USER MOD reduce.3.24.130724 H: found=0, std=0, add=997, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 212 hydrogens (6 hets) HEADER ELECTRON TRANSPORT 09-FEB-06 2FZ5 TITLE SOLUTION STRUCTURE OF TWO-ELECTRON REDUCED MEGASPHAERA TITLE 2 ELSDENII FLAVODOXIN COMPND MOL_ID: 1; COMPND 2 MOLECULE: FLAVODOXIN; COMPND 3 CHAIN: A SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: MEGASPHAERA ELSDENII; SOURCE 3 ORGANISM_TAXID: 907 KEYWDS ALPHA/BETA DOUBLY-WOUND TOPOLOGY, NON-COVALENTLY BOUND FMN, KEYWDS 2 ELECTRON TRANSPORT EXPDTA SOLUTION NMR AUTHOR C.P.M.VAN MIERLO,P.LIJNZAAD,J.VERVOORT,F.MUELLER, AUTHOR 2 H.J.BERENDSEN,J.DE VLIEG REVDAT 3 24-FEB-09 2FZ5 1 VERSN REVDAT 2 11-APR-06 2FZ5 1 FORMUL REVDAT 1 14-MAR-06 2FZ5 0 JRNL AUTH C.P.M.VAN MIERLO,P.LIJNZAAD,J.VERVOORT,F.MUELLER, JRNL AUTH 2 H.J.BERENDSEN,J.DE VLIEG JRNL TITL TERTIARY STRUCTURE OF TWO-ELECTRON REDUCED JRNL TITL 2 MEGASPHAERA ELSDENII FLAVODOXIN AND SOME JRNL TITL 3 IMPLICATIONS, AS DETERMINED BY TWO-DIMENSIONAL 1H JRNL TITL 4 NMR AND RESTRAINED MOLECULAR DYNAMICS JRNL REF EUR.J.BIOCHEM. V. 194 185 1990 JRNL REFN ISSN 0014-2956 JRNL PMID 2253614 JRNL DOI 10.1111/J.1432-1033.1990.TB19444.X REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH C.P.M.VAN MIERLO,F.MUELLER,J.VERVOORT REMARK 1 TITL SECONDARY AND TERTIARY STRUCTURE CHARACTERISTICS REMARK 1 TITL 2 OF MEGASPHAERA ELSDENII FLAVODOXIN IN THE REDUCED REMARK 1 TITL 3 STATE AS DETERMINED BY TWO-DIMENSIONAL 1H NMR REMARK 1 REF EUR.J.BIOCHEM. V. 189 589 1990 REMARK 1 REFN ISSN 0014-2956 REMARK 1 PMID 2161759 REMARK 1 DOI 10.1111/J.1432-1033.1990.TB15527.X REMARK 1 REFERENCE 2 REMARK 1 AUTH C.P.M.VAN MIERLO,J.VERVOORT,F.MUELLER,A.BACHER REMARK 1 TITL A TWO-DIMENSIONAL 1H NMR STUDY ON MEGASPHAERA REMARK 1 TITL 2 ELSDENII FLAVODOXIN IN THE REDUCED STATE: REMARK 1 TITL 3 SEQUENTIAL ASSIGNMENTS REMARK 1 REF EUR.J.BIOCHEM. V. 187 521 1990 REMARK 1 REFN ISSN 0014-2956 REMARK 1 PMID 2303055 REMARK 1 DOI 10.1111/J.1432-1033.1990.TB15334.X REMARK 1 REFERENCE 3 REMARK 1 AUTH C.P.M.VAN MIERLO,B.P.VAN DER SANDEN,P.VAN WOENSEL, REMARK 1 AUTH 2 F.MUELLER,J.VERVOORT REMARK 1 TITL A TWO-DIMENSIONAL 1H NMR STUDY ON MEGASPHAERA REMARK 1 TITL 2 ELSDENII FLAVODOXIN IN THE OXIDIZED STATE AND SOME REMARK 1 TITL 3 COMPARISONS WITH THE TWO-ELECTRON REDUCED STATE REMARK 1 REF EUR.J.BIOCHEM. V. 194 199 1990 REMARK 1 REFN ISSN 0014-2956 REMARK 1 PMID 2253616 REMARK 1 DOI 10.1111/J.1432-1033.1990.TB19445.X REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : GROMOS REMARK 3 AUTHORS : VAN GUNSTEREN AND BERENDSEN REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: THE XRAY STRUCTURE OF THE REMARK 3 SEMIQUINONE STATE OF CLOSTRIDIUM MP FLAVODOXIN WAS USED AS A REMARK 3 STARTING STRUCTURE FOR RESTRAINED MOLECULAR DYNAMICS (RMD) REMARK 3 CALCULATIONS IN VACUO (VAN MIERLO ET AL. EUR. J. BIOCHEM. 194, REMARK 3 185 - 198 (1990)). 509 DISTANCE RESTRAINTS, 293 MEDIUM, 216 REMARK 3 LONG-RANGE WERE USED IN REFINEMENT. ONE REPULSIVE RESTRAINT, REMARK 3 BETWEEN N5H OF FMN AND NH OF E60 WAS INCLUDED. RMD RUN WAS OF REMARK 3 120 PS. DURING THE FIRST 50 PS THE FORCE CONSTANT WAS REMARK 3 GRADUALLY INCREASED TO A HIGH VALUE OF 4000 KJMOL-1NM-2. FROM REMARK 3 50 PS ON, THE FORCE CONSTANT WAS KEPT CONSTANT. THE TIME SPAN REMARK 3 OF 60-120 PS, AT A TIME RESOLUTION OF 0.02 PS, WAS USED FOR REMARK 3 CALCULATING THE AVERAGE STRUCTURE. THE TIME-AVERAGED (NOT REMARK 3 ENERGY MINIMISED) STRUCTURE HAS A POTENTIAL ENERGY -2278 +/- REMARK 3 122 KJMOL-1, TIME-AVERAGED SUM OF ALL VIOLATIONS IS 2.27 NM, REMARK 3 LARGEST OCCURING VIOLATION IS 66 PM REMARK 4 REMARK 4 2FZ5 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 10-FEB-06. REMARK 100 THE RCSB ID CODE IS RCSB036485. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 303; 306; 310; 314; 316 REMARK 210 PH : 8.3; 8.3; 8.3; 8.3; 8.3 REMARK 210 IONIC STRENGTH : NULL; NULL; NULL; NULL; NULL REMARK 210 PRESSURE : NULL; NULL; NULL; NULL; NULL REMARK 210 SAMPLE CONTENTS : 6-10 MM PROTEIN, POTASSIUM REMARK 210 PHOSPHATE/POTASSIUM REMARK 210 PYROPHOSPHATE 75-200 MM, PH REMARK 210 8.3, 90% H2O, 10% D2O; 6-10 MM REMARK 210 PROTEIN, POTASSIUM PHOSPHATE/ REMARK 210 POTASSIUM PYROPHOSPHATE 75-200 REMARK 210 MM, PH 8.3, 99.9% D2O REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : COSY, DOUBLE QUANTUM FILTERED REMARK 210 COSY, NOESY (MIXING 200MS), REMARK 210 NOESY (MIXING 50, 100, 150 MS) REMARK 210 , DOUBLE QUANTUM SPECTRA, REMARK 210 HOMONUCLEAR HARTMANN HAHN REMARK 210 TRANSFER SPECTRA REMARK 210 SPECTROMETER FIELD STRENGTH : 500 MHZ, 600 MHZ REMARK 210 SPECTROMETER MODEL : WM, AM REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : DISNMR, GROMOS REMARK 210 METHOD USED : RESTRAINED MOLECULAR DYNAMICS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 3000 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: NOESY SPECTRA HAD MIXING TIMES 50, 100, 150 AND 200 MS. REMARK 210 DOUBLE QUANTUM SPECTRA HAD A DELAY OF 32 MS. HOMONUCLEAR REMARK 210 HARTMANN HAHN TRANSFER SPECTRA (USING MLEV-17 COMPOSITE PULSE REMARK 210 CYCLING) HAD MIXING TIMES 10-160 MS REMARK 215 REMARK 215 NMR STUDY REMARK 215 THE COORDINATES IN THIS ENTRY WERE GENERATED FROM SOLUTION REMARK 215 NMR DATA. PROTEIN DATA BANK CONVENTIONS REQUIRE THAT REMARK 215 CRYST1 AND SCALE RECORDS BE INCLUDED, BUT THE VALUES ON REMARK 215 THESE RECORDS ARE MEANINGLESS. 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 ASN A 118 OD1 - CG - ND2 ANGL. DEV. = -25.0 DEGREES REMARK 500 ASN A 118 CB - CG - OD1 ANGL. DEV. = 14.1 DEGREES REMARK 500 ASN A 118 CB - CG - ND2 ANGL. DEV. = -15.9 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 VAL A 66 -59.74 -122.38 REMARK 500 LEU A 78 59.95 -107.44 REMARK 500 LYS A 81 152.19 -49.43 REMARK 500 ILE A 112 53.61 -90.64 REMARK 500 GLU A 119 -73.62 62.31 REMARK 500 PRO A 121 -177.13 -63.04 REMARK 500 ASP A 122 -37.11 72.66 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 ARG A 35 0.11 SIDE_CHAIN REMARK 500 PHE A 70 0.08 SIDE_CHAIN REMARK 500 PHE A 71 0.08 SIDE_CHAIN REMARK 500 ASN A 118 0.16 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: MAIN CHAIN PLANARITY REMARK 500 REMARK 500 THE FOLLOWING RESIDUES HAVE A PSEUDO PLANARITY REMARK 500 TORSION, C(I) - CA(I) - N(I+1) - O(I), GREATER REMARK 500 10.0 DEGREES. (M=MODEL NUMBER; RES=RESIDUE NAME; REMARK 500 C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 500 I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI ANGLE REMARK 500 TRP A 96 -10.76 REMARK 500 REMARK 500 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE FNR A 138 DBREF 2FZ5 A 1 137 UNP P00321 FLAV_MEGEL 1 137 SEQRES 1 A 137 MET VAL GLU ILE VAL TYR TRP SER GLY THR GLY ASN THR SEQRES 2 A 137 GLU ALA MET ALA ASN GLU ILE GLU ALA ALA VAL LYS ALA SEQRES 3 A 137 ALA GLY ALA ASP VAL GLU SER VAL ARG PHE GLU ASP THR SEQRES 4 A 137 ASN VAL ASP ASP VAL ALA SER LYS ASP VAL ILE LEU LEU SEQRES 5 A 137 GLY CYS PRO ALA MET GLY SER GLU GLU LEU GLU ASP SER SEQRES 6 A 137 VAL VAL GLU PRO PHE PHE THR ASP LEU ALA PRO LYS LEU SEQRES 7 A 137 LYS GLY LYS LYS VAL GLY LEU PHE GLY SER TYR GLY TRP SEQRES 8 A 137 GLY SER GLY GLU TRP MET ASP ALA TRP LYS GLN ARG THR SEQRES 9 A 137 GLU ASP THR GLY ALA THR VAL ILE GLY THR ALA ILE VAL SEQRES 10 A 137 ASN GLU MET PRO ASP ASN ALA PRO GLU CYS LYS GLU LEU SEQRES 11 A 137 GLY GLU ALA ALA ALA LYS ALA HET FNR A 138 37 HETNAM FNR 1-DEOXY-1-(7,8-DIMETHYL-2,4-DIOXO-3,4-DIHYDRO-2H- HETNAM 2 FNR BENZO[G]PTERIDIN-1-ID-10(5H)-YL)-5-O-PHOSPHONATO-D- HETNAM 3 FNR RIBITOL HETSYN FNR TWO ELECTRON REDUCED FLAVIN MONONUCLEOTIDE FORMUL 2 FNR C17 H23 N4 O9 P HELIX 1 1 GLY A 11 ALA A 27 1 17 HELIX 2 2 ASN A 40 SER A 46 1 7 HELIX 3 3 GLU A 63 ALA A 75 1 13 HELIX 4 4 PRO A 76 LEU A 78 5 3 HELIX 5 5 GLY A 94 THR A 107 1 14 HELIX 6 6 PRO A 125 LYS A 136 1 12 SHEET 1 A 5 VAL A 31 ARG A 35 0 SHEET 2 A 5 VAL A 2 TYR A 6 1 N VAL A 2 O GLU A 32 SHEET 3 A 5 VAL A 49 GLY A 53 1 O LEU A 51 N VAL A 5 SHEET 4 A 5 LYS A 82 TYR A 89 1 O LYS A 82 N ILE A 50 SHEET 5 A 5 THR A 110 ASN A 118 1 O VAL A 117 N TYR A 89 SITE *** AC1 15 TRP A 7 GLY A 9 THR A 10 ASN A 12 SITE *** AC1 15 PRO A 55 ALA A 56 MET A 57 GLY A 58 SITE *** AC1 15 GLU A 60 SER A 88 TYR A 89 GLY A 90 SITE *** AC1 15 TRP A 91 GLY A 92 GLU A 119 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 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 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 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 16 MET CE :methyl -172:sc= -1.46 (180deg=-1.65) USER MOD Set 1.2: A 127 CYS SG : rot 79:sc= 0.386 USER MOD Set 2.1: A 89 TYR OH : rot -82:sc= 1.24 USER MOD Set 2.2: A 93 SER OG : rot 97:sc= 0.522 USER MOD Set 2.3: A 118 ASN : amide:sc= 0.902 K(o=2.7,f=-0.19) USER MOD Set 3.1: A 8 SER OG : rot 58:sc= 0.013 USER MOD Set 3.2: A 10 THR OG1 : rot 22:sc= 0.151 USER MOD Set 3.3: A 12 ASN : amide:sc= -2.02 K(o=-0.42,f=-2.4) USER MOD Set 3.4: A 13 THR OG1 : rot 177:sc= 0.908 USER MOD Set 3.5: A 88 SER OG : rot -100:sc= 0.53 USER MOD Set 3.6: A 138 FNR O1P : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl -165:sc= 0 (180deg=-0.331) USER MOD Single : A 1 MET N :NH3+ -175:sc= 0.00596 (180deg=0.00443) USER MOD Single : A 6 TYR OH : rot 64:sc= 0.0754 USER MOD Single : A 18 ASN : amide:sc= -0.291 K(o=-0.29,f=-1.9) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 140:sc= 0 USER MOD Single : A 39 THR OG1 : rot 113:sc= 0.441 USER MOD Single : A 40 ASN : amide:sc= 0.983 K(o=0.98,f=-5.6!) USER MOD Single : A 46 SER OG : rot -20:sc= 0.456 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 CYS SG : rot -44:sc= -0.791 USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 41:sc= 0.294 USER MOD Single : A 65 SER OG : rot 180:sc= 0.0299 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.0233 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0416) USER MOD Single : A 81 LYS NZ :NH3+ -166:sc= -0.59 (180deg=-0.892) USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 MET CE :methyl -171:sc= 0 (180deg=-0.128) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 102 GLN : amide:sc= 0.44 K(o=0.44,f=-0.38) USER MOD Single : A 104 THR OG1 : rot -76:sc= 1.26 USER MOD Single : A 107 THR OG1 : rot 100:sc= 1.24 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 31:sc= 0.321 USER MOD Single : A 120 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 123 ASN : amide:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 FNR O2' : rot 79:sc= 0.703 USER MOD Single : A 138 FNR O3' : rot 150:sc= 1.05 USER MOD Single : A 138 FNR O4' : rot -36:sc= 0.155 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -13.967 -45.312 16.176 1.00 0.00 N ATOM 2 CA MET A 1 -12.884 -45.010 17.129 1.00 0.00 C ATOM 3 C MET A 1 -11.471 -45.003 16.497 1.00 0.00 C ATOM 4 O MET A 1 -10.950 -46.028 16.056 1.00 0.00 O ATOM 5 CB MET A 1 -12.973 -46.046 18.231 1.00 0.00 C ATOM 6 CG MET A 1 -12.420 -45.529 19.554 1.00 0.00 C ATOM 7 SD MET A 1 -12.604 -46.889 20.762 1.00 0.00 S ATOM 8 CE MET A 1 -12.633 -45.942 22.260 1.00 0.00 C ATOM 0 H1 MET A 1 -14.886 -45.215 16.653 1.00 0.00 H new ATOM 0 H2 MET A 1 -13.920 -44.649 15.376 1.00 0.00 H new ATOM 0 H3 MET A 1 -13.860 -46.285 15.826 1.00 0.00 H new ATOM 0 HA MET A 1 -13.021 -43.996 17.505 1.00 0.00 H new ATOM 0 HB2 MET A 1 -14.013 -46.343 18.365 1.00 0.00 H new ATOM 0 HB3 MET A 1 -12.423 -46.939 17.933 1.00 0.00 H new ATOM 0 HG2 MET A 1 -11.374 -45.241 19.451 1.00 0.00 H new ATOM 0 HG3 MET A 1 -12.964 -44.643 19.882 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.473 -46.603 23.112 1.00 0.00 H new ATOM 0 HE2 MET A 1 -11.844 -45.190 22.231 1.00 0.00 H new ATOM 0 HE3 MET A 1 -13.600 -45.449 22.360 1.00 0.00 H new ATOM 12 N VAL A 2 -10.929 -43.797 16.495 1.00 0.00 N ATOM 13 CA VAL A 2 -9.662 -43.513 15.804 1.00 0.00 C ATOM 14 C VAL A 2 -8.549 -43.006 16.733 1.00 0.00 C ATOM 15 O VAL A 2 -8.660 -41.963 17.372 1.00 0.00 O ATOM 16 CB VAL A 2 -9.895 -42.629 14.567 1.00 0.00 C ATOM 17 CG1 VAL A 2 -10.522 -41.272 14.875 1.00 0.00 C ATOM 18 CG2 VAL A 2 -8.619 -42.470 13.723 1.00 0.00 C ATOM 0 H VAL A 2 -11.341 -42.990 16.963 1.00 0.00 H new ATOM 0 HA VAL A 2 -9.276 -44.466 15.442 1.00 0.00 H new ATOM 0 HB VAL A 2 -10.633 -43.170 13.975 1.00 0.00 H new ATOM 0 HG11 VAL A 2 -10.652 -40.713 13.949 1.00 0.00 H new ATOM 0 HG12 VAL A 2 -11.492 -41.419 15.349 1.00 0.00 H new ATOM 0 HG13 VAL A 2 -9.870 -40.714 15.547 1.00 0.00 H new ATOM 0 HG21 VAL A 2 -8.830 -41.838 12.860 1.00 0.00 H new ATOM 0 HG22 VAL A 2 -7.838 -42.009 14.328 1.00 0.00 H new ATOM 0 HG23 VAL A 2 -8.284 -43.450 13.382 1.00 0.00 H new ATOM 20 N GLU A 3 -7.451 -43.752 16.687 1.00 0.00 N ATOM 21 CA GLU A 3 -6.222 -43.338 17.376 1.00 0.00 C ATOM 22 C GLU A 3 -5.263 -42.649 16.402 1.00 0.00 C ATOM 23 O GLU A 3 -4.681 -43.259 15.501 1.00 0.00 O ATOM 24 CB GLU A 3 -5.543 -44.529 18.062 1.00 0.00 C ATOM 25 CG GLU A 3 -4.589 -44.024 19.151 1.00 0.00 C ATOM 26 CD GLU A 3 -3.792 -45.127 19.860 1.00 0.00 C ATOM 27 OE1 GLU A 3 -3.913 -46.307 19.466 1.00 0.00 O ATOM 28 OE2 GLU A 3 -3.032 -44.779 20.791 1.00 0.00 O ATOM 0 H GLU A 3 -7.380 -44.638 16.187 1.00 0.00 H new ATOM 0 HA GLU A 3 -6.496 -42.622 18.151 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -6.295 -45.186 18.500 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -4.993 -45.118 17.328 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -3.889 -43.318 18.704 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -5.166 -43.474 19.895 1.00 0.00 H new ATOM 30 N ILE A 4 -5.194 -41.336 16.561 1.00 0.00 N ATOM 31 CA ILE A 4 -4.305 -40.459 15.786 1.00 0.00 C ATOM 32 C ILE A 4 -3.001 -40.288 16.567 1.00 0.00 C ATOM 33 O ILE A 4 -2.922 -39.614 17.589 1.00 0.00 O ATOM 34 CB ILE A 4 -5.040 -39.147 15.447 1.00 0.00 C ATOM 35 CG1 ILE A 4 -6.241 -39.453 14.534 1.00 0.00 C ATOM 36 CG2 ILE A 4 -4.091 -38.128 14.788 1.00 0.00 C ATOM 37 CD1 ILE A 4 -7.220 -38.299 14.339 1.00 0.00 C ATOM 0 H ILE A 4 -5.762 -40.833 17.243 1.00 0.00 H new ATOM 0 HA ILE A 4 -4.035 -40.890 14.822 1.00 0.00 H new ATOM 0 HB ILE A 4 -5.401 -38.698 16.372 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -5.866 -39.759 13.557 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -6.784 -40.303 14.947 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -4.640 -37.214 14.561 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -3.272 -37.900 15.470 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -3.689 -38.548 13.866 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -8.029 -38.616 13.681 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -7.632 -38.004 15.304 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -6.699 -37.452 13.893 1.00 0.00 H new ATOM 39 N VAL A 5 -1.991 -41.009 16.078 1.00 0.00 N ATOM 40 CA VAL A 5 -0.652 -41.035 16.679 1.00 0.00 C ATOM 41 C VAL A 5 0.321 -40.263 15.793 1.00 0.00 C ATOM 42 O VAL A 5 0.640 -40.677 14.681 1.00 0.00 O ATOM 43 CB VAL A 5 -0.083 -42.450 16.915 1.00 0.00 C ATOM 44 CG1 VAL A 5 0.266 -42.544 18.396 1.00 0.00 C ATOM 45 CG2 VAL A 5 -0.970 -43.638 16.533 1.00 0.00 C ATOM 0 H VAL A 5 -2.077 -41.596 15.248 1.00 0.00 H new ATOM 0 HA VAL A 5 -0.763 -40.574 17.661 1.00 0.00 H new ATOM 0 HB VAL A 5 0.769 -42.544 16.241 1.00 0.00 H new ATOM 0 HG11 VAL A 5 0.674 -43.532 18.612 1.00 0.00 H new ATOM 0 HG12 VAL A 5 1.006 -41.783 18.644 1.00 0.00 H new ATOM 0 HG13 VAL A 5 -0.632 -42.384 18.992 1.00 0.00 H new ATOM 0 HG21 VAL A 5 -0.446 -44.568 16.752 1.00 0.00 H new ATOM 0 HG22 VAL A 5 -1.896 -43.600 17.106 1.00 0.00 H new ATOM 0 HG23 VAL A 5 -1.200 -43.593 15.469 1.00 0.00 H new ATOM 47 N TYR A 6 0.743 -39.121 16.303 1.00 0.00 N ATOM 48 CA TYR A 6 1.581 -38.183 15.545 1.00 0.00 C ATOM 49 C TYR A 6 2.930 -37.873 16.192 1.00 0.00 C ATOM 50 O TYR A 6 3.135 -38.086 17.386 1.00 0.00 O ATOM 51 CB TYR A 6 0.817 -36.880 15.236 1.00 0.00 C ATOM 52 CG TYR A 6 0.207 -36.230 16.478 1.00 0.00 C ATOM 53 CD1 TYR A 6 0.992 -35.410 17.305 1.00 0.00 C ATOM 54 CD2 TYR A 6 -1.135 -36.549 16.787 1.00 0.00 C ATOM 55 CE1 TYR A 6 0.443 -34.916 18.500 1.00 0.00 C ATOM 56 CE2 TYR A 6 -1.688 -36.048 17.978 1.00 0.00 C ATOM 57 CZ TYR A 6 -0.899 -35.252 18.824 1.00 0.00 C ATOM 58 OH TYR A 6 -1.440 -34.911 20.027 1.00 0.00 O ATOM 0 H TYR A 6 0.521 -38.810 17.249 1.00 0.00 H new ATOM 0 HA TYR A 6 1.812 -38.699 14.613 1.00 0.00 H new ATOM 0 HB2 TYR A 6 1.496 -36.173 14.760 1.00 0.00 H new ATOM 0 HB3 TYR A 6 0.024 -37.093 14.519 1.00 0.00 H new ATOM 0 HD1 TYR A 6 2.005 -35.162 17.026 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -1.723 -37.165 16.122 1.00 0.00 H new ATOM 0 HE1 TYR A 6 1.029 -34.293 19.159 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -2.711 -36.273 18.240 1.00 0.00 H new ATOM 0 HH TYR A 6 -1.481 -33.935 20.102 1.00 0.00 H new ATOM 61 N TRP A 7 3.892 -37.642 15.315 1.00 0.00 N ATOM 62 CA TRP A 7 5.227 -37.127 15.680 1.00 0.00 C ATOM 63 C TRP A 7 5.375 -35.725 15.085 1.00 0.00 C ATOM 64 O TRP A 7 5.303 -35.544 13.864 1.00 0.00 O ATOM 65 CB TRP A 7 6.305 -38.049 15.114 1.00 0.00 C ATOM 66 CG TRP A 7 7.675 -37.729 15.718 1.00 0.00 C ATOM 67 CD1 TRP A 7 8.149 -38.250 16.837 1.00 0.00 C ATOM 68 CD2 TRP A 7 8.608 -36.809 15.245 1.00 0.00 C ATOM 69 NE1 TRP A 7 9.340 -37.721 17.112 1.00 0.00 N ATOM 70 CE2 TRP A 7 9.662 -36.829 16.187 1.00 0.00 C ATOM 71 CE3 TRP A 7 8.652 -35.945 14.129 1.00 0.00 C ATOM 72 CZ2 TRP A 7 10.780 -35.991 16.026 1.00 0.00 C ATOM 73 CZ3 TRP A 7 9.779 -35.105 13.964 1.00 0.00 C ATOM 74 CH2 TRP A 7 10.830 -35.131 14.899 1.00 0.00 C ATOM 0 H TRP A 7 3.780 -37.805 14.314 1.00 0.00 H new ATOM 0 HA TRP A 7 5.336 -37.088 16.764 1.00 0.00 H new ATOM 0 HB2 TRP A 7 6.046 -39.087 15.322 1.00 0.00 H new ATOM 0 HB3 TRP A 7 6.348 -37.942 14.030 1.00 0.00 H new ATOM 0 HD1 TRP A 7 7.646 -38.993 17.438 1.00 0.00 H new ATOM 0 HE1 TRP A 7 9.918 -37.966 17.916 1.00 0.00 H new ATOM 0 HE3 TRP A 7 7.842 -35.926 13.415 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 11.585 -36.002 16.746 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 9.833 -34.440 13.115 1.00 0.00 H new ATOM 0 HH2 TRP A 7 11.686 -34.488 14.757 1.00 0.00 H new ATOM 77 N SER A 8 5.511 -34.748 15.963 1.00 0.00 N ATOM 78 CA SER A 8 5.560 -33.329 15.561 1.00 0.00 C ATOM 79 C SER A 8 6.817 -32.615 16.049 1.00 0.00 C ATOM 80 O SER A 8 7.039 -32.501 17.254 1.00 0.00 O ATOM 81 CB SER A 8 4.323 -32.583 16.071 1.00 0.00 C ATOM 82 OG SER A 8 4.132 -31.464 15.201 1.00 0.00 O ATOM 0 H SER A 8 5.591 -34.899 16.969 1.00 0.00 H new ATOM 0 HA SER A 8 5.580 -33.321 14.471 1.00 0.00 H new ATOM 0 HB2 SER A 8 3.448 -33.233 16.063 1.00 0.00 H new ATOM 0 HB3 SER A 8 4.466 -32.253 17.100 1.00 0.00 H new ATOM 0 HG SER A 8 4.023 -31.781 14.280 1.00 0.00 H new ATOM 85 N GLY A 9 7.656 -32.245 15.090 1.00 0.00 N ATOM 86 CA GLY A 9 8.872 -31.447 15.341 1.00 0.00 C ATOM 87 C GLY A 9 8.527 -29.953 15.459 1.00 0.00 C ATOM 88 O GLY A 9 8.556 -29.377 16.540 1.00 0.00 O ATOM 0 H GLY A 9 7.521 -32.486 14.108 1.00 0.00 H new ATOM 0 HA2 GLY A 9 9.354 -31.788 16.258 1.00 0.00 H new ATOM 0 HA3 GLY A 9 9.586 -31.598 14.531 1.00 0.00 H new ATOM 90 N THR A 10 8.031 -29.409 14.353 1.00 0.00 N ATOM 91 CA THR A 10 7.769 -27.957 14.235 1.00 0.00 C ATOM 92 C THR A 10 6.273 -27.616 14.102 1.00 0.00 C ATOM 93 O THR A 10 5.864 -26.953 13.152 1.00 0.00 O ATOM 94 CB THR A 10 8.587 -27.375 13.071 1.00 0.00 C ATOM 95 OG1 THR A 10 8.419 -28.190 11.901 1.00 0.00 O ATOM 96 CG2 THR A 10 10.060 -27.179 13.439 1.00 0.00 C ATOM 0 H THR A 10 7.798 -29.944 13.516 1.00 0.00 H new ATOM 0 HA THR A 10 8.089 -27.492 15.167 1.00 0.00 H new ATOM 0 HB THR A 10 8.206 -26.378 12.848 1.00 0.00 H new ATOM 0 HG1 THR A 10 7.592 -28.710 11.980 1.00 0.00 H new ATOM 0 HG21 THR A 10 10.597 -26.766 12.585 1.00 0.00 H new ATOM 0 HG22 THR A 10 10.136 -26.492 14.282 1.00 0.00 H new ATOM 0 HG23 THR A 10 10.498 -28.139 13.713 1.00 0.00 H new ATOM 99 N GLY A 11 5.478 -28.207 14.995 1.00 0.00 N ATOM 100 CA GLY A 11 4.006 -27.991 15.112 1.00 0.00 C ATOM 101 C GLY A 11 3.129 -28.611 14.005 1.00 0.00 C ATOM 102 O GLY A 11 2.002 -29.044 14.252 1.00 0.00 O ATOM 0 H GLY A 11 5.835 -28.870 15.683 1.00 0.00 H new ATOM 0 HA2 GLY A 11 3.678 -28.391 16.071 1.00 0.00 H new ATOM 0 HA3 GLY A 11 3.819 -26.917 15.134 1.00 0.00 H new ATOM 104 N ASN A 12 3.713 -28.709 12.823 1.00 0.00 N ATOM 105 CA ASN A 12 3.116 -29.160 11.536 1.00 0.00 C ATOM 106 C ASN A 12 2.110 -30.317 11.626 1.00 0.00 C ATOM 107 O ASN A 12 0.910 -30.134 11.431 1.00 0.00 O ATOM 108 CB ASN A 12 4.285 -29.433 10.570 1.00 0.00 C ATOM 109 CG ASN A 12 5.284 -30.470 11.079 1.00 0.00 C ATOM 110 OD1 ASN A 12 6.047 -30.264 12.037 1.00 0.00 O ATOM 111 ND2 ASN A 12 5.229 -31.652 10.544 1.00 0.00 N ATOM 0 H ASN A 12 4.695 -28.460 12.708 1.00 0.00 H new ATOM 0 HA ASN A 12 2.475 -28.363 11.160 1.00 0.00 H new ATOM 0 HB2 ASN A 12 3.882 -29.770 9.615 1.00 0.00 H new ATOM 0 HB3 ASN A 12 4.812 -28.498 10.381 1.00 0.00 H new ATOM 0 HD21 ASN A 12 5.811 -32.405 10.911 1.00 0.00 H new ATOM 0 HD22 ASN A 12 4.604 -31.827 9.757 1.00 0.00 H new ATOM 115 N THR A 13 2.595 -31.509 12.006 1.00 0.00 N ATOM 116 CA THR A 13 1.782 -32.730 12.146 1.00 0.00 C ATOM 117 C THR A 13 0.730 -32.703 13.263 1.00 0.00 C ATOM 118 O THR A 13 -0.301 -33.354 13.125 1.00 0.00 O ATOM 119 CB THR A 13 2.639 -33.985 12.303 1.00 0.00 C ATOM 120 OG1 THR A 13 3.924 -33.618 12.812 1.00 0.00 O ATOM 121 CG2 THR A 13 2.740 -34.754 10.982 1.00 0.00 C ATOM 0 H THR A 13 3.580 -31.655 12.229 1.00 0.00 H new ATOM 0 HA THR A 13 1.235 -32.762 11.204 1.00 0.00 H new ATOM 0 HB THR A 13 2.166 -34.660 13.017 1.00 0.00 H new ATOM 0 HG1 THR A 13 4.458 -34.425 12.966 1.00 0.00 H new ATOM 0 HG21 THR A 13 3.356 -35.642 11.124 1.00 0.00 H new ATOM 0 HG22 THR A 13 1.743 -35.052 10.657 1.00 0.00 H new ATOM 0 HG23 THR A 13 3.193 -34.116 10.223 1.00 0.00 H new ATOM 124 N GLU A 14 0.983 -31.933 14.310 1.00 0.00 N ATOM 125 CA GLU A 14 -0.023 -31.646 15.350 1.00 0.00 C ATOM 126 C GLU A 14 -1.227 -30.923 14.742 1.00 0.00 C ATOM 127 O GLU A 14 -2.350 -31.420 14.812 1.00 0.00 O ATOM 128 CB GLU A 14 0.659 -30.809 16.453 1.00 0.00 C ATOM 129 CG GLU A 14 -0.349 -30.297 17.488 1.00 0.00 C ATOM 130 CD GLU A 14 -0.248 -31.068 18.790 1.00 0.00 C ATOM 131 OE1 GLU A 14 -0.834 -32.164 18.874 1.00 0.00 O ATOM 132 OE2 GLU A 14 0.451 -30.549 19.688 1.00 0.00 O ATOM 0 H GLU A 14 1.885 -31.485 14.473 1.00 0.00 H new ATOM 0 HA GLU A 14 -0.403 -32.570 15.787 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.416 -31.414 16.952 1.00 0.00 H new ATOM 0 HB3 GLU A 14 1.175 -29.963 16.000 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -0.173 -29.238 17.676 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -1.359 -30.386 17.089 1.00 0.00 H new ATOM 134 N ALA A 15 -0.959 -29.800 14.067 1.00 0.00 N ATOM 135 CA ALA A 15 -1.991 -28.993 13.387 1.00 0.00 C ATOM 136 C ALA A 15 -2.746 -29.786 12.297 1.00 0.00 C ATOM 137 O ALA A 15 -3.966 -29.702 12.193 1.00 0.00 O ATOM 138 CB ALA A 15 -1.324 -27.738 12.829 1.00 0.00 C ATOM 0 H ALA A 15 -0.017 -29.419 13.974 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.757 -28.711 14.109 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -2.069 -27.125 12.321 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -0.881 -27.168 13.645 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -0.546 -28.024 12.121 1.00 0.00 H new ATOM 140 N MET A 16 -2.005 -30.629 11.589 1.00 0.00 N ATOM 141 CA MET A 16 -2.557 -31.623 10.637 1.00 0.00 C ATOM 142 C MET A 16 -3.531 -32.605 11.313 1.00 0.00 C ATOM 143 O MET A 16 -4.689 -32.701 10.911 1.00 0.00 O ATOM 144 CB MET A 16 -1.351 -32.375 10.088 1.00 0.00 C ATOM 145 CG MET A 16 -1.331 -32.448 8.570 1.00 0.00 C ATOM 146 SD MET A 16 0.176 -33.306 7.993 1.00 0.00 S ATOM 147 CE MET A 16 -0.542 -34.039 6.539 1.00 0.00 C ATOM 0 H MET A 16 -0.987 -30.653 11.651 1.00 0.00 H new ATOM 0 HA MET A 16 -3.132 -31.124 9.857 1.00 0.00 H new ATOM 0 HB2 MET A 16 -0.439 -31.888 10.434 1.00 0.00 H new ATOM 0 HB3 MET A 16 -1.346 -33.387 10.494 1.00 0.00 H new ATOM 0 HG2 MET A 16 -2.216 -32.975 8.213 1.00 0.00 H new ATOM 0 HG3 MET A 16 -1.368 -31.443 8.151 1.00 0.00 H new ATOM 0 HE1 MET A 16 0.169 -34.735 6.094 1.00 0.00 H new ATOM 0 HE2 MET A 16 -1.451 -34.574 6.812 1.00 0.00 H new ATOM 0 HE3 MET A 16 -0.784 -33.257 5.819 1.00 0.00 H new ATOM 149 N ALA A 17 -3.072 -33.204 12.410 1.00 0.00 N ATOM 150 CA ALA A 17 -3.888 -34.079 13.283 1.00 0.00 C ATOM 151 C ALA A 17 -5.151 -33.376 13.811 1.00 0.00 C ATOM 152 O ALA A 17 -6.236 -33.945 13.742 1.00 0.00 O ATOM 153 CB ALA A 17 -3.040 -34.555 14.453 1.00 0.00 C ATOM 0 H ALA A 17 -2.110 -33.100 12.732 1.00 0.00 H new ATOM 0 HA ALA A 17 -4.219 -34.925 12.681 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -3.638 -35.199 15.097 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -2.182 -35.113 14.077 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -2.691 -33.694 15.024 1.00 0.00 H new ATOM 155 N ASN A 18 -5.008 -32.122 14.216 1.00 0.00 N ATOM 156 CA ASN A 18 -6.127 -31.274 14.669 1.00 0.00 C ATOM 157 C ASN A 18 -7.214 -31.044 13.609 1.00 0.00 C ATOM 158 O ASN A 18 -8.396 -31.193 13.886 1.00 0.00 O ATOM 159 CB ASN A 18 -5.609 -29.927 15.217 1.00 0.00 C ATOM 160 CG ASN A 18 -4.718 -30.080 16.447 1.00 0.00 C ATOM 161 OD1 ASN A 18 -3.643 -29.513 16.562 1.00 0.00 O ATOM 162 ND2 ASN A 18 -5.136 -30.883 17.407 1.00 0.00 N ATOM 0 H ASN A 18 -4.105 -31.649 14.244 1.00 0.00 H new ATOM 0 HA ASN A 18 -6.609 -31.833 15.471 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -5.051 -29.414 14.434 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -6.460 -29.294 15.469 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -4.562 -31.026 18.238 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -6.033 -31.360 17.318 1.00 0.00 H new ATOM 166 N GLU A 19 -6.763 -30.850 12.379 1.00 0.00 N ATOM 167 CA GLU A 19 -7.642 -30.719 11.205 1.00 0.00 C ATOM 168 C GLU A 19 -8.443 -32.007 10.938 1.00 0.00 C ATOM 169 O GLU A 19 -9.665 -31.991 10.798 1.00 0.00 O ATOM 170 CB GLU A 19 -6.723 -30.359 10.040 1.00 0.00 C ATOM 171 CG GLU A 19 -7.464 -29.565 8.983 1.00 0.00 C ATOM 172 CD GLU A 19 -6.523 -29.108 7.863 1.00 0.00 C ATOM 173 OE1 GLU A 19 -5.450 -29.721 7.655 1.00 0.00 O ATOM 174 OE2 GLU A 19 -6.876 -28.129 7.191 1.00 0.00 O ATOM 0 H GLU A 19 -5.770 -30.777 12.156 1.00 0.00 H new ATOM 0 HA GLU A 19 -8.399 -29.950 11.360 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -5.876 -29.779 10.407 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -6.318 -31.269 9.598 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -8.264 -30.175 8.562 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -7.934 -28.696 9.442 1.00 0.00 H new ATOM 176 N ILE A 20 -7.720 -33.134 10.944 1.00 0.00 N ATOM 177 CA ILE A 20 -8.289 -34.490 10.868 1.00 0.00 C ATOM 178 C ILE A 20 -9.316 -34.743 11.987 1.00 0.00 C ATOM 179 O ILE A 20 -10.478 -35.027 11.709 1.00 0.00 O ATOM 180 CB ILE A 20 -7.134 -35.527 10.879 1.00 0.00 C ATOM 181 CG1 ILE A 20 -6.229 -35.283 9.656 1.00 0.00 C ATOM 182 CG2 ILE A 20 -7.643 -36.970 10.900 1.00 0.00 C ATOM 183 CD1 ILE A 20 -4.848 -35.959 9.720 1.00 0.00 C ATOM 0 H ILE A 20 -6.702 -33.131 11.003 1.00 0.00 H new ATOM 0 HA ILE A 20 -8.840 -34.595 9.934 1.00 0.00 H new ATOM 0 HB ILE A 20 -6.563 -35.391 11.797 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -6.747 -35.635 8.764 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -6.085 -34.209 9.538 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -6.795 -37.655 10.907 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -8.246 -37.130 11.794 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -8.251 -37.154 10.014 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -4.287 -35.728 8.814 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -4.302 -35.591 10.589 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -4.975 -37.038 9.802 1.00 0.00 H new ATOM 185 N GLU A 21 -8.898 -34.441 13.214 1.00 0.00 N ATOM 186 CA GLU A 21 -9.759 -34.516 14.427 1.00 0.00 C ATOM 187 C GLU A 21 -11.106 -33.802 14.291 1.00 0.00 C ATOM 188 O GLU A 21 -12.140 -34.400 14.571 1.00 0.00 O ATOM 189 CB GLU A 21 -9.040 -33.901 15.628 1.00 0.00 C ATOM 190 CG GLU A 21 -8.196 -34.944 16.366 1.00 0.00 C ATOM 191 CD GLU A 21 -7.270 -34.212 17.334 1.00 0.00 C ATOM 192 OE1 GLU A 21 -7.720 -33.900 18.453 1.00 0.00 O ATOM 193 OE2 GLU A 21 -6.170 -33.848 16.870 1.00 0.00 O ATOM 0 H GLU A 21 -7.946 -34.133 13.413 1.00 0.00 H new ATOM 0 HA GLU A 21 -9.954 -35.580 14.563 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -8.401 -33.084 15.293 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -9.772 -33.472 16.312 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -8.838 -35.639 16.907 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.615 -35.533 15.657 1.00 0.00 H new ATOM 195 N ALA A 22 -11.054 -32.574 13.783 1.00 0.00 N ATOM 196 CA ALA A 22 -12.249 -31.756 13.524 1.00 0.00 C ATOM 197 C ALA A 22 -13.216 -32.402 12.520 1.00 0.00 C ATOM 198 O ALA A 22 -14.404 -32.526 12.818 1.00 0.00 O ATOM 199 CB ALA A 22 -11.798 -30.367 13.038 1.00 0.00 C ATOM 0 H ALA A 22 -10.180 -32.110 13.536 1.00 0.00 H new ATOM 0 HA ALA A 22 -12.808 -31.669 14.456 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -12.674 -29.748 12.842 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -11.185 -29.895 13.805 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -11.216 -30.473 12.123 1.00 0.00 H new ATOM 201 N ALA A 23 -12.656 -32.988 11.457 1.00 0.00 N ATOM 202 CA ALA A 23 -13.439 -33.744 10.464 1.00 0.00 C ATOM 203 C ALA A 23 -14.024 -35.064 11.014 1.00 0.00 C ATOM 204 O ALA A 23 -15.143 -35.438 10.664 1.00 0.00 O ATOM 205 CB ALA A 23 -12.593 -33.976 9.210 1.00 0.00 C ATOM 0 H ALA A 23 -11.656 -32.955 11.258 1.00 0.00 H new ATOM 0 HA ALA A 23 -14.307 -33.138 10.205 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -13.174 -34.535 8.477 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -12.301 -33.016 8.785 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -11.700 -34.543 9.473 1.00 0.00 H new ATOM 207 N VAL A 24 -13.282 -35.696 11.930 1.00 0.00 N ATOM 208 CA VAL A 24 -13.745 -36.879 12.690 1.00 0.00 C ATOM 209 C VAL A 24 -14.917 -36.484 13.619 1.00 0.00 C ATOM 210 O VAL A 24 -16.003 -37.053 13.550 1.00 0.00 O ATOM 211 CB VAL A 24 -12.580 -37.531 13.479 1.00 0.00 C ATOM 212 CG1 VAL A 24 -13.044 -38.751 14.285 1.00 0.00 C ATOM 213 CG2 VAL A 24 -11.447 -37.984 12.558 1.00 0.00 C ATOM 0 H VAL A 24 -12.335 -35.404 12.172 1.00 0.00 H new ATOM 0 HA VAL A 24 -14.107 -37.628 11.986 1.00 0.00 H new ATOM 0 HB VAL A 24 -12.219 -36.756 14.155 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -12.196 -39.176 14.822 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -13.809 -38.446 14.999 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -13.457 -39.499 13.608 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -10.653 -38.435 13.153 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -11.828 -38.717 11.846 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -11.052 -37.124 12.017 1.00 0.00 H new ATOM 215 N LYS A 25 -14.696 -35.418 14.394 1.00 0.00 N ATOM 216 CA LYS A 25 -15.714 -34.884 15.332 1.00 0.00 C ATOM 217 C LYS A 25 -17.014 -34.426 14.657 1.00 0.00 C ATOM 218 O LYS A 25 -18.100 -34.694 15.170 1.00 0.00 O ATOM 219 CB LYS A 25 -15.152 -33.708 16.124 1.00 0.00 C ATOM 220 CG LYS A 25 -14.106 -34.182 17.121 1.00 0.00 C ATOM 221 CD LYS A 25 -13.538 -32.960 17.817 1.00 0.00 C ATOM 222 CE LYS A 25 -12.352 -33.362 18.696 1.00 0.00 C ATOM 223 NZ LYS A 25 -11.850 -32.157 19.345 1.00 0.00 N ATOM 0 H LYS A 25 -13.818 -34.898 14.397 1.00 0.00 H new ATOM 0 HA LYS A 25 -15.959 -35.722 15.985 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -14.709 -32.982 15.442 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -15.959 -33.199 16.651 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -14.552 -34.862 17.847 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -13.315 -34.733 16.612 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -13.220 -32.225 17.077 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -14.309 -32.487 18.426 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -12.660 -34.097 19.440 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -11.570 -33.826 18.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -11.041 -32.401 19.951 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -11.548 -31.473 18.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -12.603 -31.736 19.926 1.00 0.00 H new ATOM 228 N ALA A 26 -16.870 -33.811 13.482 1.00 0.00 N ATOM 229 CA ALA A 26 -18.007 -33.379 12.644 1.00 0.00 C ATOM 230 C ALA A 26 -18.993 -34.509 12.297 1.00 0.00 C ATOM 231 O ALA A 26 -20.200 -34.290 12.262 1.00 0.00 O ATOM 232 CB ALA A 26 -17.467 -32.739 11.353 1.00 0.00 C ATOM 0 H ALA A 26 -15.960 -33.594 13.076 1.00 0.00 H new ATOM 0 HA ALA A 26 -18.575 -32.657 13.231 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -18.301 -32.418 10.730 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -16.849 -31.877 11.605 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -16.867 -33.468 10.809 1.00 0.00 H new ATOM 234 N ALA A 27 -18.458 -35.720 12.148 1.00 0.00 N ATOM 235 CA ALA A 27 -19.260 -36.931 11.895 1.00 0.00 C ATOM 236 C ALA A 27 -19.478 -37.798 13.162 1.00 0.00 C ATOM 237 O ALA A 27 -19.721 -39.005 13.073 1.00 0.00 O ATOM 238 CB ALA A 27 -18.584 -37.712 10.761 1.00 0.00 C ATOM 0 H ALA A 27 -17.455 -35.896 12.198 1.00 0.00 H new ATOM 0 HA ALA A 27 -20.266 -36.637 11.598 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -19.156 -38.616 10.550 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -18.543 -37.092 9.866 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -17.572 -37.984 11.060 1.00 0.00 H new ATOM 240 N GLY A 28 -19.402 -37.154 14.319 1.00 0.00 N ATOM 241 CA GLY A 28 -19.681 -37.730 15.652 1.00 0.00 C ATOM 242 C GLY A 28 -18.864 -38.967 16.049 1.00 0.00 C ATOM 243 O GLY A 28 -19.328 -39.786 16.848 1.00 0.00 O ATOM 0 H GLY A 28 -19.133 -36.171 14.369 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -19.512 -36.955 16.400 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -20.738 -37.991 15.696 1.00 0.00 H new ATOM 245 N ALA A 29 -17.605 -39.020 15.625 1.00 0.00 N ATOM 246 CA ALA A 29 -16.735 -40.172 15.920 1.00 0.00 C ATOM 247 C ALA A 29 -15.661 -39.865 16.967 1.00 0.00 C ATOM 248 O ALA A 29 -15.040 -38.803 16.982 1.00 0.00 O ATOM 249 CB ALA A 29 -16.101 -40.708 14.626 1.00 0.00 C ATOM 0 H ALA A 29 -17.158 -38.285 15.077 1.00 0.00 H new ATOM 0 HA ALA A 29 -17.371 -40.942 16.355 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -15.461 -41.559 14.860 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -16.887 -41.023 13.939 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -15.505 -39.923 14.160 1.00 0.00 H new ATOM 251 N ASP A 30 -15.501 -40.852 17.840 1.00 0.00 N ATOM 252 CA ASP A 30 -14.552 -40.811 18.965 1.00 0.00 C ATOM 253 C ASP A 30 -13.097 -40.875 18.490 1.00 0.00 C ATOM 254 O ASP A 30 -12.678 -41.800 17.790 1.00 0.00 O ATOM 255 CB ASP A 30 -14.894 -41.982 19.895 1.00 0.00 C ATOM 256 CG ASP A 30 -14.221 -41.883 21.272 1.00 0.00 C ATOM 257 OD1 ASP A 30 -14.017 -40.739 21.740 1.00 0.00 O ATOM 258 OD2 ASP A 30 -14.004 -42.964 21.855 1.00 0.00 O ATOM 0 H ASP A 30 -16.032 -41.722 17.792 1.00 0.00 H new ATOM 0 HA ASP A 30 -14.646 -39.864 19.497 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -15.975 -42.026 20.029 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -14.594 -42.915 19.418 1.00 0.00 H new ATOM 260 N VAL A 31 -12.341 -39.894 18.943 1.00 0.00 N ATOM 261 CA VAL A 31 -10.943 -39.694 18.528 1.00 0.00 C ATOM 262 C VAL A 31 -9.992 -39.660 19.741 1.00 0.00 C ATOM 263 O VAL A 31 -10.305 -39.105 20.797 1.00 0.00 O ATOM 264 CB VAL A 31 -10.840 -38.431 17.648 1.00 0.00 C ATOM 265 CG1 VAL A 31 -11.272 -37.138 18.345 1.00 0.00 C ATOM 266 CG2 VAL A 31 -9.443 -38.288 17.052 1.00 0.00 C ATOM 0 H VAL A 31 -12.671 -39.201 19.615 1.00 0.00 H new ATOM 0 HA VAL A 31 -10.622 -40.545 17.927 1.00 0.00 H new ATOM 0 HB VAL A 31 -11.559 -38.583 16.843 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -11.168 -36.301 17.655 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -12.313 -37.223 18.658 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -10.643 -36.968 19.219 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -9.400 -37.389 16.437 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -8.711 -38.213 17.856 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -9.219 -39.160 16.437 1.00 0.00 H new ATOM 268 N GLU A 32 -8.874 -40.347 19.584 1.00 0.00 N ATOM 269 CA GLU A 32 -7.806 -40.420 20.594 1.00 0.00 C ATOM 270 C GLU A 32 -6.485 -39.976 19.952 1.00 0.00 C ATOM 271 O GLU A 32 -5.909 -40.691 19.143 1.00 0.00 O ATOM 272 CB GLU A 32 -7.640 -41.841 21.162 1.00 0.00 C ATOM 273 CG GLU A 32 -8.892 -42.393 21.863 1.00 0.00 C ATOM 274 CD GLU A 32 -10.002 -42.802 20.876 1.00 0.00 C ATOM 275 OE1 GLU A 32 -9.681 -43.466 19.871 1.00 0.00 O ATOM 276 OE2 GLU A 32 -11.157 -42.390 21.119 1.00 0.00 O ATOM 0 H GLU A 32 -8.669 -40.883 18.740 1.00 0.00 H new ATOM 0 HA GLU A 32 -8.079 -39.764 21.420 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -7.366 -42.514 20.350 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -6.811 -41.842 21.870 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -8.613 -43.257 22.466 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -9.281 -41.639 22.547 1.00 0.00 H new ATOM 278 N SER A 33 -6.138 -38.724 20.173 1.00 0.00 N ATOM 279 CA SER A 33 -4.907 -38.179 19.580 1.00 0.00 C ATOM 280 C SER A 33 -3.784 -37.980 20.583 1.00 0.00 C ATOM 281 O SER A 33 -3.923 -37.336 21.616 1.00 0.00 O ATOM 282 CB SER A 33 -5.203 -36.937 18.745 1.00 0.00 C ATOM 283 OG SER A 33 -6.000 -36.070 19.557 1.00 0.00 O ATOM 0 H SER A 33 -6.670 -38.067 20.744 1.00 0.00 H new ATOM 0 HA SER A 33 -4.522 -38.938 18.899 1.00 0.00 H new ATOM 0 HB2 SER A 33 -4.278 -36.444 18.446 1.00 0.00 H new ATOM 0 HB3 SER A 33 -5.732 -37.204 17.830 1.00 0.00 H new ATOM 0 HG SER A 33 -5.712 -35.142 19.425 1.00 0.00 H new ATOM 286 N VAL A 34 -2.734 -38.721 20.248 1.00 0.00 N ATOM 287 CA VAL A 34 -1.541 -38.898 21.094 1.00 0.00 C ATOM 288 C VAL A 34 -0.285 -38.828 20.237 1.00 0.00 C ATOM 289 O VAL A 34 -0.284 -38.866 19.007 1.00 0.00 O ATOM 290 CB VAL A 34 -1.562 -40.209 21.909 1.00 0.00 C ATOM 291 CG1 VAL A 34 -2.376 -40.049 23.189 1.00 0.00 C ATOM 292 CG2 VAL A 34 -1.970 -41.460 21.108 1.00 0.00 C ATOM 0 H VAL A 34 -2.679 -39.229 19.365 1.00 0.00 H new ATOM 0 HA VAL A 34 -1.543 -38.085 21.820 1.00 0.00 H new ATOM 0 HB VAL A 34 -0.524 -40.397 22.185 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -2.373 -40.988 23.742 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -1.936 -39.264 23.804 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -3.402 -39.780 22.937 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -1.956 -42.332 21.762 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -2.974 -41.323 20.707 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -1.269 -41.611 20.287 1.00 0.00 H new ATOM 294 N ARG A 35 0.806 -38.697 20.970 1.00 0.00 N ATOM 295 CA ARG A 35 2.117 -38.679 20.346 1.00 0.00 C ATOM 296 C ARG A 35 2.741 -40.071 20.368 1.00 0.00 C ATOM 297 O ARG A 35 2.640 -40.786 21.357 1.00 0.00 O ATOM 298 CB ARG A 35 2.913 -37.696 21.164 1.00 0.00 C ATOM 299 CG ARG A 35 4.282 -37.531 20.545 1.00 0.00 C ATOM 300 CD ARG A 35 4.910 -36.368 21.259 1.00 0.00 C ATOM 301 NE ARG A 35 4.283 -35.235 20.580 1.00 0.00 N ATOM 302 CZ ARG A 35 4.979 -34.224 20.115 1.00 0.00 C ATOM 303 NH1 ARG A 35 6.188 -34.448 19.624 1.00 0.00 N ATOM 304 NH2 ARG A 35 4.359 -33.117 19.769 1.00 0.00 N ATOM 0 H ARG A 35 0.812 -38.603 21.986 1.00 0.00 H new ATOM 0 HA ARG A 35 2.080 -38.389 19.296 1.00 0.00 H new ATOM 0 HB2 ARG A 35 2.399 -36.735 21.202 1.00 0.00 H new ATOM 0 HB3 ARG A 35 3.005 -38.049 22.191 1.00 0.00 H new ATOM 0 HG2 ARG A 35 4.879 -38.435 20.667 1.00 0.00 H new ATOM 0 HG3 ARG A 35 4.208 -37.340 19.474 1.00 0.00 H new ATOM 0 HD2 ARG A 35 4.693 -36.377 22.327 1.00 0.00 H new ATOM 0 HD3 ARG A 35 5.995 -36.360 21.154 1.00 0.00 H new ATOM 0 HE ARG A 35 3.270 -35.230 20.464 1.00 0.00 H new ATOM 0 HH11 ARG A 35 6.566 -35.395 19.611 1.00 0.00 H new ATOM 0 HH12 ARG A 35 6.742 -33.673 19.259 1.00 0.00 H new ATOM 0 HH21 ARG A 35 3.346 -33.049 19.863 1.00 0.00 H new ATOM 0 HH22 ARG A 35 4.892 -32.326 19.407 1.00 0.00 H new ATOM 311 N PHE A 36 3.472 -40.366 19.283 1.00 0.00 N ATOM 312 CA PHE A 36 4.283 -41.592 19.144 1.00 0.00 C ATOM 313 C PHE A 36 5.083 -42.028 20.376 1.00 0.00 C ATOM 314 O PHE A 36 5.150 -43.204 20.694 1.00 0.00 O ATOM 315 CB PHE A 36 5.237 -41.470 17.957 1.00 0.00 C ATOM 316 CG PHE A 36 4.590 -41.933 16.656 1.00 0.00 C ATOM 317 CD1 PHE A 36 4.482 -43.314 16.391 1.00 0.00 C ATOM 318 CD2 PHE A 36 4.232 -40.975 15.679 1.00 0.00 C ATOM 319 CE1 PHE A 36 4.008 -43.742 15.128 1.00 0.00 C ATOM 320 CE2 PHE A 36 3.768 -41.395 14.419 1.00 0.00 C ATOM 321 CZ PHE A 36 3.661 -42.776 14.154 1.00 0.00 C ATOM 0 H PHE A 36 3.520 -39.756 18.467 1.00 0.00 H new ATOM 0 HA PHE A 36 3.538 -42.373 18.993 1.00 0.00 H new ATOM 0 HB2 PHE A 36 5.557 -40.433 17.854 1.00 0.00 H new ATOM 0 HB3 PHE A 36 6.132 -42.063 18.148 1.00 0.00 H new ATOM 0 HD1 PHE A 36 4.758 -44.037 17.144 1.00 0.00 H new ATOM 0 HD2 PHE A 36 4.315 -39.921 15.900 1.00 0.00 H new ATOM 0 HE1 PHE A 36 3.912 -44.795 14.910 1.00 0.00 H new ATOM 0 HE2 PHE A 36 3.498 -40.670 13.665 1.00 0.00 H new ATOM 0 HZ PHE A 36 3.307 -43.103 13.188 1.00 0.00 H new ATOM 323 N GLU A 37 5.644 -41.034 21.080 1.00 0.00 N ATOM 324 CA GLU A 37 6.366 -41.244 22.357 1.00 0.00 C ATOM 325 C GLU A 37 5.549 -41.827 23.521 1.00 0.00 C ATOM 326 O GLU A 37 6.123 -42.341 24.482 1.00 0.00 O ATOM 327 CB GLU A 37 6.999 -39.956 22.853 1.00 0.00 C ATOM 328 CG GLU A 37 8.380 -39.797 22.235 1.00 0.00 C ATOM 329 CD GLU A 37 8.438 -38.662 21.207 1.00 0.00 C ATOM 330 OE1 GLU A 37 7.456 -38.481 20.457 1.00 0.00 O ATOM 331 OE2 GLU A 37 9.521 -38.035 21.145 1.00 0.00 O ATOM 0 H GLU A 37 5.613 -40.058 20.785 1.00 0.00 H new ATOM 0 HA GLU A 37 7.107 -41.995 22.083 1.00 0.00 H new ATOM 0 HB2 GLU A 37 6.371 -39.105 22.589 1.00 0.00 H new ATOM 0 HB3 GLU A 37 7.075 -39.971 23.940 1.00 0.00 H new ATOM 0 HG2 GLU A 37 9.107 -39.605 23.024 1.00 0.00 H new ATOM 0 HG3 GLU A 37 8.669 -40.732 21.755 1.00 0.00 H new ATOM 333 N ASP A 38 4.248 -41.594 23.490 1.00 0.00 N ATOM 334 CA ASP A 38 3.324 -41.996 24.558 1.00 0.00 C ATOM 335 C ASP A 38 2.106 -42.752 24.013 1.00 0.00 C ATOM 336 O ASP A 38 1.006 -42.218 23.889 1.00 0.00 O ATOM 337 CB ASP A 38 2.938 -40.800 25.448 1.00 0.00 C ATOM 338 CG ASP A 38 2.435 -39.577 24.652 1.00 0.00 C ATOM 339 OD1 ASP A 38 3.307 -38.787 24.242 1.00 0.00 O ATOM 340 OD2 ASP A 38 1.208 -39.465 24.458 1.00 0.00 O ATOM 0 H ASP A 38 3.789 -41.114 22.716 1.00 0.00 H new ATOM 0 HA ASP A 38 3.851 -42.703 25.198 1.00 0.00 H new ATOM 0 HB2 ASP A 38 2.162 -41.113 26.147 1.00 0.00 H new ATOM 0 HB3 ASP A 38 3.803 -40.506 26.043 1.00 0.00 H new ATOM 342 N THR A 39 2.421 -43.970 23.571 1.00 0.00 N ATOM 343 CA THR A 39 1.454 -44.951 23.048 1.00 0.00 C ATOM 344 C THR A 39 2.070 -46.359 23.113 1.00 0.00 C ATOM 345 O THR A 39 3.259 -46.523 23.405 1.00 0.00 O ATOM 346 CB THR A 39 0.946 -44.582 21.636 1.00 0.00 C ATOM 347 OG1 THR A 39 -0.052 -45.519 21.206 1.00 0.00 O ATOM 348 CG2 THR A 39 2.084 -44.481 20.613 1.00 0.00 C ATOM 0 H THR A 39 3.380 -44.316 23.564 1.00 0.00 H new ATOM 0 HA THR A 39 0.565 -44.938 23.679 1.00 0.00 H new ATOM 0 HB THR A 39 0.496 -43.591 21.700 1.00 0.00 H new ATOM 0 HG1 THR A 39 -0.920 -45.068 21.145 1.00 0.00 H new ATOM 0 HG21 THR A 39 1.674 -44.220 19.637 1.00 0.00 H new ATOM 0 HG22 THR A 39 2.789 -43.712 20.928 1.00 0.00 H new ATOM 0 HG23 THR A 39 2.599 -45.440 20.545 1.00 0.00 H new ATOM 351 N ASN A 40 1.274 -47.325 22.700 1.00 0.00 N ATOM 352 CA ASN A 40 1.542 -48.778 22.830 1.00 0.00 C ATOM 353 C ASN A 40 0.569 -49.561 21.947 1.00 0.00 C ATOM 354 O ASN A 40 -0.613 -49.213 21.821 1.00 0.00 O ATOM 355 CB ASN A 40 1.373 -49.178 24.302 1.00 0.00 C ATOM 356 CG ASN A 40 1.813 -50.629 24.540 1.00 0.00 C ATOM 357 OD1 ASN A 40 1.101 -51.580 24.252 1.00 0.00 O ATOM 358 ND2 ASN A 40 3.046 -50.804 24.936 1.00 0.00 N ATOM 0 H ASN A 40 0.382 -47.131 22.244 1.00 0.00 H new ATOM 0 HA ASN A 40 2.558 -49.005 22.507 1.00 0.00 H new ATOM 0 HB2 ASN A 40 1.960 -48.510 24.932 1.00 0.00 H new ATOM 0 HB3 ASN A 40 0.330 -49.059 24.596 1.00 0.00 H new ATOM 0 HD21 ASN A 40 3.429 -51.746 25.009 1.00 0.00 H new ATOM 0 HD22 ASN A 40 3.625 -49.998 25.172 1.00 0.00 H new ATOM 362 N VAL A 41 1.085 -50.665 21.414 1.00 0.00 N ATOM 363 CA VAL A 41 0.319 -51.630 20.597 1.00 0.00 C ATOM 364 C VAL A 41 -1.009 -52.110 21.232 1.00 0.00 C ATOM 365 O VAL A 41 -2.041 -52.105 20.568 1.00 0.00 O ATOM 366 CB VAL A 41 1.273 -52.771 20.177 1.00 0.00 C ATOM 367 CG1 VAL A 41 1.734 -53.663 21.338 1.00 0.00 C ATOM 368 CG2 VAL A 41 0.661 -53.607 19.053 1.00 0.00 C ATOM 0 H VAL A 41 2.063 -50.928 21.534 1.00 0.00 H new ATOM 0 HA VAL A 41 -0.040 -51.119 19.704 1.00 0.00 H new ATOM 0 HB VAL A 41 2.175 -52.281 19.809 1.00 0.00 H new ATOM 0 HG11 VAL A 41 2.400 -54.438 20.959 1.00 0.00 H new ATOM 0 HG12 VAL A 41 2.263 -53.058 22.074 1.00 0.00 H new ATOM 0 HG13 VAL A 41 0.866 -54.127 21.807 1.00 0.00 H new ATOM 0 HG21 VAL A 41 1.351 -54.404 18.775 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -0.278 -54.043 19.394 1.00 0.00 H new ATOM 0 HG23 VAL A 41 0.473 -52.971 18.188 1.00 0.00 H new ATOM 370 N ASP A 42 -0.996 -52.297 22.558 1.00 0.00 N ATOM 371 CA ASP A 42 -2.193 -52.645 23.351 1.00 0.00 C ATOM 372 C ASP A 42 -3.321 -51.605 23.260 1.00 0.00 C ATOM 373 O ASP A 42 -4.487 -51.960 23.139 1.00 0.00 O ATOM 374 CB ASP A 42 -1.848 -52.883 24.823 1.00 0.00 C ATOM 375 CG ASP A 42 -1.007 -54.155 25.027 1.00 0.00 C ATOM 376 OD1 ASP A 42 -1.366 -55.186 24.427 1.00 0.00 O ATOM 377 OD2 ASP A 42 0.039 -54.028 25.694 1.00 0.00 O ATOM 0 H ASP A 42 -0.149 -52.211 23.120 1.00 0.00 H new ATOM 0 HA ASP A 42 -2.561 -53.569 22.904 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -1.301 -52.023 25.209 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -2.768 -52.962 25.402 1.00 0.00 H new ATOM 379 N ASP A 43 -2.939 -50.329 23.205 1.00 0.00 N ATOM 380 CA ASP A 43 -3.882 -49.194 23.070 1.00 0.00 C ATOM 381 C ASP A 43 -4.522 -49.190 21.675 1.00 0.00 C ATOM 382 O ASP A 43 -5.746 -49.234 21.547 1.00 0.00 O ATOM 383 CB ASP A 43 -3.195 -47.852 23.299 1.00 0.00 C ATOM 384 CG ASP A 43 -2.671 -47.721 24.736 1.00 0.00 C ATOM 385 OD1 ASP A 43 -1.546 -48.220 24.970 1.00 0.00 O ATOM 386 OD2 ASP A 43 -3.405 -47.136 25.555 1.00 0.00 O ATOM 0 H ASP A 43 -1.962 -50.041 23.252 1.00 0.00 H new ATOM 0 HA ASP A 43 -4.648 -49.327 23.834 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -2.367 -47.743 22.598 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -3.897 -47.044 23.092 1.00 0.00 H new ATOM 388 N VAL A 44 -3.657 -49.369 20.681 1.00 0.00 N ATOM 389 CA VAL A 44 -4.014 -49.423 19.248 1.00 0.00 C ATOM 390 C VAL A 44 -5.059 -50.522 18.959 1.00 0.00 C ATOM 391 O VAL A 44 -6.055 -50.255 18.289 1.00 0.00 O ATOM 392 CB VAL A 44 -2.705 -49.599 18.440 1.00 0.00 C ATOM 393 CG1 VAL A 44 -2.963 -49.905 16.964 1.00 0.00 C ATOM 394 CG2 VAL A 44 -1.794 -48.376 18.553 1.00 0.00 C ATOM 0 H VAL A 44 -2.657 -49.485 20.844 1.00 0.00 H new ATOM 0 HA VAL A 44 -4.496 -48.495 18.941 1.00 0.00 H new ATOM 0 HB VAL A 44 -2.201 -50.457 18.885 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -2.012 -50.019 16.444 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -3.536 -50.828 16.879 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -3.526 -49.086 16.516 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -0.888 -48.543 17.971 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.315 -47.498 18.171 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -1.530 -48.215 19.598 1.00 0.00 H new ATOM 396 N ALA A 45 -4.858 -51.678 19.586 1.00 0.00 N ATOM 397 CA ALA A 45 -5.749 -52.850 19.491 1.00 0.00 C ATOM 398 C ALA A 45 -7.248 -52.557 19.726 1.00 0.00 C ATOM 399 O ALA A 45 -8.109 -53.168 19.095 1.00 0.00 O ATOM 400 CB ALA A 45 -5.275 -53.916 20.485 1.00 0.00 C ATOM 0 H ALA A 45 -4.053 -51.838 20.192 1.00 0.00 H new ATOM 0 HA ALA A 45 -5.681 -53.194 18.459 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -5.927 -54.787 20.423 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -4.253 -54.210 20.244 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -5.307 -53.510 21.496 1.00 0.00 H new ATOM 402 N SER A 46 -7.527 -51.605 20.618 1.00 0.00 N ATOM 403 CA SER A 46 -8.898 -51.176 20.941 1.00 0.00 C ATOM 404 C SER A 46 -9.563 -50.288 19.874 1.00 0.00 C ATOM 405 O SER A 46 -10.774 -50.052 19.948 1.00 0.00 O ATOM 406 CB SER A 46 -8.894 -50.445 22.290 1.00 0.00 C ATOM 407 OG SER A 46 -10.233 -50.121 22.667 1.00 0.00 O ATOM 0 H SER A 46 -6.809 -51.105 21.141 1.00 0.00 H new ATOM 0 HA SER A 46 -9.497 -52.086 20.981 1.00 0.00 H new ATOM 0 HB2 SER A 46 -8.433 -51.072 23.053 1.00 0.00 H new ATOM 0 HB3 SER A 46 -8.296 -49.536 22.220 1.00 0.00 H new ATOM 0 HG SER A 46 -10.808 -50.133 21.874 1.00 0.00 H new ATOM 410 N LYS A 47 -8.773 -49.770 18.937 1.00 0.00 N ATOM 411 CA LYS A 47 -9.236 -48.833 17.903 1.00 0.00 C ATOM 412 C LYS A 47 -9.185 -49.484 16.522 1.00 0.00 C ATOM 413 O LYS A 47 -8.124 -49.886 16.039 1.00 0.00 O ATOM 414 CB LYS A 47 -8.390 -47.560 17.829 1.00 0.00 C ATOM 415 CG LYS A 47 -8.600 -46.657 19.027 1.00 0.00 C ATOM 416 CD LYS A 47 -7.750 -47.050 20.219 1.00 0.00 C ATOM 417 CE LYS A 47 -8.206 -46.104 21.320 1.00 0.00 C ATOM 418 NZ LYS A 47 -7.610 -46.438 22.607 1.00 0.00 N ATOM 0 H LYS A 47 -7.779 -49.989 18.869 1.00 0.00 H new ATOM 0 HA LYS A 47 -10.256 -48.571 18.185 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -7.336 -47.831 17.762 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -8.638 -47.015 16.918 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -8.369 -45.629 18.746 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -9.651 -46.681 19.313 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -7.908 -48.092 20.497 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -6.687 -46.934 20.007 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -7.941 -45.081 21.052 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -9.292 -46.141 21.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -7.947 -45.770 23.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -7.883 -47.405 22.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -6.574 -46.378 22.536 1.00 0.00 H new ATOM 423 N ASP A 48 -10.360 -49.526 15.915 1.00 0.00 N ATOM 424 CA ASP A 48 -10.545 -50.096 14.564 1.00 0.00 C ATOM 425 C ASP A 48 -9.802 -49.331 13.455 1.00 0.00 C ATOM 426 O ASP A 48 -9.436 -49.904 12.425 1.00 0.00 O ATOM 427 CB ASP A 48 -12.044 -50.237 14.239 1.00 0.00 C ATOM 428 CG ASP A 48 -12.831 -48.923 14.267 1.00 0.00 C ATOM 429 OD1 ASP A 48 -13.169 -48.500 15.390 1.00 0.00 O ATOM 430 OD2 ASP A 48 -13.028 -48.354 13.170 1.00 0.00 O ATOM 0 H ASP A 48 -11.220 -49.170 16.333 1.00 0.00 H new ATOM 0 HA ASP A 48 -10.088 -51.086 14.586 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -12.147 -50.686 13.251 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -12.493 -50.929 14.952 1.00 0.00 H new ATOM 432 N VAL A 49 -9.660 -48.022 13.663 1.00 0.00 N ATOM 433 CA VAL A 49 -8.952 -47.119 12.731 1.00 0.00 C ATOM 434 C VAL A 49 -7.866 -46.331 13.479 1.00 0.00 C ATOM 435 O VAL A 49 -8.026 -45.920 14.626 1.00 0.00 O ATOM 436 CB VAL A 49 -9.945 -46.286 11.895 1.00 0.00 C ATOM 437 CG1 VAL A 49 -11.048 -45.597 12.698 1.00 0.00 C ATOM 438 CG2 VAL A 49 -9.253 -45.310 10.944 1.00 0.00 C ATOM 0 H VAL A 49 -10.032 -47.547 14.485 1.00 0.00 H new ATOM 0 HA VAL A 49 -8.410 -47.695 11.981 1.00 0.00 H new ATOM 0 HB VAL A 49 -10.456 -47.034 11.289 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -11.694 -45.037 12.022 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -11.637 -46.347 13.225 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -10.600 -44.915 13.420 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -10.004 -44.753 10.384 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -8.640 -44.615 11.518 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -8.620 -45.864 10.251 1.00 0.00 H new ATOM 440 N ILE A 50 -6.688 -46.358 12.868 1.00 0.00 N ATOM 441 CA ILE A 50 -5.463 -45.720 13.391 1.00 0.00 C ATOM 442 C ILE A 50 -4.917 -44.780 12.299 1.00 0.00 C ATOM 443 O ILE A 50 -5.089 -45.019 11.106 1.00 0.00 O ATOM 444 CB ILE A 50 -4.389 -46.774 13.769 1.00 0.00 C ATOM 445 CG1 ILE A 50 -4.937 -47.849 14.706 1.00 0.00 C ATOM 446 CG2 ILE A 50 -3.159 -46.148 14.450 1.00 0.00 C ATOM 447 CD1 ILE A 50 -5.297 -49.110 13.926 1.00 0.00 C ATOM 0 H ILE A 50 -6.543 -46.831 11.976 1.00 0.00 H new ATOM 0 HA ILE A 50 -5.703 -45.165 14.298 1.00 0.00 H new ATOM 0 HB ILE A 50 -4.095 -47.221 12.819 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -4.195 -48.086 15.469 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -5.818 -47.472 15.225 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -2.440 -46.930 14.693 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -2.697 -45.427 13.775 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.468 -45.642 15.365 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -5.685 -49.863 14.611 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -6.056 -48.872 13.180 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -4.408 -49.496 13.428 1.00 0.00 H new ATOM 449 N LEU A 51 -4.389 -43.645 12.743 1.00 0.00 N ATOM 450 CA LEU A 51 -3.676 -42.725 11.849 1.00 0.00 C ATOM 451 C LEU A 51 -2.263 -42.421 12.373 1.00 0.00 C ATOM 452 O LEU A 51 -2.093 -42.151 13.553 1.00 0.00 O ATOM 453 CB LEU A 51 -4.433 -41.394 11.677 1.00 0.00 C ATOM 454 CG LEU A 51 -5.339 -41.394 10.435 1.00 0.00 C ATOM 455 CD1 LEU A 51 -6.661 -42.126 10.675 1.00 0.00 C ATOM 456 CD2 LEU A 51 -5.639 -39.952 10.039 1.00 0.00 C ATOM 0 H LEU A 51 -4.438 -43.336 13.714 1.00 0.00 H new ATOM 0 HA LEU A 51 -3.609 -43.226 10.883 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -5.037 -41.205 12.564 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -3.715 -40.578 11.600 1.00 0.00 H new ATOM 0 HG LEU A 51 -4.808 -41.920 9.641 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -7.263 -42.097 9.767 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -6.459 -43.163 10.943 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -7.204 -41.641 11.486 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -6.281 -39.943 9.158 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -6.144 -39.446 10.862 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -4.706 -39.435 9.813 1.00 0.00 H new ATOM 458 N LEU A 52 -1.300 -42.460 11.457 1.00 0.00 N ATOM 459 CA LEU A 52 0.123 -42.260 11.796 1.00 0.00 C ATOM 460 C LEU A 52 0.645 -40.954 11.184 1.00 0.00 C ATOM 461 O LEU A 52 0.435 -40.713 9.994 1.00 0.00 O ATOM 462 CB LEU A 52 0.991 -43.418 11.269 1.00 0.00 C ATOM 463 CG LEU A 52 0.544 -44.818 11.736 1.00 0.00 C ATOM 464 CD1 LEU A 52 1.360 -45.860 10.987 1.00 0.00 C ATOM 465 CD2 LEU A 52 0.678 -45.009 13.245 1.00 0.00 C ATOM 0 H LEU A 52 -1.471 -42.629 10.466 1.00 0.00 H new ATOM 0 HA LEU A 52 0.190 -42.220 12.883 1.00 0.00 H new ATOM 0 HB2 LEU A 52 0.984 -43.393 10.179 1.00 0.00 H new ATOM 0 HB3 LEU A 52 2.021 -43.256 11.585 1.00 0.00 H new ATOM 0 HG LEU A 52 -0.517 -44.931 11.512 1.00 0.00 H new ATOM 0 HD11 LEU A 52 1.057 -46.857 11.305 1.00 0.00 H new ATOM 0 HD12 LEU A 52 1.190 -45.754 9.916 1.00 0.00 H new ATOM 0 HD13 LEU A 52 2.419 -45.717 11.203 1.00 0.00 H new ATOM 0 HD21 LEU A 52 0.349 -46.012 13.515 1.00 0.00 H new ATOM 0 HD22 LEU A 52 1.720 -44.878 13.537 1.00 0.00 H new ATOM 0 HD23 LEU A 52 0.061 -44.273 13.761 1.00 0.00 H new ATOM 467 N GLY A 53 1.307 -40.154 12.011 1.00 0.00 N ATOM 468 CA GLY A 53 1.790 -38.827 11.623 1.00 0.00 C ATOM 469 C GLY A 53 3.310 -38.697 11.694 1.00 0.00 C ATOM 470 O GLY A 53 3.874 -38.574 12.786 1.00 0.00 O ATOM 0 H GLY A 53 1.527 -40.405 12.975 1.00 0.00 H new ATOM 0 HA2 GLY A 53 1.460 -38.610 10.607 1.00 0.00 H new ATOM 0 HA3 GLY A 53 1.337 -38.078 12.272 1.00 0.00 H new ATOM 472 N CYS A 54 3.935 -38.653 10.526 1.00 0.00 N ATOM 473 CA CYS A 54 5.399 -38.544 10.415 1.00 0.00 C ATOM 474 C CYS A 54 5.817 -37.666 9.227 1.00 0.00 C ATOM 475 O CYS A 54 5.456 -37.972 8.082 1.00 0.00 O ATOM 476 CB CYS A 54 6.017 -39.945 10.310 1.00 0.00 C ATOM 477 SG CYS A 54 7.841 -39.919 10.296 1.00 0.00 S ATOM 0 H CYS A 54 3.453 -38.691 9.628 1.00 0.00 H new ATOM 0 HA CYS A 54 5.774 -38.057 11.315 1.00 0.00 H new ATOM 0 HB2 CYS A 54 5.674 -40.551 11.148 1.00 0.00 H new ATOM 0 HB3 CYS A 54 5.659 -40.427 9.400 1.00 0.00 H new ATOM 0 HG CYS A 54 8.255 -38.979 9.499 1.00 0.00 H new ATOM 480 N PRO A 55 6.528 -36.566 9.495 1.00 0.00 N ATOM 481 CA PRO A 55 7.108 -35.728 8.441 1.00 0.00 C ATOM 482 C PRO A 55 8.331 -36.371 7.778 1.00 0.00 C ATOM 483 O PRO A 55 8.841 -37.398 8.239 1.00 0.00 O ATOM 484 CB PRO A 55 7.453 -34.383 9.099 1.00 0.00 C ATOM 485 CG PRO A 55 7.410 -34.616 10.604 1.00 0.00 C ATOM 486 CD PRO A 55 6.675 -35.940 10.823 1.00 0.00 C ATOM 0 HA PRO A 55 6.394 -35.596 7.628 1.00 0.00 H new ATOM 0 HB2 PRO A 55 8.440 -34.040 8.787 1.00 0.00 H new ATOM 0 HB3 PRO A 55 6.740 -33.613 8.805 1.00 0.00 H new ATOM 0 HG2 PRO A 55 8.417 -34.660 11.018 1.00 0.00 H new ATOM 0 HG3 PRO A 55 6.894 -33.799 11.108 1.00 0.00 H new ATOM 0 HD2 PRO A 55 7.236 -36.588 11.497 1.00 0.00 H new ATOM 0 HD3 PRO A 55 5.701 -35.771 11.282 1.00 0.00 H new ATOM 487 N ALA A 56 8.684 -35.806 6.624 1.00 0.00 N ATOM 488 CA ALA A 56 9.836 -36.239 5.815 1.00 0.00 C ATOM 489 C ALA A 56 11.147 -35.762 6.424 1.00 0.00 C ATOM 490 O ALA A 56 11.365 -34.545 6.647 1.00 0.00 O ATOM 491 CB ALA A 56 9.700 -35.721 4.390 1.00 0.00 C ATOM 0 H ALA A 56 8.174 -35.023 6.214 1.00 0.00 H new ATOM 0 HA ALA A 56 9.848 -37.329 5.800 1.00 0.00 H new ATOM 0 HB1 ALA A 56 10.557 -36.047 3.801 1.00 0.00 H new ATOM 0 HB2 ALA A 56 8.785 -36.113 3.946 1.00 0.00 H new ATOM 0 HB3 ALA A 56 9.661 -34.632 4.401 1.00 0.00 H new ATOM 493 N MET A 57 11.978 -36.727 6.691 1.00 0.00 N ATOM 494 CA MET A 57 13.284 -36.546 7.327 1.00 0.00 C ATOM 495 C MET A 57 14.464 -37.044 6.497 1.00 0.00 C ATOM 496 O MET A 57 14.312 -37.873 5.591 1.00 0.00 O ATOM 497 CB MET A 57 13.207 -37.323 8.620 1.00 0.00 C ATOM 498 CG MET A 57 13.693 -36.367 9.694 1.00 0.00 C ATOM 499 SD MET A 57 13.901 -37.306 11.231 1.00 0.00 S ATOM 500 CE MET A 57 15.151 -36.265 11.927 1.00 0.00 C ATOM 0 H MET A 57 11.773 -37.702 6.471 1.00 0.00 H new ATOM 0 HA MET A 57 13.472 -35.481 7.462 1.00 0.00 H new ATOM 0 HB2 MET A 57 12.188 -37.653 8.820 1.00 0.00 H new ATOM 0 HB3 MET A 57 13.829 -38.217 8.579 1.00 0.00 H new ATOM 0 HG2 MET A 57 14.636 -35.909 9.397 1.00 0.00 H new ATOM 0 HG3 MET A 57 12.976 -35.558 9.836 1.00 0.00 H new ATOM 0 HE1 MET A 57 15.446 -36.653 12.902 1.00 0.00 H new ATOM 0 HE2 MET A 57 16.018 -36.246 11.266 1.00 0.00 H new ATOM 0 HE3 MET A 57 14.760 -35.254 12.042 1.00 0.00 H new ATOM 502 N GLY A 58 15.625 -36.528 6.860 1.00 0.00 N ATOM 503 CA GLY A 58 16.935 -36.833 6.259 1.00 0.00 C ATOM 504 C GLY A 58 16.892 -36.584 4.752 1.00 0.00 C ATOM 505 O GLY A 58 16.699 -35.450 4.305 1.00 0.00 O ATOM 0 H GLY A 58 15.696 -35.850 7.619 1.00 0.00 H new ATOM 0 HA2 GLY A 58 17.707 -36.213 6.716 1.00 0.00 H new ATOM 0 HA3 GLY A 58 17.202 -37.871 6.456 1.00 0.00 H new ATOM 507 N SER A 59 16.986 -37.678 4.014 1.00 0.00 N ATOM 508 CA SER A 59 16.769 -37.633 2.562 1.00 0.00 C ATOM 509 C SER A 59 15.651 -38.583 2.139 1.00 0.00 C ATOM 510 O SER A 59 15.800 -39.806 1.998 1.00 0.00 O ATOM 511 CB SER A 59 18.082 -37.847 1.812 1.00 0.00 C ATOM 512 OG SER A 59 18.596 -39.121 2.186 1.00 0.00 O ATOM 0 H SER A 59 17.208 -38.602 4.383 1.00 0.00 H new ATOM 0 HA SER A 59 16.423 -36.637 2.285 1.00 0.00 H new ATOM 0 HB2 SER A 59 17.918 -37.803 0.735 1.00 0.00 H new ATOM 0 HB3 SER A 59 18.795 -37.060 2.059 1.00 0.00 H new ATOM 0 HG SER A 59 17.862 -39.768 2.235 1.00 0.00 H new ATOM 515 N GLU A 60 14.502 -37.941 2.237 1.00 0.00 N ATOM 516 CA GLU A 60 13.146 -38.461 1.964 1.00 0.00 C ATOM 517 C GLU A 60 12.812 -39.787 2.658 1.00 0.00 C ATOM 518 O GLU A 60 12.407 -40.783 2.030 1.00 0.00 O ATOM 519 CB GLU A 60 12.885 -38.494 0.457 1.00 0.00 C ATOM 520 CG GLU A 60 12.145 -37.241 -0.006 1.00 0.00 C ATOM 521 CD GLU A 60 10.688 -37.261 0.447 1.00 0.00 C ATOM 522 OE1 GLU A 60 9.892 -37.997 -0.165 1.00 0.00 O ATOM 523 OE2 GLU A 60 10.413 -36.560 1.446 1.00 0.00 O ATOM 0 H GLU A 60 14.474 -36.965 2.532 1.00 0.00 H new ATOM 0 HA GLU A 60 12.450 -37.758 2.421 1.00 0.00 H new ATOM 0 HB2 GLU A 60 13.832 -38.578 -0.076 1.00 0.00 H new ATOM 0 HB3 GLU A 60 12.299 -39.378 0.207 1.00 0.00 H new ATOM 0 HG2 GLU A 60 12.640 -36.355 0.392 1.00 0.00 H new ATOM 0 HG3 GLU A 60 12.190 -37.170 -1.093 1.00 0.00 H new ATOM 525 N GLU A 61 12.845 -39.714 3.970 1.00 0.00 N ATOM 526 CA GLU A 61 12.561 -40.839 4.856 1.00 0.00 C ATOM 527 C GLU A 61 11.646 -40.539 6.033 1.00 0.00 C ATOM 528 O GLU A 61 11.473 -39.391 6.424 1.00 0.00 O ATOM 529 CB GLU A 61 13.869 -41.287 5.438 1.00 0.00 C ATOM 530 CG GLU A 61 14.362 -42.353 4.484 1.00 0.00 C ATOM 531 CD GLU A 61 15.805 -42.578 4.858 1.00 0.00 C ATOM 532 OE1 GLU A 61 16.011 -43.104 5.971 1.00 0.00 O ATOM 533 OE2 GLU A 61 16.646 -42.131 4.050 1.00 0.00 O ATOM 0 H GLU A 61 13.074 -38.855 4.469 1.00 0.00 H new ATOM 0 HA GLU A 61 12.047 -41.579 4.242 1.00 0.00 H new ATOM 0 HB2 GLU A 61 14.576 -40.460 5.509 1.00 0.00 H new ATOM 0 HB3 GLU A 61 13.740 -41.684 6.445 1.00 0.00 H new ATOM 0 HG2 GLU A 61 13.781 -43.270 4.584 1.00 0.00 H new ATOM 0 HG3 GLU A 61 14.269 -42.028 3.448 1.00 0.00 H new ATOM 535 N LEU A 62 11.244 -41.639 6.661 1.00 0.00 N ATOM 536 CA LEU A 62 10.577 -41.604 7.964 1.00 0.00 C ATOM 537 C LEU A 62 11.539 -41.245 9.109 1.00 0.00 C ATOM 538 O LEU A 62 12.762 -41.376 9.021 1.00 0.00 O ATOM 539 CB LEU A 62 9.932 -42.968 8.203 1.00 0.00 C ATOM 540 CG LEU A 62 8.678 -43.139 7.339 1.00 0.00 C ATOM 541 CD1 LEU A 62 8.429 -44.624 7.085 1.00 0.00 C ATOM 542 CD2 LEU A 62 7.468 -42.498 8.026 1.00 0.00 C ATOM 0 H LEU A 62 11.369 -42.579 6.285 1.00 0.00 H new ATOM 0 HA LEU A 62 9.821 -40.819 7.951 1.00 0.00 H new ATOM 0 HB2 LEU A 62 10.647 -43.758 7.974 1.00 0.00 H new ATOM 0 HB3 LEU A 62 9.670 -43.071 9.256 1.00 0.00 H new ATOM 0 HG LEU A 62 8.830 -42.639 6.383 1.00 0.00 H new ATOM 0 HD11 LEU A 62 7.537 -44.743 6.470 1.00 0.00 H new ATOM 0 HD12 LEU A 62 9.287 -45.053 6.567 1.00 0.00 H new ATOM 0 HD13 LEU A 62 8.286 -45.137 8.036 1.00 0.00 H new ATOM 0 HD21 LEU A 62 6.584 -42.627 7.401 1.00 0.00 H new ATOM 0 HD22 LEU A 62 7.303 -42.976 8.992 1.00 0.00 H new ATOM 0 HD23 LEU A 62 7.655 -41.435 8.175 1.00 0.00 H new ATOM 544 N GLU A 63 10.917 -40.812 10.202 1.00 0.00 N ATOM 545 CA GLU A 63 11.630 -40.380 11.415 1.00 0.00 C ATOM 546 C GLU A 63 12.070 -41.609 12.221 1.00 0.00 C ATOM 547 O GLU A 63 11.366 -42.125 13.103 1.00 0.00 O ATOM 548 CB GLU A 63 10.726 -39.407 12.182 1.00 0.00 C ATOM 549 CG GLU A 63 11.472 -38.585 13.224 1.00 0.00 C ATOM 550 CD GLU A 63 11.779 -39.396 14.483 1.00 0.00 C ATOM 551 OE1 GLU A 63 10.807 -39.742 15.178 1.00 0.00 O ATOM 552 OE2 GLU A 63 12.953 -39.783 14.619 1.00 0.00 O ATOM 0 H GLU A 63 9.902 -40.748 10.278 1.00 0.00 H new ATOM 0 HA GLU A 63 12.549 -39.843 11.180 1.00 0.00 H new ATOM 0 HB2 GLU A 63 10.246 -38.732 11.473 1.00 0.00 H new ATOM 0 HB3 GLU A 63 9.933 -39.970 12.674 1.00 0.00 H new ATOM 0 HG2 GLU A 63 12.403 -38.216 12.795 1.00 0.00 H new ATOM 0 HG3 GLU A 63 10.876 -37.712 13.492 1.00 0.00 H new ATOM 554 N ASP A 64 13.333 -41.939 11.982 1.00 0.00 N ATOM 555 CA ASP A 64 13.966 -43.193 12.438 1.00 0.00 C ATOM 556 C ASP A 64 13.853 -43.544 13.931 1.00 0.00 C ATOM 557 O ASP A 64 13.151 -44.493 14.236 1.00 0.00 O ATOM 558 CB ASP A 64 15.403 -43.345 11.909 1.00 0.00 C ATOM 559 CG ASP A 64 16.320 -42.161 12.258 1.00 0.00 C ATOM 560 OD1 ASP A 64 16.944 -42.215 13.334 1.00 0.00 O ATOM 561 OD2 ASP A 64 16.253 -41.158 11.505 1.00 0.00 O ATOM 0 H ASP A 64 13.968 -41.338 11.456 1.00 0.00 H new ATOM 0 HA ASP A 64 13.337 -43.953 11.975 1.00 0.00 H new ATOM 0 HB2 ASP A 64 15.835 -44.260 12.315 1.00 0.00 H new ATOM 0 HB3 ASP A 64 15.371 -43.461 10.826 1.00 0.00 H new ATOM 563 N SER A 65 14.254 -42.633 14.798 1.00 0.00 N ATOM 564 CA SER A 65 14.413 -42.918 16.245 1.00 0.00 C ATOM 565 C SER A 65 13.144 -43.098 17.091 1.00 0.00 C ATOM 566 O SER A 65 13.245 -43.559 18.234 1.00 0.00 O ATOM 567 CB SER A 65 15.326 -41.869 16.876 1.00 0.00 C ATOM 568 OG SER A 65 14.892 -40.573 16.444 1.00 0.00 O ATOM 0 H SER A 65 14.482 -41.673 14.539 1.00 0.00 H new ATOM 0 HA SER A 65 14.852 -43.915 16.260 1.00 0.00 H new ATOM 0 HB2 SER A 65 15.289 -41.939 17.963 1.00 0.00 H new ATOM 0 HB3 SER A 65 16.361 -42.040 16.581 1.00 0.00 H new ATOM 0 HG SER A 65 15.467 -39.886 16.841 1.00 0.00 H new ATOM 571 N VAL A 66 11.988 -42.722 16.565 1.00 0.00 N ATOM 572 CA VAL A 66 10.695 -42.898 17.279 1.00 0.00 C ATOM 573 C VAL A 66 9.719 -43.741 16.450 1.00 0.00 C ATOM 574 O VAL A 66 9.348 -44.842 16.852 1.00 0.00 O ATOM 575 CB VAL A 66 10.078 -41.543 17.695 1.00 0.00 C ATOM 576 CG1 VAL A 66 8.782 -41.718 18.491 1.00 0.00 C ATOM 577 CG2 VAL A 66 11.028 -40.702 18.562 1.00 0.00 C ATOM 0 H VAL A 66 11.900 -42.290 15.645 1.00 0.00 H new ATOM 0 HA VAL A 66 10.899 -43.443 18.200 1.00 0.00 H new ATOM 0 HB VAL A 66 9.881 -41.031 16.753 1.00 0.00 H new ATOM 0 HG11 VAL A 66 8.386 -40.739 18.761 1.00 0.00 H new ATOM 0 HG12 VAL A 66 8.051 -42.250 17.883 1.00 0.00 H new ATOM 0 HG13 VAL A 66 8.986 -42.289 19.397 1.00 0.00 H new ATOM 0 HG21 VAL A 66 10.544 -39.762 18.825 1.00 0.00 H new ATOM 0 HG22 VAL A 66 11.273 -41.251 19.471 1.00 0.00 H new ATOM 0 HG23 VAL A 66 11.942 -40.496 18.005 1.00 0.00 H new ATOM 579 N VAL A 67 9.394 -43.255 15.246 1.00 0.00 N ATOM 580 CA VAL A 67 8.423 -43.903 14.341 1.00 0.00 C ATOM 581 C VAL A 67 8.794 -45.335 13.972 1.00 0.00 C ATOM 582 O VAL A 67 7.955 -46.216 14.179 1.00 0.00 O ATOM 583 CB VAL A 67 8.146 -42.993 13.122 1.00 0.00 C ATOM 584 CG1 VAL A 67 7.160 -43.612 12.115 1.00 0.00 C ATOM 585 CG2 VAL A 67 7.591 -41.633 13.569 1.00 0.00 C ATOM 0 H VAL A 67 9.796 -42.398 14.866 1.00 0.00 H new ATOM 0 HA VAL A 67 7.485 -44.017 14.884 1.00 0.00 H new ATOM 0 HB VAL A 67 9.108 -42.870 12.625 1.00 0.00 H new ATOM 0 HG11 VAL A 67 7.009 -42.923 11.284 1.00 0.00 H new ATOM 0 HG12 VAL A 67 7.566 -44.551 11.739 1.00 0.00 H new ATOM 0 HG13 VAL A 67 6.206 -43.800 12.608 1.00 0.00 H new ATOM 0 HG21 VAL A 67 7.404 -41.011 12.694 1.00 0.00 H new ATOM 0 HG22 VAL A 67 6.659 -41.782 14.114 1.00 0.00 H new ATOM 0 HG23 VAL A 67 8.315 -41.140 14.217 1.00 0.00 H new ATOM 587 N GLU A 68 10.063 -45.602 13.663 1.00 0.00 N ATOM 588 CA GLU A 68 10.498 -46.983 13.352 1.00 0.00 C ATOM 589 C GLU A 68 10.498 -47.961 14.539 1.00 0.00 C ATOM 590 O GLU A 68 10.006 -49.076 14.352 1.00 0.00 O ATOM 591 CB GLU A 68 11.795 -47.056 12.527 1.00 0.00 C ATOM 592 CG GLU A 68 11.557 -46.954 11.018 1.00 0.00 C ATOM 593 CD GLU A 68 11.331 -45.526 10.516 1.00 0.00 C ATOM 594 OE1 GLU A 68 12.348 -44.854 10.260 1.00 0.00 O ATOM 595 OE2 GLU A 68 10.155 -45.145 10.373 1.00 0.00 O ATOM 0 H GLU A 68 10.803 -44.902 13.619 1.00 0.00 H new ATOM 0 HA GLU A 68 9.700 -47.345 12.704 1.00 0.00 H new ATOM 0 HB2 GLU A 68 12.462 -46.252 12.838 1.00 0.00 H new ATOM 0 HB3 GLU A 68 12.304 -47.995 12.745 1.00 0.00 H new ATOM 0 HG2 GLU A 68 12.414 -47.380 10.496 1.00 0.00 H new ATOM 0 HG3 GLU A 68 10.691 -47.561 10.756 1.00 0.00 H new ATOM 597 N PRO A 69 10.956 -47.578 15.750 1.00 0.00 N ATOM 598 CA PRO A 69 10.732 -48.367 16.978 1.00 0.00 C ATOM 599 C PRO A 69 9.250 -48.594 17.306 1.00 0.00 C ATOM 600 O PRO A 69 8.890 -49.683 17.735 1.00 0.00 O ATOM 601 CB PRO A 69 11.434 -47.593 18.088 1.00 0.00 C ATOM 602 CG PRO A 69 12.633 -47.003 17.371 1.00 0.00 C ATOM 603 CD PRO A 69 12.053 -46.618 16.007 1.00 0.00 C ATOM 0 HA PRO A 69 11.130 -49.374 16.854 1.00 0.00 H new ATOM 0 HB2 PRO A 69 10.793 -46.819 18.511 1.00 0.00 H new ATOM 0 HB3 PRO A 69 11.733 -48.244 18.910 1.00 0.00 H new ATOM 0 HG2 PRO A 69 13.035 -46.138 17.899 1.00 0.00 H new ATOM 0 HG3 PRO A 69 13.444 -47.725 17.277 1.00 0.00 H new ATOM 0 HD2 PRO A 69 11.682 -45.593 16.015 1.00 0.00 H new ATOM 0 HD3 PRO A 69 12.814 -46.676 15.228 1.00 0.00 H new ATOM 604 N PHE A 70 8.404 -47.581 17.124 1.00 0.00 N ATOM 605 CA PHE A 70 6.965 -47.784 17.391 1.00 0.00 C ATOM 606 C PHE A 70 6.282 -48.675 16.349 1.00 0.00 C ATOM 607 O PHE A 70 5.556 -49.583 16.694 1.00 0.00 O ATOM 608 CB PHE A 70 6.192 -46.473 17.621 1.00 0.00 C ATOM 609 CG PHE A 70 4.808 -46.773 18.213 1.00 0.00 C ATOM 610 CD1 PHE A 70 4.731 -47.361 19.506 1.00 0.00 C ATOM 611 CD2 PHE A 70 3.669 -46.728 17.384 1.00 0.00 C ATOM 612 CE1 PHE A 70 3.516 -47.921 19.944 1.00 0.00 C ATOM 613 CE2 PHE A 70 2.449 -47.280 17.817 1.00 0.00 C ATOM 614 CZ PHE A 70 2.383 -47.880 19.104 1.00 0.00 C ATOM 0 H PHE A 70 8.665 -46.647 16.807 1.00 0.00 H new ATOM 0 HA PHE A 70 6.931 -48.325 18.336 1.00 0.00 H new ATOM 0 HB2 PHE A 70 6.752 -45.825 18.296 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.084 -45.935 16.679 1.00 0.00 H new ATOM 0 HD1 PHE A 70 5.599 -47.378 20.148 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.733 -46.267 16.410 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.451 -48.380 20.919 1.00 0.00 H new ATOM 0 HE2 PHE A 70 1.576 -47.248 17.181 1.00 0.00 H new ATOM 0 HZ PHE A 70 1.453 -48.311 19.444 1.00 0.00 H new ATOM 616 N PHE A 71 6.647 -48.452 15.079 1.00 0.00 N ATOM 617 CA PHE A 71 6.197 -49.285 13.955 1.00 0.00 C ATOM 618 C PHE A 71 6.455 -50.797 14.126 1.00 0.00 C ATOM 619 O PHE A 71 5.565 -51.595 13.924 1.00 0.00 O ATOM 620 CB PHE A 71 6.833 -48.726 12.678 1.00 0.00 C ATOM 621 CG PHE A 71 6.273 -49.405 11.442 1.00 0.00 C ATOM 622 CD1 PHE A 71 4.925 -49.191 11.088 1.00 0.00 C ATOM 623 CD2 PHE A 71 7.047 -50.425 10.823 1.00 0.00 C ATOM 624 CE1 PHE A 71 4.311 -50.035 10.134 1.00 0.00 C ATOM 625 CE2 PHE A 71 6.445 -51.260 9.871 1.00 0.00 C ATOM 626 CZ PHE A 71 5.079 -51.067 9.541 1.00 0.00 C ATOM 0 H PHE A 71 7.263 -47.688 14.802 1.00 0.00 H new ATOM 0 HA PHE A 71 5.110 -49.226 13.903 1.00 0.00 H new ATOM 0 HB2 PHE A 71 6.653 -47.653 12.619 1.00 0.00 H new ATOM 0 HB3 PHE A 71 7.913 -48.867 12.715 1.00 0.00 H new ATOM 0 HD1 PHE A 71 4.365 -48.387 11.543 1.00 0.00 H new ATOM 0 HD2 PHE A 71 8.087 -50.555 11.083 1.00 0.00 H new ATOM 0 HE1 PHE A 71 3.275 -49.895 9.862 1.00 0.00 H new ATOM 0 HE2 PHE A 71 7.016 -52.043 9.394 1.00 0.00 H new ATOM 0 HZ PHE A 71 4.613 -51.723 8.820 1.00 0.00 H new ATOM 628 N THR A 72 7.671 -51.144 14.582 1.00 0.00 N ATOM 629 CA THR A 72 8.015 -52.565 14.850 1.00 0.00 C ATOM 630 C THR A 72 7.176 -53.188 15.974 1.00 0.00 C ATOM 631 O THR A 72 6.690 -54.303 15.840 1.00 0.00 O ATOM 632 CB THR A 72 9.499 -52.711 15.184 1.00 0.00 C ATOM 633 OG1 THR A 72 9.837 -51.700 16.133 1.00 0.00 O ATOM 634 CG2 THR A 72 10.384 -52.633 13.933 1.00 0.00 C ATOM 0 H THR A 72 8.423 -50.481 14.772 1.00 0.00 H new ATOM 0 HA THR A 72 7.785 -53.106 13.932 1.00 0.00 H new ATOM 0 HB THR A 72 9.681 -53.698 15.610 1.00 0.00 H new ATOM 0 HG1 THR A 72 10.786 -51.774 16.365 1.00 0.00 H new ATOM 0 HG21 THR A 72 11.430 -52.742 14.220 1.00 0.00 H new ATOM 0 HG22 THR A 72 10.112 -53.433 13.244 1.00 0.00 H new ATOM 0 HG23 THR A 72 10.240 -51.669 13.445 1.00 0.00 H new ATOM 637 N ASP A 73 6.978 -52.421 17.042 1.00 0.00 N ATOM 638 CA ASP A 73 6.058 -52.750 18.153 1.00 0.00 C ATOM 639 C ASP A 73 4.598 -52.903 17.677 1.00 0.00 C ATOM 640 O ASP A 73 3.874 -53.751 18.187 1.00 0.00 O ATOM 641 CB ASP A 73 6.181 -51.654 19.218 1.00 0.00 C ATOM 642 CG ASP A 73 5.303 -51.888 20.452 1.00 0.00 C ATOM 643 OD1 ASP A 73 5.724 -52.700 21.311 1.00 0.00 O ATOM 644 OD2 ASP A 73 4.276 -51.187 20.569 1.00 0.00 O ATOM 0 H ASP A 73 7.458 -51.531 17.173 1.00 0.00 H new ATOM 0 HA ASP A 73 6.339 -53.716 18.573 1.00 0.00 H new ATOM 0 HB2 ASP A 73 7.222 -51.582 19.533 1.00 0.00 H new ATOM 0 HB3 ASP A 73 5.916 -50.696 18.772 1.00 0.00 H new ATOM 646 N LEU A 74 4.176 -52.020 16.785 1.00 0.00 N ATOM 647 CA LEU A 74 2.824 -51.969 16.193 1.00 0.00 C ATOM 648 C LEU A 74 2.472 -53.147 15.270 1.00 0.00 C ATOM 649 O LEU A 74 1.432 -53.757 15.399 1.00 0.00 O ATOM 650 CB LEU A 74 2.741 -50.624 15.461 1.00 0.00 C ATOM 651 CG LEU A 74 1.381 -50.333 14.813 1.00 0.00 C ATOM 652 CD1 LEU A 74 0.297 -50.180 15.884 1.00 0.00 C ATOM 653 CD2 LEU A 74 1.476 -49.046 13.996 1.00 0.00 C ATOM 0 H LEU A 74 4.784 -51.282 16.430 1.00 0.00 H new ATOM 0 HA LEU A 74 2.082 -52.058 16.987 1.00 0.00 H new ATOM 0 HB2 LEU A 74 2.971 -49.826 16.167 1.00 0.00 H new ATOM 0 HB3 LEU A 74 3.510 -50.597 14.689 1.00 0.00 H new ATOM 0 HG LEU A 74 1.114 -51.167 14.163 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -0.661 -49.974 15.406 1.00 0.00 H new ATOM 0 HD12 LEU A 74 0.223 -51.102 16.461 1.00 0.00 H new ATOM 0 HD13 LEU A 74 0.556 -49.355 16.548 1.00 0.00 H new ATOM 0 HD21 LEU A 74 0.511 -48.836 13.534 1.00 0.00 H new ATOM 0 HD22 LEU A 74 1.752 -48.219 14.650 1.00 0.00 H new ATOM 0 HD23 LEU A 74 2.232 -49.163 13.220 1.00 0.00 H new ATOM 655 N ALA A 75 3.471 -53.528 14.436 1.00 0.00 N ATOM 656 CA ALA A 75 3.344 -54.555 13.396 1.00 0.00 C ATOM 657 C ALA A 75 2.530 -55.838 13.726 1.00 0.00 C ATOM 658 O ALA A 75 1.620 -56.109 12.964 1.00 0.00 O ATOM 659 CB ALA A 75 4.737 -54.896 12.827 1.00 0.00 C ATOM 0 H ALA A 75 4.403 -53.116 14.476 1.00 0.00 H new ATOM 0 HA ALA A 75 2.710 -54.084 12.645 1.00 0.00 H new ATOM 0 HB1 ALA A 75 4.638 -55.659 12.055 1.00 0.00 H new ATOM 0 HB2 ALA A 75 5.183 -54.000 12.396 1.00 0.00 H new ATOM 0 HB3 ALA A 75 5.375 -55.270 13.627 1.00 0.00 H new ATOM 661 N PRO A 76 2.741 -56.517 14.887 1.00 0.00 N ATOM 662 CA PRO A 76 1.925 -57.709 15.233 1.00 0.00 C ATOM 663 C PRO A 76 0.416 -57.477 15.267 1.00 0.00 C ATOM 664 O PRO A 76 -0.340 -58.343 14.824 1.00 0.00 O ATOM 665 CB PRO A 76 2.448 -58.217 16.585 1.00 0.00 C ATOM 666 CG PRO A 76 3.375 -57.126 17.107 1.00 0.00 C ATOM 667 CD PRO A 76 3.812 -56.338 15.868 1.00 0.00 C ATOM 0 HA PRO A 76 2.041 -58.448 14.440 1.00 0.00 H new ATOM 0 HB2 PRO A 76 1.627 -58.398 17.279 1.00 0.00 H new ATOM 0 HB3 PRO A 76 2.981 -59.161 16.469 1.00 0.00 H new ATOM 0 HG2 PRO A 76 2.861 -56.482 17.821 1.00 0.00 H new ATOM 0 HG3 PRO A 76 4.234 -57.554 17.624 1.00 0.00 H new ATOM 0 HD2 PRO A 76 3.954 -55.284 16.105 1.00 0.00 H new ATOM 0 HD3 PRO A 76 4.762 -56.709 15.483 1.00 0.00 H new ATOM 668 N LYS A 77 -0.011 -56.276 15.663 1.00 0.00 N ATOM 669 CA LYS A 77 -1.452 -55.933 15.701 1.00 0.00 C ATOM 670 C LYS A 77 -1.916 -54.963 14.637 1.00 0.00 C ATOM 671 O LYS A 77 -3.017 -54.392 14.727 1.00 0.00 O ATOM 672 CB LYS A 77 -1.835 -55.373 17.046 1.00 0.00 C ATOM 673 CG LYS A 77 -1.686 -56.554 17.981 1.00 0.00 C ATOM 674 CD LYS A 77 -2.456 -56.265 19.232 1.00 0.00 C ATOM 675 CE LYS A 77 -2.029 -57.424 20.090 1.00 0.00 C ATOM 676 NZ LYS A 77 -2.873 -57.255 21.251 1.00 0.00 N ATOM 0 H LYS A 77 0.608 -55.523 15.962 1.00 0.00 H new ATOM 0 HA LYS A 77 -1.951 -56.881 15.502 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -1.185 -54.548 17.336 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -2.855 -54.989 17.044 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -2.059 -57.462 17.507 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -0.635 -56.724 18.213 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -2.189 -55.304 19.671 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -3.533 -56.249 19.062 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -2.197 -58.382 19.598 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -0.970 -57.377 20.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -2.673 -58.010 21.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -2.683 -56.330 21.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -3.872 -57.303 20.964 1.00 0.00 H new ATOM 681 N LEU A 78 -1.165 -54.880 13.573 1.00 0.00 N ATOM 682 CA LEU A 78 -1.547 -54.015 12.439 1.00 0.00 C ATOM 683 C LEU A 78 -2.007 -54.894 11.277 1.00 0.00 C ATOM 684 O LEU A 78 -1.379 -54.968 10.211 1.00 0.00 O ATOM 685 CB LEU A 78 -0.373 -53.087 12.143 1.00 0.00 C ATOM 686 CG LEU A 78 -0.809 -51.893 11.284 1.00 0.00 C ATOM 687 CD1 LEU A 78 -1.709 -50.926 12.056 1.00 0.00 C ATOM 688 CD2 LEU A 78 0.430 -51.185 10.764 1.00 0.00 C ATOM 0 H LEU A 78 -0.289 -55.387 13.447 1.00 0.00 H new ATOM 0 HA LEU A 78 -2.397 -53.369 12.657 1.00 0.00 H new ATOM 0 HB2 LEU A 78 0.054 -52.727 13.079 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.411 -53.642 11.627 1.00 0.00 H new ATOM 0 HG LEU A 78 -1.402 -52.263 10.448 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -1.993 -50.097 11.408 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.605 -51.450 12.388 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.171 -50.542 12.923 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.133 -50.334 10.152 1.00 0.00 H new ATOM 0 HD22 LEU A 78 1.029 -50.835 11.605 1.00 0.00 H new ATOM 0 HD23 LEU A 78 1.019 -51.877 10.162 1.00 0.00 H new ATOM 690 N LYS A 79 -3.053 -55.652 11.591 1.00 0.00 N ATOM 691 CA LYS A 79 -3.689 -56.624 10.687 1.00 0.00 C ATOM 692 C LYS A 79 -5.193 -56.355 10.592 1.00 0.00 C ATOM 693 O LYS A 79 -5.837 -56.100 11.601 1.00 0.00 O ATOM 694 CB LYS A 79 -3.473 -58.038 11.220 1.00 0.00 C ATOM 695 CG LYS A 79 -2.025 -58.506 11.070 1.00 0.00 C ATOM 696 CD LYS A 79 -1.903 -59.874 11.755 1.00 0.00 C ATOM 697 CE LYS A 79 -0.669 -60.660 11.308 1.00 0.00 C ATOM 698 NZ LYS A 79 0.501 -59.934 11.813 1.00 0.00 N ATOM 0 H LYS A 79 -3.500 -55.611 12.507 1.00 0.00 H new ATOM 0 HA LYS A 79 -3.241 -56.525 9.698 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -3.756 -58.073 12.272 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -4.131 -58.727 10.690 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -1.754 -58.580 10.017 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -1.342 -57.788 11.525 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -1.864 -59.731 12.835 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -2.797 -60.461 11.543 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -0.694 -61.676 11.703 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -0.635 -60.741 10.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 1.356 -60.508 11.666 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 0.597 -59.033 11.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 0.381 -59.746 12.829 1.00 0.00 H new ATOM 703 N GLY A 80 -5.650 -56.261 9.347 1.00 0.00 N ATOM 704 CA GLY A 80 -7.049 -55.965 8.979 1.00 0.00 C ATOM 705 C GLY A 80 -7.403 -54.474 9.101 1.00 0.00 C ATOM 706 O GLY A 80 -7.951 -53.870 8.189 1.00 0.00 O ATOM 0 H GLY A 80 -5.047 -56.391 8.535 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -7.225 -56.291 7.954 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -7.716 -56.544 9.617 1.00 0.00 H new ATOM 708 N LYS A 81 -6.986 -53.916 10.228 1.00 0.00 N ATOM 709 CA LYS A 81 -7.240 -52.511 10.611 1.00 0.00 C ATOM 710 C LYS A 81 -6.927 -51.443 9.576 1.00 0.00 C ATOM 711 O LYS A 81 -5.932 -51.521 8.834 1.00 0.00 O ATOM 712 CB LYS A 81 -6.423 -52.182 11.840 1.00 0.00 C ATOM 713 CG LYS A 81 -7.049 -52.876 13.028 1.00 0.00 C ATOM 714 CD LYS A 81 -6.140 -52.496 14.171 1.00 0.00 C ATOM 715 CE LYS A 81 -5.898 -53.784 14.925 1.00 0.00 C ATOM 716 NZ LYS A 81 -6.607 -53.648 16.195 1.00 0.00 N ATOM 0 H LYS A 81 -6.448 -54.429 10.926 1.00 0.00 H new ATOM 0 HA LYS A 81 -8.319 -52.476 10.761 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -5.392 -52.510 11.709 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -6.397 -51.104 12.001 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -8.071 -52.539 13.198 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -7.089 -53.956 12.888 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -5.205 -52.071 13.807 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -6.604 -51.745 14.811 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -6.268 -54.641 14.362 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -4.833 -53.946 15.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -6.290 -54.390 16.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -6.407 -52.714 16.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -7.630 -53.743 16.033 1.00 0.00 H new ATOM 721 N LYS A 82 -7.675 -50.384 9.732 1.00 0.00 N ATOM 722 CA LYS A 82 -7.636 -49.204 8.847 1.00 0.00 C ATOM 723 C LYS A 82 -6.597 -48.213 9.380 1.00 0.00 C ATOM 724 O LYS A 82 -6.740 -47.666 10.471 1.00 0.00 O ATOM 725 CB LYS A 82 -9.003 -48.524 8.856 1.00 0.00 C ATOM 726 CG LYS A 82 -10.125 -49.449 8.414 1.00 0.00 C ATOM 727 CD LYS A 82 -10.261 -49.359 6.897 1.00 0.00 C ATOM 728 CE LYS A 82 -11.214 -50.453 6.455 1.00 0.00 C ATOM 729 NZ LYS A 82 -12.580 -49.914 6.355 1.00 0.00 N ATOM 0 H LYS A 82 -8.352 -50.295 10.490 1.00 0.00 H new ATOM 0 HA LYS A 82 -7.378 -49.515 7.835 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -9.215 -48.158 9.861 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -8.975 -47.655 8.199 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -9.910 -50.475 8.714 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -11.061 -49.165 8.895 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -10.640 -48.380 6.604 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -9.290 -49.481 6.418 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -10.900 -50.854 5.491 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -11.190 -51.278 7.167 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -13.229 -50.668 6.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -12.879 -49.552 7.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -12.598 -49.141 5.660 1.00 0.00 H new ATOM 734 N VAL A 83 -5.534 -48.065 8.611 1.00 0.00 N ATOM 735 CA VAL A 83 -4.421 -47.171 8.975 1.00 0.00 C ATOM 736 C VAL A 83 -4.205 -46.079 7.922 1.00 0.00 C ATOM 737 O VAL A 83 -4.006 -46.358 6.757 1.00 0.00 O ATOM 738 CB VAL A 83 -3.192 -48.028 9.324 1.00 0.00 C ATOM 739 CG1 VAL A 83 -2.646 -48.851 8.144 1.00 0.00 C ATOM 740 CG2 VAL A 83 -2.093 -47.181 9.950 1.00 0.00 C ATOM 0 H VAL A 83 -5.406 -48.550 7.723 1.00 0.00 H new ATOM 0 HA VAL A 83 -4.655 -46.598 9.873 1.00 0.00 H new ATOM 0 HB VAL A 83 -3.541 -48.756 10.056 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -1.781 -49.427 8.472 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -3.419 -49.530 7.785 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -2.351 -48.179 7.338 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -1.237 -47.813 10.186 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -1.788 -46.404 9.249 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -2.466 -46.719 10.864 1.00 0.00 H new ATOM 742 N GLY A 84 -4.470 -44.851 8.353 1.00 0.00 N ATOM 743 CA GLY A 84 -4.270 -43.647 7.520 1.00 0.00 C ATOM 744 C GLY A 84 -2.906 -43.025 7.837 1.00 0.00 C ATOM 745 O GLY A 84 -2.410 -43.070 8.960 1.00 0.00 O ATOM 0 H GLY A 84 -4.829 -44.651 9.286 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -4.325 -43.910 6.464 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -5.064 -42.925 7.710 1.00 0.00 H new ATOM 747 N LEU A 85 -2.277 -42.500 6.795 1.00 0.00 N ATOM 748 CA LEU A 85 -0.896 -41.993 6.868 1.00 0.00 C ATOM 749 C LEU A 85 -0.880 -40.493 6.554 1.00 0.00 C ATOM 750 O LEU A 85 -1.417 -40.064 5.534 1.00 0.00 O ATOM 751 CB LEU A 85 -0.043 -42.737 5.849 1.00 0.00 C ATOM 752 CG LEU A 85 0.459 -44.130 6.276 1.00 0.00 C ATOM 753 CD1 LEU A 85 -0.629 -45.168 6.574 1.00 0.00 C ATOM 754 CD2 LEU A 85 1.310 -44.664 5.131 1.00 0.00 C ATOM 0 H LEU A 85 -2.701 -42.409 5.872 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.498 -42.151 7.870 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -0.621 -42.847 4.932 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.822 -42.119 5.609 1.00 0.00 H new ATOM 0 HG LEU A 85 0.995 -43.991 7.215 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -0.164 -46.110 6.864 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -1.261 -44.810 7.387 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -1.237 -45.324 5.683 1.00 0.00 H new ATOM 0 HD21 LEU A 85 1.689 -45.653 5.390 1.00 0.00 H new ATOM 0 HD22 LEU A 85 0.703 -44.733 4.228 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.148 -43.989 4.955 1.00 0.00 H new ATOM 756 N PHE A 86 -0.353 -39.717 7.486 1.00 0.00 N ATOM 757 CA PHE A 86 -0.252 -38.259 7.293 1.00 0.00 C ATOM 758 C PHE A 86 1.130 -37.687 7.620 1.00 0.00 C ATOM 759 O PHE A 86 1.733 -37.990 8.648 1.00 0.00 O ATOM 760 CB PHE A 86 -1.383 -37.495 8.012 1.00 0.00 C ATOM 761 CG PHE A 86 -1.352 -37.524 9.535 1.00 0.00 C ATOM 762 CD1 PHE A 86 -1.965 -38.591 10.241 1.00 0.00 C ATOM 763 CD2 PHE A 86 -0.849 -36.390 10.218 1.00 0.00 C ATOM 764 CE1 PHE A 86 -2.083 -38.507 11.644 1.00 0.00 C ATOM 765 CE2 PHE A 86 -0.975 -36.308 11.626 1.00 0.00 C ATOM 766 CZ PHE A 86 -1.595 -37.374 12.319 1.00 0.00 C ATOM 0 H PHE A 86 0.011 -40.055 8.377 1.00 0.00 H new ATOM 0 HA PHE A 86 -0.385 -38.100 6.223 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -1.353 -36.455 7.688 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -2.337 -37.904 7.681 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -2.336 -39.456 9.711 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -0.372 -35.592 9.668 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -2.546 -39.310 12.198 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -0.604 -35.447 12.162 1.00 0.00 H new ATOM 0 HZ PHE A 86 -1.696 -37.316 13.393 1.00 0.00 H new ATOM 768 N GLY A 87 1.616 -36.903 6.670 1.00 0.00 N ATOM 769 CA GLY A 87 2.954 -36.293 6.734 1.00 0.00 C ATOM 770 C GLY A 87 3.097 -34.953 6.032 1.00 0.00 C ATOM 771 O GLY A 87 2.477 -34.677 4.980 1.00 0.00 O ATOM 0 H GLY A 87 1.098 -36.665 5.824 1.00 0.00 H new ATOM 0 HA2 GLY A 87 3.226 -36.165 7.782 1.00 0.00 H new ATOM 0 HA3 GLY A 87 3.672 -36.989 6.301 1.00 0.00 H new ATOM 773 N SER A 88 3.986 -34.180 6.596 1.00 0.00 N ATOM 774 CA SER A 88 4.428 -32.873 6.075 1.00 0.00 C ATOM 775 C SER A 88 5.789 -33.040 5.393 1.00 0.00 C ATOM 776 O SER A 88 6.673 -33.758 5.878 1.00 0.00 O ATOM 777 CB SER A 88 4.673 -31.870 7.196 1.00 0.00 C ATOM 778 OG SER A 88 3.564 -31.777 8.081 1.00 0.00 O ATOM 0 H SER A 88 4.453 -34.435 7.466 1.00 0.00 H new ATOM 0 HA SER A 88 3.645 -32.521 5.403 1.00 0.00 H new ATOM 0 HB2 SER A 88 5.560 -32.163 7.757 1.00 0.00 H new ATOM 0 HB3 SER A 88 4.877 -30.889 6.766 1.00 0.00 H new ATOM 0 HG SER A 88 3.033 -30.984 7.858 1.00 0.00 H new ATOM 781 N TYR A 89 5.910 -32.366 4.269 1.00 0.00 N ATOM 782 CA TYR A 89 7.199 -32.236 3.569 1.00 0.00 C ATOM 783 C TYR A 89 7.535 -30.774 3.273 1.00 0.00 C ATOM 784 O TYR A 89 6.665 -29.896 3.310 1.00 0.00 O ATOM 785 CB TYR A 89 7.242 -33.105 2.312 1.00 0.00 C ATOM 786 CG TYR A 89 6.183 -32.727 1.265 1.00 0.00 C ATOM 787 CD1 TYR A 89 6.479 -31.751 0.287 1.00 0.00 C ATOM 788 CD2 TYR A 89 4.929 -33.380 1.320 1.00 0.00 C ATOM 789 CE1 TYR A 89 5.498 -31.415 -0.652 1.00 0.00 C ATOM 790 CE2 TYR A 89 3.953 -33.054 0.362 1.00 0.00 C ATOM 791 CZ TYR A 89 4.254 -32.086 -0.611 1.00 0.00 C ATOM 792 OH TYR A 89 3.377 -31.916 -1.629 1.00 0.00 O ATOM 0 H TYR A 89 5.134 -31.892 3.807 1.00 0.00 H new ATOM 0 HA TYR A 89 7.976 -32.607 4.238 1.00 0.00 H new ATOM 0 HB2 TYR A 89 8.231 -33.027 1.860 1.00 0.00 H new ATOM 0 HB3 TYR A 89 7.103 -34.148 2.597 1.00 0.00 H new ATOM 0 HD1 TYR A 89 7.447 -31.272 0.265 1.00 0.00 H new ATOM 0 HD2 TYR A 89 4.725 -34.116 2.084 1.00 0.00 H new ATOM 0 HE1 TYR A 89 5.688 -30.656 -1.396 1.00 0.00 H new ATOM 0 HE2 TYR A 89 2.988 -33.539 0.374 1.00 0.00 H new ATOM 0 HH TYR A 89 2.880 -31.082 -1.497 1.00 0.00 H new ATOM 795 N GLY A 90 8.820 -30.556 3.027 1.00 0.00 N ATOM 796 CA GLY A 90 9.355 -29.253 2.616 1.00 0.00 C ATOM 797 C GLY A 90 9.580 -29.234 1.091 1.00 0.00 C ATOM 798 O GLY A 90 8.761 -28.743 0.334 1.00 0.00 O ATOM 0 H GLY A 90 9.532 -31.282 3.106 1.00 0.00 H new ATOM 0 HA2 GLY A 90 8.663 -28.460 2.900 1.00 0.00 H new ATOM 0 HA3 GLY A 90 10.294 -29.056 3.133 1.00 0.00 H new ATOM 800 N TRP A 91 10.633 -29.934 0.693 1.00 0.00 N ATOM 801 CA TRP A 91 11.122 -29.873 -0.706 1.00 0.00 C ATOM 802 C TRP A 91 10.984 -31.105 -1.621 1.00 0.00 C ATOM 803 O TRP A 91 11.084 -30.985 -2.828 1.00 0.00 O ATOM 804 CB TRP A 91 12.583 -29.401 -0.737 1.00 0.00 C ATOM 805 CG TRP A 91 13.481 -30.277 0.139 1.00 0.00 C ATOM 806 CD1 TRP A 91 14.190 -31.323 -0.261 1.00 0.00 C ATOM 807 CD2 TRP A 91 13.886 -29.944 1.423 1.00 0.00 C ATOM 808 NE1 TRP A 91 15.062 -31.664 0.689 1.00 0.00 N ATOM 809 CE2 TRP A 91 14.929 -30.852 1.725 1.00 0.00 C ATOM 810 CE3 TRP A 91 13.522 -28.920 2.320 1.00 0.00 C ATOM 811 CZ2 TRP A 91 15.644 -30.723 2.929 1.00 0.00 C ATOM 812 CZ3 TRP A 91 14.241 -28.799 3.528 1.00 0.00 C ATOM 813 CH2 TRP A 91 15.291 -29.691 3.827 1.00 0.00 C ATOM 0 H TRP A 91 11.171 -30.550 1.302 1.00 0.00 H new ATOM 0 HA TRP A 91 10.417 -29.166 -1.142 1.00 0.00 H new ATOM 0 HB2 TRP A 91 12.949 -29.418 -1.764 1.00 0.00 H new ATOM 0 HB3 TRP A 91 12.639 -28.367 -0.395 1.00 0.00 H new ATOM 0 HD1 TRP A 91 14.079 -31.823 -1.212 1.00 0.00 H new ATOM 0 HE1 TRP A 91 15.729 -32.433 0.626 1.00 0.00 H new ATOM 0 HE3 TRP A 91 12.712 -28.244 2.088 1.00 0.00 H new ATOM 0 HZ2 TRP A 91 16.450 -31.402 3.164 1.00 0.00 H new ATOM 0 HZ3 TRP A 91 13.985 -28.018 4.228 1.00 0.00 H new ATOM 0 HH2 TRP A 91 15.833 -29.584 4.755 1.00 0.00 H new ATOM 816 N GLY A 92 10.666 -32.264 -1.035 1.00 0.00 N ATOM 817 CA GLY A 92 10.593 -33.530 -1.777 1.00 0.00 C ATOM 818 C GLY A 92 9.325 -34.237 -1.290 1.00 0.00 C ATOM 819 O GLY A 92 9.135 -34.411 -0.103 1.00 0.00 O ATOM 0 H GLY A 92 10.453 -32.353 -0.041 1.00 0.00 H new ATOM 0 HA2 GLY A 92 10.550 -33.350 -2.851 1.00 0.00 H new ATOM 0 HA3 GLY A 92 11.476 -34.142 -1.591 1.00 0.00 H new ATOM 821 N SER A 93 8.521 -34.643 -2.266 1.00 0.00 N ATOM 822 CA SER A 93 7.267 -35.331 -1.963 1.00 0.00 C ATOM 823 C SER A 93 7.310 -36.793 -2.422 1.00 0.00 C ATOM 824 O SER A 93 8.186 -37.207 -3.175 1.00 0.00 O ATOM 825 CB SER A 93 6.120 -34.608 -2.683 1.00 0.00 C ATOM 826 OG SER A 93 4.891 -35.099 -2.151 1.00 0.00 O ATOM 0 H SER A 93 8.709 -34.512 -3.260 1.00 0.00 H new ATOM 0 HA SER A 93 7.114 -35.318 -0.884 1.00 0.00 H new ATOM 0 HB2 SER A 93 6.196 -33.531 -2.536 1.00 0.00 H new ATOM 0 HB3 SER A 93 6.170 -34.788 -3.757 1.00 0.00 H new ATOM 0 HG SER A 93 4.566 -34.486 -1.459 1.00 0.00 H new ATOM 829 N GLY A 94 6.467 -37.565 -1.751 1.00 0.00 N ATOM 830 CA GLY A 94 6.086 -38.922 -2.196 1.00 0.00 C ATOM 831 C GLY A 94 6.902 -40.045 -1.571 1.00 0.00 C ATOM 832 O GLY A 94 6.355 -40.806 -0.771 1.00 0.00 O ATOM 0 H GLY A 94 6.021 -37.279 -0.880 1.00 0.00 H new ATOM 0 HA2 GLY A 94 5.033 -39.084 -1.965 1.00 0.00 H new ATOM 0 HA3 GLY A 94 6.187 -38.977 -3.280 1.00 0.00 H new ATOM 834 N GLU A 95 8.176 -40.128 -1.892 1.00 0.00 N ATOM 835 CA GLU A 95 9.038 -41.272 -1.520 1.00 0.00 C ATOM 836 C GLU A 95 8.842 -41.881 -0.131 1.00 0.00 C ATOM 837 O GLU A 95 8.539 -43.067 -0.016 1.00 0.00 O ATOM 838 CB GLU A 95 10.506 -40.923 -1.597 1.00 0.00 C ATOM 839 CG GLU A 95 10.947 -40.985 -3.036 1.00 0.00 C ATOM 840 CD GLU A 95 12.205 -40.134 -3.143 1.00 0.00 C ATOM 841 OE1 GLU A 95 12.153 -38.977 -2.648 1.00 0.00 O ATOM 842 OE2 GLU A 95 13.135 -40.613 -3.802 1.00 0.00 O ATOM 0 H GLU A 95 8.663 -39.406 -2.423 1.00 0.00 H new ATOM 0 HA GLU A 95 8.720 -42.009 -2.257 1.00 0.00 H new ATOM 0 HB2 GLU A 95 10.678 -39.926 -1.193 1.00 0.00 H new ATOM 0 HB3 GLU A 95 11.091 -41.617 -0.993 1.00 0.00 H new ATOM 0 HG2 GLU A 95 11.148 -42.014 -3.335 1.00 0.00 H new ATOM 0 HG3 GLU A 95 10.167 -40.608 -3.697 1.00 0.00 H new ATOM 844 N TRP A 96 9.020 -41.036 0.875 1.00 0.00 N ATOM 845 CA TRP A 96 8.870 -41.415 2.282 1.00 0.00 C ATOM 846 C TRP A 96 7.500 -42.052 2.564 1.00 0.00 C ATOM 847 O TRP A 96 7.450 -43.226 2.970 1.00 0.00 O ATOM 848 CB TRP A 96 9.213 -40.171 3.110 1.00 0.00 C ATOM 849 CG TRP A 96 8.056 -39.488 3.852 1.00 0.00 C ATOM 850 CD1 TRP A 96 7.840 -39.622 5.162 1.00 0.00 C ATOM 851 CD2 TRP A 96 7.174 -38.538 3.370 1.00 0.00 C ATOM 852 NE1 TRP A 96 6.873 -38.802 5.539 1.00 0.00 N ATOM 853 CE2 TRP A 96 6.441 -38.112 4.491 1.00 0.00 C ATOM 854 CE3 TRP A 96 6.928 -37.975 2.089 1.00 0.00 C ATOM 855 CZ2 TRP A 96 5.457 -37.116 4.366 1.00 0.00 C ATOM 856 CZ3 TRP A 96 5.936 -36.981 1.969 1.00 0.00 C ATOM 857 CH2 TRP A 96 5.210 -36.557 3.102 1.00 0.00 C ATOM 0 H TRP A 96 9.275 -40.058 0.741 1.00 0.00 H new ATOM 0 HA TRP A 96 9.556 -42.211 2.570 1.00 0.00 H new ATOM 0 HB2 TRP A 96 9.969 -40.450 3.844 1.00 0.00 H new ATOM 0 HB3 TRP A 96 9.670 -39.437 2.446 1.00 0.00 H new ATOM 0 HD1 TRP A 96 8.373 -40.297 5.815 1.00 0.00 H new ATOM 0 HE1 TRP A 96 6.514 -38.714 6.490 1.00 0.00 H new ATOM 0 HE3 TRP A 96 7.489 -38.302 1.226 1.00 0.00 H new ATOM 0 HZ2 TRP A 96 4.899 -36.786 5.230 1.00 0.00 H new ATOM 0 HZ3 TRP A 96 5.730 -36.541 1.004 1.00 0.00 H new ATOM 0 HH2 TRP A 96 4.455 -35.793 2.996 1.00 0.00 H new ATOM 860 N MET A 97 6.469 -41.465 1.979 1.00 0.00 N ATOM 861 CA MET A 97 5.058 -41.900 2.058 1.00 0.00 C ATOM 862 C MET A 97 4.809 -43.222 1.309 1.00 0.00 C ATOM 863 O MET A 97 4.101 -44.069 1.827 1.00 0.00 O ATOM 864 CB MET A 97 4.180 -40.749 1.549 1.00 0.00 C ATOM 865 CG MET A 97 2.679 -41.024 1.666 1.00 0.00 C ATOM 866 SD MET A 97 2.088 -41.258 3.381 1.00 0.00 S ATOM 867 CE MET A 97 1.842 -39.575 3.888 1.00 0.00 C ATOM 0 H MET A 97 6.584 -40.630 1.405 1.00 0.00 H new ATOM 0 HA MET A 97 4.796 -42.120 3.093 1.00 0.00 H new ATOM 0 HB2 MET A 97 4.420 -39.845 2.109 1.00 0.00 H new ATOM 0 HB3 MET A 97 4.424 -40.551 0.505 1.00 0.00 H new ATOM 0 HG2 MET A 97 2.133 -40.195 1.216 1.00 0.00 H new ATOM 0 HG3 MET A 97 2.439 -41.915 1.086 1.00 0.00 H new ATOM 0 HE1 MET A 97 1.637 -39.544 4.958 1.00 0.00 H new ATOM 0 HE2 MET A 97 2.740 -38.996 3.674 1.00 0.00 H new ATOM 0 HE3 MET A 97 0.998 -39.151 3.344 1.00 0.00 H new ATOM 869 N ASP A 98 5.442 -43.404 0.158 1.00 0.00 N ATOM 870 CA ASP A 98 5.399 -44.671 -0.593 1.00 0.00 C ATOM 871 C ASP A 98 5.967 -45.866 0.186 1.00 0.00 C ATOM 872 O ASP A 98 5.320 -46.903 0.291 1.00 0.00 O ATOM 873 CB ASP A 98 6.174 -44.569 -1.911 1.00 0.00 C ATOM 874 CG ASP A 98 5.356 -43.838 -2.971 1.00 0.00 C ATOM 875 OD1 ASP A 98 4.511 -44.506 -3.599 1.00 0.00 O ATOM 876 OD2 ASP A 98 5.620 -42.619 -3.144 1.00 0.00 O ATOM 0 H ASP A 98 6.004 -42.681 -0.290 1.00 0.00 H new ATOM 0 HA ASP A 98 4.339 -44.845 -0.777 1.00 0.00 H new ATOM 0 HB2 ASP A 98 7.114 -44.042 -1.745 1.00 0.00 H new ATOM 0 HB3 ASP A 98 6.427 -45.568 -2.267 1.00 0.00 H new ATOM 878 N ALA A 99 7.164 -45.659 0.738 1.00 0.00 N ATOM 879 CA ALA A 99 7.845 -46.659 1.584 1.00 0.00 C ATOM 880 C ALA A 99 7.029 -46.983 2.850 1.00 0.00 C ATOM 881 O ALA A 99 6.786 -48.152 3.176 1.00 0.00 O ATOM 882 CB ALA A 99 9.237 -46.136 1.951 1.00 0.00 C ATOM 0 H ALA A 99 7.694 -44.796 0.615 1.00 0.00 H new ATOM 0 HA ALA A 99 7.939 -47.589 1.023 1.00 0.00 H new ATOM 0 HB1 ALA A 99 9.748 -46.868 2.576 1.00 0.00 H new ATOM 0 HB2 ALA A 99 9.815 -45.969 1.042 1.00 0.00 H new ATOM 0 HB3 ALA A 99 9.141 -45.197 2.497 1.00 0.00 H new ATOM 884 N TRP A 100 6.479 -45.921 3.431 1.00 0.00 N ATOM 885 CA TRP A 100 5.567 -45.958 4.586 1.00 0.00 C ATOM 886 C TRP A 100 4.268 -46.741 4.293 1.00 0.00 C ATOM 887 O TRP A 100 3.836 -47.576 5.081 1.00 0.00 O ATOM 888 CB TRP A 100 5.296 -44.507 4.934 1.00 0.00 C ATOM 889 CG TRP A 100 4.659 -44.200 6.292 1.00 0.00 C ATOM 890 CD1 TRP A 100 4.283 -45.054 7.242 1.00 0.00 C ATOM 891 CD2 TRP A 100 4.299 -42.925 6.697 1.00 0.00 C ATOM 892 NE1 TRP A 100 3.673 -44.389 8.226 1.00 0.00 N ATOM 893 CE2 TRP A 100 3.652 -43.095 7.940 1.00 0.00 C ATOM 894 CE3 TRP A 100 4.439 -41.656 6.112 1.00 0.00 C ATOM 895 CZ2 TRP A 100 3.097 -41.982 8.601 1.00 0.00 C ATOM 896 CZ3 TRP A 100 3.886 -40.537 6.780 1.00 0.00 C ATOM 897 CH2 TRP A 100 3.217 -40.707 8.003 1.00 0.00 C ATOM 0 H TRP A 100 6.659 -44.972 3.103 1.00 0.00 H new ATOM 0 HA TRP A 100 6.017 -46.492 5.423 1.00 0.00 H new ATOM 0 HB2 TRP A 100 6.242 -43.968 4.880 1.00 0.00 H new ATOM 0 HB3 TRP A 100 4.649 -44.093 4.161 1.00 0.00 H new ATOM 0 HD1 TRP A 100 4.446 -46.121 7.220 1.00 0.00 H new ATOM 0 HE1 TRP A 100 3.283 -44.812 9.068 1.00 0.00 H new ATOM 0 HE3 TRP A 100 4.958 -41.536 5.172 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 2.589 -42.101 9.547 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 3.979 -39.551 6.348 1.00 0.00 H new ATOM 0 HH2 TRP A 100 2.786 -39.848 8.496 1.00 0.00 H new ATOM 900 N LYS A 101 3.652 -46.443 3.151 1.00 0.00 N ATOM 901 CA LYS A 101 2.472 -47.174 2.668 1.00 0.00 C ATOM 902 C LYS A 101 2.719 -48.656 2.436 1.00 0.00 C ATOM 903 O LYS A 101 2.042 -49.495 3.018 1.00 0.00 O ATOM 904 CB LYS A 101 1.982 -46.459 1.412 1.00 0.00 C ATOM 905 CG LYS A 101 0.643 -47.010 0.957 1.00 0.00 C ATOM 906 CD LYS A 101 0.152 -46.217 -0.243 1.00 0.00 C ATOM 907 CE LYS A 101 -1.169 -46.821 -0.712 1.00 0.00 C ATOM 908 NZ LYS A 101 -1.728 -45.908 -1.697 1.00 0.00 N ATOM 0 H LYS A 101 3.953 -45.690 2.532 1.00 0.00 H new ATOM 0 HA LYS A 101 1.703 -47.163 3.440 1.00 0.00 H new ATOM 0 HB2 LYS A 101 1.891 -45.391 1.610 1.00 0.00 H new ATOM 0 HB3 LYS A 101 2.716 -46.574 0.614 1.00 0.00 H new ATOM 0 HG2 LYS A 101 0.741 -48.064 0.695 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -0.082 -46.949 1.768 1.00 0.00 H new ATOM 0 HD2 LYS A 101 0.016 -45.169 0.025 1.00 0.00 H new ATOM 0 HD3 LYS A 101 0.889 -46.248 -1.045 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.009 -47.807 -1.147 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -1.853 -46.950 0.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -2.633 -46.284 -2.044 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -1.884 -44.978 -1.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -1.066 -45.809 -2.493 1.00 0.00 H new ATOM 913 N GLN A 102 3.838 -48.931 1.771 1.00 0.00 N ATOM 914 CA GLN A 102 4.309 -50.293 1.515 1.00 0.00 C ATOM 915 C GLN A 102 4.449 -51.120 2.800 1.00 0.00 C ATOM 916 O GLN A 102 3.655 -52.082 2.967 1.00 0.00 O ATOM 917 CB GLN A 102 5.596 -50.065 0.704 1.00 0.00 C ATOM 918 CG GLN A 102 6.351 -51.323 0.310 1.00 0.00 C ATOM 919 CD GLN A 102 7.598 -51.417 1.189 1.00 0.00 C ATOM 920 OE1 GLN A 102 8.382 -50.489 1.339 1.00 0.00 O ATOM 921 NE2 GLN A 102 7.712 -52.517 1.876 1.00 0.00 N ATOM 0 H GLN A 102 4.450 -48.209 1.390 1.00 0.00 H new ATOM 0 HA GLN A 102 3.610 -50.915 0.956 1.00 0.00 H new ATOM 0 HB2 GLN A 102 5.341 -49.516 -0.203 1.00 0.00 H new ATOM 0 HB3 GLN A 102 6.263 -49.429 1.285 1.00 0.00 H new ATOM 0 HG2 GLN A 102 5.722 -52.203 0.444 1.00 0.00 H new ATOM 0 HG3 GLN A 102 6.629 -51.287 -0.743 1.00 0.00 H new ATOM 0 HE21 GLN A 102 7.047 -53.278 1.735 1.00 0.00 H new ATOM 0 HE22 GLN A 102 8.466 -52.618 2.555 1.00 0.00 H new ATOM 925 N ARG A 103 5.146 -50.618 3.794 1.00 0.00 N ATOM 926 CA ARG A 103 5.298 -51.316 5.098 1.00 0.00 C ATOM 927 C ARG A 103 4.020 -51.441 5.954 1.00 0.00 C ATOM 928 O ARG A 103 3.756 -52.531 6.476 1.00 0.00 O ATOM 929 CB ARG A 103 6.476 -50.771 5.906 1.00 0.00 C ATOM 930 CG ARG A 103 6.300 -49.320 6.348 1.00 0.00 C ATOM 931 CD ARG A 103 7.629 -48.731 6.827 1.00 0.00 C ATOM 932 NE ARG A 103 8.540 -48.657 5.667 1.00 0.00 N ATOM 933 CZ ARG A 103 9.836 -48.364 5.720 1.00 0.00 C ATOM 934 NH1 ARG A 103 10.432 -48.101 6.870 1.00 0.00 N ATOM 935 NH2 ARG A 103 10.561 -48.351 4.615 1.00 0.00 N ATOM 0 H ARG A 103 5.630 -49.721 3.745 1.00 0.00 H new ATOM 0 HA ARG A 103 5.519 -52.345 4.813 1.00 0.00 H new ATOM 0 HB2 ARG A 103 6.619 -51.395 6.788 1.00 0.00 H new ATOM 0 HB3 ARG A 103 7.383 -50.851 5.308 1.00 0.00 H new ATOM 0 HG2 ARG A 103 5.912 -48.727 5.519 1.00 0.00 H new ATOM 0 HG3 ARG A 103 5.564 -49.266 7.150 1.00 0.00 H new ATOM 0 HD2 ARG A 103 7.475 -47.740 7.254 1.00 0.00 H new ATOM 0 HD3 ARG A 103 8.061 -49.353 7.611 1.00 0.00 H new ATOM 0 HE ARG A 103 8.141 -48.847 4.747 1.00 0.00 H new ATOM 0 HH11 ARG A 103 9.897 -48.121 7.738 1.00 0.00 H new ATOM 0 HH12 ARG A 103 11.427 -47.878 6.889 1.00 0.00 H new ATOM 0 HH21 ARG A 103 10.127 -48.566 3.718 1.00 0.00 H new ATOM 0 HH22 ARG A 103 11.555 -48.126 4.660 1.00 0.00 H new ATOM 942 N THR A 104 3.142 -50.440 5.901 1.00 0.00 N ATOM 943 CA THR A 104 1.893 -50.441 6.695 1.00 0.00 C ATOM 944 C THR A 104 0.825 -51.377 6.109 1.00 0.00 C ATOM 945 O THR A 104 0.176 -52.133 6.828 1.00 0.00 O ATOM 946 CB THR A 104 1.281 -49.038 6.877 1.00 0.00 C ATOM 947 OG1 THR A 104 1.278 -48.321 5.646 1.00 0.00 O ATOM 948 CG2 THR A 104 2.017 -48.256 7.970 1.00 0.00 C ATOM 0 H THR A 104 3.264 -49.612 5.318 1.00 0.00 H new ATOM 0 HA THR A 104 2.197 -50.810 7.674 1.00 0.00 H new ATOM 0 HB THR A 104 0.246 -49.160 7.195 1.00 0.00 H new ATOM 0 HG1 THR A 104 2.184 -48.002 5.451 1.00 0.00 H new ATOM 0 HG21 THR A 104 1.566 -47.270 8.078 1.00 0.00 H new ATOM 0 HG22 THR A 104 1.944 -48.795 8.915 1.00 0.00 H new ATOM 0 HG23 THR A 104 3.066 -48.147 7.695 1.00 0.00 H new ATOM 951 N GLU A 105 0.723 -51.336 4.788 1.00 0.00 N ATOM 952 CA GLU A 105 -0.053 -52.306 3.992 1.00 0.00 C ATOM 953 C GLU A 105 0.441 -53.761 4.176 1.00 0.00 C ATOM 954 O GLU A 105 -0.341 -54.658 4.488 1.00 0.00 O ATOM 955 CB GLU A 105 0.077 -51.849 2.538 1.00 0.00 C ATOM 956 CG GLU A 105 -0.909 -52.536 1.589 1.00 0.00 C ATOM 957 CD GLU A 105 -2.358 -52.067 1.739 1.00 0.00 C ATOM 958 OE1 GLU A 105 -2.582 -50.851 1.978 1.00 0.00 O ATOM 959 OE2 GLU A 105 -3.236 -52.904 1.430 1.00 0.00 O ATOM 0 H GLU A 105 1.180 -50.622 4.221 1.00 0.00 H new ATOM 0 HA GLU A 105 -1.093 -52.324 4.319 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -0.076 -50.771 2.490 1.00 0.00 H new ATOM 0 HB3 GLU A 105 1.093 -52.042 2.195 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -0.588 -52.362 0.562 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -0.868 -53.612 1.758 1.00 0.00 H new ATOM 961 N ASP A 106 1.754 -53.931 4.109 1.00 0.00 N ATOM 962 CA ASP A 106 2.439 -55.244 4.152 1.00 0.00 C ATOM 963 C ASP A 106 2.207 -56.110 5.394 1.00 0.00 C ATOM 964 O ASP A 106 2.288 -57.329 5.298 1.00 0.00 O ATOM 965 CB ASP A 106 3.950 -55.129 3.912 1.00 0.00 C ATOM 966 CG ASP A 106 4.325 -54.802 2.467 1.00 0.00 C ATOM 967 OD1 ASP A 106 3.506 -55.068 1.551 1.00 0.00 O ATOM 968 OD2 ASP A 106 5.459 -54.306 2.286 1.00 0.00 O ATOM 0 H ASP A 106 2.402 -53.148 4.021 1.00 0.00 H new ATOM 0 HA ASP A 106 1.951 -55.765 3.329 1.00 0.00 H new ATOM 0 HB2 ASP A 106 4.354 -54.356 4.566 1.00 0.00 H new ATOM 0 HB3 ASP A 106 4.426 -56.068 4.197 1.00 0.00 H new ATOM 970 N THR A 107 1.922 -55.478 6.538 1.00 0.00 N ATOM 971 CA THR A 107 1.626 -56.216 7.785 1.00 0.00 C ATOM 972 C THR A 107 0.235 -56.873 7.818 1.00 0.00 C ATOM 973 O THR A 107 -0.113 -57.519 8.810 1.00 0.00 O ATOM 974 CB THR A 107 1.781 -55.312 9.018 1.00 0.00 C ATOM 975 OG1 THR A 107 0.881 -54.200 8.889 1.00 0.00 O ATOM 976 CG2 THR A 107 3.225 -54.862 9.229 1.00 0.00 C ATOM 0 H THR A 107 1.888 -54.463 6.633 1.00 0.00 H new ATOM 0 HA THR A 107 2.361 -57.021 7.809 1.00 0.00 H new ATOM 0 HB THR A 107 1.523 -55.881 9.911 1.00 0.00 H new ATOM 0 HG1 THR A 107 0.076 -54.367 9.423 1.00 0.00 H new ATOM 0 HG21 THR A 107 3.282 -54.226 10.112 1.00 0.00 H new ATOM 0 HG22 THR A 107 3.862 -55.736 9.369 1.00 0.00 H new ATOM 0 HG23 THR A 107 3.563 -54.303 8.356 1.00 0.00 H new ATOM 979 N GLY A 108 -0.512 -56.728 6.727 1.00 0.00 N ATOM 980 CA GLY A 108 -1.894 -57.227 6.567 1.00 0.00 C ATOM 981 C GLY A 108 -2.976 -56.186 6.895 1.00 0.00 C ATOM 982 O GLY A 108 -4.137 -56.556 7.085 1.00 0.00 O ATOM 0 H GLY A 108 -0.170 -56.245 5.896 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -2.030 -57.566 5.540 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -2.033 -58.095 7.211 1.00 0.00 H new ATOM 984 N ALA A 109 -2.613 -54.914 6.891 1.00 0.00 N ATOM 985 CA ALA A 109 -3.523 -53.789 7.189 1.00 0.00 C ATOM 986 C ALA A 109 -3.798 -52.973 5.928 1.00 0.00 C ATOM 987 O ALA A 109 -3.016 -52.975 4.970 1.00 0.00 O ATOM 988 CB ALA A 109 -2.895 -52.897 8.260 1.00 0.00 C ATOM 0 H ALA A 109 -1.661 -54.615 6.678 1.00 0.00 H new ATOM 0 HA ALA A 109 -4.469 -54.187 7.555 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -3.565 -52.066 8.481 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -2.728 -53.479 9.166 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -1.943 -52.508 7.898 1.00 0.00 H new ATOM 990 N THR A 110 -4.887 -52.225 5.970 1.00 0.00 N ATOM 991 CA THR A 110 -5.313 -51.435 4.806 1.00 0.00 C ATOM 992 C THR A 110 -5.236 -49.939 5.089 1.00 0.00 C ATOM 993 O THR A 110 -5.544 -49.462 6.184 1.00 0.00 O ATOM 994 CB THR A 110 -6.673 -51.878 4.251 1.00 0.00 C ATOM 995 OG1 THR A 110 -6.935 -51.118 3.075 1.00 0.00 O ATOM 996 CG2 THR A 110 -7.823 -51.763 5.266 1.00 0.00 C ATOM 0 H THR A 110 -5.494 -52.142 6.785 1.00 0.00 H new ATOM 0 HA THR A 110 -4.602 -51.637 4.005 1.00 0.00 H new ATOM 0 HB THR A 110 -6.619 -52.942 4.019 1.00 0.00 H new ATOM 0 HG1 THR A 110 -7.800 -51.384 2.699 1.00 0.00 H new ATOM 0 HG21 THR A 110 -8.752 -52.094 4.802 1.00 0.00 H new ATOM 0 HG22 THR A 110 -7.607 -52.388 6.132 1.00 0.00 H new ATOM 0 HG23 THR A 110 -7.925 -50.725 5.584 1.00 0.00 H new ATOM 999 N VAL A 111 -4.876 -49.231 4.039 1.00 0.00 N ATOM 1000 CA VAL A 111 -4.539 -47.788 4.112 1.00 0.00 C ATOM 1001 C VAL A 111 -5.742 -46.918 3.797 1.00 0.00 C ATOM 1002 O VAL A 111 -6.112 -46.694 2.645 1.00 0.00 O ATOM 1003 CB VAL A 111 -3.248 -47.510 3.310 1.00 0.00 C ATOM 1004 CG1 VAL A 111 -2.852 -46.035 3.377 1.00 0.00 C ATOM 1005 CG2 VAL A 111 -2.070 -48.324 3.869 1.00 0.00 C ATOM 0 H VAL A 111 -4.803 -49.622 3.100 1.00 0.00 H new ATOM 0 HA VAL A 111 -4.296 -47.499 5.134 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.459 -47.794 2.279 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -1.940 -45.877 2.802 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -3.653 -45.424 2.962 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.680 -45.751 4.415 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -1.173 -48.111 3.288 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -1.901 -48.051 4.911 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -2.300 -49.388 3.805 1.00 0.00 H new ATOM 1007 N ILE A 112 -6.225 -46.292 4.871 1.00 0.00 N ATOM 1008 CA ILE A 112 -7.389 -45.378 4.805 1.00 0.00 C ATOM 1009 C ILE A 112 -6.976 -43.910 4.548 1.00 0.00 C ATOM 1010 O ILE A 112 -7.185 -42.968 5.304 1.00 0.00 O ATOM 1011 CB ILE A 112 -8.363 -45.608 5.971 1.00 0.00 C ATOM 1012 CG1 ILE A 112 -9.698 -44.938 5.639 1.00 0.00 C ATOM 1013 CG2 ILE A 112 -7.848 -45.163 7.341 1.00 0.00 C ATOM 1014 CD1 ILE A 112 -10.520 -45.755 4.631 1.00 0.00 C ATOM 0 H ILE A 112 -5.832 -46.396 5.807 1.00 0.00 H new ATOM 0 HA ILE A 112 -7.971 -45.632 3.919 1.00 0.00 H new ATOM 0 HB ILE A 112 -8.483 -46.687 6.070 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -10.275 -44.807 6.555 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -9.513 -43.943 5.234 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -8.605 -45.366 8.098 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -6.937 -45.711 7.583 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -7.634 -44.094 7.320 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -11.459 -45.241 4.426 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -9.956 -45.864 3.705 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -10.729 -46.741 5.046 1.00 0.00 H new ATOM 1016 N GLY A 113 -6.208 -43.843 3.465 1.00 0.00 N ATOM 1017 CA GLY A 113 -5.750 -42.602 2.833 1.00 0.00 C ATOM 1018 C GLY A 113 -4.357 -42.143 3.283 1.00 0.00 C ATOM 1019 O GLY A 113 -3.832 -42.506 4.332 1.00 0.00 O ATOM 0 H GLY A 113 -5.874 -44.678 2.984 1.00 0.00 H new ATOM 0 HA2 GLY A 113 -5.743 -42.739 1.752 1.00 0.00 H new ATOM 0 HA3 GLY A 113 -6.468 -41.811 3.049 1.00 0.00 H new ATOM 1021 N THR A 114 -3.768 -41.364 2.372 1.00 0.00 N ATOM 1022 CA THR A 114 -2.432 -40.750 2.543 1.00 0.00 C ATOM 1023 C THR A 114 -2.510 -39.227 2.348 1.00 0.00 C ATOM 1024 O THR A 114 -2.880 -38.748 1.273 1.00 0.00 O ATOM 1025 CB THR A 114 -1.440 -41.335 1.534 1.00 0.00 C ATOM 1026 OG1 THR A 114 -1.993 -41.243 0.213 1.00 0.00 O ATOM 1027 CG2 THR A 114 -1.028 -42.772 1.878 1.00 0.00 C ATOM 0 H THR A 114 -4.205 -41.134 1.480 1.00 0.00 H new ATOM 0 HA THR A 114 -2.089 -40.967 3.555 1.00 0.00 H new ATOM 0 HB THR A 114 -0.523 -40.747 1.579 1.00 0.00 H new ATOM 0 HG1 THR A 114 -2.576 -40.458 0.157 1.00 0.00 H new ATOM 0 HG21 THR A 114 -0.324 -43.138 1.130 1.00 0.00 H new ATOM 0 HG22 THR A 114 -0.556 -42.790 2.860 1.00 0.00 H new ATOM 0 HG23 THR A 114 -1.911 -43.411 1.888 1.00 0.00 H new ATOM 1030 N ALA A 115 -2.173 -38.512 3.418 1.00 0.00 N ATOM 1031 CA ALA A 115 -2.186 -37.036 3.434 1.00 0.00 C ATOM 1032 C ALA A 115 -0.770 -36.446 3.438 1.00 0.00 C ATOM 1033 O ALA A 115 0.012 -36.633 4.377 1.00 0.00 O ATOM 1034 CB ALA A 115 -2.999 -36.518 4.622 1.00 0.00 C ATOM 0 H ALA A 115 -1.882 -38.930 4.302 1.00 0.00 H new ATOM 0 HA ALA A 115 -2.666 -36.704 2.513 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -2.997 -35.428 4.617 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -4.025 -36.879 4.546 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -2.556 -36.877 5.551 1.00 0.00 H new ATOM 1036 N ILE A 116 -0.450 -35.806 2.323 1.00 0.00 N ATOM 1037 CA ILE A 116 0.844 -35.141 2.109 1.00 0.00 C ATOM 1038 C ILE A 116 0.661 -33.627 1.994 1.00 0.00 C ATOM 1039 O ILE A 116 -0.197 -33.137 1.251 1.00 0.00 O ATOM 1040 CB ILE A 116 1.598 -35.715 0.892 1.00 0.00 C ATOM 1041 CG1 ILE A 116 0.772 -35.692 -0.408 1.00 0.00 C ATOM 1042 CG2 ILE A 116 2.123 -37.118 1.225 1.00 0.00 C ATOM 1043 CD1 ILE A 116 1.652 -35.686 -1.662 1.00 0.00 C ATOM 0 H ILE A 116 -1.083 -35.728 1.527 1.00 0.00 H new ATOM 0 HA ILE A 116 1.465 -35.342 2.982 1.00 0.00 H new ATOM 0 HB ILE A 116 2.446 -35.060 0.691 1.00 0.00 H new ATOM 0 HG12 ILE A 116 0.115 -36.562 -0.433 1.00 0.00 H new ATOM 0 HG13 ILE A 116 0.132 -34.809 -0.413 1.00 0.00 H new ATOM 0 HG21 ILE A 116 2.655 -37.521 0.364 1.00 0.00 H new ATOM 0 HG22 ILE A 116 2.801 -37.060 2.076 1.00 0.00 H new ATOM 0 HG23 ILE A 116 1.286 -37.771 1.472 1.00 0.00 H new ATOM 0 HD11 ILE A 116 1.020 -35.670 -2.550 1.00 0.00 H new ATOM 0 HD12 ILE A 116 2.290 -34.802 -1.654 1.00 0.00 H new ATOM 0 HD13 ILE A 116 2.273 -36.582 -1.675 1.00 0.00 H new ATOM 1045 N VAL A 117 1.377 -32.918 2.858 1.00 0.00 N ATOM 1046 CA VAL A 117 1.280 -31.456 2.926 1.00 0.00 C ATOM 1047 C VAL A 117 2.606 -30.702 2.815 1.00 0.00 C ATOM 1048 O VAL A 117 3.654 -31.120 3.315 1.00 0.00 O ATOM 1049 CB VAL A 117 0.382 -31.055 4.118 1.00 0.00 C ATOM 1050 CG1 VAL A 117 1.114 -30.593 5.381 1.00 0.00 C ATOM 1051 CG2 VAL A 117 -0.603 -29.976 3.678 1.00 0.00 C ATOM 0 H VAL A 117 2.033 -33.327 3.524 1.00 0.00 H new ATOM 0 HA VAL A 117 0.788 -31.115 2.015 1.00 0.00 H new ATOM 0 HB VAL A 117 -0.126 -31.975 4.406 1.00 0.00 H new ATOM 0 HG11 VAL A 117 0.386 -30.337 6.151 1.00 0.00 H new ATOM 0 HG12 VAL A 117 1.758 -31.395 5.742 1.00 0.00 H new ATOM 0 HG13 VAL A 117 1.721 -29.717 5.150 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -1.235 -29.695 4.520 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -0.053 -29.102 3.329 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -1.225 -30.359 2.869 1.00 0.00 H new ATOM 1053 N ASN A 118 2.498 -29.609 2.092 1.00 0.00 N ATOM 1054 CA ASN A 118 3.540 -28.599 1.914 1.00 0.00 C ATOM 1055 C ASN A 118 3.668 -27.795 3.202 1.00 0.00 C ATOM 1056 O ASN A 118 3.045 -26.744 3.395 1.00 0.00 O ATOM 1057 CB ASN A 118 3.013 -27.677 0.816 1.00 0.00 C ATOM 1058 CG ASN A 118 2.906 -28.301 -0.566 1.00 0.00 C ATOM 1059 OD1 ASN A 118 2.725 -29.425 -1.004 1.00 0.00 O ATOM 1060 ND2 ASN A 118 4.080 -28.167 -0.976 1.00 0.00 N ATOM 0 H ASN A 118 1.643 -29.381 1.584 1.00 0.00 H new ATOM 0 HA ASN A 118 4.507 -29.037 1.667 1.00 0.00 H new ATOM 0 HB2 ASN A 118 2.027 -27.317 1.110 1.00 0.00 H new ATOM 0 HB3 ASN A 118 3.665 -26.806 0.753 1.00 0.00 H new ATOM 0 HD21 ASN A 118 4.527 -28.921 -1.498 1.00 0.00 H new ATOM 0 HD22 ASN A 118 4.590 -27.304 -0.789 1.00 0.00 H new ATOM 1064 N GLU A 119 4.471 -28.375 4.082 1.00 0.00 N ATOM 1065 CA GLU A 119 4.784 -27.884 5.421 1.00 0.00 C ATOM 1066 C GLU A 119 3.565 -27.795 6.359 1.00 0.00 C ATOM 1067 O GLU A 119 3.402 -28.615 7.268 1.00 0.00 O ATOM 1068 CB GLU A 119 5.544 -26.570 5.245 1.00 0.00 C ATOM 1069 CG GLU A 119 5.989 -26.145 6.627 1.00 0.00 C ATOM 1070 CD GLU A 119 7.475 -25.873 6.680 1.00 0.00 C ATOM 1071 OE1 GLU A 119 7.825 -24.719 6.375 1.00 0.00 O ATOM 1072 OE2 GLU A 119 8.183 -26.781 7.180 1.00 0.00 O ATOM 0 H GLU A 119 4.950 -29.251 3.871 1.00 0.00 H new ATOM 0 HA GLU A 119 5.413 -28.604 5.945 1.00 0.00 H new ATOM 0 HB2 GLU A 119 6.401 -26.703 4.585 1.00 0.00 H new ATOM 0 HB3 GLU A 119 4.907 -25.811 4.792 1.00 0.00 H new ATOM 0 HG2 GLU A 119 5.445 -25.249 6.924 1.00 0.00 H new ATOM 0 HG3 GLU A 119 5.736 -26.924 7.346 1.00 0.00 H new ATOM 1074 N MET A 120 2.747 -26.798 6.087 1.00 0.00 N ATOM 1075 CA MET A 120 1.570 -26.409 6.873 1.00 0.00 C ATOM 1076 C MET A 120 0.297 -27.070 6.358 1.00 0.00 C ATOM 1077 O MET A 120 0.128 -27.151 5.136 1.00 0.00 O ATOM 1078 CB MET A 120 1.394 -24.892 6.796 1.00 0.00 C ATOM 1079 CG MET A 120 2.393 -24.230 7.735 1.00 0.00 C ATOM 1080 SD MET A 120 2.180 -24.831 9.448 1.00 0.00 S ATOM 1081 CE MET A 120 3.501 -23.864 10.133 1.00 0.00 C ATOM 0 H MET A 120 2.883 -26.200 5.272 1.00 0.00 H new ATOM 0 HA MET A 120 1.735 -26.735 7.900 1.00 0.00 H new ATOM 0 HB2 MET A 120 1.551 -24.546 5.774 1.00 0.00 H new ATOM 0 HB3 MET A 120 0.377 -24.616 7.073 1.00 0.00 H new ATOM 0 HG2 MET A 120 3.408 -24.438 7.397 1.00 0.00 H new ATOM 0 HG3 MET A 120 2.262 -23.148 7.707 1.00 0.00 H new ATOM 0 HE1 MET A 120 3.578 -24.059 11.203 1.00 0.00 H new ATOM 0 HE2 MET A 120 4.439 -24.133 9.647 1.00 0.00 H new ATOM 0 HE3 MET A 120 3.299 -22.805 9.971 1.00 0.00 H new ATOM 1083 N PRO A 121 -0.586 -27.497 7.272 1.00 0.00 N ATOM 1084 CA PRO A 121 -1.912 -28.010 6.902 1.00 0.00 C ATOM 1085 C PRO A 121 -2.768 -26.935 6.222 1.00 0.00 C ATOM 1086 O PRO A 121 -2.321 -25.826 5.925 1.00 0.00 O ATOM 1087 CB PRO A 121 -2.504 -28.511 8.225 1.00 0.00 C ATOM 1088 CG PRO A 121 -1.793 -27.698 9.285 1.00 0.00 C ATOM 1089 CD PRO A 121 -0.372 -27.589 8.738 1.00 0.00 C ATOM 0 HA PRO A 121 -1.866 -28.809 6.162 1.00 0.00 H new ATOM 0 HB2 PRO A 121 -3.582 -28.356 8.262 1.00 0.00 H new ATOM 0 HB3 PRO A 121 -2.330 -29.579 8.359 1.00 0.00 H new ATOM 0 HG2 PRO A 121 -2.251 -26.718 9.417 1.00 0.00 H new ATOM 0 HG3 PRO A 121 -1.815 -28.193 10.256 1.00 0.00 H new ATOM 0 HD2 PRO A 121 0.144 -26.711 9.127 1.00 0.00 H new ATOM 0 HD3 PRO A 121 0.231 -28.457 9.004 1.00 0.00 H new ATOM 1090 N ASP A 122 -3.997 -27.351 5.929 1.00 0.00 N ATOM 1091 CA ASP A 122 -5.012 -26.610 5.138 1.00 0.00 C ATOM 1092 C ASP A 122 -4.772 -26.513 3.635 1.00 0.00 C ATOM 1093 O ASP A 122 -5.657 -26.723 2.840 1.00 0.00 O ATOM 1094 CB ASP A 122 -5.339 -25.219 5.706 1.00 0.00 C ATOM 1095 CG ASP A 122 -5.897 -25.318 7.131 1.00 0.00 C ATOM 1096 OD1 ASP A 122 -7.125 -25.464 7.256 1.00 0.00 O ATOM 1097 OD2 ASP A 122 -5.061 -25.314 8.065 1.00 0.00 O ATOM 0 H ASP A 122 -4.343 -28.257 6.246 1.00 0.00 H new ATOM 0 HA ASP A 122 -5.880 -27.259 5.253 1.00 0.00 H new ATOM 0 HB2 ASP A 122 -4.440 -24.603 5.707 1.00 0.00 H new ATOM 0 HB3 ASP A 122 -6.065 -24.722 5.062 1.00 0.00 H new ATOM 1099 N ASN A 123 -3.475 -26.366 3.312 1.00 0.00 N ATOM 1100 CA ASN A 123 -2.984 -26.335 1.925 1.00 0.00 C ATOM 1101 C ASN A 123 -3.211 -27.575 1.058 1.00 0.00 C ATOM 1102 O ASN A 123 -2.897 -27.607 -0.124 1.00 0.00 O ATOM 1103 CB ASN A 123 -1.501 -25.998 1.936 1.00 0.00 C ATOM 1104 CG ASN A 123 -1.289 -24.566 2.383 1.00 0.00 C ATOM 1105 OD1 ASN A 123 -2.191 -23.734 2.579 1.00 0.00 O ATOM 1106 ND2 ASN A 123 -0.098 -24.310 2.813 1.00 0.00 N ATOM 0 H ASN A 123 -2.737 -26.265 4.008 1.00 0.00 H new ATOM 0 HA ASN A 123 -3.600 -25.573 1.447 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -0.972 -26.677 2.605 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -1.082 -26.141 0.940 1.00 0.00 H new ATOM 0 HD21 ASN A 123 0.090 -23.436 3.305 1.00 0.00 H new ATOM 0 HD22 ASN A 123 0.654 -24.982 2.661 1.00 0.00 H new ATOM 1110 N ALA A 124 -3.596 -28.628 1.763 1.00 0.00 N ATOM 1111 CA ALA A 124 -4.048 -29.890 1.162 1.00 0.00 C ATOM 1112 C ALA A 124 -5.344 -30.342 1.871 1.00 0.00 C ATOM 1113 O ALA A 124 -5.298 -30.688 3.052 1.00 0.00 O ATOM 1114 CB ALA A 124 -2.963 -30.965 1.241 1.00 0.00 C ATOM 0 H ALA A 124 -3.606 -28.638 2.783 1.00 0.00 H new ATOM 0 HA ALA A 124 -4.253 -29.733 0.103 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -3.330 -31.886 0.788 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -2.075 -30.626 0.707 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -2.710 -31.150 2.285 1.00 0.00 H new ATOM 1116 N PRO A 125 -6.479 -30.295 1.161 1.00 0.00 N ATOM 1117 CA PRO A 125 -7.774 -30.840 1.652 1.00 0.00 C ATOM 1118 C PRO A 125 -7.702 -32.320 2.056 1.00 0.00 C ATOM 1119 O PRO A 125 -8.562 -32.800 2.791 1.00 0.00 O ATOM 1120 CB PRO A 125 -8.736 -30.629 0.490 1.00 0.00 C ATOM 1121 CG PRO A 125 -8.192 -29.387 -0.196 1.00 0.00 C ATOM 1122 CD PRO A 125 -6.677 -29.573 -0.109 1.00 0.00 C ATOM 0 HA PRO A 125 -8.088 -30.335 2.565 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -8.748 -31.487 -0.182 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -9.759 -30.481 0.837 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -8.530 -29.318 -1.230 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -8.515 -28.475 0.307 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -6.296 -30.143 -0.956 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -6.157 -28.615 -0.109 1.00 0.00 H new ATOM 1123 N GLU A 126 -6.686 -33.025 1.565 1.00 0.00 N ATOM 1124 CA GLU A 126 -6.317 -34.389 1.995 1.00 0.00 C ATOM 1125 C GLU A 126 -6.421 -34.681 3.489 1.00 0.00 C ATOM 1126 O GLU A 126 -6.967 -35.706 3.879 1.00 0.00 O ATOM 1127 CB GLU A 126 -4.896 -34.690 1.519 1.00 0.00 C ATOM 1128 CG GLU A 126 -4.940 -35.567 0.268 1.00 0.00 C ATOM 1129 CD GLU A 126 -3.563 -35.818 -0.334 1.00 0.00 C ATOM 1130 OE1 GLU A 126 -2.589 -36.018 0.435 1.00 0.00 O ATOM 1131 OE2 GLU A 126 -3.484 -35.739 -1.581 1.00 0.00 O ATOM 0 H GLU A 126 -6.073 -32.661 0.835 1.00 0.00 H new ATOM 0 HA GLU A 126 -7.061 -35.040 1.537 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -4.371 -33.760 1.303 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -4.338 -35.195 2.308 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -5.401 -36.523 0.518 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -5.576 -35.092 -0.479 1.00 0.00 H new ATOM 1133 N CYS A 127 -5.984 -33.720 4.315 1.00 0.00 N ATOM 1134 CA CYS A 127 -6.059 -33.808 5.785 1.00 0.00 C ATOM 1135 C CYS A 127 -7.511 -34.003 6.253 1.00 0.00 C ATOM 1136 O CYS A 127 -7.845 -34.989 6.911 1.00 0.00 O ATOM 1137 CB CYS A 127 -5.522 -32.520 6.407 1.00 0.00 C ATOM 1138 SG CYS A 127 -3.909 -31.956 5.760 1.00 0.00 S ATOM 0 H CYS A 127 -5.565 -32.852 3.982 1.00 0.00 H new ATOM 0 HA CYS A 127 -5.462 -34.664 6.100 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -6.254 -31.728 6.252 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -5.433 -32.665 7.484 1.00 0.00 H new ATOM 0 HG CYS A 127 -4.083 -31.367 4.614 1.00 0.00 H new ATOM 1141 N LYS A 128 -8.385 -33.149 5.742 1.00 0.00 N ATOM 1142 CA LYS A 128 -9.836 -33.189 6.021 1.00 0.00 C ATOM 1143 C LYS A 128 -10.498 -34.456 5.502 1.00 0.00 C ATOM 1144 O LYS A 128 -11.289 -35.094 6.203 1.00 0.00 O ATOM 1145 CB LYS A 128 -10.531 -32.016 5.341 1.00 0.00 C ATOM 1146 CG LYS A 128 -9.945 -30.729 5.879 1.00 0.00 C ATOM 1147 CD LYS A 128 -10.509 -29.584 5.062 1.00 0.00 C ATOM 1148 CE LYS A 128 -9.886 -28.315 5.618 1.00 0.00 C ATOM 1149 NZ LYS A 128 -10.237 -27.284 4.643 1.00 0.00 N ATOM 0 H LYS A 128 -8.115 -32.394 5.112 1.00 0.00 H new ATOM 0 HA LYS A 128 -9.936 -33.149 7.106 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -10.396 -32.071 4.261 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -11.604 -32.051 5.530 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -10.196 -30.606 6.932 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -8.857 -30.747 5.811 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -10.268 -29.705 4.006 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -11.596 -29.550 5.139 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -10.280 -28.078 6.606 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -8.805 -28.414 5.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -9.846 -26.370 4.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -9.844 -27.536 3.714 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -11.272 -27.211 4.572 1.00 0.00 H new ATOM 1154 N GLU A 129 -10.092 -34.831 4.289 1.00 0.00 N ATOM 1155 CA GLU A 129 -10.491 -36.101 3.651 1.00 0.00 C ATOM 1156 C GLU A 129 -10.206 -37.328 4.517 1.00 0.00 C ATOM 1157 O GLU A 129 -11.100 -38.131 4.768 1.00 0.00 O ATOM 1158 CB GLU A 129 -9.827 -36.244 2.292 1.00 0.00 C ATOM 1159 CG GLU A 129 -10.793 -35.670 1.251 1.00 0.00 C ATOM 1160 CD GLU A 129 -10.206 -34.631 0.307 1.00 0.00 C ATOM 1161 OE1 GLU A 129 -9.024 -34.764 -0.106 1.00 0.00 O ATOM 1162 OE2 GLU A 129 -10.988 -33.723 -0.048 1.00 0.00 O ATOM 0 H GLU A 129 -9.472 -34.263 3.711 1.00 0.00 H new ATOM 0 HA GLU A 129 -11.573 -36.057 3.525 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -8.877 -35.710 2.270 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -9.609 -37.291 2.079 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -11.187 -36.493 0.655 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -11.638 -35.222 1.774 1.00 0.00 H new ATOM 1164 N LEU A 130 -8.973 -37.378 5.036 1.00 0.00 N ATOM 1165 CA LEU A 130 -8.545 -38.410 6.001 1.00 0.00 C ATOM 1166 C LEU A 130 -9.385 -38.428 7.281 1.00 0.00 C ATOM 1167 O LEU A 130 -9.783 -39.498 7.732 1.00 0.00 O ATOM 1168 CB LEU A 130 -7.063 -38.253 6.345 1.00 0.00 C ATOM 1169 CG LEU A 130 -6.237 -39.324 5.646 1.00 0.00 C ATOM 1170 CD1 LEU A 130 -6.090 -39.038 4.144 1.00 0.00 C ATOM 1171 CD2 LEU A 130 -4.850 -39.413 6.287 1.00 0.00 C ATOM 0 H LEU A 130 -8.241 -36.707 4.802 1.00 0.00 H new ATOM 0 HA LEU A 130 -8.703 -39.369 5.507 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -6.717 -37.264 6.044 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -6.924 -38.325 7.424 1.00 0.00 H new ATOM 0 HG LEU A 130 -6.761 -40.273 5.760 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -5.494 -39.824 3.680 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -7.076 -39.009 3.681 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -5.595 -38.077 4.003 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -4.264 -40.181 5.782 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -4.344 -38.452 6.195 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -4.952 -39.669 7.341 1.00 0.00 H new ATOM 1173 N GLY A 131 -9.727 -37.237 7.767 1.00 0.00 N ATOM 1174 CA GLY A 131 -10.635 -37.039 8.908 1.00 0.00 C ATOM 1175 C GLY A 131 -12.013 -37.703 8.699 1.00 0.00 C ATOM 1176 O GLY A 131 -12.416 -38.568 9.437 1.00 0.00 O ATOM 0 H GLY A 131 -9.377 -36.362 7.376 1.00 0.00 H new ATOM 0 HA2 GLY A 131 -10.174 -37.445 9.808 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -10.773 -35.971 9.075 1.00 0.00 H new ATOM 1178 N GLU A 132 -12.626 -37.324 7.555 1.00 0.00 N ATOM 1179 CA GLU A 132 -13.905 -37.900 7.090 1.00 0.00 C ATOM 1180 C GLU A 132 -13.848 -39.430 6.957 1.00 0.00 C ATOM 1181 O GLU A 132 -14.657 -40.139 7.549 1.00 0.00 O ATOM 1182 CB GLU A 132 -14.264 -37.284 5.730 1.00 0.00 C ATOM 1183 CG GLU A 132 -14.515 -35.784 5.853 1.00 0.00 C ATOM 1184 CD GLU A 132 -14.638 -35.113 4.482 1.00 0.00 C ATOM 1185 OE1 GLU A 132 -15.764 -35.142 3.930 1.00 0.00 O ATOM 1186 OE2 GLU A 132 -13.604 -34.592 4.010 1.00 0.00 O ATOM 0 H GLU A 132 -12.248 -36.612 6.930 1.00 0.00 H new ATOM 0 HA GLU A 132 -14.664 -37.668 7.837 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -13.455 -37.463 5.022 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -15.152 -37.772 5.330 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -15.428 -35.614 6.424 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.700 -35.324 6.411 1.00 0.00 H new ATOM 1188 N ALA A 133 -12.812 -39.911 6.280 1.00 0.00 N ATOM 1189 CA ALA A 133 -12.524 -41.345 6.102 1.00 0.00 C ATOM 1190 C ALA A 133 -12.336 -42.126 7.413 1.00 0.00 C ATOM 1191 O ALA A 133 -12.918 -43.185 7.586 1.00 0.00 O ATOM 1192 CB ALA A 133 -11.311 -41.504 5.186 1.00 0.00 C ATOM 0 H ALA A 133 -12.127 -39.307 5.825 1.00 0.00 H new ATOM 0 HA ALA A 133 -13.408 -41.788 5.643 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -11.093 -42.563 5.051 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -11.524 -41.051 4.218 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -10.449 -41.011 5.635 1.00 0.00 H new ATOM 1194 N ALA A 134 -11.613 -41.523 8.352 1.00 0.00 N ATOM 1195 CA ALA A 134 -11.412 -42.056 9.717 1.00 0.00 C ATOM 1196 C ALA A 134 -12.697 -42.106 10.550 1.00 0.00 C ATOM 1197 O ALA A 134 -12.953 -43.103 11.221 1.00 0.00 O ATOM 1198 CB ALA A 134 -10.335 -41.220 10.426 1.00 0.00 C ATOM 0 H ALA A 134 -11.138 -40.634 8.194 1.00 0.00 H new ATOM 0 HA ALA A 134 -11.087 -43.092 9.619 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -10.180 -41.606 11.434 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -9.401 -41.280 9.867 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -10.659 -40.181 10.481 1.00 0.00 H new ATOM 1200 N ALA A 135 -13.509 -41.057 10.449 1.00 0.00 N ATOM 1201 CA ALA A 135 -14.873 -41.024 11.017 1.00 0.00 C ATOM 1202 C ALA A 135 -15.760 -42.167 10.502 1.00 0.00 C ATOM 1203 O ALA A 135 -16.467 -42.818 11.269 1.00 0.00 O ATOM 1204 CB ALA A 135 -15.519 -39.674 10.713 1.00 0.00 C ATOM 0 H ALA A 135 -13.247 -40.196 9.970 1.00 0.00 H new ATOM 0 HA ALA A 135 -14.782 -41.162 12.094 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -16.525 -39.649 11.132 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -14.922 -38.877 11.156 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -15.572 -39.531 9.634 1.00 0.00 H new ATOM 1206 N LYS A 136 -15.580 -42.487 9.215 1.00 0.00 N ATOM 1207 CA LYS A 136 -16.269 -43.587 8.547 1.00 0.00 C ATOM 1208 C LYS A 136 -15.475 -44.909 8.441 1.00 0.00 C ATOM 1209 O LYS A 136 -15.741 -45.763 7.660 1.00 0.00 O ATOM 1210 CB LYS A 136 -16.570 -43.140 7.125 1.00 0.00 C ATOM 1211 CG LYS A 136 -17.583 -42.013 7.140 1.00 0.00 C ATOM 1212 CD LYS A 136 -17.719 -41.552 5.710 1.00 0.00 C ATOM 1213 CE LYS A 136 -18.912 -40.617 5.622 1.00 0.00 C ATOM 1214 NZ LYS A 136 -18.384 -39.258 5.599 1.00 0.00 N ATOM 0 H LYS A 136 -14.941 -41.979 8.603 1.00 0.00 H new ATOM 0 HA LYS A 136 -17.147 -43.801 9.156 1.00 0.00 H new ATOM 0 HB2 LYS A 136 -15.653 -42.809 6.637 1.00 0.00 H new ATOM 0 HB3 LYS A 136 -16.955 -43.979 6.545 1.00 0.00 H new ATOM 0 HG2 LYS A 136 -18.541 -42.355 7.532 1.00 0.00 H new ATOM 0 HG3 LYS A 136 -17.249 -41.198 7.782 1.00 0.00 H new ATOM 0 HD2 LYS A 136 -16.812 -41.041 5.388 1.00 0.00 H new ATOM 0 HD3 LYS A 136 -17.856 -42.406 5.047 1.00 0.00 H new ATOM 0 HE2 LYS A 136 -19.496 -40.820 4.724 1.00 0.00 H new ATOM 0 HE3 LYS A 136 -19.577 -40.759 6.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 -19.171 -38.581 5.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 -17.841 -39.082 6.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 -17.763 -39.141 4.773 1.00 0.00 H new ATOM 1219 N ALA A 137 -14.494 -45.016 9.400 1.00 0.00 N ATOM 1220 CA ALA A 137 -13.541 -46.132 9.475 1.00 0.00 C ATOM 1221 C ALA A 137 -12.614 -46.292 8.254 1.00 0.00 C ATOM 1222 O ALA A 137 -13.079 -46.736 7.179 1.00 0.00 O ATOM 1223 CB ALA A 137 -14.230 -47.460 9.845 1.00 0.00 C ATOM 1224 OXT ALA A 137 -11.417 -45.986 8.435 1.00 0.00 O ATOM 0 H ALA A 137 -14.360 -44.320 10.133 1.00 0.00 H new ATOM 0 HA ALA A 137 -12.873 -45.854 10.290 1.00 0.00 H new ATOM 0 HB1 ALA A 137 -13.486 -48.256 9.889 1.00 0.00 H new ATOM 0 HB2 ALA A 137 -14.713 -47.361 10.817 1.00 0.00 H new ATOM 0 HB3 ALA A 137 -14.979 -47.704 9.091 1.00 0.00 H new TER 1226 ALA A 137 HETATM 1227 C9A FNR A 138 13.487 -31.798 6.752 1.00 0.00 C HETATM 1228 N10 FNR A 138 12.490 -31.584 5.746 1.00 0.00 N HETATM 1229 CAA FNR A 138 12.482 -32.382 4.579 1.00 0.00 C HETATM 1230 N1 FNR A 138 11.532 -32.141 3.631 1.00 0.00 N HETATM 1231 C2 FNR A 138 11.448 -32.891 2.541 1.00 0.00 C HETATM 1232 O2 FNR A 138 10.585 -32.633 1.700 1.00 0.00 O HETATM 1233 N3 FNR A 138 12.316 -33.926 2.314 1.00 0.00 N HETATM 1234 C4 FNR A 138 13.323 -34.216 3.259 1.00 0.00 C HETATM 1235 O4 FNR A 138 14.045 -35.170 3.102 1.00 0.00 O HETATM 1236 C4A FNR A 138 13.396 -33.407 4.424 1.00 0.00 C HETATM 1237 N5 FNR A 138 14.388 -33.654 5.405 1.00 0.00 N HETATM 1238 C5A FNR A 138 14.438 -32.831 6.552 1.00 0.00 C HETATM 1239 C6 FNR A 138 15.460 -33.086 7.476 1.00 0.00 C HETATM 1240 C7 FNR A 138 15.525 -32.299 8.636 1.00 0.00 C HETATM 1241 C7M FNR A 138 16.663 -32.638 9.610 1.00 0.00 C HETATM 1242 C8 FNR A 138 14.574 -31.263 8.860 1.00 0.00 C HETATM 1243 C8M FNR A 138 14.590 -30.345 10.097 1.00 0.00 C HETATM 1244 C9 FNR A 138 13.559 -31.012 7.924 1.00 0.00 C HETATM 1245 C1' FNR A 138 11.398 -30.600 5.938 1.00 0.00 C HETATM 1246 C2' FNR A 138 10.232 -31.152 6.761 1.00 0.00 C HETATM 1247 O2' FNR A 138 9.625 -32.278 6.103 1.00 0.00 O HETATM 1248 C3' FNR A 138 9.208 -30.051 7.006 1.00 0.00 C HETATM 1249 O3' FNR A 138 9.861 -28.833 7.421 1.00 0.00 O HETATM 1250 C4' FNR A 138 8.159 -30.482 8.043 1.00 0.00 C HETATM 1251 O4' FNR A 138 7.018 -29.632 7.903 1.00 0.00 O HETATM 1252 C5' FNR A 138 8.675 -30.448 9.484 1.00 0.00 C HETATM 1253 O5' FNR A 138 9.478 -31.597 9.743 1.00 0.00 O HETATM 1254 P FNR A 138 10.033 -31.845 11.213 1.00 0.00 P HETATM 1255 O1P FNR A 138 11.009 -30.591 11.333 1.00 0.00 O HETATM 1256 O2P FNR A 138 10.804 -33.100 11.206 1.00 0.00 O HETATM 1257 O3P FNR A 138 8.915 -31.673 12.183 1.00 0.00 O HETATM 0 H8M3 FNR A 138 14.485 -30.948 10.999 1.00 0.00 H new HETATM 0 H8M2 FNR A 138 15.533 -29.799 10.133 1.00 0.00 H new HETATM 0 H8M1 FNR A 138 13.763 -29.637 10.036 1.00 0.00 H new HETATM 0 H7M3 FNR A 138 16.558 -33.669 9.947 1.00 0.00 H new HETATM 0 H7M2 FNR A 138 17.622 -32.517 9.106 1.00 0.00 H new HETATM 0 H7M1 FNR A 138 16.618 -31.969 10.469 1.00 0.00 H new HETATM 0 H5'2 FNR A 138 9.258 -29.542 9.648 1.00 0.00 H new HETATM 0 H5'1 FNR A 138 7.836 -30.417 10.179 1.00 0.00 H new HETATM 0 H1'2 FNR A 138 11.797 -29.715 6.433 1.00 0.00 H new HETATM 0 H1'1 FNR A 138 11.028 -30.281 4.963 1.00 0.00 H new HETATM 0 HN1 FNR A 138 10.876 -31.371 3.763 1.00 0.00 H new HETATM 0 H9 FNR A 138 12.833 -30.218 8.099 1.00 0.00 H new HETATM 0 H7 FNR A 138 16.188 -33.878 7.298 1.00 0.00 H new HETATM 0 H6 FNR A 138 10.614 -31.498 7.721 1.00 0.00 H new HETATM 0 H5 FNR A 138 15.056 -34.415 5.285 1.00 0.00 H new HETATM 0 H4' FNR A 138 7.311 -28.726 7.671 1.00 0.00 H new HETATM 0 H4 FNR A 138 8.689 -29.864 6.066 1.00 0.00 H new HETATM 0 H3' FNR A 138 9.334 -28.062 7.125 1.00 0.00 H new HETATM 0 H3 FNR A 138 12.235 -34.485 1.465 1.00 0.00 H new HETATM 0 H2' FNR A 138 10.172 -33.077 6.251 1.00 0.00 H new HETATM 0 H2 FNR A 138 7.902 -31.523 7.847 1.00 0.00 H new HETATM 0 H1 FNR A 138 11.443 -30.597 12.212 1.00 0.00 H new CONECT 1227 1228 1238 1244 CONECT 1228 1227 1229 1245 CONECT 1229 1228 1230 1236 CONECT 1230 1229 1231 CONECT 1231 1230 1232 1233 CONECT 1232 1231 CONECT 1233 1231 1234 1258 CONECT 1234 1233 1235 1236 CONECT 1235 1234 CONECT 1236 1229 1234 1237 CONECT 1237 1236 1238 1259 CONECT 1238 1227 1237 1239 CONECT 1239 1238 1240 CONECT 1240 1239 1241 1242 CONECT 1241 1240 CONECT 1242 1240 1243 1244 CONECT 1243 1242 CONECT 1244 1227 1242 CONECT 1245 1228 1246 CONECT 1246 1245 1247 1248 CONECT 1247 1246 1260 CONECT 1248 1246 1249 1250 CONECT 1249 1248 1261 CONECT 1250 1248 1251 1252 CONECT 1251 1250 1262 CONECT 1252 1250 1253 CONECT 1253 1252 1254 CONECT 1254 1253 1255 1256 1257 CONECT 1255 1254 1263 CONECT 1256 1254 CONECT 1257 1254 CONECT 1258 1233 CONECT 1259 1237 CONECT 1260 1247 CONECT 1261 1249 CONECT 1262 1251 CONECT 1263 1255 END