.770 46.221 47.654 0.50 16.70 H new ATOM 0 HB2BCYS A 57 32.738 45.951 47.587 0.50 16.70 H new ATOM 0 HB3ACYS A 57 32.585 45.069 46.619 0.50 16.70 H new ATOM 0 HB3BCYS A 57 32.287 44.840 46.590 0.50 16.70 H new ATOM 0 HG BCYS A 57 34.995 44.989 46.422 0.50 18.73 H new ATOM 476 N ASP A 58 31.843 47.539 43.752 1.00 15.85 N ATOM 477 CA ASP A 58 31.831 47.419 42.305 1.00 17.51 C ATOM 478 C ASP A 58 33.093 46.669 41.853 1.00 16.57 C ATOM 479 O ASP A 58 34.220 47.184 41.971 1.00 16.70 O ATOM 480 CB ASP A 58 31.749 48.800 41.655 1.00 19.07 C ATOM 481 CG ASP A 58 31.408 48.732 40.173 1.00 19.00 C ATOM 482 OD1 ASP A 58 32.019 47.931 39.458 1.00 16.88 O ATOM 483 OD2 ASP A 58 30.540 49.490 39.724 1.00 20.41 O ATOM 0 H AASP A 58 32.021 48.330 44.040 0.50 15.85 H new ATOM 0 H BASP A 58 32.037 48.322 44.049 0.50 15.85 H new ATOM 0 HA ASP A 58 31.049 46.917 42.026 1.00 17.51 H new ATOM 0 HB2 ASP A 58 31.078 49.330 42.113 1.00 19.07 H new ATOM 0 HB3 ASP A 58 32.597 49.257 41.767 1.00 19.07 H new ATOM 484 N LEU A 59 32.881 45.466 41.308 1.00 15.13 N ATOM 485 CA LEU A 59 33.967 44.608 40.855 1.00 14.78 C ATOM 486 C LEU A 59 34.090 44.452 39.341 1.00 14.33 C ATOM 487 O LEU A 59 34.858 43.633 38.857 1.00 14.22 O ATOM 488 CB LEU A 59 33.845 43.246 41.544 1.00 16.16 C ATOM 489 CG LEU A 59 34.085 43.278 43.071 1.00 15.94 C ATOM 490 CD1 LEU A 59 33.480 42.034 43.706 1.00 15.54 C ATOM 491 CD2 LEU A 59 35.611 43.418 43.385 1.00 14.56 C ATOM 0 H LEU A 59 32.098 45.129 41.193 1.00 15.13 H new ATOM 0 HA LEU A 59 34.790 45.053 41.110 1.00 14.78 H new ATOM 0 HB2 LEU A 59 32.959 42.888 41.374 1.00 16.16 H new ATOM 0 HB3 LEU A 59 34.480 42.634 41.141 1.00 16.16 H new ATOM 0 HG LEU A 59 33.647 44.054 43.454 1.00 15.94 H new ATOM 0 HD11 LEU A 59 33.630 42.054 44.664 1.00 15.54 H new ATOM 0 HD12 LEU A 59 32.527 42.011 43.529 1.00 15.54 H new ATOM 0 HD13 LEU A 59 33.897 41.243 43.330 1.00 15.54 H new ATOM 0 HD21 LEU A 59 35.744 43.436 44.346 1.00 14.56 H new ATOM 0 HD22 LEU A 59 36.090 42.664 43.007 1.00 14.56 H new ATOM 0 HD23 LEU A 59 35.947 44.241 42.997 1.00 14.56 H new ATOM 492 N THR A 60 33.435 45.343 38.611 1.00 15.90 N ATOM 493 CA THR A 60 33.433 45.334 37.145 1.00 15.85 C ATOM 494 C THR A 60 34.817 45.306 36.490 1.00 16.90 C ATOM 495 O THR A 60 35.049 44.499 35.593 1.00 16.86 O ATOM 496 CB THR A 60 32.633 46.550 36.573 1.00 13.38 C ATOM 497 OG1 THR A 60 31.330 46.590 37.156 1.00 15.30 O ATOM 498 CG2 THR A 60 32.484 46.415 35.082 1.00 14.46 C ATOM 0 H THR A 60 32.971 45.981 38.953 1.00 15.90 H new ATOM 0 HA THR A 60 33.002 44.495 36.919 1.00 15.85 H new ATOM 0 HB THR A 60 33.118 47.364 36.783 1.00 13.38 H new ATOM 0 HG1 THR A 60 31.364 46.995 37.891 1.00 15.30 H new ATOM 0 HG21 THR A 60 31.987 47.173 34.736 1.00 14.46 H new ATOM 0 HG22 THR A 60 33.362 46.389 34.670 1.00 14.46 H new ATOM 0 HG23 THR A 60 32.007 45.596 34.877 1.00 14.46 H new ATOM 499 N ASP A 61 35.736 46.162 36.948 1.00 15.97 N ATOM 500 CA ASP A 61 37.077 46.229 36.367 1.00 18.56 C ATOM 501 C ASP A 61 37.875 44.937 36.403 1.00 17.86 C ATOM 502 O ASP A 61 38.761 44.742 35.575 1.00 16.86 O ATOM 503 CB ASP A 61 37.896 47.324 37.034 1.00 23.79 C ATOM 504 CG ASP A 61 37.286 48.696 36.854 1.00 34.75 C ATOM 505 OD1 ASP A 61 36.349 48.821 36.035 1.00 37.88 O ATOM 506 OD2 ASP A 61 37.727 49.651 37.546 1.00 39.71 O ATOM 0 H ASP A 61 35.601 46.712 37.595 1.00 15.97 H new ATOM 0 HA ASP A 61 36.917 46.422 35.430 1.00 18.56 H new ATOM 0 HB2 ASP A 61 37.977 47.131 37.981 1.00 23.79 H new ATOM 0 HB3 ASP A 61 38.794 47.322 36.666 1.00 23.79 H new ATOM 507 N GLU A 62 37.616 44.090 37.399 1.00 16.68 N ATOM 508 CA GLU A 62 38.322 42.812 37.504 1.00 15.89 C ATOM 509 C GLU A 62 37.636 41.719 36.696 1.00 15.04 C ATOM 510 O GLU A 62 38.277 41.042 35.895 1.00 16.30 O ATOM 511 CB GLU A 62 38.426 42.361 38.963 1.00 16.20 C ATOM 512 CG GLU A 62 39.376 43.217 39.835 1.00 19.23 C ATOM 513 CD GLU A 62 40.809 43.301 39.292 1.00 23.05 C ATOM 514 OE1 GLU A 62 41.328 42.296 38.758 1.00 24.90 O ATOM 515 OE2 GLU A 62 41.431 44.379 39.405 1.00 25.50 O ATOM 0 H GLU A 62 37.039 44.235 38.020 1.00 16.68 H new ATOM 0 HA GLU A 62 39.211 42.955 37.143 1.00 15.89 H new ATOM 0 HB2 GLU A 62 37.540 42.377 39.358 1.00 16.20 H new ATOM 0 HB3 GLU A 62 38.729 41.440 38.984 1.00 16.20 H new ATOM 0 HG2 GLU A 62 39.014 44.114 39.908 1.00 19.23 H new ATOM 0 HG3 GLU A 62 39.400 42.847 40.731 1.00 19.23 H new ATOM 516 N ILE A 63 36.323 41.575 36.878 1.00 14.95 N ATOM 517 CA ILE A 63 35.584 40.516 36.188 1.00 14.78 C ATOM 518 C ILE A 63 35.603 40.629 34.663 1.00 15.99 C ATOM 519 O ILE A 63 35.502 39.621 33.964 1.00 15.75 O ATOM 520 CB ILE A 63 34.142 40.344 36.731 1.00 14.72 C ATOM 521 CG1 ILE A 63 33.240 41.525 36.361 1.00 13.50 C ATOM 522 CG2 ILE A 63 34.187 40.193 38.264 1.00 15.13 C ATOM 523 CD1 ILE A 63 32.314 41.273 35.174 1.00 13.97 C ATOM 0 H ILE A 63 35.846 42.074 37.391 1.00 14.95 H new ATOM 0 HA ILE A 63 36.072 39.704 36.396 1.00 14.78 H new ATOM 0 HB ILE A 63 33.766 39.549 36.322 1.00 14.72 H new ATOM 0 HG12 ILE A 63 32.700 41.758 37.133 1.00 13.50 H new ATOM 0 HG13 ILE A 63 33.798 42.293 36.163 1.00 13.50 H new ATOM 0 HG21 ILE A 63 33.285 40.085 38.605 1.00 15.13 H new ATOM 0 HG22 ILE A 63 34.716 39.414 38.497 1.00 15.13 H new ATOM 0 HG23 ILE A 63 34.588 40.985 38.656 1.00 15.13 H new ATOM 0 HD11 ILE A 63 31.780 42.065 35.006 1.00 13.97 H new ATOM 0 HD12 ILE A 63 32.844 41.068 34.388 1.00 13.97 H new ATOM 0 HD13 ILE A 63 31.729 40.525 35.373 1.00 13.97 H new ATOM 524 N VAL A 64 35.768 41.842 34.133 1.00 16.79 N ATOM 525 CA VAL A 64 35.797 41.959 32.684 1.00 16.99 C ATOM 526 C VAL A 64 37.131 41.526 32.110 1.00 17.57 C ATOM 527 O VAL A 64 37.231 41.307 30.900 1.00 19.09 O ATOM 528 CB VAL A 64 35.398 43.364 32.156 1.00 16.37 C ATOM 529 CG1 VAL A 64 33.946 43.658 32.521 1.00 15.01 C ATOM 530 CG2 VAL A 64 36.348 44.449 32.671 1.00 16.23 C ATOM 0 H VAL A 64 35.861 42.575 34.574 1.00 16.79 H new ATOM 0 HA VAL A 64 35.113 41.348 32.369 1.00 16.99 H new ATOM 0 HB VAL A 64 35.477 43.368 31.189 1.00 16.37 H new ATOM 0 HG11 VAL A 64 33.700 44.536 32.190 1.00 15.01 H new ATOM 0 HG12 VAL A 64 33.370 42.989 32.120 1.00 15.01 H new ATOM 0 HG13 VAL A 64 33.844 43.636 33.485 1.00 15.01 H new ATOM 0 HG21 VAL A 64 36.072 45.312 32.324 1.00 16.23 H new ATOM 0 HG22 VAL A 64 36.323 44.468 33.641 1.00 16.23 H new ATOM 0 HG23 VAL A 64 37.251 44.256 32.375 1.00 16.23 H new ATOM 531 N LYS A 65 38.132 41.340 32.971 1.00 17.87 N ATOM 532 CA LYS A 65 39.450 40.927 32.493 1.00 19.75 C ATOM 533 C LYS A 65 39.370 39.617 31.743 1.00 21.26 C ATOM 534 O LYS A 65 40.155 39.382 30.825 1.00 22.07 O ATOM 535 CB LYS A 65 40.454 40.904 33.625 1.00 20.53 C ATOM 536 CG LYS A 65 40.773 42.333 34.031 1.00 23.34 C ATOM 537 CD LYS A 65 41.562 42.460 35.314 1.00 26.04 C ATOM 538 CE LYS A 65 41.729 43.933 35.626 1.00 28.28 C ATOM 539 NZ LYS A 65 42.713 44.157 36.698 1.00 32.29 N ATOM 0 H LYS A 65 38.070 41.446 33.822 1.00 17.87 H new ATOM 0 HA LYS A 65 39.770 41.586 31.857 1.00 19.75 H new ATOM 0 HB2 LYS A 65 40.096 40.413 34.381 1.00 20.53 H new ATOM 0 HB3 LYS A 65 41.263 40.446 33.347 1.00 20.53 H new ATOM 0 HG2 LYS A 65 41.272 42.757 33.315 1.00 23.34 H new ATOM 0 HG3 LYS A 65 39.941 42.823 34.126 1.00 23.34 H new ATOM 0 HD2 LYS A 65 41.101 42.011 36.040 1.00 26.04 H new ATOM 0 HD3 LYS A 65 42.428 42.034 35.221 1.00 26.04 H new ATOM 0 HE2 LYS A 65 42.010 44.403 34.826 1.00 28.28 H new ATOM 0 HE3 LYS A 65 40.873 44.307 35.889 1.00 28.28 H new ATOM 0 HZ1 LYS A 65 42.294 44.436 37.432 1.00 32.29 H new ATOM 0 HZ2 LYS A 65 43.141 43.396 36.872 1.00 32.29 H new ATOM 0 HZ3 LYS A 65 43.300 44.774 36.439 1.00 32.29 H new ATOM 540 N ASP A 66 38.427 38.762 32.143 1.00 20.24 N ATOM 541 CA ASP A 66 38.159 37.519 31.429 1.00 18.60 C ATOM 542 C ASP A 66 36.741 37.152 31.794 1.00 17.68 C ATOM 543 O ASP A 66 36.505 36.592 32.861 1.00 16.93 O ATOM 544 CB ASP A 66 39.101 36.383 31.794 1.00 20.63 C ATOM 545 CG ASP A 66 38.930 35.161 30.866 1.00 24.42 C ATOM 546 OD1 ASP A 66 37.873 35.008 30.182 1.00 24.68 O ATOM 547 OD2 ASP A 66 39.877 34.359 30.796 1.00 27.92 O ATOM 0 H ASP A 66 37.929 38.888 32.833 1.00 20.24 H new ATOM 0 HA ASP A 66 38.292 37.654 30.478 1.00 18.60 H new ATOM 0 HB2 ASP A 66 40.017 36.697 31.746 1.00 20.63 H new ATOM 0 HB3 ASP A 66 38.941 36.115 32.712 1.00 20.63 H new ATOM 548 N VAL A 67 35.804 37.433 30.892 1.00 15.60 N ATOM 549 CA VAL A 67 34.405 37.162 31.175 1.00 14.58 C ATOM 550 C VAL A 67 33.994 35.695 31.287 1.00 15.71 C ATOM 551 O VAL A 67 32.969 35.400 31.889 1.00 15.48 O ATOM 552 CB VAL A 67 33.446 37.911 30.210 1.00 14.75 C ATOM 553 CG1 VAL A 67 33.602 39.423 30.385 1.00 15.28 C ATOM 554 CG2 VAL A 67 33.670 37.479 28.737 1.00 15.59 C ATOM 0 H VAL A 67 35.958 37.777 30.119 1.00 15.60 H new ATOM 0 HA VAL A 67 34.313 37.515 32.074 1.00 14.58 H new ATOM 0 HB VAL A 67 32.534 37.671 30.436 1.00 14.75 H new ATOM 0 HG11 VAL A 67 33.000 39.883 29.779 1.00 15.28 H new ATOM 0 HG12 VAL A 67 33.389 39.667 31.299 1.00 15.28 H new ATOM 0 HG13 VAL A 67 34.517 39.679 30.188 1.00 15.28 H new ATOM 0 HG21 VAL A 67 33.058 37.963 28.161 1.00 15.59 H new ATOM 0 HG22 VAL A 67 34.583 37.677 28.477 1.00 15.59 H new ATOM 0 HG23 VAL A 67 33.509 36.526 28.651 1.00 15.59 H new ATOM 555 N LYS A 68 34.769 34.787 30.693 1.00 17.93 N ATOM 556 CA LYS A 68 34.471 33.340 30.755 1.00 16.19 C ATOM 557 C LYS A 68 35.115 32.630 31.933 1.00 17.34 C ATOM 558 O LYS A 68 35.000 31.417 32.080 1.00 17.93 O ATOM 559 CB LYS A 68 34.868 32.639 29.471 1.00 14.63 C ATOM 560 CG LYS A 68 34.011 33.081 28.315 1.00 16.06 C ATOM 561 CD LYS A 68 34.182 32.184 27.087 1.00 15.87 C ATOM 562 CE LYS A 68 33.294 32.624 25.960 1.00 17.21 C ATOM 563 NZ LYS A 68 33.560 31.810 24.740 1.00 22.35 N ATOM 0 H LYS A 68 35.477 34.983 30.245 1.00 17.93 H new ATOM 0 HA LYS A 68 33.510 33.287 30.878 1.00 16.19 H new ATOM 0 HB2 LYS A 68 35.800 32.824 29.274 1.00 14.63 H new ATOM 0 HB3 LYS A 68 34.788 31.679 29.587 1.00 14.63 H new ATOM 0 HG2 LYS A 68 33.080 33.079 28.587 1.00 16.06 H new ATOM 0 HG3 LYS A 68 34.236 33.995 28.079 1.00 16.06 H new ATOM 0 HD2 LYS A 68 35.108 32.202 26.798 1.00 15.87 H new ATOM 0 HD3 LYS A 68 33.976 31.266 27.324 1.00 15.87 H new ATOM 0 HE2 LYS A 68 32.364 32.534 26.219 1.00 17.21 H new ATOM 0 HE3 LYS A 68 33.445 33.563 25.769 1.00 17.21 H new ATOM 0 HZ1 LYS A 68 33.510 32.330 24.019 1.00 22.35 H new ATOM 0 HZ2 LYS A 68 34.374 31.453 24.792 1.00 22.35 H new ATOM 0 HZ3 LYS A 68 32.955 31.160 24.679 1.00 22.35 H new ATOM 564 N GLN A 69 35.847 33.386 32.734 1.00 17.73 N ATOM 565 CA GLN A 69 36.483 32.863 33.921 1.00 17.60 C ATOM 566 C GLN A 69 35.402 32.830 35.034 1.00 17.86 C ATOM 567 O GLN A 69 34.325 33.438 34.888 1.00 16.41 O ATOM 568 CB GLN A 69 37.650 33.795 34.274 1.00 19.10 C ATOM 569 CG GLN A 69 38.459 33.418 35.453 1.00 24.01 C ATOM 570 CD GLN A 69 39.093 32.054 35.308 1.00 24.84 C ATOM 571 OE1 GLN A 69 38.552 31.069 35.785 1.00 26.46 O ATOM 572 NE2 GLN A 69 40.243 31.995 34.659 1.00 25.22 N ATOM 0 H GLN A 69 35.988 34.224 32.600 1.00 17.73 H new ATOM 0 HA GLN A 69 36.838 31.968 33.803 1.00 17.60 H new ATOM 0 HB2 GLN A 69 38.239 33.849 33.505 1.00 19.10 H new ATOM 0 HB3 GLN A 69 37.294 34.685 34.421 1.00 19.10 H new ATOM 0 HG2 GLN A 69 39.153 34.081 35.590 1.00 24.01 H new ATOM 0 HG3 GLN A 69 37.897 33.428 36.244 1.00 24.01 H new ATOM 0 HE21 GLN A 69 40.592 32.712 34.337 1.00 25.22 H new ATOM 0 HE22 GLN A 69 40.642 31.240 34.559 1.00 25.22 H new ATOM 573 N THR A 70 35.639 32.029 36.075 1.00 17.39 N ATOM 574 CA THR A 70 34.742 31.950 37.231 1.00 17.81 C ATOM 575 C THR A 70 35.465 32.673 38.384 1.00 17.49 C ATOM 576 O THR A 70 36.637 32.413 38.658 1.00 18.67 O ATOM 577 CB THR A 70 34.446 30.476 37.624 1.00 21.01 C ATOM 578 OG1 THR A 70 33.743 29.838 36.546 1.00 21.45 O ATOM 579 CG2 THR A 70 33.601 30.389 38.947 1.00 18.94 C ATOM 0 H THR A 70 36.326 31.515 36.131 1.00 17.39 H new ATOM 0 HA THR A 70 33.886 32.359 37.027 1.00 17.81 H new ATOM 0 HB THR A 70 35.288 30.024 37.787 1.00 21.01 H new ATOM 0 HG1 THR A 70 32.997 30.209 36.440 1.00 21.45 H new ATOM 0 HG21 THR A 70 33.434 29.458 39.164 1.00 18.94 H new ATOM 0 HG22 THR A 70 34.091 30.807 39.672 1.00 18.94 H new ATOM 0 HG23 THR A 70 32.756 30.848 38.822 1.00 18.94 H new ATOM 580 N TYR A 71 34.759 33.586 39.037 1.00 18.25 N ATOM 581 CA TYR A 71 35.310 34.395 40.135 1.00 18.35 C ATOM 582 C TYR A 71 34.674 34.104 41.511 1.00 18.44 C ATOM 583 O TYR A 71 33.506 33.708 41.626 1.00 17.44 O ATOM 584 CB TYR A 71 35.112 35.907 39.824 1.00 15.87 C ATOM 585 CG TYR A 71 35.800 36.389 38.568 1.00 15.25 C ATOM 586 CD1 TYR A 71 35.197 36.241 37.319 1.00 14.87 C ATOM 587 CD2 TYR A 71 37.100 36.908 38.614 1.00 14.88 C ATOM 588 CE1 TYR A 71 35.881 36.584 36.146 1.00 13.55 C ATOM 589 CE2 TYR A 71 37.788 37.253 37.455 1.00 14.27 C ATOM 590 CZ TYR A 71 37.175 37.083 36.223 1.00 13.61 C ATOM 591 OH TYR A 71 37.861 37.370 35.058 1.00 16.66 O ATOM 0 H TYR A 71 33.936 33.761 38.858 1.00 18.25 H new ATOM 0 HA TYR A 71 36.248 34.156 40.191 1.00 18.35 H new ATOM 0 HB2 TYR A 71 34.162 36.087 39.747 1.00 15.87 H new ATOM 0 HB3 TYR A 71 35.439 36.425 40.576 1.00 15.87 H new ATOM 0 HD1 TYR A 71 34.330 35.910 37.264 1.00 14.87 H new ATOM 0 HD2 TYR A 71 37.513 37.025 39.439 1.00 14.88 H new ATOM 0 HE1 TYR A 71 35.470 36.478 35.318 1.00 13.55 H new ATOM 0 HE2 TYR A 71 38.651 37.595 37.506 1.00 14.27 H new ATOM 0 HH TYR A 71 37.410 37.114 34.397 1.00 16.66 H new ATOM 592 N LEU A 72 35.451 34.384 42.547 1.00 19.73 N ATOM 593 CA LEU A 72 35.023 34.250 43.939 1.00 20.18 C ATOM 594 C LEU A 72 35.451 35.545 44.625 1.00 19.36 C ATOM 595 O LEU A 72 36.538 36.076 44.336 1.00 19.56 O ATOM 596 CB LEU A 72 35.743 33.087 44.630 1.00 22.78 C ATOM 597 CG LEU A 72 35.187 31.676 44.399 1.00 28.06 C ATOM 598 CD1 LEU A 72 36.177 30.633 44.926 1.00 30.46 C ATOM 599 CD2 LEU A 72 33.811 31.525 45.071 1.00 28.82 C ATOM 0 H LEU A 72 36.260 34.664 42.463 1.00 19.73 H new ATOM 0 HA LEU A 72 34.068 34.084 43.986 1.00 20.18 H new ATOM 0 HB2 LEU A 72 36.669 33.095 44.343 1.00 22.78 H new ATOM 0 HB3 LEU A 72 35.740 33.258 45.585 1.00 22.78 H new ATOM 0 HG LEU A 72 35.070 31.532 43.447 1.00 28.06 H new ATOM 0 HD11 LEU A 72 35.820 29.743 44.777 1.00 30.46 H new ATOM 0 HD12 LEU A 72 37.022 30.724 44.459 1.00 30.46 H new ATOM 0 HD13 LEU A 72 36.317 30.770 45.876 1.00 30.46 H new ATOM 0 HD21 LEU A 72 33.472 30.629 44.917 1.00 28.82 H new ATOM 0 HD22 LEU A 72 33.898 31.678 46.025 1.00 28.82 H new ATOM 0 HD23 LEU A 72 33.194 32.173 44.695 1.00 28.82 H new ATOM 600 N ALA A 73 34.564 36.098 45.446 1.00 17.48 N ATOM 601 CA ALA A 73 34.871 37.292 46.222 1.00 15.91 C ATOM 602 C ALA A 73 34.890 36.862 47.712 1.00 17.75 C ATOM 603 O ALA A 73 34.332 35.822 48.087 1.00 17.28 O ATOM 604 CB ALA A 73 33.814 38.350 45.990 1.00 14.10 C ATOM 0 H ALA A 73 33.770 35.792 45.568 1.00 17.48 H new ATOM 0 HA ALA A 73 35.725 37.671 45.960 1.00 15.91 H new ATOM 0 HB1 ALA A 73 34.027 39.140 46.511 1.00 14.10 H new ATOM 0 HB2 ALA A 73 33.788 38.581 45.048 1.00 14.10 H new ATOM 0 HB3 ALA A 73 32.948 38.008 46.262 1.00 14.10 H new ATOM 605 N ARG A 74 35.618 37.597 48.538 1.00 17.58 N ATOM 606 CA ARG A 74 35.650 37.321 49.963 1.00 18.41 C ATOM 607 C ARG A 74 35.615 38.649 50.724 1.00 18.53 C ATOM 608 O ARG A 74 36.262 39.628 50.311 1.00 18.45 O ATOM 609 CB AARG A 74 36.722 36.332 50.431 0.50 18.42 C ATOM 610 CB BARG A 74 36.982 36.584 50.206 0.50 18.76 C ATOM 611 CG AARG A 74 38.149 36.717 50.321 0.50 16.32 C ATOM 612 CG BARG A 74 37.486 36.448 51.618 0.50 17.79 C ATOM 613 CD AARG A 74 38.976 35.794 51.214 0.50 16.90 C ATOM 614 CD BARG A 74 38.625 35.419 51.659 0.50 18.12 C ATOM 615 NE AARG A 74 38.547 34.391 51.170 0.50 15.91 N ATOM 616 NE BARG A 74 39.968 35.957 51.411 0.50 18.12 N ATOM 617 CZ AARG A 74 39.351 33.357 51.403 0.50 13.89 C ATOM 618 CZ BARG A 74 41.060 35.204 51.298 0.50 15.59 C ATOM 619 NH1AARG A 74 40.624 33.577 51.689 0.50 15.37 N ATOM 620 NH1BARG A 74 40.963 33.889 51.385 0.50 15.81 N ATOM 621 NH2AARG A 74 38.888 32.112 51.349 0.50 12.21 N ATOM 622 NH2BARG A 74 42.259 35.762 51.186 0.50 15.20 N ATOM 0 H ARG A 74 36.103 38.263 48.292 1.00 17.58 H new ATOM 0 HA ARG A 74 34.850 36.818 50.182 1.00 18.41 H new ATOM 0 HB2AARG A 74 36.545 36.126 51.362 0.50 18.76 H new ATOM 0 HB2BARG A 74 36.896 35.691 49.837 0.50 18.76 H new ATOM 0 HB3AARG A 74 36.601 35.510 49.931 0.50 18.76 H new ATOM 0 HB3BARG A 74 37.668 37.038 49.691 0.50 18.76 H new ATOM 0 HG2AARG A 74 38.446 36.648 49.400 0.50 17.79 H new ATOM 0 HG2BARG A 74 37.801 37.306 51.943 0.50 17.79 H new ATOM 0 HG3AARG A 74 38.270 37.641 50.590 0.50 17.79 H new ATOM 0 HG3BARG A 74 36.765 36.170 52.204 0.50 17.79 H new ATOM 0 HD2AARG A 74 39.907 35.848 50.947 0.50 18.12 H new ATOM 0 HD2BARG A 74 38.621 34.989 52.528 0.50 18.12 H new ATOM 0 HD3AARG A 74 38.925 36.111 52.129 0.50 18.12 H new ATOM 0 HD3BARG A 74 38.442 34.730 51.001 0.50 18.12 H new ATOM 0 HE AARG A 74 37.724 34.227 50.982 0.50 18.12 H new ATOM 0 HE BARG A 74 40.055 36.809 51.334 0.50 18.12 H new ATOM 0 HH11AARG A 74 40.924 34.382 51.723 0.50 15.81 H new ATOM 0 HH11BARG A 74 40.196 33.522 51.514 0.50 15.81 H new ATOM 0 HH12AARG A 74 41.151 32.915 51.841 0.50 15.81 H new ATOM 0 HH12BARG A 74 41.667 33.400 51.312 0.50 15.81 H new ATOM 0 HH21AARG A 74 38.061 31.969 51.162 0.50 15.20 H new ATOM 0 HH21BARG A 74 42.336 36.619 51.186 0.50 15.20 H new ATOM 0 HH22AARG A 74 39.416 31.450 51.501 0.50 15.20 H new ATOM 0 HH22BARG A 74 42.959 35.267 51.114 0.50 15.20 H new ATOM 623 N VAL A 75 34.708 38.724 51.704 1.00 16.40 N ATOM 624 CA VAL A 75 34.520 39.928 52.513 1.00 17.59 C ATOM 625 C VAL A 75 35.057 39.749 53.942 1.00 18.43 C ATOM 626 O VAL A 75 34.560 38.911 54.684 1.00 17.53 O ATOM 627 CB VAL A 75 32.999 40.319 52.594 1.00 15.20 C ATOM 628 CG1 VAL A 75 32.798 41.600 53.424 1.00 14.54 C ATOM 629 CG2 VAL A 75 32.409 40.486 51.196 1.00 15.02 C ATOM 0 H VAL A 75 34.185 38.075 51.916 1.00 16.40 H new ATOM 0 HA VAL A 75 35.020 40.634 52.075 1.00 17.59 H new ATOM 0 HB VAL A 75 32.530 39.597 53.040 1.00 15.20 H new ATOM 0 HG11 VAL A 75 31.854 41.819 53.458 1.00 14.54 H new ATOM 0 HG12 VAL A 75 33.129 41.458 54.324 1.00 14.54 H new ATOM 0 HG13 VAL A 75 33.284 42.332 53.013 1.00 14.54 H new ATOM 0 HG21 VAL A 75 31.472 40.727 51.267 1.00 15.02 H new ATOM 0 HG22 VAL A 75 32.887 41.186 50.724 1.00 15.02 H new ATOM 0 HG23 VAL A 75 32.492 39.652 50.708 1.00 15.02 H new ATOM 630 N PHE A 76 36.068 40.539 54.309 1.00 18.85 N ATOM 631 CA PHE A 76 36.641 40.514 55.662 1.00 19.71 C ATOM 632 C PHE A 76 36.013 41.605 56.548 1.00 19.77 C ATOM 633 O PHE A 76 35.650 42.695 56.074 1.00 18.24 O ATOM 634 CB PHE A 76 38.152 40.802 55.640 1.00 20.34 C ATOM 635 CG PHE A 76 38.986 39.741 54.989 1.00 20.24 C ATOM 636 CD1 PHE A 76 39.160 39.724 53.598 1.00 19.21 C ATOM 637 CD2 PHE A 76 39.647 38.803 55.766 1.00 20.62 C ATOM 638 CE1 PHE A 76 39.983 38.801 52.988 1.00 20.56 C ATOM 639 CE2 PHE A 76 40.483 37.860 55.179 1.00 23.40 C ATOM 640 CZ PHE A 76 40.658 37.855 53.767 1.00 23.82 C ATOM 0 H PHE A 76 36.443 41.106 53.782 1.00 18.85 H new ATOM 0 HA PHE A 76 36.462 39.627 56.011 1.00 19.71 H new ATOM 0 HB2 PHE A 76 38.301 41.642 55.178 1.00 20.34 H new ATOM 0 HB3 PHE A 76 38.459 40.922 56.552 1.00 20.34 H new ATOM 0 HD1 PHE A 76 38.711 40.349 53.076 1.00 19.21 H new ATOM 0 HD2 PHE A 76 39.530 38.804 56.689 1.00 20.62 H new ATOM 0 HE1 PHE A 76 40.089 38.807 52.064 1.00 20.56 H new ATOM 0 HE2 PHE A 76 40.926 37.235 55.707 1.00 23.40 H new ATOM 0 HZ PHE A 76 41.216 37.229 53.366 1.00 23.82 H new ATOM 641 N SER A 77 35.941 41.332 57.846 1.00 21.11 N ATOM 642 CA SER A 77 35.427 42.325 58.793 1.00 21.65 C ATOM 643 C SER A 77 36.574 42.702 59.719 1.00 21.53 C ATOM 644 O SER A 77 37.254 41.821 60.239 1.00 22.60 O ATOM 645 CB SER A 77 34.281 41.760 59.623 1.00 21.98 C ATOM 646 OG SER A 77 33.141 41.589 58.813 1.00 21.22 O ATOM 0 H SER A 77 36.181 40.586 58.200 1.00 21.11 H new ATOM 0 HA SER A 77 35.089 43.093 58.307 1.00 21.65 H new ATOM 0 HB2 SER A 77 34.541 40.911 60.012 1.00 21.98 H new ATOM 0 HB3 SER A 77 34.078 42.359 60.359 1.00 21.98 H new ATOM 0 HG SER A 77 32.491 41.354 59.290 1.00 21.22 H new ATOM 647 N TYR A 78 36.804 44.003 59.887 1.00 22.07 N ATOM 648 CA TYR A 78 37.870 44.522 60.742 1.00 20.70 C ATOM 649 C TYR A 78 37.294 45.485 61.771 1.00 21.34 C ATOM 650 O TYR A 78 36.360 46.239 61.469 1.00 19.53 O ATOM 651 CB TYR A 78 38.894 45.278 59.906 1.00 20.30 C ATOM 652 CG TYR A 78 39.752 44.410 59.032 1.00 22.42 C ATOM 653 CD1 TYR A 78 40.819 43.709 59.568 1.00 23.53 C ATOM 654 CD2 TYR A 78 39.511 44.302 57.659 1.00 21.44 C ATOM 655 CE1 TYR A 78 41.630 42.926 58.764 1.00 26.15 C ATOM 656 CE2 TYR A 78 40.319 43.526 56.848 1.00 22.99 C ATOM 657 CZ TYR A 78 41.371 42.839 57.407 1.00 25.39 C ATOM 658 OH TYR A 78 42.182 42.046 56.640 1.00 30.61 O ATOM 0 H TYR A 78 36.340 44.616 59.503 1.00 22.07 H new ATOM 0 HA TYR A 78 38.293 43.771 61.187 1.00 20.70 H new ATOM 0 HB2 TYR A 78 38.428 45.919 59.347 1.00 20.30 H new ATOM 0 HB3 TYR A 78 39.468 45.785 60.501 1.00 20.30 H new ATOM 0 HD1 TYR A 78 40.993 43.765 60.480 1.00 23.53 H new ATOM 0 HD2 TYR A 78 38.794 44.761 57.284 1.00 21.44 H new ATOM 0 HE1 TYR A 78 42.345 42.461 59.134 1.00 26.15 H new ATOM 0 HE2 TYR A 78 40.153 43.469 55.935 1.00 22.99 H new ATOM 0 HH TYR A 78 42.474 41.411 57.105 1.00 30.61 H new ATOM 659 N PRO A 79 37.827 45.460 63.016 1.00 23.00 N ATOM 660 CA PRO A 79 37.306 46.384 64.035 1.00 23.69 C ATOM 661 C PRO A 79 37.588 47.820 63.563 1.00 23.73 C ATOM 662 O PRO A 79 38.544 48.046 62.808 1.00 24.76 O ATOM 663 CB PRO A 79 38.122 46.017 65.287 1.00 23.43 C ATOM 664 CG PRO A 79 39.395 45.429 64.729 1.00 23.88 C ATOM 665 CD PRO A 79 38.911 44.614 63.553 1.00 23.48 C ATOM 0 HA PRO A 79 36.352 46.324 64.201 1.00 23.69 H new ATOM 0 HB2 PRO A 79 38.301 46.796 65.836 1.00 23.43 H new ATOM 0 HB3 PRO A 79 37.650 45.379 65.845 1.00 23.43 H new ATOM 0 HG2 PRO A 79 40.019 46.119 64.454 1.00 23.88 H new ATOM 0 HG3 PRO A 79 39.852 44.878 65.383 1.00 23.88 H new ATOM 0 HD2 PRO A 79 39.613 44.466 62.900 1.00 23.48 H new ATOM 0 HD3 PRO A 79 38.589 43.741 63.825 1.00 23.48 H new ATOM 666 N ALA A 80 36.723 48.764 63.927 1.00 22.78 N ATOM 667 CA ALA A 80 36.908 50.153 63.530 1.00 23.56 C ATOM 668 C ALA A 80 36.810 51.087 64.736 1.00 25.94 C ATOM 669 O ALA A 80 35.899 50.939 65.550 1.00 29.51 O ATOM 670 CB ALA A 80 35.877 50.542 62.491 1.00 22.49 C ATOM 0 H ALA A 80 36.023 48.619 64.404 1.00 22.78 H new ATOM 0 HA ALA A 80 37.795 50.240 63.148 1.00 23.56 H new ATOM 0 HB1 ALA A 80 36.009 51.468 62.234 1.00 22.49 H new ATOM 0 HB2 ALA A 80 35.973 49.974 61.711 1.00 22.49 H new ATOM 0 HB3 ALA A 80 34.987 50.434 62.862 1.00 22.49 H new ATOM 671 N GLY A 81 37.732 52.049 64.849 1.00 22.83 N ATOM 672 CA GLY A 81 37.698 52.984 65.961 1.00 21.20 C ATOM 673 C GLY A 81 38.556 52.582 67.149 1.00 22.30 C ATOM 674 O GLY A 81 39.346 51.630 67.080 1.00 21.44 O ATOM 0 H GLY A 81 38.377 52.171 64.294 1.00 22.83 H new ATOM 0 HA2 GLY A 81 37.989 53.854 65.646 1.00 21.20 H new ATOM 0 HA3 GLY A 81 36.780 53.082 66.258 1.00 21.20 H new ATOM 675 N ASN A 82 38.395 53.317 68.248 1.00 23.53 N ATOM 676 CA ASN A 82 39.164 53.086 69.480 1.00 25.15 C ATOM 677 C ASN A 82 38.572 51.867 70.195 1.00 24.80 C ATOM 678 O ASN A 82 37.593 51.954 70.939 1.00 23.15 O ATOM 679 CB ASN A 82 39.145 54.368 70.344 1.00 26.65 C ATOM 680 CG ASN A 82 40.296 54.428 71.349 1.00 27.62 C ATOM 681 OD1 ASN A 82 40.625 53.440 71.981 1.00 29.22 O ATOM 682 ND2 ASN A 82 40.885 55.599 71.510 1.00 27.15 N ATOM 0 H ASN A 82 37.835 53.967 68.304 1.00 23.53 H new ATOM 0 HA ASN A 82 40.096 52.893 69.290 1.00 25.15 H new ATOM 0 HB2 ASN A 82 39.188 55.144 69.764 1.00 26.65 H new ATOM 0 HB3 ASN A 82 38.302 54.418 70.822 1.00 26.65 H new ATOM 0 HD21 ASN A 82 41.526 55.684 72.078 1.00 27.15 H new ATOM 0 HD22 ASN A 82 40.628 56.277 71.047 1.00 27.15 H new ATOM 683 N VAL A 83 39.176 50.715 69.929 1.00 28.12 N ATOM 684 CA VAL A 83 38.693 49.448 70.466 1.00 31.57 C ATOM 685 C VAL A 83 39.769 48.440 70.882 1.00 33.34 C ATOM 686 O VAL A 83 40.937 48.511 70.458 1.00 30.20 O ATOM 687 CB VAL A 83 37.774 48.686 69.406 1.00 33.06 C ATOM 688 CG1 VAL A 83 36.571 49.543 68.966 1.00 33.17 C ATOM 689 CG2 VAL A 83 38.596 48.231 68.196 1.00 31.33 C ATOM 0 H VAL A 83 39.875 50.645 69.434 1.00 28.12 H new ATOM 0 HA VAL A 83 38.214 49.727 71.262 1.00 31.57 H new ATOM 0 HB VAL A 83 37.419 47.898 69.846 1.00 33.06 H new ATOM 0 HG11 VAL A 83 36.038 49.048 68.324 1.00 33.17 H new ATOM 0 HG12 VAL A 83 36.027 49.759 69.740 1.00 33.17 H new ATOM 0 HG13 VAL A 83 36.890 50.363 68.557 1.00 33.17 H new ATOM 0 HG21 VAL A 83 38.018 47.771 67.567 1.00 31.33 H new ATOM 0 HG22 VAL A 83 38.993 49.004 67.765 1.00 31.33 H new ATOM 0 HG23 VAL A 83 39.298 47.629 68.489 1.00 31.33 H new ATOM 690 N GLU A 84 39.323 47.486 71.710 1.00 36.22 N ATOM 691 CA GLU A 84 40.147 46.368 72.176 1.00 37.46 C ATOM 692 C GLU A 84 39.680 45.161 71.377 1.00 37.32 C ATOM 693 O GLU A 84 38.627 44.587 71.637 1.00 34.48 O ATOM 694 CB GLU A 84 39.995 46.124 73.673 1.00 38.02 C ATOM 695 CG GLU A 84 40.827 47.090 74.521 1.00 43.31 C ATOM 696 CD GLU A 84 42.339 46.844 74.434 1.00 45.16 C ATOM 697 OE1 GLU A 84 42.830 45.895 75.104 1.00 45.02 O ATOM 698 OE2 GLU A 84 43.021 47.617 73.711 1.00 45.55 O ATOM 0 H GLU A 84 38.521 47.473 72.020 1.00 36.22 H new ATOM 0 HA GLU A 84 41.090 46.553 72.041 1.00 37.46 H new ATOM 0 HB2 GLU A 84 39.060 46.210 73.917 1.00 38.02 H new ATOM 0 HB3 GLU A 84 40.259 45.213 73.876 1.00 38.02 H new ATOM 0 HG2 GLU A 84 40.639 47.999 74.239 1.00 43.31 H new ATOM 0 HG3 GLU A 84 40.548 47.017 75.447 1.00 43.31 H new ATOM 699 N SER A 85 40.411 44.924 70.295 1.00 39.05 N ATOM 700 CA SER A 85 40.157 43.849 69.367 1.00 40.15 C ATOM 701 C SER A 85 40.618 42.549 69.996 1.00 44.04 C ATOM 702 O SER A 85 41.818 42.298 70.086 1.00 46.57 O ATOM 703 CB SER A 85 40.944 44.126 68.090 1.00 38.15 C ATOM 704 OG SER A 85 41.040 42.970 67.293 1.00 34.99 O ATOM 0 H SER A 85 41.091 45.405 70.079 1.00 39.05 H new ATOM 0 HA SER A 85 39.212 43.783 69.157 1.00 40.15 H new ATOM 0 HB2 SER A 85 40.512 44.834 67.587 1.00 38.15 H new ATOM 0 HB3 SER A 85 41.833 44.441 68.316 1.00 38.15 H new ATOM 0 HG SER A 85 40.272 42.655 67.163 1.00 34.99 H new ATOM 705 N THR A 86 39.680 41.718 70.440 1.00 45.90 N ATOM 706 CA THR A 86 40.054 40.460 71.070 1.00 46.49 C ATOM 707 C THR A 86 40.071 39.306 70.075 1.00 47.76 C ATOM 708 O THR A 86 40.719 38.288 70.329 1.00 50.25 O ATOM 709 CB THR A 86 39.132 40.140 72.263 1.00 44.93 C ATOM 710 OG1 THR A 86 37.781 40.121 71.797 1.00 47.35 O ATOM 711 CG2 THR A 86 39.266 41.201 73.361 1.00 41.34 C ATOM 0 H THR A 86 38.834 41.862 70.387 1.00 45.90 H new ATOM 0 HA THR A 86 40.958 40.568 71.404 1.00 46.49 H new ATOM 0 HB THR A 86 39.384 39.280 72.635 1.00 44.93 H new ATOM 0 HG1 THR A 86 37.624 39.386 71.423 1.00 47.35 H new ATOM 0 HG21 THR A 86 38.678 40.979 74.100 1.00 41.34 H new ATOM 0 HG22 THR A 86 40.183 41.227 73.675 1.00 41.34 H new ATOM 0 HG23 THR A 86 39.022 42.069 73.004 1.00 41.34 H new ATOM 712 N GLU A 91 43.826 36.434 62.284 1.00 45.22 N ATOM 713 CA GLU A 91 42.743 35.611 61.693 1.00 45.41 C ATOM 714 C GLU A 91 41.372 36.323 61.833 1.00 42.08 C ATOM 715 O GLU A 91 40.502 35.887 62.589 1.00 40.16 O ATOM 716 CB GLU A 91 42.816 34.232 62.361 1.00 50.59 C ATOM 717 CG GLU A 91 41.543 33.424 62.522 1.00 59.32 C ATOM 718 CD GLU A 91 41.700 32.327 63.575 1.00 66.13 C ATOM 719 OE1 GLU A 91 42.830 32.143 64.099 1.00 69.32 O ATOM 720 OE2 GLU A 91 40.689 31.649 63.883 1.00 69.10 O ATOM 0 HA GLU A 91 42.853 35.492 60.737 1.00 45.41 H new ATOM 0 HB2 GLU A 91 43.442 33.693 61.853 1.00 50.59 H new ATOM 0 HB3 GLU A 91 43.199 34.354 63.244 1.00 50.59 H new ATOM 0 HG2 GLU A 91 40.815 34.013 62.774 1.00 59.32 H new ATOM 0 HG3 GLU A 91 41.303 33.025 61.671 1.00 59.32 H new ATOM 721 N PRO A 92 41.172 37.445 61.091 1.00 39.39 N ATOM 722 CA PRO A 92 39.911 38.191 61.154 1.00 35.02 C ATOM 723 C PRO A 92 38.851 37.380 60.473 1.00 31.09 C ATOM 724 O PRO A 92 39.154 36.469 59.702 1.00 29.71 O ATOM 725 CB PRO A 92 40.206 39.461 60.346 1.00 35.26 C ATOM 726 CG PRO A 92 41.096 38.975 59.294 1.00 37.83 C ATOM 727 CD PRO A 92 42.051 38.030 60.060 1.00 39.81 C ATOM 0 HA PRO A 92 39.608 38.386 62.055 1.00 35.02 H new ATOM 0 HB2 PRO A 92 39.397 39.852 59.981 1.00 35.26 H new ATOM 0 HB3 PRO A 92 40.630 40.143 60.890 1.00 35.26 H new ATOM 0 HG2 PRO A 92 40.608 38.507 58.598 1.00 37.83 H new ATOM 0 HG3 PRO A 92 41.576 39.701 58.865 1.00 37.83 H new ATOM 0 HD2 PRO A 92 42.427 37.350 59.479 1.00 39.81 H new ATOM 0 HD3 PRO A 92 42.796 38.512 60.453 1.00 39.81 H new ATOM 728 N LEU A 93 37.607 37.711 60.784 1.00 28.58 N ATOM 729 CA LEU A 93 36.456 37.034 60.211 1.00 27.49 C ATOM 730 C LEU A 93 36.298 37.414 58.734 1.00 25.95 C ATOM 731 O LEU A 93 36.680 38.511 58.301 1.00 24.59 O ATOM 732 CB LEU A 93 35.173 37.427 60.980 1.00 27.37 C ATOM 733 CG LEU A 93 35.124 37.193 62.501 1.00 26.12 C ATOM 734 CD1 LEU A 93 33.810 37.669 63.069 1.00 22.98 C ATOM 735 CD2 LEU A 93 35.329 35.723 62.783 1.00 24.46 C ATOM 0 H LEU A 93 37.406 38.338 61.337 1.00 28.58 H new ATOM 0 HA LEU A 93 36.595 36.077 60.282 1.00 27.49 H new ATOM 0 HB2 LEU A 93 35.012 38.370 60.822 1.00 27.37 H new ATOM 0 HB3 LEU A 93 34.432 36.943 60.584 1.00 27.37 H new ATOM 0 HG LEU A 93 35.831 37.701 62.928 1.00 26.12 H new ATOM 0 HD11 LEU A 93 33.796 37.514 64.026 1.00 22.98 H new ATOM 0 HD12 LEU A 93 33.706 38.617 62.894 1.00 22.98 H new ATOM 0 HD13 LEU A 93 33.082 37.182 62.653 1.00 22.98 H new ATOM 0 HD21 LEU A 93 35.299 35.570 63.740 1.00 24.46 H new ATOM 0 HD22 LEU A 93 34.628 35.210 62.352 1.00 24.46 H new ATOM 0 HD23 LEU A 93 36.192 35.444 62.438 1.00 24.46 H new ATOM 736 N TYR A 94 35.739 36.485 57.976 1.00 25.98 N ATOM 737 CA TYR A 94 35.460 36.706 56.572 1.00 25.79 C ATOM 738 C TYR A 94 34.473 35.669 56.071 1.00 25.46 C ATOM 739 O TYR A 94 34.224 34.654 56.726 1.00 24.96 O ATOM 740 CB TYR A 94 36.736 36.691 55.731 1.00 26.85 C ATOM 741 CG TYR A 94 37.377 35.350 55.586 1.00 30.41 C ATOM 742 CD1 TYR A 94 36.971 34.480 54.581 1.00 32.98 C ATOM 743 CD2 TYR A 94 38.407 34.954 56.438 1.00 33.02 C ATOM 744 CE1 TYR A 94 37.568 33.254 54.416 1.00 35.90 C ATOM 745 CE2 TYR A 94 39.018 33.732 56.286 1.00 35.21 C ATOM 746 CZ TYR A 94 38.592 32.885 55.268 1.00 38.63 C ATOM 747 OH TYR A 94 39.197 31.664 55.078 1.00 44.31 O ATOM 0 H TYR A 94 35.511 35.707 58.263 1.00 25.98 H new ATOM 0 HA TYR A 94 35.067 37.588 56.479 1.00 25.79 H new ATOM 0 HB2 TYR A 94 36.530 37.034 54.847 1.00 26.85 H new ATOM 0 HB3 TYR A 94 37.377 37.300 56.129 1.00 26.85 H new ATOM 0 HD1 TYR A 94 36.282 34.733 54.010 1.00 32.98 H new ATOM 0 HD2 TYR A 94 38.684 35.524 57.118 1.00 33.02 H new ATOM 0 HE1 TYR A 94 37.287 32.680 53.740 1.00 35.90 H new ATOM 0 HE2 TYR A 94 39.707 33.475 56.856 1.00 35.21 H new ATOM 0 HH TYR A 94 39.799 31.557 55.654 1.00 44.31 H new ATOM 748 N GLU A 95 33.895 35.952 54.914 1.00 25.04 N ATOM 749 CA GLU A 95 32.933 35.071 54.280 1.00 23.48 C ATOM 750 C GLU A 95 33.127 35.125 52.761 1.00 21.60 C ATOM 751 O GLU A 95 33.354 36.190 52.189 1.00 19.33 O ATOM 752 CB GLU A 95 31.512 35.492 54.653 1.00 25.81 C ATOM 753 CG GLU A 95 30.437 34.654 53.959 1.00 30.54 C ATOM 754 CD GLU A 95 30.474 33.217 54.413 1.00 33.51 C ATOM 755 OE1 GLU A 95 31.214 32.399 53.835 1.00 34.38 O ATOM 756 OE2 GLU A 95 29.789 32.911 55.394 1.00 36.41 O ATOM 0 H GLU A 95 34.053 36.671 54.470 1.00 25.04 H new ATOM 0 HA GLU A 95 33.072 34.161 54.587 1.00 23.48 H new ATOM 0 HB2 GLU A 95 31.401 35.420 55.614 1.00 25.81 H new ATOM 0 HB3 GLU A 95 31.386 36.426 54.422 1.00 25.81 H new ATOM 0 HG2 GLU A 95 29.562 35.030 54.145 1.00 30.54 H new ATOM 0 HG3 GLU A 95 30.565 34.694 52.998 1.00 30.54 H new ATOM 757 N ASN A 96 33.127 33.950 52.140 1.00 21.06 N ATOM 758 CA ASN A 96 33.255 33.833 50.699 1.00 21.68 C ATOM 759 C ASN A 96 31.899 33.922 50.026 1.00 20.42 C ATOM 760 O ASN A 96 30.886 33.446 50.552 1.00 19.53 O ATOM 761 CB ASN A 96 33.894 32.511 50.330 1.00 25.18 C ATOM 762 CG ASN A 96 35.200 32.296 51.031 1.00 28.30 C ATOM 763 OD1 ASN A 96 36.190 32.955 50.740 1.00 27.18 O ATOM 764 ND2 ASN A 96 35.209 31.369 51.981 1.00 32.75 N ATOM 0 H ASN A 96 33.052 33.197 52.548 1.00 21.06 H new ATOM 0 HA ASN A 96 33.814 34.565 50.394 1.00 21.68 H new ATOM 0 HB2 ASN A 96 33.287 31.788 50.552 1.00 25.18 H new ATOM 0 HB3 ASN A 96 34.035 32.479 49.371 1.00 25.18 H new ATOM 0 HD21 ASN A 96 35.931 31.211 52.421 1.00 32.75 H new ATOM 0 HD22 ASN A 96 34.493 30.926 52.157 1.00 32.75 H new ATOM 765 N SER A 97 31.901 34.526 48.846 1.00 18.51 N ATOM 766 CA SER A 97 30.699 34.704 48.034 1.00 17.96 C ATOM 767 C SER A 97 30.425 33.456 47.188 1.00 18.31 C ATOM 768 O SER A 97 31.226 32.515 47.164 1.00 15.89 O ATOM 769 CB SER A 97 30.956 35.835 47.021 1.00 17.68 C ATOM 770 OG SER A 97 31.796 35.344 45.968 1.00 16.89 O ATOM 0 H SER A 97 32.611 34.851 48.486 1.00 18.51 H new ATOM 0 HA SER A 97 29.958 34.888 48.632 1.00 17.96 H new ATOM 0 HB2 SER A 97 30.116 36.154 46.657 1.00 17.68 H new ATOM 0 HB3 SER A 97 31.379 36.589 47.462 1.00 17.68 H new ATOM 0 HG SER A 97 31.358 35.312 45.252 1.00 16.89 H new ATOM 771 N PRO A 98 29.249 33.420 46.522 1.00 18.62 N ATOM 772 CA PRO A 98 28.962 32.273 45.663 1.00 18.42 C ATOM 773 C PRO A 98 29.882 32.501 44.431 1.00 18.54 C ATOM 774 O PRO A 98 30.435 33.601 44.246 1.00 17.66 O ATOM 775 CB PRO A 98 27.502 32.518 45.252 1.00 17.64 C ATOM 776 CG PRO A 98 26.930 33.286 46.407 1.00 17.27 C ATOM 777 CD PRO A 98 28.043 34.250 46.713 1.00 17.33 C ATOM 0 HA PRO A 98 29.093 31.391 46.045 1.00 18.42 H new ATOM 0 HB2 PRO A 98 27.445 33.022 44.426 1.00 17.64 H new ATOM 0 HB3 PRO A 98 27.028 31.684 45.109 1.00 17.64 H new ATOM 0 HG2 PRO A 98 26.108 33.742 46.169 1.00 17.27 H new ATOM 0 HG3 PRO A 98 26.728 32.712 47.162 1.00 17.27 H new ATOM 0 HD2 PRO A 98 28.033 35.014 46.116 1.00 17.33 H new ATOM 0 HD3 PRO A 98 27.982 34.596 47.617 1.00 17.33 H new ATOM 778 N GLU A 99 30.074 31.469 43.615 1.00 19.76 N ATOM 779 CA GLU A 99 30.856 31.578 42.380 1.00 22.40 C ATOM 780 C GLU A 99 30.105 32.438 41.347 1.00 19.87 C ATOM 781 O GLU A 99 28.875 32.440 41.309 1.00 20.28 O ATOM 782 CB GLU A 99 31.092 30.198 41.766 1.00 25.51 C ATOM 783 CG GLU A 99 32.146 29.350 42.439 1.00 30.30 C ATOM 784 CD GLU A 99 32.181 27.928 41.858 1.00 34.62 C ATOM 785 OE1 GLU A 99 31.551 27.687 40.793 1.00 35.54 O ATOM 786 OE2 GLU A 99 32.824 27.051 42.479 1.00 36.65 O ATOM 0 H GLU A 99 29.755 30.683 43.759 1.00 19.76 H new ATOM 0 HA GLU A 99 31.706 31.988 42.605 1.00 22.40 H new ATOM 0 HB2 GLU A 99 30.254 29.710 41.777 1.00 25.51 H new ATOM 0 HB3 GLU A 99 31.341 30.315 40.836 1.00 25.51 H new ATOM 0 HG2 GLU A 99 33.015 29.766 42.331 1.00 30.30 H new ATOM 0 HG3 GLU A 99 31.969 29.307 43.392 1.00 30.30 H new ATOM 787 N PHE A 100 30.857 33.121 40.485 1.00 18.63 N ATOM 788 CA PHE A 100 30.271 33.983 39.457 1.00 18.06 C ATOM 789 C PHE A 100 31.017 33.884 38.133 1.00 15.59 C ATOM 790 O PHE A 100 32.210 34.154 38.073 1.00 16.08 O ATOM 791 CB PHE A 100 30.278 35.454 39.923 1.00 17.91 C ATOM 792 CG PHE A 100 29.585 36.396 38.967 1.00 17.64 C ATOM 793 CD1 PHE A 100 28.201 36.311 38.757 1.00 17.62 C ATOM 794 CD2 PHE A 100 30.316 37.345 38.263 1.00 15.13 C ATOM 795 CE1 PHE A 100 27.572 37.138 37.860 1.00 16.31 C ATOM 796 CE2 PHE A 100 29.685 38.182 37.353 1.00 15.96 C ATOM 797 CZ PHE A 100 28.306 38.077 37.160 1.00 16.11 C ATOM 0 H PHE A 100 31.717 33.099 40.479 1.00 18.63 H new ATOM 0 HA PHE A 100 29.360 33.678 39.320 1.00 18.06 H new ATOM 0 HB2 PHE A 100 29.848 35.512 40.791 1.00 17.91 H new ATOM 0 HB3 PHE A 100 31.196 35.743 40.041 1.00 17.91 H new ATOM 0 HD1 PHE A 100 27.703 35.686 39.232 1.00 17.62 H new ATOM 0 HD2 PHE A 100 31.232 37.420 38.402 1.00 15.13 H new ATOM 0 HE1 PHE A 100 26.655 37.067 37.724 1.00 16.31 H new ATOM 0 HE2 PHE A 100 30.178 38.809 36.875 1.00 15.96 H new ATOM 0 HZ PHE A 100 27.879 38.642 36.557 1.00 16.11 H new ATOM 798 N THR A 101 30.301 33.510 37.076 1.00 15.53 N ATOM 799 CA THR A 101 30.862 33.392 35.721 1.00 16.47 C ATOM 800 C THR A 101 30.106 34.444 34.904 1.00 16.66 C ATOM 801 O THR A 101 29.012 34.187 34.409 1.00 15.95 O ATOM 802 CB THR A 101 30.593 31.983 35.100 1.00 17.19 C ATOM 803 OG1 THR A 101 31.090 30.965 35.973 1.00 17.63 O ATOM 804 CG2 THR A 101 31.279 31.863 33.788 1.00 15.71 C ATOM 0 H THR A 101 29.465 33.314 37.121 1.00 15.53 H new ATOM 0 HA THR A 101 31.824 33.515 35.730 1.00 16.47 H new ATOM 0 HB THR A 101 29.636 31.877 34.979 1.00 17.19 H new ATOM 0 HG1 THR A 101 30.535 30.829 36.589 1.00 17.63 H new ATOM 0 HG21 THR A 101 31.106 30.986 33.411 1.00 15.71 H new ATOM 0 HG22 THR A 101 30.945 32.545 33.185 1.00 15.71 H new ATOM 0 HG23 THR A 101 32.234 31.979 33.910 1.00 15.71 H new ATOM 805 N PRO A 102 30.710 35.626 34.719 1.00 16.17 N ATOM 806 CA PRO A 102 30.111 36.740 33.979 1.00 15.38 C ATOM 807 C PRO A 102 29.448 36.407 32.653 1.00 14.55 C ATOM 808 O PRO A 102 28.306 36.790 32.445 1.00 16.88 O ATOM 809 CB PRO A 102 31.288 37.711 33.792 1.00 14.31 C ATOM 810 CG PRO A 102 32.124 37.454 35.008 1.00 16.58 C ATOM 811 CD PRO A 102 32.106 35.932 35.088 1.00 16.13 C ATOM 0 HA PRO A 102 29.358 37.095 34.478 1.00 15.38 H new ATOM 0 HB2 PRO A 102 31.777 37.531 32.974 1.00 14.31 H new ATOM 0 HB3 PRO A 102 30.991 38.633 33.748 1.00 14.31 H new ATOM 0 HG2 PRO A 102 33.024 37.802 34.910 1.00 16.58 H new ATOM 0 HG3 PRO A 102 31.746 37.864 35.802 1.00 16.58 H new ATOM 0 HD2 PRO A 102 32.741 35.528 34.476 1.00 16.13 H new ATOM 0 HD3 PRO A 102 32.326 35.612 35.977 1.00 16.13 H new ATOM 812 N TYR A 103 30.126 35.650 31.792 1.00 14.61 N ATOM 813 CA TYR A 103 29.599 35.330 30.460 1.00 15.04 C ATOM 814 C TYR A 103 28.262 34.618 30.460 1.00 14.91 C ATOM 815 O TYR A 103 27.363 34.937 29.665 1.00 14.97 O ATOM 816 CB TYR A 103 30.628 34.534 29.656 1.00 15.33 C ATOM 817 CG TYR A 103 30.365 34.475 28.177 1.00 15.77 C ATOM 818 CD1 TYR A 103 30.705 35.538 27.342 1.00 15.25 C ATOM 819 CD2 TYR A 103 29.744 33.365 27.612 1.00 15.96 C ATOM 820 CE1 TYR A 103 30.423 35.492 25.961 1.00 18.03 C ATOM 821 CE2 TYR A 103 29.458 33.312 26.249 1.00 16.95 C ATOM 822 CZ TYR A 103 29.786 34.380 25.419 1.00 17.71 C ATOM 823 OH TYR A 103 29.397 34.360 24.079 1.00 18.04 O ATOM 0 H TYR A 103 30.898 35.309 31.959 1.00 14.61 H new ATOM 0 HA TYR A 103 29.433 36.187 30.037 1.00 15.04 H new ATOM 0 HB2 TYR A 103 31.504 34.924 29.800 1.00 15.33 H new ATOM 0 HB3 TYR A 103 30.660 33.628 30.002 1.00 15.33 H new ATOM 0 HD1 TYR A 103 31.123 36.287 27.700 1.00 15.25 H new ATOM 0 HD2 TYR A 103 29.516 32.645 28.154 1.00 15.96 H new ATOM 0 HE1 TYR A 103 30.663 36.204 25.413 1.00 18.03 H new ATOM 0 HE2 TYR A 103 29.046 32.559 25.892 1.00 16.95 H new ATOM 0 HH TYR A 103 28.931 33.677 23.932 1.00 18.04 H new ATOM 824 N LEU A 104 28.114 33.696 31.395 1.00 15.23 N ATOM 825 CA LEU A 104 26.894 32.916 31.516 1.00 16.16 C ATOM 826 C LEU A 104 25.866 33.458 32.497 1.00 15.55 C ATOM 827 O LEU A 104 24.703 33.077 32.456 1.00 16.07 O ATOM 828 CB LEU A 104 27.261 31.503 31.960 1.00 16.95 C ATOM 829 CG LEU A 104 28.128 30.646 31.046 1.00 16.04 C ATOM 830 CD1 LEU A 104 28.614 29.412 31.808 1.00 15.21 C ATOM 831 CD2 LEU A 104 27.317 30.249 29.825 1.00 16.48 C ATOM 0 H LEU A 104 28.717 33.504 31.978 1.00 15.23 H new ATOM 0 HA LEU A 104 26.479 32.950 30.640 1.00 16.16 H new ATOM 0 HB2 LEU A 104 27.715 31.573 32.814 1.00 16.95 H new ATOM 0 HB3 LEU A 104 26.434 31.021 32.117 1.00 16.95 H new ATOM 0 HG LEU A 104 28.906 31.147 30.755 1.00 16.04 H new ATOM 0 HD11 LEU A 104 29.166 28.868 31.225 1.00 15.21 H new ATOM 0 HD12 LEU A 104 29.135 29.691 32.577 1.00 15.21 H new ATOM 0 HD13 LEU A 104 27.850 28.894 32.106 1.00 15.21 H new ATOM 0 HD21 LEU A 104 27.862 29.703 29.238 1.00 16.48 H new ATOM 0 HD22 LEU A 104 26.537 29.744 30.104 1.00 16.48 H new ATOM 0 HD23 LEU A 104 27.032 31.047 29.352 1.00 16.48 H new ATOM 832 N GLU A 105 26.292 34.342 33.384 1.00 17.21 N ATOM 833 CA GLU A 105 25.400 34.831 34.417 1.00 18.98 C ATOM 834 C GLU A 105 24.956 36.265 34.399 1.00 17.71 C ATOM 835 O GLU A 105 23.906 36.569 34.950 1.00 19.78 O ATOM 836 CB GLU A 105 25.977 34.499 35.812 1.00 21.72 C ATOM 837 CG GLU A 105 26.223 33.004 36.054 1.00 25.43 C ATOM 838 CD GLU A 105 26.562 32.699 37.505 1.00 27.50 C ATOM 839 OE1 GLU A 105 25.663 32.812 38.353 1.00 32.89 O ATOM 840 OE2 GLU A 105 27.718 32.365 37.818 1.00 25.84 O ATOM 0 H GLU A 105 27.087 34.669 33.405 1.00 17.21 H new ATOM 0 HA GLU A 105 24.582 34.355 34.207 1.00 18.98 H new ATOM 0 HB2 GLU A 105 26.814 34.976 35.926 1.00 21.72 H new ATOM 0 HB3 GLU A 105 25.367 34.830 36.490 1.00 21.72 H new ATOM 0 HG2 GLU A 105 25.433 32.503 35.797 1.00 25.43 H new ATOM 0 HG3 GLU A 105 26.948 32.702 35.485 1.00 25.43 H new ATOM 841 N THR A 106 25.720 37.158 33.796 1.00 16.08 N ATOM 842 CA THR A 106 25.302 38.558 33.803 1.00 16.08 C ATOM 843 C THR A 106 23.922 38.726 33.155 1.00 16.09 C ATOM 844 O THR A 106 23.651 38.110 32.120 1.00 18.11 O ATOM 845 CB THR A 106 26.355 39.493 33.129 1.00 14.36 C ATOM 846 OG1 THR A 106 26.109 40.840 33.549 1.00 13.75 O ATOM 847 CG2 THR A 106 26.269 39.430 31.611 1.00 12.58 C ATOM 0 H THR A 106 26.459 36.990 33.389 1.00 16.08 H new ATOM 0 HA THR A 106 25.236 38.828 34.732 1.00 16.08 H new ATOM 0 HB THR A 106 27.240 39.199 33.396 1.00 14.36 H new ATOM 0 HG1 THR A 106 26.387 40.944 34.335 1.00 13.75 H new ATOM 0 HG21 THR A 106 26.934 40.020 31.224 1.00 12.58 H new ATOM 0 HG22 THR A 106 26.433 38.521 31.315 1.00 12.58 H new ATOM 0 HG23 THR A 106 25.385 39.708 31.325 1.00 12.58 H new ATOM 848 N ASN A 107 23.042 39.522 33.765 1.00 14.69 N ATOM 849 CA ASN A 107 21.719 39.715 33.185 1.00 16.05 C ATOM 850 C ASN A 107 21.750 40.593 31.933 1.00 16.71 C ATOM 851 O ASN A 107 22.548 41.513 31.827 1.00 15.84 O ATOM 852 CB ASN A 107 20.773 40.338 34.200 1.00 19.91 C ATOM 853 CG ASN A 107 20.557 39.453 35.426 1.00 25.64 C ATOM 854 OD1 ASN A 107 19.735 38.538 35.414 1.00 28.08 O ATOM 855 ND2 ASN A 107 21.289 39.736 36.493 1.00 29.02 N ATOM 0 H ASN A 107 23.189 39.949 34.497 1.00 14.69 H new ATOM 0 HA ASN A 107 21.402 38.834 32.930 1.00 16.05 H new ATOM 0 HB2 ASN A 107 21.128 41.195 34.483 1.00 19.91 H new ATOM 0 HB3 ASN A 107 19.918 40.511 33.776 1.00 19.91 H new ATOM 0 HD21 ASN A 107 21.198 39.273 37.212 1.00 29.02 H new ATOM 0 HD22 ASN A 107 21.855 40.383 36.467 1.00 29.02 H new ATOM 856 N LEU A 108 20.890 40.273 30.972 1.00 16.83 N ATOM 857 CA LEU A 108 20.756 41.041 29.735 1.00 17.47 C ATOM 858 C LEU A 108 19.849 42.209 30.089 1.00 18.67 C ATOM 859 O LEU A 108 18.743 42.004 30.589 1.00 19.82 O ATOM 860 CB LEU A 108 20.086 40.190 28.647 1.00 18.17 C ATOM 861 CG LEU A 108 20.983 39.058 28.143 1.00 20.62 C ATOM 862 CD1 LEU A 108 20.175 37.971 27.457 1.00 20.72 C ATOM 863 CD2 LEU A 108 22.057 39.651 27.235 1.00 23.10 C ATOM 0 H LEU A 108 20.361 39.596 31.019 1.00 16.83 H new ATOM 0 HA LEU A 108 21.619 41.326 29.396 1.00 17.47 H new ATOM 0 HB2 LEU A 108 19.264 39.814 28.997 1.00 18.17 H new ATOM 0 HB3 LEU A 108 19.842 40.760 27.901 1.00 18.17 H new ATOM 0 HG LEU A 108 21.418 38.626 28.895 1.00 20.62 H new ATOM 0 HD11 LEU A 108 20.771 37.270 27.150 1.00 20.72 H new ATOM 0 HD12 LEU A 108 19.535 37.599 28.084 1.00 20.72 H new ATOM 0 HD13 LEU A 108 19.702 38.349 26.699 1.00 20.72 H new ATOM 0 HD21 LEU A 108 22.633 38.942 26.909 1.00 23.10 H new ATOM 0 HD22 LEU A 108 21.636 40.096 26.483 1.00 23.10 H new ATOM 0 HD23 LEU A 108 22.586 40.292 27.735 1.00 23.10 H new ATOM 864 N GLY A 109 20.330 43.423 29.868 1.00 17.30 N ATOM 865 CA GLY A 109 19.541 44.592 30.186 1.00 18.28 C ATOM 866 C GLY A 109 18.423 44.762 29.189 1.00 19.76 C ATOM 867 O GLY A 109 18.464 44.223 28.095 1.00 19.82 O ATOM 0 H GLY A 109 21.106 43.588 29.537 1.00 17.30 H new ATOM 0 HA2 GLY A 109 19.174 44.508 31.080 1.00 18.28 H new ATOM 0 HA3 GLY A 109 20.106 45.380 30.184 1.00 18.28 H new ATOM 868 N GLN A 110 17.421 45.539 29.553 1.00 20.70 N ATOM 869 CA GLN A 110 16.306 45.757 28.662 1.00 22.55 C ATOM 870 C GLN A 110 16.772 46.446 27.353 1.00 21.75 C ATOM 871 O GLN A 110 17.457 47.476 27.387 1.00 21.45 O ATOM 872 CB GLN A 110 15.250 46.601 29.372 1.00 24.84 C ATOM 873 CG GLN A 110 13.968 46.765 28.580 1.00 27.88 C ATOM 874 CD GLN A 110 13.033 47.749 29.231 1.00 31.43 C ATOM 875 OE1 GLN A 110 13.358 48.930 29.375 1.00 32.83 O ATOM 876 NE2 GLN A 110 11.864 47.271 29.637 1.00 35.08 N ATOM 0 H GLN A 110 17.368 45.947 30.308 1.00 20.70 H new ATOM 0 HA GLN A 110 15.920 44.900 28.421 1.00 22.55 H new ATOM 0 HB2 GLN A 110 15.043 46.193 30.227 1.00 24.84 H new ATOM 0 HB3 GLN A 110 15.620 47.478 29.559 1.00 24.84 H new ATOM 0 HG2 GLN A 110 14.178 47.064 27.682 1.00 27.88 H new ATOM 0 HG3 GLN A 110 13.527 45.905 28.497 1.00 27.88 H new ATOM 0 HE21 GLN A 110 11.674 46.441 29.518 1.00 35.08 H new ATOM 0 HE22 GLN A 110 11.296 47.792 30.019 1.00 35.08 H new ATOM 877 N PRO A 111 16.424 45.859 26.188 1.00 21.41 N ATOM 878 CA PRO A 111 16.793 46.407 24.879 1.00 20.49 C ATOM 879 C PRO A 111 16.050 47.716 24.551 1.00 19.85 C ATOM 880 O PRO A 111 15.062 48.077 25.188 1.00 20.01 O ATOM 881 CB PRO A 111 16.366 45.303 23.896 1.00 19.93 C ATOM 882 CG PRO A 111 16.245 44.066 24.725 1.00 20.82 C ATOM 883 CD PRO A 111 15.692 44.586 26.035 1.00 20.74 C ATOM 0 HA PRO A 111 17.736 46.632 24.841 1.00 20.49 H new ATOM 0 HB2 PRO A 111 15.524 45.522 23.468 1.00 19.93 H new ATOM 0 HB3 PRO A 111 17.022 45.189 23.190 1.00 19.93 H new ATOM 0 HG2 PRO A 111 15.651 43.417 24.317 1.00 20.82 H new ATOM 0 HG3 PRO A 111 17.103 43.629 24.845 1.00 20.82 H new ATOM 0 HD2 PRO A 111 14.732 44.721 25.997 1.00 20.74 H new ATOM 0 HD3 PRO A 111 15.864 43.977 26.770 1.00 20.74 H new ATOM 884 N THR A 112 16.503 48.374 23.495 1.00 20.63 N ATOM 885 CA THR A 112 15.929 49.628 23.020 1.00 19.39 C ATOM 886 C THR A 112 15.933 49.649 21.494 1.00 18.82 C ATOM 887 O THR A 112 16.948 49.373 20.864 1.00 17.30 O ATOM 888 CB THR A 112 16.764 50.844 23.480 1.00 20.11 C ATOM 889 OG1 THR A 112 16.785 50.902 24.915 1.00 23.05 O ATOM 890 CG2 THR A 112 16.173 52.149 22.919 1.00 19.92 C ATOM 0 H THR A 112 17.167 48.100 23.022 1.00 20.63 H new ATOM 0 HA THR A 112 15.031 49.685 23.381 1.00 19.39 H new ATOM 0 HB THR A 112 17.669 50.743 23.145 1.00 20.11 H new ATOM 0 HG1 THR A 112 16.085 50.552 25.220 1.00 23.05 H new ATOM 0 HG21 THR A 112 16.708 52.901 23.217 1.00 19.92 H new ATOM 0 HG22 THR A 112 16.175 52.115 21.950 1.00 19.92 H new ATOM 0 HG23 THR A 112 15.263 52.255 23.236 1.00 19.92 H new ATOM 891 N ILE A 113 14.797 50.001 20.906 1.00 18.85 N ATOM 892 CA ILE A 113 14.708 50.083 19.458 1.00 19.75 C ATOM 893 C ILE A 113 15.347 51.419 19.079 1.00 19.91 C ATOM 894 O ILE A 113 14.948 52.449 19.574 1.00 20.38 O ATOM 895 CB ILE A 113 13.233 49.979 18.973 1.00 17.74 C ATOM 896 CG1 ILE A 113 12.751 48.529 19.106 1.00 17.29 C ATOM 897 CG2 ILE A 113 13.120 50.443 17.514 1.00 17.14 C ATOM 898 CD1 ILE A 113 11.242 48.357 19.096 1.00 18.39 C ATOM 0 H ILE A 113 14.071 50.195 21.325 1.00 18.85 H new ATOM 0 HA ILE A 113 15.169 49.345 19.029 1.00 19.75 H new ATOM 0 HB ILE A 113 12.676 50.552 19.522 1.00 17.74 H new ATOM 0 HG12 ILE A 113 13.128 48.008 18.380 1.00 17.29 H new ATOM 0 HG13 ILE A 113 13.101 48.159 19.932 1.00 17.29 H new ATOM 0 HG21 ILE A 113 12.197 50.374 17.223 1.00 17.14 H new ATOM 0 HG22 ILE A 113 13.413 51.365 17.444 1.00 17.14 H new ATOM 0 HG23 ILE A 113 13.679 49.883 16.952 1.00 17.14 H new ATOM 0 HD11 ILE A 113 11.023 47.416 19.184 1.00 18.39 H new ATOM 0 HD12 ILE A 113 10.855 48.849 19.837 1.00 18.39 H new ATOM 0 HD13 ILE A 113 10.883 48.695 18.261 1.00 18.39 H new ATOM 899 N GLN A 114 16.427 51.363 18.312 1.00 19.87 N ATOM 900 CA GLN A 114 17.129 52.551 17.886 1.00 20.08 C ATOM 901 C GLN A 114 16.304 53.275 16.815 1.00 22.11 C ATOM 902 O GLN A 114 16.149 54.496 16.865 1.00 22.20 O ATOM 903 CB GLN A 114 18.510 52.153 17.357 1.00 19.88 C ATOM 904 CG GLN A 114 19.387 53.293 16.863 1.00 21.60 C ATOM 905 CD GLN A 114 20.835 52.858 16.596 1.00 22.98 C ATOM 906 OE1 GLN A 114 21.602 52.656 17.533 1.00 24.47 O ATOM 907 NE2 GLN A 114 21.209 52.714 15.312 1.00 22.62 N ATOM 0 H GLN A 114 16.771 50.629 18.025 1.00 19.87 H new ATOM 0 HA GLN A 114 17.251 53.159 18.632 1.00 20.08 H new ATOM 0 HB2 GLN A 114 18.985 51.685 18.062 1.00 19.88 H new ATOM 0 HB3 GLN A 114 18.389 51.523 16.630 1.00 19.88 H new ATOM 0 HG2 GLN A 114 19.008 53.657 16.048 1.00 21.60 H new ATOM 0 HG3 GLN A 114 19.384 54.006 17.521 1.00 21.60 H new ATOM 0 HE21 GLN A 114 20.645 52.864 14.680 1.00 22.62 H new ATOM 0 HE22 GLN A 114 22.012 52.472 15.123 1.00 22.62 H new ATOM 908 N SER A 115 15.724 52.528 15.881 1.00 22.54 N ATOM 909 CA SER A 115 14.944 53.158 14.821 1.00 24.30 C ATOM 910 C SER A 115 14.225 52.179 13.900 1.00 26.23 C ATOM 911 O SER A 115 14.430 50.970 13.985 1.00 25.08 O ATOM 912 CB SER A 115 15.908 53.939 13.949 1.00 23.72 C ATOM 913 OG SER A 115 16.761 53.018 13.293 1.00 24.84 O ATOM 0 H SER A 115 15.768 51.670 15.842 1.00 22.54 H new ATOM 0 HA SER A 115 14.268 53.699 15.259 1.00 24.30 H new ATOM 0 HB2 SER A 115 15.421 54.470 13.300 1.00 23.72 H new ATOM 0 HB3 SER A 115 16.428 54.556 14.488 1.00 23.72 H new ATOM 0 HG SER A 115 16.663 53.088 12.462 1.00 24.84 H new ATOM 914 N PHE A 116 13.272 52.699 13.125 1.00 29.66 N ATOM 915 CA PHE A 116 12.646 51.903 12.075 1.00 33.84 C ATOM 916 C PHE A 116 12.617 52.767 10.837 1.00 38.29 C ATOM 917 O PHE A 116 12.543 53.987 10.934 1.00 40.27 O ATOM 918 CB APHE A 116 11.238 51.421 12.476 0.50 32.24 C ATOM 919 CB BPHE A 116 11.252 51.325 12.341 0.50 33.93 C ATOM 920 CG APHE A 116 10.256 52.524 12.778 0.50 31.94 C ATOM 921 CG BPHE A 116 10.596 51.788 13.577 0.50 35.10 C ATOM 922 CD1APHE A 116 9.688 53.283 11.755 0.50 32.46 C ATOM 923 CD1BPHE A 116 10.335 53.130 13.792 0.50 36.06 C ATOM 924 CD2APHE A 116 9.824 52.744 14.083 0.50 31.96 C ATOM 925 CD2BPHE A 116 10.120 50.853 14.488 0.50 36.27 C ATOM 926 CE1APHE A 116 8.712 54.261 12.028 0.50 31.93 C ATOM 927 CE1BPHE A 116 9.598 53.539 14.894 0.50 37.18 C ATOM 928 CE2APHE A 116 8.850 53.715 14.367 0.50 32.43 C ATOM 929 CE2BPHE A 116 9.383 51.244 15.589 0.50 37.29 C ATOM 930 CZ APHE A 116 8.289 54.467 13.336 0.50 32.44 C ATOM 931 CZ BPHE A 116 9.118 52.592 15.794 0.50 37.89 C ATOM 0 H PHE A 116 12.977 53.504 13.192 1.00 29.66 H new ATOM 0 HA PHE A 116 13.153 51.092 11.914 1.00 33.84 H new ATOM 0 HB2APHE A 116 10.881 50.874 11.759 0.50 33.93 H new ATOM 0 HB2BPHE A 116 10.680 51.544 11.589 0.50 33.93 H new ATOM 0 HB3APHE A 116 11.315 50.851 13.257 0.50 33.93 H new ATOM 0 HB3BPHE A 116 11.321 50.358 12.373 0.50 33.93 H new ATOM 0 HD1APHE A 116 9.959 53.141 10.877 0.50 36.06 H new ATOM 0 HD1BPHE A 116 10.657 53.764 13.192 0.50 36.06 H new ATOM 0 HD2APHE A 116 10.186 52.241 14.777 0.50 36.27 H new ATOM 0 HD2BPHE A 116 10.300 49.950 14.355 0.50 36.27 H new ATOM 0 HE1APHE A 116 8.352 54.767 11.336 0.50 37.18 H new ATOM 0 HE1BPHE A 116 9.425 54.443 15.031 0.50 37.18 H new ATOM 0 HE2APHE A 116 8.579 53.857 15.245 0.50 37.29 H new ATOM 0 HE2BPHE A 116 9.066 50.608 16.189 0.50 37.29 H new ATOM 0 HZ APHE A 116 7.636 55.102 13.522 0.50 37.89 H new ATOM 0 HZ BPHE A 116 8.620 52.862 16.532 0.50 37.89 H new ATOM 932 N GLU A 117 12.773 52.148 9.678 1.00 42.01 N ATOM 933 CA GLU A 117 12.797 52.888 8.433 1.00 46.71 C ATOM 934 C GLU A 117 11.999 52.149 7.396 1.00 48.25 C ATOM 935 O GLU A 117 12.411 51.089 6.933 1.00 47.54 O ATOM 936 CB GLU A 117 14.238 53.036 7.921 1.00 50.78 C ATOM 937 CG GLU A 117 14.329 53.704 6.533 1.00 56.59 C ATOM 938 CD GLU A 117 15.700 53.584 5.855 1.00 60.72 C ATOM 939 OE1 GLU A 117 16.554 52.775 6.312 1.00 62.66 O ATOM 940 OE2 GLU A 117 15.908 54.299 4.840 1.00 62.18 O ATOM 0 H GLU A 117 12.867 51.297 9.592 1.00 42.01 H new ATOM 0 HA GLU A 117 12.418 53.767 8.592 1.00 46.71 H new ATOM 0 HB2 GLU A 117 14.749 53.559 8.559 1.00 50.78 H new ATOM 0 HB3 GLU A 117 14.651 52.159 7.878 1.00 50.78 H new ATOM 0 HG2 GLU A 117 13.659 53.310 5.953 1.00 56.59 H new ATOM 0 HG3 GLU A 117 14.108 54.644 6.624 1.00 56.59 H new ATOM 941 N GLN A 118 10.835 52.677 7.050 1.00 52.35 N ATOM 942 CA GLN A 118 10.052 52.013 6.016 1.00 55.71 C ATOM 943 C GLN A 118 10.636 52.326 4.649 1.00 55.24 C ATOM 944 O GLN A 118 10.820 53.477 4.266 1.00 54.97 O ATOM 945 CB GLN A 118 8.561 52.370 6.045 1.00 57.78 C ATOM 946 CG GLN A 118 7.826 51.648 4.923 1.00 61.26 C ATOM 947 CD GLN A 118 6.383 51.380 5.231 1.00 63.42 C ATOM 948 OE1 GLN A 118 5.762 52.112 5.998 1.00 64.87 O ATOM 949 NE2 GLN A 118 5.832 50.321 4.638 1.00 63.80 N ATOM 0 H GLN A 118 10.489 53.390 7.384 1.00 52.35 H new ATOM 0 HA GLN A 118 10.106 51.062 6.198 1.00 55.71 H new ATOM 0 HB2 GLN A 118 8.179 52.124 6.902 1.00 57.78 H new ATOM 0 HB3 GLN A 118 8.449 53.329 5.950 1.00 57.78 H new ATOM 0 HG2 GLN A 118 7.884 52.179 4.114 1.00 61.26 H new ATOM 0 HG3 GLN A 118 8.273 50.806 4.742 1.00 61.26 H new ATOM 0 HE21 GLN A 118 6.301 49.833 4.107 1.00 63.80 H new ATOM 0 HE22 GLN A 118 5.008 50.126 4.786 1.00 63.80 H new ATOM 950 N VAL A 119 10.976 51.266 3.946 1.00 55.17 N ATOM 951 CA VAL A 119 11.542 51.377 2.629 1.00 56.10 C ATOM 952 C VAL A 119 10.578 50.696 1.656 1.00 54.39 C ATOM 953 O VAL A 119 10.591 49.476 1.466 1.00 54.66 O ATOM 954 CB VAL A 119 12.943 50.764 2.647 1.00 59.07 C ATOM 955 CG1 VAL A 119 13.844 51.604 3.553 1.00 60.69 C ATOM 956 CG2 VAL A 119 12.911 49.350 3.211 1.00 61.43 C ATOM 0 H VAL A 119 10.883 50.457 4.224 1.00 55.17 H new ATOM 0 HA VAL A 119 11.649 52.296 2.339 1.00 56.10 H new ATOM 0 HB VAL A 119 13.276 50.743 1.736 1.00 59.07 H new ATOM 0 HG11 VAL A 119 14.735 51.221 3.569 1.00 60.69 H new ATOM 0 HG12 VAL A 119 13.889 52.511 3.213 1.00 60.69 H new ATOM 0 HG13 VAL A 119 13.480 51.614 4.452 1.00 60.69 H new ATOM 0 HG21 VAL A 119 13.808 48.982 3.213 1.00 61.43 H new ATOM 0 HG22 VAL A 119 12.569 49.371 4.118 1.00 61.43 H new ATOM 0 HG23 VAL A 119 12.335 48.795 2.662 1.00 61.43 H new ATOM 957 N GLY A 120 9.684 51.510 1.104 1.00 52.16 N ATOM 958 CA GLY A 120 8.682 50.994 0.188 1.00 49.98 C ATOM 959 C GLY A 120 7.656 50.157 0.922 1.00 48.60 C ATOM 960 O GLY A 120 6.847 50.703 1.685 1.00 48.17 O ATOM 0 H GLY A 120 9.643 52.357 1.247 1.00 52.16 H new ATOM 0 HA2 GLY A 120 8.241 51.731 -0.263 1.00 49.98 H new ATOM 0 HA3 GLY A 120 9.111 50.458 -0.498 1.00 49.98 H new ATOM 961 N THR A 121 7.705 48.839 0.734 1.00 46.87 N ATOM 962 CA THR A 121 6.753 47.967 1.414 1.00 46.78 C ATOM 963 C THR A 121 7.424 47.169 2.535 1.00 44.21 C ATOM 964 O THR A 121 6.839 46.242 3.126 1.00 44.55 O ATOM 965 CB THR A 121 5.993 47.035 0.406 1.00 49.48 C ATOM 966 OG1 THR A 121 4.677 46.749 0.923 1.00 51.08 O ATOM 967 CG2 THR A 121 6.771 45.716 0.139 1.00 49.53 C ATOM 0 H THR A 121 8.271 48.437 0.226 1.00 46.87 H new ATOM 0 HA THR A 121 6.086 48.537 1.828 1.00 46.78 H new ATOM 0 HB THR A 121 5.919 47.499 -0.443 1.00 49.48 H new ATOM 0 HG1 THR A 121 4.267 46.251 0.385 1.00 51.08 H new ATOM 0 HG21 THR A 121 6.273 45.167 -0.486 1.00 49.53 H new ATOM 0 HG22 THR A 121 7.641 45.924 -0.236 1.00 49.53 H new ATOM 0 HG23 THR A 121 6.885 45.233 0.972 1.00 49.53 H new ATOM 968 N LYS A 122 8.670 47.532 2.817 1.00 41.79 N ATOM 969 CA LYS A 122 9.436 46.871 3.859 1.00 38.45 C ATOM 970 C LYS A 122 9.811 47.842 4.969 1.00 36.47 C ATOM 971 O LYS A 122 9.903 49.056 4.755 1.00 35.72 O ATOM 972 CB LYS A 122 10.694 46.247 3.276 1.00 36.04 C ATOM 973 CG LYS A 122 10.439 44.998 2.512 1.00 34.90 C ATOM 974 CD LYS A 122 11.693 44.573 1.791 1.00 36.54 C ATOM 975 CE LYS A 122 11.548 43.180 1.211 1.00 38.96 C ATOM 976 NZ LYS A 122 11.310 42.142 2.265 1.00 42.50 N ATOM 0 H LYS A 122 9.090 48.164 2.412 1.00 41.79 H new ATOM 0 HA LYS A 122 8.878 46.174 4.238 1.00 38.45 H new ATOM 0 HB2 LYS A 122 11.125 46.891 2.693 1.00 36.04 H new ATOM 0 HB3 LYS A 122 11.315 46.056 3.996 1.00 36.04 H new ATOM 0 HG2 LYS A 122 10.148 44.295 3.114 1.00 34.90 H new ATOM 0 HG3 LYS A 122 9.722 45.140 1.874 1.00 34.90 H new ATOM 0 HD2 LYS A 122 11.889 45.203 1.080 1.00 36.54 H new ATOM 0 HD3 LYS A 122 12.444 44.594 2.404 1.00 36.54 H new ATOM 0 HE2 LYS A 122 10.811 43.171 0.580 1.00 38.96 H new ATOM 0 HE3 LYS A 122 12.350 42.954 0.714 1.00 38.96 H new ATOM 0 HZ1 LYS A 122 11.877 41.465 2.149 1.00 42.50 H new ATOM 0 HZ2 LYS A 122 11.438 42.501 3.069 1.00 42.50 H new ATOM 0 HZ3 LYS A 122 10.474 41.842 2.203 1.00 42.50 H new ATOM 977 N VAL A 123 9.966 47.289 6.170 1.00 34.34 N ATOM 978 CA VAL A 123 10.359 48.061 7.336 1.00 31.27 C ATOM 979 C VAL A 123 11.587 47.415 7.966 1.00 27.50 C ATOM 980 O VAL A 123 11.652 46.203 8.165 1.00 23.61 O ATOM 981 CB VAL A 123 9.207 48.187 8.376 1.00 32.59 C ATOM 982 CG1 VAL A 123 9.723 48.857 9.648 1.00 31.43 C ATOM 983 CG2 VAL A 123 8.058 49.029 7.790 1.00 31.60 C ATOM 0 H VAL A 123 9.845 46.452 6.328 1.00 34.34 H new ATOM 0 HA VAL A 123 10.570 48.963 7.049 1.00 31.27 H new ATOM 0 HB VAL A 123 8.881 47.298 8.588 1.00 32.59 H new ATOM 0 HG11 VAL A 123 9.000 48.932 10.291 1.00 31.43 H new ATOM 0 HG12 VAL A 123 10.439 48.323 10.028 1.00 31.43 H new ATOM 0 HG13 VAL A 123 10.058 49.742 9.435 1.00 31.43 H new ATOM 0 HG21 VAL A 123 7.345 49.103 8.443 1.00 31.60 H new ATOM 0 HG22 VAL A 123 8.386 49.915 7.568 1.00 31.60 H new ATOM 0 HG23 VAL A 123 7.719 48.601 6.989 1.00 31.60 H new ATOM 984 N ASN A 124 12.589 48.255 8.190 1.00 28.27 N ATOM 985 CA ASN A 124 13.850 47.850 8.803 1.00 28.63 C ATOM 986 C ASN A 124 13.790 48.355 10.253 1.00 25.16 C ATOM 987 O ASN A 124 13.522 49.535 10.475 1.00 24.24 O ATOM 988 CB ASN A 124 15.018 48.517 8.042 1.00 31.82 C ATOM 989 CG ASN A 124 16.399 48.120 8.573 1.00 35.34 C ATOM 990 OD1 ASN A 124 17.142 48.966 9.079 1.00 37.25 O ATOM 991 ND2 ASN A 124 16.763 46.841 8.417 1.00 36.07 N ATOM 0 H ASN A 124 12.556 49.090 7.987 1.00 28.27 H new ATOM 0 HA ASN A 124 13.986 46.890 8.774 1.00 28.63 H new ATOM 0 HB2 ASN A 124 14.960 48.280 7.103 1.00 31.82 H new ATOM 0 HB3 ASN A 124 14.923 49.481 8.098 1.00 31.82 H new ATOM 0 HD21 ASN A 124 17.542 46.581 8.674 1.00 36.07 H new ATOM 0 HD22 ASN A 124 16.218 46.279 8.060 1.00 36.07 H new ATOM 992 N VAL A 125 13.913 47.440 11.216 1.00 22.91 N ATOM 993 CA VAL A 125 13.912 47.776 12.654 1.00 20.63 C ATOM 994 C VAL A 125 15.326 47.537 13.207 1.00 20.52 C ATOM 995 O VAL A 125 15.887 46.433 13.095 1.00 20.06 O ATOM 996 CB VAL A 125 12.916 46.915 13.453 1.00 18.52 C ATOM 997 CG1 VAL A 125 12.912 47.341 14.918 1.00 16.02 C ATOM 998 CG2 VAL A 125 11.514 47.007 12.822 1.00 18.05 C ATOM 0 H VAL A 125 14.000 46.599 11.058 1.00 22.91 H new ATOM 0 HA VAL A 125 13.642 48.703 12.748 1.00 20.63 H new ATOM 0 HB VAL A 125 13.191 45.986 13.420 1.00 18.52 H new ATOM 0 HG11 VAL A 125 12.282 46.794 15.413 1.00 16.02 H new ATOM 0 HG12 VAL A 125 13.800 47.228 15.291 1.00 16.02 H new ATOM 0 HG13 VAL A 125 12.651 48.273 14.984 1.00 16.02 H new ATOM 0 HG21 VAL A 125 10.893 46.462 13.331 1.00 18.05 H new ATOM 0 HG22 VAL A 125 11.215 47.930 12.830 1.00 18.05 H new ATOM 0 HG23 VAL A 125 11.549 46.687 11.907 1.00 18.05 H new ATOM 999 N THR A 126 15.917 48.593 13.754 1.00 19.23 N ATOM 1000 CA THR A 126 17.269 48.496 14.295 1.00 18.55 C ATOM 1001 C THR A 126 17.252 48.577 15.829 1.00 18.61 C ATOM 1002 O THR A 126 16.530 49.401 16.417 1.00 18.38 O ATOM 1003 CB THR A 126 18.200 49.601 13.694 1.00 18.91 C ATOM 1004 OG1 THR A 126 18.235 49.481 12.257 1.00 19.15 O ATOM 1005 CG2 THR A 126 19.623 49.483 14.263 1.00 17.89 C ATOM 0 H THR A 126 15.556 49.371 13.822 1.00 19.23 H new ATOM 0 HA THR A 126 17.628 47.632 14.040 1.00 18.55 H new ATOM 0 HB THR A 126 17.844 50.470 13.937 1.00 18.91 H new ATOM 0 HG1 THR A 126 18.084 50.231 11.909 1.00 19.15 H new ATOM 0 HG21 THR A 126 20.184 50.175 13.879 1.00 17.89 H new ATOM 0 HG22 THR A 126 19.596 49.587 15.227 1.00 17.89 H new ATOM 0 HG23 THR A 126 19.989 48.612 14.043 1.00 17.89 H new ATOM 1006 N VAL A 127 18.025 47.682 16.446 1.00 16.55 N ATOM 1007 CA VAL A 127 18.155 47.565 17.899 1.00 16.56 C ATOM 1008 C VAL A 127 19.444 48.237 18.336 1.00 17.02 C ATOM 1009 O VAL A 127 20.493 48.055 17.714 1.00 16.55 O ATOM 1010 CB VAL A 127 18.248 46.078 18.331 1.00 15.65 C ATOM 1011 CG1 VAL A 127 18.355 45.977 19.834 1.00 16.62 C ATOM 1012 CG2 VAL A 127 17.062 45.281 17.824 1.00 15.97 C ATOM 0 H VAL A 127 18.502 47.109 16.017 1.00 16.55 H new ATOM 0 HA VAL A 127 17.377 47.979 18.304 1.00 16.56 H new ATOM 0 HB VAL A 127 19.048 45.698 17.935 1.00 15.65 H new ATOM 0 HG11 VAL A 127 18.412 45.044 20.093 1.00 16.62 H new ATOM 0 HG12 VAL A 127 19.150 46.445 20.134 1.00 16.62 H new ATOM 0 HG13 VAL A 127 17.571 46.377 20.242 1.00 16.62 H new ATOM 0 HG21 VAL A 127 17.147 44.358 18.109 1.00 15.97 H new ATOM 0 HG22 VAL A 127 16.243 45.656 18.184 1.00 15.97 H new ATOM 0 HG23 VAL A 127 17.037 45.319 16.855 1.00 15.97 H new ATOM 1013 N GLU A 128 19.363 48.998 19.421 1.00 18.89 N ATOM 1014 CA GLU A 128 20.515 49.697 19.987 1.00 20.93 C ATOM 1015 C GLU A 128 21.590 48.702 20.473 1.00 19.72 C ATOM 1016 O GLU A 128 21.265 47.730 21.156 1.00 18.90 O ATOM 1017 CB GLU A 128 20.041 50.548 21.160 1.00 25.12 C ATOM 1018 CG GLU A 128 21.024 51.586 21.614 1.00 31.20 C ATOM 1019 CD GLU A 128 20.549 52.272 22.873 1.00 35.75 C ATOM 1020 OE1 GLU A 128 19.401 52.771 22.905 1.00 36.34 O ATOM 1021 OE2 GLU A 128 21.331 52.289 23.839 1.00 40.17 O ATOM 0 H GLU A 128 18.632 49.126 19.855 1.00 18.89 H new ATOM 0 HA GLU A 128 20.912 50.254 19.299 1.00 20.93 H new ATOM 0 HB2 GLU A 128 19.214 50.989 20.911 1.00 25.12 H new ATOM 0 HB3 GLU A 128 19.837 49.964 21.907 1.00 25.12 H new ATOM 0 HG2 GLU A 128 21.886 51.171 21.774 1.00 31.20 H new ATOM 0 HG3 GLU A 128 21.151 52.244 20.912 1.00 31.20 H new ATOM 1022 N ASP A 129 22.839 48.893 20.055 1.00 19.40 N ATOM 1023 CA ASP A 129 23.894 48.002 20.504 1.00 19.93 C ATOM 1024 C ASP A 129 24.630 48.776 21.572 1.00 20.43 C ATOM 1025 O ASP A 129 25.428 49.646 21.275 1.00 21.09 O ATOM 1026 CB ASP A 129 24.840 47.604 19.360 1.00 19.15 C ATOM 1027 CG ASP A 129 25.896 46.580 19.792 1.00 21.09 C ATOM 1028 OD1 ASP A 129 25.757 45.962 20.882 1.00 21.34 O ATOM 1029 OD2 ASP A 129 26.863 46.380 19.021 1.00 20.83 O ATOM 0 H ASP A 129 23.089 49.520 19.522 1.00 19.40 H new ATOM 0 HA ASP A 129 23.531 47.167 20.838 1.00 19.93 H new ATOM 0 HB2 ASP A 129 24.320 47.237 18.628 1.00 19.15 H new ATOM 0 HB3 ASP A 129 25.284 48.397 19.022 1.00 19.15 H new ATOM 1030 N GLU A 130 24.356 48.428 22.820 1.00 21.87 N ATOM 1031 CA GLU A 130 24.936 49.079 23.999 1.00 24.39 C ATOM 1032 C GLU A 130 26.399 48.865 24.306 1.00 22.93 C ATOM 1033 O GLU A 130 26.899 47.758 24.227 1.00 21.75 O ATOM 1034 CB GLU A 130 24.136 48.689 25.227 1.00 25.19 C ATOM 1035 CG GLU A 130 22.704 48.994 25.025 1.00 30.81 C ATOM 1036 CD GLU A 130 22.003 49.124 26.307 1.00 36.39 C ATOM 1037 OE1 GLU A 130 21.602 48.089 26.846 1.00 40.51 O ATOM 1038 OE2 GLU A 130 21.875 50.254 26.803 1.00 41.32 O ATOM 0 H GLU A 130 23.814 47.790 23.016 1.00 21.87 H new ATOM 0 HA GLU A 130 24.885 50.019 23.766 1.00 24.39 H new ATOM 0 HB2 GLU A 130 24.249 47.743 25.407 1.00 25.19 H new ATOM 0 HB3 GLU A 130 24.469 49.167 26.003 1.00 25.19 H new ATOM 0 HG2 GLU A 130 22.614 49.817 24.520 1.00 30.81 H new ATOM 0 HG3 GLU A 130 22.292 48.291 24.498 1.00 30.81 H new ATOM 1039 N ARG A 131 27.070 49.935 24.710 1.00 22.51 N ATOM 1040 CA ARG A 131 28.469 49.834 25.082 1.00 21.68 C ATOM 1041 C ARG A 131 28.563 49.119 26.442 1.00 19.59 C ATOM 1042 O ARG A 131 27.599 49.126 27.213 1.00 20.27 O ATOM 1043 CB ARG A 131 29.084 51.237 25.185 1.00 22.56 C ATOM 1044 CG ARG A 131 28.540 52.076 26.312 1.00 24.77 C ATOM 1045 CD ARG A 131 29.386 53.327 26.440 1.00 27.02 C ATOM 1046 NE ARG A 131 28.980 54.215 27.530 1.00 28.02 N ATOM 1047 CZ ARG A 131 29.323 54.075 28.815 1.00 28.47 C ATOM 1048 NH1 ARG A 131 30.087 53.058 29.223 1.00 22.21 N ATOM 1049 NH2 ARG A 131 28.940 55.014 29.690 1.00 28.87 N ATOM 0 H ARG A 131 26.734 50.724 24.775 1.00 22.51 H new ATOM 0 HA ARG A 131 28.955 49.332 24.410 1.00 21.68 H new ATOM 0 HB2 ARG A 131 30.044 51.150 25.296 1.00 22.56 H new ATOM 0 HB3 ARG A 131 28.936 51.705 24.348 1.00 22.56 H new ATOM 0 HG2 ARG A 131 27.615 52.312 26.139 1.00 24.77 H new ATOM 0 HG3 ARG A 131 28.554 51.574 27.142 1.00 24.77 H new ATOM 0 HD2 ARG A 131 30.311 53.068 26.575 1.00 27.02 H new ATOM 0 HD3 ARG A 131 29.348 53.818 25.604 1.00 27.02 H new ATOM 0 HE ARG A 131 28.478 54.883 27.327 1.00 28.02 H new ATOM 0 HH11 ARG A 131 30.369 52.477 28.655 1.00 22.21 H new ATOM 0 HH12 ARG A 131 30.297 52.984 30.054 1.00 22.21 H new ATOM 0 HH21 ARG A 131 28.482 55.691 29.422 1.00 28.87 H new ATOM 0 HH22 ARG A 131 29.152 54.940 30.520 1.00 28.87 H new ATOM 1050 N THR A 132 29.697 48.454 26.698 1.00 19.81 N ATOM 1051 CA THR A 132 29.960 47.772 27.983 1.00 17.40 C ATOM 1052 C THR A 132 31.363 48.214 28.417 1.00 16.37 C ATOM 1053 O THR A 132 32.071 48.880 27.657 1.00 17.86 O ATOM 1054 CB THR A 132 29.952 46.198 27.879 1.00 16.35 C ATOM 1055 OG1 THR A 132 31.186 45.721 27.322 1.00 15.70 O ATOM 1056 CG2 THR A 132 28.798 45.703 27.020 1.00 17.72 C ATOM 0 H THR A 132 30.340 48.384 26.131 1.00 19.81 H new ATOM 0 HA THR A 132 29.258 48.010 28.609 1.00 17.40 H new ATOM 0 HB THR A 132 29.844 45.853 28.779 1.00 16.35 H new ATOM 0 HG1 THR A 132 31.273 46.015 26.540 1.00 15.70 H new ATOM 0 HG21 THR A 132 28.820 44.734 26.975 1.00 17.72 H new ATOM 0 HG22 THR A 132 27.958 45.989 27.411 1.00 17.72 H new ATOM 0 HG23 THR A 132 28.880 46.069 26.126 1.00 17.72 H new ATOM 1057 N LEU A 133 31.764 47.831 29.622 1.00 15.99 N ATOM 1058 CA LEU A 133 33.099 48.161 30.126 1.00 17.99 C ATOM 1059 C LEU A 133 34.144 47.068 29.845 1.00 18.60 C ATOM 1060 O LEU A 133 35.261 47.138 30.342 1.00 18.57 O ATOM 1061 CB LEU A 133 33.051 48.482 31.623 1.00 18.46 C ATOM 1062 CG LEU A 133 32.248 49.754 31.936 1.00 19.99 C ATOM 1063 CD1 LEU A 133 32.070 49.893 33.428 1.00 21.30 C ATOM 1064 CD2 LEU A 133 32.933 50.995 31.351 1.00 21.70 C ATOM 0 H LEU A 133 31.279 47.377 30.169 1.00 15.99 H new ATOM 0 HA LEU A 133 33.385 48.949 29.637 1.00 17.99 H new ATOM 0 HB2 LEU A 133 32.659 47.732 32.097 1.00 18.46 H new ATOM 0 HB3 LEU A 133 33.956 48.586 31.956 1.00 18.46 H new ATOM 0 HG LEU A 133 31.374 49.679 31.522 1.00 19.99 H new ATOM 0 HD11 LEU A 133 31.563 50.697 33.620 1.00 21.30 H new ATOM 0 HD12 LEU A 133 31.593 49.121 33.771 1.00 21.30 H new ATOM 0 HD13 LEU A 133 32.940 49.950 33.854 1.00 21.30 H new ATOM 0 HD21 LEU A 133 32.409 51.784 31.561 1.00 21.70 H new ATOM 0 HD22 LEU A 133 33.820 51.086 31.733 1.00 21.70 H new ATOM 0 HD23 LEU A 133 33.004 50.902 30.388 1.00 21.70 H new ATOM 1065 N VAL A 134 33.762 46.023 29.108 1.00 17.29 N ATOM 1066 CA VAL A 134 34.701 44.966 28.744 1.00 17.49 C ATOM 1067 C VAL A 134 35.639 45.596 27.699 1.00 19.78 C ATOM 1068 O VAL A 134 35.191 46.241 26.738 1.00 18.92 O ATOM 1069 CB VAL A 134 33.963 43.737 28.132 1.00 16.76 C ATOM 1070 CG1 VAL A 134 34.937 42.598 27.822 1.00 16.16 C ATOM 1071 CG2 VAL A 134 32.907 43.241 29.089 1.00 16.87 C ATOM 0 H VAL A 134 32.963 45.909 28.810 1.00 17.29 H new ATOM 0 HA VAL A 134 35.181 44.640 29.522 1.00 17.49 H new ATOM 0 HB VAL A 134 33.550 44.023 27.302 1.00 16.76 H new ATOM 0 HG11 VAL A 134 34.450 41.849 27.443 1.00 16.16 H new ATOM 0 HG12 VAL A 134 35.602 42.905 27.186 1.00 16.16 H new ATOM 0 HG13 VAL A 134 35.377 42.317 28.639 1.00 16.16 H new ATOM 0 HG21 VAL A 134 32.452 42.477 28.702 1.00 16.87 H new ATOM 0 HG22 VAL A 134 33.324 42.979 29.924 1.00 16.87 H new ATOM 0 HG23 VAL A 134 32.264 43.948 29.257 1.00 16.87 H new ATOM 1072 N ARG A 135 36.942 45.454 27.917 1.00 22.08 N ATOM 1073 CA ARG A 135 37.924 46.033 27.012 1.00 24.49 C ATOM 1074 C ARG A 135 38.565 45.029 26.079 1.00 26.95 C ATOM 1075 O ARG A 135 38.622 43.843 26.365 1.00 28.00 O ATOM 1076 CB ARG A 135 39.085 46.631 27.815 1.00 25.92 C ATOM 1077 CG ARG A 135 38.787 47.808 28.701 1.00 28.39 C ATOM 1078 CD ARG A 135 39.331 49.083 28.090 1.00 32.58 C ATOM 1079 NE ARG A 135 40.758 49.040 27.733 1.00 35.41 N ATOM 1080 CZ ARG A 135 41.778 49.283 28.571 1.00 37.11 C ATOM 1081 NH1 ARG A 135 41.579 49.567 29.861 1.00 35.10 N ATOM 1082 NH2 ARG A 135 43.016 49.347 28.086 1.00 37.90 N ATOM 0 H ARG A 135 37.277 45.026 28.583 1.00 22.08 H new ATOM 0 HA ARG A 135 37.430 46.689 26.495 1.00 24.49 H new ATOM 0 HB2 ARG A 135 39.459 45.928 28.369 1.00 25.92 H new ATOM 0 HB3 ARG A 135 39.776 46.896 27.188 1.00 25.92 H new ATOM 0 HG2 ARG A 135 37.829 47.888 28.830 1.00 28.39 H new ATOM 0 HG3 ARG A 135 39.181 47.669 29.576 1.00 28.39 H new ATOM 0 HD2 ARG A 135 38.818 49.289 27.293 1.00 32.58 H new ATOM 0 HD3 ARG A 135 39.189 49.812 28.715 1.00 32.58 H new ATOM 0 HE ARG A 135 40.955 48.843 26.919 1.00 35.41 H new ATOM 0 HH11 ARG A 135 40.779 49.598 30.176 1.00 35.10 H new ATOM 0 HH12 ARG A 135 42.250 49.719 30.376 1.00 35.10 H new ATOM 0 HH21 ARG A 135 43.155 49.233 27.245 1.00 37.90 H new ATOM 0 HH22 ARG A 135 43.677 49.502 28.614 1.00 37.90 H new ATOM 1083 N ARG A 136 39.057 45.533 24.959 1.00 30.16 N ATOM 1084 CA ARG A 136 39.846 44.737 24.027 1.00 32.33 C ATOM 1085 C ARG A 136 40.755 45.807 23.461 1.00 33.25 C ATOM 1086 O ARG A 136 40.276 46.711 22.773 1.00 31.35 O ATOM 1087 CB AARG A 136 39.019 44.057 22.950 0.50 32.69 C ATOM 1088 CB BARG A 136 38.978 44.165 22.909 0.50 33.51 C ATOM 1089 CG AARG A 136 39.824 42.953 22.275 0.50 33.89 C ATOM 1090 CG BARG A 136 39.784 43.861 21.651 0.50 35.84 C ATOM 1091 CD AARG A 136 39.024 42.171 21.253 0.50 34.80 C ATOM 1092 CD BARG A 136 39.170 42.738 20.828 0.50 37.74 C ATOM 1093 NE AARG A 136 38.388 40.987 21.819 0.50 36.00 N ATOM 1094 NE BARG A 136 38.110 43.176 19.928 0.50 39.34 N ATOM 1095 CZ AARG A 136 37.271 40.455 21.339 0.50 36.89 C ATOM 1096 CZ BARG A 136 37.046 42.433 19.645 0.50 40.34 C ATOM 1097 NH1AARG A 136 36.679 41.013 20.291 0.50 38.25 N ATOM 1098 NH1BARG A 136 36.924 41.249 20.223 0.50 41.51 N ATOM 1099 NH2AARG A 136 36.753 39.366 21.883 0.50 36.37 N ATOM 1100 NH2BARG A 136 36.141 42.836 18.765 0.50 40.11 N ATOM 0 H ARG A 136 38.944 46.350 24.715 1.00 30.16 H new ATOM 0 HA ARG A 136 40.299 43.986 24.441 1.00 32.33 H new ATOM 0 HB2AARG A 136 38.213 43.684 23.341 0.50 33.51 H new ATOM 0 HB2BARG A 136 38.548 43.353 23.219 0.50 33.51 H new ATOM 0 HB3AARG A 136 38.738 44.710 22.290 0.50 33.51 H new ATOM 0 HB3BARG A 136 38.273 44.796 22.695 0.50 33.51 H new ATOM 0 HG2AARG A 136 40.598 43.344 21.841 0.50 35.84 H new ATOM 0 HG2BARG A 136 39.845 44.662 21.107 0.50 35.84 H new ATOM 0 HG3AARG A 136 40.157 42.343 22.952 0.50 35.84 H new ATOM 0 HG3BARG A 136 40.689 43.618 21.900 0.50 35.84 H new ATOM 0 HD2AARG A 136 38.344 42.747 20.871 0.50 37.74 H new ATOM 0 HD2BARG A 136 39.868 42.312 20.307 0.50 37.74 H new ATOM 0 HD3AARG A 136 39.609 41.903 20.527 0.50 37.74 H new ATOM 0 HD3BARG A 136 38.814 42.066 21.430 0.50 37.74 H new ATOM 0 HE AARG A 136 38.757 40.614 22.500 0.50 39.34 H new ATOM 0 HE BARG A 136 38.177 43.952 19.563 0.50 39.34 H new ATOM 0 HH11AARG A 136 37.019 41.714 19.928 0.50 41.51 H new ATOM 0 HH11BARG A 136 37.527 40.974 20.771 0.50 41.51 H new ATOM 0 HH12AARG A 136 35.955 40.673 19.975 0.50 41.51 H new ATOM 0 HH12BARG A 136 36.241 40.755 20.051 0.50 41.51 H new ATOM 0 HH21AARG A 136 37.141 38.995 22.555 0.50 40.11 H new ATOM 0 HH21BARG A 136 36.237 43.591 18.365 0.50 40.11 H new ATOM 0 HH22AARG A 136 36.029 39.029 21.564 0.50 40.11 H new ATOM 0 HH22BARG A 136 35.458 42.342 18.594 0.50 40.11 H new ATOM 1101 N ASN A 137 42.029 45.768 23.874 1.00 36.40 N ATOM 1102 CA ASN A 137 43.063 46.749 23.494 1.00 38.30 C ATOM 1103 C ASN A 137 42.648 48.117 24.056 1.00 38.23 C ATOM 1104 O ASN A 137 42.410 48.229 25.271 1.00 38.99 O ATOM 1105 CB ASN A 137 43.242 46.829 21.972 1.00 41.57 C ATOM 1106 CG ASN A 137 43.543 45.491 21.352 1.00 44.04 C ATOM 1107 OD1 ASN A 137 44.316 44.698 21.896 1.00 45.53 O ATOM 1108 ND2 ASN A 137 42.924 45.224 20.205 1.00 44.56 N ATOM 0 H ASN A 137 42.325 45.153 24.398 1.00 36.40 H new ATOM 0 HA ASN A 137 43.917 46.472 23.862 1.00 38.30 H new ATOM 0 HB2 ASN A 137 42.435 47.192 21.574 1.00 41.57 H new ATOM 0 HB3 ASN A 137 43.962 47.446 21.767 1.00 41.57 H new ATOM 0 HD21 ASN A 137 43.056 44.471 19.810 1.00 44.56 H new ATOM 0 HD22 ASN A 137 42.392 45.804 19.858 1.00 44.56 H new ATOM 1109 N ASN A 138 42.558 49.150 23.204 1.00 38.21 N ATOM 1110 CA ASN A 138 42.127 50.460 23.685 1.00 37.40 C ATOM 1111 C ASN A 138 40.743 50.916 23.218 1.00 34.45 C ATOM 1112 O ASN A 138 40.534 52.055 22.822 1.00 34.52 O ATOM 1113 CB ASN A 138 43.200 51.554 23.529 1.00 40.83 C ATOM 1114 CG ASN A 138 43.749 52.045 24.903 1.00 44.41 C ATOM 1115 OD1 ASN A 138 43.570 51.382 25.936 1.00 46.15 O ATOM 1116 ND2 ASN A 138 44.407 53.204 24.907 1.00 44.16 N ATOM 0 H ASN A 138 42.739 49.110 22.364 1.00 38.21 H new ATOM 0 HA ASN A 138 42.014 50.316 24.638 1.00 37.40 H new ATOM 0 HB2 ASN A 138 43.933 51.211 22.994 1.00 40.83 H new ATOM 0 HB3 ASN A 138 42.824 52.306 23.046 1.00 40.83 H new ATOM 0 HD21 ASN A 138 44.724 53.516 25.643 1.00 44.16 H new ATOM 0 HD22 ASN A 138 44.514 53.640 24.174 1.00 44.16 H new ATOM 1117 N THR A 139 39.794 49.997 23.317 1.00 31.25 N ATOM 1118 CA THR A 139 38.400 50.257 23.013 1.00 27.99 C ATOM 1119 C THR A 139 37.559 49.367 23.947 1.00 26.00 C ATOM 1120 O THR A 139 38.059 48.409 24.541 1.00 25.81 O ATOM 1121 CB THR A 139 38.033 49.948 21.548 1.00 30.29 C ATOM 1122 OG1 THR A 139 36.680 50.385 21.290 1.00 32.40 O ATOM 1123 CG2 THR A 139 38.147 48.433 21.266 1.00 30.71 C ATOM 0 H THR A 139 39.947 49.189 23.568 1.00 31.25 H new ATOM 0 HA THR A 139 38.225 51.202 23.145 1.00 27.99 H new ATOM 0 HB THR A 139 38.650 50.419 20.966 1.00 30.29 H new ATOM 0 HG1 THR A 139 36.479 50.218 20.492 1.00 32.40 H new ATOM 0 HG21 THR A 139 37.913 48.257 20.341 1.00 30.71 H new ATOM 0 HG22 THR A 139 39.057 48.141 21.430 1.00 30.71 H new ATOM 0 HG23 THR A 139 37.542 47.949 21.850 1.00 30.71 H new ATOM 1124 N PHE A 140 36.307 49.754 24.138 1.00 24.34 N ATOM 1125 CA PHE A 140 35.374 48.997 24.965 1.00 23.59 C ATOM 1126 C PHE A 140 34.517 48.199 23.970 1.00 24.64 C ATOM 1127 O PHE A 140 34.225 48.694 22.864 1.00 27.02 O ATOM 1128 CB PHE A 140 34.475 49.947 25.766 1.00 22.18 C ATOM 1129 CG PHE A 140 35.185 50.696 26.872 1.00 19.06 C ATOM 1130 CD1 PHE A 140 35.622 50.029 28.019 1.00 17.78 C ATOM 1131 CD2 PHE A 140 35.367 52.080 26.794 1.00 18.85 C ATOM 1132 CE1 PHE A 140 36.221 50.726 29.083 1.00 16.29 C ATOM 1133 CE2 PHE A 140 35.965 52.792 27.854 1.00 17.53 C ATOM 1134 CZ PHE A 140 36.395 52.109 28.997 1.00 17.47 C ATOM 0 H PHE A 140 35.971 50.466 23.791 1.00 24.34 H new ATOM 0 HA PHE A 140 35.837 48.429 25.600 1.00 23.59 H new ATOM 0 HB2 PHE A 140 34.079 50.590 25.157 1.00 22.18 H new ATOM 0 HB3 PHE A 140 33.746 49.436 26.152 1.00 22.18 H new ATOM 0 HD1 PHE A 140 35.515 49.107 28.080 1.00 17.78 H new ATOM 0 HD2 PHE A 140 35.090 52.537 26.033 1.00 18.85 H new ATOM 0 HE1 PHE A 140 36.501 50.267 29.842 1.00 16.29 H new ATOM 0 HE2 PHE A 140 36.073 53.714 27.794 1.00 17.53 H new ATOM 0 HZ PHE A 140 36.795 52.574 29.696 1.00 17.47 H new ATOM 1135 N LEU A 141 34.147 46.973 24.336 1.00 22.26 N ATOM 1136 CA LEU A 141 33.326 46.118 23.468 1.00 20.08 C ATOM 1137 C LEU A 141 31.831 46.360 23.699 1.00 19.45 C ATOM 1138 O LEU A 141 31.413 46.644 24.809 1.00 18.82 O ATOM 1139 CB LEU A 141 33.633 44.635 23.725 1.00 19.14 C ATOM 1140 CG LEU A 141 35.037 44.098 23.429 1.00 19.30 C ATOM 1141 CD1 LEU A 141 35.073 42.627 23.723 1.00 18.24 C ATOM 1142 CD2 LEU A 141 35.416 44.360 21.987 1.00 20.22 C ATOM 0 H LEU A 141 34.361 46.613 25.087 1.00 22.26 H new ATOM 0 HA LEU A 141 33.545 46.346 22.551 1.00 20.08 H new ATOM 0 HB2 LEU A 141 33.443 44.456 24.659 1.00 19.14 H new ATOM 0 HB3 LEU A 141 33.005 44.112 23.202 1.00 19.14 H new ATOM 0 HG LEU A 141 35.680 44.555 23.993 1.00 19.30 H new ATOM 0 HD11 LEU A 141 35.960 42.281 23.537 1.00 18.24 H new ATOM 0 HD12 LEU A 141 34.857 42.478 24.657 1.00 18.24 H new ATOM 0 HD13 LEU A 141 34.425 42.169 23.165 1.00 18.24 H new ATOM 0 HD21 LEU A 141 36.306 44.014 21.818 1.00 20.22 H new ATOM 0 HD22 LEU A 141 34.782 43.919 21.400 1.00 20.22 H new ATOM 0 HD23 LEU A 141 35.403 45.315 21.817 1.00 20.22 H new ATOM 1143 N SER A 142 31.034 46.306 22.638 1.00 17.75 N ATOM 1144 CA SER A 142 29.593 46.479 22.783 1.00 17.60 C ATOM 1145 C SER A 142 29.069 45.123 23.222 1.00 16.72 C ATOM 1146 O SER A 142 29.790 44.131 23.144 1.00 17.27 O ATOM 1147 CB SER A 142 28.960 46.858 21.433 1.00 20.45 C ATOM 1148 OG SER A 142 29.084 45.800 20.480 1.00 19.51 O ATOM 0 H SER A 142 31.304 46.172 21.833 1.00 17.75 H new ATOM 0 HA SER A 142 29.380 47.183 23.416 1.00 17.60 H new ATOM 0 HB2 SER A 142 28.022 47.070 21.562 1.00 20.45 H new ATOM 0 HB3 SER A 142 29.387 47.658 21.088 1.00 20.45 H new ATOM 0 HG SER A 142 28.454 45.846 19.926 1.00 19.51 H new ATOM 1149 N LEU A 143 27.800 45.063 23.599 1.00 15.77 N ATOM 1150 CA LEU A 143 27.191 43.818 24.030 1.00 15.79 C ATOM 1151 C LEU A 143 27.271 42.762 22.908 1.00 17.34 C ATOM 1152 O LEU A 143 27.612 41.597 23.155 1.00 16.49 O ATOM 1153 CB LEU A 143 25.746 44.099 24.426 1.00 18.63 C ATOM 1154 CG LEU A 143 25.140 43.069 25.364 1.00 21.45 C ATOM 1155 CD1 LEU A 143 25.832 43.173 26.740 1.00 21.49 C ATOM 1156 CD2 LEU A 143 23.645 43.309 25.463 1.00 22.83 C ATOM 0 H LEU A 143 27.270 45.741 23.612 1.00 15.77 H new ATOM 0 HA LEU A 143 27.668 43.460 24.795 1.00 15.79 H new ATOM 0 HB2 LEU A 143 25.702 44.971 24.849 1.00 18.63 H new ATOM 0 HB3 LEU A 143 25.205 44.146 23.622 1.00 18.63 H new ATOM 0 HG LEU A 143 25.277 42.170 25.027 1.00 21.45 H new ATOM 0 HD11 LEU A 143 25.450 42.518 27.345 1.00 21.49 H new ATOM 0 HD12 LEU A 143 26.782 43.004 26.638 1.00 21.49 H new ATOM 0 HD13 LEU A 143 25.700 44.063 27.103 1.00 21.49 H new ATOM 0 HD21 LEU A 143 23.251 42.655 26.061 1.00 22.83 H new ATOM 0 HD22 LEU A 143 23.482 44.201 25.808 1.00 22.83 H new ATOM 0 HD23 LEU A 143 23.245 43.225 24.583 1.00 22.83 H new ATOM 1157 N ARG A 144 26.997 43.192 21.671 1.00 18.29 N ATOM 1158 CA ARG A 144 27.061 42.319 20.485 1.00 19.13 C ATOM 1159 C ARG A 144 28.526 41.903 20.219 1.00 17.16 C ATOM 1160 O ARG A 144 28.789 40.774 19.826 1.00 17.54 O ATOM 1161 CB ARG A 144 26.421 43.043 19.284 1.00 19.57 C ATOM 1162 CG ARG A 144 26.708 42.483 17.895 1.00 22.90 C ATOM 1163 CD ARG A 144 25.989 41.183 17.582 1.00 21.43 C ATOM 1164 NE ARG A 144 24.519 41.235 17.616 1.00 17.66 N ATOM 1165 CZ ARG A 144 23.770 40.188 17.957 1.00 14.77 C ATOM 1166 NH1 ARG A 144 24.342 39.038 18.291 1.00 13.05 N ATOM 1167 NH2 ARG A 144 22.457 40.274 17.950 1.00 15.41 N ATOM 0 H ARG A 144 26.768 44.002 21.493 1.00 18.29 H new ATOM 0 HA ARG A 144 26.558 41.503 20.636 1.00 19.13 H new ATOM 0 HB2 ARG A 144 25.460 43.047 19.413 1.00 19.57 H new ATOM 0 HB3 ARG A 144 26.713 43.968 19.301 1.00 19.57 H new ATOM 0 HG2 ARG A 144 26.457 43.146 17.233 1.00 22.90 H new ATOM 0 HG3 ARG A 144 27.663 42.341 17.807 1.00 22.90 H new ATOM 0 HD2 ARG A 144 26.264 40.886 16.701 1.00 21.43 H new ATOM 0 HD3 ARG A 144 26.286 40.510 18.214 1.00 21.43 H new ATOM 0 HE ARG A 144 24.127 41.972 17.407 1.00 17.66 H new ATOM 0 HH11 ARG A 144 25.199 38.967 18.288 1.00 13.05 H new ATOM 0 HH12 ARG A 144 23.856 38.364 18.511 1.00 13.05 H new ATOM 0 HH21 ARG A 144 22.076 41.011 17.724 1.00 15.41 H new ATOM 0 HH22 ARG A 144 21.980 39.593 18.172 1.00 15.41 H new ATOM 1168 N ASP A 145 29.482 42.785 20.487 1.00 15.66 N ATOM 1169 CA ASP A 145 30.886 42.417 20.308 1.00 14.71 C ATOM 1170 C ASP A 145 31.261 41.288 21.251 1.00 15.18 C ATOM 1171 O ASP A 145 32.025 40.398 20.886 1.00 16.36 O ATOM 1172 CB ASP A 145 31.824 43.579 20.630 1.00 17.00 C ATOM 1173 CG ASP A 145 31.767 44.699 19.608 1.00 19.70 C ATOM 1174 OD1 ASP A 145 31.454 44.425 18.425 1.00 19.85 O ATOM 1175 OD2 ASP A 145 32.070 45.859 19.991 1.00 19.41 O ATOM 0 H ASP A 145 29.346 43.586 20.768 1.00 15.66 H new ATOM 0 HA ASP A 145 30.982 42.156 19.379 1.00 14.71 H new ATOM 0 HB2 ASP A 145 31.599 43.935 21.504 1.00 17.00 H new ATOM 0 HB3 ASP A 145 32.733 43.246 20.685 1.00 17.00 H new ATOM 1176 N VAL A 146 30.780 41.363 22.491 1.00 16.12 N ATOM 1177 CA VAL A 146 31.078 40.334 23.502 1.00 16.00 C ATOM 1178 C VAL A 146 30.426 38.974 23.238 1.00 15.53 C ATOM 1179 O VAL A 146 31.106 37.958 23.269 1.00 14.50 O ATOM 1180 CB VAL A 146 30.708 40.790 24.951 1.00 14.44 C ATOM 1181 CG1 VAL A 146 31.088 39.701 25.995 1.00 11.92 C ATOM 1182 CG2 VAL A 146 31.440 42.070 25.287 1.00 14.96 C ATOM 0 H VAL A 146 30.277 42.002 22.772 1.00 16.12 H new ATOM 0 HA VAL A 146 32.038 40.221 23.426 1.00 16.00 H new ATOM 0 HB VAL A 146 29.749 40.934 24.984 1.00 14.44 H new ATOM 0 HG11 VAL A 146 30.849 40.007 26.884 1.00 11.92 H new ATOM 0 HG12 VAL A 146 30.609 38.881 25.796 1.00 11.92 H new ATOM 0 HG13 VAL A 146 32.043 39.535 25.957 1.00 11.92 H new ATOM 0 HG21 VAL A 146 31.208 42.349 26.186 1.00 14.96 H new ATOM 0 HG22 VAL A 146 32.397 41.920 25.232 1.00 14.96 H new ATOM 0 HG23 VAL A 146 31.186 42.763 24.658 1.00 14.96 H new ATOM 1183 N PHE A 147 29.121 38.949 22.984 1.00 14.72 N ATOM 1184 CA PHE A 147 28.433 37.669 22.778 1.00 14.78 C ATOM 1185 C PHE A 147 28.495 37.102 21.373 1.00 14.36 C ATOM 1186 O PHE A 147 28.312 35.895 21.186 1.00 14.85 O ATOM 1187 CB PHE A 147 26.968 37.774 23.220 1.00 14.04 C ATOM 1188 CG PHE A 147 26.797 37.940 24.690 1.00 15.59 C ATOM 1189 CD1 PHE A 147 27.085 36.884 25.553 1.00 16.18 C ATOM 1190 CD2 PHE A 147 26.335 39.146 25.230 1.00 15.70 C ATOM 1191 CE1 PHE A 147 26.913 37.017 26.934 1.00 17.01 C ATOM 1192 CE2 PHE A 147 26.158 39.283 26.614 1.00 15.96 C ATOM 1193 CZ PHE A 147 26.449 38.212 27.463 1.00 16.56 C ATOM 0 H PHE A 147 28.620 39.646 22.927 1.00 14.72 H new ATOM 0 HA PHE A 147 28.926 37.042 23.329 1.00 14.78 H new ATOM 0 HB2 PHE A 147 26.555 38.526 22.767 1.00 14.04 H new ATOM 0 HB3 PHE A 147 26.495 36.977 22.935 1.00 14.04 H new ATOM 0 HD1 PHE A 147 27.396 36.080 25.205 1.00 16.18 H new ATOM 0 HD2 PHE A 147 26.144 39.861 24.667 1.00 15.70 H new ATOM 0 HE1 PHE A 147 27.110 36.304 27.498 1.00 17.01 H new ATOM 0 HE2 PHE A 147 25.847 40.086 26.967 1.00 15.96 H new ATOM 0 HZ PHE A 147 26.332 38.300 28.381 1.00 16.56 H new ATOM 1194 N GLY A 148 28.729 37.970 20.392 1.00 14.46 N ATOM 1195 CA GLY A 148 28.779 37.535 19.000 1.00 15.07 C ATOM 1196 C GLY A 148 27.495 36.814 18.575 1.00 15.80 C ATOM 1197 O GLY A 148 26.384 37.249 18.896 1.00 19.11 O ATOM 0 H GLY A 148 28.861 38.811 20.511 1.00 14.46 H new ATOM 0 HA2 GLY A 148 28.921 38.305 18.427 1.00 15.07 H new ATOM 0 HA3 GLY A 148 29.537 36.944 18.874 1.00 15.07 H new ATOM 1198 N LYS A 149 27.638 35.658 17.941 1.00 14.59 N ATOM 1199 CA LYS A 149 26.494 34.880 17.495 1.00 16.65 C ATOM 1200 C LYS A 149 25.663 34.248 18.602 1.00 15.91 C ATOM 1201 O LYS A 149 24.574 33.712 18.325 1.00 15.46 O ATOM 1202 CB LYS A 149 26.941 33.803 16.510 1.00 19.89 C ATOM 1203 CG LYS A 149 27.233 34.387 15.158 1.00 27.74 C ATOM 1204 CD LYS A 149 27.978 33.419 14.283 1.00 33.72 C ATOM 1205 CE LYS A 149 28.368 34.099 12.978 1.00 37.88 C ATOM 1206 NZ LYS A 149 29.016 35.430 13.213 1.00 41.13 N ATOM 0 H LYS A 149 28.400 35.304 17.758 1.00 14.59 H new ATOM 0 HA LYS A 149 25.908 35.524 17.068 1.00 16.65 H new ATOM 0 HB2 LYS A 149 27.733 33.359 16.851 1.00 19.89 H new ATOM 0 HB3 LYS A 149 26.249 33.128 16.430 1.00 19.89 H new ATOM 0 HG2 LYS A 149 26.401 34.638 14.727 1.00 27.74 H new ATOM 0 HG3 LYS A 149 27.755 35.198 15.261 1.00 27.74 H new ATOM 0 HD2 LYS A 149 28.771 33.100 14.741 1.00 33.72 H new ATOM 0 HD3 LYS A 149 27.425 32.643 14.101 1.00 33.72 H new ATOM 0 HE2 LYS A 149 28.976 33.526 12.484 1.00 37.88 H new ATOM 0 HE3 LYS A 149 27.579 34.217 12.427 1.00 37.88 H new ATOM 0 HZ1 LYS A 149 29.482 35.665 12.492 1.00 41.13 H new ATOM 0 HZ2 LYS A 149 28.389 36.041 13.373 1.00 41.13 H new ATOM 0 HZ3 LYS A 149 29.562 35.375 13.914 1.00 41.13 H new ATOM 1207 N ASP A 150 26.173 34.254 19.831 1.00 13.55 N ATOM 1208 CA ASP A 150 25.397 33.707 20.940 1.00 15.66 C ATOM 1209 C ASP A 150 24.143 34.555 21.255 1.00 16.43 C ATOM 1210 O ASP A 150 23.162 34.046 21.826 1.00 16.82 O ATOM 1211 CB ASP A 150 26.250 33.588 22.206 1.00 17.28 C ATOM 1212 CG ASP A 150 27.281 32.478 22.124 1.00 19.43 C ATOM 1213 OD1 ASP A 150 27.273 31.709 21.142 1.00 22.74 O ATOM 1214 OD2 ASP A 150 28.093 32.358 23.059 1.00 19.89 O ATOM 0 H ASP A 150 26.948 34.562 20.041 1.00 13.55 H new ATOM 0 HA ASP A 150 25.107 32.825 20.658 1.00 15.66 H new ATOM 0 HB2 ASP A 150 26.702 34.431 22.366 1.00 17.28 H new ATOM 0 HB3 ASP A 150 25.670 33.428 22.967 1.00 17.28 H new ATOM 1215 N LEU A 151 24.201 35.846 20.927 1.00 16.30 N ATOM 1216 CA LEU A 151 23.092 36.749 21.183 1.00 17.49 C ATOM 1217 C LEU A 151 22.112 36.848 19.991 1.00 19.14 C ATOM 1218 O LEU A 151 22.503 37.204 18.871 1.00 19.25 O ATOM 1219 CB LEU A 151 23.618 38.135 21.562 1.00 15.77 C ATOM 1220 CG LEU A 151 22.583 39.239 21.850 1.00 17.96 C ATOM 1221 CD1 LEU A 151 21.843 38.984 23.176 1.00 16.43 C ATOM 1222 CD2 LEU A 151 23.313 40.594 21.910 1.00 18.01 C ATOM 0 H LEU A 151 24.881 36.216 20.553 1.00 16.30 H new ATOM 0 HA LEU A 151 22.589 36.379 21.926 1.00 17.49 H new ATOM 0 HB2 LEU A 151 24.177 38.037 22.349 1.00 15.77 H new ATOM 0 HB3 LEU A 151 24.191 38.444 20.843 1.00 15.77 H new ATOM 0 HG LEU A 151 21.921 39.242 21.141 1.00 17.96 H new ATOM 0 HD11 LEU A 151 21.200 39.694 23.330 1.00 16.43 H new ATOM 0 HD12 LEU A 151 21.380 38.133 23.130 1.00 16.43 H new ATOM 0 HD13 LEU A 151 22.482 38.964 23.905 1.00 16.43 H new ATOM 0 HD21 LEU A 151 22.672 41.299 22.091 1.00 18.01 H new ATOM 0 HD22 LEU A 151 23.978 40.573 22.616 1.00 18.01 H new ATOM 0 HD23 LEU A 151 23.749 40.765 21.061 1.00 18.01 H new ATOM 1223 N ILE A 152 20.834 36.579 20.281 1.00 19.32 N ATOM 1224 CA ILE A 152 19.744 36.625 19.300 1.00 18.85 C ATOM 1225 C ILE A 152 18.640 37.578 19.809 1.00 19.05 C ATOM 1226 O ILE A 152 18.306 37.562 20.990 1.00 19.75 O ATOM 1227 CB ILE A 152 19.076 35.220 19.134 1.00 19.90 C ATOM 1228 CG1 ILE A 152 20.122 34.108 18.886 1.00 17.83 C ATOM 1229 CG2 ILE A 152 17.959 35.271 18.085 1.00 18.84 C ATOM 1230 CD1 ILE A 152 21.013 34.313 17.722 1.00 18.07 C ATOM 0 H ILE A 152 20.572 36.360 21.070 1.00 19.32 H new ATOM 0 HA ILE A 152 20.121 36.920 18.457 1.00 18.85 H new ATOM 0 HB ILE A 152 18.651 34.979 19.972 1.00 19.90 H new ATOM 0 HG12 ILE A 152 20.671 34.020 19.681 1.00 17.83 H new ATOM 0 HG13 ILE A 152 19.654 33.266 18.770 1.00 17.83 H new ATOM 0 HG21 ILE A 152 17.558 34.392 17.996 1.00 18.84 H new ATOM 0 HG22 ILE A 152 17.283 35.908 18.363 1.00 18.84 H new ATOM 0 HG23 ILE A 152 18.329 35.545 17.231 1.00 18.84 H new ATOM 0 HD11 ILE A 152 21.629 33.567 17.651 1.00 18.07 H new ATOM 0 HD12 ILE A 152 20.481 34.371 16.913 1.00 18.07 H new ATOM 0 HD13 ILE A 152 21.514 35.136 17.838 1.00 18.07 H new ATOM 1231 N TYR A 153 18.118 38.432 18.934 1.00 16.51 N ATOM 1232 CA TYR A 153 17.021 39.318 19.300 1.00 16.10 C ATOM 1233 C TYR A 153 15.752 38.838 18.640 1.00 16.62 C ATOM 1234 O TYR A 153 15.778 38.388 17.500 1.00 16.24 O ATOM 1235 CB TYR A 153 17.259 40.741 18.803 1.00 16.95 C ATOM 1236 CG TYR A 153 18.284 41.502 19.584 1.00 17.21 C ATOM 1237 CD1 TYR A 153 18.019 41.923 20.888 1.00 16.65 C ATOM 1238 CD2 TYR A 153 19.510 41.822 19.020 1.00 17.49 C ATOM 1239 CE1 TYR A 153 18.954 42.648 21.616 1.00 16.09 C ATOM 1240 CE2 TYR A 153 20.459 42.549 19.741 1.00 18.95 C ATOM 1241 CZ TYR A 153 20.169 42.959 21.038 1.00 17.82 C ATOM 1242 OH TYR A 153 21.106 43.670 21.752 1.00 18.59 O ATOM 0 H TYR A 153 18.387 38.513 18.121 1.00 16.51 H new ATOM 0 HA TYR A 153 16.956 39.312 20.268 1.00 16.10 H new ATOM 0 HB2 TYR A 153 17.536 40.706 17.874 1.00 16.95 H new ATOM 0 HB3 TYR A 153 16.420 41.227 18.831 1.00 16.95 H new ATOM 0 HD1 TYR A 153 17.201 41.714 21.277 1.00 16.65 H new ATOM 0 HD2 TYR A 153 19.702 41.549 18.152 1.00 17.49 H new ATOM 0 HE1 TYR A 153 18.764 42.921 22.484 1.00 16.09 H new ATOM 0 HE2 TYR A 153 21.280 42.758 19.357 1.00 18.95 H new ATOM 0 HH TYR A 153 21.820 43.714 21.312 1.00 18.59 H new ATOM 1243 N THR A 154 14.643 38.952 19.359 1.00 18.33 N ATOM 1244 CA THR A 154 13.324 38.595 18.831 1.00 19.49 C ATOM 1245 C THR A 154 12.521 39.893 18.651 1.00 19.76 C ATOM 1246 O THR A 154 12.486 40.740 19.559 1.00 20.33 O ATOM 1247 CB THR A 154 12.515 37.690 19.801 1.00 20.25 C ATOM 1248 OG1 THR A 154 13.257 36.499 20.089 1.00 20.70 O ATOM 1249 CG2 THR A 154 11.164 37.301 19.171 1.00 19.80 C ATOM 0 H THR A 154 14.630 39.239 20.170 1.00 18.33 H new ATOM 0 HA THR A 154 13.461 38.111 18.001 1.00 19.49 H new ATOM 0 HB THR A 154 12.356 38.184 20.621 1.00 20.25 H new ATOM 0 HG1 THR A 154 13.928 36.458 19.585 1.00 20.70 H new ATOM 0 HG21 THR A 154 10.670 36.737 19.786 1.00 19.80 H new ATOM 0 HG22 THR A 154 10.651 38.103 18.985 1.00 19.80 H new ATOM 0 HG23 THR A 154 11.319 36.818 18.344 1.00 19.80 H new ATOM 1250 N LEU A 155 11.950 40.072 17.460 1.00 18.59 N ATOM 1251 CA LEU A 155 11.108 41.220 17.177 1.00 18.17 C ATOM 1252 C LEU A 155 9.668 40.733 17.214 1.00 18.65 C ATOM 1253 O LEU A 155 9.349 39.675 16.681 1.00 20.00 O ATOM 1254 CB LEU A 155 11.391 41.815 15.799 1.00 18.01 C ATOM 1255 CG LEU A 155 10.492 42.994 15.348 1.00 18.78 C ATOM 1256 CD1 LEU A 155 10.756 44.288 16.158 1.00 15.72 C ATOM 1257 CD2 LEU A 155 10.692 43.257 13.881 1.00 17.23 C ATOM 0 H LEU A 155 12.043 39.530 16.799 1.00 18.59 H new ATOM 0 HA LEU A 155 11.282 41.913 17.833 1.00 18.17 H new ATOM 0 HB2 LEU A 155 12.313 42.115 15.783 1.00 18.01 H new ATOM 0 HB3 LEU A 155 11.312 41.106 15.142 1.00 18.01 H new ATOM 0 HG LEU A 155 9.573 42.735 15.516 1.00 18.78 H new ATOM 0 HD11 LEU A 155 10.172 44.994 15.840 1.00 15.72 H new ATOM 0 HD12 LEU A 155 10.581 44.123 17.098 1.00 15.72 H new ATOM 0 HD13 LEU A 155 11.681 44.558 16.044 1.00 15.72 H new ATOM 0 HD21 LEU A 155 10.127 43.995 13.604 1.00 17.23 H new ATOM 0 HD22 LEU A 155 11.621 43.482 13.716 1.00 17.23 H new ATOM 0 HD23 LEU A 155 10.457 42.464 13.375 1.00 17.23 H new ATOM 1258 N TYR A 156 8.838 41.455 17.945 1.00 19.29 N ATOM 1259 CA TYR A 156 7.412 41.168 18.039 1.00 21.58 C ATOM 1260 C TYR A 156 6.768 42.357 17.350 1.00 22.20 C ATOM 1261 O TYR A 156 7.127 43.511 17.620 1.00 20.86 O ATOM 1262 CB TYR A 156 6.961 41.116 19.494 1.00 23.20 C ATOM 1263 CG TYR A 156 7.550 39.960 20.263 1.00 24.27 C ATOM 1264 CD1 TYR A 156 6.911 38.720 20.280 1.00 26.00 C ATOM 1265 CD2 TYR A 156 8.706 40.119 21.029 1.00 24.99 C ATOM 1266 CE1 TYR A 156 7.401 37.666 21.037 1.00 26.50 C ATOM 1267 CE2 TYR A 156 9.206 39.071 21.796 1.00 27.98 C ATOM 1268 CZ TYR A 156 8.540 37.845 21.803 1.00 28.68 C ATOM 1269 OH TYR A 156 8.991 36.804 22.589 1.00 30.28 O ATOM 0 H TYR A 156 9.087 42.136 18.408 1.00 19.29 H new ATOM 0 HA TYR A 156 7.179 40.313 17.645 1.00 21.58 H new ATOM 0 HB2 TYR A 156 7.207 41.946 19.932 1.00 23.20 H new ATOM 0 HB3 TYR A 156 5.993 41.056 19.524 1.00 23.20 H new ATOM 0 HD1 TYR A 156 6.141 38.598 19.773 1.00 26.00 H new ATOM 0 HD2 TYR A 156 9.148 40.937 21.027 1.00 24.99 H new ATOM 0 HE1 TYR A 156 6.967 36.844 21.030 1.00 26.50 H new ATOM 0 HE2 TYR A 156 9.979 39.187 22.300 1.00 27.98 H new ATOM 0 HH TYR A 156 9.685 37.042 22.998 1.00 30.28 H new ATOM 1270 N TYR A 157 5.876 42.068 16.408 1.00 23.38 N ATOM 1271 CA TYR A 157 5.205 43.123 15.654 1.00 25.44 C ATOM 1272 C TYR A 157 3.730 42.805 15.418 1.00 26.38 C ATOM 1273 O TYR A 157 3.335 41.638 15.372 1.00 25.60 O ATOM 1274 CB TYR A 157 5.931 43.446 14.326 1.00 25.48 C ATOM 1275 CG TYR A 157 6.089 42.309 13.307 1.00 27.00 C ATOM 1276 CD1 TYR A 157 7.041 41.307 13.487 1.00 26.82 C ATOM 1277 CD2 TYR A 157 5.347 42.298 12.127 1.00 25.85 C ATOM 1278 CE1 TYR A 157 7.247 40.344 12.527 1.00 27.31 C ATOM 1279 CE2 TYR A 157 5.548 41.341 11.162 1.00 25.55 C ATOM 1280 CZ TYR A 157 6.499 40.367 11.368 1.00 28.53 C ATOM 1281 OH TYR A 157 6.708 39.391 10.415 1.00 30.91 O ATOM 0 H TYR A 157 5.645 41.269 16.190 1.00 23.38 H new ATOM 0 HA TYR A 157 5.246 43.922 16.203 1.00 25.44 H new ATOM 0 HB2 TYR A 157 5.454 44.171 13.893 1.00 25.48 H new ATOM 0 HB3 TYR A 157 6.816 43.778 14.542 1.00 25.48 H new ATOM 0 HD1 TYR A 157 7.545 41.289 14.269 1.00 26.82 H new ATOM 0 HD2 TYR A 157 4.701 42.953 11.990 1.00 25.85 H new ATOM 0 HE1 TYR A 157 7.886 39.682 12.658 1.00 27.31 H new ATOM 0 HE2 TYR A 157 5.047 41.351 10.378 1.00 25.55 H new ATOM 0 HH TYR A 157 6.192 39.519 9.765 1.00 30.91 H new ATOM 1282 N TRP A 158 2.928 43.858 15.280 1.00 26.80 N ATOM 1283 CA TRP A 158 1.499 43.698 15.095 1.00 27.13 C ATOM 1284 C TRP A 158 0.885 45.035 14.771 1.00 29.29 C ATOM 1285 O TRP A 158 1.488 46.080 15.000 1.00 26.55 O ATOM 1286 CB TRP A 158 0.887 43.225 16.422 1.00 27.55 C ATOM 1287 CG TRP A 158 1.075 44.237 17.569 1.00 29.05 C ATOM 1288 CD1 TRP A 158 0.206 45.235 17.938 1.00 29.51 C ATOM 1289 CD2 TRP A 158 2.212 44.374 18.443 1.00 28.24 C ATOM 1290 NE1 TRP A 158 0.731 45.974 18.967 1.00 28.92 N ATOM 1291 CE2 TRP A 158 1.961 45.464 19.298 1.00 28.29 C ATOM 1292 CE3 TRP A 158 3.420 43.666 18.575 1.00 29.01 C ATOM 1293 CZ2 TRP A 158 2.869 45.877 20.283 1.00 28.76 C ATOM 1294 CZ3 TRP A 158 4.328 44.075 19.559 1.00 30.17 C ATOM 1295 CH2 TRP A 158 4.044 45.173 20.400 1.00 30.07 C ATOM 0 H TRP A 158 3.198 44.675 15.291 1.00 26.80 H new ATOM 0 HA TRP A 158 1.334 43.063 14.380 1.00 27.13 H new ATOM 0 HB2 TRP A 158 -0.061 43.061 16.295 1.00 27.55 H new ATOM 0 HB3 TRP A 158 1.290 42.380 16.675 1.00 27.55 H new ATOM 0 HD1 TRP A 158 -0.623 45.388 17.545 1.00 29.51 H new ATOM 0 HE1 TRP A 158 0.351 46.647 19.344 1.00 28.92 H new ATOM 0 HE3 TRP A 158 3.611 42.943 18.022 1.00 29.01 H new ATOM 0 HZ2 TRP A 158 2.683 46.601 20.837 1.00 28.76 H new ATOM 0 HZ3 TRP A 158 5.131 43.616 19.660 1.00 30.17 H new ATOM 0 HH2 TRP A 158 4.664 45.425 21.046 1.00 30.07 H new ATOM 1296 N LYS A 159 -0.290 45.001 14.161 1.00 35.36 N ATOM 1297 CA LYS A 159 -1.043 46.233 13.930 1.00 40.52 C ATOM 1298 C LYS A 159 -2.225 46.029 14.891 1.00 43.89 C ATOM 1299 O LYS A 159 -2.356 44.954 15.477 1.00 45.05 O ATOM 1300 CB LYS A 159 -1.481 46.361 12.475 1.00 40.49 C ATOM 1301 CG LYS A 159 -2.094 45.128 11.939 1.00 41.95 C ATOM 1302 CD LYS A 159 -1.636 44.894 10.547 1.00 42.10 C ATOM 1303 CE LYS A 159 -2.113 43.560 10.103 1.00 42.46 C ATOM 1304 NZ LYS A 159 -2.629 43.734 8.747 1.00 46.35 N ATOM 0 H LYS A 159 -0.670 44.285 13.874 1.00 35.36 H new ATOM 0 HA LYS A 159 -0.546 47.051 14.087 1.00 40.52 H new ATOM 0 HB2 LYS A 159 -2.116 47.090 12.398 1.00 40.49 H new ATOM 0 HB3 LYS A 159 -0.712 46.595 11.932 1.00 40.49 H new ATOM 0 HG2 LYS A 159 -1.856 44.371 12.497 1.00 41.95 H new ATOM 0 HG3 LYS A 159 -3.061 45.203 11.961 1.00 41.95 H new ATOM 0 HD2 LYS A 159 -1.979 45.586 9.960 1.00 42.10 H new ATOM 0 HD3 LYS A 159 -0.668 44.937 10.500 1.00 42.10 H new ATOM 0 HE2 LYS A 159 -1.391 42.913 10.117 1.00 42.46 H new ATOM 0 HE3 LYS A 159 -2.805 43.226 10.695 1.00 42.46 H new ATOM 0 HZ1 LYS A 159 -3.422 43.336 8.678 1.00 46.35 H new ATOM 0 HZ2 LYS A 159 -2.716 44.602 8.572 1.00 46.35 H new ATOM 0 HZ3 LYS A 159 -2.063 43.370 8.165 1.00 46.35 H new ATOM 1305 N SER A 160 -3.062 47.029 15.121 1.00 46.98 N ATOM 1306 CA SER A 160 -4.163 46.801 16.054 1.00 49.80 C ATOM 1307 C SER A 160 -5.519 46.639 15.397 1.00 51.09 C ATOM 1308 O SER A 160 -5.852 45.544 14.938 1.00 52.13 O ATOM 1309 CB SER A 160 -4.198 47.883 17.116 1.00 52.74 C ATOM 1310 OG SER A 160 -3.054 47.769 17.946 1.00 56.64 O ATOM 0 H SER A 160 -3.020 47.812 14.769 1.00 46.98 H new ATOM 0 HA SER A 160 -3.979 45.945 16.471 1.00 49.80 H new ATOM 0 HB2 SER A 160 -4.221 48.758 16.699 1.00 52.74 H new ATOM 0 HB3 SER A 160 -5.005 47.801 17.648 1.00 52.74 H new ATOM 0 HG SER A 160 -3.073 48.369 18.533 1.00 56.64 H new ATOM 1311 N SER A 163 -5.155 41.010 17.289 1.00 61.16 N ATOM 1312 CA SER A 163 -5.401 39.636 17.814 1.00 61.31 C ATOM 1313 C SER A 163 -4.086 39.032 18.267 1.00 59.66 C ATOM 1314 O SER A 163 -3.898 38.773 19.455 1.00 60.13 O ATOM 1315 CB SER A 163 -6.038 38.742 16.734 1.00 63.85 C ATOM 1316 OG SER A 163 -7.288 39.260 16.285 1.00 65.46 O ATOM 0 HA SER A 163 -6.015 39.693 18.563 1.00 61.31 H new ATOM 0 HB2 SER A 163 -5.432 38.663 15.981 1.00 63.85 H new ATOM 0 HB3 SER A 163 -6.167 37.849 17.089 1.00 63.85 H new ATOM 0 HG SER A 163 -7.284 40.098 16.349 1.00 65.46 H new ATOM 1317 N GLY A 164 -3.153 38.874 17.330 1.00 58.46 N ATOM 1318 CA GLY A 164 -1.863 38.288 17.666 1.00 56.99 C ATOM 1319 C GLY A 164 -0.625 38.895 17.018 1.00 54.89 C ATOM 1320 O GLY A 164 -0.675 39.454 15.915 1.00 55.57 O ATOM 0 H GLY A 164 -3.247 39.097 16.505 1.00 58.46 H new ATOM 0 HA2 GLY A 164 -1.753 38.339 18.628 1.00 56.99 H new ATOM 0 HA3 GLY A 164 -1.892 37.347 17.433 1.00 56.99 H new ATOM 1321 N LYS A 165 0.500 38.767 17.715 1.00 51.74 N ATOM 1322 CA LYS A 165 1.778 39.286 17.234 1.00 49.23 C ATOM 1323 C LYS A 165 2.598 38.278 16.419 1.00 46.89 C ATOM 1324 O LYS A 165 2.666 37.082 16.744 1.00 46.84 O ATOM 1325 CB LYS A 165 2.617 39.773 18.418 1.00 48.42 C ATOM 1326 CG LYS A 165 1.862 40.755 19.274 1.00 50.29 C ATOM 1327 CD LYS A 165 2.534 41.094 20.590 1.00 49.97 C ATOM 1328 CE LYS A 165 1.602 42.029 21.345 1.00 51.54 C ATOM 1329 NZ LYS A 165 2.185 42.631 22.567 1.00 52.65 N ATOM 0 H LYS A 165 0.545 38.377 18.480 1.00 51.74 H new ATOM 0 HA LYS A 165 1.560 40.016 16.633 1.00 49.23 H new ATOM 0 HB2 LYS A 165 2.886 39.013 18.958 1.00 48.42 H new ATOM 0 HB3 LYS A 165 3.429 40.189 18.089 1.00 48.42 H new ATOM 0 HG2 LYS A 165 1.734 41.574 18.770 1.00 50.29 H new ATOM 0 HG3 LYS A 165 0.981 40.394 19.458 1.00 50.29 H new ATOM 0 HD2 LYS A 165 2.703 40.290 21.105 1.00 49.97 H new ATOM 0 HD3 LYS A 165 3.393 41.518 20.436 1.00 49.97 H new ATOM 0 HE2 LYS A 165 1.326 42.742 20.748 1.00 51.54 H new ATOM 0 HE3 LYS A 165 0.802 41.539 21.591 1.00 51.54 H new ATOM 0 HZ1 LYS A 165 1.584 43.163 22.952 1.00 52.65 H new ATOM 0 HZ2 LYS A 165 2.417 41.986 23.135 1.00 52.65 H new ATOM 0 HZ3 LYS A 165 2.905 43.107 22.349 1.00 52.65 H new ATOM 1330 N LYS A 166 3.190 38.773 15.337 1.00 43.05 N ATOM 1331 CA LYS A 166 4.064 37.969 14.493 1.00 38.54 C ATOM 1332 C LYS A 166 5.470 38.186 15.066 1.00 34.49 C ATOM 1333 O LYS A 166 5.711 39.167 15.765 1.00 31.10 O ATOM 1334 CB LYS A 166 3.985 38.456 13.061 1.00 38.20 C ATOM 1335 CG LYS A 166 2.588 38.336 12.490 1.00 43.09 C ATOM 1336 CD LYS A 166 2.519 38.946 11.100 1.00 47.40 C ATOM 1337 CE LYS A 166 2.035 37.937 10.074 1.00 51.00 C ATOM 1338 NZ LYS A 166 3.010 37.800 8.952 1.00 53.76 N ATOM 0 H LYS A 166 3.096 39.586 15.072 1.00 43.05 H new ATOM 0 HA LYS A 166 3.819 37.030 14.486 1.00 38.54 H new ATOM 0 HB2 LYS A 166 4.270 39.382 13.020 1.00 38.20 H new ATOM 0 HB3 LYS A 166 4.601 37.945 12.513 1.00 38.20 H new ATOM 0 HG2 LYS A 166 2.329 37.402 12.451 1.00 43.09 H new ATOM 0 HG3 LYS A 166 1.956 38.782 13.075 1.00 43.09 H new ATOM 0 HD2 LYS A 166 1.922 39.711 11.110 1.00 47.40 H new ATOM 0 HD3 LYS A 166 3.396 39.274 10.845 1.00 47.40 H new ATOM 0 HE2 LYS A 166 1.905 37.075 10.500 1.00 51.00 H new ATOM 0 HE3 LYS A 166 1.173 38.214 9.725 1.00 51.00 H new ATOM 0 HZ1 LYS A 166 2.705 37.205 8.365 1.00 53.76 H new ATOM 0 HZ2 LYS A 166 3.113 38.587 8.550 1.00 53.76 H new ATOM 0 HZ3 LYS A 166 3.794 37.526 9.272 1.00 53.76 H new ATOM 1339 N THR A 167 6.385 37.262 14.807 1.00 31.94 N ATOM 1340 CA THR A 167 7.728 37.402 15.346 1.00 29.13 C ATOM 1341 C THR A 167 8.788 37.120 14.288 1.00 26.78 C ATOM 1342 O THR A 167 8.511 36.481 13.283 1.00 26.42 O ATOM 1343 CB THR A 167 7.944 36.454 16.572 1.00 30.13 C ATOM 1344 OG1 THR A 167 8.017 35.096 16.129 1.00 31.63 O ATOM 1345 CG2 THR A 167 6.784 36.562 17.557 1.00 28.62 C ATOM 0 H THR A 167 6.252 36.559 14.330 1.00 31.94 H new ATOM 0 HA THR A 167 7.822 38.322 15.638 1.00 29.13 H new ATOM 0 HB THR A 167 8.769 36.720 17.008 1.00 30.13 H new ATOM 0 HG1 THR A 167 8.134 34.591 16.790 1.00 31.63 H new ATOM 0 HG21 THR A 167 6.940 35.967 18.307 1.00 28.62 H new ATOM 0 HG22 THR A 167 6.716 37.475 17.878 1.00 28.62 H new ATOM 0 HG23 THR A 167 5.958 36.313 17.113 1.00 28.62 H new ATOM 1346 N ALA A 168 9.985 37.656 14.500 1.00 24.05 N ATOM 1347 CA ALA A 168 11.123 37.444 13.601 1.00 21.72 C ATOM 1348 C ALA A 168 12.332 37.404 14.536 1.00 21.12 C ATOM 1349 O ALA A 168 12.268 37.949 15.640 1.00 19.32 O ATOM 1350 CB ALA A 168 11.260 38.591 12.625 1.00 20.59 C ATOM 0 H ALA A 168 10.165 38.158 15.175 1.00 24.05 H new ATOM 0 HA ALA A 168 11.027 36.639 13.069 1.00 21.72 H new ATOM 0 HB1 ALA A 168 12.018 38.430 12.041 1.00 20.59 H new ATOM 0 HB2 ALA A 168 10.452 38.662 12.093 1.00 20.59 H new ATOM 0 HB3 ALA A 168 11.399 39.417 13.114 1.00 20.59 H new ATOM 1351 N LYS A 169 13.423 36.787 14.088 1.00 20.53 N ATOM 1352 CA LYS A 169 14.644 36.681 14.899 1.00 18.38 C ATOM 1353 C LYS A 169 15.893 37.039 14.126 1.00 16.86 C ATOM 1354 O LYS A 169 15.939 36.922 12.905 1.00 15.82 O ATOM 1355 CB LYS A 169 14.804 35.271 15.448 1.00 16.88 C ATOM 1356 CG LYS A 169 13.801 34.954 16.512 1.00 21.65 C ATOM 1357 CD LYS A 169 14.031 33.583 17.055 1.00 26.14 C ATOM 1358 CE LYS A 169 13.134 33.334 18.238 1.00 30.68 C ATOM 1359 NZ LYS A 169 13.189 31.882 18.605 1.00 35.01 N ATOM 0 H LYS A 169 13.481 36.420 13.313 1.00 20.53 H new ATOM 0 HA LYS A 169 14.540 37.318 15.623 1.00 18.38 H new ATOM 0 HB2 LYS A 169 14.715 34.633 14.723 1.00 16.88 H new ATOM 0 HB3 LYS A 169 15.698 35.167 15.809 1.00 16.88 H new ATOM 0 HG2 LYS A 169 13.863 35.606 17.228 1.00 21.65 H new ATOM 0 HG3 LYS A 169 12.904 35.017 16.148 1.00 21.65 H new ATOM 0 HD2 LYS A 169 13.859 32.922 16.366 1.00 26.14 H new ATOM 0 HD3 LYS A 169 14.959 33.484 17.318 1.00 26.14 H new ATOM 0 HE2 LYS A 169 13.414 33.879 18.990 1.00 30.68 H new ATOM 0 HE3 LYS A 169 12.223 33.590 18.026 1.00 30.68 H new ATOM 0 HZ1 LYS A 169 12.659 31.732 19.304 1.00 35.01 H new ATOM 0 HZ2 LYS A 169 12.915 31.391 17.915 1.00 35.01 H new ATOM 0 HZ3 LYS A 169 14.025 31.660 18.814 1.00 35.01 H new ATOM 1360 N THR A 170 16.925 37.453 14.844 1.00 16.28 N ATOM 1361 CA THR A 170 18.175 37.788 14.195 1.00 17.54 C ATOM 1362 C THR A 170 19.378 37.716 15.128 1.00 16.87 C ATOM 1363 O THR A 170 19.242 37.892 16.323 1.00 15.92 O ATOM 1364 CB THR A 170 18.122 39.217 13.523 1.00 17.47 C ATOM 1365 OG1 THR A 170 19.313 39.429 12.748 1.00 16.80 O ATOM 1366 CG2 THR A 170 17.999 40.330 14.583 1.00 16.60 C ATOM 0 H THR A 170 16.921 37.545 15.699 1.00 16.28 H new ATOM 0 HA THR A 170 18.291 37.112 13.509 1.00 17.54 H new ATOM 0 HB THR A 170 17.340 39.252 12.950 1.00 17.47 H new ATOM 0 HG1 THR A 170 19.281 38.962 12.051 1.00 16.80 H new ATOM 0 HG21 THR A 170 17.969 41.194 14.143 1.00 16.60 H new ATOM 0 HG22 THR A 170 17.186 40.200 15.096 1.00 16.60 H new ATOM 0 HG23 THR A 170 18.765 40.297 15.178 1.00 16.60 H new ATOM 1367 N ASN A 171 20.538 37.390 14.559 1.00 16.85 N ATOM 1368 CA ASN A 171 21.780 37.372 15.317 1.00 17.25 C ATOM 1369 C ASN A 171 22.616 38.632 14.983 1.00 17.70 C ATOM 1370 O ASN A 171 23.824 38.643 15.198 1.00 17.70 O ATOM 1371 CB ASN A 171 22.586 36.070 15.130 1.00 17.90 C ATOM 1372 CG ASN A 171 23.012 35.823 13.691 1.00 19.49 C ATOM 1373 OD1 ASN A 171 22.672 36.586 12.778 1.00 21.52 O ATOM 1374 ND2 ASN A 171 23.757 34.737 13.477 1.00 17.01 N ATOM 0 H ASN A 171 20.624 37.176 13.731 1.00 16.85 H new ATOM 0 HA ASN A 171 21.551 37.392 16.259 1.00 17.25 H new ATOM 0 HB2 ASN A 171 23.376 36.103 15.693 1.00 17.90 H new ATOM 0 HB3 ASN A 171 22.051 35.320 15.435 1.00 17.90 H new ATOM 0 HD21 ASN A 171 24.019 34.546 12.681 1.00 17.01 H new ATOM 0 HD22 ASN A 171 23.975 34.229 14.135 1.00 17.01 H new ATOM 1375 N THR A 172 21.965 39.656 14.402 1.00 15.71 N ATOM 1376 CA THR A 172 22.587 40.946 14.109 1.00 14.94 C ATOM 1377 C THR A 172 21.753 41.954 14.909 1.00 15.96 C ATOM 1378 O THR A 172 21.043 41.583 15.852 1.00 17.13 O ATOM 1379 CB THR A 172 22.551 41.331 12.591 1.00 16.99 C ATOM 1380 OG1 THR A 172 21.207 41.593 12.166 1.00 16.80 O ATOM 1381 CG2 THR A 172 23.089 40.211 11.735 1.00 18.23 C ATOM 0 H THR A 172 21.139 39.612 14.167 1.00 15.71 H new ATOM 0 HA THR A 172 23.528 40.926 14.343 1.00 14.94 H new ATOM 0 HB THR A 172 23.100 42.124 12.487 1.00 16.99 H new ATOM 0 HG1 THR A 172 20.722 40.932 12.348 1.00 16.80 H new ATOM 0 HG21 THR A 172 23.056 40.473 10.802 1.00 18.23 H new ATOM 0 HG22 THR A 172 24.007 40.024 11.986 1.00 18.23 H new ATOM 0 HG23 THR A 172 22.550 39.415 11.866 1.00 18.23 H new ATOM 1382 N ASN A 173 21.835 43.228 14.551 1.00 17.35 N ATOM 1383 CA ASN A 173 21.055 44.260 15.245 1.00 20.16 C ATOM 1384 C ASN A 173 19.909 44.870 14.445 1.00 20.75 C ATOM 1385 O ASN A 173 19.426 45.943 14.779 1.00 20.50 O ATOM 1386 CB ASN A 173 21.954 45.372 15.805 1.00 21.13 C ATOM 1387 CG ASN A 173 22.568 44.982 17.129 1.00 25.14 C ATOM 1388 OD1 ASN A 173 23.346 44.049 17.185 1.00 24.66 O ATOM 1389 ND2 ASN A 173 22.143 45.630 18.213 1.00 28.90 N ATOM 0 H ASN A 173 22.332 43.521 13.913 1.00 17.35 H new ATOM 0 HA ASN A 173 20.635 43.776 15.973 1.00 20.16 H new ATOM 0 HB2 ASN A 173 22.658 45.571 15.168 1.00 21.13 H new ATOM 0 HB3 ASN A 173 21.434 46.183 15.916 1.00 21.13 H new ATOM 0 HD21 ASN A 173 22.420 45.393 18.992 1.00 28.90 H new ATOM 0 HD22 ASN A 173 21.592 46.286 18.134 1.00 28.90 H new ATOM 1390 N GLU A 174 19.502 44.216 13.365 1.00 21.50 N ATOM 1391 CA GLU A 174 18.385 44.702 12.569 1.00 22.80 C ATOM 1392 C GLU A 174 17.523 43.607 11.977 1.00 21.82 C ATOM 1393 O GLU A 174 17.931 42.451 11.841 1.00 21.39 O ATOM 1394 CB GLU A 174 18.811 45.692 11.492 1.00 24.89 C ATOM 1395 CG GLU A 174 20.226 45.619 11.071 1.00 30.96 C ATOM 1396 CD GLU A 174 20.643 46.875 10.338 1.00 37.27 C ATOM 1397 OE1 GLU A 174 20.345 46.982 9.126 1.00 40.30 O ATOM 1398 OE2 GLU A 174 21.249 47.770 10.974 1.00 40.20 O ATOM 0 H GLU A 174 19.859 43.489 13.076 1.00 21.50 H new ATOM 0 HA GLU A 174 17.830 45.175 13.209 1.00 22.80 H new ATOM 0 HB2 GLU A 174 18.252 45.555 10.711 1.00 24.89 H new ATOM 0 HB3 GLU A 174 18.633 46.590 11.814 1.00 24.89 H new ATOM 0 HG2 GLU A 174 20.792 45.492 11.849 1.00 30.96 H new ATOM 0 HG3 GLU A 174 20.356 44.848 10.497 1.00 30.96 H new ATOM 1399 N PHE A 175 16.285 43.987 11.717 1.00 22.38 N ATOM 1400 CA PHE A 175 15.293 43.110 11.145 1.00 22.80 C ATOM 1401 C PHE A 175 14.769 43.830 9.932 1.00 25.32 C ATOM 1402 O PHE A 175 14.643 45.047 9.941 1.00 27.02 O ATOM 1403 CB PHE A 175 14.106 42.940 12.097 1.00 21.99 C ATOM 1404 CG PHE A 175 14.459 42.339 13.430 1.00 19.71 C ATOM 1405 CD1 PHE A 175 14.911 43.153 14.485 1.00 18.13 C ATOM 1406 CD2 PHE A 175 14.284 40.967 13.656 1.00 16.60 C ATOM 1407 CE1 PHE A 175 15.178 42.591 15.757 1.00 18.40 C ATOM 1408 CE2 PHE A 175 14.545 40.410 14.907 1.00 17.27 C ATOM 1409 CZ PHE A 175 14.989 41.217 15.960 1.00 15.82 C ATOM 0 H PHE A 175 15.995 44.781 11.873 1.00 22.38 H new ATOM 0 HA PHE A 175 15.681 42.241 10.956 1.00 22.80 H new ATOM 0 HB2 PHE A 175 13.697 43.807 12.244 1.00 21.99 H new ATOM 0 HB3 PHE A 175 13.440 42.380 11.669 1.00 21.99 H new ATOM 0 HD1 PHE A 175 15.035 44.064 14.346 1.00 18.13 H new ATOM 0 HD2 PHE A 175 13.990 40.421 12.963 1.00 16.60 H new ATOM 0 HE1 PHE A 175 15.477 43.130 16.453 1.00 18.40 H new ATOM 0 HE2 PHE A 175 14.423 39.498 15.042 1.00 17.27 H new ATOM 0 HZ PHE A 175 15.159 40.842 16.794 1.00 15.82 H new ATOM 1410 N LEU A 176 14.502 43.085 8.872 1.00 26.92 N ATOM 1411 CA LEU A 176 13.919 43.658 7.667 1.00 28.18 C ATOM 1412 C LEU A 176 12.671 42.790 7.486 1.00 29.12 C ATOM 1413 O LEU A 176 12.771 41.560 7.365 1.00 27.62 O ATOM 1414 CB LEU A 176 14.866 43.555 6.472 1.00 26.81 C ATOM 1415 CG LEU A 176 14.370 44.314 5.245 1.00 24.27 C ATOM 1416 CD1 LEU A 176 14.219 45.792 5.544 1.00 25.07 C ATOM 1417 CD2 LEU A 176 15.353 44.101 4.132 1.00 25.58 C ATOM 0 H LEU A 176 14.651 42.239 8.828 1.00 26.92 H new ATOM 0 HA LEU A 176 13.730 44.607 7.734 1.00 28.18 H new ATOM 0 HB2 LEU A 176 15.737 43.897 6.727 1.00 26.81 H new ATOM 0 HB3 LEU A 176 14.985 42.621 6.241 1.00 26.81 H new ATOM 0 HG LEU A 176 13.496 43.981 4.987 1.00 24.27 H new ATOM 0 HD11 LEU A 176 13.903 46.252 4.751 1.00 25.07 H new ATOM 0 HD12 LEU A 176 13.580 45.913 6.263 1.00 25.07 H new ATOM 0 HD13 LEU A 176 15.077 46.158 5.810 1.00 25.07 H new ATOM 0 HD21 LEU A 176 15.055 44.577 3.341 1.00 25.58 H new ATOM 0 HD22 LEU A 176 16.223 44.435 4.400 1.00 25.58 H new ATOM 0 HD23 LEU A 176 15.417 43.154 3.934 1.00 25.58 H new ATOM 1418 N ILE A 177 11.506 43.414 7.665 1.00 30.32 N ATOM 1419 CA ILE A 177 10.240 42.700 7.544 1.00 32.15 C ATOM 1420 C ILE A 177 9.318 43.254 6.450 1.00 33.88 C ATOM 1421 O ILE A 177 9.519 44.346 5.927 1.00 33.26 O ATOM 1422 CB ILE A 177 9.448 42.692 8.897 1.00 32.46 C ATOM 1423 CG1 ILE A 177 9.047 44.114 9.305 1.00 32.59 C ATOM 1424 CG2 ILE A 177 10.261 42.005 10.015 1.00 31.96 C ATOM 1425 CD1 ILE A 177 8.018 44.154 10.458 1.00 31.40 C ATOM 0 H ILE A 177 11.430 44.249 7.857 1.00 30.32 H new ATOM 0 HA ILE A 177 10.494 41.797 7.295 1.00 32.15 H new ATOM 0 HB ILE A 177 8.636 42.178 8.763 1.00 32.46 H new ATOM 0 HG12 ILE A 177 9.841 44.603 9.572 1.00 32.59 H new ATOM 0 HG13 ILE A 177 8.677 44.572 8.534 1.00 32.59 H new ATOM 0 HG21 ILE A 177 9.750 42.014 10.839 1.00 31.96 H new ATOM 0 HG22 ILE A 177 10.450 41.088 9.761 1.00 31.96 H new ATOM 0 HG23 ILE A 177 11.096 42.481 10.148 1.00 31.96 H new ATOM 0 HD11 ILE A 177 7.805 45.076 10.670 1.00 31.40 H new ATOM 0 HD12 ILE A 177 7.210 43.690 10.187 1.00 31.40 H new ATOM 0 HD13 ILE A 177 8.392 43.721 11.241 1.00 31.40 H new ATOM 1426 N ASP A 178 8.322 42.466 6.078 1.00 37.23 N ATOM 1427 CA ASP A 178 7.351 42.907 5.086 1.00 40.98 C ATOM 1428 C ASP A 178 6.129 43.396 5.837 1.00 41.83 C ATOM 1429 O ASP A 178 5.660 42.732 6.762 1.00 43.82 O ATOM 1430 CB ASP A 178 6.979 41.757 4.158 1.00 43.94 C ATOM 1431 CG ASP A 178 7.824 41.738 2.907 1.00 49.41 C ATOM 1432 OD1 ASP A 178 7.874 42.785 2.225 1.00 52.78 O ATOM 1433 OD2 ASP A 178 8.448 40.699 2.606 1.00 52.06 O ATOM 0 H ASP A 178 8.189 41.674 6.386 1.00 37.23 H new ATOM 0 HA ASP A 178 7.722 43.616 4.538 1.00 40.98 H new ATOM 0 HB2 ASP A 178 7.084 40.916 4.630 1.00 43.94 H new ATOM 0 HB3 ASP A 178 6.043 41.831 3.913 1.00 43.94 H new ATOM 1434 N VAL A 179 5.619 44.562 5.486 1.00 41.52 N ATOM 1435 CA VAL A 179 4.453 45.053 6.200 1.00 43.15 C ATOM 1436 C VAL A 179 3.220 45.211 5.343 1.00 44.67 C ATOM 1437 O VAL A 179 3.317 45.406 4.137 1.00 44.75 O ATOM 1438 CB VAL A 179 4.729 46.393 6.922 1.00 43.28 C ATOM 1439 CG1 VAL A 179 5.594 46.156 8.156 1.00 42.12 C ATOM 1440 CG2 VAL A 179 5.382 47.392 5.966 1.00 43.15 C ATOM 0 H VAL A 179 5.918 45.071 4.860 1.00 41.52 H new ATOM 0 HA VAL A 179 4.272 44.357 6.851 1.00 43.15 H new ATOM 0 HB VAL A 179 3.886 46.774 7.214 1.00 43.28 H new ATOM 0 HG11 VAL A 179 5.761 47.001 8.601 1.00 42.12 H new ATOM 0 HG12 VAL A 179 5.134 45.556 8.764 1.00 42.12 H new ATOM 0 HG13 VAL A 179 6.438 45.759 7.889 1.00 42.12 H new ATOM 0 HG21 VAL A 179 5.548 48.226 6.433 1.00 43.15 H new ATOM 0 HG22 VAL A 179 6.222 47.030 5.643 1.00 43.15 H new ATOM 0 HG23 VAL A 179 4.791 47.555 5.215 1.00 43.15 H new ATOM 1441 N ASP A 180 2.058 45.094 5.978 1.00 46.98 N ATOM 1442 CA ASP A 180 0.795 45.259 5.280 1.00 49.75 C ATOM 1443 C ASP A 180 0.549 46.721 4.982 1.00 51.67 C ATOM 1444 O ASP A 180 0.676 47.592 5.847 1.00 50.97 O ATOM 1445 CB ASP A 180 -0.384 44.679 6.060 1.00 50.65 C ATOM 1446 CG ASP A 180 -0.529 43.188 5.871 1.00 51.25 C ATOM 1447 OD1 ASP A 180 0.204 42.610 5.042 1.00 52.79 O ATOM 1448 OD2 ASP A 180 -1.382 42.586 6.547 1.00 51.33 O ATOM 0 H ASP A 180 1.982 44.919 6.817 1.00 46.98 H new ATOM 0 HA ASP A 180 0.863 44.763 4.449 1.00 49.75 H new ATOM 0 HB2 ASP A 180 -0.269 44.872 7.004 1.00 50.65 H new ATOM 0 HB3 ASP A 180 -1.201 45.118 5.778 1.00 50.65 H new ATOM 1449 N LYS A 181 0.231 46.959 3.719 1.00 53.18 N ATOM 1450 CA LYS A 181 -0.049 48.266 3.186 1.00 54.34 C ATOM 1451 C LYS A 181 -1.216 48.899 3.943 1.00 54.70 C ATOM 1452 O LYS A 181 -2.203 48.228 4.281 1.00 54.40 O ATOM 1453 CB LYS A 181 -0.328 48.100 1.678 1.00 56.30 C ATOM 1454 CG LYS A 181 -1.415 48.948 1.067 1.00 57.65 C ATOM 1455 CD LYS A 181 -1.530 48.653 -0.413 1.00 58.44 C ATOM 1456 CE LYS A 181 -2.350 49.729 -1.078 1.00 59.84 C ATOM 1457 NZ LYS A 181 -2.203 49.703 -2.554 1.00 62.07 N ATOM 0 H LYS A 181 0.172 46.334 3.131 1.00 53.18 H new ATOM 0 HA LYS A 181 0.702 48.869 3.298 1.00 54.34 H new ATOM 0 HB2 LYS A 181 0.496 48.282 1.200 1.00 56.30 H new ATOM 0 HB3 LYS A 181 -0.549 47.170 1.516 1.00 56.30 H new ATOM 0 HG2 LYS A 181 -2.261 48.769 1.507 1.00 57.65 H new ATOM 0 HG3 LYS A 181 -1.217 49.888 1.203 1.00 57.65 H new ATOM 0 HD2 LYS A 181 -0.648 48.611 -0.814 1.00 58.44 H new ATOM 0 HD3 LYS A 181 -1.945 47.787 -0.549 1.00 58.44 H new ATOM 0 HE2 LYS A 181 -3.284 49.614 -0.844 1.00 59.84 H new ATOM 0 HE3 LYS A 181 -2.078 50.597 -0.741 1.00 59.84 H new ATOM 0 HZ1 LYS A 181 -2.699 50.349 -2.913 1.00 62.07 H new ATOM 0 HZ2 LYS A 181 -1.349 49.830 -2.770 1.00 62.07 H new ATOM 0 HZ3 LYS A 181 -2.473 48.914 -2.866 1.00 62.07 H new ATOM 1458 N GLY A 182 -1.046 50.177 4.267 1.00 54.95 N ATOM 1459 CA GLY A 182 -2.071 50.915 4.976 1.00 55.25 C ATOM 1460 C GLY A 182 -2.289 50.406 6.380 1.00 55.26 C ATOM 1461 O GLY A 182 -3.436 50.240 6.810 1.00 56.37 O ATOM 0 H GLY A 182 -0.340 50.632 4.082 1.00 54.95 H new ATOM 0 HA2 GLY A 182 -1.824 51.852 5.010 1.00 55.25 H new ATOM 0 HA3 GLY A 182 -2.904 50.859 4.483 1.00 55.25 H new ATOM 1462 N GLU A 183 -1.190 50.139 7.079 1.00 53.78 N ATOM 1463 CA GLU A 183 -1.251 49.651 8.447 1.00 53.14 C ATOM 1464 C GLU A 183 -0.128 50.270 9.265 1.00 50.14 C ATOM 1465 O GLU A 183 0.999 50.354 8.793 1.00 51.47 O ATOM 1466 CB GLU A 183 -1.066 48.128 8.491 1.00 57.91 C ATOM 1467 CG GLU A 183 -2.003 47.295 7.623 1.00 63.17 C ATOM 1468 CD GLU A 183 -3.455 47.307 8.097 1.00 68.00 C ATOM 1469 OE1 GLU A 183 -3.775 47.958 9.128 1.00 69.01 O ATOM 1470 OE2 GLU A 183 -4.287 46.652 7.421 1.00 70.60 O ATOM 0 H GLU A 183 -0.392 50.236 6.773 1.00 53.78 H new ATOM 0 HA GLU A 183 -2.119 49.891 8.808 1.00 53.14 H new ATOM 0 HB2 GLU A 183 -0.154 47.927 8.230 1.00 57.91 H new ATOM 0 HB3 GLU A 183 -1.168 47.838 9.411 1.00 57.91 H new ATOM 0 HG2 GLU A 183 -1.966 47.626 6.712 1.00 63.17 H new ATOM 0 HG3 GLU A 183 -1.685 46.379 7.605 1.00 63.17 H new ATOM 1471 N ASN A 184 -0.441 50.752 10.462 1.00 46.26 N ATOM 1472 CA ASN A 184 0.583 51.289 11.349 1.00 41.84 C ATOM 1473 C ASN A 184 0.960 50.135 12.271 1.00 38.65 C ATOM 1474 O ASN A 184 0.090 49.581 12.943 1.00 39.84 O ATOM 1475 CB ASN A 184 0.032 52.443 12.182 1.00 42.50 C ATOM 1476 CG ASN A 184 0.051 53.771 11.438 1.00 45.03 C ATOM 1477 OD1 ASN A 184 -0.555 54.758 11.885 1.00 45.40 O ATOM 1478 ND2 ASN A 184 0.759 53.816 10.310 1.00 44.89 N ATOM 0 H ASN A 184 -1.240 50.777 10.779 1.00 46.26 H new ATOM 0 HA ASN A 184 1.339 51.631 10.847 1.00 41.84 H new ATOM 0 HB2 ASN A 184 -0.878 52.239 12.447 1.00 42.50 H new ATOM 0 HB3 ASN A 184 0.553 52.526 12.996 1.00 42.50 H new ATOM 0 HD21 ASN A 184 0.809 54.549 9.862 1.00 44.89 H new ATOM 0 HD22 ASN A 184 1.166 53.112 10.030 1.00 44.89 H new ATOM 1479 N TYR A 185 2.220 49.707 12.238 1.00 34.12 N ATOM 1480 CA TYR A 185 2.669 48.609 13.101 1.00 30.34 C ATOM 1481 C TYR A 185 3.364 49.096 14.346 1.00 27.15 C ATOM 1482 O TYR A 185 4.011 50.132 14.330 1.00 24.85 O ATOM 1483 CB TYR A 185 3.665 47.683 12.387 1.00 29.90 C ATOM 1484 CG TYR A 185 3.052 46.775 11.378 1.00 29.98 C ATOM 1485 CD1 TYR A 185 2.679 47.262 10.118 1.00 32.41 C ATOM 1486 CD2 TYR A 185 2.815 45.436 11.679 1.00 29.94 C ATOM 1487 CE1 TYR A 185 2.068 46.435 9.172 1.00 34.41 C ATOM 1488 CE2 TYR A 185 2.208 44.590 10.743 1.00 33.46 C ATOM 1489 CZ TYR A 185 1.839 45.106 9.491 1.00 34.77 C ATOM 1490 OH TYR A 185 1.238 44.306 8.566 1.00 36.29 O ATOM 0 H TYR A 185 2.829 50.035 11.727 1.00 34.12 H new ATOM 0 HA TYR A 185 1.855 48.134 13.331 1.00 30.34 H new ATOM 0 HB2 TYR A 185 4.338 48.227 11.949 1.00 29.90 H new ATOM 0 HB3 TYR A 185 4.124 47.146 13.052 1.00 29.90 H new ATOM 0 HD1 TYR A 185 2.841 48.153 9.907 1.00 32.41 H new ATOM 0 HD2 TYR A 185 3.062 45.100 12.510 1.00 29.94 H new ATOM 0 HE1 TYR A 185 1.819 46.771 8.341 1.00 34.41 H new ATOM 0 HE2 TYR A 185 2.051 43.697 10.948 1.00 33.46 H new ATOM 0 HH TYR A 185 1.281 43.506 8.817 1.00 36.29 H new ATOM 1491 N CYS A 186 3.244 48.307 15.410 1.00 27.22 N ATOM 1492 CA CYS A 186 3.924 48.581 16.686 1.00 27.10 C ATOM 1493 C CYS A 186 4.930 47.454 16.840 1.00 25.52 C ATOM 1494 O CYS A 186 4.665 46.330 16.403 1.00 22.98 O ATOM 1495 CB CYS A 186 2.955 48.564 17.855 1.00 28.83 C ATOM 1496 SG CYS A 186 1.889 50.037 17.855 1.00 33.94 S ATOM 0 H CYS A 186 2.765 47.593 15.418 1.00 27.22 H new ATOM 0 HA CYS A 186 4.334 49.460 16.682 1.00 27.10 H new ATOM 0 HB2 CYS A 186 2.406 47.765 17.811 1.00 28.83 H new ATOM 0 HB3 CYS A 186 3.451 48.522 18.688 1.00 28.83 H new ATOM 1497 N PHE A 187 6.070 47.754 17.461 1.00 25.22 N ATOM 1498 CA PHE A 187 7.151 46.768 17.625 1.00 24.92 C ATOM 1499 C PHE A 187 7.754 46.753 19.037 1.00 23.88 C ATOM 1500 O PHE A 187 7.713 47.749 19.744 1.00 21.24 O ATOM 1501 CB PHE A 187 8.313 47.104 16.670 1.00 24.85 C ATOM 1502 CG PHE A 187 7.916 47.250 15.230 1.00 26.37 C ATOM 1503 CD1 PHE A 187 7.805 46.135 14.409 1.00 26.76 C ATOM 1504 CD2 PHE A 187 7.680 48.506 14.680 1.00 27.45 C ATOM 1505 CE1 PHE A 187 7.471 46.272 13.068 1.00 26.14 C ATOM 1506 CE2 PHE A 187 7.345 48.639 13.336 1.00 25.74 C ATOM 1507 CZ PHE A 187 7.242 47.521 12.538 1.00 24.21 C ATOM 0 H PHE A 187 6.242 48.526 17.798 1.00 25.22 H new ATOM 0 HA PHE A 187 6.746 45.906 17.440 1.00 24.92 H new ATOM 0 HB2 PHE A 187 8.729 47.929 16.964 1.00 24.85 H new ATOM 0 HB3 PHE A 187 8.985 46.408 16.739 1.00 24.85 H new ATOM 0 HD1 PHE A 187 7.956 45.288 14.761 1.00 26.76 H new ATOM 0 HD2 PHE A 187 7.747 49.263 15.215 1.00 27.45 H new ATOM 0 HE1 PHE A 187 7.402 45.518 12.527 1.00 26.14 H new ATOM 0 HE2 PHE A 187 7.191 49.483 12.977 1.00 25.74 H new ATOM 0 HZ PHE A 187 7.017 47.610 11.640 1.00 24.21 H new ATOM 1508 N SER A 188 8.310 45.604 19.413 1.00 22.89 N ATOM 1509 CA SER A 188 9.017 45.432 20.685 1.00 22.62 C ATOM 1510 C SER A 188 10.085 44.329 20.451 1.00 21.41 C ATOM 1511 O SER A 188 9.890 43.426 19.619 1.00 19.91 O ATOM 1512 CB ASER A 188 8.059 45.038 21.812 0.50 23.12 C ATOM 1513 CB BSER A 188 8.042 45.020 21.797 0.50 21.82 C ATOM 1514 OG ASER A 188 8.736 45.040 23.060 0.50 23.82 O ATOM 1515 OG BSER A 188 7.405 43.789 21.503 0.50 20.02 O ATOM 0 H SER A 188 8.288 44.892 18.932 1.00 22.89 H new ATOM 0 HA SER A 188 9.429 46.265 20.962 1.00 22.62 H new ATOM 0 HB2ASER A 188 7.313 45.657 21.841 0.50 21.82 H new ATOM 0 HB2BSER A 188 8.521 44.945 22.637 0.50 21.82 H new ATOM 0 HB3ASER A 188 7.691 44.158 21.638 0.50 21.82 H new ATOM 0 HB3BSER A 188 7.372 45.712 21.914 0.50 21.82 H new ATOM 0 HG ASER A 188 8.764 45.823 23.363 0.50 20.02 H new ATOM 0 HG BSER A 188 6.880 43.589 22.127 0.50 20.02 H new ATOM 1516 N VAL A 189 11.235 44.442 21.111 1.00 20.32 N ATOM 1517 CA VAL A 189 12.299 43.447 20.921 1.00 19.51 C ATOM 1518 C VAL A 189 12.759 42.871 22.243 1.00 20.10 C ATOM 1519 O VAL A 189 12.685 43.543 23.281 1.00 21.47 O ATOM 1520 CB AVAL A 189 13.531 44.081 20.188 0.50 21.09 C ATOM 1521 CB BVAL A 189 13.528 43.985 20.125 0.50 19.41 C ATOM 1522 CG1AVAL A 189 13.993 45.334 20.894 0.50 22.64 C ATOM 1523 CG1BVAL A 189 13.097 44.531 18.777 0.50 16.59 C ATOM 1524 CG2AVAL A 189 14.692 43.098 20.125 0.50 21.22 C ATOM 1525 CG2BVAL A 189 14.302 45.015 20.919 0.50 20.03 C ATOM 0 H VAL A 189 11.421 45.073 21.664 1.00 20.32 H new ATOM 0 HA VAL A 189 11.928 42.735 20.377 1.00 19.51 H new ATOM 0 HB AVAL A 189 13.246 44.303 19.288 0.50 19.41 H new ATOM 0 HB BVAL A 189 14.129 43.240 19.968 0.50 19.41 H new ATOM 0 HG11AVAL A 189 14.755 45.708 20.424 0.50 16.59 H new ATOM 0 HG11BVAL A 189 13.873 44.860 18.298 0.50 16.59 H new ATOM 0 HG12AVAL A 189 13.272 45.982 20.908 0.50 16.59 H new ATOM 0 HG12BVAL A 189 12.675 43.826 18.262 0.50 16.59 H new ATOM 0 HG13AVAL A 189 14.250 45.117 21.804 0.50 16.59 H new ATOM 0 HG13BVAL A 189 12.467 45.257 18.908 0.50 16.59 H new ATOM 0 HG21AVAL A 189 15.441 43.511 19.668 0.50 20.03 H new ATOM 0 HG21BVAL A 189 15.057 45.327 20.396 0.50 20.03 H new ATOM 0 HG22AVAL A 189 14.958 42.853 21.025 0.50 20.03 H new ATOM 0 HG22BVAL A 189 13.723 45.764 21.129 0.50 20.03 H new ATOM 0 HG23AVAL A 189 14.417 42.303 19.642 0.50 20.03 H new ATOM 0 HG23BVAL A 189 14.623 44.615 21.742 0.50 20.03 H new ATOM 1526 N GLN A 190 13.197 41.619 22.207 1.00 17.99 N ATOM 1527 CA GLN A 190 13.686 40.960 23.400 1.00 17.89 C ATOM 1528 C GLN A 190 15.029 40.280 23.090 1.00 18.12 C ATOM 1529 O GLN A 190 15.233 39.763 21.980 1.00 17.97 O ATOM 1530 CB GLN A 190 12.664 39.945 23.898 1.00 19.54 C ATOM 1531 CG GLN A 190 13.006 39.350 25.265 1.00 22.35 C ATOM 1532 CD GLN A 190 12.048 38.252 25.659 1.00 25.39 C ATOM 1533 OE1 GLN A 190 11.664 37.417 24.838 1.00 25.83 O ATOM 1534 NE2 GLN A 190 11.643 38.252 26.917 1.00 25.72 N ATOM 0 H GLN A 190 13.218 41.135 21.496 1.00 17.99 H new ATOM 0 HA GLN A 190 13.821 41.616 24.102 1.00 17.89 H new ATOM 0 HB2 GLN A 190 11.794 40.371 23.948 1.00 19.54 H new ATOM 0 HB3 GLN A 190 12.591 39.227 23.250 1.00 19.54 H new ATOM 0 HG2 GLN A 190 13.910 38.999 25.247 1.00 22.35 H new ATOM 0 HG3 GLN A 190 12.987 40.051 25.936 1.00 22.35 H new ATOM 0 HE21 GLN A 190 11.933 38.851 27.462 1.00 25.72 H new ATOM 0 HE22 GLN A 190 11.090 37.653 27.191 1.00 25.72 H new ATOM 1535 N ALA A 191 15.961 40.343 24.046 1.00 16.91 N ATOM 1536 CA ALA A 191 17.274 39.723 23.872 1.00 16.54 C ATOM 1537 C ALA A 191 17.239 38.320 24.452 1.00 16.63 C ATOM 1538 O ALA A 191 16.639 38.110 25.502 1.00 18.62 O ATOM 1539 CB ALA A 191 18.363 40.556 24.558 1.00 13.45 C ATOM 0 H ALA A 191 15.851 40.740 24.801 1.00 16.91 H new ATOM 0 HA ALA A 191 17.484 39.680 22.926 1.00 16.54 H new ATOM 0 HB1 ALA A 191 19.225 40.129 24.432 1.00 13.45 H new ATOM 0 HB2 ALA A 191 18.383 41.445 24.170 1.00 13.45 H new ATOM 0 HB3 ALA A 191 18.171 40.622 25.507 1.00 13.45 H new ATOM 1540 N VAL A 192 17.877 37.369 23.771 1.00 15.19 N ATOM 1541 CA VAL A 192 17.937 35.980 24.230 1.00 16.09 C ATOM 1542 C VAL A 192 19.273 35.333 23.858 1.00 15.58 C ATOM 1543 O VAL A 192 19.807 35.561 22.787 1.00 16.43 O ATOM 1544 CB VAL A 192 16.806 35.063 23.599 1.00 17.89 C ATOM 1545 CG1 VAL A 192 16.873 33.650 24.175 1.00 17.34 C ATOM 1546 CG2 VAL A 192 15.417 35.632 23.836 1.00 20.97 C ATOM 0 H VAL A 192 18.288 37.511 23.029 1.00 15.19 H new ATOM 0 HA VAL A 192 17.817 36.032 25.191 1.00 16.09 H new ATOM 0 HB VAL A 192 16.968 35.035 22.643 1.00 17.89 H new ATOM 0 HG11 VAL A 192 16.175 33.105 23.778 1.00 17.34 H new ATOM 0 HG12 VAL A 192 17.739 33.260 23.977 1.00 17.34 H new ATOM 0 HG13 VAL A 192 16.747 33.686 25.136 1.00 17.34 H new ATOM 0 HG21 VAL A 192 14.755 35.046 23.437 1.00 20.97 H new ATOM 0 HG22 VAL A 192 15.254 35.702 24.790 1.00 20.97 H new ATOM 0 HG23 VAL A 192 15.354 36.512 23.433 1.00 20.97 H new ATOM 1547 N ILE A 193 19.812 34.539 24.773 1.00 15.19 N ATOM 1548 CA ILE A 193 21.035 33.800 24.535 1.00 16.45 C ATOM 1549 C ILE A 193 20.522 32.370 24.740 1.00 19.03 C ATOM 1550 O ILE A 193 20.559 31.819 25.847 1.00 17.34 O ATOM 1551 CB ILE A 193 22.162 34.191 25.528 1.00 15.45 C ATOM 1552 CG1 ILE A 193 22.589 35.632 25.257 1.00 16.14 C ATOM 1553 CG2 ILE A 193 23.400 33.288 25.371 1.00 13.23 C ATOM 1554 CD1 ILE A 193 23.481 36.171 26.322 1.00 18.78 C ATOM 0 H ILE A 193 19.474 34.415 25.554 1.00 15.19 H new ATOM 0 HA ILE A 193 21.451 33.957 23.673 1.00 16.45 H new ATOM 0 HB ILE A 193 21.813 34.088 26.427 1.00 15.45 H new ATOM 0 HG12 ILE A 193 23.047 35.676 24.403 1.00 16.14 H new ATOM 0 HG13 ILE A 193 21.800 36.192 25.185 1.00 16.14 H new ATOM 0 HG21 ILE A 193 24.082 33.560 26.005 1.00 13.23 H new ATOM 0 HG22 ILE A 193 23.152 32.366 25.540 1.00 13.23 H new ATOM 0 HG23 ILE A 193 23.747 33.369 24.469 1.00 13.23 H new ATOM 0 HD11 ILE A 193 23.725 37.085 26.108 1.00 18.78 H new ATOM 0 HD12 ILE A 193 23.017 36.152 27.174 1.00 18.78 H new ATOM 0 HD13 ILE A 193 24.282 35.627 26.379 1.00 18.78 H new ATOM 1555 N PRO A 194 19.999 31.759 23.656 1.00 19.38 N ATOM 1556 CA PRO A 194 19.469 30.397 23.751 1.00 19.80 C ATOM 1557 C PRO A 194 20.379 29.340 24.377 1.00 19.22 C ATOM 1558 O PRO A 194 19.883 28.437 25.029 1.00 21.19 O ATOM 1559 CB PRO A 194 19.064 30.076 22.310 1.00 20.71 C ATOM 1560 CG PRO A 194 19.915 30.975 21.485 1.00 20.44 C ATOM 1561 CD PRO A 194 19.967 32.254 22.267 1.00 18.30 C ATOM 0 HA PRO A 194 18.734 30.366 24.384 1.00 19.80 H new ATOM 0 HB2 PRO A 194 19.222 29.143 22.096 1.00 20.71 H new ATOM 0 HB3 PRO A 194 18.121 30.245 22.161 1.00 20.71 H new ATOM 0 HG2 PRO A 194 20.801 30.603 21.355 1.00 20.44 H new ATOM 0 HG3 PRO A 194 19.534 31.114 20.604 1.00 20.44 H new ATOM 0 HD2 PRO A 194 20.752 32.781 22.051 1.00 18.30 H new ATOM 0 HD3 PRO A 194 19.194 32.815 22.099 1.00 18.30 H new ATOM 1562 N SER A 195 21.698 29.461 24.212 1.00 19.12 N ATOM 1563 CA SER A 195 22.622 28.491 24.794 1.00 18.59 C ATOM 1564 C SER A 195 22.777 28.542 26.337 1.00 18.65 C ATOM 1565 O SER A 195 23.371 27.638 26.944 1.00 19.06 O ATOM 1566 CB SER A 195 23.987 28.610 24.126 1.00 19.07 C ATOM 1567 OG SER A 195 24.567 29.879 24.384 1.00 19.99 O ATOM 0 H SER A 195 22.074 30.095 23.769 1.00 19.12 H new ATOM 0 HA SER A 195 22.218 27.627 24.618 1.00 18.59 H new ATOM 0 HB2 SER A 195 24.573 27.910 24.452 1.00 19.07 H new ATOM 0 HB3 SER A 195 23.896 28.480 23.169 1.00 19.07 H new ATOM 0 HG SER A 195 24.267 30.441 23.837 1.00 19.99 H new ATOM 1568 N ARG A 196 22.278 29.589 26.983 1.00 18.66 N ATOM 1569 CA ARG A 196 22.383 29.660 28.453 1.00 18.34 C ATOM 1570 C ARG A 196 21.399 28.671 29.040 1.00 20.76 C ATOM 1571 O ARG A 196 20.461 28.250 28.356 1.00 20.55 O ATOM 1572 CB ARG A 196 22.003 31.049 28.971 1.00 17.42 C ATOM 1573 CG ARG A 196 23.162 32.045 29.011 1.00 17.98 C ATOM 1574 CD ARG A 196 22.691 33.457 29.349 1.00 16.75 C ATOM 1575 NE ARG A 196 23.827 34.385 29.484 1.00 15.59 N ATOM 1576 CZ ARG A 196 23.797 35.526 30.179 1.00 17.17 C ATOM 1577 NH1 ARG A 196 22.682 35.893 30.808 1.00 15.62 N ATOM 1578 NH2 ARG A 196 24.892 36.286 30.278 1.00 16.32 N ATOM 0 H ARG A 196 21.884 30.256 26.610 1.00 18.66 H new ATOM 0 HA ARG A 196 23.298 29.465 28.708 1.00 18.34 H new ATOM 0 HB2 ARG A 196 21.299 31.410 28.410 1.00 17.42 H new ATOM 0 HB3 ARG A 196 21.636 30.960 29.864 1.00 17.42 H new ATOM 0 HG2 ARG A 196 23.813 31.756 29.669 1.00 17.98 H new ATOM 0 HG3 ARG A 196 23.611 32.052 28.151 1.00 17.98 H new ATOM 0 HD2 ARG A 196 22.092 33.775 28.655 1.00 16.75 H new ATOM 0 HD3 ARG A 196 22.184 33.441 30.176 1.00 16.75 H new ATOM 0 HE ARG A 196 24.561 34.178 29.087 1.00 15.59 H new ATOM 0 HH11 ARG A 196 21.982 35.396 30.767 1.00 15.62 H new ATOM 0 HH12 ARG A 196 22.662 36.627 31.255 1.00 15.62 H new ATOM 0 HH21 ARG A 196 25.621 36.042 29.893 1.00 16.32 H new ATOM 0 HH22 ARG A 196 24.867 37.019 30.726 1.00 16.32 H new ATOM 1579 N THR A 197 21.592 28.300 30.299 1.00 22.65 N ATOM 1580 CA THR A 197 20.643 27.390 30.943 1.00 24.45 C ATOM 1581 C THR A 197 19.765 28.185 31.894 1.00 23.87 C ATOM 1582 O THR A 197 18.621 27.819 32.164 1.00 24.30 O ATOM 1583 CB THR A 197 21.349 26.257 31.678 1.00 25.41 C ATOM 1584 OG1 THR A 197 22.302 26.800 32.582 1.00 27.31 O ATOM 1585 CG2 THR A 197 22.070 25.372 30.701 1.00 26.54 C ATOM 0 H THR A 197 22.249 28.555 30.792 1.00 22.65 H new ATOM 0 HA THR A 197 20.095 26.978 30.257 1.00 24.45 H new ATOM 0 HB THR A 197 20.685 25.738 32.158 1.00 25.41 H new ATOM 0 HG1 THR A 197 22.690 26.176 32.988 1.00 27.31 H new ATOM 0 HG21 THR A 197 22.515 24.656 31.180 1.00 26.54 H new ATOM 0 HG22 THR A 197 21.433 24.994 30.075 1.00 26.54 H new ATOM 0 HG23 THR A 197 22.729 25.894 30.216 1.00 26.54 H new ATOM 1586 N VAL A 198 20.308 29.298 32.377 1.00 24.38 N ATOM 1587 CA VAL A 198 19.601 30.183 33.294 1.00 25.88 C ATOM 1588 C VAL A 198 19.792 31.611 32.782 1.00 25.34 C ATOM 1589 O VAL A 198 20.716 31.886 32.021 1.00 25.95 O ATOM 1590 CB VAL A 198 20.187 30.140 34.761 1.00 28.32 C ATOM 1591 CG1 VAL A 198 19.084 30.358 35.762 1.00 29.11 C ATOM 1592 CG2 VAL A 198 20.911 28.828 35.059 1.00 31.07 C ATOM 0 H VAL A 198 21.102 29.562 32.180 1.00 24.38 H new ATOM 0 HA VAL A 198 18.674 29.900 33.328 1.00 25.88 H new ATOM 0 HB VAL A 198 20.841 30.853 34.832 1.00 28.32 H new ATOM 0 HG11 VAL A 198 19.451 30.330 36.659 1.00 29.11 H new ATOM 0 HG12 VAL A 198 18.673 31.223 35.608 1.00 29.11 H new ATOM 0 HG13 VAL A 198 18.416 29.661 35.665 1.00 29.11 H new ATOM 0 HG21 VAL A 198 21.253 28.846 35.967 1.00 31.07 H new ATOM 0 HG22 VAL A 198 20.292 28.087 34.961 1.00 31.07 H new ATOM 0 HG23 VAL A 198 21.648 28.717 34.438 1.00 31.07 H new ATOM 1593 N ASN A 199 18.925 32.520 33.209 1.00 23.83 N ATOM 1594 CA ASN A 199 19.044 33.923 32.825 1.00 23.18 C ATOM 1595 C ASN A 199 19.159 34.091 31.303 1.00 21.48 C ATOM 1596 O ASN A 199 19.963 34.886 30.822 1.00 21.87 O ATOM 1597 CB AASN A 199 20.251 34.600 33.495 0.50 22.58 C ATOM 1598 CB BASN A 199 20.306 34.458 33.490 0.50 24.08 C ATOM 1599 CG AASN A 199 19.978 35.035 34.930 0.50 22.29 C ATOM 1600 CG BASN A 199 20.254 35.920 33.728 0.50 24.51 C ATOM 1601 OD1AASN A 199 20.901 35.430 35.646 0.50 21.57 O ATOM 1602 OD1BASN A 199 21.222 36.499 34.210 0.50 27.40 O ATOM 1603 ND2AASN A 199 18.716 34.996 35.348 0.50 20.96 N ATOM 1604 ND2BASN A 199 19.114 36.535 33.446 0.50 24.51 N ATOM 0 H ASN A 199 18.258 32.346 33.723 1.00 23.83 H new ATOM 0 HA ASN A 199 18.230 34.353 33.131 1.00 23.18 H new ATOM 0 HB2AASN A 199 21.003 33.988 33.487 0.50 24.08 H new ATOM 0 HB2BASN A 199 20.440 34.001 34.335 0.50 24.08 H new ATOM 0 HB3AASN A 199 20.510 35.375 32.972 0.50 24.08 H new ATOM 0 HB3BASN A 199 21.073 34.252 32.932 0.50 24.08 H new ATOM 0 HD21AASN A 199 18.519 35.252 36.145 0.50 24.51 H new ATOM 0 HD21BASN A 199 19.030 37.377 33.601 0.50 24.51 H new ATOM 0 HD22AASN A 199 18.097 34.714 34.821 0.50 24.51 H new ATOM 0 HD22BASN A 199 18.459 36.092 33.108 0.50 24.51 H new ATOM 1605 N ARG A 200 18.321 33.374 30.565 1.00 19.68 N ATOM 1606 CA ARG A 200 18.361 33.381 29.105 1.00 18.91 C ATOM 1607 C ARG A 200 17.808 34.590 28.386 1.00 17.82 C ATOM 1608 O ARG A 200 18.241 34.867 27.273 1.00 17.82 O ATOM 1609 CB ARG A 200 17.639 32.143 28.562 1.00 19.18 C ATOM 1610 CG ARG A 200 18.148 30.842 29.140 1.00 20.85 C ATOM 1611 CD ARG A 200 17.343 29.638 28.693 1.00 23.41 C ATOM 1612 NE ARG A 200 17.612 29.213 27.320 1.00 24.98 N ATOM 1613 CZ ARG A 200 16.735 29.318 26.321 1.00 26.91 C ATOM 1614 NH1 ARG A 200 15.528 29.849 26.533 1.00 25.66 N ATOM 1615 NH2 ARG A 200 17.045 28.842 25.123 1.00 28.42 N ATOM 0 H ARG A 200 17.710 32.867 30.896 1.00 19.68 H new ATOM 0 HA ARG A 200 19.313 33.395 28.918 1.00 18.91 H new ATOM 0 HB2 ARG A 200 16.691 32.223 28.750 1.00 19.18 H new ATOM 0 HB3 ARG A 200 17.736 32.119 27.597 1.00 19.18 H new ATOM 0 HG2 ARG A 200 19.075 30.719 28.880 1.00 20.85 H new ATOM 0 HG3 ARG A 200 18.130 30.895 30.108 1.00 20.85 H new ATOM 0 HD2 ARG A 200 17.528 28.898 29.292 1.00 23.41 H new ATOM 0 HD3 ARG A 200 16.399 29.843 28.778 1.00 23.41 H new ATOM 0 HE ARG A 200 18.383 28.875 27.146 1.00 24.98 H new ATOM 0 HH11 ARG A 200 15.312 30.126 27.318 1.00 25.66 H new ATOM 0 HH12 ARG A 200 14.967 29.914 25.885 1.00 25.66 H new ATOM 0 HH21 ARG A 200 17.808 28.468 24.993 1.00 28.42 H new ATOM 0 HH22 ARG A 200 16.483 28.907 24.476 1.00 28.42 H new ATOM 1616 N LYS A 201 16.845 35.287 28.995 1.00 16.64 N ATOM 1617 CA LYS A 201 16.173 36.421 28.354 1.00 17.64 C ATOM 1618 C LYS A 201 16.141 37.717 29.098 1.00 19.21 C ATOM 1619 O LYS A 201 16.172 37.734 30.331 1.00 22.04 O ATOM 1620 CB LYS A 201 14.723 36.045 28.082 1.00 18.26 C ATOM 1621 CG LYS A 201 14.595 34.697 27.426 1.00 22.31 C ATOM 1622 CD LYS A 201 13.188 34.428 26.993 1.00 26.34 C ATOM 1623 CE LYS A 201 13.139 33.115 26.261 1.00 28.51 C ATOM 1624 NZ LYS A 201 11.741 32.814 25.909 1.00 31.38 N ATOM 0 H LYS A 201 16.564 35.116 29.790 1.00 16.64 H new ATOM 0 HA LYS A 201 16.712 36.582 27.563 1.00 17.64 H new ATOM 0 HB2 LYS A 201 14.229 36.044 28.917 1.00 18.26 H new ATOM 0 HB3 LYS A 201 14.318 36.719 27.514 1.00 18.26 H new ATOM 0 HG2 LYS A 201 15.185 34.653 26.657 1.00 22.31 H new ATOM 0 HG3 LYS A 201 14.882 34.007 28.044 1.00 22.31 H new ATOM 0 HD2 LYS A 201 12.600 34.403 27.764 1.00 26.34 H new ATOM 0 HD3 LYS A 201 12.872 35.143 26.419 1.00 26.34 H new ATOM 0 HE2 LYS A 201 13.684 33.157 25.460 1.00 28.51 H new ATOM 0 HE3 LYS A 201 13.504 32.408 26.816 1.00 28.51 H new ATOM 0 HZ1 LYS A 201 11.704 32.038 25.475 1.00 31.38 H new ATOM 0 HZ2 LYS A 201 11.252 32.762 26.651 1.00 31.38 H new ATOM 0 HZ3 LYS A 201 11.420 33.460 25.388 1.00 31.38 H new ATOM 1625 N SER A 202 16.078 38.809 28.340 1.00 17.89 N ATOM 1626 CA SER A 202 15.959 40.141 28.922 1.00 18.57 C ATOM 1627 C SER A 202 14.446 40.405 29.002 1.00 20.16 C ATOM 1628 O SER A 202 13.645 39.552 28.630 1.00 20.58 O ATOM 1629 CB SER A 202 16.559 41.166 27.968 1.00 19.57 C ATOM 1630 OG SER A 202 15.761 41.282 26.794 1.00 19.42 O ATOM 0 H SER A 202 16.103 38.798 27.480 1.00 17.89 H new ATOM 0 HA SER A 202 16.407 40.202 29.780 1.00 18.57 H new ATOM 0 HB2 SER A 202 16.623 42.028 28.409 1.00 19.57 H new ATOM 0 HB3 SER A 202 17.461 40.903 27.728 1.00 19.57 H new ATOM 0 HG SER A 202 15.124 41.811 26.939 1.00 19.42 H new ATOM 1631 N THR A 203 14.054 41.558 29.523 1.00 20.80 N ATOM 1632 CA THR A 203 12.645 41.927 29.514 1.00 22.66 C ATOM 1633 C THR A 203 12.403 42.485 28.083 1.00 24.01 C ATOM 1634 O THR A 203 13.352 42.679 27.314 1.00 21.86 O ATOM 1635 CB THR A 203 12.333 43.027 30.566 1.00 21.70 C ATOM 1636 OG1 THR A 203 13.163 44.173 30.346 1.00 22.03 O ATOM 1637 CG2 THR A 203 12.594 42.505 31.949 1.00 23.50 C ATOM 0 H THR A 203 14.580 42.136 29.883 1.00 20.80 H new ATOM 0 HA THR A 203 12.078 41.172 29.734 1.00 22.66 H new ATOM 0 HB THR A 203 11.400 43.277 30.477 1.00 21.70 H new ATOM 0 HG1 THR A 203 13.776 44.190 30.921 1.00 22.03 H new ATOM 0 HG21 THR A 203 12.397 43.197 32.599 1.00 23.50 H new ATOM 0 HG22 THR A 203 12.029 41.735 32.116 1.00 23.50 H new ATOM 0 HG23 THR A 203 13.525 42.245 32.027 1.00 23.50 H new ATOM 1638 N ASP A 204 11.148 42.726 27.719 1.00 23.89 N ATOM 1639 CA ASP A 204 10.856 43.265 26.405 1.00 24.69 C ATOM 1640 C ASP A 204 11.132 44.765 26.387 1.00 24.18 C ATOM 1641 O ASP A 204 10.960 45.447 27.389 1.00 23.91 O ATOM 1642 CB ASP A 204 9.396 42.987 26.043 1.00 28.95 C ATOM 1643 CG ASP A 204 9.068 41.492 26.003 1.00 34.06 C ATOM 1644 OD1 ASP A 204 9.970 40.669 25.768 1.00 35.50 O ATOM 1645 OD2 ASP A 204 7.895 41.124 26.204 1.00 39.20 O ATOM 0 H ASP A 204 10.460 42.585 28.215 1.00 23.89 H new ATOM 0 HA ASP A 204 11.427 42.836 25.749 1.00 24.69 H new ATOM 0 HB2 ASP A 204 8.818 43.423 26.689 1.00 28.95 H new ATOM 0 HB3 ASP A 204 9.201 43.380 25.178 1.00 28.95 H new ATOM 1646 N SER A 205 11.592 45.277 25.257 1.00 22.86 N ATOM 1647 CA SER A 205 11.874 46.693 25.118 1.00 22.99 C ATOM 1648 C SER A 205 10.591 47.530 25.142 1.00 24.13 C ATOM 1649 O SER A 205 9.486 47.003 25.005 1.00 24.71 O ATOM 1650 CB SER A 205 12.522 46.942 23.755 1.00 22.31 C ATOM 1651 OG SER A 205 11.544 46.856 22.711 1.00 21.21 O ATOM 0 H SER A 205 11.749 44.813 24.550 1.00 22.86 H new ATOM 0 HA SER A 205 12.450 46.946 25.856 1.00 22.99 H new ATOM 0 HB2 SER A 205 12.939 47.818 23.744 1.00 22.31 H new ATOM 0 HB3 SER A 205 13.225 46.292 23.601 1.00 22.31 H new ATOM 0 HG SER A 205 11.764 47.362 22.078 1.00 21.21 H new ATOM 1652 N PRO A 206 10.720 48.850 25.333 1.00 24.40 N ATOM 1653 CA PRO A 206 9.497 49.660 25.319 1.00 25.63 C ATOM 1654 C PRO A 206 8.950 49.564 23.861 1.00 27.21 C ATOM 1655 O PRO A 206 9.720 49.366 22.903 1.00 26.69 O ATOM 1656 CB PRO A 206 10.024 51.074 25.571 1.00 26.02 C ATOM 1657 CG PRO A 206 11.313 50.854 26.337 1.00 24.79 C ATOM 1658 CD PRO A 206 11.911 49.654 25.667 1.00 24.21 C ATOM 0 HA PRO A 206 8.808 49.402 25.952 1.00 25.63 H new ATOM 0 HB2 PRO A 206 10.182 51.548 24.739 1.00 26.02 H new ATOM 0 HB3 PRO A 206 9.392 51.602 26.083 1.00 26.02 H new ATOM 0 HG2 PRO A 206 11.899 51.625 26.281 1.00 24.79 H new ATOM 0 HG3 PRO A 206 11.147 50.692 27.279 1.00 24.79 H new ATOM 0 HD2 PRO A 206 12.417 49.897 24.876 1.00 24.21 H new ATOM 0 HD3 PRO A 206 12.516 49.176 26.255 1.00 24.21 H new ATOM 1659 N VAL A 207 7.639 49.691 23.692 1.00 27.54 N ATOM 1660 CA VAL A 207 7.029 49.622 22.372 1.00 26.97 C ATOM 1661 C VAL A 207 7.221 50.914 21.585 1.00 29.60 C ATOM 1662 O VAL A 207 7.202 52.009 22.149 1.00 32.43 O ATOM 1663 CB VAL A 207 5.512 49.308 22.471 1.00 26.08 C ATOM 1664 CG1 VAL A 207 4.848 49.339 21.076 1.00 24.27 C ATOM 1665 CG2 VAL A 207 5.314 47.927 23.090 1.00 27.72 C ATOM 0 H VAL A 207 7.082 49.819 24.335 1.00 27.54 H new ATOM 0 HA VAL A 207 7.478 48.903 21.900 1.00 26.97 H new ATOM 0 HB VAL A 207 5.097 49.985 23.028 1.00 26.08 H new ATOM 0 HG11 VAL A 207 3.903 49.140 21.163 1.00 24.27 H new ATOM 0 HG12 VAL A 207 4.958 50.220 20.684 1.00 24.27 H new ATOM 0 HG13 VAL A 207 5.266 48.677 20.504 1.00 24.27 H new ATOM 0 HG21 VAL A 207 4.366 47.733 23.151 1.00 27.72 H new ATOM 0 HG22 VAL A 207 5.746 47.259 22.535 1.00 27.72 H new ATOM 0 HG23 VAL A 207 5.705 47.911 23.978 1.00 27.72 H new ATOM 1666 N GLU A 208 7.479 50.762 20.290 1.00 30.26 N ATOM 1667 CA GLU A 208 7.631 51.879 19.359 1.00 31.14 C ATOM 1668 C GLU A 208 6.701 51.564 18.178 1.00 29.19 C ATOM 1669 O GLU A 208 6.622 50.413 17.725 1.00 26.73 O ATOM 1670 CB GLU A 208 9.083 52.020 18.923 1.00 34.86 C ATOM 1671 CG GLU A 208 9.989 52.350 20.077 1.00 41.77 C ATOM 1672 CD GLU A 208 9.607 53.675 20.722 1.00 48.55 C ATOM 1673 OE1 GLU A 208 9.543 54.681 19.966 1.00 51.11 O ATOM 1674 OE2 GLU A 208 9.368 53.711 21.963 1.00 49.76 O ATOM 0 H GLU A 208 7.573 49.992 19.919 1.00 30.26 H new ATOM 0 HA GLU A 208 7.395 52.728 19.764 1.00 31.14 H new ATOM 0 HB2 GLU A 208 9.377 51.194 18.508 1.00 34.86 H new ATOM 0 HB3 GLU A 208 9.152 52.715 18.250 1.00 34.86 H new ATOM 0 HG2 GLU A 208 9.944 51.642 20.738 1.00 41.77 H new ATOM 0 HG3 GLU A 208 10.907 52.392 19.768 1.00 41.77 H new ATOM 1675 N CYS A 209 5.956 52.566 17.723 1.00 28.10 N ATOM 1676 CA CYS A 209 5.006 52.330 16.653 1.00 30.41 C ATOM 1677 C CYS A 209 5.171 53.220 15.459 1.00 32.63 C ATOM 1678 O CYS A 209 5.642 54.339 15.579 1.00 32.23 O ATOM 1679 CB CYS A 209 3.574 52.547 17.149 1.00 31.36 C ATOM 1680 SG CYS A 209 3.044 51.574 18.584 1.00 35.61 S ATOM 0 H CYS A 209 5.986 53.374 18.016 1.00 28.10 H new ATOM 0 HA CYS A 209 5.179 51.415 16.383 1.00 30.41 H new ATOM 0 HB2 CYS A 209 3.469 53.486 17.366 1.00 31.36 H new ATOM 0 HB3 CYS A 209 2.969 52.357 16.415 1.00 31.36 H new ATOM 1681 N MET A 210 4.731 52.714 14.310 1.00 35.65 N ATOM 1682 CA MET A 210 4.710 53.470 13.062 1.00 39.81 C ATOM 1683 C MET A 210 3.465 54.368 13.245 1.00 42.66 C ATOM 1684 O MET A 210 2.421 53.899 13.737 1.00 43.58 O ATOM 1685 CB AMET A 210 4.503 52.513 11.892 0.50 41.46 C ATOM 1686 CB BMET A 210 4.392 52.575 11.864 0.50 38.58 C ATOM 1687 CG AMET A 210 5.473 51.341 11.860 0.50 42.70 C ATOM 1688 CG BMET A 210 5.315 51.435 11.550 0.50 36.36 C ATOM 1689 SD AMET A 210 7.106 51.771 11.244 0.50 43.99 S ATOM 1690 SD BMET A 210 4.625 50.654 10.058 0.50 32.62 S ATOM 1691 CE AMET A 210 6.744 51.994 9.504 0.50 43.78 C ATOM 1692 CE BMET A 210 5.619 49.249 9.923 0.50 32.54 C ATOM 0 H MET A 210 4.432 51.911 14.233 1.00 35.65 H new ATOM 0 HA MET A 210 5.524 53.966 12.880 1.00 39.81 H new ATOM 0 HB2AMET A 210 3.597 52.168 11.927 0.50 38.58 H new ATOM 0 HB2BMET A 210 3.505 52.206 12.000 0.50 38.58 H new ATOM 0 HB3AMET A 210 4.586 53.010 11.063 0.50 38.58 H new ATOM 0 HB3BMET A 210 4.346 53.141 11.078 0.50 38.58 H new ATOM 0 HG2AMET A 210 5.559 50.978 12.755 0.50 36.36 H new ATOM 0 HG2BMET A 210 6.219 51.750 11.394 0.50 36.36 H new ATOM 0 HG3AMET A 210 5.101 50.639 11.304 0.50 36.36 H new ATOM 0 HG3BMET A 210 5.357 50.806 12.287 0.50 36.36 H new ATOM 0 HE1AMET A 210 7.441 51.578 8.972 0.50 32.54 H new ATOM 0 HE1BMET A 210 5.808 49.075 8.988 0.50 32.54 H new ATOM 0 HE2AMET A 210 5.890 51.583 9.296 0.50 32.54 H new ATOM 0 HE2BMET A 210 6.451 49.394 10.399 0.50 32.54 H new ATOM 0 HE3AMET A 210 6.704 52.942 9.300 0.50 32.54 H new ATOM 0 HE3BMET A 210 5.157 48.487 10.306 0.50 32.54 H new ATOM 1693 N GLY A 211 3.541 55.625 12.825 1.00 45.44 N ATOM 1694 CA GLY A 211 2.388 56.500 12.972 1.00 47.58 C ATOM 1695 C GLY A 211 2.622 57.899 12.455 1.00 49.62 C ATOM 1696 O GLY A 211 1.971 58.337 11.503 1.00 51.72 O ATOM 0 H GLY A 211 4.233 55.983 12.461 1.00 45.44 H new ATOM 0 HA2 GLY A 211 1.634 56.111 12.501 1.00 47.58 H new ATOM 0 HA3 GLY A 211 2.144 56.546 13.910 1.00 47.58 H new TER 1697 GLY A 211 HETATM 1698 S SO4 A 850 37.837 41.760 67.545 1.00 41.94 S HETATM 1699 O1 SO4 A 850 38.829 40.756 67.191 1.00 39.46 O HETATM 1700 O2 SO4 A 850 36.762 41.900 66.661 1.00 44.68 O HETATM 1701 O3 SO4 A 850 37.407 41.564 68.897 1.00 40.44 O HETATM 1702 O4 SO4 A 850 38.257 43.079 67.258 1.00 42.12 O HETATM 1703 O HOH A 301 25.955 33.320 27.711 1.00 15.20 O HETATM 1704 O HOH A 302 33.312 39.090 57.125 1.00 18.84 O HETATM 1705 O HOH A 303 36.694 44.105 73.089 1.00 19.41 O HETATM 1706 O HOH A 304 40.099 57.995 70.405 1.00 21.06 O HETATM 1707 O HOH A 305 12.271 50.309 22.458 1.00 20.70 O HETATM 1708 O HOH A 306 38.253 43.529 29.459 1.00 19.71 O HETATM 1709 O HOH A 307 23.261 31.274 22.366 1.00 17.93 O HETATM 1710 O HOH A 308 23.732 51.157 18.351 1.00 20.04 O HETATM 1711 O HOH A 309 19.387 47.630 23.234 1.00 18.89 O HETATM 1712 O HOH A 310 35.010 48.343 38.963 1.00 20.28 O HETATM 1713 O HOH A 311 37.302 31.248 24.476 1.00 25.08 O HETATM 1714 O HOH A 312 40.221 44.839 31.095 1.00 20.98 O HETATM 1715 O HOH A 313 22.667 48.738 16.390 1.00 20.34 O HETATM 1716 O HOH A 314 39.226 46.240 33.449 1.00 22.32 O HETATM 1717 O HOH A 315 19.959 44.948 23.967 1.00 21.53 O HETATM 1718 O HOH A 316 37.005 48.200 32.095 1.00 23.22 O HETATM 1719 O HOH A 317 30.483 34.713 17.064 1.00 23.76 O HETATM 1720 O HOH A 318 19.209 37.949 10.441 1.00 24.81 O HETATM 1721 O HOH A 319 15.818 51.364 10.961 1.00 21.78 O HETATM 1722 O HOH A 320 19.157 37.864 31.241 1.00 22.95 O HETATM 1723 O HOH A 321 32.040 50.323 47.678 1.00 20.84 O HETATM 1724 O HOH A 322 29.730 46.830 31.409 1.00 23.37 O HETATM 1725 O HOH A 323 23.380 44.349 20.581 1.00 21.28 O HETATM 1726 O HOH A 324 31.817 51.781 27.662 1.00 21.99 O HETATM 1727 O HOH A 325 29.004 44.158 66.358 1.00 27.61 O HETATM 1728 O HOH A 326 43.128 35.205 40.928 1.00 21.19 O HETATM 1729 O HOH A 327 26.406 31.024 25.978 1.00 29.46 O HETATM 1730 O HOH A 328 37.962 28.365 36.100 1.00 31.25 O HETATM 1731 O HOH A 329 16.096 42.896 31.087 1.00 25.79 O HETATM 1732 O HOH A 330 36.066 53.731 56.198 1.00 30.52 O HETATM 1733 O HOH A 331 22.413 41.765 61.262 1.00 26.03 O HETATM 1734 O HOH A 332 47.916 30.560 44.843 1.00 31.06 O HETATM 1735 O HOH A 333 28.837 29.000 44.300 1.00 29.07 O HETATM 1736 O HOH A 334 24.061 36.069 44.198 1.00 26.08 O HETATM 1737 O HOH A 335 21.847 54.552 19.322 1.00 29.23 O HETATM 1738 O HOH A 336 15.761 31.923 31.417 1.00 30.46 O HETATM 1739 O HOH A 337 30.055 36.727 63.358 1.00 28.04 O HETATM 1740 O HOH A 338 34.831 29.500 34.092 1.00 27.87 O HETATM 1741 O HOH A 339 40.624 31.515 45.012 1.00 27.37 O HETATM 1742 O HOH A 340 24.385 46.427 37.904 1.00 34.92 O HETATM 1743 O HOH A 341 31.507 29.973 24.937 1.00 32.03 O HETATM 1744 O HOH A 342 24.406 47.179 67.526 1.00 30.74 O HETATM 1745 O HOH A 343 35.766 33.536 59.310 1.00 32.51 O HETATM 1746 O HOH A 344 23.402 32.925 15.880 1.00 32.57 O HETATM 1747 O HOH A 345 23.256 37.873 37.570 1.00 29.11 O HETATM 1748 O HOH A 346 32.634 35.855 69.536 1.00 24.87 O HETATM 1749 O HOH A 347 37.082 39.270 28.511 1.00 27.48 O HETATM 1750 O HOH A 348 28.243 33.132 50.058 1.00 27.85 O HETATM 1751 O HOH A 349 31.467 50.081 36.972 1.00 30.52 O HETATM 1752 O HOH A 350 24.956 34.014 54.344 1.00 31.76 O HETATM 1753 O HOH A 351 25.545 44.880 63.019 1.00 29.58 O HETATM 1754 O HOH A 352 26.610 34.687 51.951 1.00 26.91 O HETATM 1755 O HOH A 353 31.617 37.223 65.720 1.00 35.97 O HETATM 1756 O HOH A 354 20.218 30.475 18.097 1.00 31.34 O HETATM 1757 O HOH A 355 32.067 51.557 61.057 1.00 34.60 O HETATM 1758 O HOH A 356 45.316 48.808 20.470 1.00 30.67 O HETATM 1759 O HOH A 357 36.266 55.280 68.381 1.00 32.50 O HETATM 1760 O HOH A 358 20.782 45.725 26.644 1.00 28.78 O HETATM 1761 O HOH A 359 34.005 36.712 24.712 1.00 36.48 O HETATM 1762 O HOH A 360 37.094 40.212 62.609 1.00 29.37 O HETATM 1763 O HOH A 361 35.999 50.043 33.889 1.00 32.37 O HETATM 1764 O HOH A 362 22.082 45.525 58.158 1.00 32.62 O HETATM 1765 O HOH A 363 22.578 39.755 39.116 1.00 30.42 O HETATM 1766 O HOH A 364 15.729 35.406 20.348 1.00 30.08 O HETATM 1767 O HOH A 365 7.374 46.186 26.612 1.00 33.85 O HETATM 1768 O HOH A 366 41.403 29.684 39.173 1.00 26.68 O HETATM 1769 O HOH A 367 46.374 34.727 47.423 1.00 29.89 O HETATM 1770 O HOH A 368 31.350 49.616 23.670 1.00 29.20 O HETATM 1771 O HOH A 369 15.033 50.196 27.469 1.00 32.29 O HETATM 1772 O HOH A 370 13.920 30.524 29.347 1.00 31.19 O HETATM 1773 O HOH A 371 30.211 44.516 64.194 1.00 28.78 O HETATM 1774 O HOH A 372 23.400 44.853 12.303 1.00 32.84 O HETATM 1775 O HOH A 373 28.340 45.350 62.240 1.00 28.72 O HETATM 1776 O HOH A 374 27.690 50.411 19.922 1.00 41.65 O HETATM 1777 O HOH A 375 23.821 37.046 10.297 1.00 31.33 O HETATM 1778 O HOH A 376 25.260 52.242 22.130 1.00 31.76 O HETATM 1779 O HOH A 377 29.237 30.318 38.262 1.00 31.55 O HETATM 1780 O HOH A 378 17.633 46.961 32.506 1.00 37.77 O HETATM 1781 O HOH A 379 15.034 38.874 10.305 1.00 43.60 O HETATM 1782 O HOH A 380 22.587 41.073 50.745 1.00 36.33 O HETATM 1783 O HOH A 381 45.800 33.969 40.270 1.00 38.16 O HETATM 1784 O HOH A 382 27.537 30.640 48.785 1.00 38.03 O HETATM 1785 O HOH A 383 22.244 27.201 21.340 1.00 37.78 O HETATM 1786 O HOH A 384 41.331 38.627 39.910 1.00 36.89 O HETATM 1787 O HOH A 385 16.248 29.236 32.461 1.00 29.70 O HETATM 1788 O HOH A 386 24.842 52.306 25.656 1.00 36.78 O HETATM 1789 O HOH A 387 25.284 48.447 28.995 1.00 39.57 O HETATM 1790 O HOH A 388 28.545 48.314 17.813 1.00 34.56 O HETATM 1791 O HOH A 389 19.846 28.070 19.173 1.00 38.35 O HETATM 1792 O HOH A 390 12.780 29.610 24.415 1.00 42.24 O HETATM 1793 O HOH A 391 7.731 49.567 28.185 1.00 36.06 O HETATM 1794 O HOH A 392 24.046 33.960 49.539 1.00 44.56 O HETATM 1795 O HOH A 393 16.603 32.234 34.872 1.00 40.79 O HETATM 1796 O HOH A 394 11.874 35.375 22.446 1.00 43.09 O HETATM 1797 O HOH A 395 26.535 33.896 40.853 1.00 43.21 O HETATM 1798 O HOH A 396 34.101 50.016 36.547 1.00 31.15 O HETATM 1799 O HOH A 397 44.148 47.006 44.602 1.00 34.60 O HETATM 1800 O HOH A 398 23.915 46.362 61.604 1.00 38.56 O HETATM 1801 O HOH A 399 24.974 41.805 62.612 1.00 42.16 O HETATM 1802 O HOH A 400 40.734 48.372 34.147 1.00 46.95 O HETATM 1803 O HOH A 401 26.176 38.506 14.201 1.00 39.44 O HETATM 1804 O HOH A 402 22.575 46.037 23.190 1.00 34.80 O HETATM 1805 O HOH A 403 28.973 51.225 40.875 1.00 40.45 O HETATM 1806 O HOH A 404 22.366 44.547 38.327 1.00 40.67 O HETATM 1807 O HOH A 405 13.118 40.280 2.345 1.00 45.73 O HETATM 1808 O HOH A 406 36.515 47.418 71.734 1.00 35.27 O HETATM 1809 O HOH A 407 29.875 40.362 16.569 1.00 36.85 O HETATM 1810 O HOH A 408 1.432 41.528 9.524 1.00 38.69 O HETATM 1811 O HOH A 409 20.779 42.406 38.849 1.00 37.10 O HETATM 1812 O HOH A 410 26.543 48.650 31.599 1.00 40.23 O HETATM 1813 O HOH A 411 20.222 25.721 26.492 1.00 37.13 O HETATM 1814 O HOH A 412 26.717 51.075 55.652 1.00 43.08 O HETATM 1815 O HOH A 413 26.447 29.564 43.549 1.00 39.09 O HETATM 1816 O HOH A 414 34.505 51.692 67.859 1.00 36.72 O HETATM 1817 O HOH A 415 19.411 49.596 25.182 1.00 32.82 O HETATM 1818 O HOH A 416 40.313 30.084 47.604 1.00 48.33 O HETATM 1819 O HOH A 417 8.644 39.738 7.004 1.00 39.15 O HETATM 1820 O HOH A 418 15.706 32.326 20.203 1.00 42.55 O HETATM 1821 O HOH A 419 8.638 36.913 10.553 1.00 38.87 O HETATM 1822 O HOH A 420 14.769 40.284 6.024 1.00 38.73 O HETATM 1823 O HOH A 421 12.773 55.732 13.597 1.00 37.46 O HETATM 1824 O HOH A 422 23.589 30.049 19.592 1.00 45.01 O HETATM 1825 O HOH A 423 27.695 45.654 16.544 1.00 44.93 O HETATM 1826 O HOH A 424 26.555 28.859 21.485 1.00 42.86 O HETATM 1827 O HOH A 425 40.602 37.130 34.662 1.00 47.62 O HETATM 1828 O HOH A 426 42.427 24.452 44.038 1.00 55.65 O HETATM 1829 O HOH A 427 -1.690 54.157 14.602 1.00 47.23 O HETATM 1830 O HOH A 428 31.500 33.378 58.144 1.00 50.73 O HETATM 1831 O HOH A 429 17.431 26.033 31.219 1.00 37.04 O HETATM 1832 O HOH A 430 21.519 24.816 34.192 1.00 44.88 O HETATM 1833 O HOH A 431 34.183 51.651 49.060 1.00 36.36 O HETATM 1834 O HOH A 432 31.672 34.439 62.804 1.00 38.62 O HETATM 1835 O HOH A 433 44.492 43.873 51.736 1.00 44.85 O HETATM 1836 O HOH A 434 26.951 50.781 50.569 1.00 43.80 O HETATM 1837 O HOH A 435 -0.578 57.441 11.151 1.00 41.34 O HETATM 1838 O HOH A 436 24.194 47.789 33.322 1.00 41.14 O HETATM 1839 O HOH A 437 34.375 29.356 48.765 1.00 63.31 O HETATM 1840 O HOH A 438 17.838 40.593 9.687 1.00 42.47 O HETATM 1841 O HOH A 439 43.058 40.754 53.759 1.00 37.16 O HETATM 1842 O HOH A 440 8.645 38.412 24.993 1.00 44.29 O HETATM 1843 O HOH A 441 43.471 32.545 37.128 1.00 46.64 O HETATM 1844 O HOH A 442 45.407 38.787 50.493 1.00 39.95 O HETATM 1845 O HOH A 443 22.628 43.730 50.606 1.00 39.57 O HETATM 1846 O HOH A 444 28.581 34.745 57.551 1.00 37.84 O HETATM 1847 O HOH A 445 18.495 43.499 34.860 1.00 46.18 O HETATM 1848 O HOH A 446 34.409 53.726 51.500 1.00 44.62 O HETATM 1849 O HOH A 447 17.337 38.181 33.123 1.00 41.35 O HETATM 1850 O HOH A 448 17.260 36.166 10.349 1.00 37.08 O HETATM 1851 O HOH A 449 19.984 47.772 28.641 1.00 31.74 O HETATM 1852 O HOH A 450 7.187 55.408 18.767 1.00 40.64 O HETATM 1853 O HOH A 451 37.557 29.393 52.982 1.00 50.04 O HETATM 1854 O HOH A 452 45.479 46.344 53.761 1.00 42.16 O HETATM 1855 O HOH A 453 41.567 47.314 37.004 1.00 41.16 O HETATM 1856 O HOH A 454 18.179 43.924 7.532 1.00 45.24 O HETATM 1857 O HOH A 455 34.283 38.455 21.789 1.00 39.54 O HETATM 1858 O HOH A 456 30.152 30.460 22.687 1.00 44.15 O HETATM 1859 O HOH A 457 15.663 44.815 32.887 1.00 40.66 O HETATM 1860 O HOH A 458 33.651 53.980 54.110 1.00 46.46 O HETATM 1861 O HOH A 459 38.797 33.658 60.767 1.00 41.64 O HETATM 1862 O HOH A 460 21.799 44.344 61.043 1.00 51.26 O HETATM 1863 O HOH A 461 11.945 53.173 22.859 1.00 42.86 O HETATM 1864 O HOH A 462 42.969 42.254 19.547 1.00 48.33 O HETATM 1865 O HOH A 463 39.198 40.713 64.415 1.00 41.45 O HETATM 1866 O HOH A 464 1.331 58.854 14.949 1.00 42.87 O HETATM 1867 O HOH A 465 9.247 41.872 29.570 1.00 41.81 O HETATM 1868 O HOH A 466 41.334 35.576 58.401 1.00 49.05 O HETATM 1869 O HOH A 467 34.101 40.807 18.916 1.00 45.99 O HETATM 1870 O HOH A 468 31.154 35.094 21.954 1.00 47.50 O HETATM 1871 O HOH A 469 16.640 40.743 32.717 1.00 41.12 O HETATM 1872 O HOH A 470 15.668 35.334 31.867 1.00 41.92 O HETATM 1873 O HOH A 471 29.344 53.869 53.934 1.00 42.96 O HETATM 1874 O HOH A 472 37.142 37.110 70.806 1.00 46.65 O HETATM 1875 O HOH A 473 2.990 40.354 4.734 1.00 51.19 O HETATM 1876 O HOH A 474 31.600 38.948 18.333 1.00 41.57 O HETATM 1877 O HOH A 475 22.766 48.337 13.288 1.00 43.15 O HETATM 1878 O HOH A 476 15.263 48.661 32.693 1.00 44.72 O HETATM 1879 O HOH A 477 38.238 34.467 68.940 1.00 59.71 O HETATM 1880 O HOH A 478 46.139 38.514 42.078 1.00 45.11 O HETATM 1881 O HOH A 479 -1.424 41.945 14.045 1.00 54.01 O HETATM 1882 O HOH A 480 39.702 37.600 64.206 1.00 43.29 O HETATM 1883 O HOH A 481 29.539 33.129 66.100 1.00 49.47 O HETATM 1884 O HOH A 482 46.052 42.646 46.574 1.00 48.83 O HETATM 1885 O HOH A 483 37.742 27.800 45.473 1.00 50.12 O HETATM 1886 O HOH A 484 18.248 54.385 20.733 1.00 46.04 O HETATM 1887 O HOH A 485 47.380 37.163 47.178 1.00 50.56 O HETATM 1888 O HOH A 486 42.958 46.355 29.218 1.00 45.66 O HETATM 1889 O HOH A 487 30.002 33.751 19.946 1.00 45.53 O HETATM 1890 O HOH A 488 20.161 43.371 26.258 1.00 40.64 O HETATM 1891 O HOH A 489 19.462 39.894 40.183 1.00 52.24 O HETATM 1892 O HOH A 490 28.065 38.671 15.970 1.00 53.47 O HETATM 1893 O HOH A 491 21.383 42.033 48.086 1.00 60.13 O HETATM 1894 O HOH A 492 42.489 30.701 50.545 1.00 58.47 O HETATM 1895 O HOH A 493 13.695 38.913 32.551 1.00 52.72 O HETATM 1896 O HOH A 494 13.495 54.360 21.143 1.00 53.14 O HETATM 1897 O HOH A 495 5.696 40.065 7.715 1.00 48.74 O HETATM 1898 O HOH A 496 45.097 31.887 47.298 1.00 61.18 O HETATM 1899 O HOH A 497 21.348 41.541 8.943 1.00 51.56 O HETATM 1900 O HOH A 498 40.621 40.287 37.383 1.00 49.70 O HETATM 1901 O HOH A 499 31.187 29.929 46.722 1.00 40.50 O HETATM 1902 O HOH A 500 10.249 33.885 15.099 1.00 57.48 O HETATM 1903 O HOH A 501 32.320 55.231 60.661 1.00 52.47 O HETATM 1904 O HOH A 502 10.833 30.128 27.915 1.00 42.62 O HETATM 1905 O HOH A 503 40.199 54.777 74.703 1.00 54.32 O HETATM 1906 O HOH A 504 36.725 39.453 75.887 1.00 47.96 O HETATM 1907 O HOH A 505 15.989 48.666 3.681 1.00 61.13 O HETATM 1908 O HOH A 506 22.870 31.652 38.411 1.00 55.98 O HETATM 1909 O HOH A 507 30.272 42.852 16.835 1.00 54.24 O HETATM 1910 O HOH A 508 42.408 41.860 30.256 1.00 55.84 O HETATM 1911 O HOH A 509 40.586 37.711 28.421 1.00 60.95 O HETATM 1912 O HOH A 510 17.029 28.526 19.514 1.00 58.35 O HETATM 1913 O HOH A 511 2.070 49.701 6.594 1.00 66.54 O HETATM 1914 O HOH A 512 24.265 47.652 49.480 1.00 51.85 O HETATM 1915 O HOH A 513 8.953 45.470 29.007 1.00 49.16 O HETATM 1916 O HOH A 514 33.481 28.120 71.785 1.00 57.80 O HETATM 1917 O HOH A 515 41.588 32.603 59.468 1.00 65.10 O HETATM 1918 O HOH A 516 -0.960 48.482 15.954 1.00 44.85 O HETATM 1919 O HOH A 517 26.060 42.646 14.114 1.00 51.75 O HETATM 1920 O HOH A 518 42.525 33.378 55.491 1.00 61.32 O HETATM 1921 O HOH A 519 28.600 31.670 18.694 1.00 61.99 O HETATM 1922 O HOH A 520 14.200 52.469 26.189 1.00 62.32 O HETATM 1923 O HOH A 521 9.851 49.868 29.599 1.00 61.80 O HETATM 1924 O HOH A 522 15.663 40.821 8.342 1.00 45.03 O HETATM 1925 O HOH A 523 26.841 33.124 55.919 1.00 63.80 O HETATM 1926 O HOH A 524 12.921 48.281 -0.886 1.00 58.73 O HETATM 1927 O HOH A 525 46.806 40.701 48.669 1.00 64.77 O HETATM 1928 O HOH A 526 17.563 25.842 27.898 1.00 63.51 O HETATM 1929 O HOH A 527 43.136 44.612 54.101 1.00 63.24 O HETATM 1930 O HOH A 528 39.843 50.706 31.424 1.00 60.67 O HETATM 1931 O HOH A 529 17.909 46.853 5.357 1.00 58.82 O HETATM 1932 O HOH A 530 24.556 52.515 46.840 1.00 61.17 O HETATM 1933 O HOH A 531 33.593 47.081 66.957 1.00 54.44 O HETATM 1934 O HOH A 532 19.491 40.539 57.973 1.00 59.30 O HETATM 1935 O HOH A 533 0.734 55.859 15.307 1.00 51.14 O HETATM 1936 O HOH A 534 29.077 27.903 39.818 1.00 61.07 O HETATM 1937 O HOH A 535 31.882 37.167 20.378 1.00 60.31 O CONECT 401 474 CONECT 474 401 CONECT 1496 1680 CONECT 1680 1496 CONECT 1698 1699 1700 1701 1702 CONECT 1699 1698 CONECT 1700 1698 CONECT 1701 1698 CONECT 1702 1698 END