USER MOD reduce.3.24.130724 H: found=0, std=0, add=1705, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER SERINE PROTEASE 18-JUN-98 1HFD TITLE HUMAN COMPLEMENT FACTOR D IN A P21 CRYSTAL FORM COMPND MOL_ID: 1; COMPND 2 MOLECULE: COMPLEMENT FACTOR D; COMPND 3 CHAIN: A; COMPND 4 EC: 3.4.21.46 SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606 KEYWDS SERINE PROTEASE, HYDROLASE, COMPLEMENT, FACTOR D, CATALYTIC KEYWDS 2 TRIAD, SELF-REGULATION EXPDTA X-RAY DIFFRACTION AUTHOR H.JING,Y.S.BABU,D.MOORE,J.M.KILPATRICK,X.-Y.LIU, AUTHOR 2 J.E.VOLANAKIS,S.V.L.NARAYANA REVDAT 2 24-FEB-09 1HFD 1 VERSN REVDAT 1 22-JUN-99 1HFD 0 JRNL AUTH H.JING,Y.S.BABU,D.MOORE,J.M.KILPATRICK,X.Y.LIU, JRNL AUTH 2 J.E.VOLANAKIS,S.V.NARAYANA JRNL TITL STRUCTURES OF NATIVE AND COMPLEXED COMPLEMENT JRNL TITL 2 FACTOR D: IMPLICATIONS OF THE ATYPICAL HIS57 JRNL TITL 3 CONFORMATION AND SELF-INHIBITORY LOOP IN THE JRNL TITL 4 REGULATION OF SPECIFIC SERINE PROTEASE ACTIVITY. JRNL REF J.MOL.BIOL. V. 282 1061 1998 JRNL REFN ISSN 0022-2836 JRNL PMID 9753554 JRNL DOI 10.1006/JMBI.1998.2089 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH J.E.VOLANAKIS,S.V.NARAYANA REMARK 1 TITL COMPLEMENT FACTOR D, A NOVEL SERINE PROTEASE REMARK 1 REF PROTEIN SCI. V. 5 553 1996 REMARK 1 REFN ISSN 0961-8368 REMARK 1 REFERENCE 2 REMARK 1 AUTH S.KIM,S.V.NARAYANA,J.E.VOLANAKIS REMARK 1 TITL CRYSTAL STRUCTURE OF A COMPLEMENT FACTOR D MUTANT REMARK 1 TITL 2 EXPRESSING ENHANCED CATALYTIC ACTIVITY REMARK 1 REF J.BIOL.CHEM. V. 270 24399 1995 REMARK 1 REFN ISSN 0021-9258 REMARK 1 REFERENCE 3 REMARK 1 AUTH S.V.NARAYANA,M.CARSON,O.EL-KABBANI,J.M.KILPATRICK, REMARK 1 AUTH 2 D.MOORE,X.CHEN,C.E.BUGG,J.E.VOLANAKIS,L.J.DELUCAS REMARK 1 TITL STRUCTURE OF HUMAN FACTOR D. A COMPLEMENT SYSTEM REMARK 1 TITL 2 PROTEIN AT 2.0 A RESOLUTION REMARK 1 REF J.MOL.BIOL. V. 235 695 1994 REMARK 1 REFN ISSN 0022-2836 REMARK 1 REFERENCE 4 REMARK 1 AUTH S.V.NARAYANA,J.M.KILPATRICK,O.EL-KABBANI,Y.S.BABU, REMARK 1 AUTH 2 C.E.BUGG,J.E.VOLANAKIS,L.J.DELUCAS REMARK 1 TITL CRYSTALLIZATION AND PRELIMINARY X-RAY REMARK 1 TITL 2 INVESTIGATION OF FACTOR D OF HUMAN COMPLEMENT REMARK 1 REF J.MOL.BIOL. V. 219 1 1991 REMARK 1 REFN ISSN 0022-2836 REMARK 2 REMARK 2 RESOLUTION. 2.30 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.851 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.30 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 20.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 2.000 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 1000000.000 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.0010 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 95.0 REMARK 3 NUMBER OF REFLECTIONS : 8925 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING SET) : 0.174 REMARK 3 FREE R VALUE : 0.216 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 10.000 REMARK 3 FREE R VALUE TEST SET COUNT : 936 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.007 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 8 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.30 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.40 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 78.50 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 808 REMARK 3 BIN R VALUE (WORKING SET) : 0.2150 REMARK 3 BIN FREE R VALUE : 0.2560 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 10.00 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 90 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.027 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1712 REMARK 3 NUCLEIC ACID ATOMS : NULL REMARK 3 HETEROGEN ATOMS : NULL REMARK 3 SOLVENT ATOMS : 75 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 15.70 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 22.00 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) : 0.23 REMARK 3 ESD FROM SIGMAA (A) : 0.22 REMARK 3 LOW RESOLUTION CUTOFF (A) : 5.00 REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : 0.29 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.28 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.012 REMARK 3 BOND ANGLES (DEGREES) : 1.60 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 28.58 REMARK 3 IMPROPER ANGLES (DEGREES) : 0.89 REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 REMARK 3 NCS MODEL : NULL REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : PROTEIN_REP.PARAM REMARK 3 PARAMETER FILE 2 : NULL REMARK 3 PARAMETER FILE 3 : NULL REMARK 3 PARAMETER FILE 4 : NULL REMARK 3 TOPOLOGY FILE 1 : TOPHCSDX.PRO REMARK 3 TOPOLOGY FILE 2 : TOPH19.SOL REMARK 3 TOPOLOGY FILE 3 : TOPH19.PEP REMARK 3 TOPOLOGY FILE 4 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: BULK SOLVENT CORRECTION WAS APPLIED REMARK 4 REMARK 4 1HFD 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 : JUN-93 REMARK 200 TEMPERATURE (KELVIN) : 293 REMARK 200 PH : 5.4 REMARK 200 NUMBER OF CRYSTALS USED : 4 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : ROTATING ANODE REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : RIGAKU RUH2R REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : GRAPHITE(002) REMARK 200 OPTICS : COLLIMATOR REMARK 200 REMARK 200 DETECTOR TYPE : AREA DETECTOR REMARK 200 DETECTOR MANUFACTURER : SIEMENS REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XENGEN REMARK 200 DATA SCALING SOFTWARE : XENGEN REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 9267 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.300 REMARK 200 RESOLUTION RANGE LOW (A) : 20.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 2.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 95.0 REMARK 200 DATA REDUNDANCY : 4.000 REMARK 200 R MERGE (I) : 0.08300 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 15.0000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.30 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.40 REMARK 200 COMPLETENESS FOR SHELL (%) : 79.0 REMARK 200 DATA REDUNDANCY IN SHELL : 4.00 REMARK 200 R MERGE FOR SHELL (I) : 0.24200 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 2.800 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: NULL REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: X-PLOR 3.851 REMARK 200 STARTING MODEL: PDB ENTRY 1DSU MOLECULE B REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 44.00 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.15 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PH 5.4 REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 1 21 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,Y+1/2,-Z 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 25.57500 REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 ARG A 150 NE - CZ - NH2 ANGL. DEV. = 3.7 DEGREES REMARK 500 ARG A 151 NE - CZ - NH2 ANGL. DEV. = 3.7 DEGREES REMARK 500 ARG A 187 NE - CZ - NH2 ANGL. DEV. = 3.6 DEGREES REMARK 500 ARG A 188 NE - CZ - NH2 ANGL. DEV. = 3.5 DEGREES REMARK 500 ARG A 223 NE - CZ - NH2 ANGL. DEV. = 3.6 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 SER A 54 -158.99 -145.38 REMARK 500 ALA A 61A 26.59 -78.50 REMARK 500 HIS A 71 -54.18 -134.22 REMARK 500 PRO A 96 4.63 -64.39 REMARK 500 HIS A 171 -108.99 -108.47 REMARK 500 ASP A 173 75.01 19.62 REMARK 500 ARG A 187 -29.70 71.70 REMARK 500 SER A 215 51.84 -109.81 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 359 DISTANCE = 6.03 ANGSTROMS REMARK 525 HOH A 364 DISTANCE = 6.22 ANGSTROMS REMARK 525 HOH A 374 DISTANCE = 5.24 ANGSTROMS REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: NUL REMARK 800 EVIDENCE_CODE: UNKNOWN REMARK 800 SITE_DESCRIPTION: CATALYTIC TRIAD. DBREF 1HFD A 16 243 UNP P00746 CFAD_HUMAN 26 253 SEQRES 1 A 228 ILE LEU GLY GLY ARG GLU ALA GLU ALA HIS ALA ARG PRO SEQRES 2 A 228 TYR MET ALA SER VAL GLN LEU ASN GLY ALA HIS LEU CYS SEQRES 3 A 228 GLY GLY VAL LEU VAL ALA GLU GLN TRP VAL LEU SER ALA SEQRES 4 A 228 ALA HIS CYS LEU GLU ASP ALA ALA ASP GLY LYS VAL GLN SEQRES 5 A 228 VAL LEU LEU GLY ALA HIS SER LEU SER GLN PRO GLU PRO SEQRES 6 A 228 SER LYS ARG LEU TYR ASP VAL LEU ARG ALA VAL PRO HIS SEQRES 7 A 228 PRO ASP SER GLN PRO ASP THR ILE ASP HIS ASP LEU LEU SEQRES 8 A 228 LEU LEU GLN LEU SER GLU LYS ALA THR LEU GLY PRO ALA SEQRES 9 A 228 VAL ARG PRO LEU PRO TRP GLN ARG VAL ASP ARG ASP VAL SEQRES 10 A 228 ALA PRO GLY THR LEU CYS ASP VAL ALA GLY TRP GLY ILE SEQRES 11 A 228 VAL ASN HIS ALA GLY ARG ARG PRO ASP SER LEU GLN HIS SEQRES 12 A 228 VAL LEU LEU PRO VAL LEU ASP ARG ALA THR CYS ASN ARG SEQRES 13 A 228 ARG THR HIS HIS ASP GLY ALA ILE THR GLU ARG LEU MET SEQRES 14 A 228 CYS ALA GLU SER ASN ARG ARG ASP SER CYS LYS GLY ASP SEQRES 15 A 228 SER GLY GLY PRO LEU VAL CYS GLY GLY VAL LEU GLU GLY SEQRES 16 A 228 VAL VAL THR SER GLY SER ARG VAL CYS GLY ASN ARG LYS SEQRES 17 A 228 LYS PRO GLY ILE TYR THR ARG VAL ALA SER TYR ALA ALA SEQRES 18 A 228 TRP ILE ASP SER VAL LEU ALA FORMUL 2 HOH *75(H2 O) HELIX 1 1 ALA A 56 CYS A 58 5 3 HELIX 2 2 ARG A 165 CYS A 168 1 4 HELIX 3 3 ALA A 232 VAL A 241 5 10 SHEET 1 A 7 ARG A 81 ASP A 84 0 SHEET 2 A 7 VAL A 64 LEU A 68 -1 N LEU A 68 O ARG A 81 SHEET 3 A 7 MET A 30 LEU A 35 -1 N GLN A 34 O GLN A 65 SHEET 4 A 7 HIS A 40 ALA A 48 -1 N GLY A 44 O ALA A 31 SHEET 5 A 7 TRP A 51 SER A 54 -1 N LEU A 53 O VAL A 45 SHEET 6 A 7 LEU A 104 LEU A 108 -1 N LEU A 106 O VAL A 52 SHEET 7 A 7 VAL A 85 PRO A 90 -1 N VAL A 89 O LEU A 105 SHEET 1 B 2 LEU A 135 GLY A 140 0 SHEET 2 B 2 GLN A 156 PRO A 161 -1 N LEU A 160 O CYS A 136 SHEET 1 C 4 LEU A 180 ALA A 183 0 SHEET 2 C 4 GLY A 226 ARG A 230 -1 N TYR A 228 O MET A 181 SHEET 3 C 4 VAL A 208 VAL A 213 -1 N VAL A 212 O THR A 229 SHEET 4 C 4 PRO A 198 CYS A 201 -1 N CYS A 201 O VAL A 208 SSBOND *** CYS A 42 CYS A 58 1555 1555 2.04 SSBOND *** CYS A 136 CYS A 201 1555 1555 2.03 SSBOND *** CYS A 168 CYS A 182 1555 1555 2.03 SSBOND *** CYS A 191 CYS A 220 1555 1555 1.99 SITE *** NUL 3 HIS A 57 ASP A 102 SER A 195 CRYST1 55.710 51.150 39.470 90.00 105.96 90.00 P 1 21 1 2 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 0.017950 0.000000 0.005134 0.00000 SCALE2 0.000000 0.019550 0.000000 0.00000 SCALE3 0.000000 0.000000 0.026351 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 101 HIS :FLIP no HD1:sc= 0.181 F(o=0.45,f=1.9) USER MOD Set 1.2: A 234 TYR OH : rot 6:sc= 1.67 USER MOD Set 2.1: A 190 SER OG : rot -112:sc= 0.0896 USER MOD Set 2.2: A 228 TYR OH : rot 150:sc= 0.697 USER MOD Set 3.1: A 170BTHR OG1 : rot 78:sc= 0.447 USER MOD Set 3.2: A 171 HIS : no HD1:sc= 0.0421 K(o=0.49,f=-2.2) USER MOD Set 4.1: A 32 SER OG : rot 83:sc= 2.28 USER MOD Set 4.2: A 34 GLN : amide:sc= 0.988 K(o=5,f=3.8) USER MOD Set 4.3: A 40 HIS : no HD1:sc= 1.73 K(o=5,f=-5.2!) USER MOD Set 5.1: A 25 HIS : no HE2:sc= 0.946 K(o=2.2,f=-2!) USER MOD Set 5.2: A 79 SER OG : rot 91:sc= 1.28 USER MOD Single : A 29 TYR OH : rot -171:sc= -1.16! USER MOD Single : A 30 MET CE :methyl -175:sc= 0 (180deg=-0.0183) USER MOD Single : A 36 ASN : amide:sc= -0.0404 K(o=-0.04,f=-1.2) USER MOD Single : A 50 GLN : amide:sc= 0.858 K(o=0.86,f=-0.69) USER MOD Single : A 54 SER OG : rot 81:sc= 0.837 USER MOD Single : A 57 HIS : +bothHN:sc= -0.121 K(o=-0.12,f=-9.4!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 GLN : amide:sc= 0.987 X(o=0.99,f=1.2) USER MOD Single : A 71 HIS :FLIP no HD1:sc= -0.0792 F(o=-2.7!,f=-0.079) USER MOD Single : A 72 SER OG : rot 91:sc= 1.57 USER MOD Single : A 74 SER OG : rot -74:sc= 1.3 USER MOD Single : A 75 GLN :FLIP amide:sc= 0 F(o=-0.62,f=0) USER MOD Single : A 80 LYS NZ :NH3+ -174:sc= 2.24 (180deg=2.05) USER MOD Single : A 83 TYR OH : rot -163:sc= 1.6 USER MOD Single : A 91 HIS : no HD1:sc= 1.09 K(o=1.1,f=-7.8!) USER MOD Single : A 94 SER OG : rot -80:sc= 1.23 USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 GLN : amide:sc= 0 K(o=0,f=-1.6) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 GLN : amide:sc= -1.8! C(o=-1.8!,f=-6.5!) USER MOD Single : A 134 THR OG1 : rot 98:sc= 0.497 USER MOD Single : A 145 ASN : amide:sc= 0.484 K(o=0.48,f=-8!) USER MOD Single : A 146 HIS : no HD1:sc= -0.0176 X(o=-0.018,f=-0.1) USER MOD Single : A 154 SER OG : rot -140:sc= 0 USER MOD Single : A 156 GLN : amide:sc= 0.12 X(o=0.12,f=-0.056) USER MOD Single : A 157 HIS : no HE2:sc= 1.09 K(o=1.1,f=-3.4!) USER MOD Single : A 167 THR OG1 : rot 53:sc= 1.18 USER MOD Single : A 169 ASN : amide:sc= -1.63 K(o=-1.6,f=-4.9!) USER MOD Single : A 172 HIS : no HD1:sc= -0.0993 K(o=-0.099,f=-2.9!) USER MOD Single : A 177 THR OG1 : rot -174:sc= 1.5 USER MOD Single : A 181 MET CE :methyl -114:sc= 0 (180deg=-0.102) USER MOD Single : A 185 SER OG : rot 111:sc= -0.137 USER MOD Single : A 186 ASN : amide:sc= -0.812 X(o=-0.81,f=-0.85) USER MOD Single : A 192 LYS NZ :NH3+ -176:sc= -0.43 (180deg=-0.688) USER MOD Single : A 195 SER OG : rot 94:sc= 0.0569 USER MOD Single : A 214 THR OG1 : rot -80:sc=0.000921 USER MOD Single : A 215 SER OG : rot -51:sc= -2.97! USER MOD Single : A 217 SER OG : rot 180:sc= 0 USER MOD Single : A 222 ASN : amide:sc= 0.0497 K(o=0.05,f=-4.9!) USER MOD Single : A 223ALYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 224 LYS NZ :NH3+ -177:sc= 0.231 (180deg=0.227) USER MOD Single : A 229 THR OG1 : rot -77:sc= 2.25 USER MOD Single : A 233 SER OG : rot -140:sc= 0 USER MOD Single : A 240 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ILE A 16 27.418 1.322 28.673 1.00 16.24 N ATOM 2 CA ILE A 16 26.759 -0.016 28.606 1.00 18.24 C ATOM 3 C ILE A 16 25.385 0.026 29.256 1.00 19.91 C ATOM 4 O ILE A 16 25.240 0.506 30.366 1.00 19.24 O ATOM 5 CB ILE A 16 27.609 -1.100 29.318 1.00 16.48 C ATOM 6 CG1 ILE A 16 28.989 -1.192 28.658 1.00 14.09 C ATOM 7 CG2 ILE A 16 26.906 -2.460 29.258 1.00 13.71 C ATOM 8 CD1 ILE A 16 28.970 -1.836 27.302 1.00 12.47 C ATOM 0 HA ILE A 16 26.672 -0.243 27.667 1.00 18.24 H new ATOM 0 HB ILE A 16 27.716 -0.851 30.249 1.00 16.48 H new ATOM 0 HG12 ILE A 16 29.360 -0.299 28.578 1.00 14.09 H new ATOM 0 HG13 ILE A 16 29.583 -1.695 29.237 1.00 14.09 H new ATOM 0 HG21 ILE A 16 27.450 -3.126 29.707 1.00 13.71 H new ATOM 0 HG22 ILE A 16 26.043 -2.398 29.697 1.00 13.71 H new ATOM 0 HG23 ILE A 16 26.779 -2.718 28.332 1.00 13.71 H new ATOM 0 HD11 ILE A 16 29.871 -1.862 26.943 1.00 12.47 H new ATOM 0 HD12 ILE A 16 28.626 -2.740 27.378 1.00 12.47 H new ATOM 0 HD13 ILE A 16 28.400 -1.323 26.708 1.00 12.47 H new ATOM 9 N LEU A 17 24.386 -0.489 28.545 1.00 22.54 N ATOM 10 CA LEU A 17 23.001 -0.533 29.011 1.00 23.41 C ATOM 11 C LEU A 17 22.641 -1.986 29.297 1.00 22.68 C ATOM 12 O LEU A 17 22.975 -2.857 28.500 1.00 22.47 O ATOM 13 CB LEU A 17 22.066 -0.016 27.919 1.00 25.46 C ATOM 14 CG LEU A 17 21.399 1.345 28.087 1.00 28.74 C ATOM 15 CD1 LEU A 17 22.440 2.430 27.928 1.00 31.01 C ATOM 16 CD2 LEU A 17 20.294 1.513 27.052 1.00 30.30 C ATOM 0 H LEU A 17 24.495 -0.829 27.763 1.00 22.54 H new ATOM 0 HA LEU A 17 22.908 0.016 29.805 1.00 23.41 H new ATOM 0 HB2 LEU A 17 22.571 0.007 27.091 1.00 25.46 H new ATOM 0 HB3 LEU A 17 21.362 -0.673 27.804 1.00 25.46 H new ATOM 0 HG LEU A 17 21.004 1.409 28.970 1.00 28.74 H new ATOM 0 HD11 LEU A 17 22.021 3.299 28.034 1.00 31.01 H new ATOM 0 HD12 LEU A 17 23.129 2.319 28.602 1.00 31.01 H new ATOM 0 HD13 LEU A 17 22.839 2.369 27.046 1.00 31.01 H new ATOM 0 HD21 LEU A 17 19.874 2.380 27.164 1.00 30.30 H new ATOM 0 HD22 LEU A 17 20.673 1.451 26.161 1.00 30.30 H new ATOM 0 HD23 LEU A 17 19.631 0.815 27.170 1.00 30.30 H new ATOM 17 N GLY A 18 21.974 -2.238 30.429 1.00 22.33 N ATOM 18 CA GLY A 18 21.558 -3.591 30.772 1.00 20.95 C ATOM 19 C GLY A 18 22.714 -4.493 31.131 1.00 20.39 C ATOM 20 O GLY A 18 22.605 -5.721 31.097 1.00 17.81 O ATOM 0 H GLY A 18 21.756 -1.638 31.006 1.00 22.33 H new ATOM 0 HA2 GLY A 18 20.940 -3.554 31.519 1.00 20.95 H new ATOM 0 HA3 GLY A 18 21.076 -3.975 30.023 1.00 20.95 H new ATOM 21 N GLY A 19 23.825 -3.863 31.499 1.00 21.87 N ATOM 22 CA GLY A 19 25.032 -4.594 31.843 1.00 23.83 C ATOM 23 C GLY A 19 25.355 -4.668 33.314 1.00 24.57 C ATOM 24 O GLY A 19 24.599 -4.195 34.149 1.00 27.66 O ATOM 0 H GLY A 19 23.898 -3.008 31.555 1.00 21.87 H new ATOM 0 HA2 GLY A 19 24.952 -5.498 31.501 1.00 23.83 H new ATOM 0 HA3 GLY A 19 25.781 -4.183 31.384 1.00 23.83 H new ATOM 25 N ARG A 20 26.480 -5.267 33.656 1.00 25.07 N ATOM 26 CA ARG A 20 26.830 -5.380 35.063 1.00 25.14 C ATOM 27 C ARG A 20 28.181 -4.728 35.212 1.00 24.34 C ATOM 28 O ARG A 20 28.799 -4.335 34.200 1.00 23.42 O ATOM 29 CB ARG A 20 26.908 -6.865 35.475 1.00 28.34 C ATOM 30 CG ARG A 20 25.582 -7.645 35.473 1.00 35.06 C ATOM 31 CD ARG A 20 25.565 -8.699 36.553 1.00 39.74 C ATOM 32 NE ARG A 20 26.793 -8.682 37.353 1.00 45.72 N ATOM 33 CZ ARG A 20 26.931 -9.273 38.545 1.00 46.79 C ATOM 34 NH1 ARG A 20 25.926 -9.933 39.084 1.00 47.52 N ATOM 35 NH2 ARG A 20 28.087 -9.210 39.197 1.00 48.30 N ATOM 0 H ARG A 20 27.045 -5.609 33.106 1.00 25.07 H new ATOM 0 HA ARG A 20 26.166 -4.955 35.629 1.00 25.14 H new ATOM 0 HB2 ARG A 20 27.526 -7.314 34.878 1.00 28.34 H new ATOM 0 HB3 ARG A 20 27.288 -6.914 36.366 1.00 28.34 H new ATOM 0 HG2 ARG A 20 24.843 -7.031 35.606 1.00 35.06 H new ATOM 0 HG3 ARG A 20 25.452 -8.063 34.608 1.00 35.06 H new ATOM 0 HD2 ARG A 20 24.800 -8.556 37.132 1.00 39.74 H new ATOM 0 HD3 ARG A 20 25.455 -9.574 36.149 1.00 39.74 H new ATOM 0 HE ARG A 20 27.472 -8.263 37.034 1.00 45.72 H new ATOM 0 HH11 ARG A 20 25.175 -9.986 38.669 1.00 47.52 H new ATOM 0 HH12 ARG A 20 26.021 -10.311 39.851 1.00 47.52 H new ATOM 0 HH21 ARG A 20 28.752 -8.787 38.853 1.00 48.30 H new ATOM 0 HH22 ARG A 20 28.170 -9.592 39.963 1.00 48.30 H new ATOM 36 N GLU A 21 28.645 -4.595 36.454 1.00 21.38 N ATOM 37 CA GLU A 21 29.950 -4.018 36.678 1.00 21.03 C ATOM 38 C GLU A 21 30.950 -5.114 36.348 1.00 19.84 C ATOM 39 O GLU A 21 30.713 -6.295 36.648 1.00 18.73 O ATOM 40 CB GLU A 21 30.110 -3.568 38.124 1.00 21.32 C ATOM 41 CG GLU A 21 31.201 -2.533 38.298 1.00 23.31 C ATOM 42 CD GLU A 21 31.519 -2.269 39.742 1.00 25.64 C ATOM 43 OE1 GLU A 21 30.637 -1.750 40.473 1.00 27.48 O ATOM 44 OE2 GLU A 21 32.651 -2.582 40.172 1.00 25.84 O ATOM 0 H GLU A 21 28.222 -4.831 37.164 1.00 21.38 H new ATOM 0 HA GLU A 21 30.084 -3.231 36.127 1.00 21.03 H new ATOM 0 HB2 GLU A 21 29.269 -3.202 38.439 1.00 21.32 H new ATOM 0 HB3 GLU A 21 30.309 -4.339 38.678 1.00 21.32 H new ATOM 0 HG2 GLU A 21 32.003 -2.834 37.843 1.00 23.31 H new ATOM 0 HG3 GLU A 21 30.928 -1.705 37.874 1.00 23.31 H new ATOM 45 N ALA A 22 32.062 -4.742 35.733 1.00 16.67 N ATOM 46 CA ALA A 22 33.028 -5.743 35.365 1.00 17.42 C ATOM 47 C ALA A 22 33.936 -6.124 36.528 1.00 17.86 C ATOM 48 O ALA A 22 34.117 -5.335 37.464 1.00 18.71 O ATOM 49 CB ALA A 22 33.842 -5.233 34.169 1.00 15.70 C ATOM 0 H ALA A 22 32.268 -3.933 35.526 1.00 16.67 H new ATOM 0 HA ALA A 22 32.555 -6.552 35.116 1.00 17.42 H new ATOM 0 HB1 ALA A 22 34.496 -5.902 33.914 1.00 15.70 H new ATOM 0 HB2 ALA A 22 33.247 -5.062 33.422 1.00 15.70 H new ATOM 0 HB3 ALA A 22 34.298 -4.412 34.414 1.00 15.70 H new ATOM 50 N GLU A 23 34.483 -7.344 36.503 1.00 18.72 N ATOM 51 CA GLU A 23 35.403 -7.798 37.544 1.00 18.77 C ATOM 52 C GLU A 23 36.597 -6.848 37.440 1.00 17.92 C ATOM 53 O GLU A 23 37.107 -6.592 36.343 1.00 16.53 O ATOM 54 CB GLU A 23 35.840 -9.240 37.288 1.00 23.33 C ATOM 55 CG GLU A 23 37.296 -9.555 37.702 1.00 31.02 C ATOM 56 CD GLU A 23 37.575 -11.052 37.916 1.00 35.41 C ATOM 57 OE1 GLU A 23 36.638 -11.783 38.341 1.00 39.56 O ATOM 58 OE2 GLU A 23 38.727 -11.519 37.669 1.00 36.49 O ATOM 0 H GLU A 23 34.331 -7.924 35.887 1.00 18.72 H new ATOM 0 HA GLU A 23 34.997 -7.787 38.425 1.00 18.77 H new ATOM 0 HB2 GLU A 23 35.244 -9.836 37.768 1.00 23.33 H new ATOM 0 HB3 GLU A 23 35.736 -9.434 36.343 1.00 23.33 H new ATOM 0 HG2 GLU A 23 37.897 -9.218 37.019 1.00 31.02 H new ATOM 0 HG3 GLU A 23 37.500 -9.077 38.521 1.00 31.02 H new ATOM 59 N ALA A 24 37.047 -6.296 38.554 1.00 17.16 N ATOM 60 CA ALA A 24 38.159 -5.358 38.491 1.00 16.77 C ATOM 61 C ALA A 24 39.436 -5.955 37.873 1.00 16.73 C ATOM 62 O ALA A 24 39.954 -6.980 38.342 1.00 15.65 O ATOM 63 CB ALA A 24 38.445 -4.814 39.912 1.00 16.74 C ATOM 0 H ALA A 24 36.733 -6.444 39.341 1.00 17.16 H new ATOM 0 HA ALA A 24 37.894 -4.637 37.899 1.00 16.77 H new ATOM 0 HB1 ALA A 24 39.185 -4.188 39.876 1.00 16.74 H new ATOM 0 HB2 ALA A 24 37.656 -4.362 40.251 1.00 16.74 H new ATOM 0 HB3 ALA A 24 38.673 -5.550 40.501 1.00 16.74 H new ATOM 64 N HIS A 25 39.860 -5.236 36.833 1.00 15.73 N ATOM 65 CA HIS A 25 41.097 -5.483 36.059 1.00 14.30 C ATOM 66 C HIS A 25 41.128 -6.869 35.412 1.00 14.05 C ATOM 67 O HIS A 25 42.197 -7.475 35.253 1.00 15.18 O ATOM 68 CB HIS A 25 42.308 -5.357 36.976 1.00 13.19 C ATOM 69 CG HIS A 25 42.279 -4.067 37.790 1.00 13.01 C ATOM 70 ND1 HIS A 25 42.679 -2.849 37.252 1.00 14.23 N ATOM 71 CD2 HIS A 25 41.911 -3.818 39.072 1.00 11.65 C ATOM 72 CE1 HIS A 25 42.548 -1.926 38.187 1.00 12.21 C ATOM 73 NE2 HIS A 25 42.091 -2.488 39.279 1.00 14.17 N ATOM 0 H HIS A 25 39.419 -4.558 36.540 1.00 15.73 H new ATOM 0 HA HIS A 25 41.118 -4.821 35.351 1.00 14.30 H new ATOM 0 HB2 HIS A 25 42.337 -6.117 37.578 1.00 13.19 H new ATOM 0 HB3 HIS A 25 43.119 -5.385 36.445 1.00 13.19 H new ATOM 0 HD1 HIS A 25 42.962 -2.719 36.450 1.00 14.23 H new ATOM 0 HD2 HIS A 25 41.596 -4.438 39.689 1.00 11.65 H new ATOM 0 HE1 HIS A 25 42.748 -1.023 38.087 1.00 12.21 H new ATOM 74 N ALA A 26 39.962 -7.340 35.036 1.00 13.07 N ATOM 75 CA ALA A 26 39.823 -8.656 34.399 1.00 12.68 C ATOM 76 C ALA A 26 39.907 -8.522 32.872 1.00 11.55 C ATOM 77 O ALA A 26 39.813 -9.514 32.167 1.00 10.54 O ATOM 78 CB ALA A 26 38.472 -9.275 34.765 1.00 10.73 C ATOM 0 H ALA A 26 39.220 -6.916 35.137 1.00 13.07 H new ATOM 0 HA ALA A 26 40.543 -9.224 34.715 1.00 12.68 H new ATOM 0 HB1 ALA A 26 38.388 -10.143 34.341 1.00 10.73 H new ATOM 0 HB2 ALA A 26 38.414 -9.379 35.728 1.00 10.73 H new ATOM 0 HB3 ALA A 26 37.757 -8.696 34.459 1.00 10.73 H new ATOM 79 N ARG A 27 40.023 -7.290 32.385 1.00 11.67 N ATOM 80 CA ARG A 27 40.149 -6.965 30.960 1.00 11.51 C ATOM 81 C ARG A 27 41.284 -5.952 30.970 1.00 11.26 C ATOM 82 O ARG A 27 41.058 -4.753 30.905 1.00 13.35 O ATOM 83 CB ARG A 27 38.873 -6.327 30.457 1.00 11.85 C ATOM 84 CG ARG A 27 37.754 -7.323 30.272 1.00 12.53 C ATOM 85 CD ARG A 27 36.380 -6.681 30.454 1.00 16.12 C ATOM 86 NE ARG A 27 35.327 -7.683 30.312 1.00 18.10 N ATOM 87 CZ ARG A 27 34.867 -8.424 31.312 1.00 20.23 C ATOM 88 NH1 ARG A 27 35.342 -8.274 32.541 1.00 19.47 N ATOM 89 NH2 ARG A 27 33.913 -9.311 31.082 1.00 22.65 N ATOM 0 H ARG A 27 40.031 -6.594 32.890 1.00 11.67 H new ATOM 0 HA ARG A 27 40.311 -7.732 30.389 1.00 11.51 H new ATOM 0 HB2 ARG A 27 38.590 -5.642 31.083 1.00 11.85 H new ATOM 0 HB3 ARG A 27 39.049 -5.884 29.612 1.00 11.85 H new ATOM 0 HG2 ARG A 27 37.813 -7.713 29.386 1.00 12.53 H new ATOM 0 HG3 ARG A 27 37.858 -8.047 30.909 1.00 12.53 H new ATOM 0 HD2 ARG A 27 36.324 -6.266 31.329 1.00 16.12 H new ATOM 0 HD3 ARG A 27 36.256 -5.977 29.798 1.00 16.12 H new ATOM 0 HE ARG A 27 34.984 -7.800 29.532 1.00 18.10 H new ATOM 0 HH11 ARG A 27 35.955 -7.691 32.697 1.00 19.47 H new ATOM 0 HH12 ARG A 27 35.037 -8.759 33.182 1.00 19.47 H new ATOM 0 HH21 ARG A 27 33.595 -9.404 30.288 1.00 22.65 H new ATOM 0 HH22 ARG A 27 33.611 -9.794 31.726 1.00 22.65 H new ATOM 90 N PRO A 28 42.526 -6.435 31.028 1.00 10.03 N ATOM 91 CA PRO A 28 43.717 -5.595 31.076 1.00 9.85 C ATOM 92 C PRO A 28 43.974 -4.692 29.892 1.00 10.47 C ATOM 93 O PRO A 28 44.778 -3.740 29.983 1.00 10.58 O ATOM 94 CB PRO A 28 44.865 -6.599 31.298 1.00 10.28 C ATOM 95 CG PRO A 28 44.221 -7.889 31.613 1.00 9.30 C ATOM 96 CD PRO A 28 42.879 -7.862 30.978 1.00 9.20 C ATOM 0 HA PRO A 28 43.614 -4.936 31.780 1.00 9.85 H new ATOM 0 HB2 PRO A 28 45.420 -6.672 30.506 1.00 10.28 H new ATOM 0 HB3 PRO A 28 45.442 -6.312 32.023 1.00 10.28 H new ATOM 0 HG2 PRO A 28 44.748 -8.629 31.273 1.00 9.30 H new ATOM 0 HG3 PRO A 28 44.146 -8.011 32.572 1.00 9.30 H new ATOM 0 HD2 PRO A 28 42.905 -8.195 30.067 1.00 9.20 H new ATOM 0 HD3 PRO A 28 42.240 -8.408 31.462 1.00 9.20 H new ATOM 97 N TYR A 29 43.292 -4.992 28.793 1.00 10.38 N ATOM 98 CA TYR A 29 43.421 -4.257 27.537 1.00 10.16 C ATOM 99 C TYR A 29 42.512 -3.067 27.474 1.00 10.15 C ATOM 100 O TYR A 29 42.622 -2.265 26.572 1.00 10.62 O ATOM 101 CB TYR A 29 43.061 -5.146 26.357 1.00 10.14 C ATOM 102 CG TYR A 29 41.768 -5.893 26.595 1.00 11.04 C ATOM 103 CD1 TYR A 29 40.536 -5.251 26.401 1.00 10.68 C ATOM 104 CD2 TYR A 29 41.828 -7.211 27.020 1.00 11.68 C ATOM 105 CE1 TYR A 29 39.350 -5.958 26.631 1.00 13.07 C ATOM 106 CE2 TYR A 29 40.650 -7.918 27.248 1.00 10.07 C ATOM 107 CZ TYR A 29 39.414 -7.295 27.052 1.00 11.41 C ATOM 108 OH TYR A 29 38.279 -8.006 27.268 1.00 10.19 O ATOM 0 H TYR A 29 42.730 -5.641 28.754 1.00 10.38 H new ATOM 0 HA TYR A 29 44.345 -3.966 27.496 1.00 10.16 H new ATOM 0 HB2 TYR A 29 42.980 -4.605 25.556 1.00 10.14 H new ATOM 0 HB3 TYR A 29 43.777 -5.781 26.199 1.00 10.14 H new ATOM 0 HD1 TYR A 29 40.507 -4.364 26.122 1.00 10.68 H new ATOM 0 HD2 TYR A 29 42.652 -7.622 27.152 1.00 11.68 H new ATOM 0 HE1 TYR A 29 38.526 -5.545 26.506 1.00 13.07 H new ATOM 0 HE2 TYR A 29 40.686 -8.803 27.530 1.00 10.07 H new ATOM 0 HH TYR A 29 38.472 -8.740 27.629 1.00 10.19 H new ATOM 109 N MET A 30 41.595 -2.959 28.416 1.00 11.51 N ATOM 110 CA MET A 30 40.639 -1.853 28.428 1.00 11.40 C ATOM 111 C MET A 30 41.307 -0.507 28.615 1.00 11.00 C ATOM 112 O MET A 30 42.042 -0.285 29.593 1.00 10.59 O ATOM 113 CB MET A 30 39.574 -2.057 29.532 1.00 10.30 C ATOM 114 CG MET A 30 38.301 -1.304 29.251 1.00 13.46 C ATOM 115 SD MET A 30 37.603 -1.641 27.585 1.00 15.06 S ATOM 116 CE MET A 30 36.977 -0.059 27.358 1.00 11.05 C ATOM 0 H MET A 30 41.503 -3.516 29.065 1.00 11.51 H new ATOM 0 HA MET A 30 40.212 -1.854 27.557 1.00 11.40 H new ATOM 0 HB2 MET A 30 39.375 -3.003 29.615 1.00 10.30 H new ATOM 0 HB3 MET A 30 39.936 -1.768 30.384 1.00 10.30 H new ATOM 0 HG2 MET A 30 37.641 -1.536 29.923 1.00 13.46 H new ATOM 0 HG3 MET A 30 38.471 -0.353 29.336 1.00 13.46 H new ATOM 0 HE1 MET A 30 36.472 -0.026 26.530 1.00 11.05 H new ATOM 0 HE2 MET A 30 36.395 0.169 28.100 1.00 11.05 H new ATOM 0 HE3 MET A 30 37.709 0.576 27.315 1.00 11.05 H new ATOM 117 N ALA A 31 41.055 0.421 27.701 1.00 8.16 N ATOM 118 CA ALA A 31 41.655 1.718 27.832 1.00 7.33 C ATOM 119 C ALA A 31 40.572 2.762 27.849 1.00 7.87 C ATOM 120 O ALA A 31 39.473 2.509 27.360 1.00 8.19 O ATOM 121 CB ALA A 31 42.590 1.941 26.686 1.00 5.40 C ATOM 0 H ALA A 31 40.549 0.315 27.014 1.00 8.16 H new ATOM 0 HA ALA A 31 42.157 1.777 28.660 1.00 7.33 H new ATOM 0 HB1 ALA A 31 43.000 2.816 26.768 1.00 5.40 H new ATOM 0 HB2 ALA A 31 43.280 1.260 26.694 1.00 5.40 H new ATOM 0 HB3 ALA A 31 42.097 1.892 25.852 1.00 5.40 H new ATOM 122 N SER A 32 40.834 3.919 28.449 1.00 8.38 N ATOM 123 CA SER A 32 39.848 4.998 28.462 1.00 7.75 C ATOM 124 C SER A 32 40.534 6.161 27.765 1.00 9.55 C ATOM 125 O SER A 32 41.558 6.656 28.235 1.00 12.45 O ATOM 126 CB SER A 32 39.461 5.394 29.891 1.00 6.68 C ATOM 127 OG SER A 32 38.948 6.723 29.956 1.00 6.47 O ATOM 0 H SER A 32 41.572 4.100 28.852 1.00 8.38 H new ATOM 0 HA SER A 32 39.025 4.729 28.024 1.00 7.75 H new ATOM 0 HB2 SER A 32 38.795 4.774 30.229 1.00 6.68 H new ATOM 0 HB3 SER A 32 40.237 5.319 30.468 1.00 6.68 H new ATOM 0 HG SER A 32 38.132 6.719 29.755 1.00 6.47 H new ATOM 128 N VAL A 33 40.017 6.583 26.625 1.00 9.56 N ATOM 129 CA VAL A 33 40.618 7.692 25.909 1.00 11.91 C ATOM 130 C VAL A 33 40.034 8.967 26.510 1.00 13.95 C ATOM 131 O VAL A 33 38.806 9.128 26.531 1.00 15.41 O ATOM 132 CB VAL A 33 40.313 7.571 24.402 1.00 11.20 C ATOM 133 CG1 VAL A 33 40.815 8.754 23.670 1.00 13.98 C ATOM 134 CG2 VAL A 33 40.988 6.354 23.853 1.00 12.01 C ATOM 0 H VAL A 33 39.322 6.243 26.250 1.00 9.56 H new ATOM 0 HA VAL A 33 41.584 7.699 25.996 1.00 11.91 H new ATOM 0 HB VAL A 33 39.352 7.508 24.290 1.00 11.20 H new ATOM 0 HG11 VAL A 33 40.614 8.660 22.726 1.00 13.98 H new ATOM 0 HG12 VAL A 33 40.386 9.553 24.013 1.00 13.98 H new ATOM 0 HG13 VAL A 33 41.775 8.826 23.790 1.00 13.98 H new ATOM 0 HG21 VAL A 33 40.797 6.277 22.905 1.00 12.01 H new ATOM 0 HG22 VAL A 33 41.946 6.428 23.984 1.00 12.01 H new ATOM 0 HG23 VAL A 33 40.659 5.566 24.314 1.00 12.01 H new ATOM 135 N GLN A 34 40.888 9.875 27.005 1.00 16.01 N ATOM 136 CA GLN A 34 40.414 11.103 27.645 1.00 16.94 C ATOM 137 C GLN A 34 40.706 12.449 27.007 1.00 18.13 C ATOM 138 O GLN A 34 41.708 12.638 26.319 1.00 16.40 O ATOM 139 CB GLN A 34 40.920 11.131 29.085 1.00 17.70 C ATOM 140 CG GLN A 34 41.089 9.752 29.693 1.00 20.62 C ATOM 141 CD GLN A 34 40.675 9.688 31.158 1.00 21.61 C ATOM 142 OE1 GLN A 34 41.237 10.379 32.004 1.00 21.41 O ATOM 143 NE2 GLN A 34 39.691 8.843 31.461 1.00 20.13 N ATOM 0 H GLN A 34 41.744 9.795 26.978 1.00 16.01 H new ATOM 0 HA GLN A 34 39.452 11.028 27.548 1.00 16.94 H new ATOM 0 HB2 GLN A 34 41.771 11.595 29.112 1.00 17.70 H new ATOM 0 HB3 GLN A 34 40.300 11.643 29.628 1.00 17.70 H new ATOM 0 HG2 GLN A 34 40.562 9.114 29.186 1.00 20.62 H new ATOM 0 HG3 GLN A 34 42.017 9.481 29.613 1.00 20.62 H new ATOM 0 HE21 GLN A 34 39.320 8.375 30.842 1.00 20.13 H new ATOM 0 HE22 GLN A 34 39.426 8.766 32.276 1.00 20.13 H new ATOM 144 N LEU A 35 39.818 13.403 27.255 1.00 19.45 N ATOM 145 CA LEU A 35 39.973 14.738 26.725 1.00 23.14 C ATOM 146 C LEU A 35 39.911 15.707 27.876 1.00 25.71 C ATOM 147 O LEU A 35 38.823 16.001 28.385 1.00 28.53 O ATOM 148 CB LEU A 35 38.849 15.050 25.753 1.00 23.44 C ATOM 149 CG LEU A 35 38.985 16.350 24.971 1.00 24.13 C ATOM 150 CD1 LEU A 35 40.231 16.314 24.114 1.00 21.76 C ATOM 151 CD2 LEU A 35 37.730 16.563 24.107 1.00 23.59 C ATOM 0 H LEU A 35 39.113 13.290 27.734 1.00 19.45 H new ATOM 0 HA LEU A 35 40.820 14.810 26.257 1.00 23.14 H new ATOM 0 HB2 LEU A 35 38.780 14.318 25.120 1.00 23.44 H new ATOM 0 HB3 LEU A 35 38.015 15.077 26.248 1.00 23.44 H new ATOM 0 HG LEU A 35 39.067 17.093 25.589 1.00 24.13 H new ATOM 0 HD11 LEU A 35 40.309 17.145 23.620 1.00 21.76 H new ATOM 0 HD12 LEU A 35 41.010 16.201 24.680 1.00 21.76 H new ATOM 0 HD13 LEU A 35 40.174 15.573 23.491 1.00 21.76 H new ATOM 0 HD21 LEU A 35 37.816 17.391 23.609 1.00 23.59 H new ATOM 0 HD22 LEU A 35 37.633 15.822 23.488 1.00 23.59 H new ATOM 0 HD23 LEU A 35 36.948 16.610 24.678 1.00 23.59 H new ATOM 152 N ASN A 36 41.070 16.213 28.283 1.00 26.66 N ATOM 153 CA ASN A 36 41.132 17.169 29.385 1.00 26.95 C ATOM 154 C ASN A 36 40.682 16.565 30.709 1.00 25.70 C ATOM 155 O ASN A 36 39.853 17.165 31.422 1.00 24.77 O ATOM 156 CB ASN A 36 40.282 18.405 29.042 1.00 28.69 C ATOM 157 CG ASN A 36 40.939 19.277 27.982 1.00 29.76 C ATOM 158 OD1 ASN A 36 42.166 19.343 27.912 1.00 32.52 O ATOM 159 ND2 ASN A 36 40.145 19.945 27.174 1.00 29.21 N ATOM 0 H ASN A 36 41.832 16.017 27.935 1.00 26.66 H new ATOM 0 HA ASN A 36 42.060 17.428 29.498 1.00 26.95 H new ATOM 0 HB2 ASN A 36 39.410 18.119 28.728 1.00 28.69 H new ATOM 0 HB3 ASN A 36 40.137 18.929 29.845 1.00 28.69 H new ATOM 0 HD21 ASN A 36 40.479 20.453 26.566 1.00 29.21 H new ATOM 0 HD22 ASN A 36 39.292 19.873 27.253 1.00 29.21 H new ATOM 160 N GLY A 38 41.214 15.375 31.014 1.00 24.62 N ATOM 161 CA GLY A 38 40.913 14.684 32.256 1.00 23.62 C ATOM 162 C GLY A 38 39.550 14.032 32.361 1.00 24.20 C ATOM 163 O GLY A 38 39.188 13.513 33.422 1.00 25.12 O ATOM 0 H GLY A 38 41.759 14.952 30.501 1.00 24.62 H new ATOM 0 HA2 GLY A 38 41.587 14.000 32.392 1.00 23.62 H new ATOM 0 HA3 GLY A 38 41.002 15.319 32.984 1.00 23.62 H new ATOM 164 N ALA A 39 38.788 14.033 31.272 1.00 22.58 N ATOM 165 CA ALA A 39 37.460 13.434 31.261 1.00 20.71 C ATOM 166 C ALA A 39 37.395 12.290 30.253 1.00 19.30 C ATOM 167 O ALA A 39 37.996 12.381 29.187 1.00 19.75 O ATOM 168 CB ALA A 39 36.415 14.496 30.892 1.00 20.96 C ATOM 0 H ALA A 39 39.026 14.380 30.522 1.00 22.58 H new ATOM 0 HA ALA A 39 37.274 13.084 32.146 1.00 20.71 H new ATOM 0 HB1 ALA A 39 35.533 14.093 30.886 1.00 20.96 H new ATOM 0 HB2 ALA A 39 36.438 15.213 31.544 1.00 20.96 H new ATOM 0 HB3 ALA A 39 36.613 14.853 30.012 1.00 20.96 H new ATOM 169 N HIS A 40 36.664 11.229 30.590 1.00 17.39 N ATOM 170 CA HIS A 40 36.517 10.084 29.700 1.00 16.27 C ATOM 171 C HIS A 40 35.724 10.475 28.483 1.00 15.72 C ATOM 172 O HIS A 40 34.666 11.110 28.580 1.00 16.50 O ATOM 173 CB HIS A 40 35.796 8.924 30.388 1.00 13.96 C ATOM 174 CG HIS A 40 35.425 7.812 29.455 1.00 12.77 C ATOM 175 ND1 HIS A 40 36.275 6.765 29.167 1.00 12.27 N ATOM 176 CD2 HIS A 40 34.293 7.581 28.755 1.00 11.95 C ATOM 177 CE1 HIS A 40 35.679 5.933 28.336 1.00 10.68 C ATOM 178 NE2 HIS A 40 34.475 6.405 28.069 1.00 12.73 N ATOM 0 H HIS A 40 36.243 11.154 31.336 1.00 17.39 H new ATOM 0 HA HIS A 40 37.410 9.799 29.450 1.00 16.27 H new ATOM 0 HB2 HIS A 40 36.364 8.571 31.091 1.00 13.96 H new ATOM 0 HB3 HIS A 40 34.992 9.260 30.815 1.00 13.96 H new ATOM 0 HD2 HIS A 40 33.533 8.117 28.740 1.00 11.95 H new ATOM 0 HE1 HIS A 40 36.044 5.148 27.996 1.00 10.68 H new ATOM 0 HE2 HIS A 40 33.898 6.036 27.549 1.00 12.73 H new ATOM 179 N LEU A 41 36.232 10.076 27.328 1.00 15.90 N ATOM 180 CA LEU A 41 35.623 10.381 26.034 1.00 16.19 C ATOM 181 C LEU A 41 35.113 9.122 25.314 1.00 14.53 C ATOM 182 O LEU A 41 33.965 9.045 24.943 1.00 14.91 O ATOM 183 CB LEU A 41 36.655 11.074 25.147 1.00 18.07 C ATOM 184 CG LEU A 41 36.248 11.719 23.812 1.00 19.53 C ATOM 185 CD1 LEU A 41 35.369 12.942 24.077 1.00 18.53 C ATOM 186 CD2 LEU A 41 37.516 12.103 23.032 1.00 18.28 C ATOM 0 H LEU A 41 36.953 9.612 27.268 1.00 15.90 H new ATOM 0 HA LEU A 41 34.860 10.957 26.199 1.00 16.19 H new ATOM 0 HB2 LEU A 41 37.070 11.768 25.683 1.00 18.07 H new ATOM 0 HB3 LEU A 41 37.343 10.420 24.948 1.00 18.07 H new ATOM 0 HG LEU A 41 35.735 11.091 23.280 1.00 19.53 H new ATOM 0 HD11 LEU A 41 35.114 13.346 23.233 1.00 18.53 H new ATOM 0 HD12 LEU A 41 34.572 12.670 24.558 1.00 18.53 H new ATOM 0 HD13 LEU A 41 35.863 13.587 24.608 1.00 18.53 H new ATOM 0 HD21 LEU A 41 37.266 12.511 22.188 1.00 18.28 H new ATOM 0 HD22 LEU A 41 38.038 12.733 23.553 1.00 18.28 H new ATOM 0 HD23 LEU A 41 38.045 11.308 22.862 1.00 18.28 H new ATOM 187 N CYS A 42 36.005 8.161 25.108 1.00 13.90 N ATOM 188 CA CYS A 42 35.652 6.935 24.416 1.00 12.39 C ATOM 189 C CYS A 42 36.411 5.811 25.017 1.00 11.17 C ATOM 190 O CYS A 42 37.315 6.012 25.794 1.00 10.77 O ATOM 191 CB CYS A 42 36.097 6.998 22.979 1.00 13.81 C ATOM 192 SG CYS A 42 35.215 8.207 21.978 1.00 18.47 S ATOM 0 H CYS A 42 36.825 8.202 25.364 1.00 13.90 H new ATOM 0 HA CYS A 42 34.691 6.817 24.482 1.00 12.39 H new ATOM 0 HB2 CYS A 42 37.045 7.204 22.954 1.00 13.81 H new ATOM 0 HB3 CYS A 42 35.987 6.121 22.579 1.00 13.81 H new ATOM 193 N GLY A 43 36.062 4.610 24.623 1.00 11.23 N ATOM 194 CA GLY A 43 36.812 3.472 25.099 1.00 9.64 C ATOM 195 C GLY A 43 37.950 3.277 24.103 1.00 8.90 C ATOM 196 O GLY A 43 38.017 3.972 23.098 1.00 6.45 O ATOM 0 H GLY A 43 35.409 4.431 24.092 1.00 11.23 H new ATOM 0 HA2 GLY A 43 37.155 3.631 25.992 1.00 9.64 H new ATOM 0 HA3 GLY A 43 36.252 2.681 25.146 1.00 9.64 H new ATOM 197 N GLY A 44 38.843 2.336 24.380 1.00 8.11 N ATOM 198 CA GLY A 44 39.953 2.068 23.489 1.00 7.26 C ATOM 199 C GLY A 44 40.483 0.710 23.873 1.00 8.50 C ATOM 200 O GLY A 44 40.136 0.188 24.941 1.00 8.79 O ATOM 0 H GLY A 44 38.821 1.841 25.083 1.00 8.11 H new ATOM 0 HA2 GLY A 44 39.664 2.078 22.563 1.00 7.26 H new ATOM 0 HA3 GLY A 44 40.641 2.746 23.579 1.00 7.26 H new ATOM 201 N VAL A 45 41.290 0.097 23.019 1.00 8.07 N ATOM 202 CA VAL A 45 41.843 -1.196 23.391 1.00 9.07 C ATOM 203 C VAL A 45 43.326 -1.210 23.049 1.00 9.73 C ATOM 204 O VAL A 45 43.717 -0.764 21.978 1.00 10.38 O ATOM 205 CB VAL A 45 41.080 -2.341 22.689 1.00 10.46 C ATOM 206 CG1 VAL A 45 40.859 -1.981 21.271 1.00 10.37 C ATOM 207 CG2 VAL A 45 41.838 -3.674 22.823 1.00 9.73 C ATOM 0 H VAL A 45 41.524 0.398 22.248 1.00 8.07 H new ATOM 0 HA VAL A 45 41.741 -1.337 24.345 1.00 9.07 H new ATOM 0 HB VAL A 45 40.219 -2.463 23.118 1.00 10.46 H new ATOM 0 HG11 VAL A 45 40.380 -2.697 20.826 1.00 10.37 H new ATOM 0 HG12 VAL A 45 40.338 -1.165 21.222 1.00 10.37 H new ATOM 0 HG13 VAL A 45 41.714 -1.845 20.834 1.00 10.37 H new ATOM 0 HG21 VAL A 45 41.340 -4.376 22.375 1.00 9.73 H new ATOM 0 HG22 VAL A 45 42.715 -3.590 22.417 1.00 9.73 H new ATOM 0 HG23 VAL A 45 41.937 -3.897 23.762 1.00 9.73 H new ATOM 208 N LEU A 46 44.146 -1.667 23.993 1.00 8.53 N ATOM 209 CA LEU A 46 45.590 -1.753 23.811 1.00 9.05 C ATOM 210 C LEU A 46 45.808 -2.949 22.913 1.00 9.97 C ATOM 211 O LEU A 46 45.376 -4.046 23.232 1.00 11.84 O ATOM 212 CB LEU A 46 46.307 -1.948 25.174 1.00 8.18 C ATOM 213 CG LEU A 46 47.844 -1.849 25.300 1.00 7.47 C ATOM 214 CD1 LEU A 46 48.311 -0.422 25.065 1.00 6.50 C ATOM 215 CD2 LEU A 46 48.271 -2.284 26.684 1.00 8.35 C ATOM 0 H LEU A 46 43.876 -1.938 24.763 1.00 8.53 H new ATOM 0 HA LEU A 46 45.954 -0.941 23.424 1.00 9.05 H new ATOM 0 HB2 LEU A 46 45.932 -1.296 25.786 1.00 8.18 H new ATOM 0 HB3 LEU A 46 46.053 -2.824 25.503 1.00 8.18 H new ATOM 0 HG LEU A 46 48.243 -2.427 24.631 1.00 7.47 H new ATOM 0 HD11 LEU A 46 49.277 -0.379 25.148 1.00 6.50 H new ATOM 0 HD12 LEU A 46 48.051 -0.139 24.175 1.00 6.50 H new ATOM 0 HD13 LEU A 46 47.904 0.164 25.722 1.00 6.50 H new ATOM 0 HD21 LEU A 46 49.236 -2.221 26.760 1.00 8.35 H new ATOM 0 HD22 LEU A 46 47.857 -1.709 27.346 1.00 8.35 H new ATOM 0 HD23 LEU A 46 47.995 -3.202 26.835 1.00 8.35 H new ATOM 216 N VAL A 47 46.457 -2.726 21.776 1.00 11.32 N ATOM 217 CA VAL A 47 46.707 -3.796 20.820 1.00 12.49 C ATOM 218 C VAL A 47 48.189 -4.112 20.737 1.00 15.04 C ATOM 219 O VAL A 47 48.570 -5.168 20.252 1.00 18.51 O ATOM 220 CB VAL A 47 46.204 -3.418 19.415 1.00 10.15 C ATOM 221 CG1 VAL A 47 44.710 -3.546 19.363 1.00 9.64 C ATOM 222 CG2 VAL A 47 46.564 -2.013 19.085 1.00 6.14 C ATOM 0 H VAL A 47 46.762 -1.958 21.539 1.00 11.32 H new ATOM 0 HA VAL A 47 46.224 -4.576 21.134 1.00 12.49 H new ATOM 0 HB VAL A 47 46.620 -4.016 18.775 1.00 10.15 H new ATOM 0 HG11 VAL A 47 44.395 -3.307 18.477 1.00 9.64 H new ATOM 0 HG12 VAL A 47 44.456 -4.461 19.560 1.00 9.64 H new ATOM 0 HG13 VAL A 47 44.311 -2.952 20.018 1.00 9.64 H new ATOM 0 HG21 VAL A 47 46.239 -1.795 18.198 1.00 6.14 H new ATOM 0 HG22 VAL A 47 46.160 -1.415 19.733 1.00 6.14 H new ATOM 0 HG23 VAL A 47 47.528 -1.912 19.109 1.00 6.14 H new ATOM 223 N ALA A 48 49.017 -3.191 21.192 1.00 14.73 N ATOM 224 CA ALA A 48 50.462 -3.362 21.195 1.00 18.00 C ATOM 225 C ALA A 48 50.929 -2.577 22.417 1.00 19.70 C ATOM 226 O ALA A 48 50.133 -1.855 23.006 1.00 21.04 O ATOM 227 CB ALA A 48 51.076 -2.785 19.925 1.00 16.69 C ATOM 0 H ALA A 48 48.755 -2.437 21.513 1.00 14.73 H new ATOM 0 HA ALA A 48 50.724 -4.295 21.227 1.00 18.00 H new ATOM 0 HB1 ALA A 48 52.038 -2.908 19.945 1.00 16.69 H new ATOM 0 HB2 ALA A 48 50.708 -3.241 19.152 1.00 16.69 H new ATOM 0 HB3 ALA A 48 50.873 -1.838 19.868 1.00 16.69 H new ATOM 228 N GLU A 49 52.200 -2.688 22.793 1.00 20.77 N ATOM 229 CA GLU A 49 52.672 -1.983 23.983 1.00 21.41 C ATOM 230 C GLU A 49 52.564 -0.478 23.920 1.00 18.51 C ATOM 231 O GLU A 49 52.359 0.171 24.935 1.00 17.23 O ATOM 232 CB GLU A 49 54.113 -2.344 24.276 1.00 23.76 C ATOM 233 CG GLU A 49 54.303 -3.777 24.638 1.00 29.70 C ATOM 234 CD GLU A 49 55.760 -4.120 24.760 1.00 32.95 C ATOM 235 OE1 GLU A 49 56.440 -3.543 25.642 1.00 34.62 O ATOM 236 OE2 GLU A 49 56.230 -4.957 23.960 1.00 35.61 O ATOM 0 H GLU A 49 52.795 -3.156 22.384 1.00 20.77 H new ATOM 0 HA GLU A 49 52.077 -2.277 24.690 1.00 21.41 H new ATOM 0 HB2 GLU A 49 54.655 -2.139 23.498 1.00 23.76 H new ATOM 0 HB3 GLU A 49 54.437 -1.788 25.002 1.00 23.76 H new ATOM 0 HG2 GLU A 49 53.853 -3.963 25.477 1.00 29.70 H new ATOM 0 HG3 GLU A 49 53.891 -4.340 23.964 1.00 29.70 H new ATOM 237 N GLN A 50 52.679 0.086 22.735 1.00 14.32 N ATOM 238 CA GLN A 50 52.623 1.524 22.645 1.00 14.41 C ATOM 239 C GLN A 50 51.452 2.026 21.808 1.00 13.60 C ATOM 240 O GLN A 50 51.361 3.214 21.503 1.00 13.44 O ATOM 241 CB GLN A 50 53.953 2.018 22.070 1.00 13.88 C ATOM 242 CG GLN A 50 54.161 3.520 22.092 1.00 16.64 C ATOM 243 CD GLN A 50 55.598 3.900 21.814 1.00 18.14 C ATOM 244 OE1 GLN A 50 56.380 3.080 21.347 1.00 19.48 O ATOM 245 NE2 GLN A 50 55.950 5.143 22.101 1.00 16.62 N ATOM 0 H GLN A 50 52.787 -0.332 21.991 1.00 14.32 H new ATOM 0 HA GLN A 50 52.479 1.881 23.535 1.00 14.41 H new ATOM 0 HB2 GLN A 50 54.675 1.601 22.565 1.00 13.88 H new ATOM 0 HB3 GLN A 50 54.024 1.712 21.152 1.00 13.88 H new ATOM 0 HG2 GLN A 50 53.585 3.935 21.431 1.00 16.64 H new ATOM 0 HG3 GLN A 50 53.897 3.869 22.958 1.00 16.64 H new ATOM 0 HE21 GLN A 50 55.372 5.689 22.428 1.00 16.62 H new ATOM 0 HE22 GLN A 50 56.757 5.405 21.961 1.00 16.62 H new ATOM 246 N TRP A 51 50.537 1.130 21.457 1.00 13.51 N ATOM 247 CA TRP A 51 49.402 1.483 20.613 1.00 11.33 C ATOM 248 C TRP A 51 48.052 1.110 21.165 1.00 9.74 C ATOM 249 O TRP A 51 47.818 -0.020 21.604 1.00 6.93 O ATOM 250 CB TRP A 51 49.546 0.817 19.230 1.00 12.04 C ATOM 251 CG TRP A 51 50.644 1.382 18.409 1.00 12.60 C ATOM 252 CD1 TRP A 51 51.939 0.948 18.365 1.00 11.76 C ATOM 253 CD2 TRP A 51 50.578 2.549 17.576 1.00 12.82 C ATOM 254 NE1 TRP A 51 52.683 1.778 17.565 1.00 12.50 N ATOM 255 CE2 TRP A 51 51.877 2.768 17.064 1.00 12.48 C ATOM 256 CE3 TRP A 51 49.551 3.429 17.215 1.00 12.42 C ATOM 257 CZ2 TRP A 51 52.180 3.837 16.214 1.00 13.51 C ATOM 258 CZ3 TRP A 51 49.854 4.503 16.364 1.00 13.45 C ATOM 259 CH2 TRP A 51 51.159 4.693 15.874 1.00 13.74 C ATOM 0 H TRP A 51 50.556 0.305 21.699 1.00 13.51 H new ATOM 0 HA TRP A 51 49.428 2.451 20.562 1.00 11.33 H new ATOM 0 HB2 TRP A 51 49.699 -0.133 19.352 1.00 12.04 H new ATOM 0 HB3 TRP A 51 48.710 0.910 18.746 1.00 12.04 H new ATOM 0 HD1 TRP A 51 52.267 0.201 18.811 1.00 11.76 H new ATOM 0 HE1 TRP A 51 53.523 1.691 17.403 1.00 12.50 H new ATOM 0 HE3 TRP A 51 48.686 3.305 17.533 1.00 12.42 H new ATOM 0 HZ2 TRP A 51 53.042 3.964 15.890 1.00 13.51 H new ATOM 0 HZ3 TRP A 51 49.182 5.098 16.120 1.00 13.45 H new ATOM 0 HH2 TRP A 51 51.334 5.411 15.310 1.00 13.74 H new ATOM 260 N VAL A 52 47.137 2.056 21.087 1.00 9.64 N ATOM 261 CA VAL A 52 45.792 1.811 21.549 1.00 9.83 C ATOM 262 C VAL A 52 44.893 2.034 20.357 1.00 10.51 C ATOM 263 O VAL A 52 45.038 3.051 19.684 1.00 9.96 O ATOM 264 CB VAL A 52 45.400 2.820 22.627 1.00 10.49 C ATOM 265 CG1 VAL A 52 43.887 2.770 22.854 1.00 9.37 C ATOM 266 CG2 VAL A 52 46.207 2.562 23.897 1.00 8.24 C ATOM 0 H VAL A 52 47.275 2.844 20.771 1.00 9.64 H new ATOM 0 HA VAL A 52 45.719 0.917 21.918 1.00 9.83 H new ATOM 0 HB VAL A 52 45.613 3.722 22.340 1.00 10.49 H new ATOM 0 HG11 VAL A 52 43.641 3.411 23.539 1.00 9.37 H new ATOM 0 HG12 VAL A 52 43.428 2.988 22.028 1.00 9.37 H new ATOM 0 HG13 VAL A 52 43.632 1.879 23.140 1.00 9.37 H new ATOM 0 HG21 VAL A 52 45.954 3.205 24.578 1.00 8.24 H new ATOM 0 HG22 VAL A 52 46.027 1.665 24.218 1.00 8.24 H new ATOM 0 HG23 VAL A 52 47.153 2.652 23.703 1.00 8.24 H new ATOM 267 N LEU A 53 43.989 1.087 20.090 1.00 11.00 N ATOM 268 CA LEU A 53 43.013 1.192 18.995 1.00 10.68 C ATOM 269 C LEU A 53 41.668 1.747 19.528 1.00 10.09 C ATOM 270 O LEU A 53 41.169 1.294 20.561 1.00 10.31 O ATOM 271 CB LEU A 53 42.779 -0.186 18.341 1.00 10.58 C ATOM 272 CG LEU A 53 41.743 -0.257 17.214 1.00 10.59 C ATOM 273 CD1 LEU A 53 42.289 0.397 15.939 1.00 11.66 C ATOM 274 CD2 LEU A 53 41.413 -1.709 16.954 1.00 10.56 C ATOM 0 H LEU A 53 43.923 0.359 20.543 1.00 11.00 H new ATOM 0 HA LEU A 53 43.370 1.800 18.329 1.00 10.68 H new ATOM 0 HB2 LEU A 53 43.627 -0.501 17.991 1.00 10.58 H new ATOM 0 HB3 LEU A 53 42.511 -0.807 19.036 1.00 10.58 H new ATOM 0 HG LEU A 53 40.942 0.223 17.478 1.00 10.59 H new ATOM 0 HD11 LEU A 53 41.622 0.344 15.237 1.00 11.66 H new ATOM 0 HD12 LEU A 53 42.498 1.328 16.116 1.00 11.66 H new ATOM 0 HD13 LEU A 53 43.093 -0.066 15.656 1.00 11.66 H new ATOM 0 HD21 LEU A 53 40.757 -1.770 16.242 1.00 10.56 H new ATOM 0 HD22 LEU A 53 42.218 -2.182 16.693 1.00 10.56 H new ATOM 0 HD23 LEU A 53 41.051 -2.108 17.761 1.00 10.56 H new ATOM 275 N SER A 54 41.102 2.719 18.808 1.00 8.66 N ATOM 276 CA SER A 54 39.841 3.363 19.164 1.00 10.71 C ATOM 277 C SER A 54 39.043 3.731 17.904 1.00 10.95 C ATOM 278 O SER A 54 39.271 3.157 16.861 1.00 11.82 O ATOM 279 CB SER A 54 40.107 4.619 19.976 1.00 10.92 C ATOM 280 OG SER A 54 38.934 5.036 20.642 1.00 11.98 O ATOM 0 H SER A 54 41.450 3.027 18.084 1.00 8.66 H new ATOM 0 HA SER A 54 39.322 2.738 19.693 1.00 10.71 H new ATOM 0 HB2 SER A 54 40.810 4.450 20.623 1.00 10.92 H new ATOM 0 HB3 SER A 54 40.423 5.327 19.393 1.00 10.92 H new ATOM 0 HG SER A 54 38.835 4.585 21.344 1.00 11.98 H new ATOM 281 N ALA A 55 38.111 4.674 18.008 1.00 9.27 N ATOM 282 CA ALA A 55 37.304 5.092 16.868 1.00 7.69 C ATOM 283 C ALA A 55 37.680 6.511 16.473 1.00 9.87 C ATOM 284 O ALA A 55 37.916 7.369 17.324 1.00 9.59 O ATOM 285 CB ALA A 55 35.835 5.006 17.204 1.00 7.28 C ATOM 0 H ALA A 55 37.930 5.088 18.740 1.00 9.27 H new ATOM 0 HA ALA A 55 37.477 4.499 16.120 1.00 7.69 H new ATOM 0 HB1 ALA A 55 35.311 5.287 16.438 1.00 7.28 H new ATOM 0 HB2 ALA A 55 35.608 4.091 17.433 1.00 7.28 H new ATOM 0 HB3 ALA A 55 35.641 5.585 17.958 1.00 7.28 H new ATOM 286 N ALA A 56 37.737 6.748 15.166 1.00 11.77 N ATOM 287 CA ALA A 56 38.134 8.035 14.601 1.00 14.17 C ATOM 288 C ALA A 56 37.303 9.238 14.998 1.00 15.54 C ATOM 289 O ALA A 56 37.842 10.286 15.324 1.00 16.34 O ATOM 290 CB ALA A 56 38.187 7.931 13.094 1.00 13.12 C ATOM 0 H ALA A 56 37.543 6.156 14.573 1.00 11.77 H new ATOM 0 HA ALA A 56 39.006 8.208 14.988 1.00 14.17 H new ATOM 0 HB1 ALA A 56 38.451 8.786 12.720 1.00 13.12 H new ATOM 0 HB2 ALA A 56 38.833 7.254 12.839 1.00 13.12 H new ATOM 0 HB3 ALA A 56 37.312 7.686 12.755 1.00 13.12 H new ATOM 291 N HIS A 57 35.988 9.090 14.973 1.00 18.70 N ATOM 292 CA HIS A 57 35.111 10.198 15.312 1.00 22.96 C ATOM 293 C HIS A 57 35.200 10.651 16.759 1.00 24.33 C ATOM 294 O HIS A 57 34.571 11.629 17.137 1.00 24.85 O ATOM 295 CB HIS A 57 33.675 9.846 14.929 1.00 24.51 C ATOM 296 CG HIS A 57 33.507 9.562 13.466 1.00 29.79 C ATOM 297 ND1 HIS A 57 34.197 10.255 12.493 1.00 30.38 N ATOM 298 CD2 HIS A 57 32.769 8.632 12.812 1.00 31.39 C ATOM 299 CE1 HIS A 57 33.892 9.763 11.306 1.00 31.71 C ATOM 300 NE2 HIS A 57 33.028 8.778 11.473 1.00 32.74 N ATOM 0 H HIS A 57 35.584 8.360 14.764 1.00 18.70 H new ATOM 0 HA HIS A 57 35.417 10.961 14.797 1.00 22.96 H new ATOM 0 HB2 HIS A 57 33.392 9.070 15.438 1.00 24.51 H new ATOM 0 HB3 HIS A 57 33.091 10.579 15.180 1.00 24.51 H new ATOM 0 HD1 HIS A 57 34.741 10.906 12.637 1.00 30.38 H new ATOM 0 HD2 HIS A 57 32.195 8.011 13.199 1.00 31.39 H new ATOM 0 HE1 HIS A 57 34.228 10.060 10.491 1.00 31.71 H new ATOM 0 HE2 HIS A 57 32.683 8.304 10.843 1.00 32.74 H new ATOM 301 N CYS A 58 35.995 9.944 17.553 1.00 26.14 N ATOM 302 CA CYS A 58 36.206 10.288 18.959 1.00 27.26 C ATOM 303 C CYS A 58 37.101 11.519 19.006 1.00 29.42 C ATOM 304 O CYS A 58 37.051 12.325 19.919 1.00 29.15 O ATOM 305 CB CYS A 58 36.909 9.138 19.681 1.00 24.19 C ATOM 306 SG CYS A 58 35.836 7.728 20.097 1.00 20.84 S ATOM 0 H CYS A 58 36.430 9.249 17.293 1.00 26.14 H new ATOM 0 HA CYS A 58 35.354 10.457 19.391 1.00 27.26 H new ATOM 0 HB2 CYS A 58 37.637 8.821 19.125 1.00 24.19 H new ATOM 0 HB3 CYS A 58 37.304 9.480 20.498 1.00 24.19 H new ATOM 307 N LEU A 59 37.934 11.662 17.996 1.00 33.74 N ATOM 308 CA LEU A 59 38.828 12.799 17.950 1.00 38.47 C ATOM 309 C LEU A 59 38.111 14.003 17.431 1.00 40.64 C ATOM 310 O LEU A 59 38.623 15.129 17.506 1.00 41.51 O ATOM 311 CB LEU A 59 40.018 12.508 17.057 1.00 39.19 C ATOM 312 CG LEU A 59 41.378 12.650 17.720 1.00 40.11 C ATOM 313 CD1 LEU A 59 41.453 11.819 19.038 1.00 39.12 C ATOM 314 CD2 LEU A 59 42.440 12.233 16.662 1.00 40.62 C ATOM 0 H LEU A 59 37.999 11.119 17.333 1.00 33.74 H new ATOM 0 HA LEU A 59 39.140 12.971 18.852 1.00 38.47 H new ATOM 0 HB2 LEU A 59 39.934 11.604 16.716 1.00 39.19 H new ATOM 0 HB3 LEU A 59 39.983 13.104 16.293 1.00 39.19 H new ATOM 0 HG LEU A 59 41.546 13.564 17.997 1.00 40.11 H new ATOM 0 HD11 LEU A 59 42.329 11.927 19.440 1.00 39.12 H new ATOM 0 HD12 LEU A 59 40.774 12.131 19.656 1.00 39.12 H new ATOM 0 HD13 LEU A 59 41.303 10.882 18.839 1.00 39.12 H new ATOM 0 HD21 LEU A 59 43.327 12.310 17.046 1.00 40.62 H new ATOM 0 HD22 LEU A 59 42.284 11.315 16.391 1.00 40.62 H new ATOM 0 HD23 LEU A 59 42.372 12.814 15.888 1.00 40.62 H new ATOM 315 N GLU A 60 36.942 13.761 16.865 1.00 43.69 N ATOM 316 CA GLU A 60 36.150 14.851 16.363 1.00 47.18 C ATOM 317 C GLU A 60 35.717 15.711 17.546 1.00 49.44 C ATOM 318 O GLU A 60 35.457 16.908 17.380 1.00 49.71 O ATOM 319 CB GLU A 60 34.936 14.323 15.618 1.00 47.82 C ATOM 320 CG GLU A 60 35.122 14.340 14.125 1.00 48.91 C ATOM 321 CD GLU A 60 33.999 13.660 13.381 1.00 50.91 C ATOM 322 OE1 GLU A 60 32.803 14.014 13.605 1.00 51.13 O ATOM 323 OE2 GLU A 60 34.314 12.757 12.561 1.00 50.80 O ATOM 0 H GLU A 60 36.597 12.980 16.765 1.00 43.69 H new ATOM 0 HA GLU A 60 36.672 15.382 15.741 1.00 47.18 H new ATOM 0 HB2 GLU A 60 34.752 13.416 15.907 1.00 47.82 H new ATOM 0 HB3 GLU A 60 34.160 14.857 15.850 1.00 47.82 H new ATOM 0 HG2 GLU A 60 35.192 15.259 13.824 1.00 48.91 H new ATOM 0 HG3 GLU A 60 35.960 13.904 13.904 1.00 48.91 H new ATOM 324 N ASP A 61 35.647 15.105 18.737 1.00 51.90 N ATOM 325 CA ASP A 61 35.256 15.814 19.966 1.00 53.73 C ATOM 326 C ASP A 61 36.478 16.502 20.576 1.00 54.43 C ATOM 327 O ASP A 61 36.401 17.616 21.083 1.00 54.47 O ATOM 328 CB ASP A 61 34.656 14.837 21.007 1.00 54.32 C ATOM 329 CG ASP A 61 33.430 14.070 20.487 1.00 55.76 C ATOM 330 OD1 ASP A 61 32.417 14.721 20.113 1.00 56.62 O ATOM 331 OD2 ASP A 61 33.463 12.804 20.463 1.00 55.32 O ATOM 0 H ASP A 61 35.825 14.272 18.856 1.00 51.90 H new ATOM 0 HA ASP A 61 34.583 16.472 19.732 1.00 53.73 H new ATOM 0 HB2 ASP A 61 35.338 14.201 21.274 1.00 54.32 H new ATOM 0 HB3 ASP A 61 34.405 15.335 21.801 1.00 54.32 H new ATOM 332 N ALA A 61A 37.608 15.817 20.511 1.00 55.49 N ATOM 333 CA ALA A 61A 38.832 16.330 21.077 1.00 56.80 C ATOM 334 C ALA A 61A 39.467 17.363 20.184 1.00 57.32 C ATOM 335 O ALA A 61A 40.684 17.542 20.213 1.00 57.32 O ATOM 336 CB ALA A 61A 39.789 15.199 21.316 1.00 56.92 C ATOM 0 H ALA A 61A 37.683 15.045 20.138 1.00 55.49 H new ATOM 0 HA ALA A 61A 38.617 16.761 21.919 1.00 56.80 H new ATOM 0 HB1 ALA A 61A 40.611 15.546 21.696 1.00 56.92 H new ATOM 0 HB2 ALA A 61A 39.391 14.563 21.931 1.00 56.92 H new ATOM 0 HB3 ALA A 61A 39.984 14.756 20.475 1.00 56.92 H new ATOM 337 N ALA A 61B 38.644 18.032 19.383 1.00 58.26 N ATOM 338 CA ALA A 61B 39.133 19.069 18.473 1.00 58.68 C ATOM 339 C ALA A 61B 40.048 20.017 19.255 1.00 58.56 C ATOM 340 O ALA A 61B 41.215 20.242 18.888 1.00 58.56 O ATOM 341 CB ALA A 61B 37.938 19.864 17.848 1.00 58.55 C ATOM 0 H ALA A 61B 37.795 17.901 19.350 1.00 58.26 H new ATOM 0 HA ALA A 61B 39.628 18.656 17.748 1.00 58.68 H new ATOM 0 HB1 ALA A 61B 38.281 20.546 17.249 1.00 58.55 H new ATOM 0 HB2 ALA A 61B 37.368 19.255 17.352 1.00 58.55 H new ATOM 0 HB3 ALA A 61B 37.424 20.284 18.555 1.00 58.55 H new ATOM 342 N ASP A 61C 39.512 20.561 20.341 1.00 57.28 N ATOM 343 CA ASP A 61C 40.263 21.475 21.189 1.00 56.06 C ATOM 344 C ASP A 61C 40.409 20.787 22.537 1.00 53.63 C ATOM 345 O ASP A 61C 39.416 20.589 23.256 1.00 54.20 O ATOM 346 CB ASP A 61C 39.489 22.787 21.307 1.00 58.90 C ATOM 347 CG ASP A 61C 38.682 23.087 20.041 1.00 61.93 C ATOM 348 OD1 ASP A 61C 39.284 23.101 18.934 1.00 63.31 O ATOM 349 OD2 ASP A 61C 37.449 23.291 20.145 1.00 63.56 O ATOM 0 H ASP A 61C 38.707 20.411 20.605 1.00 57.28 H new ATOM 0 HA ASP A 61C 41.139 21.685 20.829 1.00 56.06 H new ATOM 0 HB2 ASP A 61C 38.890 22.742 22.069 1.00 58.90 H new ATOM 0 HB3 ASP A 61C 40.109 23.514 21.475 1.00 58.90 H new ATOM 350 N GLY A 62 41.644 20.395 22.852 1.00 49.59 N ATOM 351 CA GLY A 62 41.906 19.701 24.100 1.00 44.82 C ATOM 352 C GLY A 62 43.038 18.697 23.974 1.00 41.18 C ATOM 353 O GLY A 62 43.425 18.301 22.870 1.00 41.41 O ATOM 0 H GLY A 62 42.336 20.523 22.357 1.00 49.59 H new ATOM 0 HA2 GLY A 62 42.126 20.349 24.788 1.00 44.82 H new ATOM 0 HA3 GLY A 62 41.101 19.243 24.388 1.00 44.82 H new ATOM 354 N LYS A 63 43.563 18.277 25.120 1.00 37.47 N ATOM 355 CA LYS A 63 44.673 17.331 25.186 1.00 34.06 C ATOM 356 C LYS A 63 44.168 15.911 25.302 1.00 31.40 C ATOM 357 O LYS A 63 43.360 15.628 26.169 1.00 31.92 O ATOM 358 CB LYS A 63 45.543 17.641 26.406 1.00 34.16 C ATOM 359 CG LYS A 63 46.381 16.465 26.911 1.00 34.74 C ATOM 360 CD LYS A 63 47.865 16.820 26.895 1.00 35.20 C ATOM 361 CE LYS A 63 48.639 16.225 28.071 1.00 35.14 C ATOM 362 NZ LYS A 63 48.557 17.020 29.341 1.00 36.32 N ATOM 0 H LYS A 63 43.282 18.536 25.890 1.00 37.47 H new ATOM 0 HA LYS A 63 45.191 17.418 24.370 1.00 34.06 H new ATOM 0 HB2 LYS A 63 46.138 18.375 26.185 1.00 34.16 H new ATOM 0 HB3 LYS A 63 44.970 17.947 27.127 1.00 34.16 H new ATOM 0 HG2 LYS A 63 46.109 16.230 27.812 1.00 34.74 H new ATOM 0 HG3 LYS A 63 46.223 15.686 26.355 1.00 34.74 H new ATOM 0 HD2 LYS A 63 48.258 16.507 26.065 1.00 35.20 H new ATOM 0 HD3 LYS A 63 47.961 17.785 26.907 1.00 35.20 H new ATOM 0 HE2 LYS A 63 48.306 15.330 28.242 1.00 35.14 H new ATOM 0 HE3 LYS A 63 49.571 16.138 27.818 1.00 35.14 H new ATOM 0 HZ1 LYS A 63 49.029 16.614 29.977 1.00 36.32 H new ATOM 0 HZ2 LYS A 63 48.886 17.835 29.203 1.00 36.32 H new ATOM 0 HZ3 LYS A 63 47.707 17.083 29.598 1.00 36.32 H new ATOM 363 N VAL A 64 44.671 15.022 24.447 1.00 28.94 N ATOM 364 CA VAL A 64 44.269 13.621 24.447 1.00 25.77 C ATOM 365 C VAL A 64 45.271 12.743 25.195 1.00 24.58 C ATOM 366 O VAL A 64 46.479 12.758 24.911 1.00 25.71 O ATOM 367 CB VAL A 64 44.083 13.084 22.987 1.00 24.58 C ATOM 368 CG1 VAL A 64 43.702 11.619 22.983 1.00 23.68 C ATOM 369 CG2 VAL A 64 42.991 13.849 22.303 1.00 24.34 C ATOM 0 H VAL A 64 45.257 15.218 23.849 1.00 28.94 H new ATOM 0 HA VAL A 64 43.418 13.575 24.910 1.00 25.77 H new ATOM 0 HB VAL A 64 44.928 13.196 22.524 1.00 24.58 H new ATOM 0 HG11 VAL A 64 43.594 11.315 22.068 1.00 23.68 H new ATOM 0 HG12 VAL A 64 44.400 11.102 23.415 1.00 23.68 H new ATOM 0 HG13 VAL A 64 42.868 11.500 23.463 1.00 23.68 H new ATOM 0 HG21 VAL A 64 42.878 13.514 21.400 1.00 24.34 H new ATOM 0 HG22 VAL A 64 42.162 13.739 22.794 1.00 24.34 H new ATOM 0 HG23 VAL A 64 43.225 14.790 22.272 1.00 24.34 H new ATOM 370 N GLN A 65 44.751 11.980 26.150 1.00 21.00 N ATOM 371 CA GLN A 65 45.534 11.070 26.967 1.00 19.42 C ATOM 372 C GLN A 65 44.780 9.764 27.051 1.00 16.91 C ATOM 373 O GLN A 65 43.604 9.701 26.729 1.00 15.76 O ATOM 374 CB GLN A 65 45.704 11.630 28.392 1.00 21.24 C ATOM 375 CG GLN A 65 46.590 12.868 28.500 1.00 24.37 C ATOM 376 CD GLN A 65 46.556 13.480 29.884 1.00 25.74 C ATOM 377 OE1 GLN A 65 45.522 13.980 30.338 1.00 26.54 O ATOM 378 NE2 GLN A 65 47.686 13.456 30.557 1.00 25.36 N ATOM 0 H GLN A 65 43.913 11.979 26.343 1.00 21.00 H new ATOM 0 HA GLN A 65 46.412 10.951 26.572 1.00 19.42 H new ATOM 0 HB2 GLN A 65 44.827 11.845 28.747 1.00 21.24 H new ATOM 0 HB3 GLN A 65 46.075 10.934 28.956 1.00 21.24 H new ATOM 0 HG2 GLN A 65 47.503 12.630 28.276 1.00 24.37 H new ATOM 0 HG3 GLN A 65 46.301 13.527 27.850 1.00 24.37 H new ATOM 0 HE21 GLN A 65 48.387 13.099 30.209 1.00 25.36 H new ATOM 0 HE22 GLN A 65 47.724 13.797 31.345 1.00 25.36 H new ATOM 379 N VAL A 66 45.447 8.709 27.476 1.00 15.19 N ATOM 380 CA VAL A 66 44.763 7.460 27.618 1.00 15.75 C ATOM 381 C VAL A 66 45.082 6.843 28.956 1.00 15.75 C ATOM 382 O VAL A 66 46.220 6.807 29.413 1.00 14.92 O ATOM 383 CB VAL A 66 45.045 6.493 26.437 1.00 15.60 C ATOM 384 CG1 VAL A 66 46.076 7.063 25.556 1.00 16.22 C ATOM 385 CG2 VAL A 66 45.445 5.123 26.929 1.00 15.35 C ATOM 0 H VAL A 66 46.282 8.701 27.683 1.00 15.19 H new ATOM 0 HA VAL A 66 43.809 7.635 27.588 1.00 15.75 H new ATOM 0 HB VAL A 66 44.226 6.386 25.928 1.00 15.60 H new ATOM 0 HG11 VAL A 66 46.247 6.454 24.821 1.00 16.22 H new ATOM 0 HG12 VAL A 66 45.768 7.914 25.206 1.00 16.22 H new ATOM 0 HG13 VAL A 66 46.894 7.198 26.060 1.00 16.22 H new ATOM 0 HG21 VAL A 66 45.614 4.543 26.170 1.00 15.35 H new ATOM 0 HG22 VAL A 66 46.249 5.194 27.467 1.00 15.35 H new ATOM 0 HG23 VAL A 66 44.729 4.750 27.467 1.00 15.35 H new ATOM 386 N LEU A 67 44.023 6.371 29.591 1.00 16.03 N ATOM 387 CA LEU A 67 44.127 5.770 30.902 1.00 14.71 C ATOM 388 C LEU A 67 44.078 4.250 30.810 1.00 14.32 C ATOM 389 O LEU A 67 43.126 3.697 30.265 1.00 13.83 O ATOM 390 CB LEU A 67 42.997 6.321 31.783 1.00 11.86 C ATOM 391 CG LEU A 67 42.886 5.741 33.196 1.00 12.12 C ATOM 392 CD1 LEU A 67 44.078 6.225 34.019 1.00 10.37 C ATOM 393 CD2 LEU A 67 41.551 6.137 33.843 1.00 8.59 C ATOM 0 H LEU A 67 43.224 6.391 29.272 1.00 16.03 H new ATOM 0 HA LEU A 67 44.981 5.997 31.302 1.00 14.71 H new ATOM 0 HB2 LEU A 67 43.111 7.281 31.857 1.00 11.86 H new ATOM 0 HB3 LEU A 67 42.155 6.170 31.326 1.00 11.86 H new ATOM 0 HG LEU A 67 42.903 4.772 33.158 1.00 12.12 H new ATOM 0 HD11 LEU A 67 44.019 5.864 34.917 1.00 10.37 H new ATOM 0 HD12 LEU A 67 44.902 5.925 33.604 1.00 10.37 H new ATOM 0 HD13 LEU A 67 44.071 7.194 34.059 1.00 10.37 H new ATOM 0 HD21 LEU A 67 41.500 5.761 34.736 1.00 8.59 H new ATOM 0 HD22 LEU A 67 41.491 7.104 33.896 1.00 8.59 H new ATOM 0 HD23 LEU A 67 40.818 5.797 33.307 1.00 8.59 H new ATOM 394 N LEU A 68 45.120 3.598 31.346 1.00 14.19 N ATOM 395 CA LEU A 68 45.255 2.139 31.352 1.00 13.75 C ATOM 396 C LEU A 68 45.374 1.606 32.753 1.00 13.84 C ATOM 397 O LEU A 68 45.764 2.328 33.649 1.00 14.23 O ATOM 398 CB LEU A 68 46.510 1.733 30.603 1.00 13.85 C ATOM 399 CG LEU A 68 46.545 1.971 29.101 1.00 13.76 C ATOM 400 CD1 LEU A 68 47.964 1.749 28.640 1.00 14.23 C ATOM 401 CD2 LEU A 68 45.618 1.007 28.378 1.00 12.17 C ATOM 0 H LEU A 68 45.779 4.003 31.723 1.00 14.19 H new ATOM 0 HA LEU A 68 44.461 1.775 30.929 1.00 13.75 H new ATOM 0 HB2 LEU A 68 47.259 2.206 30.998 1.00 13.85 H new ATOM 0 HB3 LEU A 68 46.658 0.787 30.759 1.00 13.85 H new ATOM 0 HG LEU A 68 46.249 2.873 28.903 1.00 13.76 H new ATOM 0 HD11 LEU A 68 48.020 1.894 27.682 1.00 14.23 H new ATOM 0 HD12 LEU A 68 48.553 2.370 29.095 1.00 14.23 H new ATOM 0 HD13 LEU A 68 48.233 0.840 28.845 1.00 14.23 H new ATOM 0 HD21 LEU A 68 45.656 1.176 27.424 1.00 12.17 H new ATOM 0 HD22 LEU A 68 45.897 0.095 28.556 1.00 12.17 H new ATOM 0 HD23 LEU A 68 44.709 1.134 28.693 1.00 12.17 H new ATOM 402 N GLY A 69 45.081 0.330 32.933 1.00 12.70 N ATOM 403 CA GLY A 69 45.155 -0.273 34.252 1.00 12.74 C ATOM 404 C GLY A 69 44.049 0.174 35.199 1.00 12.44 C ATOM 405 O GLY A 69 44.128 -0.089 36.389 1.00 14.10 O ATOM 0 H GLY A 69 44.837 -0.205 32.305 1.00 12.70 H new ATOM 0 HA2 GLY A 69 45.119 -1.238 34.159 1.00 12.74 H new ATOM 0 HA3 GLY A 69 46.014 -0.058 34.648 1.00 12.74 H new ATOM 406 N ALA A 70 43.017 0.831 34.686 1.00 12.33 N ATOM 407 CA ALA A 70 41.929 1.335 35.535 1.00 13.21 C ATOM 408 C ALA A 70 40.670 0.489 35.617 1.00 14.03 C ATOM 409 O ALA A 70 40.448 -0.415 34.818 1.00 13.54 O ATOM 410 CB ALA A 70 41.534 2.740 35.084 1.00 12.27 C ATOM 0 H ALA A 70 42.922 0.999 33.848 1.00 12.33 H new ATOM 0 HA ALA A 70 42.307 1.313 36.428 1.00 13.21 H new ATOM 0 HB1 ALA A 70 40.816 3.070 35.646 1.00 12.27 H new ATOM 0 HB2 ALA A 70 42.300 3.331 35.158 1.00 12.27 H new ATOM 0 HB3 ALA A 70 41.235 2.712 34.162 1.00 12.27 H new ATOM 411 N HIS A 71 39.865 0.801 36.634 1.00 15.12 N ATOM 412 CA HIS A 71 38.546 0.188 36.850 1.00 15.45 C ATOM 413 C HIS A 71 37.619 1.370 37.164 1.00 14.77 C ATOM 414 O HIS A 71 36.609 1.572 36.527 1.00 17.01 O ATOM 415 CB HIS A 71 38.539 -0.829 37.993 1.00 14.16 C ATOM 416 CG HIS A 71 37.239 -1.561 38.120 1.00 16.11 C ATOM 417 ND1 HIS A 71 36.616 -2.423 37.279 1.00 17.49 N flip ATOM 418 CD2 HIS A 71 36.357 -1.335 39.157 1.00 16.02 C flip ATOM 419 CE1 HIS A 71 35.378 -2.689 37.813 1.00 16.63 C flip ATOM 420 NE2 HIS A 71 35.246 -2.021 38.946 1.00 16.58 N flip ATOM 0 H HIS A 71 40.072 1.385 37.230 1.00 15.12 H new ATOM 0 HA HIS A 71 38.267 -0.318 36.071 1.00 15.45 H new ATOM 0 HB2 HIS A 71 39.253 -1.471 37.852 1.00 14.16 H new ATOM 0 HB3 HIS A 71 38.729 -0.372 38.827 1.00 14.16 H new ATOM 0 HD2 HIS A 71 36.519 -0.786 39.890 1.00 16.02 H new ATOM 0 HE1 HIS A 71 34.737 -3.248 37.438 1.00 16.63 H new ATOM 0 HE2 HIS A 71 34.555 -2.031 39.459 1.00 16.58 H new ATOM 421 N SER A 72 37.993 2.167 38.151 1.00 15.31 N ATOM 422 CA SER A 72 37.243 3.356 38.538 1.00 14.38 C ATOM 423 C SER A 72 37.999 4.534 37.902 1.00 14.19 C ATOM 424 O SER A 72 39.224 4.572 37.932 1.00 14.04 O ATOM 425 CB SER A 72 37.240 3.450 40.068 1.00 14.97 C ATOM 426 OG SER A 72 37.159 4.784 40.547 1.00 15.56 O ATOM 0 H SER A 72 38.699 2.033 38.623 1.00 15.31 H new ATOM 0 HA SER A 72 36.319 3.345 38.244 1.00 14.38 H new ATOM 0 HB2 SER A 72 36.491 2.942 40.416 1.00 14.97 H new ATOM 0 HB3 SER A 72 38.047 3.037 40.413 1.00 14.97 H new ATOM 0 HG SER A 72 36.353 4.994 40.657 1.00 15.56 H new ATOM 427 N LEU A 73 37.283 5.468 37.294 1.00 14.62 N ATOM 428 CA LEU A 73 37.914 6.623 36.678 1.00 16.23 C ATOM 429 C LEU A 73 38.347 7.698 37.675 1.00 18.81 C ATOM 430 O LEU A 73 39.190 8.529 37.344 1.00 20.62 O ATOM 431 CB LEU A 73 36.948 7.283 35.704 1.00 13.10 C ATOM 432 CG LEU A 73 36.475 6.498 34.494 1.00 13.26 C ATOM 433 CD1 LEU A 73 35.230 7.198 33.952 1.00 8.71 C ATOM 434 CD2 LEU A 73 37.579 6.416 33.436 1.00 9.45 C ATOM 0 H LEU A 73 36.426 5.451 37.227 1.00 14.62 H new ATOM 0 HA LEU A 73 38.707 6.278 36.238 1.00 16.23 H new ATOM 0 HB2 LEU A 73 36.162 7.550 36.206 1.00 13.10 H new ATOM 0 HB3 LEU A 73 37.367 8.096 35.381 1.00 13.10 H new ATOM 0 HG LEU A 73 36.259 5.585 34.740 1.00 13.26 H new ATOM 0 HD11 LEU A 73 34.902 6.719 33.175 1.00 8.71 H new ATOM 0 HD12 LEU A 73 34.543 7.213 34.637 1.00 8.71 H new ATOM 0 HD13 LEU A 73 35.454 8.107 33.700 1.00 8.71 H new ATOM 0 HD21 LEU A 73 37.258 5.912 32.672 1.00 9.45 H new ATOM 0 HD22 LEU A 73 37.823 7.311 33.153 1.00 9.45 H new ATOM 0 HD23 LEU A 73 38.356 5.973 33.812 1.00 9.45 H new ATOM 435 N SER A 74 37.764 7.696 38.877 1.00 20.01 N ATOM 436 CA SER A 74 38.075 8.719 39.885 1.00 20.81 C ATOM 437 C SER A 74 38.950 8.303 41.064 1.00 21.20 C ATOM 438 O SER A 74 39.636 9.124 41.657 1.00 21.59 O ATOM 439 CB SER A 74 36.768 9.333 40.424 1.00 19.37 C ATOM 440 OG SER A 74 36.085 8.467 41.319 1.00 18.52 O ATOM 0 H SER A 74 37.186 7.112 39.130 1.00 20.01 H new ATOM 0 HA SER A 74 38.619 9.357 39.397 1.00 20.81 H new ATOM 0 HB2 SER A 74 36.969 10.167 40.877 1.00 19.37 H new ATOM 0 HB3 SER A 74 36.185 9.548 39.679 1.00 19.37 H new ATOM 0 HG SER A 74 35.725 7.844 40.886 1.00 18.52 H new ATOM 441 N GLN A 75 38.946 7.023 41.383 1.00 22.49 N ATOM 442 CA GLN A 75 39.715 6.562 42.520 1.00 25.27 C ATOM 443 C GLN A 75 41.106 6.047 42.189 1.00 25.63 C ATOM 444 O GLN A 75 41.324 5.495 41.103 1.00 24.97 O ATOM 445 CB GLN A 75 38.941 5.459 43.251 1.00 26.75 C ATOM 446 CG GLN A 75 37.677 5.935 43.998 1.00 32.55 C ATOM 447 CD GLN A 75 37.230 4.950 45.067 1.00 35.14 C ATOM 448 OE1 GLN A 75 37.610 3.685 44.890 1.00 35.07 O flip ATOM 449 NE2 GLN A 75 36.556 5.322 46.047 1.00 35.38 N flip ATOM 0 H GLN A 75 38.512 6.412 40.961 1.00 22.49 H new ATOM 0 HA GLN A 75 39.843 7.346 43.077 1.00 25.27 H new ATOM 0 HB2 GLN A 75 38.683 4.782 42.606 1.00 26.75 H new ATOM 0 HB3 GLN A 75 39.536 5.033 43.888 1.00 26.75 H new ATOM 0 HG2 GLN A 75 37.852 6.796 44.408 1.00 32.55 H new ATOM 0 HG3 GLN A 75 36.957 6.065 43.361 1.00 32.55 H new ATOM 0 HE21 GLN A 75 36.331 6.148 46.125 1.00 35.38 H new ATOM 0 HE22 GLN A 75 36.316 4.752 46.645 1.00 35.38 H new ATOM 450 N PRO A 76 42.079 6.245 43.115 1.00 25.06 N ATOM 451 CA PRO A 76 43.469 5.802 42.979 1.00 24.63 C ATOM 452 C PRO A 76 43.542 4.281 42.946 1.00 24.55 C ATOM 453 O PRO A 76 42.872 3.609 43.729 1.00 25.95 O ATOM 454 CB PRO A 76 44.161 6.348 44.232 1.00 24.26 C ATOM 455 CG PRO A 76 43.338 7.491 44.639 1.00 23.94 C ATOM 456 CD PRO A 76 41.920 7.037 44.351 1.00 24.25 C ATOM 0 HA PRO A 76 43.883 6.115 42.160 1.00 24.63 H new ATOM 0 HB2 PRO A 76 44.205 5.678 44.932 1.00 24.26 H new ATOM 0 HB3 PRO A 76 45.073 6.619 44.042 1.00 24.26 H new ATOM 0 HG2 PRO A 76 43.461 7.701 45.578 1.00 23.94 H new ATOM 0 HG3 PRO A 76 43.565 8.290 44.137 1.00 23.94 H new ATOM 0 HD2 PRO A 76 41.558 6.505 45.076 1.00 24.25 H new ATOM 0 HD3 PRO A 76 41.320 7.788 44.223 1.00 24.25 H new ATOM 457 N GLU A 77 44.343 3.766 42.029 1.00 23.33 N ATOM 458 CA GLU A 77 44.562 2.336 41.887 1.00 23.86 C ATOM 459 C GLU A 77 46.033 2.178 41.473 1.00 23.21 C ATOM 460 O GLU A 77 46.507 2.878 40.594 1.00 23.49 O ATOM 461 CB GLU A 77 43.633 1.740 40.846 1.00 24.72 C ATOM 462 CG GLU A 77 42.188 1.904 41.243 1.00 24.44 C ATOM 463 CD GLU A 77 41.238 1.627 40.116 1.00 25.58 C ATOM 464 OE1 GLU A 77 41.660 1.710 38.937 1.00 25.46 O ATOM 465 OE2 GLU A 77 40.064 1.322 40.420 1.00 25.82 O ATOM 0 H GLU A 77 44.781 4.243 41.463 1.00 23.33 H new ATOM 0 HA GLU A 77 44.374 1.865 42.714 1.00 23.86 H new ATOM 0 HB2 GLU A 77 43.786 2.169 39.990 1.00 24.72 H new ATOM 0 HB3 GLU A 77 43.834 0.798 40.731 1.00 24.72 H new ATOM 0 HG2 GLU A 77 41.990 1.306 41.981 1.00 24.44 H new ATOM 0 HG3 GLU A 77 42.046 2.808 41.565 1.00 24.44 H new ATOM 466 N PRO A 78 46.760 1.265 42.128 1.00 23.97 N ATOM 467 CA PRO A 78 48.174 0.998 41.859 1.00 23.50 C ATOM 468 C PRO A 78 48.515 0.783 40.372 1.00 23.61 C ATOM 469 O PRO A 78 49.544 1.239 39.889 1.00 23.91 O ATOM 470 CB PRO A 78 48.490 -0.243 42.665 1.00 23.16 C ATOM 471 CG PRO A 78 47.435 -0.309 43.706 1.00 24.32 C ATOM 472 CD PRO A 78 46.229 0.400 43.188 1.00 23.59 C ATOM 0 HA PRO A 78 48.706 1.770 42.106 1.00 23.50 H new ATOM 0 HB2 PRO A 78 48.481 -1.036 42.106 1.00 23.16 H new ATOM 0 HB3 PRO A 78 49.373 -0.187 43.063 1.00 23.16 H new ATOM 0 HG2 PRO A 78 47.222 -1.232 43.914 1.00 24.32 H new ATOM 0 HG3 PRO A 78 47.744 0.103 44.528 1.00 24.32 H new ATOM 0 HD2 PRO A 78 45.571 -0.223 42.843 1.00 23.59 H new ATOM 0 HD3 PRO A 78 45.793 0.916 43.884 1.00 23.59 H new ATOM 473 N SER A 79 47.640 0.068 39.679 1.00 21.99 N ATOM 474 CA SER A 79 47.879 -0.227 38.271 1.00 20.99 C ATOM 475 C SER A 79 47.488 0.914 37.363 1.00 20.89 C ATOM 476 O SER A 79 47.866 0.930 36.206 1.00 21.42 O ATOM 477 CB SER A 79 47.057 -1.438 37.892 1.00 19.94 C ATOM 478 OG SER A 79 45.711 -1.141 38.173 1.00 22.45 O ATOM 0 H SER A 79 46.909 -0.253 39.999 1.00 21.99 H new ATOM 0 HA SER A 79 48.830 -0.382 38.159 1.00 20.99 H new ATOM 0 HB2 SER A 79 47.171 -1.647 36.952 1.00 19.94 H new ATOM 0 HB3 SER A 79 47.346 -2.217 38.393 1.00 19.94 H new ATOM 0 HG SER A 79 45.349 -0.808 37.492 1.00 22.45 H new ATOM 479 N LYS A 80 46.740 1.881 37.869 1.00 20.57 N ATOM 480 CA LYS A 80 46.322 3.000 37.034 1.00 20.01 C ATOM 481 C LYS A 80 47.463 3.867 36.508 1.00 20.75 C ATOM 482 O LYS A 80 48.400 4.199 37.230 1.00 21.27 O ATOM 483 CB LYS A 80 45.347 3.877 37.796 1.00 19.17 C ATOM 484 CG LYS A 80 44.064 4.079 37.064 1.00 20.95 C ATOM 485 CD LYS A 80 42.928 4.323 38.040 1.00 19.58 C ATOM 486 CE LYS A 80 42.639 5.801 38.175 1.00 19.02 C ATOM 487 NZ LYS A 80 41.288 5.999 38.738 1.00 20.28 N ATOM 0 H LYS A 80 46.465 1.911 38.683 1.00 20.57 H new ATOM 0 HA LYS A 80 45.905 2.597 36.256 1.00 20.01 H new ATOM 0 HB2 LYS A 80 45.163 3.475 38.660 1.00 19.17 H new ATOM 0 HB3 LYS A 80 45.758 4.739 37.966 1.00 19.17 H new ATOM 0 HG2 LYS A 80 44.146 4.833 36.459 1.00 20.95 H new ATOM 0 HG3 LYS A 80 43.869 3.299 36.521 1.00 20.95 H new ATOM 0 HD2 LYS A 80 42.131 3.860 37.737 1.00 19.58 H new ATOM 0 HD3 LYS A 80 43.157 3.954 38.907 1.00 19.58 H new ATOM 0 HE2 LYS A 80 43.301 6.217 38.749 1.00 19.02 H new ATOM 0 HE3 LYS A 80 42.703 6.232 37.308 1.00 19.02 H new ATOM 0 HZ1 LYS A 80 41.089 6.866 38.734 1.00 20.28 H new ATOM 0 HZ2 LYS A 80 40.693 5.556 38.246 1.00 20.28 H new ATOM 0 HZ3 LYS A 80 41.267 5.694 39.574 1.00 20.28 H new ATOM 488 N ARG A 81 47.375 4.256 35.243 1.00 21.09 N ATOM 489 CA ARG A 81 48.419 5.083 34.642 1.00 21.06 C ATOM 490 C ARG A 81 47.884 5.925 33.492 1.00 18.28 C ATOM 491 O ARG A 81 47.193 5.420 32.621 1.00 17.30 O ATOM 492 CB ARG A 81 49.549 4.185 34.137 1.00 24.01 C ATOM 493 CG ARG A 81 50.902 4.502 34.740 1.00 28.10 C ATOM 494 CD ARG A 81 51.540 5.648 33.991 1.00 32.49 C ATOM 495 NE ARG A 81 52.879 5.316 33.497 1.00 37.46 N ATOM 496 CZ ARG A 81 53.678 6.182 32.871 1.00 38.89 C ATOM 497 NH1 ARG A 81 53.279 7.435 32.656 1.00 38.23 N ATOM 498 NH2 ARG A 81 54.883 5.792 32.456 1.00 40.61 N ATOM 0 H ARG A 81 46.725 4.055 34.717 1.00 21.09 H new ATOM 0 HA ARG A 81 48.749 5.689 35.323 1.00 21.06 H new ATOM 0 HB2 ARG A 81 49.327 3.261 34.331 1.00 24.01 H new ATOM 0 HB3 ARG A 81 49.608 4.266 33.172 1.00 24.01 H new ATOM 0 HG2 ARG A 81 50.802 4.733 35.677 1.00 28.10 H new ATOM 0 HG3 ARG A 81 51.474 3.720 34.700 1.00 28.10 H new ATOM 0 HD2 ARG A 81 50.975 5.897 33.243 1.00 32.49 H new ATOM 0 HD3 ARG A 81 51.596 6.421 34.574 1.00 32.49 H new ATOM 0 HE ARG A 81 53.167 4.515 33.618 1.00 37.46 H new ATOM 0 HH11 ARG A 81 52.502 7.690 32.921 1.00 38.23 H new ATOM 0 HH12 ARG A 81 53.799 7.988 32.252 1.00 38.23 H new ATOM 0 HH21 ARG A 81 55.144 4.984 32.592 1.00 40.61 H new ATOM 0 HH22 ARG A 81 55.400 6.348 32.052 1.00 40.61 H new ATOM 499 N LEU A 82 48.207 7.209 33.478 1.00 15.69 N ATOM 500 CA LEU A 82 47.739 8.057 32.405 1.00 16.30 C ATOM 501 C LEU A 82 48.898 8.189 31.443 1.00 16.92 C ATOM 502 O LEU A 82 49.997 8.499 31.852 1.00 17.48 O ATOM 503 CB LEU A 82 47.373 9.436 32.928 1.00 14.83 C ATOM 504 CG LEU A 82 45.941 9.967 32.935 1.00 16.00 C ATOM 505 CD1 LEU A 82 46.016 11.460 33.119 1.00 16.74 C ATOM 506 CD2 LEU A 82 45.221 9.668 31.645 1.00 16.45 C ATOM 0 H LEU A 82 48.689 7.601 34.072 1.00 15.69 H new ATOM 0 HA LEU A 82 46.950 7.678 31.987 1.00 16.30 H new ATOM 0 HB2 LEU A 82 47.686 9.475 33.845 1.00 14.83 H new ATOM 0 HB3 LEU A 82 47.901 10.072 32.421 1.00 14.83 H new ATOM 0 HG LEU A 82 45.447 9.536 33.650 1.00 16.00 H new ATOM 0 HD11 LEU A 82 45.120 11.831 33.128 1.00 16.74 H new ATOM 0 HD12 LEU A 82 46.457 11.661 33.959 1.00 16.74 H new ATOM 0 HD13 LEU A 82 46.520 11.851 32.388 1.00 16.74 H new ATOM 0 HD21 LEU A 82 44.318 10.020 31.689 1.00 16.45 H new ATOM 0 HD22 LEU A 82 45.694 10.083 30.907 1.00 16.45 H new ATOM 0 HD23 LEU A 82 45.187 8.708 31.508 1.00 16.45 H new ATOM 507 N TYR A 83 48.654 7.946 30.167 1.00 17.17 N ATOM 508 CA TYR A 83 49.690 8.048 29.158 1.00 16.81 C ATOM 509 C TYR A 83 49.376 9.208 28.236 1.00 16.86 C ATOM 510 O TYR A 83 48.228 9.476 27.958 1.00 15.37 O ATOM 511 CB TYR A 83 49.754 6.754 28.353 1.00 17.34 C ATOM 512 CG TYR A 83 50.436 5.630 29.087 1.00 17.26 C ATOM 513 CD1 TYR A 83 51.819 5.458 28.999 1.00 16.92 C ATOM 514 CD2 TYR A 83 49.713 4.759 29.892 1.00 16.31 C ATOM 515 CE1 TYR A 83 52.469 4.450 29.700 1.00 16.95 C ATOM 516 CE2 TYR A 83 50.358 3.740 30.605 1.00 17.61 C ATOM 517 CZ TYR A 83 51.740 3.600 30.500 1.00 17.25 C ATOM 518 OH TYR A 83 52.400 2.634 31.218 1.00 16.11 O ATOM 0 H TYR A 83 47.883 7.717 29.862 1.00 17.17 H new ATOM 0 HA TYR A 83 50.547 8.197 29.587 1.00 16.81 H new ATOM 0 HB2 TYR A 83 48.853 6.480 28.120 1.00 17.34 H new ATOM 0 HB3 TYR A 83 50.224 6.921 27.521 1.00 17.34 H new ATOM 0 HD1 TYR A 83 52.315 6.030 28.460 1.00 16.92 H new ATOM 0 HD2 TYR A 83 48.790 4.853 29.958 1.00 16.31 H new ATOM 0 HE1 TYR A 83 53.391 4.350 29.629 1.00 16.95 H new ATOM 0 HE2 TYR A 83 49.868 3.162 31.144 1.00 17.61 H new ATOM 0 HH TYR A 83 51.852 2.050 31.472 1.00 16.11 H new ATOM 519 N ASP A 84 50.389 9.936 27.797 1.00 17.70 N ATOM 520 CA ASP A 84 50.134 11.029 26.882 1.00 18.48 C ATOM 521 C ASP A 84 50.135 10.431 25.469 1.00 17.52 C ATOM 522 O ASP A 84 50.616 9.330 25.248 1.00 14.02 O ATOM 523 CB ASP A 84 51.228 12.076 26.978 1.00 21.90 C ATOM 524 CG ASP A 84 50.990 13.066 28.095 1.00 25.01 C ATOM 525 OD1 ASP A 84 50.077 13.911 27.971 1.00 23.83 O ATOM 526 OD2 ASP A 84 51.733 12.998 29.095 1.00 26.39 O ATOM 0 H ASP A 84 51.213 9.817 28.011 1.00 17.70 H new ATOM 0 HA ASP A 84 49.290 11.457 27.094 1.00 18.48 H new ATOM 0 HB2 ASP A 84 52.081 11.636 27.117 1.00 21.90 H new ATOM 0 HB3 ASP A 84 51.289 12.553 26.136 1.00 21.90 H new ATOM 527 N VAL A 85 49.616 11.169 24.508 1.00 17.57 N ATOM 528 CA VAL A 85 49.575 10.667 23.142 1.00 17.38 C ATOM 529 C VAL A 85 50.602 11.345 22.220 1.00 17.51 C ATOM 530 O VAL A 85 50.586 12.571 22.056 1.00 17.01 O ATOM 531 CB VAL A 85 48.162 10.880 22.585 1.00 16.99 C ATOM 532 CG1 VAL A 85 48.119 10.565 21.106 1.00 16.47 C ATOM 533 CG2 VAL A 85 47.188 10.036 23.378 1.00 17.53 C ATOM 0 H VAL A 85 49.285 11.955 24.618 1.00 17.57 H new ATOM 0 HA VAL A 85 49.805 9.725 23.167 1.00 17.38 H new ATOM 0 HB VAL A 85 47.906 11.811 22.678 1.00 16.99 H new ATOM 0 HG11 VAL A 85 47.219 10.705 20.771 1.00 16.47 H new ATOM 0 HG12 VAL A 85 48.734 11.147 20.633 1.00 16.47 H new ATOM 0 HG13 VAL A 85 48.376 9.640 20.964 1.00 16.47 H new ATOM 0 HG21 VAL A 85 46.291 10.165 23.032 1.00 17.53 H new ATOM 0 HG22 VAL A 85 47.433 9.101 23.301 1.00 17.53 H new ATOM 0 HG23 VAL A 85 47.215 10.301 24.311 1.00 17.53 H new ATOM 534 N LEU A 86 51.484 10.548 21.617 1.00 17.46 N ATOM 535 CA LEU A 86 52.494 11.065 20.689 1.00 19.62 C ATOM 536 C LEU A 86 51.881 11.459 19.321 1.00 20.32 C ATOM 537 O LEU A 86 52.127 12.544 18.800 1.00 20.46 O ATOM 538 CB LEU A 86 53.570 10.023 20.495 1.00 19.69 C ATOM 539 CG LEU A 86 54.879 10.478 19.870 1.00 21.01 C ATOM 540 CD1 LEU A 86 55.455 11.746 20.495 1.00 22.76 C ATOM 541 CD2 LEU A 86 55.810 9.334 20.081 1.00 22.51 C ATOM 0 H LEU A 86 51.515 9.696 21.733 1.00 17.46 H new ATOM 0 HA LEU A 86 52.874 11.870 21.075 1.00 19.62 H new ATOM 0 HB2 LEU A 86 53.770 9.634 21.361 1.00 19.69 H new ATOM 0 HB3 LEU A 86 53.205 9.314 19.943 1.00 19.69 H new ATOM 0 HG LEU A 86 54.742 10.707 18.937 1.00 21.01 H new ATOM 0 HD11 LEU A 86 56.285 11.978 20.050 1.00 22.76 H new ATOM 0 HD12 LEU A 86 54.821 12.473 20.394 1.00 22.76 H new ATOM 0 HD13 LEU A 86 55.625 11.594 21.438 1.00 22.76 H new ATOM 0 HD21 LEU A 86 56.678 9.549 19.705 1.00 22.51 H new ATOM 0 HD22 LEU A 86 55.903 9.163 21.031 1.00 22.51 H new ATOM 0 HD23 LEU A 86 55.456 8.544 19.644 1.00 22.51 H new ATOM 542 N ARG A 87 51.081 10.577 18.744 1.00 19.74 N ATOM 543 CA ARG A 87 50.409 10.867 17.483 1.00 20.62 C ATOM 544 C ARG A 87 49.050 10.141 17.405 1.00 19.99 C ATOM 545 O ARG A 87 48.832 9.112 18.042 1.00 18.90 O ATOM 546 CB ARG A 87 51.284 10.460 16.305 1.00 22.72 C ATOM 547 CG ARG A 87 51.542 9.007 16.230 1.00 28.38 C ATOM 548 CD ARG A 87 52.400 8.740 15.046 1.00 33.99 C ATOM 549 NE ARG A 87 53.571 9.602 15.050 1.00 41.68 N ATOM 550 CZ ARG A 87 54.718 9.277 14.459 1.00 46.00 C ATOM 551 NH1 ARG A 87 54.817 8.107 13.820 1.00 49.29 N ATOM 552 NH2 ARG A 87 55.765 10.105 14.495 1.00 47.56 N ATOM 0 H ARG A 87 50.911 9.798 19.067 1.00 19.74 H new ATOM 0 HA ARG A 87 50.251 11.823 17.441 1.00 20.62 H new ATOM 0 HB2 ARG A 87 50.859 10.748 15.482 1.00 22.72 H new ATOM 0 HB3 ARG A 87 52.131 10.928 16.365 1.00 22.72 H new ATOM 0 HG2 ARG A 87 51.980 8.700 17.039 1.00 28.38 H new ATOM 0 HG3 ARG A 87 50.706 8.520 16.157 1.00 28.38 H new ATOM 0 HD2 ARG A 87 52.678 7.811 15.046 1.00 33.99 H new ATOM 0 HD3 ARG A 87 51.890 8.884 14.233 1.00 33.99 H new ATOM 0 HE ARG A 87 53.520 10.359 15.454 1.00 41.68 H new ATOM 0 HH11 ARG A 87 54.143 7.573 13.794 1.00 49.29 H new ATOM 0 HH12 ARG A 87 55.554 7.888 13.435 1.00 49.29 H new ATOM 0 HH21 ARG A 87 55.703 10.859 14.904 1.00 47.56 H new ATOM 0 HH22 ARG A 87 56.501 9.884 14.109 1.00 47.56 H new ATOM 553 N ALA A 88 48.128 10.699 16.636 1.00 18.78 N ATOM 554 CA ALA A 88 46.831 10.102 16.477 1.00 17.31 C ATOM 555 C ALA A 88 46.716 9.856 14.999 1.00 17.96 C ATOM 556 O ALA A 88 46.822 10.779 14.204 1.00 18.63 O ATOM 557 CB ALA A 88 45.784 11.044 16.925 1.00 15.72 C ATOM 0 H ALA A 88 48.242 11.430 16.197 1.00 18.78 H new ATOM 0 HA ALA A 88 46.723 9.290 16.997 1.00 17.31 H new ATOM 0 HB1 ALA A 88 44.912 10.635 16.815 1.00 15.72 H new ATOM 0 HB2 ALA A 88 45.923 11.262 17.860 1.00 15.72 H new ATOM 0 HB3 ALA A 88 45.829 11.855 16.395 1.00 15.72 H new ATOM 558 N VAL A 89 46.510 8.600 14.633 1.00 17.72 N ATOM 559 CA VAL A 89 46.392 8.210 13.236 1.00 17.07 C ATOM 560 C VAL A 89 44.991 7.670 12.908 1.00 16.49 C ATOM 561 O VAL A 89 44.688 6.507 13.172 1.00 16.27 O ATOM 562 CB VAL A 89 47.431 7.105 12.868 1.00 17.75 C ATOM 563 CG1 VAL A 89 47.622 7.076 11.384 1.00 16.88 C ATOM 564 CG2 VAL A 89 48.790 7.348 13.577 1.00 17.99 C ATOM 0 H VAL A 89 46.434 7.948 15.188 1.00 17.72 H new ATOM 0 HA VAL A 89 46.559 9.013 12.718 1.00 17.07 H new ATOM 0 HB VAL A 89 47.089 6.249 13.171 1.00 17.75 H new ATOM 0 HG11 VAL A 89 48.268 6.390 11.154 1.00 16.88 H new ATOM 0 HG12 VAL A 89 46.776 6.881 10.952 1.00 16.88 H new ATOM 0 HG13 VAL A 89 47.947 7.939 11.082 1.00 16.88 H new ATOM 0 HG21 VAL A 89 49.414 6.648 13.330 1.00 17.99 H new ATOM 0 HG22 VAL A 89 49.147 8.208 13.307 1.00 17.99 H new ATOM 0 HG23 VAL A 89 48.660 7.340 14.538 1.00 17.99 H new ATOM 565 N PRO A 90 44.120 8.511 12.335 1.00 14.82 N ATOM 566 CA PRO A 90 42.758 8.115 11.965 1.00 14.20 C ATOM 567 C PRO A 90 42.829 7.387 10.651 1.00 13.65 C ATOM 568 O PRO A 90 43.674 7.711 9.851 1.00 15.35 O ATOM 569 CB PRO A 90 42.048 9.423 11.773 1.00 14.51 C ATOM 570 CG PRO A 90 43.120 10.363 11.329 1.00 16.06 C ATOM 571 CD PRO A 90 44.396 9.915 11.989 1.00 17.17 C ATOM 0 HA PRO A 90 42.321 7.544 12.616 1.00 14.20 H new ATOM 0 HB2 PRO A 90 41.344 9.350 11.109 1.00 14.51 H new ATOM 0 HB3 PRO A 90 41.632 9.724 12.596 1.00 14.51 H new ATOM 0 HG2 PRO A 90 43.210 10.350 10.363 1.00 16.06 H new ATOM 0 HG3 PRO A 90 42.904 11.274 11.582 1.00 16.06 H new ATOM 0 HD2 PRO A 90 45.156 9.994 11.391 1.00 17.17 H new ATOM 0 HD3 PRO A 90 44.598 10.445 12.776 1.00 17.17 H new ATOM 572 N HIS A 91 41.975 6.416 10.407 1.00 12.80 N ATOM 573 CA HIS A 91 42.033 5.732 9.133 1.00 13.04 C ATOM 574 C HIS A 91 41.870 6.768 8.019 1.00 14.05 C ATOM 575 O HIS A 91 41.065 7.698 8.124 1.00 14.80 O ATOM 576 CB HIS A 91 40.912 4.682 9.022 1.00 11.58 C ATOM 577 CG HIS A 91 41.126 3.700 7.912 1.00 11.01 C ATOM 578 ND1 HIS A 91 40.957 4.035 6.583 1.00 11.58 N ATOM 579 CD2 HIS A 91 41.569 2.421 7.926 1.00 9.37 C ATOM 580 CE1 HIS A 91 41.294 3.006 5.828 1.00 9.05 C ATOM 581 NE2 HIS A 91 41.670 2.015 6.617 1.00 10.31 N ATOM 0 H HIS A 91 41.367 6.141 10.950 1.00 12.80 H new ATOM 0 HA HIS A 91 42.885 5.276 9.055 1.00 13.04 H new ATOM 0 HB2 HIS A 91 40.844 4.201 9.862 1.00 11.58 H new ATOM 0 HB3 HIS A 91 40.065 5.135 8.885 1.00 11.58 H new ATOM 0 HD2 HIS A 91 41.768 1.913 8.679 1.00 9.37 H new ATOM 0 HE1 HIS A 91 41.271 2.983 4.899 1.00 9.05 H new ATOM 0 HE2 HIS A 91 41.935 1.240 6.354 1.00 10.31 H new ATOM 582 N PRO A 92 42.668 6.647 6.940 1.00 14.93 N ATOM 583 CA PRO A 92 42.576 7.602 5.814 1.00 15.55 C ATOM 584 C PRO A 92 41.270 7.762 5.039 1.00 16.60 C ATOM 585 O PRO A 92 41.032 8.808 4.470 1.00 18.18 O ATOM 586 CB PRO A 92 43.725 7.167 4.899 1.00 15.11 C ATOM 587 CG PRO A 92 44.090 5.801 5.328 1.00 14.55 C ATOM 588 CD PRO A 92 43.754 5.679 6.767 1.00 14.15 C ATOM 0 HA PRO A 92 42.623 8.496 6.187 1.00 15.55 H new ATOM 0 HB2 PRO A 92 43.451 7.178 3.968 1.00 15.11 H new ATOM 0 HB3 PRO A 92 44.481 7.770 4.979 1.00 15.11 H new ATOM 0 HG2 PRO A 92 43.607 5.140 4.808 1.00 14.55 H new ATOM 0 HG3 PRO A 92 45.036 5.640 5.184 1.00 14.55 H new ATOM 0 HD2 PRO A 92 43.472 4.779 6.994 1.00 14.15 H new ATOM 0 HD3 PRO A 92 44.514 5.889 7.332 1.00 14.15 H new ATOM 589 N ASP A 93 40.427 6.738 4.985 1.00 17.61 N ATOM 590 CA ASP A 93 39.163 6.836 4.258 1.00 19.18 C ATOM 591 C ASP A 93 37.972 7.229 5.153 1.00 21.31 C ATOM 592 O ASP A 93 36.807 7.155 4.728 1.00 21.64 O ATOM 593 CB ASP A 93 38.852 5.497 3.590 1.00 17.63 C ATOM 594 CG ASP A 93 39.873 5.102 2.561 1.00 17.18 C ATOM 595 OD1 ASP A 93 40.174 5.926 1.684 1.00 17.26 O ATOM 596 OD2 ASP A 93 40.370 3.964 2.618 1.00 18.94 O ATOM 0 H ASP A 93 40.566 5.977 5.361 1.00 17.61 H new ATOM 0 HA ASP A 93 39.277 7.541 3.601 1.00 19.18 H new ATOM 0 HB2 ASP A 93 38.801 4.807 4.269 1.00 17.63 H new ATOM 0 HB3 ASP A 93 37.979 5.546 3.170 1.00 17.63 H new ATOM 597 N SER A 94 38.252 7.634 6.385 1.00 22.72 N ATOM 598 CA SER A 94 37.170 8.004 7.298 1.00 26.42 C ATOM 599 C SER A 94 36.684 9.424 7.038 1.00 28.20 C ATOM 600 O SER A 94 37.469 10.331 6.779 1.00 27.41 O ATOM 601 CB SER A 94 37.613 7.864 8.754 1.00 24.73 C ATOM 602 OG SER A 94 38.727 8.690 8.993 1.00 26.06 O ATOM 0 H SER A 94 39.045 7.702 6.711 1.00 22.72 H new ATOM 0 HA SER A 94 36.433 7.394 7.134 1.00 26.42 H new ATOM 0 HB2 SER A 94 36.885 8.108 9.347 1.00 24.73 H new ATOM 0 HB3 SER A 94 37.838 6.940 8.945 1.00 24.73 H new ATOM 0 HG SER A 94 39.422 8.313 8.710 1.00 26.06 H new ATOM 603 N GLN A 95 35.370 9.586 7.119 1.00 32.12 N ATOM 604 CA GLN A 95 34.733 10.855 6.859 1.00 35.48 C ATOM 605 C GLN A 95 33.885 11.278 8.054 1.00 36.79 C ATOM 606 O GLN A 95 33.190 10.453 8.666 1.00 37.51 O ATOM 607 CB GLN A 95 33.909 10.761 5.611 1.00 37.01 C ATOM 608 CG GLN A 95 34.675 11.182 4.356 1.00 40.12 C ATOM 609 CD GLN A 95 34.041 10.661 3.065 1.00 43.42 C ATOM 610 OE1 GLN A 95 34.673 9.903 2.331 1.00 44.96 O ATOM 611 NE2 GLN A 95 32.815 11.025 2.738 1.00 44.80 N ATOM 0 H GLN A 95 34.824 8.955 7.328 1.00 32.12 H new ATOM 0 HA GLN A 95 35.412 11.534 6.725 1.00 35.48 H new ATOM 0 HB2 GLN A 95 33.598 9.849 5.503 1.00 37.01 H new ATOM 0 HB3 GLN A 95 33.122 11.320 5.706 1.00 37.01 H new ATOM 0 HG2 GLN A 95 34.720 12.150 4.320 1.00 40.12 H new ATOM 0 HG3 GLN A 95 35.587 10.858 4.416 1.00 40.12 H new ATOM 0 HE21 GLN A 95 32.373 11.555 3.251 1.00 44.80 H new ATOM 0 HE22 GLN A 95 32.459 10.732 2.012 1.00 44.80 H new ATOM 612 N PRO A 96 33.890 12.566 8.414 1.00 38.47 N ATOM 613 CA PRO A 96 33.214 13.091 9.581 1.00 40.03 C ATOM 614 C PRO A 96 31.743 12.905 9.414 1.00 40.65 C ATOM 615 O PRO A 96 30.961 13.390 10.347 1.00 40.78 O ATOM 616 CB PRO A 96 33.619 14.540 9.598 1.00 39.86 C ATOM 617 CG PRO A 96 33.954 14.868 8.171 1.00 40.28 C ATOM 618 CD PRO A 96 34.507 13.602 7.582 1.00 39.33 C ATOM 0 HA PRO A 96 33.444 12.653 10.416 1.00 40.03 H new ATOM 0 HB2 PRO A 96 32.900 15.102 9.928 1.00 39.86 H new ATOM 0 HB3 PRO A 96 34.382 14.685 10.180 1.00 39.86 H new ATOM 0 HG2 PRO A 96 33.167 15.162 7.687 1.00 40.28 H new ATOM 0 HG3 PRO A 96 34.603 15.588 8.122 1.00 40.28 H new ATOM 0 HD2 PRO A 96 34.267 13.504 6.647 1.00 39.33 H new ATOM 0 HD3 PRO A 96 35.475 13.574 7.631 1.00 39.33 H new ATOM 619 N ASP A 97 31.272 12.261 8.377 1.00 41.24 N ATOM 620 CA ASP A 97 29.826 12.104 8.119 1.00 43.77 C ATOM 621 C ASP A 97 29.425 10.659 7.799 1.00 41.92 C ATOM 622 O ASP A 97 28.419 10.410 7.119 1.00 42.52 O ATOM 623 CB ASP A 97 29.425 12.937 6.905 1.00 49.16 C ATOM 624 CG ASP A 97 30.182 12.526 5.641 1.00 54.02 C ATOM 625 OD1 ASP A 97 30.723 11.356 5.565 1.00 57.12 O ATOM 626 OD2 ASP A 97 30.284 13.348 4.653 1.00 57.09 O ATOM 0 H ASP A 97 31.773 11.891 7.784 1.00 41.24 H new ATOM 0 HA ASP A 97 29.380 12.388 8.932 1.00 43.77 H new ATOM 0 HB2 ASP A 97 28.472 12.844 6.753 1.00 49.16 H new ATOM 0 HB3 ASP A 97 29.593 13.874 7.089 1.00 49.16 H new ATOM 627 N THR A 98 30.193 9.708 8.287 1.00 38.42 N ATOM 628 CA THR A 98 29.893 8.294 8.019 1.00 34.47 C ATOM 629 C THR A 98 30.472 7.371 9.094 1.00 31.80 C ATOM 630 O THR A 98 31.272 7.800 9.939 1.00 30.60 O ATOM 631 CB THR A 98 30.485 7.875 6.672 1.00 35.44 C ATOM 632 OG1 THR A 98 31.898 8.008 6.699 1.00 36.08 O ATOM 633 CG2 THR A 98 29.969 8.718 5.504 1.00 34.68 C ATOM 0 H THR A 98 30.889 9.845 8.773 1.00 38.42 H new ATOM 0 HA THR A 98 28.927 8.209 8.015 1.00 34.47 H new ATOM 0 HB THR A 98 30.213 6.954 6.535 1.00 35.44 H new ATOM 0 HG1 THR A 98 32.216 7.775 5.957 1.00 36.08 H new ATOM 0 HG21 THR A 98 30.375 8.411 4.679 1.00 34.68 H new ATOM 0 HG22 THR A 98 29.005 8.630 5.442 1.00 34.68 H new ATOM 0 HG23 THR A 98 30.199 9.649 5.650 1.00 34.68 H new ATOM 634 N ILE A 99 30.051 6.119 9.036 1.00 28.98 N ATOM 635 CA ILE A 99 30.455 5.106 10.024 1.00 27.16 C ATOM 636 C ILE A 99 31.470 4.123 9.459 1.00 25.89 C ATOM 637 O ILE A 99 31.772 3.115 10.074 1.00 27.05 O ATOM 638 CB ILE A 99 29.238 4.304 10.489 1.00 27.08 C ATOM 639 CG1 ILE A 99 28.657 3.406 9.395 1.00 28.12 C ATOM 640 CG2 ILE A 99 28.081 5.189 10.956 1.00 25.92 C ATOM 641 CD1 ILE A 99 27.518 2.516 9.894 1.00 30.22 C ATOM 0 H ILE A 99 29.522 5.823 8.426 1.00 28.98 H new ATOM 0 HA ILE A 99 30.858 5.588 10.763 1.00 27.16 H new ATOM 0 HB ILE A 99 29.588 3.774 11.222 1.00 27.08 H new ATOM 0 HG12 ILE A 99 28.333 3.960 8.667 1.00 28.12 H new ATOM 0 HG13 ILE A 99 29.363 2.847 9.034 1.00 28.12 H new ATOM 0 HG21 ILE A 99 27.340 4.631 11.238 1.00 25.92 H new ATOM 0 HG22 ILE A 99 28.373 5.738 11.700 1.00 25.92 H new ATOM 0 HG23 ILE A 99 27.795 5.760 10.226 1.00 25.92 H new ATOM 0 HD11 ILE A 99 27.189 1.971 9.162 1.00 30.22 H new ATOM 0 HD12 ILE A 99 27.844 1.941 10.604 1.00 30.22 H new ATOM 0 HD13 ILE A 99 26.798 3.071 10.232 1.00 30.22 H new ATOM 642 N ASP A 100 31.978 4.400 8.273 1.00 24.64 N ATOM 643 CA ASP A 100 32.949 3.510 7.655 1.00 23.25 C ATOM 644 C ASP A 100 34.373 3.913 8.047 1.00 19.91 C ATOM 645 O ASP A 100 34.680 5.103 8.206 1.00 16.97 O ATOM 646 CB ASP A 100 32.852 3.605 6.130 1.00 27.01 C ATOM 647 CG ASP A 100 31.440 3.362 5.601 1.00 29.69 C ATOM 648 OD1 ASP A 100 30.622 2.622 6.267 1.00 32.35 O ATOM 649 OD2 ASP A 100 31.071 3.899 4.488 1.00 34.18 O ATOM 0 H ASP A 100 31.777 5.095 7.808 1.00 24.64 H new ATOM 0 HA ASP A 100 32.757 2.609 7.958 1.00 23.25 H new ATOM 0 HB2 ASP A 100 33.151 4.483 5.847 1.00 27.01 H new ATOM 0 HB3 ASP A 100 33.456 2.958 5.732 1.00 27.01 H new ATOM 650 N HIS A 101 35.208 2.900 8.187 1.00 18.22 N ATOM 651 CA HIS A 101 36.627 3.077 8.536 1.00 17.95 C ATOM 652 C HIS A 101 36.762 3.982 9.761 1.00 17.61 C ATOM 653 O HIS A 101 37.612 4.885 9.799 1.00 17.38 O ATOM 654 CB HIS A 101 37.366 3.717 7.362 1.00 17.26 C ATOM 655 CG HIS A 101 36.798 3.286 6.011 1.00 18.42 C ATOM 656 ND1 HIS A 101 36.766 2.079 5.388 1.00 18.88 N flip ATOM 657 CD2 HIS A 101 36.166 4.184 5.156 1.00 17.81 C flip ATOM 658 CE1 HIS A 101 36.132 2.266 4.202 1.00 17.73 C flip ATOM 659 NE2 HIS A 101 35.782 3.523 4.078 1.00 18.27 N flip ATOM 0 H HIS A 101 34.976 2.079 8.083 1.00 18.22 H new ATOM 0 HA HIS A 101 37.009 2.208 8.735 1.00 17.95 H new ATOM 0 HB2 HIS A 101 37.314 4.683 7.438 1.00 17.26 H new ATOM 0 HB3 HIS A 101 38.305 3.479 7.406 1.00 17.26 H new ATOM 0 HD2 HIS A 101 36.036 5.091 5.315 1.00 17.81 H new ATOM 0 HE1 HIS A 101 35.970 1.601 3.572 1.00 17.73 H new ATOM 0 HE2 HIS A 101 35.369 3.863 3.404 1.00 18.27 H new ATOM 660 N ASP A 102 35.914 3.700 10.726 1.00 15.95 N ATOM 661 CA ASP A 102 35.868 4.443 11.988 1.00 14.64 C ATOM 662 C ASP A 102 36.861 3.852 12.989 1.00 12.91 C ATOM 663 O ASP A 102 36.479 3.351 14.050 1.00 11.75 O ATOM 664 CB ASP A 102 34.467 4.352 12.591 1.00 14.21 C ATOM 665 CG ASP A 102 34.185 5.451 13.613 1.00 16.81 C ATOM 666 OD1 ASP A 102 35.044 6.396 13.793 1.00 17.01 O ATOM 667 OD2 ASP A 102 33.089 5.434 14.290 1.00 19.55 O ATOM 0 H ASP A 102 35.336 3.065 10.676 1.00 15.95 H new ATOM 0 HA ASP A 102 36.097 5.368 11.806 1.00 14.64 H new ATOM 0 HB2 ASP A 102 33.810 4.403 11.879 1.00 14.21 H new ATOM 0 HB3 ASP A 102 34.359 3.487 13.016 1.00 14.21 H new ATOM 668 N LEU A 103 38.124 3.919 12.626 1.00 11.07 N ATOM 669 CA LEU A 103 39.213 3.422 13.481 1.00 10.06 C ATOM 670 C LEU A 103 40.228 4.501 13.659 1.00 10.80 C ATOM 671 O LEU A 103 40.403 5.351 12.795 1.00 11.81 O ATOM 672 CB LEU A 103 39.918 2.236 12.822 1.00 8.65 C ATOM 673 CG LEU A 103 39.049 0.987 12.707 1.00 12.44 C ATOM 674 CD1 LEU A 103 39.767 -0.156 11.984 1.00 11.73 C ATOM 675 CD2 LEU A 103 38.622 0.429 14.065 1.00 12.42 C ATOM 0 H LEU A 103 38.388 4.252 11.878 1.00 11.07 H new ATOM 0 HA LEU A 103 38.831 3.151 14.330 1.00 10.06 H new ATOM 0 HB2 LEU A 103 40.212 2.498 11.935 1.00 8.65 H new ATOM 0 HB3 LEU A 103 40.714 2.020 13.332 1.00 8.65 H new ATOM 0 HG LEU A 103 38.274 1.286 12.206 1.00 12.44 H new ATOM 0 HD11 LEU A 103 39.180 -0.927 11.934 1.00 11.73 H new ATOM 0 HD12 LEU A 103 40.006 0.127 11.087 1.00 11.73 H new ATOM 0 HD13 LEU A 103 40.571 -0.394 12.472 1.00 11.73 H new ATOM 0 HD21 LEU A 103 38.074 -0.361 13.933 1.00 12.42 H new ATOM 0 HD22 LEU A 103 39.409 0.193 14.580 1.00 12.42 H new ATOM 0 HD23 LEU A 103 38.111 1.100 14.545 1.00 12.42 H new ATOM 676 N LEU A 104 40.913 4.462 14.783 1.00 10.45 N ATOM 677 CA LEU A 104 41.904 5.451 15.096 1.00 10.25 C ATOM 678 C LEU A 104 42.953 4.712 15.863 1.00 10.33 C ATOM 679 O LEU A 104 42.625 3.848 16.642 1.00 9.54 O ATOM 680 CB LEU A 104 41.292 6.521 15.985 1.00 9.74 C ATOM 681 CG LEU A 104 42.170 7.566 16.661 1.00 9.93 C ATOM 682 CD1 LEU A 104 42.497 8.697 15.720 1.00 12.22 C ATOM 683 CD2 LEU A 104 41.359 8.141 17.815 1.00 11.97 C ATOM 0 H LEU A 104 40.813 3.857 15.386 1.00 10.45 H new ATOM 0 HA LEU A 104 42.257 5.883 14.303 1.00 10.25 H new ATOM 0 HB2 LEU A 104 40.640 6.999 15.449 1.00 9.74 H new ATOM 0 HB3 LEU A 104 40.802 6.064 16.686 1.00 9.74 H new ATOM 0 HG LEU A 104 43.000 7.155 16.950 1.00 9.93 H new ATOM 0 HD11 LEU A 104 43.056 9.346 16.176 1.00 12.22 H new ATOM 0 HD12 LEU A 104 42.970 8.349 14.948 1.00 12.22 H new ATOM 0 HD13 LEU A 104 41.676 9.125 15.430 1.00 12.22 H new ATOM 0 HD21 LEU A 104 41.884 8.814 18.276 1.00 11.97 H new ATOM 0 HD22 LEU A 104 40.547 8.544 17.471 1.00 11.97 H new ATOM 0 HD23 LEU A 104 41.129 7.431 18.435 1.00 11.97 H new ATOM 684 N LEU A 105 44.217 5.053 15.627 1.00 10.88 N ATOM 685 CA LEU A 105 45.314 4.417 16.331 1.00 10.62 C ATOM 686 C LEU A 105 46.038 5.525 17.087 1.00 12.01 C ATOM 687 O LEU A 105 46.335 6.594 16.549 1.00 11.96 O ATOM 688 CB LEU A 105 46.244 3.672 15.352 1.00 10.03 C ATOM 689 CG LEU A 105 45.799 2.234 15.025 1.00 10.89 C ATOM 690 CD1 LEU A 105 46.555 1.679 13.856 1.00 11.53 C ATOM 691 CD2 LEU A 105 46.051 1.336 16.225 1.00 12.85 C ATOM 0 H LEU A 105 44.457 5.653 15.060 1.00 10.88 H new ATOM 0 HA LEU A 105 44.995 3.741 16.949 1.00 10.62 H new ATOM 0 HB2 LEU A 105 46.299 4.178 14.526 1.00 10.03 H new ATOM 0 HB3 LEU A 105 47.138 3.645 15.728 1.00 10.03 H new ATOM 0 HG LEU A 105 44.854 2.261 14.807 1.00 10.89 H new ATOM 0 HD11 LEU A 105 46.253 0.775 13.675 1.00 11.53 H new ATOM 0 HD12 LEU A 105 46.398 2.234 13.076 1.00 11.53 H new ATOM 0 HD13 LEU A 105 47.503 1.668 14.059 1.00 11.53 H new ATOM 0 HD21 LEU A 105 45.770 0.431 16.017 1.00 12.85 H new ATOM 0 HD22 LEU A 105 46.997 1.339 16.439 1.00 12.85 H new ATOM 0 HD23 LEU A 105 45.547 1.664 16.986 1.00 12.85 H new ATOM 692 N LEU A 106 46.270 5.288 18.368 1.00 12.26 N ATOM 693 CA LEU A 106 46.951 6.276 19.168 1.00 12.43 C ATOM 694 C LEU A 106 48.271 5.719 19.628 1.00 12.90 C ATOM 695 O LEU A 106 48.310 4.641 20.208 1.00 11.69 O ATOM 696 CB LEU A 106 46.127 6.626 20.406 1.00 14.21 C ATOM 697 CG LEU A 106 44.829 7.407 20.246 1.00 15.36 C ATOM 698 CD1 LEU A 106 43.889 7.149 21.417 1.00 17.68 C ATOM 699 CD2 LEU A 106 45.182 8.843 20.163 1.00 17.16 C ATOM 0 H LEU A 106 46.043 4.571 18.785 1.00 12.26 H new ATOM 0 HA LEU A 106 47.080 7.071 18.628 1.00 12.43 H new ATOM 0 HB2 LEU A 106 45.912 5.795 20.857 1.00 14.21 H new ATOM 0 HB3 LEU A 106 46.700 7.133 21.003 1.00 14.21 H new ATOM 0 HG LEU A 106 44.364 7.125 19.443 1.00 15.36 H new ATOM 0 HD11 LEU A 106 43.071 7.656 21.293 1.00 17.68 H new ATOM 0 HD12 LEU A 106 43.679 6.203 21.461 1.00 17.68 H new ATOM 0 HD13 LEU A 106 44.317 7.424 22.243 1.00 17.68 H new ATOM 0 HD21 LEU A 106 44.374 9.370 20.060 1.00 17.16 H new ATOM 0 HD22 LEU A 106 45.641 9.111 20.974 1.00 17.16 H new ATOM 0 HD23 LEU A 106 45.762 8.990 19.400 1.00 17.16 H new ATOM 700 N GLN A 107 49.352 6.451 19.374 1.00 12.89 N ATOM 701 CA GLN A 107 50.661 6.033 19.853 1.00 13.76 C ATOM 702 C GLN A 107 50.895 6.694 21.191 1.00 15.01 C ATOM 703 O GLN A 107 50.831 7.932 21.307 1.00 15.64 O ATOM 704 CB GLN A 107 51.782 6.485 18.952 1.00 14.37 C ATOM 705 CG GLN A 107 53.035 5.736 19.274 1.00 15.75 C ATOM 706 CD GLN A 107 54.098 6.020 18.267 1.00 16.75 C ATOM 707 OE1 GLN A 107 54.088 7.080 17.650 1.00 18.64 O ATOM 708 NE2 GLN A 107 55.016 5.087 18.085 1.00 15.75 N ATOM 0 H GLN A 107 49.348 7.187 18.929 1.00 12.89 H new ATOM 0 HA GLN A 107 50.662 5.064 19.892 1.00 13.76 H new ATOM 0 HB2 GLN A 107 51.539 6.339 18.024 1.00 14.37 H new ATOM 0 HB3 GLN A 107 51.929 7.438 19.060 1.00 14.37 H new ATOM 0 HG2 GLN A 107 53.347 5.985 20.158 1.00 15.75 H new ATOM 0 HG3 GLN A 107 52.851 4.784 19.296 1.00 15.75 H new ATOM 0 HE21 GLN A 107 54.984 4.358 18.540 1.00 15.75 H new ATOM 0 HE22 GLN A 107 55.645 5.209 17.511 1.00 15.75 H new ATOM 709 N LEU A 108 51.171 5.895 22.211 1.00 13.38 N ATOM 710 CA LEU A 108 51.420 6.461 23.518 1.00 13.76 C ATOM 711 C LEU A 108 52.822 7.098 23.553 1.00 13.47 C ATOM 712 O LEU A 108 53.726 6.637 22.867 1.00 11.73 O ATOM 713 CB LEU A 108 51.273 5.356 24.567 1.00 13.25 C ATOM 714 CG LEU A 108 49.944 4.604 24.576 1.00 12.42 C ATOM 715 CD1 LEU A 108 49.990 3.581 25.691 1.00 12.01 C ATOM 716 CD2 LEU A 108 48.750 5.562 24.749 1.00 12.02 C ATOM 0 H LEU A 108 51.218 5.037 22.166 1.00 13.38 H new ATOM 0 HA LEU A 108 50.778 7.161 23.714 1.00 13.76 H new ATOM 0 HB2 LEU A 108 51.986 4.712 24.433 1.00 13.25 H new ATOM 0 HB3 LEU A 108 51.406 5.749 25.444 1.00 13.25 H new ATOM 0 HG LEU A 108 49.817 4.160 23.723 1.00 12.42 H new ATOM 0 HD11 LEU A 108 49.154 3.090 25.715 1.00 12.01 H new ATOM 0 HD12 LEU A 108 50.722 2.964 25.534 1.00 12.01 H new ATOM 0 HD13 LEU A 108 50.124 4.032 26.539 1.00 12.01 H new ATOM 0 HD21 LEU A 108 47.924 5.053 24.750 1.00 12.02 H new ATOM 0 HD22 LEU A 108 48.837 6.039 25.589 1.00 12.02 H new ATOM 0 HD23 LEU A 108 48.736 6.198 24.017 1.00 12.02 H new ATOM 717 N SER A 109 52.994 8.132 24.369 1.00 14.10 N ATOM 718 CA SER A 109 54.289 8.813 24.492 1.00 15.80 C ATOM 719 C SER A 109 55.410 7.829 24.827 1.00 16.62 C ATOM 720 O SER A 109 56.590 8.084 24.553 1.00 18.83 O ATOM 721 CB SER A 109 54.248 9.877 25.572 1.00 16.26 C ATOM 722 OG SER A 109 53.856 9.299 26.808 1.00 20.05 O ATOM 0 H SER A 109 52.373 8.460 24.865 1.00 14.10 H new ATOM 0 HA SER A 109 54.467 9.225 23.632 1.00 15.80 H new ATOM 0 HB2 SER A 109 55.121 10.291 25.662 1.00 16.26 H new ATOM 0 HB3 SER A 109 53.626 10.578 25.322 1.00 16.26 H new ATOM 0 HG SER A 109 53.837 9.893 27.402 1.00 20.05 H new ATOM 723 N GLU A 110 55.026 6.721 25.417 1.00 18.69 N ATOM 724 CA GLU A 110 55.981 5.670 25.787 1.00 19.90 C ATOM 725 C GLU A 110 55.263 4.337 25.889 1.00 19.34 C ATOM 726 O GLU A 110 54.033 4.279 26.011 1.00 20.32 O ATOM 727 CB GLU A 110 56.634 5.991 27.133 1.00 22.52 C ATOM 728 CG GLU A 110 55.687 5.816 28.321 1.00 27.90 C ATOM 729 CD GLU A 110 55.993 6.786 29.462 1.00 31.10 C ATOM 730 OE1 GLU A 110 57.012 6.582 30.226 1.00 32.47 O ATOM 731 OE2 GLU A 110 55.235 7.811 29.656 1.00 33.78 O ATOM 0 H GLU A 110 54.209 6.545 25.620 1.00 18.69 H new ATOM 0 HA GLU A 110 56.667 5.623 25.103 1.00 19.90 H new ATOM 0 HB2 GLU A 110 57.406 5.417 27.256 1.00 22.52 H new ATOM 0 HB3 GLU A 110 56.959 6.905 27.118 1.00 22.52 H new ATOM 0 HG2 GLU A 110 54.773 5.948 28.024 1.00 27.90 H new ATOM 0 HG3 GLU A 110 55.750 4.905 28.649 1.00 27.90 H new ATOM 732 N LYS A 111 56.053 3.292 25.829 1.00 18.28 N ATOM 733 CA LYS A 111 55.531 1.937 25.934 1.00 19.91 C ATOM 734 C LYS A 111 54.891 1.757 27.305 1.00 20.76 C ATOM 735 O LYS A 111 55.431 2.183 28.325 1.00 20.96 O ATOM 736 CB LYS A 111 56.662 0.921 25.772 1.00 21.75 C ATOM 737 CG LYS A 111 56.974 0.586 24.312 1.00 25.93 C ATOM 738 CD LYS A 111 58.272 -0.210 24.161 1.00 28.48 C ATOM 739 CE LYS A 111 58.428 -0.865 22.789 1.00 30.83 C ATOM 740 NZ LYS A 111 59.741 -1.504 22.609 1.00 33.46 N ATOM 0 H LYS A 111 56.906 3.339 25.727 1.00 18.28 H new ATOM 0 HA LYS A 111 54.874 1.794 25.235 1.00 19.91 H new ATOM 0 HB2 LYS A 111 57.463 1.268 26.195 1.00 21.75 H new ATOM 0 HB3 LYS A 111 56.425 0.105 26.240 1.00 21.75 H new ATOM 0 HG2 LYS A 111 56.239 0.077 23.936 1.00 25.93 H new ATOM 0 HG3 LYS A 111 57.040 1.408 23.801 1.00 25.93 H new ATOM 0 HD2 LYS A 111 59.025 0.381 24.317 1.00 28.48 H new ATOM 0 HD3 LYS A 111 58.303 -0.897 24.845 1.00 28.48 H new ATOM 0 HE2 LYS A 111 57.731 -1.529 22.671 1.00 30.83 H new ATOM 0 HE3 LYS A 111 58.302 -0.195 22.099 1.00 30.83 H new ATOM 0 HZ1 LYS A 111 59.785 -1.870 21.799 1.00 33.46 H new ATOM 0 HZ2 LYS A 111 60.383 -0.893 22.693 1.00 33.46 H new ATOM 0 HZ3 LYS A 111 59.851 -2.136 23.226 1.00 33.46 H new ATOM 741 N ALA A 112 53.717 1.140 27.316 1.00 20.98 N ATOM 742 CA ALA A 112 52.980 0.898 28.535 1.00 20.50 C ATOM 743 C ALA A 112 53.655 -0.143 29.415 1.00 19.85 C ATOM 744 O ALA A 112 54.097 -1.186 28.950 1.00 21.42 O ATOM 745 CB ALA A 112 51.584 0.440 28.186 1.00 19.41 C ATOM 0 H ALA A 112 53.326 0.849 26.607 1.00 20.98 H new ATOM 0 HA ALA A 112 52.950 1.728 29.037 1.00 20.50 H new ATOM 0 HB1 ALA A 112 51.084 0.276 29.001 1.00 19.41 H new ATOM 0 HB2 ALA A 112 51.138 1.127 27.666 1.00 19.41 H new ATOM 0 HB3 ALA A 112 51.632 -0.378 27.666 1.00 19.41 H new ATOM 746 N THR A 113 53.710 0.152 30.698 1.00 19.68 N ATOM 747 CA THR A 113 54.273 -0.742 31.690 1.00 19.75 C ATOM 748 C THR A 113 53.280 -1.873 31.778 1.00 19.97 C ATOM 749 O THR A 113 52.148 -1.667 32.174 1.00 21.37 O ATOM 750 CB THR A 113 54.327 -0.028 33.023 1.00 20.83 C ATOM 751 OG1 THR A 113 55.305 1.010 32.944 1.00 21.25 O ATOM 752 CG2 THR A 113 54.656 -0.997 34.153 1.00 19.83 C ATOM 0 H THR A 113 53.416 0.891 31.025 1.00 19.68 H new ATOM 0 HA THR A 113 55.168 -1.041 31.465 1.00 19.75 H new ATOM 0 HB THR A 113 53.458 0.355 33.219 1.00 20.83 H new ATOM 0 HG1 THR A 113 55.343 1.415 33.679 1.00 21.25 H new ATOM 0 HG21 THR A 113 54.685 -0.515 34.995 1.00 19.83 H new ATOM 0 HG22 THR A 113 53.974 -1.685 34.198 1.00 19.83 H new ATOM 0 HG23 THR A 113 55.519 -1.408 33.987 1.00 19.83 H new ATOM 753 N LEU A 114 53.695 -3.069 31.415 1.00 19.41 N ATOM 754 CA LEU A 114 52.790 -4.204 31.437 1.00 20.24 C ATOM 755 C LEU A 114 52.764 -4.939 32.760 1.00 21.40 C ATOM 756 O LEU A 114 53.765 -5.025 33.458 1.00 23.78 O ATOM 757 CB LEU A 114 53.159 -5.207 30.344 1.00 20.31 C ATOM 758 CG LEU A 114 53.038 -4.839 28.870 1.00 21.03 C ATOM 759 CD1 LEU A 114 53.274 -6.121 28.105 1.00 20.08 C ATOM 760 CD2 LEU A 114 51.653 -4.242 28.517 1.00 22.11 C ATOM 0 H LEU A 114 54.494 -3.248 31.153 1.00 19.41 H new ATOM 0 HA LEU A 114 51.908 -3.829 31.287 1.00 20.24 H new ATOM 0 HB2 LEU A 114 54.080 -5.468 30.497 1.00 20.31 H new ATOM 0 HB3 LEU A 114 52.613 -5.996 30.486 1.00 20.31 H new ATOM 0 HG LEU A 114 53.682 -4.150 28.642 1.00 21.03 H new ATOM 0 HD11 LEU A 114 53.209 -5.947 27.153 1.00 20.08 H new ATOM 0 HD12 LEU A 114 54.158 -6.463 28.311 1.00 20.08 H new ATOM 0 HD13 LEU A 114 52.607 -6.777 28.360 1.00 20.08 H new ATOM 0 HD21 LEU A 114 51.625 -4.025 27.572 1.00 22.11 H new ATOM 0 HD22 LEU A 114 50.960 -4.890 28.720 1.00 22.11 H new ATOM 0 HD23 LEU A 114 51.505 -3.437 29.038 1.00 22.11 H new ATOM 761 N GLY A 115 51.600 -5.491 33.078 1.00 21.69 N ATOM 762 CA GLY A 115 51.411 -6.236 34.303 1.00 22.09 C ATOM 763 C GLY A 115 50.103 -6.983 34.197 1.00 22.58 C ATOM 764 O GLY A 115 49.507 -7.052 33.127 1.00 22.21 O ATOM 0 H GLY A 115 50.898 -5.441 32.584 1.00 21.69 H new ATOM 0 HA2 GLY A 115 52.145 -6.855 34.440 1.00 22.09 H new ATOM 0 HA3 GLY A 115 51.399 -5.637 35.066 1.00 22.09 H new ATOM 765 N PRO A 118 49.622 -7.543 35.306 1.00 22.63 N ATOM 766 CA PRO A 118 48.358 -8.280 35.280 1.00 23.28 C ATOM 767 C PRO A 118 47.140 -7.388 34.987 1.00 23.51 C ATOM 768 O PRO A 118 46.102 -7.856 34.505 1.00 24.39 O ATOM 769 CB PRO A 118 48.294 -8.926 36.663 1.00 23.24 C ATOM 770 CG PRO A 118 49.101 -8.043 37.511 1.00 23.91 C ATOM 771 CD PRO A 118 50.219 -7.512 36.646 1.00 21.84 C ATOM 0 HA PRO A 118 48.329 -8.929 34.560 1.00 23.28 H new ATOM 0 HB2 PRO A 118 47.381 -8.987 36.983 1.00 23.24 H new ATOM 0 HB3 PRO A 118 48.651 -9.828 36.650 1.00 23.24 H new ATOM 0 HG2 PRO A 118 48.563 -7.316 37.862 1.00 23.91 H new ATOM 0 HG3 PRO A 118 49.456 -8.527 38.273 1.00 23.91 H new ATOM 0 HD2 PRO A 118 50.481 -6.615 36.904 1.00 21.84 H new ATOM 0 HD3 PRO A 118 51.013 -8.066 36.701 1.00 21.84 H new ATOM 772 N ALA A 119 47.278 -6.099 35.260 1.00 22.06 N ATOM 773 CA ALA A 119 46.177 -5.185 35.041 1.00 21.85 C ATOM 774 C ALA A 119 46.305 -4.378 33.751 1.00 21.22 C ATOM 775 O ALA A 119 45.417 -3.583 33.437 1.00 20.76 O ATOM 776 CB ALA A 119 46.061 -4.254 36.226 1.00 21.56 C ATOM 0 H ALA A 119 47.995 -5.739 35.570 1.00 22.06 H new ATOM 0 HA ALA A 119 45.374 -5.721 34.946 1.00 21.85 H new ATOM 0 HB1 ALA A 119 45.324 -3.639 36.084 1.00 21.56 H new ATOM 0 HB2 ALA A 119 45.899 -4.772 37.030 1.00 21.56 H new ATOM 0 HB3 ALA A 119 46.885 -3.752 36.326 1.00 21.56 H new ATOM 777 N VAL A 120 47.403 -4.590 33.018 1.00 20.33 N ATOM 778 CA VAL A 120 47.687 -3.897 31.755 1.00 18.74 C ATOM 779 C VAL A 120 48.399 -4.846 30.783 1.00 18.80 C ATOM 780 O VAL A 120 49.578 -5.144 30.935 1.00 18.77 O ATOM 781 CB VAL A 120 48.603 -2.666 31.978 1.00 18.97 C ATOM 782 CG1 VAL A 120 48.839 -1.956 30.652 1.00 16.73 C ATOM 783 CG2 VAL A 120 47.999 -1.715 33.016 1.00 16.67 C ATOM 0 H VAL A 120 48.014 -5.151 33.245 1.00 20.33 H new ATOM 0 HA VAL A 120 46.837 -3.604 31.390 1.00 18.74 H new ATOM 0 HB VAL A 120 49.457 -2.968 32.325 1.00 18.97 H new ATOM 0 HG11 VAL A 120 49.412 -1.186 30.794 1.00 16.73 H new ATOM 0 HG12 VAL A 120 49.266 -2.566 30.030 1.00 16.73 H new ATOM 0 HG13 VAL A 120 47.990 -1.663 30.286 1.00 16.73 H new ATOM 0 HG21 VAL A 120 48.588 -0.954 33.139 1.00 16.67 H new ATOM 0 HG22 VAL A 120 47.133 -1.407 32.707 1.00 16.67 H new ATOM 0 HG23 VAL A 120 47.894 -2.181 33.860 1.00 16.67 H new ATOM 784 N ARG A 121 47.690 -5.287 29.756 1.00 18.25 N ATOM 785 CA ARG A 121 48.257 -6.225 28.794 1.00 19.18 C ATOM 786 C ARG A 121 47.506 -6.127 27.461 1.00 17.76 C ATOM 787 O ARG A 121 46.285 -6.003 27.442 1.00 17.14 O ATOM 788 CB ARG A 121 48.136 -7.643 29.363 1.00 22.15 C ATOM 789 CG ARG A 121 48.839 -8.722 28.556 1.00 30.18 C ATOM 790 CD ARG A 121 50.247 -9.031 29.089 1.00 34.70 C ATOM 791 NE ARG A 121 50.258 -9.093 30.545 1.00 39.09 N ATOM 792 CZ ARG A 121 51.331 -9.381 31.285 1.00 41.24 C ATOM 793 NH1 ARG A 121 52.508 -9.640 30.716 1.00 41.15 N ATOM 794 NH2 ARG A 121 51.222 -9.407 32.611 1.00 41.47 N ATOM 0 H ARG A 121 46.877 -5.057 29.596 1.00 18.25 H new ATOM 0 HA ARG A 121 49.190 -6.012 28.637 1.00 19.18 H new ATOM 0 HB2 ARG A 121 48.495 -7.647 30.264 1.00 22.15 H new ATOM 0 HB3 ARG A 121 47.195 -7.870 29.431 1.00 22.15 H new ATOM 0 HG2 ARG A 121 48.306 -9.532 28.571 1.00 30.18 H new ATOM 0 HG3 ARG A 121 48.901 -8.440 27.630 1.00 30.18 H new ATOM 0 HD2 ARG A 121 50.555 -9.875 28.725 1.00 34.70 H new ATOM 0 HD3 ARG A 121 50.867 -8.349 28.787 1.00 34.70 H new ATOM 0 HE ARG A 121 49.520 -8.933 30.957 1.00 39.09 H new ATOM 0 HH11 ARG A 121 52.585 -9.623 29.860 1.00 41.15 H new ATOM 0 HH12 ARG A 121 53.191 -9.824 31.205 1.00 41.15 H new ATOM 0 HH21 ARG A 121 50.465 -9.239 32.984 1.00 41.47 H new ATOM 0 HH22 ARG A 121 51.908 -9.592 33.095 1.00 41.47 H new ATOM 795 N PRO A 122 48.221 -6.157 26.328 1.00 16.38 N ATOM 796 CA PRO A 122 47.540 -6.067 25.028 1.00 14.69 C ATOM 797 C PRO A 122 46.615 -7.251 24.774 1.00 14.66 C ATOM 798 O PRO A 122 46.790 -8.324 25.347 1.00 12.99 O ATOM 799 CB PRO A 122 48.687 -6.026 24.008 1.00 14.43 C ATOM 800 CG PRO A 122 49.906 -5.682 24.780 1.00 14.29 C ATOM 801 CD PRO A 122 49.684 -6.259 26.164 1.00 16.84 C ATOM 0 HA PRO A 122 46.962 -5.290 24.977 1.00 14.69 H new ATOM 0 HB2 PRO A 122 48.787 -6.882 23.563 1.00 14.43 H new ATOM 0 HB3 PRO A 122 48.515 -5.366 23.318 1.00 14.43 H new ATOM 0 HG2 PRO A 122 50.699 -6.059 24.367 1.00 14.29 H new ATOM 0 HG3 PRO A 122 50.036 -4.721 24.819 1.00 14.29 H new ATOM 0 HD2 PRO A 122 49.990 -7.177 26.225 1.00 16.84 H new ATOM 0 HD3 PRO A 122 50.159 -5.756 26.844 1.00 16.84 H new ATOM 802 N LEU A 123 45.620 -7.036 23.919 1.00 15.26 N ATOM 803 CA LEU A 123 44.666 -8.078 23.569 1.00 15.72 C ATOM 804 C LEU A 123 44.864 -8.530 22.123 1.00 15.09 C ATOM 805 O LEU A 123 44.892 -7.708 21.216 1.00 16.17 O ATOM 806 CB LEU A 123 43.224 -7.573 23.732 1.00 15.88 C ATOM 807 CG LEU A 123 42.131 -8.531 23.251 1.00 15.85 C ATOM 808 CD1 LEU A 123 41.981 -9.675 24.243 1.00 17.45 C ATOM 809 CD2 LEU A 123 40.824 -7.763 23.123 1.00 16.38 C ATOM 0 H LEU A 123 45.481 -6.283 23.527 1.00 15.26 H new ATOM 0 HA LEU A 123 44.819 -8.826 24.168 1.00 15.72 H new ATOM 0 HB2 LEU A 123 43.071 -7.377 24.670 1.00 15.88 H new ATOM 0 HB3 LEU A 123 43.134 -6.737 23.249 1.00 15.88 H new ATOM 0 HG LEU A 123 42.370 -8.902 22.387 1.00 15.85 H new ATOM 0 HD11 LEU A 123 41.288 -10.281 23.936 1.00 17.45 H new ATOM 0 HD12 LEU A 123 42.821 -10.155 24.314 1.00 17.45 H new ATOM 0 HD13 LEU A 123 41.738 -9.320 25.112 1.00 17.45 H new ATOM 0 HD21 LEU A 123 40.125 -8.362 22.818 1.00 16.38 H new ATOM 0 HD22 LEU A 123 40.580 -7.394 23.986 1.00 16.38 H new ATOM 0 HD23 LEU A 123 40.933 -7.043 22.483 1.00 16.38 H new ATOM 810 N PRO A 124 45.025 -9.834 21.893 1.00 15.57 N ATOM 811 CA PRO A 124 45.206 -10.356 20.537 1.00 15.72 C ATOM 812 C PRO A 124 44.031 -9.976 19.642 1.00 15.68 C ATOM 813 O PRO A 124 42.881 -10.069 20.062 1.00 16.95 O ATOM 814 CB PRO A 124 45.277 -11.873 20.740 1.00 15.83 C ATOM 815 CG PRO A 124 45.719 -12.044 22.138 1.00 15.00 C ATOM 816 CD PRO A 124 45.095 -10.911 22.898 1.00 15.26 C ATOM 0 HA PRO A 124 45.994 -9.999 20.098 1.00 15.72 H new ATOM 0 HB2 PRO A 124 44.414 -12.289 20.590 1.00 15.83 H new ATOM 0 HB3 PRO A 124 45.901 -12.283 20.121 1.00 15.83 H new ATOM 0 HG2 PRO A 124 45.434 -12.901 22.492 1.00 15.00 H new ATOM 0 HG3 PRO A 124 46.686 -12.018 22.204 1.00 15.00 H new ATOM 0 HD2 PRO A 124 44.216 -11.146 23.234 1.00 15.26 H new ATOM 0 HD3 PRO A 124 45.632 -10.653 23.663 1.00 15.26 H new ATOM 817 N TRP A 124A 44.294 -9.540 18.417 1.00 16.50 N ATOM 818 CA TRP A 124A 43.179 -9.206 17.537 1.00 16.13 C ATOM 819 C TRP A 124A 43.068 -10.127 16.298 1.00 17.11 C ATOM 820 O TRP A 124A 44.048 -10.766 15.881 1.00 15.67 O ATOM 821 CB TRP A 124A 43.243 -7.731 17.151 1.00 16.77 C ATOM 822 CG TRP A 124A 44.525 -7.303 16.508 1.00 18.75 C ATOM 823 CD1 TRP A 124A 45.672 -6.907 17.142 1.00 16.90 C ATOM 824 CD2 TRP A 124A 44.800 -7.252 15.102 1.00 15.94 C ATOM 825 NE1 TRP A 124A 46.640 -6.615 16.220 1.00 14.70 N ATOM 826 CE2 TRP A 124A 46.131 -6.821 14.959 1.00 16.13 C ATOM 827 CE3 TRP A 124A 44.047 -7.531 13.950 1.00 17.06 C ATOM 828 CZ2 TRP A 124A 46.727 -6.666 13.712 1.00 14.89 C ATOM 829 CZ3 TRP A 124A 44.641 -7.379 12.709 1.00 15.27 C ATOM 830 CH2 TRP A 124A 45.964 -6.951 12.599 1.00 16.81 C ATOM 0 H TRP A 124A 45.079 -9.433 18.083 1.00 16.50 H new ATOM 0 HA TRP A 124A 42.363 -9.364 18.037 1.00 16.13 H new ATOM 0 HB2 TRP A 124A 42.511 -7.537 16.544 1.00 16.77 H new ATOM 0 HB3 TRP A 124A 43.101 -7.195 17.947 1.00 16.77 H new ATOM 0 HD1 TRP A 124A 45.778 -6.845 18.064 1.00 16.90 H new ATOM 0 HE1 TRP A 124A 47.437 -6.346 16.400 1.00 14.70 H new ATOM 0 HE3 TRP A 124A 43.164 -7.813 14.020 1.00 17.06 H new ATOM 0 HZ2 TRP A 124A 47.608 -6.380 13.632 1.00 14.89 H new ATOM 0 HZ3 TRP A 124A 44.152 -7.564 11.940 1.00 15.27 H new ATOM 0 HH2 TRP A 124A 46.341 -6.855 11.754 1.00 16.81 H new ATOM 831 N GLN A 125 41.860 -10.198 15.740 1.00 16.50 N ATOM 832 CA GLN A 125 41.551 -11.053 14.598 1.00 17.05 C ATOM 833 C GLN A 125 42.152 -10.663 13.243 1.00 17.13 C ATOM 834 O GLN A 125 41.905 -9.573 12.738 1.00 15.95 O ATOM 835 CB GLN A 125 40.029 -11.156 14.451 1.00 18.45 C ATOM 836 CG GLN A 125 39.579 -12.272 13.538 1.00 17.28 C ATOM 837 CD GLN A 125 40.165 -13.594 13.969 1.00 18.76 C ATOM 838 OE1 GLN A 125 41.089 -14.102 13.348 1.00 20.81 O ATOM 839 NE2 GLN A 125 39.636 -14.154 15.049 1.00 18.85 N ATOM 0 H GLN A 125 41.187 -9.742 16.020 1.00 16.50 H new ATOM 0 HA GLN A 125 41.976 -11.898 14.814 1.00 17.05 H new ATOM 0 HB2 GLN A 125 39.636 -11.288 15.328 1.00 18.45 H new ATOM 0 HB3 GLN A 125 39.688 -10.314 14.111 1.00 18.45 H new ATOM 0 HG2 GLN A 125 38.611 -12.327 13.542 1.00 17.28 H new ATOM 0 HG3 GLN A 125 39.848 -12.077 12.627 1.00 17.28 H new ATOM 0 HE21 GLN A 125 38.987 -13.767 15.460 1.00 18.85 H new ATOM 0 HE22 GLN A 125 39.942 -14.904 15.338 1.00 18.85 H new ATOM 840 N ARG A 126 42.917 -11.567 12.644 1.00 18.43 N ATOM 841 CA ARG A 126 43.513 -11.287 11.336 1.00 21.67 C ATOM 842 C ARG A 126 42.842 -12.088 10.217 1.00 22.64 C ATOM 843 O ARG A 126 43.002 -11.775 9.042 1.00 24.52 O ATOM 844 CB ARG A 126 45.008 -11.587 11.357 1.00 21.94 C ATOM 845 CG ARG A 126 45.660 -11.276 12.679 1.00 24.67 C ATOM 846 CD ARG A 126 46.995 -10.608 12.502 1.00 28.28 C ATOM 847 NE ARG A 126 47.642 -10.346 13.781 1.00 32.24 N ATOM 848 CZ ARG A 126 48.644 -9.481 13.894 1.00 34.72 C ATOM 849 NH1 ARG A 126 49.044 -8.827 12.790 1.00 33.37 N ATOM 850 NH2 ARG A 126 49.231 -9.251 15.083 1.00 33.45 N ATOM 0 H ARG A 126 43.104 -12.341 12.970 1.00 18.43 H new ATOM 0 HA ARG A 126 43.373 -10.345 11.154 1.00 21.67 H new ATOM 0 HB2 ARG A 126 45.146 -12.524 11.148 1.00 21.94 H new ATOM 0 HB3 ARG A 126 45.444 -11.073 10.660 1.00 21.94 H new ATOM 0 HG2 ARG A 126 45.077 -10.701 13.199 1.00 24.67 H new ATOM 0 HG3 ARG A 126 45.774 -12.096 13.184 1.00 24.67 H new ATOM 0 HD2 ARG A 126 47.569 -11.170 11.958 1.00 28.28 H new ATOM 0 HD3 ARG A 126 46.878 -9.774 12.022 1.00 28.28 H new ATOM 0 HE ARG A 126 47.368 -10.763 14.482 1.00 32.24 H new ATOM 0 HH11 ARG A 126 48.653 -8.974 12.038 1.00 33.37 H new ATOM 0 HH12 ARG A 126 49.690 -8.262 12.836 1.00 33.37 H new ATOM 0 HH21 ARG A 126 48.958 -9.667 15.785 1.00 33.45 H new ATOM 0 HH22 ARG A 126 49.879 -8.688 15.141 1.00 33.45 H new ATOM 851 N VAL A 127 42.103 -13.133 10.570 1.00 22.95 N ATOM 852 CA VAL A 127 41.432 -13.890 9.528 1.00 25.39 C ATOM 853 C VAL A 127 40.147 -13.154 9.297 1.00 25.39 C ATOM 854 O VAL A 127 39.441 -12.827 10.247 1.00 25.64 O ATOM 855 CB VAL A 127 41.100 -15.375 9.929 1.00 27.10 C ATOM 856 CG1 VAL A 127 42.302 -16.011 10.601 1.00 28.33 C ATOM 857 CG2 VAL A 127 39.890 -15.437 10.846 1.00 28.60 C ATOM 0 H VAL A 127 41.981 -13.411 11.375 1.00 22.95 H new ATOM 0 HA VAL A 127 42.008 -13.955 8.750 1.00 25.39 H new ATOM 0 HB VAL A 127 40.889 -15.869 9.121 1.00 27.10 H new ATOM 0 HG11 VAL A 127 42.090 -16.926 10.845 1.00 28.33 H new ATOM 0 HG12 VAL A 127 43.055 -16.006 9.990 1.00 28.33 H new ATOM 0 HG13 VAL A 127 42.531 -15.509 11.399 1.00 28.33 H new ATOM 0 HG21 VAL A 127 39.707 -16.361 11.078 1.00 28.60 H new ATOM 0 HG22 VAL A 127 40.070 -14.931 11.654 1.00 28.60 H new ATOM 0 HG23 VAL A 127 39.120 -15.059 10.392 1.00 28.60 H new ATOM 858 N ASP A 128 39.871 -12.869 8.033 1.00 25.77 N ATOM 859 CA ASP A 128 38.664 -12.167 7.625 1.00 26.70 C ATOM 860 C ASP A 128 37.526 -13.188 7.515 1.00 26.99 C ATOM 861 O ASP A 128 37.199 -13.667 6.436 1.00 26.15 O ATOM 862 CB ASP A 128 38.919 -11.486 6.288 1.00 27.70 C ATOM 863 CG ASP A 128 38.013 -10.318 6.048 1.00 30.43 C ATOM 864 OD1 ASP A 128 36.826 -10.433 6.379 1.00 33.36 O ATOM 865 OD2 ASP A 128 38.481 -9.289 5.511 1.00 33.38 O ATOM 0 H ASP A 128 40.387 -13.081 7.378 1.00 25.77 H new ATOM 0 HA ASP A 128 38.417 -11.489 8.273 1.00 26.70 H new ATOM 0 HB2 ASP A 128 39.841 -11.187 6.253 1.00 27.70 H new ATOM 0 HB3 ASP A 128 38.803 -12.132 5.574 1.00 27.70 H new ATOM 866 N ARG A 129 36.950 -13.531 8.658 1.00 28.61 N ATOM 867 CA ARG A 129 35.869 -14.494 8.710 1.00 31.60 C ATOM 868 C ARG A 129 34.869 -13.984 9.725 1.00 31.40 C ATOM 869 O ARG A 129 35.241 -13.550 10.829 1.00 32.54 O ATOM 870 CB ARG A 129 36.396 -15.871 9.128 1.00 34.70 C ATOM 871 CG ARG A 129 35.991 -17.009 8.190 1.00 39.24 C ATOM 872 CD ARG A 129 36.002 -18.371 8.907 1.00 44.00 C ATOM 873 NE ARG A 129 35.506 -18.312 10.287 1.00 48.68 N ATOM 874 CZ ARG A 129 34.904 -19.332 10.898 1.00 50.59 C ATOM 875 NH1 ARG A 129 34.722 -20.479 10.236 1.00 50.51 N ATOM 876 NH2 ARG A 129 34.479 -19.210 12.158 1.00 50.28 N ATOM 0 H ARG A 129 37.176 -13.211 9.423 1.00 28.61 H new ATOM 0 HA ARG A 129 35.456 -14.593 7.838 1.00 31.60 H new ATOM 0 HB2 ARG A 129 37.364 -15.834 9.176 1.00 34.70 H new ATOM 0 HB3 ARG A 129 36.075 -16.072 10.021 1.00 34.70 H new ATOM 0 HG2 ARG A 129 35.104 -16.837 7.836 1.00 39.24 H new ATOM 0 HG3 ARG A 129 36.598 -17.036 7.434 1.00 39.24 H new ATOM 0 HD2 ARG A 129 35.460 -18.998 8.403 1.00 44.00 H new ATOM 0 HD3 ARG A 129 36.908 -18.719 8.911 1.00 44.00 H new ATOM 0 HE ARG A 129 35.609 -17.579 10.725 1.00 48.68 H new ATOM 0 HH11 ARG A 129 34.993 -20.554 9.423 1.00 50.51 H new ATOM 0 HH12 ARG A 129 34.334 -21.142 10.623 1.00 50.51 H new ATOM 0 HH21 ARG A 129 34.593 -18.470 12.580 1.00 50.28 H new ATOM 0 HH22 ARG A 129 34.091 -19.872 12.547 1.00 50.28 H new ATOM 877 N ASP A 129A 33.599 -14.034 9.337 1.00 30.42 N ATOM 878 CA ASP A 129A 32.504 -13.559 10.173 1.00 30.52 C ATOM 879 C ASP A 129A 32.285 -14.458 11.380 1.00 28.83 C ATOM 880 O ASP A 129A 32.379 -15.686 11.279 1.00 29.91 O ATOM 881 CB ASP A 129A 31.206 -13.472 9.348 1.00 30.95 C ATOM 882 CG ASP A 129A 30.931 -12.063 8.824 1.00 34.92 C ATOM 883 OD1 ASP A 129A 31.396 -11.725 7.709 1.00 35.80 O ATOM 884 OD2 ASP A 129A 30.244 -11.285 9.532 1.00 38.15 O ATOM 0 H ASP A 129A 33.347 -14.347 8.576 1.00 30.42 H new ATOM 0 HA ASP A 129A 32.745 -12.677 10.497 1.00 30.52 H new ATOM 0 HB2 ASP A 129A 31.262 -14.086 8.599 1.00 30.95 H new ATOM 0 HB3 ASP A 129A 30.459 -13.760 9.896 1.00 30.95 H new ATOM 885 N VAL A 130 32.010 -13.831 12.520 1.00 26.43 N ATOM 886 CA VAL A 130 31.747 -14.556 13.744 1.00 24.01 C ATOM 887 C VAL A 130 30.447 -15.281 13.461 1.00 24.00 C ATOM 888 O VAL A 130 29.556 -14.727 12.816 1.00 24.81 O ATOM 889 CB VAL A 130 31.535 -13.571 14.924 1.00 24.08 C ATOM 890 CG1 VAL A 130 31.135 -14.328 16.206 1.00 22.42 C ATOM 891 CG2 VAL A 130 32.786 -12.780 15.152 1.00 22.04 C ATOM 0 H VAL A 130 31.972 -12.976 12.600 1.00 26.43 H new ATOM 0 HA VAL A 130 32.477 -15.146 13.989 1.00 24.01 H new ATOM 0 HB VAL A 130 30.812 -12.965 14.697 1.00 24.08 H new ATOM 0 HG11 VAL A 130 31.008 -13.695 16.930 1.00 22.42 H new ATOM 0 HG12 VAL A 130 30.309 -14.812 16.052 1.00 22.42 H new ATOM 0 HG13 VAL A 130 31.836 -14.954 16.445 1.00 22.42 H new ATOM 0 HG21 VAL A 130 32.650 -12.165 15.890 1.00 22.04 H new ATOM 0 HG22 VAL A 130 33.516 -13.383 15.364 1.00 22.04 H new ATOM 0 HG23 VAL A 130 33.003 -12.279 14.350 1.00 22.04 H new ATOM 892 N ALA A 131 30.316 -16.526 13.888 1.00 22.55 N ATOM 893 CA ALA A 131 29.050 -17.192 13.643 1.00 21.76 C ATOM 894 C ALA A 131 27.954 -16.457 14.438 1.00 20.36 C ATOM 895 O ALA A 131 28.169 -15.993 15.574 1.00 20.62 O ATOM 896 CB ALA A 131 29.121 -18.656 14.058 1.00 21.24 C ATOM 0 H ALA A 131 30.915 -16.985 14.301 1.00 22.55 H new ATOM 0 HA ALA A 131 28.845 -17.167 12.695 1.00 21.76 H new ATOM 0 HB1 ALA A 131 28.267 -19.083 13.887 1.00 21.24 H new ATOM 0 HB2 ALA A 131 29.814 -19.104 13.548 1.00 21.24 H new ATOM 0 HB3 ALA A 131 29.327 -18.715 15.004 1.00 21.24 H new ATOM 897 N PRO A 132 26.764 -16.321 13.840 1.00 18.38 N ATOM 898 CA PRO A 132 25.706 -15.627 14.583 1.00 16.60 C ATOM 899 C PRO A 132 25.288 -16.393 15.850 1.00 15.53 C ATOM 900 O PRO A 132 25.300 -17.620 15.890 1.00 15.19 O ATOM 901 CB PRO A 132 24.584 -15.473 13.559 1.00 16.11 C ATOM 902 CG PRO A 132 24.876 -16.497 12.493 1.00 16.58 C ATOM 903 CD PRO A 132 26.339 -16.787 12.510 1.00 16.35 C ATOM 0 HA PRO A 132 25.988 -14.767 14.932 1.00 16.60 H new ATOM 0 HB2 PRO A 132 23.716 -15.627 13.964 1.00 16.11 H new ATOM 0 HB3 PRO A 132 24.569 -14.577 13.189 1.00 16.11 H new ATOM 0 HG2 PRO A 132 24.369 -17.308 12.655 1.00 16.58 H new ATOM 0 HG3 PRO A 132 24.608 -16.164 11.622 1.00 16.58 H new ATOM 0 HD2 PRO A 132 26.517 -17.733 12.389 1.00 16.35 H new ATOM 0 HD3 PRO A 132 26.805 -16.317 11.801 1.00 16.35 H new ATOM 904 N GLY A 133 24.944 -15.649 16.896 1.00 15.36 N ATOM 905 CA GLY A 133 24.556 -16.255 18.164 1.00 17.70 C ATOM 906 C GLY A 133 25.709 -16.323 19.146 1.00 18.28 C ATOM 907 O GLY A 133 25.549 -16.479 20.358 1.00 18.34 O ATOM 0 H GLY A 133 24.929 -14.789 16.892 1.00 15.36 H new ATOM 0 HA2 GLY A 133 23.830 -15.744 18.555 1.00 17.70 H new ATOM 0 HA3 GLY A 133 24.218 -17.150 18.002 1.00 17.70 H new ATOM 908 N THR A 134 26.907 -16.214 18.607 1.00 18.40 N ATOM 909 CA THR A 134 28.098 -16.230 19.418 1.00 17.88 C ATOM 910 C THR A 134 27.959 -15.074 20.376 1.00 17.02 C ATOM 911 O THR A 134 27.518 -13.999 20.003 1.00 17.39 O ATOM 912 CB THR A 134 29.312 -16.048 18.524 1.00 18.52 C ATOM 913 OG1 THR A 134 29.485 -17.245 17.758 1.00 17.81 O ATOM 914 CG2 THR A 134 30.550 -15.726 19.343 1.00 17.55 C ATOM 0 H THR A 134 27.050 -16.129 17.763 1.00 18.40 H new ATOM 0 HA THR A 134 28.209 -17.065 19.898 1.00 17.88 H new ATOM 0 HB THR A 134 29.174 -15.297 17.926 1.00 18.52 H new ATOM 0 HG1 THR A 134 29.152 -17.140 16.994 1.00 17.81 H new ATOM 0 HG21 THR A 134 31.310 -15.615 18.751 1.00 17.55 H new ATOM 0 HG22 THR A 134 30.405 -14.906 19.840 1.00 17.55 H new ATOM 0 HG23 THR A 134 30.727 -16.452 19.962 1.00 17.55 H new ATOM 915 N LEU A 135 28.324 -15.292 21.623 1.00 16.72 N ATOM 916 CA LEU A 135 28.228 -14.225 22.594 1.00 16.92 C ATOM 917 C LEU A 135 29.574 -13.522 22.721 1.00 15.70 C ATOM 918 O LEU A 135 30.594 -14.139 22.971 1.00 16.66 O ATOM 919 CB LEU A 135 27.789 -14.781 23.950 1.00 17.17 C ATOM 920 CG LEU A 135 26.291 -15.076 24.091 1.00 19.28 C ATOM 921 CD1 LEU A 135 26.063 -15.811 25.407 1.00 19.74 C ATOM 922 CD2 LEU A 135 25.481 -13.797 24.068 1.00 16.99 C ATOM 0 H LEU A 135 28.626 -16.039 21.925 1.00 16.72 H new ATOM 0 HA LEU A 135 27.564 -13.584 22.295 1.00 16.92 H new ATOM 0 HB2 LEU A 135 28.281 -15.599 24.121 1.00 17.17 H new ATOM 0 HB3 LEU A 135 28.044 -14.148 24.639 1.00 17.17 H new ATOM 0 HG LEU A 135 26.002 -15.624 23.345 1.00 19.28 H new ATOM 0 HD11 LEU A 135 25.118 -16.005 25.510 1.00 19.74 H new ATOM 0 HD12 LEU A 135 26.565 -16.641 25.405 1.00 19.74 H new ATOM 0 HD13 LEU A 135 26.361 -15.255 26.144 1.00 19.74 H new ATOM 0 HD21 LEU A 135 24.539 -14.009 24.158 1.00 16.99 H new ATOM 0 HD22 LEU A 135 25.756 -13.226 24.803 1.00 16.99 H new ATOM 0 HD23 LEU A 135 25.629 -13.335 23.228 1.00 16.99 H new ATOM 923 N CYS A 136 29.578 -12.223 22.521 1.00 14.77 N ATOM 924 CA CYS A 136 30.817 -11.494 22.630 1.00 14.63 C ATOM 925 C CYS A 136 30.662 -10.508 23.763 1.00 15.21 C ATOM 926 O CYS A 136 29.553 -10.121 24.129 1.00 14.42 O ATOM 927 CB CYS A 136 31.124 -10.786 21.324 1.00 15.39 C ATOM 928 SG CYS A 136 31.248 -11.926 19.911 1.00 15.67 S ATOM 0 H CYS A 136 28.887 -11.751 22.324 1.00 14.77 H new ATOM 0 HA CYS A 136 31.558 -12.093 22.812 1.00 14.63 H new ATOM 0 HB2 CYS A 136 30.431 -10.132 21.146 1.00 15.39 H new ATOM 0 HB3 CYS A 136 31.958 -10.298 21.414 1.00 15.39 H new ATOM 929 N ASP A 137 31.798 -10.132 24.326 1.00 15.11 N ATOM 930 CA ASP A 137 31.887 -9.213 25.460 1.00 15.45 C ATOM 931 C ASP A 137 32.271 -7.785 25.027 1.00 15.04 C ATOM 932 O ASP A 137 33.232 -7.579 24.271 1.00 16.45 O ATOM 933 CB ASP A 137 32.921 -9.769 26.460 1.00 17.43 C ATOM 934 CG ASP A 137 32.856 -9.099 27.803 1.00 21.33 C ATOM 935 OD1 ASP A 137 31.917 -9.360 28.565 1.00 23.53 O ATOM 936 OD2 ASP A 137 33.747 -8.300 28.105 1.00 25.00 O ATOM 0 H ASP A 137 32.565 -10.410 24.054 1.00 15.11 H new ATOM 0 HA ASP A 137 31.013 -9.150 25.875 1.00 15.45 H new ATOM 0 HB2 ASP A 137 32.776 -10.722 26.572 1.00 17.43 H new ATOM 0 HB3 ASP A 137 33.812 -9.659 26.092 1.00 17.43 H new ATOM 937 N VAL A 138 31.492 -6.798 25.470 1.00 13.82 N ATOM 938 CA VAL A 138 31.780 -5.398 25.165 1.00 12.54 C ATOM 939 C VAL A 138 31.845 -4.697 26.519 1.00 12.72 C ATOM 940 O VAL A 138 31.106 -5.043 27.440 1.00 11.80 O ATOM 941 CB VAL A 138 30.701 -4.755 24.199 1.00 12.54 C ATOM 942 CG1 VAL A 138 29.331 -5.044 24.657 1.00 15.27 C ATOM 943 CG2 VAL A 138 30.876 -3.261 24.111 1.00 12.36 C ATOM 0 H VAL A 138 30.789 -6.920 25.951 1.00 13.82 H new ATOM 0 HA VAL A 138 32.614 -5.305 24.679 1.00 12.54 H new ATOM 0 HB VAL A 138 30.836 -5.151 23.324 1.00 12.54 H new ATOM 0 HG11 VAL A 138 28.694 -4.639 24.048 1.00 15.27 H new ATOM 0 HG12 VAL A 138 29.192 -6.004 24.678 1.00 15.27 H new ATOM 0 HG13 VAL A 138 29.204 -4.680 25.547 1.00 15.27 H new ATOM 0 HG21 VAL A 138 30.206 -2.891 23.515 1.00 12.36 H new ATOM 0 HG22 VAL A 138 30.775 -2.871 24.993 1.00 12.36 H new ATOM 0 HG23 VAL A 138 31.760 -3.058 23.768 1.00 12.36 H new ATOM 944 N ALA A 139 32.743 -3.728 26.654 1.00 11.28 N ATOM 945 CA ALA A 139 32.921 -3.039 27.907 1.00 8.64 C ATOM 946 C ALA A 139 33.125 -1.555 27.677 1.00 8.12 C ATOM 947 O ALA A 139 33.505 -1.146 26.598 1.00 9.84 O ATOM 948 CB ALA A 139 34.126 -3.652 28.626 1.00 8.34 C ATOM 0 H ALA A 139 33.260 -3.458 26.022 1.00 11.28 H new ATOM 0 HA ALA A 139 32.127 -3.139 28.456 1.00 8.64 H new ATOM 0 HB1 ALA A 139 34.262 -3.200 29.473 1.00 8.34 H new ATOM 0 HB2 ALA A 139 33.963 -4.595 28.785 1.00 8.34 H new ATOM 0 HB3 ALA A 139 34.918 -3.550 28.075 1.00 8.34 H new ATOM 949 N GLY A 140 32.869 -0.740 28.697 1.00 7.63 N ATOM 950 CA GLY A 140 33.044 0.687 28.548 1.00 6.45 C ATOM 951 C GLY A 140 32.569 1.401 29.778 1.00 8.34 C ATOM 952 O GLY A 140 31.955 0.797 30.668 1.00 8.39 O ATOM 0 H GLY A 140 32.597 -0.996 29.472 1.00 7.63 H new ATOM 0 HA2 GLY A 140 33.979 0.890 28.390 1.00 6.45 H new ATOM 0 HA3 GLY A 140 32.551 1.001 27.774 1.00 6.45 H new ATOM 953 N TRP A 141 32.877 2.686 29.839 1.00 8.74 N ATOM 954 CA TRP A 141 32.450 3.538 30.921 1.00 10.91 C ATOM 955 C TRP A 141 31.393 4.465 30.344 1.00 11.06 C ATOM 956 O TRP A 141 31.146 5.534 30.886 1.00 13.79 O ATOM 957 CB TRP A 141 33.613 4.372 31.442 1.00 10.44 C ATOM 958 CG TRP A 141 34.599 3.612 32.257 1.00 9.32 C ATOM 959 CD1 TRP A 141 34.584 3.416 33.613 1.00 8.83 C ATOM 960 CD2 TRP A 141 35.822 3.034 31.798 1.00 6.79 C ATOM 961 NE1 TRP A 141 35.701 2.779 34.012 1.00 5.99 N ATOM 962 CE2 TRP A 141 36.495 2.523 32.923 1.00 6.75 C ATOM 963 CE3 TRP A 141 36.412 2.909 30.547 1.00 7.78 C ATOM 964 CZ2 TRP A 141 37.736 1.899 32.826 1.00 6.75 C ATOM 965 CZ3 TRP A 141 37.653 2.270 30.439 1.00 6.60 C ATOM 966 CH2 TRP A 141 38.289 1.792 31.592 1.00 8.05 C ATOM 0 H TRP A 141 33.347 3.089 29.242 1.00 8.74 H new ATOM 0 HA TRP A 141 32.109 3.008 31.658 1.00 10.91 H new ATOM 0 HB2 TRP A 141 34.073 4.772 30.688 1.00 10.44 H new ATOM 0 HB3 TRP A 141 33.260 5.100 31.977 1.00 10.44 H new ATOM 0 HD1 TRP A 141 33.897 3.686 34.179 1.00 8.83 H new ATOM 0 HE1 TRP A 141 35.888 2.566 34.824 1.00 5.99 H new ATOM 0 HE3 TRP A 141 35.988 3.245 29.791 1.00 7.78 H new ATOM 0 HZ2 TRP A 141 38.170 1.568 33.579 1.00 6.75 H new ATOM 0 HZ3 TRP A 141 38.053 2.163 29.606 1.00 6.60 H new ATOM 0 HH2 TRP A 141 39.122 1.386 31.508 1.00 8.05 H new ATOM 967 N GLY A 142 30.783 4.080 29.229 1.00 11.66 N ATOM 968 CA GLY A 142 29.749 4.909 28.624 1.00 10.86 C ATOM 969 C GLY A 142 28.468 4.988 29.440 1.00 12.77 C ATOM 970 O GLY A 142 28.294 4.280 30.462 1.00 11.61 O ATOM 0 H GLY A 142 30.951 3.348 28.810 1.00 11.66 H new ATOM 0 HA2 GLY A 142 30.098 5.805 28.498 1.00 10.86 H new ATOM 0 HA3 GLY A 142 29.540 4.559 27.744 1.00 10.86 H new ATOM 971 N ILE A 143 27.526 5.822 29.025 1.00 11.85 N ATOM 972 CA ILE A 143 26.323 5.960 29.829 1.00 12.86 C ATOM 973 C ILE A 143 25.566 4.646 30.095 1.00 12.09 C ATOM 974 O ILE A 143 25.574 3.700 29.314 1.00 10.65 O ATOM 975 CB ILE A 143 25.392 7.073 29.266 1.00 12.95 C ATOM 976 CG1 ILE A 143 24.596 6.529 28.088 1.00 14.45 C ATOM 977 CG2 ILE A 143 26.222 8.320 28.908 1.00 10.43 C ATOM 978 CD1 ILE A 143 23.682 7.557 27.393 1.00 17.79 C ATOM 0 H ILE A 143 27.559 6.300 28.311 1.00 11.85 H new ATOM 0 HA ILE A 143 26.633 6.236 30.706 1.00 12.86 H new ATOM 0 HB ILE A 143 24.750 7.348 29.940 1.00 12.95 H new ATOM 0 HG12 ILE A 143 25.216 6.172 27.433 1.00 14.45 H new ATOM 0 HG13 ILE A 143 24.051 5.788 28.397 1.00 14.45 H new ATOM 0 HG21 ILE A 143 25.636 9.009 28.558 1.00 10.43 H new ATOM 0 HG22 ILE A 143 26.670 8.650 29.703 1.00 10.43 H new ATOM 0 HG23 ILE A 143 26.883 8.087 28.238 1.00 10.43 H new ATOM 0 HD11 ILE A 143 23.214 7.130 26.658 1.00 17.79 H new ATOM 0 HD12 ILE A 143 23.037 7.900 28.031 1.00 17.79 H new ATOM 0 HD13 ILE A 143 24.219 8.289 27.052 1.00 17.79 H new ATOM 979 N VAL A 144 24.903 4.591 31.245 1.00 14.20 N ATOM 980 CA VAL A 144 24.161 3.399 31.664 1.00 14.12 C ATOM 981 C VAL A 144 22.648 3.452 31.484 1.00 14.64 C ATOM 982 O VAL A 144 22.009 2.429 31.547 1.00 15.05 O ATOM 983 CB VAL A 144 24.482 3.054 33.120 1.00 11.98 C ATOM 984 CG1 VAL A 144 25.871 2.498 33.200 1.00 13.60 C ATOM 985 CG2 VAL A 144 24.374 4.278 33.944 1.00 11.77 C ATOM 0 H VAL A 144 24.869 5.242 31.806 1.00 14.20 H new ATOM 0 HA VAL A 144 24.468 2.708 31.056 1.00 14.12 H new ATOM 0 HB VAL A 144 23.856 2.391 33.451 1.00 11.98 H new ATOM 0 HG11 VAL A 144 26.079 2.278 34.121 1.00 13.60 H new ATOM 0 HG12 VAL A 144 25.931 1.698 32.655 1.00 13.60 H new ATOM 0 HG13 VAL A 144 26.503 3.158 32.875 1.00 13.60 H new ATOM 0 HG21 VAL A 144 24.577 4.065 34.868 1.00 11.77 H new ATOM 0 HG22 VAL A 144 25.002 4.943 33.621 1.00 11.77 H new ATOM 0 HG23 VAL A 144 23.472 4.630 33.884 1.00 11.77 H new ATOM 986 N ASN A 145 22.087 4.639 31.298 1.00 16.12 N ATOM 987 CA ASN A 145 20.660 4.726 31.078 1.00 18.93 C ATOM 988 C ASN A 145 20.333 5.820 30.074 1.00 21.58 C ATOM 989 O ASN A 145 21.223 6.424 29.481 1.00 22.93 O ATOM 990 CB ASN A 145 19.940 4.988 32.391 1.00 19.35 C ATOM 991 CG ASN A 145 20.615 6.052 33.191 1.00 23.01 C ATOM 992 OD1 ASN A 145 21.204 6.973 32.631 1.00 27.00 O ATOM 993 ND2 ASN A 145 20.561 5.936 34.508 1.00 23.33 N ATOM 0 H ASN A 145 22.507 5.389 31.296 1.00 16.12 H new ATOM 0 HA ASN A 145 20.357 3.879 30.716 1.00 18.93 H new ATOM 0 HB2 ASN A 145 19.024 5.251 32.211 1.00 19.35 H new ATOM 0 HB3 ASN A 145 19.903 4.169 32.909 1.00 19.35 H new ATOM 0 HD21 ASN A 145 20.948 6.520 35.007 1.00 23.33 H new ATOM 0 HD22 ASN A 145 20.139 5.277 34.865 1.00 23.33 H new ATOM 994 N HIS A 146 19.045 6.090 29.887 1.00 23.78 N ATOM 995 CA HIS A 146 18.602 7.117 28.946 1.00 24.91 C ATOM 996 C HIS A 146 18.686 8.532 29.529 1.00 25.34 C ATOM 997 O HIS A 146 18.573 9.532 28.803 1.00 26.11 O ATOM 998 CB HIS A 146 17.180 6.792 28.472 1.00 27.42 C ATOM 999 CG HIS A 146 17.115 5.628 27.524 1.00 29.34 C ATOM 1000 ND1 HIS A 146 15.927 5.121 27.046 1.00 31.07 N ATOM 1001 CD2 HIS A 146 18.093 4.879 26.962 1.00 30.53 C ATOM 1002 CE1 HIS A 146 16.177 4.110 26.232 1.00 30.54 C ATOM 1003 NE2 HIS A 146 17.483 3.942 26.162 1.00 30.07 N ATOM 0 H HIS A 146 18.406 5.687 30.298 1.00 23.78 H new ATOM 0 HA HIS A 146 19.206 7.108 28.187 1.00 24.91 H new ATOM 0 HB2 HIS A 146 16.625 6.602 29.244 1.00 27.42 H new ATOM 0 HB3 HIS A 146 16.805 7.574 28.038 1.00 27.42 H new ATOM 0 HD2 HIS A 146 19.008 4.980 27.093 1.00 30.53 H new ATOM 0 HE1 HIS A 146 15.539 3.603 25.784 1.00 30.54 H new ATOM 0 HE2 HIS A 146 17.887 3.345 25.693 1.00 30.07 H new ATOM 1004 N ALA A 147 18.889 8.623 30.841 1.00 24.74 N ATOM 1005 CA ALA A 147 19.013 9.930 31.468 1.00 24.06 C ATOM 1006 C ALA A 147 20.424 10.454 31.206 1.00 23.32 C ATOM 1007 O ALA A 147 20.702 11.638 31.423 1.00 23.13 O ATOM 1008 CB ALA A 147 18.745 9.838 32.974 1.00 22.35 C ATOM 0 H ALA A 147 18.957 7.952 31.375 1.00 24.74 H new ATOM 0 HA ALA A 147 18.357 10.538 31.092 1.00 24.06 H new ATOM 0 HB1 ALA A 147 18.832 10.718 33.373 1.00 22.35 H new ATOM 0 HB2 ALA A 147 17.847 9.504 33.123 1.00 22.35 H new ATOM 0 HB3 ALA A 147 19.386 9.234 33.381 1.00 22.35 H new ATOM 1009 N GLY A 149 21.312 9.569 30.747 1.00 23.94 N ATOM 1010 CA GLY A 149 22.679 9.963 30.443 1.00 23.20 C ATOM 1011 C GLY A 149 23.611 9.760 31.607 1.00 24.28 C ATOM 1012 O GLY A 149 24.652 10.400 31.699 1.00 26.17 O ATOM 0 H GLY A 149 21.139 8.738 30.607 1.00 23.94 H new ATOM 0 HA2 GLY A 149 22.999 9.451 29.684 1.00 23.20 H new ATOM 0 HA3 GLY A 149 22.692 10.897 30.181 1.00 23.20 H new ATOM 1013 N ARG A 150 23.271 8.858 32.507 1.00 24.09 N ATOM 1014 CA ARG A 150 24.125 8.651 33.664 1.00 25.61 C ATOM 1015 C ARG A 150 25.406 7.902 33.237 1.00 24.42 C ATOM 1016 O ARG A 150 25.358 6.967 32.424 1.00 24.58 O ATOM 1017 CB ARG A 150 23.349 7.871 34.740 1.00 27.35 C ATOM 1018 CG ARG A 150 23.894 8.097 36.152 1.00 31.12 C ATOM 1019 CD ARG A 150 24.533 6.844 36.754 1.00 36.35 C ATOM 1020 NE ARG A 150 23.743 6.267 37.852 1.00 42.98 N ATOM 1021 CZ ARG A 150 24.117 6.294 39.138 1.00 46.16 C ATOM 1022 NH1 ARG A 150 25.270 6.866 39.510 1.00 46.97 N ATOM 1023 NH2 ARG A 150 23.397 5.768 40.139 1.00 45.98 N ATOM 0 H ARG A 150 22.568 8.364 32.472 1.00 24.09 H new ATOM 0 HA ARG A 150 24.389 9.505 34.040 1.00 25.61 H new ATOM 0 HB2 ARG A 150 22.416 8.134 34.713 1.00 27.35 H new ATOM 0 HB3 ARG A 150 23.383 6.924 34.533 1.00 27.35 H new ATOM 0 HG2 ARG A 150 24.551 8.810 36.129 1.00 31.12 H new ATOM 0 HG3 ARG A 150 23.172 8.395 36.728 1.00 31.12 H new ATOM 0 HD2 ARG A 150 24.645 6.178 36.058 1.00 36.35 H new ATOM 0 HD3 ARG A 150 25.419 7.064 37.081 1.00 36.35 H new ATOM 0 HE ARG A 150 22.995 5.889 37.657 1.00 42.98 H new ATOM 0 HH11 ARG A 150 25.783 7.223 38.919 1.00 46.97 H new ATOM 0 HH12 ARG A 150 25.497 6.876 40.339 1.00 46.97 H new ATOM 0 HH21 ARG A 150 22.646 5.384 39.973 1.00 45.98 H new ATOM 0 HH22 ARG A 150 23.687 5.814 40.947 1.00 45.98 H new ATOM 1024 N ARG A 151 26.498 8.316 33.722 1.00 24.12 N ATOM 1025 CA ARG A 151 27.874 7.806 33.490 1.00 23.82 C ATOM 1026 C ARG A 151 28.461 7.042 34.689 1.00 20.25 C ATOM 1027 O ARG A 151 28.640 7.606 35.780 1.00 19.97 O ATOM 1028 CB ARG A 151 28.844 8.969 33.264 1.00 25.36 C ATOM 1029 CG ARG A 151 28.645 9.668 31.918 1.00 30.91 C ATOM 1030 CD ARG A 151 29.680 10.765 31.658 1.00 34.86 C ATOM 1031 NE ARG A 151 30.260 10.698 30.308 1.00 41.85 N ATOM 1032 CZ ARG A 151 31.524 11.037 30.017 1.00 44.50 C ATOM 1033 NH1 ARG A 151 32.360 11.470 30.970 1.00 43.07 N ATOM 1034 NH2 ARG A 151 32.051 10.976 28.786 1.00 45.73 N ATOM 0 H ARG A 151 26.505 8.981 34.267 1.00 24.12 H new ATOM 0 HA ARG A 151 27.788 7.217 32.724 1.00 23.82 H new ATOM 0 HB2 ARG A 151 28.734 9.617 33.977 1.00 25.36 H new ATOM 0 HB3 ARG A 151 29.754 8.638 33.318 1.00 25.36 H new ATOM 0 HG2 ARG A 151 28.692 9.010 31.207 1.00 30.91 H new ATOM 0 HG3 ARG A 151 27.756 10.055 31.888 1.00 30.91 H new ATOM 0 HD2 ARG A 151 29.264 11.632 31.783 1.00 34.86 H new ATOM 0 HD3 ARG A 151 30.391 10.694 32.314 1.00 34.86 H new ATOM 0 HE ARG A 151 29.757 10.425 29.666 1.00 41.85 H new ATOM 0 HH11 ARG A 151 32.089 11.534 31.784 1.00 43.07 H new ATOM 0 HH12 ARG A 151 33.168 11.684 30.768 1.00 43.07 H new ATOM 0 HH21 ARG A 151 31.571 10.707 28.125 1.00 45.73 H new ATOM 0 HH22 ARG A 151 32.869 11.206 28.657 1.00 45.73 H new ATOM 1035 N PRO A 152 28.811 5.740 34.563 1.00 17.70 N ATOM 1036 CA PRO A 152 29.415 4.968 35.628 1.00 16.48 C ATOM 1037 C PRO A 152 30.781 5.502 35.899 1.00 17.33 C ATOM 1038 O PRO A 152 31.441 6.123 35.014 1.00 18.71 O ATOM 1039 CB PRO A 152 29.435 3.569 35.076 1.00 16.57 C ATOM 1040 CG PRO A 152 29.435 3.737 33.583 1.00 17.60 C ATOM 1041 CD PRO A 152 28.648 4.988 33.316 1.00 17.38 C ATOM 0 HA PRO A 152 28.944 5.004 36.475 1.00 16.48 H new ATOM 0 HB2 PRO A 152 30.221 3.085 35.375 1.00 16.57 H new ATOM 0 HB3 PRO A 152 28.662 3.064 35.372 1.00 16.57 H new ATOM 0 HG2 PRO A 152 30.339 3.814 33.241 1.00 17.60 H new ATOM 0 HG3 PRO A 152 29.031 2.971 33.146 1.00 17.60 H new ATOM 0 HD2 PRO A 152 28.994 5.476 32.553 1.00 17.38 H new ATOM 0 HD3 PRO A 152 27.716 4.795 33.130 1.00 17.38 H new ATOM 1042 N ASP A 153 31.269 5.238 37.142 1.00 15.67 N ATOM 1043 CA ASP A 153 32.627 5.633 37.579 1.00 14.58 C ATOM 1044 C ASP A 153 33.603 4.481 37.330 1.00 12.54 C ATOM 1045 O ASP A 153 34.801 4.697 37.091 1.00 12.07 O ATOM 1046 CB ASP A 153 32.665 5.966 39.075 1.00 13.55 C ATOM 1047 CG ASP A 153 34.095 5.996 39.638 1.00 13.83 C ATOM 1048 OD1 ASP A 153 34.826 7.052 39.497 1.00 13.40 O ATOM 1049 OD2 ASP A 153 34.573 4.964 40.250 1.00 13.02 O ATOM 0 H ASP A 153 30.817 4.826 37.747 1.00 15.67 H new ATOM 0 HA ASP A 153 32.877 6.420 37.071 1.00 14.58 H new ATOM 0 HB2 ASP A 153 32.245 6.828 39.222 1.00 13.55 H new ATOM 0 HB3 ASP A 153 32.143 5.310 39.562 1.00 13.55 H new ATOM 1050 N SER A 154 33.048 3.280 37.395 1.00 12.50 N ATOM 1051 CA SER A 154 33.805 2.037 37.181 1.00 13.58 C ATOM 1052 C SER A 154 33.328 1.348 35.896 1.00 13.82 C ATOM 1053 O SER A 154 32.253 1.658 35.365 1.00 14.68 O ATOM 1054 CB SER A 154 33.634 1.101 38.377 1.00 13.98 C ATOM 1055 OG SER A 154 32.385 0.438 38.301 1.00 21.35 O ATOM 0 H SER A 154 32.215 3.154 37.566 1.00 12.50 H new ATOM 0 HA SER A 154 34.746 2.254 37.090 1.00 13.58 H new ATOM 0 HB2 SER A 154 34.353 0.450 38.393 1.00 13.98 H new ATOM 0 HB3 SER A 154 33.690 1.606 39.203 1.00 13.98 H new ATOM 0 HG SER A 154 32.045 0.391 39.068 1.00 21.35 H new ATOM 1056 N LEU A 155 34.156 0.426 35.463 1.00 12.91 N ATOM 1057 CA LEU A 155 33.988 -0.321 34.206 1.00 12.31 C ATOM 1058 C LEU A 155 32.779 -1.253 34.196 1.00 12.69 C ATOM 1059 O LEU A 155 32.587 -2.075 35.092 1.00 13.44 O ATOM 1060 CB LEU A 155 35.238 -1.183 33.979 1.00 10.08 C ATOM 1061 CG LEU A 155 35.297 -1.850 32.604 1.00 9.82 C ATOM 1062 CD1 LEU A 155 35.263 -0.849 31.448 1.00 7.48 C ATOM 1063 CD2 LEU A 155 36.573 -2.675 32.398 1.00 8.38 C ATOM 0 H LEU A 155 34.862 0.198 35.898 1.00 12.91 H new ATOM 0 HA LEU A 155 33.852 0.340 33.510 1.00 12.31 H new ATOM 0 HB2 LEU A 155 36.026 -0.629 34.093 1.00 10.08 H new ATOM 0 HB3 LEU A 155 35.273 -1.870 34.663 1.00 10.08 H new ATOM 0 HG LEU A 155 34.508 -2.415 32.595 1.00 9.82 H new ATOM 0 HD11 LEU A 155 35.303 -1.327 30.605 1.00 7.48 H new ATOM 0 HD12 LEU A 155 34.442 -0.335 31.489 1.00 7.48 H new ATOM 0 HD13 LEU A 155 36.023 -0.250 31.516 1.00 7.48 H new ATOM 0 HD21 LEU A 155 36.561 -3.075 31.514 1.00 8.38 H new ATOM 0 HD22 LEU A 155 37.348 -2.098 32.481 1.00 8.38 H new ATOM 0 HD23 LEU A 155 36.618 -3.375 33.068 1.00 8.38 H new ATOM 1064 N GLN A 156 31.998 -1.158 33.129 1.00 11.67 N ATOM 1065 CA GLN A 156 30.825 -1.997 32.971 1.00 11.88 C ATOM 1066 C GLN A 156 31.043 -2.870 31.741 1.00 12.51 C ATOM 1067 O GLN A 156 31.939 -2.615 30.925 1.00 12.58 O ATOM 1068 CB GLN A 156 29.581 -1.154 32.707 1.00 11.77 C ATOM 1069 CG GLN A 156 29.362 -0.067 33.756 1.00 15.79 C ATOM 1070 CD GLN A 156 28.640 -0.583 34.999 1.00 16.93 C ATOM 1071 OE1 GLN A 156 27.523 -1.088 34.895 1.00 20.82 O ATOM 1072 NE2 GLN A 156 29.217 -0.490 36.181 1.00 15.91 N ATOM 0 H GLN A 156 32.133 -0.609 32.481 1.00 11.67 H new ATOM 0 HA GLN A 156 30.698 -2.516 33.781 1.00 11.88 H new ATOM 0 HB2 GLN A 156 29.656 -0.742 31.832 1.00 11.77 H new ATOM 0 HB3 GLN A 156 28.803 -1.733 32.682 1.00 11.77 H new ATOM 0 HG2 GLN A 156 30.220 0.304 34.016 1.00 15.79 H new ATOM 0 HG3 GLN A 156 28.847 0.656 33.364 1.00 15.79 H new ATOM 0 HE21 GLN A 156 29.998 -0.137 36.252 1.00 15.91 H new ATOM 0 HE22 GLN A 156 28.812 -0.783 36.881 1.00 15.91 H new ATOM 1073 N HIS A 157 30.226 -3.881 31.614 1.00 12.58 N ATOM 1074 CA HIS A 157 30.308 -4.784 30.466 1.00 13.94 C ATOM 1075 C HIS A 157 29.013 -5.562 30.337 1.00 14.46 C ATOM 1076 O HIS A 157 28.139 -5.500 31.215 1.00 13.81 O ATOM 1077 CB HIS A 157 31.480 -5.750 30.633 1.00 14.89 C ATOM 1078 CG HIS A 157 31.131 -6.972 31.477 1.00 16.74 C ATOM 1079 ND1 HIS A 157 31.053 -8.246 30.926 1.00 18.28 N ATOM 1080 CD2 HIS A 157 30.849 -7.106 32.797 1.00 18.18 C ATOM 1081 CE1 HIS A 157 30.737 -9.090 31.891 1.00 19.01 C ATOM 1082 NE2 HIS A 157 30.612 -8.425 33.013 1.00 18.32 N ATOM 0 H HIS A 157 29.607 -4.075 32.179 1.00 12.58 H new ATOM 0 HA HIS A 157 30.450 -4.260 29.663 1.00 13.94 H new ATOM 0 HB2 HIS A 157 31.779 -6.043 29.758 1.00 14.89 H new ATOM 0 HB3 HIS A 157 32.223 -5.281 31.044 1.00 14.89 H new ATOM 0 HD1 HIS A 157 31.187 -8.449 30.101 1.00 18.28 H new ATOM 0 HD2 HIS A 157 30.823 -6.426 33.431 1.00 18.18 H new ATOM 0 HE1 HIS A 157 30.622 -10.007 31.791 1.00 19.01 H new ATOM 1083 N VAL A 158 28.926 -6.273 29.240 1.00 14.96 N ATOM 1084 CA VAL A 158 27.747 -7.069 28.938 1.00 15.13 C ATOM 1085 C VAL A 158 28.036 -8.030 27.804 1.00 16.36 C ATOM 1086 O VAL A 158 28.755 -7.678 26.883 1.00 18.62 O ATOM 1087 CB VAL A 158 26.593 -6.132 28.574 1.00 13.47 C ATOM 1088 CG1 VAL A 158 26.750 -5.493 27.195 1.00 12.71 C ATOM 1089 CG2 VAL A 158 25.233 -6.830 28.563 1.00 16.04 C ATOM 0 H VAL A 158 29.544 -6.314 28.644 1.00 14.96 H new ATOM 0 HA VAL A 158 27.500 -7.593 29.716 1.00 15.13 H new ATOM 0 HB VAL A 158 26.627 -5.458 29.270 1.00 13.47 H new ATOM 0 HG11 VAL A 158 25.993 -4.912 27.019 1.00 12.71 H new ATOM 0 HG12 VAL A 158 27.569 -4.973 27.170 1.00 12.71 H new ATOM 0 HG13 VAL A 158 26.788 -6.187 26.519 1.00 12.71 H new ATOM 0 HG21 VAL A 158 24.543 -6.191 28.327 1.00 16.04 H new ATOM 0 HG22 VAL A 158 25.243 -7.549 27.912 1.00 16.04 H new ATOM 0 HG23 VAL A 158 25.049 -7.194 29.443 1.00 16.04 H new ATOM 1090 N LEU A 159 27.544 -9.260 27.863 1.00 16.89 N ATOM 1091 CA LEU A 159 27.766 -10.197 26.774 1.00 18.03 C ATOM 1092 C LEU A 159 26.634 -9.948 25.797 1.00 18.04 C ATOM 1093 O LEU A 159 25.515 -9.805 26.219 1.00 18.65 O ATOM 1094 CB LEU A 159 27.721 -11.632 27.271 1.00 17.71 C ATOM 1095 CG LEU A 159 28.825 -12.048 28.229 1.00 18.25 C ATOM 1096 CD1 LEU A 159 28.727 -13.529 28.449 1.00 17.72 C ATOM 1097 CD2 LEU A 159 30.192 -11.716 27.677 1.00 20.25 C ATOM 0 H LEU A 159 27.083 -9.569 28.519 1.00 16.89 H new ATOM 0 HA LEU A 159 28.638 -10.070 26.369 1.00 18.03 H new ATOM 0 HB2 LEU A 159 26.868 -11.776 27.709 1.00 17.71 H new ATOM 0 HB3 LEU A 159 27.748 -12.222 26.501 1.00 17.71 H new ATOM 0 HG LEU A 159 28.714 -11.564 29.062 1.00 18.25 H new ATOM 0 HD11 LEU A 159 29.426 -13.813 29.059 1.00 17.72 H new ATOM 0 HD12 LEU A 159 27.860 -13.743 28.828 1.00 17.72 H new ATOM 0 HD13 LEU A 159 28.832 -13.990 27.602 1.00 17.72 H new ATOM 0 HD21 LEU A 159 30.873 -11.993 28.310 1.00 20.25 H new ATOM 0 HD22 LEU A 159 30.324 -12.182 26.836 1.00 20.25 H new ATOM 0 HD23 LEU A 159 30.258 -10.760 27.530 1.00 20.25 H new ATOM 1098 N LEU A 160 26.924 -9.909 24.501 1.00 18.62 N ATOM 1099 CA LEU A 160 25.893 -9.657 23.493 1.00 18.03 C ATOM 1100 C LEU A 160 26.028 -10.654 22.360 1.00 17.72 C ATOM 1101 O LEU A 160 27.114 -10.949 21.931 1.00 17.33 O ATOM 1102 CB LEU A 160 26.048 -8.227 22.926 1.00 18.73 C ATOM 1103 CG LEU A 160 25.859 -7.034 23.864 1.00 19.34 C ATOM 1104 CD1 LEU A 160 26.069 -5.699 23.138 1.00 18.18 C ATOM 1105 CD2 LEU A 160 24.470 -7.113 24.469 1.00 21.58 C ATOM 0 H LEU A 160 27.714 -10.026 24.181 1.00 18.62 H new ATOM 0 HA LEU A 160 25.021 -9.749 23.908 1.00 18.03 H new ATOM 0 HB2 LEU A 160 26.936 -8.159 22.541 1.00 18.73 H new ATOM 0 HB3 LEU A 160 25.415 -8.130 22.198 1.00 18.73 H new ATOM 0 HG LEU A 160 26.527 -7.073 24.566 1.00 19.34 H new ATOM 0 HD11 LEU A 160 25.941 -4.967 23.762 1.00 18.18 H new ATOM 0 HD12 LEU A 160 26.969 -5.664 22.779 1.00 18.18 H new ATOM 0 HD13 LEU A 160 25.429 -5.620 22.413 1.00 18.18 H new ATOM 0 HD21 LEU A 160 24.334 -6.362 25.068 1.00 21.58 H new ATOM 0 HD22 LEU A 160 23.807 -7.086 23.762 1.00 21.58 H new ATOM 0 HD23 LEU A 160 24.380 -7.942 24.965 1.00 21.58 H new ATOM 1106 N PRO A 161 24.914 -11.155 21.791 1.00 18.64 N ATOM 1107 CA PRO A 161 24.958 -12.140 20.731 1.00 18.16 C ATOM 1108 C PRO A 161 25.228 -11.449 19.438 1.00 17.58 C ATOM 1109 O PRO A 161 24.720 -10.386 19.133 1.00 17.90 O ATOM 1110 CB PRO A 161 23.593 -12.769 20.782 1.00 18.29 C ATOM 1111 CG PRO A 161 22.704 -11.726 21.398 1.00 19.96 C ATOM 1112 CD PRO A 161 23.575 -10.966 22.356 1.00 19.34 C ATOM 0 HA PRO A 161 25.655 -12.808 20.824 1.00 18.16 H new ATOM 0 HB2 PRO A 161 23.286 -13.012 19.895 1.00 18.29 H new ATOM 0 HB3 PRO A 161 23.601 -13.581 21.312 1.00 18.29 H new ATOM 0 HG2 PRO A 161 22.335 -11.138 20.720 1.00 19.96 H new ATOM 0 HG3 PRO A 161 21.954 -12.135 21.858 1.00 19.96 H new ATOM 0 HD2 PRO A 161 23.331 -10.028 22.399 1.00 19.34 H new ATOM 0 HD3 PRO A 161 23.511 -11.317 23.258 1.00 19.34 H new ATOM 1113 N VAL A 162 26.023 -12.107 18.539 1.00 17.38 N ATOM 1114 CA VAL A 162 26.316 -11.555 17.230 1.00 16.99 C ATOM 1115 C VAL A 162 25.139 -11.837 16.316 1.00 19.11 C ATOM 1116 O VAL A 162 24.573 -12.915 16.357 1.00 19.00 O ATOM 1117 CB VAL A 162 27.576 -12.178 16.633 1.00 15.75 C ATOM 1118 CG1 VAL A 162 27.719 -11.797 15.155 1.00 9.27 C ATOM 1119 CG2 VAL A 162 28.747 -11.722 17.420 1.00 13.71 C ATOM 0 H VAL A 162 26.389 -12.870 18.692 1.00 17.38 H new ATOM 0 HA VAL A 162 26.466 -10.601 17.319 1.00 16.99 H new ATOM 0 HB VAL A 162 27.518 -13.145 16.676 1.00 15.75 H new ATOM 0 HG11 VAL A 162 28.523 -12.201 14.793 1.00 9.27 H new ATOM 0 HG12 VAL A 162 26.947 -12.117 14.662 1.00 9.27 H new ATOM 0 HG13 VAL A 162 27.777 -10.832 15.074 1.00 9.27 H new ATOM 0 HG21 VAL A 162 29.556 -12.111 17.052 1.00 13.71 H new ATOM 0 HG22 VAL A 162 28.807 -10.755 17.381 1.00 13.71 H new ATOM 0 HG23 VAL A 162 28.646 -12.002 18.343 1.00 13.71 H new ATOM 1120 N LEU A 163 24.795 -10.889 15.456 1.00 19.91 N ATOM 1121 CA LEU A 163 23.673 -11.031 14.553 1.00 21.57 C ATOM 1122 C LEU A 163 24.168 -11.275 13.146 1.00 22.70 C ATOM 1123 O LEU A 163 25.065 -10.581 12.715 1.00 23.91 O ATOM 1124 CB LEU A 163 22.894 -9.730 14.582 1.00 23.63 C ATOM 1125 CG LEU A 163 21.438 -9.692 14.990 1.00 23.81 C ATOM 1126 CD1 LEU A 163 20.775 -8.554 14.224 1.00 24.68 C ATOM 1127 CD2 LEU A 163 20.759 -11.041 14.698 1.00 25.21 C ATOM 0 H LEU A 163 25.212 -10.140 15.382 1.00 19.91 H new ATOM 0 HA LEU A 163 23.118 -11.779 14.824 1.00 21.57 H new ATOM 0 HB2 LEU A 163 23.370 -9.129 15.177 1.00 23.63 H new ATOM 0 HB3 LEU A 163 22.948 -9.349 13.692 1.00 23.63 H new ATOM 0 HG LEU A 163 21.353 -9.538 15.944 1.00 23.81 H new ATOM 0 HD11 LEU A 163 19.837 -8.504 14.466 1.00 24.68 H new ATOM 0 HD12 LEU A 163 21.211 -7.717 14.447 1.00 24.68 H new ATOM 0 HD13 LEU A 163 20.855 -8.716 13.271 1.00 24.68 H new ATOM 0 HD21 LEU A 163 19.827 -10.999 14.965 1.00 25.21 H new ATOM 0 HD22 LEU A 163 20.814 -11.233 13.749 1.00 25.21 H new ATOM 0 HD23 LEU A 163 21.206 -11.743 15.196 1.00 25.21 H new ATOM 1128 N ASP A 164 23.572 -12.210 12.408 1.00 22.27 N ATOM 1129 CA ASP A 164 24.011 -12.441 11.030 1.00 22.93 C ATOM 1130 C ASP A 164 23.807 -11.147 10.225 1.00 23.29 C ATOM 1131 O ASP A 164 22.840 -10.423 10.468 1.00 22.95 O ATOM 1132 CB ASP A 164 23.220 -13.609 10.422 1.00 23.76 C ATOM 1133 CG ASP A 164 21.724 -13.349 10.401 1.00 22.55 C ATOM 1134 OD1 ASP A 164 21.042 -13.573 11.420 1.00 22.53 O ATOM 1135 OD2 ASP A 164 21.210 -12.911 9.353 1.00 22.20 O ATOM 0 H ASP A 164 22.927 -12.711 12.677 1.00 22.27 H new ATOM 0 HA ASP A 164 24.951 -12.678 11.009 1.00 22.93 H new ATOM 0 HB2 ASP A 164 23.530 -13.770 9.517 1.00 23.76 H new ATOM 0 HB3 ASP A 164 23.398 -14.416 10.930 1.00 23.76 H new ATOM 1136 N ARG A 165 24.698 -10.840 9.281 1.00 23.79 N ATOM 1137 CA ARG A 165 24.571 -9.597 8.525 1.00 24.66 C ATOM 1138 C ARG A 165 23.271 -9.364 7.768 1.00 25.48 C ATOM 1139 O ARG A 165 22.740 -8.251 7.768 1.00 26.31 O ATOM 1140 CB ARG A 165 25.733 -9.436 7.546 1.00 24.47 C ATOM 1141 CG ARG A 165 26.437 -10.725 7.191 1.00 24.38 C ATOM 1142 CD ARG A 165 27.671 -10.447 6.306 1.00 25.01 C ATOM 1143 NE ARG A 165 28.868 -10.129 7.086 1.00 21.04 N ATOM 1144 CZ ARG A 165 29.218 -8.897 7.440 1.00 20.42 C ATOM 1145 NH1 ARG A 165 28.476 -7.857 7.078 1.00 20.08 N ATOM 1146 NH2 ARG A 165 30.315 -8.707 8.151 1.00 21.21 N ATOM 0 H ARG A 165 25.372 -11.330 9.067 1.00 23.79 H new ATOM 0 HA ARG A 165 24.578 -8.927 9.226 1.00 24.66 H new ATOM 0 HB2 ARG A 165 25.400 -9.028 6.731 1.00 24.47 H new ATOM 0 HB3 ARG A 165 26.380 -8.822 7.928 1.00 24.47 H new ATOM 0 HG2 ARG A 165 26.711 -11.183 8.001 1.00 24.38 H new ATOM 0 HG3 ARG A 165 25.825 -11.315 6.724 1.00 24.38 H new ATOM 0 HD2 ARG A 165 27.848 -11.223 5.752 1.00 25.01 H new ATOM 0 HD3 ARG A 165 27.475 -9.710 5.707 1.00 25.01 H new ATOM 0 HE ARG A 165 29.376 -10.779 7.330 1.00 21.04 H new ATOM 0 HH11 ARG A 165 27.764 -7.978 6.611 1.00 20.08 H new ATOM 0 HH12 ARG A 165 28.708 -7.062 7.310 1.00 20.08 H new ATOM 0 HH21 ARG A 165 30.799 -9.379 8.383 1.00 21.21 H new ATOM 0 HH22 ARG A 165 30.545 -7.911 8.382 1.00 21.21 H new ATOM 1147 N ALA A 166 22.763 -10.408 7.124 1.00 25.21 N ATOM 1148 CA ALA A 166 21.541 -10.300 6.338 1.00 24.93 C ATOM 1149 C ALA A 166 20.386 -9.740 7.139 1.00 26.62 C ATOM 1150 O ALA A 166 19.516 -9.071 6.580 1.00 26.91 O ATOM 1151 CB ALA A 166 21.161 -11.637 5.795 1.00 23.36 C ATOM 0 H ALA A 166 23.114 -11.193 7.130 1.00 25.21 H new ATOM 0 HA ALA A 166 21.725 -9.683 5.613 1.00 24.93 H new ATOM 0 HB1 ALA A 166 20.347 -11.555 5.274 1.00 23.36 H new ATOM 0 HB2 ALA A 166 21.875 -11.972 5.229 1.00 23.36 H new ATOM 0 HB3 ALA A 166 21.014 -12.254 6.528 1.00 23.36 H new ATOM 1152 N THR A 167 20.375 -10.032 8.441 1.00 27.50 N ATOM 1153 CA THR A 167 19.313 -9.572 9.331 1.00 29.37 C ATOM 1154 C THR A 167 19.507 -8.127 9.759 1.00 29.43 C ATOM 1155 O THR A 167 18.560 -7.397 10.015 1.00 28.91 O ATOM 1156 CB THR A 167 19.244 -10.450 10.599 1.00 30.21 C ATOM 1157 OG1 THR A 167 19.068 -11.821 10.218 1.00 29.53 O ATOM 1158 CG2 THR A 167 18.082 -10.018 11.506 1.00 31.00 C ATOM 0 H THR A 167 20.982 -10.501 8.830 1.00 27.50 H new ATOM 0 HA THR A 167 18.487 -9.641 8.828 1.00 29.37 H new ATOM 0 HB THR A 167 20.073 -10.344 11.092 1.00 30.21 H new ATOM 0 HG1 THR A 167 19.666 -12.038 9.669 1.00 29.53 H new ATOM 0 HG21 THR A 167 18.059 -10.583 12.294 1.00 31.00 H new ATOM 0 HG22 THR A 167 18.207 -9.094 11.774 1.00 31.00 H new ATOM 0 HG23 THR A 167 17.245 -10.104 11.023 1.00 31.00 H new ATOM 1159 N CYS A 168 20.759 -7.727 9.825 1.00 31.01 N ATOM 1160 CA CYS A 168 21.100 -6.394 10.253 1.00 32.25 C ATOM 1161 C CYS A 168 20.873 -5.383 9.148 1.00 34.09 C ATOM 1162 O CYS A 168 20.719 -4.169 9.383 1.00 34.24 O ATOM 1163 CB CYS A 168 22.552 -6.396 10.652 1.00 29.61 C ATOM 1164 SG CYS A 168 22.873 -5.096 11.851 1.00 29.42 S ATOM 0 H CYS A 168 21.434 -8.221 9.623 1.00 31.01 H new ATOM 0 HA CYS A 168 20.534 -6.140 10.999 1.00 32.25 H new ATOM 0 HB2 CYS A 168 22.789 -7.258 11.029 1.00 29.61 H new ATOM 0 HB3 CYS A 168 23.109 -6.266 9.869 1.00 29.61 H new ATOM 1165 N ASN A 169 20.823 -5.920 7.937 1.00 35.71 N ATOM 1166 CA ASN A 169 20.648 -5.132 6.730 1.00 36.89 C ATOM 1167 C ASN A 169 19.234 -4.805 6.327 1.00 37.35 C ATOM 1168 O ASN A 169 19.026 -3.855 5.589 1.00 37.17 O ATOM 1169 CB ASN A 169 21.344 -5.838 5.582 1.00 35.58 C ATOM 1170 CG ASN A 169 22.807 -5.531 5.552 1.00 35.71 C ATOM 1171 OD1 ASN A 169 23.190 -4.374 5.695 1.00 35.09 O ATOM 1172 ND2 ASN A 169 23.643 -6.555 5.374 1.00 35.72 N ATOM 0 H ASN A 169 20.891 -6.765 7.793 1.00 35.71 H new ATOM 0 HA ASN A 169 21.040 -4.270 6.941 1.00 36.89 H new ATOM 0 HB2 ASN A 169 21.215 -6.796 5.665 1.00 35.58 H new ATOM 0 HB3 ASN A 169 20.939 -5.569 4.743 1.00 35.58 H new ATOM 0 HD21 ASN A 169 24.492 -6.419 5.356 1.00 35.72 H new ATOM 0 HD22 ASN A 169 23.333 -7.351 5.278 1.00 35.72 H new ATOM 1173 N ARG A 170 18.270 -5.574 6.816 1.00 39.47 N ATOM 1174 CA ARG A 170 16.867 -5.346 6.468 1.00 42.73 C ATOM 1175 C ARG A 170 16.437 -3.906 6.729 1.00 43.93 C ATOM 1176 O ARG A 170 16.977 -3.250 7.622 1.00 44.16 O ATOM 1177 CB ARG A 170 15.969 -6.319 7.234 1.00 43.02 C ATOM 1178 CG ARG A 170 16.166 -7.759 6.837 1.00 44.66 C ATOM 1179 CD ARG A 170 15.850 -8.634 8.007 1.00 46.62 C ATOM 1180 NE ARG A 170 16.169 -10.021 7.719 1.00 50.06 N ATOM 1181 CZ ARG A 170 15.418 -11.057 8.090 1.00 52.46 C ATOM 1182 NH1 ARG A 170 14.298 -10.868 8.767 1.00 53.35 N ATOM 1183 NH2 ARG A 170 15.791 -12.292 7.786 1.00 53.18 N ATOM 0 H ARG A 170 18.403 -6.234 7.351 1.00 39.47 H new ATOM 0 HA ARG A 170 16.773 -5.505 5.516 1.00 42.73 H new ATOM 0 HB2 ARG A 170 16.141 -6.227 8.184 1.00 43.02 H new ATOM 0 HB3 ARG A 170 15.042 -6.075 7.088 1.00 43.02 H new ATOM 0 HG2 ARG A 170 15.592 -7.981 6.088 1.00 44.66 H new ATOM 0 HG3 ARG A 170 17.080 -7.905 6.547 1.00 44.66 H new ATOM 0 HD2 ARG A 170 16.352 -8.337 8.782 1.00 46.62 H new ATOM 0 HD3 ARG A 170 14.909 -8.554 8.230 1.00 46.62 H new ATOM 0 HE ARG A 170 16.890 -10.184 7.280 1.00 50.06 H new ATOM 0 HH11 ARG A 170 14.049 -10.071 8.972 1.00 53.35 H new ATOM 0 HH12 ARG A 170 13.819 -11.542 9.003 1.00 53.35 H new ATOM 0 HH21 ARG A 170 16.519 -12.426 7.348 1.00 53.18 H new ATOM 0 HH22 ARG A 170 15.305 -12.959 8.026 1.00 53.18 H new ATOM 1184 N ARG A 170A 15.472 -3.420 5.941 1.00 46.02 N ATOM 1185 CA ARG A 170A 14.970 -2.040 6.051 1.00 47.53 C ATOM 1186 C ARG A 170A 14.422 -1.732 7.446 1.00 46.53 C ATOM 1187 O ARG A 170A 14.330 -0.577 7.873 1.00 46.25 O ATOM 1188 CB ARG A 170A 13.894 -1.758 4.972 1.00 48.92 C ATOM 1189 CG ARG A 170A 13.899 -2.726 3.777 1.00 51.06 C ATOM 1190 CD ARG A 170A 14.461 -2.077 2.510 1.00 53.94 C ATOM 1191 NE ARG A 170A 14.661 -3.030 1.406 1.00 55.95 N ATOM 1192 CZ ARG A 170A 15.002 -2.686 0.160 1.00 56.61 C ATOM 1193 NH1 ARG A 170A 15.185 -1.414 -0.153 1.00 56.47 N ATOM 1194 NH2 ARG A 170A 15.150 -3.619 -0.788 1.00 55.92 N ATOM 0 H ARG A 170A 15.088 -3.881 5.325 1.00 46.02 H new ATOM 0 HA ARG A 170A 15.726 -1.451 5.901 1.00 47.53 H new ATOM 0 HB2 ARG A 170A 13.020 -1.788 5.391 1.00 48.92 H new ATOM 0 HB3 ARG A 170A 14.018 -0.855 4.640 1.00 48.92 H new ATOM 0 HG2 ARG A 170A 14.427 -3.509 3.999 1.00 51.06 H new ATOM 0 HG3 ARG A 170A 12.995 -3.033 3.607 1.00 51.06 H new ATOM 0 HD2 ARG A 170A 13.857 -1.376 2.218 1.00 53.94 H new ATOM 0 HD3 ARG A 170A 15.308 -1.653 2.720 1.00 53.94 H new ATOM 0 HE ARG A 170A 14.551 -3.866 1.574 1.00 55.95 H new ATOM 0 HH11 ARG A 170A 15.085 -0.805 0.446 1.00 56.47 H new ATOM 0 HH12 ARG A 170A 15.404 -1.196 -0.955 1.00 56.47 H new ATOM 0 HH21 ARG A 170A 15.026 -4.448 -0.598 1.00 55.92 H new ATOM 0 HH22 ARG A 170A 15.370 -3.389 -1.587 1.00 55.92 H new ATOM 1195 N THR A 170B 14.057 -2.780 8.160 1.00 46.23 N ATOM 1196 CA THR A 170B 13.525 -2.627 9.509 1.00 46.42 C ATOM 1197 C THR A 170B 14.642 -2.390 10.525 1.00 45.83 C ATOM 1198 O THR A 170B 14.408 -1.891 11.646 1.00 46.10 O ATOM 1199 CB THR A 170B 12.763 -3.873 9.893 1.00 46.52 C ATOM 1200 OG1 THR A 170B 13.515 -5.023 9.488 1.00 47.64 O ATOM 1201 CG2 THR A 170B 11.436 -3.894 9.187 1.00 46.17 C ATOM 0 H THR A 170B 14.108 -3.593 7.885 1.00 46.23 H new ATOM 0 HA THR A 170B 12.937 -1.856 9.515 1.00 46.42 H new ATOM 0 HB THR A 170B 12.623 -3.881 10.853 1.00 46.52 H new ATOM 0 HG1 THR A 170B 14.136 -5.160 10.037 1.00 47.64 H new ATOM 0 HG21 THR A 170B 10.949 -4.695 9.436 1.00 46.17 H new ATOM 0 HG22 THR A 170B 10.922 -3.112 9.441 1.00 46.17 H new ATOM 0 HG23 THR A 170B 11.579 -3.888 8.228 1.00 46.17 H new ATOM 1202 N HIS A 171 15.857 -2.761 10.128 1.00 44.51 N ATOM 1203 CA HIS A 171 17.019 -2.602 10.980 1.00 42.55 C ATOM 1204 C HIS A 171 17.890 -1.487 10.431 1.00 41.52 C ATOM 1205 O HIS A 171 17.508 -0.311 10.495 1.00 40.28 O ATOM 1206 CB HIS A 171 17.764 -3.922 11.048 1.00 41.86 C ATOM 1207 CG HIS A 171 17.044 -4.963 11.826 1.00 41.66 C ATOM 1208 ND1 HIS A 171 15.698 -5.188 11.673 1.00 42.56 N ATOM 1209 CD2 HIS A 171 17.452 -5.802 12.803 1.00 42.24 C ATOM 1210 CE1 HIS A 171 15.311 -6.124 12.522 1.00 42.18 C ATOM 1211 NE2 HIS A 171 16.352 -6.512 13.217 1.00 41.55 N ATOM 0 H HIS A 171 16.025 -3.110 9.360 1.00 44.51 H new ATOM 0 HA HIS A 171 16.757 -2.358 11.881 1.00 42.55 H new ATOM 0 HB2 HIS A 171 17.916 -4.248 10.147 1.00 41.86 H new ATOM 0 HB3 HIS A 171 18.636 -3.774 11.447 1.00 41.86 H new ATOM 0 HD2 HIS A 171 18.317 -5.884 13.134 1.00 42.24 H new ATOM 0 HE1 HIS A 171 14.445 -6.452 12.611 1.00 42.18 H new ATOM 0 HE2 HIS A 171 16.347 -7.113 13.832 1.00 41.55 H new ATOM 1212 N HIS A 172 19.049 -1.815 9.873 1.00 40.67 N ATOM 1213 CA HIS A 172 19.915 -0.750 9.387 1.00 40.94 C ATOM 1214 C HIS A 172 19.978 -0.659 7.845 1.00 40.98 C ATOM 1215 O HIS A 172 21.011 -0.285 7.269 1.00 41.17 O ATOM 1216 CB HIS A 172 21.318 -0.958 9.953 1.00 40.93 C ATOM 1217 CG HIS A 172 21.481 -0.478 11.395 1.00 41.93 C ATOM 1218 ND1 HIS A 172 21.345 0.862 11.746 1.00 42.31 N ATOM 1219 CD2 HIS A 172 21.768 -1.146 12.544 1.00 41.13 C ATOM 1220 CE1 HIS A 172 21.545 0.967 13.048 1.00 42.34 C ATOM 1221 NE2 HIS A 172 21.799 -0.221 13.538 1.00 40.60 N ATOM 0 H HIS A 172 19.344 -2.616 9.769 1.00 40.67 H new ATOM 0 HA HIS A 172 19.536 0.090 9.691 1.00 40.94 H new ATOM 0 HB2 HIS A 172 21.539 -1.902 9.909 1.00 40.93 H new ATOM 0 HB3 HIS A 172 21.956 -0.491 9.392 1.00 40.93 H new ATOM 0 HD2 HIS A 172 21.915 -2.060 12.632 1.00 41.13 H new ATOM 0 HE1 HIS A 172 21.511 1.757 13.538 1.00 42.34 H new ATOM 0 HE2 HIS A 172 21.961 -0.390 14.365 1.00 40.60 H new ATOM 1222 N ASP A 173 18.862 -0.991 7.237 1.00 41.59 N ATOM 1223 CA ASP A 173 18.640 -0.915 5.773 1.00 42.03 C ATOM 1224 C ASP A 173 19.944 -0.870 4.936 1.00 41.66 C ATOM 1225 O ASP A 173 20.324 0.183 4.403 1.00 41.65 O ATOM 1226 CB ASP A 173 17.862 0.363 5.449 1.00 43.37 C ATOM 1227 CG ASP A 173 17.002 0.253 4.191 1.00 45.26 C ATOM 1228 OD1 ASP A 173 16.968 -0.850 3.526 1.00 45.06 O ATOM 1229 OD2 ASP A 173 16.309 1.268 3.796 1.00 45.88 O ATOM 0 H ASP A 173 18.174 -1.280 7.665 1.00 41.59 H new ATOM 0 HA ASP A 173 18.159 -1.724 5.538 1.00 42.03 H new ATOM 0 HB2 ASP A 173 17.293 0.586 6.202 1.00 43.37 H new ATOM 0 HB3 ASP A 173 18.489 1.095 5.340 1.00 43.37 H new ATOM 1230 N GLY A 174 20.579 -2.027 4.838 1.00 42.04 N ATOM 1231 CA GLY A 174 21.793 -2.258 4.008 1.00 42.21 C ATOM 1232 C GLY A 174 22.940 -1.249 4.252 1.00 41.32 C ATOM 1233 O GLY A 174 23.742 -0.959 3.350 1.00 41.04 O ATOM 0 H GLY A 174 20.321 -2.731 5.259 1.00 42.04 H new ATOM 0 HA2 GLY A 174 22.123 -3.153 4.181 1.00 42.21 H new ATOM 0 HA3 GLY A 174 21.542 -2.224 3.072 1.00 42.21 H new ATOM 1234 N ALA A 175 23.026 -0.726 5.462 1.00 40.11 N ATOM 1235 CA ALA A 175 24.117 0.207 5.841 1.00 37.74 C ATOM 1236 C ALA A 175 25.329 -0.625 6.269 1.00 37.06 C ATOM 1237 O ALA A 175 26.441 -0.127 6.374 1.00 38.10 O ATOM 1238 CB ALA A 175 23.663 1.098 6.999 1.00 37.83 C ATOM 0 H ALA A 175 22.466 -0.890 6.094 1.00 40.11 H new ATOM 0 HA ALA A 175 24.348 0.774 5.089 1.00 37.74 H new ATOM 0 HB1 ALA A 175 24.380 1.705 7.241 1.00 37.83 H new ATOM 0 HB2 ALA A 175 22.885 1.610 6.728 1.00 37.83 H new ATOM 0 HB3 ALA A 175 23.436 0.545 7.763 1.00 37.83 H new ATOM 1239 N ILE A 176 25.119 -1.910 6.500 1.00 34.81 N ATOM 1240 CA ILE A 176 26.184 -2.817 6.917 1.00 33.35 C ATOM 1241 C ILE A 176 27.033 -3.449 5.821 1.00 31.34 C ATOM 1242 O ILE A 176 26.594 -4.372 5.133 1.00 31.98 O ATOM 1243 CB ILE A 176 25.631 -3.943 7.768 1.00 34.09 C ATOM 1244 CG1 ILE A 176 24.650 -3.373 8.797 1.00 34.08 C ATOM 1245 CG2 ILE A 176 26.770 -4.724 8.397 1.00 35.48 C ATOM 1246 CD1 ILE A 176 25.153 -2.134 9.504 1.00 33.61 C ATOM 0 H ILE A 176 24.350 -2.287 6.420 1.00 34.81 H new ATOM 0 HA ILE A 176 26.777 -2.225 7.406 1.00 33.35 H new ATOM 0 HB ILE A 176 25.135 -4.570 7.219 1.00 34.09 H new ATOM 0 HG12 ILE A 176 23.814 -3.164 8.352 1.00 34.08 H new ATOM 0 HG13 ILE A 176 24.456 -4.056 9.458 1.00 34.08 H new ATOM 0 HG21 ILE A 176 26.409 -5.442 8.940 1.00 35.48 H new ATOM 0 HG22 ILE A 176 27.331 -5.097 7.699 1.00 35.48 H new ATOM 0 HG23 ILE A 176 27.299 -4.132 8.955 1.00 35.48 H new ATOM 0 HD11 ILE A 176 24.485 -1.829 10.138 1.00 33.61 H new ATOM 0 HD12 ILE A 176 25.975 -2.342 9.976 1.00 33.61 H new ATOM 0 HD13 ILE A 176 25.322 -1.436 8.852 1.00 33.61 H new ATOM 1247 N THR A 177 28.275 -2.992 5.683 1.00 29.24 N ATOM 1248 CA THR A 177 29.172 -3.551 4.674 1.00 27.02 C ATOM 1249 C THR A 177 29.879 -4.771 5.242 1.00 25.99 C ATOM 1250 O THR A 177 29.642 -5.152 6.391 1.00 24.50 O ATOM 1251 CB THR A 177 30.201 -2.514 4.202 1.00 25.73 C ATOM 1252 OG1 THR A 177 31.119 -2.222 5.261 1.00 24.93 O ATOM 1253 CG2 THR A 177 29.492 -1.237 3.805 1.00 24.64 C ATOM 0 H THR A 177 28.616 -2.363 6.160 1.00 29.24 H new ATOM 0 HA THR A 177 28.642 -3.811 3.904 1.00 27.02 H new ATOM 0 HB THR A 177 30.683 -2.875 3.441 1.00 25.73 H new ATOM 0 HG1 THR A 177 31.628 -1.597 5.026 1.00 24.93 H new ATOM 0 HG21 THR A 177 30.144 -0.584 3.507 1.00 24.64 H new ATOM 0 HG22 THR A 177 28.869 -1.423 3.085 1.00 24.64 H new ATOM 0 HG23 THR A 177 29.008 -0.885 4.568 1.00 24.64 H new ATOM 1254 N GLU A 178 30.735 -5.394 4.439 1.00 25.18 N ATOM 1255 CA GLU A 178 31.471 -6.577 4.856 1.00 24.69 C ATOM 1256 C GLU A 178 32.439 -6.193 5.969 1.00 22.46 C ATOM 1257 O GLU A 178 32.949 -7.039 6.719 1.00 21.68 O ATOM 1258 CB GLU A 178 32.251 -7.154 3.665 1.00 29.03 C ATOM 1259 CG GLU A 178 33.736 -6.774 3.689 1.00 37.18 C ATOM 1260 CD GLU A 178 34.571 -7.446 2.606 1.00 41.99 C ATOM 1261 OE1 GLU A 178 34.024 -8.271 1.820 1.00 44.26 O ATOM 1262 OE2 GLU A 178 35.797 -7.144 2.532 1.00 45.05 O ATOM 0 H GLU A 178 30.904 -5.140 3.635 1.00 25.18 H new ATOM 0 HA GLU A 178 30.851 -7.249 5.179 1.00 24.69 H new ATOM 0 HB2 GLU A 178 32.168 -8.120 3.667 1.00 29.03 H new ATOM 0 HB3 GLU A 178 31.853 -6.837 2.839 1.00 29.03 H new ATOM 0 HG2 GLU A 178 33.815 -5.812 3.593 1.00 37.18 H new ATOM 0 HG3 GLU A 178 34.104 -7.004 4.556 1.00 37.18 H new ATOM 1263 N ARG A 179 32.692 -4.904 6.094 1.00 20.17 N ATOM 1264 CA ARG A 179 33.629 -4.460 7.093 1.00 19.90 C ATOM 1265 C ARG A 179 32.990 -4.147 8.431 1.00 17.64 C ATOM 1266 O ARG A 179 33.639 -3.642 9.334 1.00 16.24 O ATOM 1267 CB ARG A 179 34.395 -3.256 6.558 1.00 21.07 C ATOM 1268 CG ARG A 179 34.811 -3.388 5.104 1.00 24.78 C ATOM 1269 CD ARG A 179 36.299 -3.328 5.020 1.00 27.58 C ATOM 1270 NE ARG A 179 36.774 -2.388 4.024 1.00 29.73 N ATOM 1271 CZ ARG A 179 38.059 -2.145 3.789 1.00 31.72 C ATOM 1272 NH1 ARG A 179 38.994 -2.756 4.465 1.00 31.91 N ATOM 1273 NH2 ARG A 179 38.414 -1.312 2.824 1.00 35.18 N ATOM 0 H ARG A 179 32.337 -4.282 5.618 1.00 20.17 H new ATOM 0 HA ARG A 179 34.238 -5.195 7.266 1.00 19.90 H new ATOM 0 HB2 ARG A 179 33.844 -2.464 6.657 1.00 21.07 H new ATOM 0 HB3 ARG A 179 35.187 -3.121 7.101 1.00 21.07 H new ATOM 0 HG2 ARG A 179 34.488 -4.226 4.737 1.00 24.78 H new ATOM 0 HG3 ARG A 179 34.416 -2.676 4.576 1.00 24.78 H new ATOM 0 HD2 ARG A 179 36.657 -3.081 5.887 1.00 27.58 H new ATOM 0 HD3 ARG A 179 36.642 -4.211 4.813 1.00 27.58 H new ATOM 0 HE ARG A 179 36.190 -1.963 3.558 1.00 29.73 H new ATOM 0 HH11 ARG A 179 38.782 -3.326 5.073 1.00 31.91 H new ATOM 0 HH12 ARG A 179 39.822 -2.589 4.302 1.00 31.91 H new ATOM 0 HH21 ARG A 179 37.812 -0.926 2.346 1.00 35.18 H new ATOM 0 HH22 ARG A 179 39.247 -1.157 2.675 1.00 35.18 H new ATOM 1274 N LEU A 180 31.715 -4.452 8.560 1.00 15.98 N ATOM 1275 CA LEU A 180 31.018 -4.144 9.776 1.00 15.30 C ATOM 1276 C LEU A 180 30.290 -5.375 10.245 1.00 14.96 C ATOM 1277 O LEU A 180 30.026 -6.275 9.454 1.00 14.82 O ATOM 1278 CB LEU A 180 30.008 -3.015 9.536 1.00 15.25 C ATOM 1279 CG LEU A 180 30.423 -1.764 8.736 1.00 16.94 C ATOM 1280 CD1 LEU A 180 29.280 -0.767 8.712 1.00 15.13 C ATOM 1281 CD2 LEU A 180 31.641 -1.100 9.357 1.00 17.30 C ATOM 0 H LEU A 180 31.240 -4.836 7.955 1.00 15.98 H new ATOM 0 HA LEU A 180 31.655 -3.856 10.448 1.00 15.30 H new ATOM 0 HB2 LEU A 180 29.242 -3.404 9.085 1.00 15.25 H new ATOM 0 HB3 LEU A 180 29.702 -2.713 10.405 1.00 15.25 H new ATOM 0 HG LEU A 180 30.642 -2.044 7.833 1.00 16.94 H new ATOM 0 HD11 LEU A 180 29.546 0.018 8.208 1.00 15.13 H new ATOM 0 HD12 LEU A 180 28.505 -1.173 8.293 1.00 15.13 H new ATOM 0 HD13 LEU A 180 29.057 -0.508 9.620 1.00 15.13 H new ATOM 0 HD21 LEU A 180 31.883 -0.317 8.838 1.00 17.30 H new ATOM 0 HD22 LEU A 180 31.436 -0.833 10.267 1.00 17.30 H new ATOM 0 HD23 LEU A 180 32.383 -1.725 9.363 1.00 17.30 H new ATOM 1282 N MET A 181 29.998 -5.427 11.538 1.00 14.27 N ATOM 1283 CA MET A 181 29.215 -6.528 12.094 1.00 14.10 C ATOM 1284 C MET A 181 28.228 -5.951 13.119 1.00 13.22 C ATOM 1285 O MET A 181 28.393 -4.815 13.580 1.00 13.41 O ATOM 1286 CB MET A 181 30.120 -7.579 12.756 1.00 13.62 C ATOM 1287 CG MET A 181 30.826 -7.068 13.965 1.00 14.74 C ATOM 1288 SD MET A 181 32.064 -8.175 14.537 1.00 19.03 S ATOM 1289 CE MET A 181 31.113 -9.360 15.436 1.00 17.52 C ATOM 0 H MET A 181 30.243 -4.836 12.113 1.00 14.27 H new ATOM 0 HA MET A 181 28.734 -6.972 11.378 1.00 14.10 H new ATOM 0 HB2 MET A 181 29.584 -8.349 13.003 1.00 13.62 H new ATOM 0 HB3 MET A 181 30.776 -7.885 12.111 1.00 13.62 H new ATOM 0 HG2 MET A 181 31.232 -6.211 13.761 1.00 14.74 H new ATOM 0 HG3 MET A 181 30.181 -6.915 14.673 1.00 14.74 H new ATOM 0 HE1 MET A 181 31.337 -9.307 16.378 1.00 17.52 H new ATOM 0 HE2 MET A 181 30.168 -9.174 15.318 1.00 17.52 H new ATOM 0 HE3 MET A 181 31.311 -10.251 15.107 1.00 17.52 H new ATOM 1290 N CYS A 182 27.186 -6.708 13.442 1.00 12.97 N ATOM 1291 CA CYS A 182 26.228 -6.266 14.433 1.00 14.36 C ATOM 1292 C CYS A 182 26.022 -7.302 15.504 1.00 13.93 C ATOM 1293 O CYS A 182 26.248 -8.493 15.298 1.00 12.51 O ATOM 1294 CB CYS A 182 24.873 -5.977 13.820 1.00 16.94 C ATOM 1295 SG CYS A 182 24.868 -5.262 12.166 1.00 22.68 S ATOM 0 H CYS A 182 27.020 -7.478 13.097 1.00 12.97 H new ATOM 0 HA CYS A 182 26.601 -5.455 14.814 1.00 14.36 H new ATOM 0 HB2 CYS A 182 24.370 -6.806 13.793 1.00 16.94 H new ATOM 0 HB3 CYS A 182 24.395 -5.375 14.412 1.00 16.94 H new ATOM 1296 N ALA A 183 25.573 -6.822 16.650 1.00 14.62 N ATOM 1297 CA ALA A 183 25.294 -7.662 17.794 1.00 15.54 C ATOM 1298 C ALA A 183 23.896 -7.227 18.223 1.00 17.02 C ATOM 1299 O ALA A 183 23.447 -6.134 17.842 1.00 17.05 O ATOM 1300 CB ALA A 183 26.327 -7.393 18.892 1.00 14.74 C ATOM 0 H ALA A 183 25.420 -5.987 16.786 1.00 14.62 H new ATOM 0 HA ALA A 183 25.339 -8.612 17.605 1.00 15.54 H new ATOM 0 HB1 ALA A 183 26.139 -7.957 19.659 1.00 14.74 H new ATOM 0 HB2 ALA A 183 27.215 -7.590 18.556 1.00 14.74 H new ATOM 0 HB3 ALA A 183 26.282 -6.461 19.158 1.00 14.74 H new ATOM 1301 N GLU A 184 23.194 -8.053 18.996 1.00 19.29 N ATOM 1302 CA GLU A 184 21.845 -7.686 19.405 1.00 20.48 C ATOM 1303 C GLU A 184 21.850 -6.452 20.301 1.00 21.10 C ATOM 1304 O GLU A 184 22.818 -6.162 20.996 1.00 20.93 O ATOM 1305 CB GLU A 184 21.183 -8.872 20.108 1.00 23.41 C ATOM 1306 CG GLU A 184 21.184 -10.150 19.283 1.00 28.21 C ATOM 1307 CD GLU A 184 19.986 -11.055 19.541 1.00 31.17 C ATOM 1308 OE1 GLU A 184 18.945 -10.576 20.080 1.00 33.41 O ATOM 1309 OE2 GLU A 184 20.088 -12.267 19.200 1.00 32.08 O ATOM 0 H GLU A 184 23.474 -8.812 19.288 1.00 19.29 H new ATOM 0 HA GLU A 184 21.332 -7.461 18.613 1.00 20.48 H new ATOM 0 HB2 GLU A 184 21.641 -9.038 20.947 1.00 23.41 H new ATOM 0 HB3 GLU A 184 20.267 -8.638 20.326 1.00 23.41 H new ATOM 0 HG2 GLU A 184 21.204 -9.916 18.342 1.00 28.21 H new ATOM 0 HG3 GLU A 184 21.997 -10.644 19.470 1.00 28.21 H new ATOM 1310 N SER A 185 20.761 -5.702 20.274 1.00 22.56 N ATOM 1311 CA SER A 185 20.652 -4.497 21.088 1.00 23.52 C ATOM 1312 C SER A 185 19.401 -4.447 21.979 1.00 23.58 C ATOM 1313 O SER A 185 19.012 -3.393 22.476 1.00 24.62 O ATOM 1314 CB SER A 185 20.686 -3.272 20.179 1.00 22.34 C ATOM 1315 OG SER A 185 19.836 -3.468 19.089 1.00 20.41 O ATOM 0 H SER A 185 20.070 -5.871 19.791 1.00 22.56 H new ATOM 0 HA SER A 185 21.409 -4.507 21.694 1.00 23.52 H new ATOM 0 HB2 SER A 185 20.414 -2.484 20.674 1.00 22.34 H new ATOM 0 HB3 SER A 185 21.592 -3.114 19.869 1.00 22.34 H new ATOM 0 HG SER A 185 19.177 -2.951 19.151 1.00 20.41 H new ATOM 1316 N ASN A 186 18.783 -5.592 22.192 1.00 24.00 N ATOM 1317 CA ASN A 186 17.581 -5.679 22.995 1.00 25.82 C ATOM 1318 C ASN A 186 17.814 -5.627 24.479 1.00 26.18 C ATOM 1319 O ASN A 186 18.188 -6.626 25.075 1.00 24.77 O ATOM 1320 CB ASN A 186 16.845 -6.959 22.662 1.00 28.15 C ATOM 1321 CG ASN A 186 15.519 -7.062 23.359 1.00 30.47 C ATOM 1322 OD1 ASN A 186 14.775 -6.088 23.421 1.00 32.67 O ATOM 1323 ND2 ASN A 186 15.209 -8.246 23.892 1.00 27.89 N ATOM 0 H ASN A 186 19.050 -6.345 21.874 1.00 24.00 H new ATOM 0 HA ASN A 186 17.059 -4.893 22.772 1.00 25.82 H new ATOM 0 HB2 ASN A 186 16.707 -7.008 21.703 1.00 28.15 H new ATOM 0 HB3 ASN A 186 17.396 -7.718 22.909 1.00 28.15 H new ATOM 0 HD21 ASN A 186 14.460 -8.351 24.301 1.00 27.89 H new ATOM 0 HD22 ASN A 186 15.759 -8.904 23.827 1.00 27.89 H new ATOM 1324 N ARG A 187 17.561 -4.458 25.071 1.00 28.60 N ATOM 1325 CA ARG A 187 17.721 -4.238 26.504 1.00 30.19 C ATOM 1326 C ARG A 187 19.193 -4.190 26.953 1.00 30.51 C ATOM 1327 O ARG A 187 19.541 -3.528 27.936 1.00 31.69 O ATOM 1328 CB ARG A 187 16.999 -5.341 27.305 1.00 33.22 C ATOM 1329 CG ARG A 187 15.478 -5.375 27.122 1.00 35.79 C ATOM 1330 CD ARG A 187 14.794 -6.425 28.017 1.00 38.76 C ATOM 1331 NE ARG A 187 14.756 -7.764 27.405 1.00 41.17 N ATOM 1332 CZ ARG A 187 13.719 -8.244 26.700 1.00 42.02 C ATOM 1333 NH1 ARG A 187 12.613 -7.512 26.510 1.00 41.20 N ATOM 1334 NH2 ARG A 187 13.698 -9.460 26.137 1.00 43.07 N ATOM 0 H ARG A 187 17.288 -3.764 24.643 1.00 28.60 H new ATOM 0 HA ARG A 187 17.327 -3.370 26.683 1.00 30.19 H new ATOM 0 HB2 ARG A 187 17.363 -6.202 27.046 1.00 33.22 H new ATOM 0 HB3 ARG A 187 17.196 -5.221 28.247 1.00 33.22 H new ATOM 0 HG2 ARG A 187 15.113 -4.499 27.321 1.00 35.79 H new ATOM 0 HG3 ARG A 187 15.272 -5.564 26.193 1.00 35.79 H new ATOM 0 HD2 ARG A 187 15.263 -6.475 28.865 1.00 38.76 H new ATOM 0 HD3 ARG A 187 13.888 -6.137 28.211 1.00 38.76 H new ATOM 0 HE ARG A 187 15.443 -8.272 27.506 1.00 41.17 H new ATOM 0 HH11 ARG A 187 12.559 -6.721 26.842 1.00 41.20 H new ATOM 0 HH12 ARG A 187 11.957 -7.834 26.056 1.00 41.20 H new ATOM 0 HH21 ARG A 187 14.376 -9.983 26.217 1.00 43.07 H new ATOM 0 HH22 ARG A 187 13.006 -9.717 25.695 1.00 43.07 H new ATOM 1335 N ARG A 188 20.045 -4.900 26.251 1.00 29.53 N ATOM 1336 CA ARG A 188 21.495 -4.898 26.541 1.00 28.51 C ATOM 1337 C ARG A 188 22.177 -4.306 25.306 1.00 26.37 C ATOM 1338 O ARG A 188 21.987 -4.781 24.186 1.00 26.08 O ATOM 1339 CB ARG A 188 21.967 -6.324 26.821 1.00 31.93 C ATOM 1340 CG ARG A 188 21.042 -7.067 27.787 1.00 35.81 C ATOM 1341 CD ARG A 188 21.714 -8.257 28.465 1.00 40.39 C ATOM 1342 NE ARG A 188 21.169 -9.545 28.024 1.00 45.70 N ATOM 1343 CZ ARG A 188 19.909 -9.927 28.235 1.00 48.49 C ATOM 1344 NH1 ARG A 188 19.051 -9.126 28.879 1.00 51.11 N ATOM 1345 NH2 ARG A 188 19.412 -11.105 27.840 1.00 49.25 N ATOM 0 H ARG A 188 19.818 -5.402 25.590 1.00 29.53 H new ATOM 0 HA ARG A 188 21.712 -4.373 27.327 1.00 28.51 H new ATOM 0 HB2 ARG A 188 22.019 -6.814 25.986 1.00 31.93 H new ATOM 0 HB3 ARG A 188 22.863 -6.298 27.191 1.00 31.93 H new ATOM 0 HG2 ARG A 188 20.729 -6.449 28.466 1.00 35.81 H new ATOM 0 HG3 ARG A 188 20.260 -7.377 27.304 1.00 35.81 H new ATOM 0 HD2 ARG A 188 22.666 -8.233 28.281 1.00 40.39 H new ATOM 0 HD3 ARG A 188 21.609 -8.178 29.426 1.00 40.39 H new ATOM 0 HE ARG A 188 21.692 -10.085 27.606 1.00 45.70 H new ATOM 0 HH11 ARG A 188 19.311 -8.356 29.161 1.00 51.11 H new ATOM 0 HH12 ARG A 188 18.240 -9.381 29.010 1.00 51.11 H new ATOM 0 HH21 ARG A 188 19.914 -11.666 27.424 1.00 49.25 H new ATOM 0 HH22 ARG A 188 18.591 -11.301 28.002 1.00 49.25 H new ATOM 1346 N ASP A 189 22.969 -3.257 25.506 1.00 23.26 N ATOM 1347 CA ASP A 189 23.630 -2.578 24.378 1.00 20.30 C ATOM 1348 C ASP A 189 24.757 -1.676 24.858 1.00 20.43 C ATOM 1349 O ASP A 189 24.862 -1.361 26.051 1.00 18.75 O ATOM 1350 CB ASP A 189 22.605 -1.694 23.685 1.00 16.95 C ATOM 1351 CG ASP A 189 22.940 -1.406 22.221 1.00 15.79 C ATOM 1352 OD1 ASP A 189 24.013 -1.891 21.697 1.00 14.13 O ATOM 1353 OD2 ASP A 189 22.147 -0.677 21.511 1.00 16.33 O ATOM 0 H ASP A 189 23.140 -2.920 26.278 1.00 23.26 H new ATOM 0 HA ASP A 189 23.992 -3.255 23.785 1.00 20.30 H new ATOM 0 HB2 ASP A 189 21.735 -2.121 23.733 1.00 16.95 H new ATOM 0 HB3 ASP A 189 22.535 -0.854 24.165 1.00 16.95 H new ATOM 1354 N SER A 190 25.570 -1.306 23.894 1.00 20.48 N ATOM 1355 CA SER A 190 26.639 -0.335 24.097 1.00 20.50 C ATOM 1356 C SER A 190 26.025 1.010 23.752 1.00 19.70 C ATOM 1357 O SER A 190 25.147 1.108 22.885 1.00 18.47 O ATOM 1358 CB SER A 190 27.829 -0.663 23.191 1.00 20.37 C ATOM 1359 OG SER A 190 27.422 -0.648 21.831 1.00 21.83 O ATOM 0 H SER A 190 25.523 -1.610 23.091 1.00 20.48 H new ATOM 0 HA SER A 190 26.980 -0.341 25.005 1.00 20.50 H new ATOM 0 HB2 SER A 190 28.539 -0.018 23.331 1.00 20.37 H new ATOM 0 HB3 SER A 190 28.189 -1.535 23.419 1.00 20.37 H new ATOM 0 HG SER A 190 27.454 -1.428 21.520 1.00 21.83 H new ATOM 1360 N CYS A 191 26.455 2.040 24.423 1.00 19.98 N ATOM 1361 CA CYS A 191 25.873 3.359 24.192 1.00 20.80 C ATOM 1362 C CYS A 191 26.954 4.434 24.104 1.00 20.10 C ATOM 1363 O CYS A 191 28.135 4.104 24.007 1.00 19.13 O ATOM 1364 CB CYS A 191 24.938 3.714 25.351 1.00 23.36 C ATOM 1365 SG CYS A 191 23.488 4.752 24.829 1.00 30.91 S ATOM 0 H CYS A 191 27.078 2.014 25.016 1.00 19.98 H new ATOM 0 HA CYS A 191 25.388 3.327 23.353 1.00 20.80 H new ATOM 0 HB2 CYS A 191 24.613 2.896 25.759 1.00 23.36 H new ATOM 0 HB3 CYS A 191 25.441 4.189 26.031 1.00 23.36 H new ATOM 1366 N LYS A 192 26.537 5.699 24.123 1.00 19.19 N ATOM 1367 CA LYS A 192 27.446 6.849 24.054 1.00 18.98 C ATOM 1368 C LYS A 192 28.536 6.773 25.131 1.00 17.11 C ATOM 1369 O LYS A 192 28.269 6.536 26.296 1.00 16.40 O ATOM 1370 CB LYS A 192 26.648 8.150 24.213 1.00 20.33 C ATOM 1371 CG LYS A 192 27.281 9.340 23.520 1.00 23.58 C ATOM 1372 CD LYS A 192 26.851 10.682 24.117 1.00 26.08 C ATOM 1373 CE LYS A 192 27.413 11.857 23.303 1.00 29.14 C ATOM 1374 NZ LYS A 192 28.470 11.389 22.329 1.00 32.03 N ATOM 0 H LYS A 192 25.707 5.919 24.177 1.00 19.19 H new ATOM 0 HA LYS A 192 27.882 6.834 23.188 1.00 18.98 H new ATOM 0 HB2 LYS A 192 25.754 8.017 23.860 1.00 20.33 H new ATOM 0 HB3 LYS A 192 26.553 8.349 25.158 1.00 20.33 H new ATOM 0 HG2 LYS A 192 28.246 9.263 23.574 1.00 23.58 H new ATOM 0 HG3 LYS A 192 27.047 9.321 22.579 1.00 23.58 H new ATOM 0 HD2 LYS A 192 25.883 10.734 24.139 1.00 26.08 H new ATOM 0 HD3 LYS A 192 27.159 10.744 25.035 1.00 26.08 H new ATOM 0 HE2 LYS A 192 26.694 12.292 22.819 1.00 29.14 H new ATOM 0 HE3 LYS A 192 27.792 12.518 23.903 1.00 29.14 H new ATOM 0 HZ1 LYS A 192 28.821 12.092 21.911 1.00 32.03 H new ATOM 0 HZ2 LYS A 192 29.110 10.957 22.771 1.00 32.03 H new ATOM 0 HZ3 LYS A 192 28.102 10.842 21.731 1.00 32.03 H new ATOM 1375 N GLY A 193 29.773 6.959 24.730 1.00 15.91 N ATOM 1376 CA GLY A 193 30.833 6.851 25.703 1.00 13.44 C ATOM 1377 C GLY A 193 31.524 5.509 25.579 1.00 12.61 C ATOM 1378 O GLY A 193 32.648 5.372 26.068 1.00 14.64 O ATOM 0 H GLY A 193 30.017 7.143 23.926 1.00 15.91 H new ATOM 0 HA2 GLY A 193 31.475 7.566 25.572 1.00 13.44 H new ATOM 0 HA3 GLY A 193 30.472 6.955 26.597 1.00 13.44 H new ATOM 1379 N ASP A 194 30.871 4.515 24.967 1.00 10.15 N ATOM 1380 CA ASP A 194 31.461 3.184 24.788 1.00 10.02 C ATOM 1381 C ASP A 194 32.118 3.046 23.424 1.00 9.82 C ATOM 1382 O ASP A 194 32.769 2.028 23.142 1.00 7.12 O ATOM 1383 CB ASP A 194 30.403 2.096 24.909 1.00 11.12 C ATOM 1384 CG ASP A 194 29.757 2.062 26.256 1.00 12.96 C ATOM 1385 OD1 ASP A 194 30.502 2.070 27.255 1.00 13.65 O ATOM 1386 OD2 ASP A 194 28.504 2.021 26.334 1.00 13.28 O ATOM 0 H ASP A 194 30.077 4.594 24.646 1.00 10.15 H new ATOM 0 HA ASP A 194 32.128 3.082 25.485 1.00 10.02 H new ATOM 0 HB2 ASP A 194 29.722 2.236 24.232 1.00 11.12 H new ATOM 0 HB3 ASP A 194 30.810 1.234 24.728 1.00 11.12 H new ATOM 1387 N SER A 195 31.914 4.052 22.579 1.00 9.33 N ATOM 1388 CA SER A 195 32.482 4.089 21.236 1.00 12.14 C ATOM 1389 C SER A 195 33.968 3.905 21.313 1.00 11.56 C ATOM 1390 O SER A 195 34.594 4.412 22.234 1.00 12.00 O ATOM 1391 CB SER A 195 32.179 5.423 20.583 1.00 12.84 C ATOM 1392 OG SER A 195 30.897 5.869 20.974 1.00 22.78 O ATOM 0 H SER A 195 31.436 4.740 22.772 1.00 9.33 H new ATOM 0 HA SER A 195 32.090 3.376 20.708 1.00 12.14 H new ATOM 0 HB2 SER A 195 32.849 6.076 20.838 1.00 12.84 H new ATOM 0 HB3 SER A 195 32.220 5.336 19.618 1.00 12.84 H new ATOM 0 HG SER A 195 30.968 6.377 21.640 1.00 22.78 H new ATOM 1393 N GLY A 196 34.548 3.193 20.363 1.00 10.91 N ATOM 1394 CA GLY A 196 35.975 2.968 20.401 1.00 12.20 C ATOM 1395 C GLY A 196 36.342 1.765 21.234 1.00 12.70 C ATOM 1396 O GLY A 196 37.475 1.313 21.222 1.00 15.35 O ATOM 0 H GLY A 196 34.138 2.836 19.696 1.00 10.91 H new ATOM 0 HA2 GLY A 196 36.305 2.846 19.497 1.00 12.20 H new ATOM 0 HA3 GLY A 196 36.415 3.754 20.760 1.00 12.20 H new ATOM 1397 N GLY A 197 35.388 1.191 21.933 1.00 11.95 N ATOM 1398 CA GLY A 197 35.732 0.053 22.742 1.00 9.56 C ATOM 1399 C GLY A 197 35.775 -1.277 22.036 1.00 9.93 C ATOM 1400 O GLY A 197 35.402 -1.403 20.880 1.00 10.14 O ATOM 0 H GLY A 197 34.563 1.435 21.954 1.00 11.95 H new ATOM 0 HA2 GLY A 197 36.601 0.214 23.141 1.00 9.56 H new ATOM 0 HA3 GLY A 197 35.093 -0.008 23.469 1.00 9.56 H new ATOM 1401 N PRO A 198 36.183 -2.312 22.768 1.00 10.34 N ATOM 1402 CA PRO A 198 36.350 -3.712 22.396 1.00 10.98 C ATOM 1403 C PRO A 198 35.123 -4.600 22.343 1.00 13.36 C ATOM 1404 O PRO A 198 34.270 -4.567 23.217 1.00 15.55 O ATOM 1405 CB PRO A 198 37.283 -4.244 23.463 1.00 10.48 C ATOM 1406 CG PRO A 198 36.878 -3.495 24.675 1.00 8.72 C ATOM 1407 CD PRO A 198 36.536 -2.107 24.194 1.00 8.36 C ATOM 0 HA PRO A 198 36.656 -3.735 21.476 1.00 10.98 H new ATOM 0 HB2 PRO A 198 37.181 -5.201 23.583 1.00 10.48 H new ATOM 0 HB3 PRO A 198 38.213 -4.084 23.238 1.00 10.48 H new ATOM 0 HG2 PRO A 198 36.116 -3.913 25.106 1.00 8.72 H new ATOM 0 HG3 PRO A 198 37.595 -3.472 25.327 1.00 8.72 H new ATOM 0 HD2 PRO A 198 35.796 -1.728 24.694 1.00 8.36 H new ATOM 0 HD3 PRO A 198 37.286 -1.500 24.293 1.00 8.36 H new ATOM 1408 N LEU A 199 35.042 -5.367 21.314 1.00 14.54 N ATOM 1409 CA LEU A 199 34.030 -6.428 21.187 1.00 13.07 C ATOM 1410 C LEU A 199 34.790 -7.741 21.062 1.00 13.97 C ATOM 1411 O LEU A 199 35.186 -8.149 19.964 1.00 15.83 O ATOM 1412 CB LEU A 199 33.176 -6.199 19.939 1.00 12.69 C ATOM 1413 CG LEU A 199 32.099 -7.269 19.748 1.00 10.35 C ATOM 1414 CD1 LEU A 199 31.117 -7.345 20.919 1.00 10.15 C ATOM 1415 CD2 LEU A 199 31.241 -7.039 18.502 1.00 14.32 C ATOM 0 H LEU A 199 35.571 -5.309 20.639 1.00 14.54 H new ATOM 0 HA LEU A 199 33.436 -6.436 21.954 1.00 13.07 H new ATOM 0 HB2 LEU A 199 32.753 -5.328 19.998 1.00 12.69 H new ATOM 0 HB3 LEU A 199 33.751 -6.183 19.158 1.00 12.69 H new ATOM 0 HG LEU A 199 32.610 -8.090 19.670 1.00 10.35 H new ATOM 0 HD11 LEU A 199 30.459 -8.036 20.746 1.00 10.15 H new ATOM 0 HD12 LEU A 199 31.600 -7.556 21.733 1.00 10.15 H new ATOM 0 HD13 LEU A 199 30.668 -6.491 21.021 1.00 10.15 H new ATOM 0 HD21 LEU A 199 30.578 -7.744 18.431 1.00 14.32 H new ATOM 0 HD22 LEU A 199 30.794 -6.181 18.571 1.00 14.32 H new ATOM 0 HD23 LEU A 199 31.806 -7.047 17.714 1.00 14.32 H new ATOM 1416 N VAL A 200 34.987 -8.359 22.200 1.00 13.90 N ATOM 1417 CA VAL A 200 35.790 -9.577 22.294 1.00 14.37 C ATOM 1418 C VAL A 200 34.970 -10.817 22.172 1.00 16.26 C ATOM 1419 O VAL A 200 33.965 -10.952 22.852 1.00 16.89 O ATOM 1420 CB VAL A 200 36.507 -9.602 23.645 1.00 13.25 C ATOM 1421 CG1 VAL A 200 37.518 -10.741 23.767 1.00 10.63 C ATOM 1422 CG2 VAL A 200 37.292 -8.317 23.924 1.00 11.72 C ATOM 0 H VAL A 200 34.662 -8.092 22.950 1.00 13.90 H new ATOM 0 HA VAL A 200 36.420 -9.562 21.557 1.00 14.37 H new ATOM 0 HB VAL A 200 35.784 -9.715 24.282 1.00 13.25 H new ATOM 0 HG11 VAL A 200 37.940 -10.707 24.640 1.00 10.63 H new ATOM 0 HG12 VAL A 200 37.063 -11.591 23.661 1.00 10.63 H new ATOM 0 HG13 VAL A 200 38.194 -10.649 23.078 1.00 10.63 H new ATOM 0 HG21 VAL A 200 37.726 -8.384 24.789 1.00 11.72 H new ATOM 0 HG22 VAL A 200 37.963 -8.191 23.235 1.00 11.72 H new ATOM 0 HG23 VAL A 200 36.685 -7.560 23.925 1.00 11.72 H new ATOM 1423 N CYS A 201 35.410 -11.740 21.325 1.00 16.84 N ATOM 1424 CA CYS A 201 34.717 -13.005 21.105 1.00 17.49 C ATOM 1425 C CYS A 201 35.768 -14.108 21.134 1.00 18.52 C ATOM 1426 O CYS A 201 36.724 -14.068 20.347 1.00 18.37 O ATOM 1427 CB CYS A 201 34.038 -13.039 19.728 1.00 16.14 C ATOM 1428 SG CYS A 201 33.115 -11.546 19.208 1.00 16.63 S ATOM 0 H CYS A 201 36.126 -11.650 20.857 1.00 16.84 H new ATOM 0 HA CYS A 201 34.038 -13.119 21.788 1.00 17.49 H new ATOM 0 HB2 CYS A 201 34.720 -13.217 19.062 1.00 16.14 H new ATOM 0 HB3 CYS A 201 33.425 -13.791 19.714 1.00 16.14 H new ATOM 1429 N GLY A 202 35.616 -15.054 22.063 1.00 18.68 N ATOM 1430 CA GLY A 202 36.551 -16.165 22.161 1.00 19.62 C ATOM 1431 C GLY A 202 37.940 -15.773 22.571 1.00 20.53 C ATOM 1432 O GLY A 202 38.910 -16.432 22.181 1.00 21.75 O ATOM 0 H GLY A 202 34.980 -15.067 22.641 1.00 18.68 H new ATOM 0 HA2 GLY A 202 36.206 -16.808 22.800 1.00 19.62 H new ATOM 0 HA3 GLY A 202 36.594 -16.614 21.302 1.00 19.62 H new ATOM 1433 N GLY A 207 38.052 -14.690 23.332 1.00 20.17 N ATOM 1434 CA GLY A 207 39.348 -14.207 23.795 1.00 19.02 C ATOM 1435 C GLY A 207 40.129 -13.374 22.784 1.00 19.09 C ATOM 1436 O GLY A 207 41.325 -13.098 22.942 1.00 19.47 O ATOM 0 H GLY A 207 37.383 -14.217 23.593 1.00 20.17 H new ATOM 0 HA2 GLY A 207 39.212 -13.675 24.595 1.00 19.02 H new ATOM 0 HA3 GLY A 207 39.889 -14.970 24.051 1.00 19.02 H new ATOM 1437 N VAL A 208 39.457 -12.970 21.714 1.00 17.60 N ATOM 1438 CA VAL A 208 40.113 -12.186 20.696 1.00 15.82 C ATOM 1439 C VAL A 208 39.271 -10.995 20.357 1.00 14.37 C ATOM 1440 O VAL A 208 38.069 -11.048 20.456 1.00 15.66 O ATOM 1441 CB VAL A 208 40.353 -13.013 19.416 1.00 16.44 C ATOM 1442 CG1 VAL A 208 41.162 -12.212 18.468 1.00 15.12 C ATOM 1443 CG2 VAL A 208 41.071 -14.299 19.754 1.00 16.42 C ATOM 0 H VAL A 208 38.627 -13.140 21.564 1.00 17.60 H new ATOM 0 HA VAL A 208 40.972 -11.903 21.046 1.00 15.82 H new ATOM 0 HB VAL A 208 39.501 -13.235 19.009 1.00 16.44 H new ATOM 0 HG11 VAL A 208 41.317 -12.726 17.660 1.00 15.12 H new ATOM 0 HG12 VAL A 208 40.687 -11.396 18.246 1.00 15.12 H new ATOM 0 HG13 VAL A 208 42.013 -11.989 18.877 1.00 15.12 H new ATOM 0 HG21 VAL A 208 41.217 -14.811 18.943 1.00 16.42 H new ATOM 0 HG22 VAL A 208 41.926 -14.094 20.165 1.00 16.42 H new ATOM 0 HG23 VAL A 208 40.532 -14.818 20.371 1.00 16.42 H new ATOM 1444 N LEU A 209 39.918 -9.925 19.928 1.00 12.54 N ATOM 1445 CA LEU A 209 39.226 -8.698 19.526 1.00 13.08 C ATOM 1446 C LEU A 209 38.650 -8.889 18.124 1.00 12.95 C ATOM 1447 O LEU A 209 39.388 -9.137 17.164 1.00 13.12 O ATOM 1448 CB LEU A 209 40.211 -7.524 19.528 1.00 10.92 C ATOM 1449 CG LEU A 209 39.684 -6.138 19.160 1.00 12.81 C ATOM 1450 CD1 LEU A 209 38.634 -5.657 20.173 1.00 11.05 C ATOM 1451 CD2 LEU A 209 40.882 -5.182 19.103 1.00 10.11 C ATOM 0 H LEU A 209 40.774 -9.883 19.859 1.00 12.54 H new ATOM 0 HA LEU A 209 38.508 -8.507 20.150 1.00 13.08 H new ATOM 0 HB2 LEU A 209 40.602 -7.467 20.414 1.00 10.92 H new ATOM 0 HB3 LEU A 209 40.930 -7.740 18.914 1.00 10.92 H new ATOM 0 HG LEU A 209 39.242 -6.167 18.297 1.00 12.81 H new ATOM 0 HD11 LEU A 209 38.316 -4.777 19.917 1.00 11.05 H new ATOM 0 HD12 LEU A 209 37.889 -6.278 20.187 1.00 11.05 H new ATOM 0 HD13 LEU A 209 39.033 -5.612 21.056 1.00 11.05 H new ATOM 0 HD21 LEU A 209 40.575 -4.292 18.871 1.00 10.11 H new ATOM 0 HD22 LEU A 209 41.318 -5.157 19.969 1.00 10.11 H new ATOM 0 HD23 LEU A 209 41.512 -5.492 18.433 1.00 10.11 H new ATOM 1452 N GLU A 210 37.331 -8.818 18.019 1.00 12.60 N ATOM 1453 CA GLU A 210 36.692 -8.978 16.737 1.00 12.54 C ATOM 1454 C GLU A 210 36.262 -7.638 16.265 1.00 12.40 C ATOM 1455 O GLU A 210 36.299 -7.360 15.091 1.00 13.94 O ATOM 1456 CB GLU A 210 35.473 -9.884 16.814 1.00 13.68 C ATOM 1457 CG GLU A 210 35.833 -11.312 17.046 1.00 16.14 C ATOM 1458 CD GLU A 210 36.381 -11.977 15.804 1.00 18.34 C ATOM 1459 OE1 GLU A 210 36.151 -11.427 14.701 1.00 17.80 O ATOM 1460 OE2 GLU A 210 37.030 -13.049 15.930 1.00 18.72 O ATOM 0 H GLU A 210 36.796 -8.678 18.677 1.00 12.60 H new ATOM 0 HA GLU A 210 37.326 -9.387 16.128 1.00 12.54 H new ATOM 0 HB2 GLU A 210 34.893 -9.580 17.530 1.00 13.68 H new ATOM 0 HB3 GLU A 210 34.968 -9.811 15.989 1.00 13.68 H new ATOM 0 HG2 GLU A 210 36.492 -11.366 17.756 1.00 16.14 H new ATOM 0 HG3 GLU A 210 35.049 -11.795 17.350 1.00 16.14 H new ATOM 1461 N GLY A 211 35.852 -6.771 17.160 1.00 11.58 N ATOM 1462 CA GLY A 211 35.434 -5.496 16.640 1.00 10.53 C ATOM 1463 C GLY A 211 35.635 -4.345 17.562 1.00 10.89 C ATOM 1464 O GLY A 211 36.061 -4.502 18.704 1.00 10.22 O ATOM 0 H GLY A 211 35.808 -6.885 18.011 1.00 11.58 H new ATOM 0 HA2 GLY A 211 35.918 -5.323 15.818 1.00 10.53 H new ATOM 0 HA3 GLY A 211 34.493 -5.548 16.410 1.00 10.53 H new ATOM 1465 N VAL A 212 35.328 -3.171 17.041 1.00 9.91 N ATOM 1466 CA VAL A 212 35.449 -1.942 17.787 1.00 10.29 C ATOM 1467 C VAL A 212 34.097 -1.257 17.664 1.00 11.73 C ATOM 1468 O VAL A 212 33.542 -1.177 16.572 1.00 12.86 O ATOM 1469 CB VAL A 212 36.599 -1.054 17.205 1.00 9.67 C ATOM 1470 CG1 VAL A 212 36.584 0.322 17.830 1.00 9.66 C ATOM 1471 CG2 VAL A 212 37.939 -1.725 17.454 1.00 7.67 C ATOM 0 H VAL A 212 35.041 -3.067 16.237 1.00 9.91 H new ATOM 0 HA VAL A 212 35.677 -2.101 18.716 1.00 10.29 H new ATOM 0 HB VAL A 212 36.461 -0.955 16.250 1.00 9.67 H new ATOM 0 HG11 VAL A 212 37.303 0.855 17.456 1.00 9.66 H new ATOM 0 HG12 VAL A 212 35.734 0.752 17.646 1.00 9.66 H new ATOM 0 HG13 VAL A 212 36.705 0.243 18.789 1.00 9.66 H new ATOM 0 HG21 VAL A 212 38.650 -1.173 17.092 1.00 7.67 H new ATOM 0 HG22 VAL A 212 38.072 -1.839 18.408 1.00 7.67 H new ATOM 0 HG23 VAL A 212 37.952 -2.593 17.021 1.00 7.67 H new ATOM 1472 N VAL A 213 33.556 -0.823 18.802 1.00 13.73 N ATOM 1473 CA VAL A 213 32.266 -0.116 18.881 1.00 13.33 C ATOM 1474 C VAL A 213 32.359 1.182 18.064 1.00 15.60 C ATOM 1475 O VAL A 213 33.237 2.021 18.325 1.00 14.65 O ATOM 1476 CB VAL A 213 31.951 0.246 20.368 1.00 13.92 C ATOM 1477 CG1 VAL A 213 30.589 0.930 20.487 1.00 10.65 C ATOM 1478 CG2 VAL A 213 32.006 -1.005 21.236 1.00 12.02 C ATOM 0 H VAL A 213 33.933 -0.931 19.568 1.00 13.73 H new ATOM 0 HA VAL A 213 31.564 -0.686 18.531 1.00 13.33 H new ATOM 0 HB VAL A 213 32.624 0.870 20.681 1.00 13.92 H new ATOM 0 HG11 VAL A 213 30.415 1.145 21.417 1.00 10.65 H new ATOM 0 HG12 VAL A 213 30.589 1.745 19.961 1.00 10.65 H new ATOM 0 HG13 VAL A 213 29.898 0.334 20.159 1.00 10.65 H new ATOM 0 HG21 VAL A 213 31.809 -0.770 22.156 1.00 12.02 H new ATOM 0 HG22 VAL A 213 31.351 -1.647 20.920 1.00 12.02 H new ATOM 0 HG23 VAL A 213 32.892 -1.396 21.185 1.00 12.02 H new ATOM 1479 N THR A 214 31.476 1.360 17.076 1.00 17.10 N ATOM 1480 CA THR A 214 31.529 2.581 16.255 1.00 19.62 C ATOM 1481 C THR A 214 31.164 3.802 17.063 1.00 21.89 C ATOM 1482 O THR A 214 30.528 3.707 18.112 1.00 21.75 O ATOM 1483 CB THR A 214 30.590 2.542 15.021 1.00 20.19 C ATOM 1484 OG1 THR A 214 29.236 2.339 15.455 1.00 22.29 O ATOM 1485 CG2 THR A 214 31.030 1.473 14.036 1.00 17.77 C ATOM 0 H THR A 214 30.854 0.804 16.867 1.00 17.10 H new ATOM 0 HA THR A 214 32.447 2.628 15.946 1.00 19.62 H new ATOM 0 HB THR A 214 30.639 3.392 14.556 1.00 20.19 H new ATOM 0 HG1 THR A 214 29.114 1.525 15.622 1.00 22.29 H new ATOM 0 HG21 THR A 214 30.429 1.467 13.274 1.00 17.77 H new ATOM 0 HG22 THR A 214 31.932 1.662 13.734 1.00 17.77 H new ATOM 0 HG23 THR A 214 31.010 0.605 14.469 1.00 17.77 H new ATOM 1486 N SER A 215 31.555 4.967 16.567 1.00 24.02 N ATOM 1487 CA SER A 215 31.279 6.222 17.248 1.00 26.45 C ATOM 1488 C SER A 215 30.240 7.111 16.545 1.00 28.59 C ATOM 1489 O SER A 215 30.507 8.294 16.291 1.00 30.02 O ATOM 1490 CB SER A 215 32.581 6.995 17.428 1.00 27.13 C ATOM 1491 OG SER A 215 33.102 7.324 16.164 1.00 28.22 O ATOM 0 H SER A 215 31.987 5.052 15.828 1.00 24.02 H new ATOM 0 HA SER A 215 30.889 5.986 18.104 1.00 26.45 H new ATOM 0 HB2 SER A 215 32.423 7.801 17.944 1.00 27.13 H new ATOM 0 HB3 SER A 215 33.221 6.461 17.925 1.00 27.13 H new ATOM 0 HG SER A 215 33.137 6.634 15.687 1.00 28.22 H new ATOM 1492 N GLY A 216 29.068 6.563 16.215 1.00 28.94 N ATOM 1493 CA GLY A 216 28.048 7.368 15.567 1.00 29.80 C ATOM 1494 C GLY A 216 26.832 7.496 16.453 1.00 30.52 C ATOM 1495 O GLY A 216 26.584 6.655 17.320 1.00 30.50 O ATOM 0 H GLY A 216 28.852 5.743 16.357 1.00 28.94 H new ATOM 0 HA2 GLY A 216 28.402 8.248 15.366 1.00 29.80 H new ATOM 0 HA3 GLY A 216 27.798 6.963 14.722 1.00 29.80 H new ATOM 1496 N SER A 217 26.068 8.558 16.259 1.00 31.26 N ATOM 1497 CA SER A 217 24.850 8.790 17.033 1.00 31.45 C ATOM 1498 C SER A 217 23.855 7.659 16.763 1.00 30.38 C ATOM 1499 O SER A 217 23.426 7.450 15.617 1.00 32.96 O ATOM 1500 CB SER A 217 24.234 10.132 16.635 1.00 31.29 C ATOM 1501 OG SER A 217 24.774 11.159 17.445 1.00 33.82 O ATOM 0 H SER A 217 26.237 9.167 15.676 1.00 31.26 H new ATOM 0 HA SER A 217 25.065 8.810 17.979 1.00 31.45 H new ATOM 0 HB2 SER A 217 24.414 10.316 15.700 1.00 31.29 H new ATOM 0 HB3 SER A 217 23.270 10.099 16.738 1.00 31.29 H new ATOM 0 HG SER A 217 24.437 11.896 17.225 1.00 33.82 H new ATOM 1502 N ARG A 218 23.466 6.939 17.808 1.00 28.06 N ATOM 1503 CA ARG A 218 22.556 5.809 17.638 1.00 25.99 C ATOM 1504 C ARG A 218 21.816 5.674 18.947 1.00 25.41 C ATOM 1505 O ARG A 218 22.388 5.953 19.999 1.00 25.29 O ATOM 1506 CB ARG A 218 23.385 4.540 17.350 1.00 23.25 C ATOM 1507 CG ARG A 218 22.585 3.269 17.125 1.00 23.06 C ATOM 1508 CD ARG A 218 23.497 2.025 17.048 1.00 21.41 C ATOM 1509 NE ARG A 218 24.163 1.781 18.321 1.00 21.56 N ATOM 1510 CZ ARG A 218 23.736 0.937 19.251 1.00 20.02 C ATOM 1511 NH1 ARG A 218 22.642 0.238 19.067 1.00 18.25 N ATOM 1512 NH2 ARG A 218 24.396 0.821 20.390 1.00 19.68 N ATOM 0 H ARG A 218 23.714 7.085 18.618 1.00 28.06 H new ATOM 0 HA ARG A 218 21.937 5.937 16.902 1.00 25.99 H new ATOM 0 HB2 ARG A 218 23.932 4.702 16.565 1.00 23.25 H new ATOM 0 HB3 ARG A 218 23.991 4.394 18.093 1.00 23.25 H new ATOM 0 HG2 ARG A 218 21.945 3.157 17.846 1.00 23.06 H new ATOM 0 HG3 ARG A 218 22.076 3.348 16.303 1.00 23.06 H new ATOM 0 HD2 ARG A 218 22.970 1.249 16.802 1.00 21.41 H new ATOM 0 HD3 ARG A 218 24.161 2.150 16.351 1.00 21.41 H new ATOM 0 HE ARG A 218 24.887 2.217 18.481 1.00 21.56 H new ATOM 0 HH11 ARG A 218 22.194 0.324 18.338 1.00 18.25 H new ATOM 0 HH12 ARG A 218 22.372 -0.307 19.675 1.00 18.25 H new ATOM 0 HH21 ARG A 218 25.102 1.293 20.528 1.00 19.68 H new ATOM 0 HH22 ARG A 218 24.120 0.274 20.993 1.00 19.68 H new ATOM 1513 N VAL A 219 20.546 5.280 18.885 1.00 24.57 N ATOM 1514 CA VAL A 219 19.751 5.073 20.095 1.00 25.60 C ATOM 1515 C VAL A 219 20.186 3.704 20.650 1.00 25.27 C ATOM 1516 O VAL A 219 20.547 2.804 19.881 1.00 23.14 O ATOM 1517 CB VAL A 219 18.229 5.062 19.779 1.00 25.57 C ATOM 1518 CG1 VAL A 219 17.896 3.867 18.884 1.00 26.79 C ATOM 1519 CG2 VAL A 219 17.416 5.045 21.065 1.00 26.68 C ATOM 0 H VAL A 219 20.125 5.127 18.151 1.00 24.57 H new ATOM 0 HA VAL A 219 19.896 5.790 20.732 1.00 25.60 H new ATOM 0 HB VAL A 219 17.995 5.873 19.301 1.00 25.57 H new ATOM 0 HG11 VAL A 219 16.946 3.863 18.689 1.00 26.79 H new ATOM 0 HG12 VAL A 219 18.396 3.934 18.055 1.00 26.79 H new ATOM 0 HG13 VAL A 219 18.135 3.045 19.340 1.00 26.79 H new ATOM 0 HG21 VAL A 219 16.470 5.038 20.850 1.00 26.68 H new ATOM 0 HG22 VAL A 219 17.636 4.251 21.577 1.00 26.68 H new ATOM 0 HG23 VAL A 219 17.622 5.835 21.589 1.00 26.68 H new ATOM 1520 N CYS A 220 20.143 3.565 21.975 1.00 26.08 N ATOM 1521 CA CYS A 220 20.566 2.347 22.638 1.00 26.29 C ATOM 1522 C CYS A 220 19.450 1.518 23.245 1.00 25.95 C ATOM 1523 O CYS A 220 18.490 2.051 23.754 1.00 25.30 O ATOM 1524 CB CYS A 220 21.562 2.695 23.739 1.00 27.17 C ATOM 1525 SG CYS A 220 22.722 3.962 23.175 1.00 31.94 S ATOM 0 H CYS A 220 19.866 4.179 22.510 1.00 26.08 H new ATOM 0 HA CYS A 220 20.959 1.799 21.940 1.00 26.29 H new ATOM 0 HB2 CYS A 220 21.087 3.011 24.523 1.00 27.17 H new ATOM 0 HB3 CYS A 220 22.049 1.899 24.004 1.00 27.17 H new ATOM 1526 N GLY A 221 19.640 0.199 23.164 1.00 26.53 N ATOM 1527 CA GLY A 221 18.687 -0.719 23.749 1.00 27.31 C ATOM 1528 C GLY A 221 17.466 -1.054 22.955 1.00 28.11 C ATOM 1529 O GLY A 221 16.574 -1.769 23.443 1.00 28.78 O ATOM 0 H GLY A 221 20.311 -0.174 22.776 1.00 26.53 H new ATOM 0 HA2 GLY A 221 19.152 -1.547 23.944 1.00 27.31 H new ATOM 0 HA3 GLY A 221 18.398 -0.349 24.598 1.00 27.31 H new ATOM 1530 N ASN A 222 17.407 -0.549 21.735 1.00 29.16 N ATOM 1531 CA ASN A 222 16.281 -0.788 20.847 1.00 30.65 C ATOM 1532 C ASN A 222 16.637 -1.937 19.934 1.00 30.42 C ATOM 1533 O ASN A 222 17.510 -1.805 19.084 1.00 29.86 O ATOM 1534 CB ASN A 222 16.001 0.480 20.024 1.00 31.85 C ATOM 1535 CG ASN A 222 14.791 0.330 19.079 1.00 34.74 C ATOM 1536 OD1 ASN A 222 14.228 -0.768 18.910 1.00 34.00 O ATOM 1537 ND2 ASN A 222 14.398 1.441 18.452 1.00 34.78 N ATOM 0 H ASN A 222 18.023 -0.054 21.395 1.00 29.16 H new ATOM 0 HA ASN A 222 15.485 -1.008 21.356 1.00 30.65 H new ATOM 0 HB2 ASN A 222 15.844 1.223 20.627 1.00 31.85 H new ATOM 0 HB3 ASN A 222 16.788 0.701 19.501 1.00 31.85 H new ATOM 0 HD21 ASN A 222 13.733 1.415 17.908 1.00 34.78 H new ATOM 0 HD22 ASN A 222 14.810 2.183 18.592 1.00 34.78 H new ATOM 1538 N ARG A 223 15.950 -3.056 20.093 1.00 31.30 N ATOM 1539 CA ARG A 223 16.219 -4.229 19.276 1.00 33.46 C ATOM 1540 C ARG A 223 16.021 -4.046 17.757 1.00 32.65 C ATOM 1541 O ARG A 223 16.379 -4.923 16.956 1.00 33.44 O ATOM 1542 CB ARG A 223 15.368 -5.430 19.726 1.00 37.11 C ATOM 1543 CG ARG A 223 14.045 -5.019 20.372 1.00 42.66 C ATOM 1544 CD ARG A 223 12.822 -5.533 19.610 1.00 46.91 C ATOM 1545 NE ARG A 223 11.600 -4.780 19.923 1.00 49.81 N ATOM 1546 CZ ARG A 223 10.527 -4.721 19.123 1.00 51.23 C ATOM 1547 NH1 ARG A 223 10.502 -5.370 17.952 1.00 51.90 N ATOM 1548 NH2 ARG A 223 9.416 -4.029 19.412 1.00 53.35 N ATOM 0 H ARG A 223 15.321 -3.159 20.670 1.00 31.30 H new ATOM 0 HA ARG A 223 17.165 -4.387 19.419 1.00 33.46 H new ATOM 0 HB2 ARG A 223 15.185 -5.995 18.959 1.00 37.11 H new ATOM 0 HB3 ARG A 223 15.878 -5.963 20.356 1.00 37.11 H new ATOM 0 HG2 ARG A 223 14.017 -5.354 21.282 1.00 42.66 H new ATOM 0 HG3 ARG A 223 14.004 -4.051 20.425 1.00 42.66 H new ATOM 0 HD2 ARG A 223 12.994 -5.481 18.657 1.00 46.91 H new ATOM 0 HD3 ARG A 223 12.684 -6.469 19.822 1.00 46.91 H new ATOM 0 HE ARG A 223 11.572 -4.350 20.667 1.00 49.81 H new ATOM 0 HH11 ARG A 223 11.182 -5.834 17.703 1.00 51.90 H new ATOM 0 HH12 ARG A 223 9.806 -5.323 17.449 1.00 51.90 H new ATOM 0 HH21 ARG A 223 9.363 -3.588 20.148 1.00 53.35 H new ATOM 0 HH22 ARG A 223 8.756 -4.026 18.861 1.00 53.35 H new ATOM 1549 N LYS A 223A 15.473 -2.928 17.335 1.00 30.76 N ATOM 1550 CA LYS A 223A 15.254 -2.689 15.891 1.00 30.67 C ATOM 1551 C LYS A 223A 16.427 -1.899 15.291 1.00 29.48 C ATOM 1552 O LYS A 223A 16.446 -1.593 14.089 1.00 27.39 O ATOM 1553 CB LYS A 223A 13.959 -1.916 15.671 1.00 33.34 C ATOM 1554 CG LYS A 223A 12.713 -2.781 15.869 1.00 37.23 C ATOM 1555 CD LYS A 223A 11.419 -2.058 15.496 1.00 42.23 C ATOM 1556 CE LYS A 223A 10.164 -2.835 15.897 1.00 45.02 C ATOM 1557 NZ LYS A 223A 8.920 -2.132 15.554 1.00 48.22 N ATOM 0 H LYS A 223A 15.216 -2.288 17.850 1.00 30.76 H new ATOM 0 HA LYS A 223A 15.192 -3.550 15.449 1.00 30.67 H new ATOM 0 HB2 LYS A 223A 13.927 -1.165 16.284 1.00 33.34 H new ATOM 0 HB3 LYS A 223A 13.954 -1.550 14.773 1.00 33.34 H new ATOM 0 HG2 LYS A 223A 12.795 -3.585 15.332 1.00 37.23 H new ATOM 0 HG3 LYS A 223A 12.665 -3.063 16.796 1.00 37.23 H new ATOM 0 HD2 LYS A 223A 11.405 -1.188 15.924 1.00 42.23 H new ATOM 0 HD3 LYS A 223A 11.405 -1.903 14.539 1.00 42.23 H new ATOM 0 HE2 LYS A 223A 10.172 -3.701 15.459 1.00 45.02 H new ATOM 0 HE3 LYS A 223A 10.183 -3.000 16.853 1.00 45.02 H new ATOM 0 HZ1 LYS A 223A 8.222 -2.623 15.807 1.00 48.22 H new ATOM 0 HZ2 LYS A 223A 8.897 -1.347 15.973 1.00 48.22 H new ATOM 0 HZ3 LYS A 223A 8.886 -2.000 14.675 1.00 48.22 H new ATOM 1558 N LYS A 224 17.371 -1.591 16.160 1.00 27.97 N ATOM 1559 CA LYS A 224 18.590 -0.848 15.798 1.00 25.61 C ATOM 1560 C LYS A 224 19.801 -1.541 16.426 1.00 23.49 C ATOM 1561 O LYS A 224 20.317 -1.103 17.466 1.00 24.59 O ATOM 1562 CB LYS A 224 18.485 0.594 16.296 1.00 26.84 C ATOM 1563 CG LYS A 224 17.415 1.405 15.557 1.00 28.88 C ATOM 1564 CD LYS A 224 17.329 1.066 14.066 1.00 31.71 C ATOM 1565 CE LYS A 224 17.295 2.308 13.172 1.00 32.52 C ATOM 1566 NZ LYS A 224 16.423 2.151 11.999 1.00 32.68 N ATOM 0 H LYS A 224 17.332 -1.806 16.992 1.00 27.97 H new ATOM 0 HA LYS A 224 18.693 -0.834 14.834 1.00 25.61 H new ATOM 0 HB2 LYS A 224 18.283 0.590 17.245 1.00 26.84 H new ATOM 0 HB3 LYS A 224 19.345 1.031 16.191 1.00 26.84 H new ATOM 0 HG2 LYS A 224 16.552 1.244 15.970 1.00 28.88 H new ATOM 0 HG3 LYS A 224 17.606 2.351 15.658 1.00 28.88 H new ATOM 0 HD2 LYS A 224 18.090 0.517 13.820 1.00 31.71 H new ATOM 0 HD3 LYS A 224 16.533 0.536 13.905 1.00 31.71 H new ATOM 0 HE2 LYS A 224 16.992 3.067 13.694 1.00 32.52 H new ATOM 0 HE3 LYS A 224 18.196 2.510 12.874 1.00 32.52 H new ATOM 0 HZ1 LYS A 224 16.473 2.881 11.492 1.00 32.68 H new ATOM 0 HZ2 LYS A 224 16.685 1.444 11.527 1.00 32.68 H new ATOM 0 HZ3 LYS A 224 15.583 2.033 12.267 1.00 32.68 H new ATOM 1567 N PRO A 225 20.289 -2.628 15.816 1.00 21.13 N ATOM 1568 CA PRO A 225 21.402 -3.405 16.355 1.00 19.11 C ATOM 1569 C PRO A 225 22.633 -2.557 16.482 1.00 17.51 C ATOM 1570 O PRO A 225 22.767 -1.535 15.755 1.00 17.82 O ATOM 1571 CB PRO A 225 21.583 -4.507 15.345 1.00 19.80 C ATOM 1572 CG PRO A 225 20.267 -4.603 14.626 1.00 21.23 C ATOM 1573 CD PRO A 225 19.713 -3.213 14.604 1.00 20.48 C ATOM 0 HA PRO A 225 21.235 -3.746 17.247 1.00 19.11 H new ATOM 0 HB2 PRO A 225 22.304 -4.303 14.730 1.00 19.80 H new ATOM 0 HB3 PRO A 225 21.808 -5.345 15.778 1.00 19.80 H new ATOM 0 HG2 PRO A 225 20.386 -4.945 13.726 1.00 21.23 H new ATOM 0 HG3 PRO A 225 19.664 -5.211 15.083 1.00 21.23 H new ATOM 0 HD2 PRO A 225 19.980 -2.730 13.807 1.00 20.48 H new ATOM 0 HD3 PRO A 225 18.743 -3.210 14.626 1.00 20.48 H new ATOM 1574 N GLY A 226 23.483 -3.004 17.388 1.00 15.92 N ATOM 1575 CA GLY A 226 24.769 -2.356 17.621 1.00 14.59 C ATOM 1576 C GLY A 226 25.663 -2.643 16.420 1.00 14.70 C ATOM 1577 O GLY A 226 25.691 -3.765 15.898 1.00 15.11 O ATOM 0 H GLY A 226 23.336 -3.689 17.886 1.00 15.92 H new ATOM 0 HA2 GLY A 226 24.652 -1.400 17.736 1.00 14.59 H new ATOM 0 HA3 GLY A 226 25.176 -2.692 18.435 1.00 14.59 H new ATOM 1578 N ILE A 227 26.363 -1.620 15.993 1.00 12.92 N ATOM 1579 CA ILE A 227 27.280 -1.729 14.856 1.00 12.63 C ATOM 1580 C ILE A 227 28.719 -1.672 15.370 1.00 13.63 C ATOM 1581 O ILE A 227 29.055 -0.841 16.201 1.00 12.66 O ATOM 1582 CB ILE A 227 27.020 -0.592 13.870 1.00 12.39 C ATOM 1583 CG1 ILE A 227 25.586 -0.593 13.334 1.00 13.56 C ATOM 1584 CG2 ILE A 227 27.926 -0.651 12.639 1.00 10.36 C ATOM 1585 CD1 ILE A 227 25.118 0.788 12.875 1.00 12.68 C ATOM 0 H ILE A 227 26.329 -0.836 16.346 1.00 12.92 H new ATOM 0 HA ILE A 227 27.138 -2.571 14.397 1.00 12.63 H new ATOM 0 HB ILE A 227 27.198 0.208 14.390 1.00 12.39 H new ATOM 0 HG12 ILE A 227 25.524 -1.213 12.591 1.00 13.56 H new ATOM 0 HG13 ILE A 227 24.988 -0.918 14.025 1.00 13.56 H new ATOM 0 HG21 ILE A 227 27.719 0.091 12.049 1.00 10.36 H new ATOM 0 HG22 ILE A 227 28.854 -0.594 12.917 1.00 10.36 H new ATOM 0 HG23 ILE A 227 27.780 -1.487 12.170 1.00 10.36 H new ATOM 0 HD11 ILE A 227 24.207 0.729 12.547 1.00 12.68 H new ATOM 0 HD12 ILE A 227 25.152 1.406 13.622 1.00 12.68 H new ATOM 0 HD13 ILE A 227 25.697 1.107 12.165 1.00 12.68 H new ATOM 1586 N TYR A 228 29.554 -2.582 14.879 1.00 14.18 N ATOM 1587 CA TYR A 228 30.943 -2.670 15.280 1.00 12.35 C ATOM 1588 C TYR A 228 31.770 -2.850 14.018 1.00 14.00 C ATOM 1589 O TYR A 228 31.359 -3.540 13.067 1.00 12.51 O ATOM 1590 CB TYR A 228 31.120 -3.872 16.215 1.00 11.83 C ATOM 1591 CG TYR A 228 30.160 -3.812 17.408 1.00 13.11 C ATOM 1592 CD1 TYR A 228 28.834 -4.241 17.264 1.00 12.15 C ATOM 1593 CD2 TYR A 228 30.602 -3.324 18.645 1.00 13.84 C ATOM 1594 CE1 TYR A 228 27.947 -4.156 18.345 1.00 11.73 C ATOM 1595 CE2 TYR A 228 29.714 -3.232 19.723 1.00 13.78 C ATOM 1596 CZ TYR A 228 28.385 -3.643 19.572 1.00 14.79 C ATOM 1597 OH TYR A 228 27.517 -3.535 20.614 1.00 13.92 O ATOM 0 H TYR A 228 29.322 -3.171 14.297 1.00 14.18 H new ATOM 0 HA TYR A 228 31.227 -1.872 15.752 1.00 12.35 H new ATOM 0 HB2 TYR A 228 30.969 -4.692 15.719 1.00 11.83 H new ATOM 0 HB3 TYR A 228 32.035 -3.899 16.537 1.00 11.83 H new ATOM 0 HD1 TYR A 228 28.542 -4.583 16.450 1.00 12.15 H new ATOM 0 HD2 TYR A 228 31.488 -3.061 18.750 1.00 13.84 H new ATOM 0 HE1 TYR A 228 27.067 -4.440 18.248 1.00 11.73 H new ATOM 0 HE2 TYR A 228 30.007 -2.898 20.540 1.00 13.78 H new ATOM 0 HH TYR A 228 27.936 -3.614 21.338 1.00 13.92 H new ATOM 1598 N THR A 229 32.920 -2.182 13.992 1.00 14.84 N ATOM 1599 CA THR A 229 33.851 -2.289 12.861 1.00 14.17 C ATOM 1600 C THR A 229 34.715 -3.571 12.999 1.00 13.99 C ATOM 1601 O THR A 229 35.299 -3.837 14.065 1.00 14.10 O ATOM 1602 CB THR A 229 34.789 -1.076 12.809 1.00 14.56 C ATOM 1603 OG1 THR A 229 34.032 0.134 12.710 1.00 15.19 O ATOM 1604 CG2 THR A 229 35.730 -1.199 11.630 1.00 16.05 C ATOM 0 H THR A 229 33.184 -1.658 14.621 1.00 14.84 H new ATOM 0 HA THR A 229 33.324 -2.326 12.047 1.00 14.17 H new ATOM 0 HB THR A 229 35.310 -1.050 13.627 1.00 14.56 H new ATOM 0 HG1 THR A 229 33.755 0.228 11.922 1.00 15.19 H new ATOM 0 HG21 THR A 229 36.319 -0.429 11.604 1.00 16.05 H new ATOM 0 HG22 THR A 229 36.259 -2.007 11.721 1.00 16.05 H new ATOM 0 HG23 THR A 229 35.216 -1.240 10.808 1.00 16.05 H new ATOM 1605 N ARG A 230 34.796 -4.377 11.947 1.00 12.33 N ATOM 1606 CA ARG A 230 35.589 -5.599 12.012 1.00 12.76 C ATOM 1607 C ARG A 230 37.073 -5.284 11.870 1.00 12.48 C ATOM 1608 O ARG A 230 37.486 -4.698 10.878 1.00 14.53 O ATOM 1609 CB ARG A 230 35.122 -6.575 10.938 1.00 13.27 C ATOM 1610 CG ARG A 230 33.648 -6.912 11.022 1.00 15.33 C ATOM 1611 CD ARG A 230 33.389 -8.375 10.741 1.00 18.93 C ATOM 1612 NE ARG A 230 33.760 -8.632 9.372 1.00 19.67 N ATOM 1613 CZ ARG A 230 34.670 -9.495 8.954 1.00 20.15 C ATOM 1614 NH1 ARG A 230 35.363 -10.240 9.769 1.00 22.00 N ATOM 1615 NH2 ARG A 230 34.912 -9.538 7.671 1.00 23.71 N ATOM 0 H ARG A 230 34.405 -4.238 11.194 1.00 12.33 H new ATOM 0 HA ARG A 230 35.462 -6.015 12.879 1.00 12.76 H new ATOM 0 HB2 ARG A 230 35.310 -6.197 10.065 1.00 13.27 H new ATOM 0 HB3 ARG A 230 35.637 -7.394 11.010 1.00 13.27 H new ATOM 0 HG2 ARG A 230 33.315 -6.688 11.905 1.00 15.33 H new ATOM 0 HG3 ARG A 230 33.155 -6.369 10.387 1.00 15.33 H new ATOM 0 HD2 ARG A 230 33.904 -8.934 11.344 1.00 18.93 H new ATOM 0 HD3 ARG A 230 32.454 -8.589 10.886 1.00 18.93 H new ATOM 0 HE ARG A 230 33.349 -8.179 8.767 1.00 19.67 H new ATOM 0 HH11 ARG A 230 35.237 -10.182 10.618 1.00 22.00 H new ATOM 0 HH12 ARG A 230 35.946 -10.790 9.458 1.00 22.00 H new ATOM 0 HH21 ARG A 230 34.486 -9.017 7.135 1.00 23.71 H new ATOM 0 HH22 ARG A 230 35.498 -10.087 7.362 1.00 23.71 H new ATOM 1616 N VAL A 231 37.897 -5.651 12.851 1.00 12.77 N ATOM 1617 CA VAL A 231 39.320 -5.334 12.770 1.00 13.11 C ATOM 1618 C VAL A 231 40.049 -6.174 11.751 1.00 13.66 C ATOM 1619 O VAL A 231 41.064 -5.716 11.222 1.00 14.52 O ATOM 1620 CB VAL A 231 40.074 -5.488 14.110 1.00 12.91 C ATOM 1621 CG1 VAL A 231 39.353 -4.733 15.178 1.00 14.77 C ATOM 1622 CG2 VAL A 231 40.265 -6.937 14.451 1.00 11.50 C ATOM 0 H VAL A 231 37.657 -6.076 13.559 1.00 12.77 H new ATOM 0 HA VAL A 231 39.324 -4.401 12.506 1.00 13.11 H new ATOM 0 HB VAL A 231 40.963 -5.108 14.031 1.00 12.91 H new ATOM 0 HG11 VAL A 231 39.827 -4.830 16.019 1.00 14.77 H new ATOM 0 HG12 VAL A 231 39.310 -3.794 14.938 1.00 14.77 H new ATOM 0 HG13 VAL A 231 38.454 -5.084 15.272 1.00 14.77 H new ATOM 0 HG21 VAL A 231 40.739 -7.011 15.294 1.00 11.50 H new ATOM 0 HG22 VAL A 231 39.400 -7.368 14.528 1.00 11.50 H new ATOM 0 HG23 VAL A 231 40.780 -7.369 13.752 1.00 11.50 H new ATOM 1623 N ALA A 232 39.560 -7.391 11.497 1.00 13.13 N ATOM 1624 CA ALA A 232 40.193 -8.265 10.522 1.00 14.39 C ATOM 1625 C ALA A 232 40.210 -7.586 9.173 1.00 16.87 C ATOM 1626 O ALA A 232 41.167 -7.722 8.423 1.00 18.81 O ATOM 1627 CB ALA A 232 39.464 -9.575 10.418 1.00 12.97 C ATOM 0 H ALA A 232 38.865 -7.723 11.880 1.00 13.13 H new ATOM 0 HA ALA A 232 41.101 -8.444 10.814 1.00 14.39 H new ATOM 0 HB1 ALA A 232 39.904 -10.139 9.763 1.00 12.97 H new ATOM 0 HB2 ALA A 232 39.469 -10.018 11.281 1.00 12.97 H new ATOM 0 HB3 ALA A 232 38.548 -9.415 10.143 1.00 12.97 H new ATOM 1628 N SER A 233 39.145 -6.856 8.854 1.00 16.87 N ATOM 1629 CA SER A 233 39.058 -6.162 7.583 1.00 17.06 C ATOM 1630 C SER A 233 40.091 -5.058 7.485 1.00 17.36 C ATOM 1631 O SER A 233 40.309 -4.529 6.403 1.00 17.25 O ATOM 1632 CB SER A 233 37.677 -5.540 7.394 1.00 17.45 C ATOM 1633 OG SER A 233 36.684 -6.532 7.206 1.00 23.17 O ATOM 0 H SER A 233 38.461 -6.752 9.365 1.00 16.87 H new ATOM 0 HA SER A 233 39.222 -6.823 6.892 1.00 17.06 H new ATOM 0 HB2 SER A 233 37.455 -5.000 8.169 1.00 17.45 H new ATOM 0 HB3 SER A 233 37.691 -4.945 6.628 1.00 17.45 H new ATOM 0 HG SER A 233 36.141 -6.277 6.618 1.00 23.17 H new ATOM 1634 N TYR A 234 40.718 -4.692 8.599 1.00 16.51 N ATOM 1635 CA TYR A 234 41.703 -3.617 8.564 1.00 15.28 C ATOM 1636 C TYR A 234 43.086 -4.087 8.995 1.00 15.33 C ATOM 1637 O TYR A 234 43.964 -3.283 9.314 1.00 14.82 O ATOM 1638 CB TYR A 234 41.226 -2.467 9.457 1.00 14.27 C ATOM 1639 CG TYR A 234 39.949 -1.792 8.944 1.00 12.42 C ATOM 1640 CD1 TYR A 234 40.028 -0.725 8.038 1.00 10.93 C ATOM 1641 CD2 TYR A 234 38.698 -2.239 9.382 1.00 13.03 C ATOM 1642 CE1 TYR A 234 38.857 -0.114 7.567 1.00 10.61 C ATOM 1643 CE2 TYR A 234 37.528 -1.627 8.913 1.00 13.11 C ATOM 1644 CZ TYR A 234 37.606 -0.565 8.004 1.00 11.86 C ATOM 1645 OH TYR A 234 36.466 0.023 7.548 1.00 11.46 O ATOM 0 H TYR A 234 40.591 -5.046 9.372 1.00 16.51 H new ATOM 0 HA TYR A 234 41.784 -3.313 7.647 1.00 15.28 H new ATOM 0 HB2 TYR A 234 41.069 -2.805 10.353 1.00 14.27 H new ATOM 0 HB3 TYR A 234 41.931 -1.804 9.524 1.00 14.27 H new ATOM 0 HD1 TYR A 234 40.858 -0.422 7.749 1.00 10.93 H new ATOM 0 HD2 TYR A 234 38.643 -2.944 9.986 1.00 13.03 H new ATOM 0 HE1 TYR A 234 38.912 0.592 6.964 1.00 10.61 H new ATOM 0 HE2 TYR A 234 36.698 -1.927 9.206 1.00 13.11 H new ATOM 0 HH TYR A 234 36.658 0.580 6.949 1.00 11.46 H new ATOM 1646 N ALA A 235 43.289 -5.397 8.984 1.00 15.32 N ATOM 1647 CA ALA A 235 44.561 -5.950 9.408 1.00 16.00 C ATOM 1648 C ALA A 235 45.761 -5.330 8.702 1.00 16.42 C ATOM 1649 O ALA A 235 46.820 -5.172 9.304 1.00 18.68 O ATOM 1650 CB ALA A 235 44.556 -7.455 9.217 1.00 16.06 C ATOM 0 H ALA A 235 42.706 -5.978 8.736 1.00 15.32 H new ATOM 0 HA ALA A 235 44.660 -5.732 10.348 1.00 16.00 H new ATOM 0 HB1 ALA A 235 45.408 -7.820 9.502 1.00 16.06 H new ATOM 0 HB2 ALA A 235 43.844 -7.846 9.747 1.00 16.06 H new ATOM 0 HB3 ALA A 235 44.413 -7.662 8.280 1.00 16.06 H new ATOM 1651 N ALA A 236 45.597 -4.967 7.430 1.00 16.28 N ATOM 1652 CA ALA A 236 46.691 -4.373 6.649 1.00 16.04 C ATOM 1653 C ALA A 236 47.031 -2.964 7.095 1.00 15.50 C ATOM 1654 O ALA A 236 48.210 -2.615 7.181 1.00 15.23 O ATOM 1655 CB ALA A 236 46.351 -4.368 5.151 1.00 16.00 C ATOM 0 H ALA A 236 44.859 -5.055 6.997 1.00 16.28 H new ATOM 0 HA ALA A 236 47.471 -4.928 6.806 1.00 16.04 H new ATOM 0 HB1 ALA A 236 47.084 -3.973 4.654 1.00 16.00 H new ATOM 0 HB2 ALA A 236 46.209 -5.279 4.848 1.00 16.00 H new ATOM 0 HB3 ALA A 236 45.545 -3.850 5.004 1.00 16.00 H new ATOM 1656 N TRP A 237 46.006 -2.163 7.378 1.00 14.59 N ATOM 1657 CA TRP A 237 46.218 -0.791 7.812 1.00 13.58 C ATOM 1658 C TRP A 237 46.928 -0.729 9.166 1.00 13.20 C ATOM 1659 O TRP A 237 47.830 0.087 9.386 1.00 12.18 O ATOM 1660 CB TRP A 237 44.876 -0.048 7.881 1.00 11.90 C ATOM 1661 CG TRP A 237 44.969 1.335 8.531 1.00 13.66 C ATOM 1662 CD1 TRP A 237 45.668 2.418 8.065 1.00 14.44 C ATOM 1663 CD2 TRP A 237 44.419 1.737 9.796 1.00 12.41 C ATOM 1664 NE1 TRP A 237 45.595 3.459 8.964 1.00 13.94 N ATOM 1665 CE2 TRP A 237 44.834 3.066 10.034 1.00 13.02 C ATOM 1666 CE3 TRP A 237 43.618 1.101 10.751 1.00 13.50 C ATOM 1667 CZ2 TRP A 237 44.477 3.768 11.191 1.00 12.21 C ATOM 1668 CZ3 TRP A 237 43.269 1.801 11.898 1.00 13.91 C ATOM 1669 CH2 TRP A 237 43.698 3.116 12.107 1.00 12.96 C ATOM 0 H TRP A 237 45.180 -2.398 7.324 1.00 14.59 H new ATOM 0 HA TRP A 237 46.792 -0.359 7.160 1.00 13.58 H new ATOM 0 HB2 TRP A 237 44.523 0.049 6.983 1.00 11.90 H new ATOM 0 HB3 TRP A 237 44.242 -0.588 8.378 1.00 11.90 H new ATOM 0 HD1 TRP A 237 46.127 2.446 7.256 1.00 14.44 H new ATOM 0 HE1 TRP A 237 45.966 4.229 8.869 1.00 13.94 H new ATOM 0 HE3 TRP A 237 43.326 0.228 10.620 1.00 13.50 H new ATOM 0 HZ2 TRP A 237 44.758 4.643 11.331 1.00 12.21 H new ATOM 0 HZ3 TRP A 237 42.739 1.387 12.541 1.00 13.91 H new ATOM 0 HH2 TRP A 237 43.448 3.557 12.887 1.00 12.96 H new ATOM 1670 N ILE A 238 46.522 -1.615 10.066 1.00 14.00 N ATOM 1671 CA ILE A 238 47.071 -1.667 11.418 1.00 14.02 C ATOM 1672 C ILE A 238 48.493 -2.101 11.308 1.00 15.30 C ATOM 1673 O ILE A 238 49.395 -1.413 11.777 1.00 16.47 O ATOM 1674 CB ILE A 238 46.245 -2.652 12.322 1.00 12.96 C ATOM 1675 CG1 ILE A 238 44.778 -2.191 12.357 1.00 12.48 C ATOM 1676 CG2 ILE A 238 46.791 -2.706 13.757 1.00 11.88 C ATOM 1677 CD1 ILE A 238 43.870 -3.026 13.293 1.00 13.87 C ATOM 0 H ILE A 238 45.917 -2.207 9.911 1.00 14.00 H new ATOM 0 HA ILE A 238 47.019 -0.794 11.838 1.00 14.02 H new ATOM 0 HB ILE A 238 46.318 -3.541 11.941 1.00 12.96 H new ATOM 0 HG12 ILE A 238 44.748 -1.263 12.638 1.00 12.48 H new ATOM 0 HG13 ILE A 238 44.417 -2.227 11.457 1.00 12.48 H new ATOM 0 HG21 ILE A 238 46.258 -3.322 14.283 1.00 11.88 H new ATOM 0 HG22 ILE A 238 47.713 -3.008 13.742 1.00 11.88 H new ATOM 0 HG23 ILE A 238 46.748 -1.822 14.153 1.00 11.88 H new ATOM 0 HD11 ILE A 238 42.965 -2.677 13.262 1.00 13.87 H new ATOM 0 HD12 ILE A 238 43.870 -3.951 13.003 1.00 13.87 H new ATOM 0 HD13 ILE A 238 44.206 -2.973 14.202 1.00 13.87 H new ATOM 1678 N ASP A 239 48.706 -3.231 10.655 1.00 18.12 N ATOM 1679 CA ASP A 239 50.056 -3.730 10.484 1.00 20.36 C ATOM 1680 C ASP A 239 50.981 -2.643 9.976 1.00 19.85 C ATOM 1681 O ASP A 239 52.092 -2.485 10.471 1.00 20.32 O ATOM 1682 CB ASP A 239 50.066 -4.910 9.528 1.00 22.36 C ATOM 1683 CG ASP A 239 49.779 -6.217 10.235 1.00 26.10 C ATOM 1684 OD1 ASP A 239 49.952 -6.255 11.472 1.00 28.71 O ATOM 1685 OD2 ASP A 239 49.374 -7.200 9.571 1.00 29.16 O ATOM 0 H ASP A 239 48.090 -3.719 10.307 1.00 18.12 H new ATOM 0 HA ASP A 239 50.378 -4.022 11.351 1.00 20.36 H new ATOM 0 HB2 ASP A 239 49.404 -4.767 8.833 1.00 22.36 H new ATOM 0 HB3 ASP A 239 50.930 -4.963 9.091 1.00 22.36 H new ATOM 1686 N SER A 240 50.495 -1.856 9.024 1.00 20.56 N ATOM 1687 CA SER A 240 51.284 -0.795 8.429 1.00 20.01 C ATOM 1688 C SER A 240 51.487 0.398 9.343 1.00 19.84 C ATOM 1689 O SER A 240 52.514 1.060 9.287 1.00 21.41 O ATOM 1690 CB SER A 240 50.650 -0.335 7.131 1.00 19.94 C ATOM 1691 OG SER A 240 50.142 0.970 7.281 1.00 24.21 O ATOM 0 H SER A 240 49.698 -1.925 8.707 1.00 20.56 H new ATOM 0 HA SER A 240 52.161 -1.174 8.263 1.00 20.01 H new ATOM 0 HB2 SER A 240 51.306 -0.355 6.417 1.00 19.94 H new ATOM 0 HB3 SER A 240 49.936 -0.941 6.878 1.00 19.94 H new ATOM 0 HG SER A 240 49.793 1.220 6.559 1.00 24.21 H new ATOM 1692 N VAL A 241 50.512 0.700 10.175 1.00 20.41 N ATOM 1693 CA VAL A 241 50.684 1.817 11.079 1.00 20.75 C ATOM 1694 C VAL A 241 51.623 1.434 12.234 1.00 22.61 C ATOM 1695 O VAL A 241 52.383 2.277 12.727 1.00 23.15 O ATOM 1696 CB VAL A 241 49.345 2.254 11.672 1.00 19.49 C ATOM 1697 CG1 VAL A 241 49.579 3.253 12.781 1.00 14.94 C ATOM 1698 CG2 VAL A 241 48.473 2.821 10.578 1.00 18.62 C ATOM 0 H VAL A 241 49.761 0.285 10.234 1.00 20.41 H new ATOM 0 HA VAL A 241 51.066 2.547 10.567 1.00 20.75 H new ATOM 0 HB VAL A 241 48.885 1.492 12.057 1.00 19.49 H new ATOM 0 HG11 VAL A 241 48.727 3.528 13.154 1.00 14.94 H new ATOM 0 HG12 VAL A 241 50.120 2.845 13.475 1.00 14.94 H new ATOM 0 HG13 VAL A 241 50.041 4.029 12.426 1.00 14.94 H new ATOM 0 HG21 VAL A 241 47.623 3.099 10.953 1.00 18.62 H new ATOM 0 HG22 VAL A 241 48.914 3.586 10.176 1.00 18.62 H new ATOM 0 HG23 VAL A 241 48.321 2.143 9.901 1.00 18.62 H new ATOM 1699 N LEU A 242 51.574 0.177 12.673 1.00 24.36 N ATOM 1700 CA LEU A 242 52.430 -0.266 13.786 1.00 26.72 C ATOM 1701 C LEU A 242 53.836 -0.699 13.333 1.00 30.37 C ATOM 1702 O LEU A 242 54.699 -1.017 14.168 1.00 30.83 O ATOM 1703 CB LEU A 242 51.762 -1.419 14.543 1.00 24.45 C ATOM 1704 CG LEU A 242 50.768 -1.058 15.650 1.00 23.79 C ATOM 1705 CD1 LEU A 242 49.820 0.045 15.170 1.00 22.91 C ATOM 1706 CD2 LEU A 242 49.996 -2.311 16.050 1.00 21.46 C ATOM 0 H LEU A 242 51.060 -0.432 12.348 1.00 24.36 H new ATOM 0 HA LEU A 242 52.539 0.502 14.369 1.00 26.72 H new ATOM 0 HB2 LEU A 242 51.300 -1.974 13.895 1.00 24.45 H new ATOM 0 HB3 LEU A 242 52.462 -1.964 14.936 1.00 24.45 H new ATOM 0 HG LEU A 242 51.244 -0.721 16.425 1.00 23.79 H new ATOM 0 HD11 LEU A 242 49.195 0.266 15.878 1.00 22.91 H new ATOM 0 HD12 LEU A 242 50.334 0.834 14.935 1.00 22.91 H new ATOM 0 HD13 LEU A 242 49.330 -0.265 14.392 1.00 22.91 H new ATOM 0 HD21 LEU A 242 49.363 -2.091 16.752 1.00 21.46 H new ATOM 0 HD22 LEU A 242 49.517 -2.656 15.280 1.00 21.46 H new ATOM 0 HD23 LEU A 242 50.616 -2.984 16.373 1.00 21.46 H new ATOM 1707 N ALA A 243 54.060 -0.693 12.013 1.00 32.51 N ATOM 1708 CA ALA A 243 55.340 -1.071 11.414 1.00 34.21 C ATOM 1709 C ALA A 243 56.450 -0.038 11.682 1.00 35.95 C ATOM 1710 O ALA A 243 57.536 -0.444 12.171 1.00 36.84 O ATOM 1711 CB ALA A 243 55.162 -1.243 9.929 1.00 32.78 C ATOM 1712 OXT ALA A 243 56.229 1.165 11.385 1.00 37.60 O ATOM 0 H ALA A 243 53.463 -0.466 11.437 1.00 32.51 H new ATOM 0 HA ALA A 243 55.618 -1.904 11.826 1.00 34.21 H new ATOM 0 HB1 ALA A 243 56.009 -1.494 9.528 1.00 32.78 H new ATOM 0 HB2 ALA A 243 54.506 -1.938 9.760 1.00 32.78 H new ATOM 0 HB3 ALA A 243 54.856 -0.409 9.541 1.00 32.78 H new TER 1713 ALA A 243 HETATM 1714 O HOH A 301 33.634 1.570 10.684 1.00 8.53 O HETATM 1715 O HOH A 302 42.871 -3.326 34.625 1.00 9.89 O HETATM 1716 O HOH A 303 34.239 3.270 27.378 1.00 10.07 O HETATM 1717 O HOH A 304 38.930 -2.873 35.221 1.00 10.49 O HETATM 1718 O HOH A 305 34.688 1.739 15.065 1.00 10.72 O HETATM 1719 O HOH A 306 41.375 -1.808 32.830 1.00 10.89 O HETATM 1720 O HOH A 307 42.047 1.456 31.643 1.00 11.67 O HETATM 1721 O HOH A 308 19.506 0.625 19.633 1.00 12.16 O HETATM 1722 O HOH A 309 29.073 1.904 31.014 1.00 13.06 O HETATM 1723 O HOH A 310 32.038 -0.017 5.806 1.00 13.31 O HETATM 1724 O HOH A 311 39.368 -4.439 33.343 1.00 13.33 O HETATM 1725 O HOH A 312 34.236 1.233 25.573 1.00 13.75 O HETATM 1726 O HOH A 313 26.132 12.171 29.991 1.00 13.77 O HETATM 1727 O HOH A 314 37.126 -6.155 33.635 1.00 14.10 O HETATM 1728 O HOH A 315 44.060 -1.450 30.841 1.00 14.19 O HETATM 1729 O HOH A 316 33.936 0.374 8.192 1.00 14.29 O HETATM 1730 O HOH A 317 47.770 -7.560 20.244 1.00 14.63 O HETATM 1731 O HOH A 318 37.137 -9.037 12.637 1.00 15.12 O HETATM 1732 O HOH A 319 54.318 -1.353 20.379 1.00 16.06 O HETATM 1733 O HOH A 320 24.544 -3.903 20.372 1.00 16.43 O HETATM 1734 O HOH A 321 48.855 13.907 24.712 1.00 17.99 O HETATM 1735 O HOH A 322 32.099 7.306 32.743 1.00 18.37 O HETATM 1736 O HOH A 323 50.708 0.842 32.254 1.00 18.77 O HETATM 1737 O HOH A 324 42.225 -0.295 5.272 1.00 19.28 O HETATM 1738 O HOH A 325 34.131 7.286 9.230 1.00 20.51 O HETATM 1739 O HOH A 326 43.184 14.434 29.091 1.00 20.56 O HETATM 1740 O HOH A 327 33.903 -10.739 12.204 1.00 21.56 O HETATM 1741 O HOH A 328 48.718 13.546 15.787 1.00 23.03 O HETATM 1742 O HOH A 329 25.164 -1.191 32.701 1.00 23.10 O HETATM 1743 O HOH A 330 49.838 -3.669 35.755 1.00 23.20 O HETATM 1744 O HOH A 331 26.630 -9.283 11.713 1.00 24.27 O HETATM 1745 O HOH A 332 23.981 -8.376 31.819 1.00 24.38 O HETATM 1746 O HOH A 333 36.181 -14.394 13.080 1.00 25.37 O HETATM 1747 O HOH A 334 59.301 6.395 23.583 1.00 25.46 O HETATM 1748 O HOH A 335 35.541 -6.802 26.700 1.00 25.62 O HETATM 1749 O HOH A 336 56.457 -2.846 28.364 1.00 26.54 O HETATM 1750 O HOH A 337 43.041 -6.193 5.652 1.00 27.03 O HETATM 1751 O HOH A 338 22.209 -0.329 32.815 1.00 27.66 O HETATM 1752 O HOH A 339 27.472 0.369 18.284 1.00 29.10 O HETATM 1753 O HOH A 340 36.949 -14.704 17.864 1.00 30.52 O HETATM 1754 O HOH A 341 47.270 -10.584 17.126 1.00 30.66 O HETATM 1755 O HOH A 342 28.104 -13.038 12.087 1.00 31.16 O HETATM 1756 O HOH A 343 43.739 -10.009 34.780 1.00 32.51 O HETATM 1757 O HOH A 344 41.348 10.706 8.223 1.00 33.13 O HETATM 1758 O HOH A 345 48.140 20.138 24.998 1.00 33.36 O HETATM 1759 O HOH A 346 26.756 -13.557 9.009 1.00 33.83 O HETATM 1760 O HOH A 348 49.573 -6.308 6.026 1.00 34.99 O HETATM 1761 O HOH A 349 45.661 -0.349 4.304 1.00 35.09 O HETATM 1762 O HOH A 350 49.833 -6.297 17.788 1.00 35.31 O HETATM 1763 O HOH A 351 46.483 15.509 15.701 1.00 35.61 O HETATM 1764 O HOH A 352 14.399 -3.508 22.645 1.00 36.63 O HETATM 1765 O HOH A 353 55.721 1.617 16.800 1.00 37.14 O HETATM 1766 O HOH A 354 27.335 7.154 20.259 1.00 37.30 O HETATM 1767 O HOH A 355 30.969 -9.326 36.250 1.00 37.54 O HETATM 1768 O HOH A 356 53.660 -4.968 21.478 1.00 37.84 O HETATM 1769 O HOH A 357 34.249 -10.063 34.860 1.00 37.87 O HETATM 1770 O HOH A 358 27.035 -8.082 32.478 1.00 38.43 O HETATM 1771 O HOH A 359 20.744 5.979 8.619 1.00 39.22 O HETATM 1772 O HOH A 360 35.564 8.516 45.842 1.00 40.32 O HETATM 1773 O HOH A 361 49.358 0.619 4.227 1.00 40.43 O HETATM 1774 O HOH A 362 19.888 4.008 3.433 1.00 40.65 O HETATM 1775 O HOH A 363 26.562 11.390 34.740 1.00 41.43 O HETATM 1776 O HOH A 364 48.343 -2.822 46.540 1.00 42.31 O HETATM 1777 O HOH A 365 37.768 -17.680 13.237 1.00 43.88 O HETATM 1778 O HOH A 366 19.808 -12.769 24.105 1.00 45.41 O HETATM 1779 O HOH A 367 27.310 -5.076 39.364 1.00 45.56 O HETATM 1780 O HOH A 368 52.555 -8.084 24.501 1.00 45.62 O HETATM 1781 O HOH A 369 39.707 9.790 34.736 1.00 46.40 O HETATM 1782 O HOH A 370 21.056 -9.246 23.804 1.00 46.48 O HETATM 1783 O HOH A 371 27.279 6.198 6.516 1.00 48.54 O HETATM 1784 O HOH A 372 56.358 -4.382 30.944 1.00 48.59 O HETATM 1785 O HOH A 373 44.259 21.323 30.143 1.00 49.80 O HETATM 1786 O HOH A 374 7.247 0.067 11.100 1.00 52.01 O HETATM 1787 O HOH A 375 20.310 2.853 7.060 1.00 52.42 O HETATM 1788 O HOH A 376 16.556 -7.815 15.487 1.00 53.65 O CONECT 192 306 CONECT 306 192 CONECT 928 1428 CONECT 1164 1295 CONECT 1295 1164 CONECT 1365 1525 CONECT 1428 928 CONECT 1525 1365 END