HEADER SIGNALING PROTEIN 10-JAN-02 1J56 TITLE MINIMIZED AVERAGE STRUCTURE OF BERYLLOFLUORIDE-ACTIVATED TITLE 2 NTRC RECEIVER DOMAIN: MODEL STRUCTURE INCORPORATING ACTIVE TITLE 3 SITE CONTACTS COMPND MOL_ID: 1; COMPND 2 MOLECULE: NITROGEN REGULATION PROTEIN NR(I); COMPND 3 CHAIN: A; COMPND 4 FRAGMENT: N-TERMINAL DOMAIN: RECEIVER DOMAIN, RESIDUES 1- COMPND 5 124; COMPND 6 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; SOURCE 3 ORGANISM_TAXID: 602; SOURCE 4 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21; SOURCE 5 EXPRESSION_SYSTEM_TAXID: 511693; SOURCE 6 EXPRESSION_SYSTEM_STRAIN: BL21; SOURCE 7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 8 EXPRESSION_SYSTEM_PLASMID: PET21 KEYWDS TWO COMPONENT SIGNAL TRANSDUCTION, RECEIVER DOMAIN, BEF3, KEYWDS 2 PHOSPHORYLATION, BACTERIAL NITROGEN REGULATORY PROTEIN, KEYWDS 3 SIGNALING PROTEIN EXPDTA SOLUTION NMR MDLTYP MINIMIZED AVERAGE AUTHOR C.A.HASTINGS,S.-Y.LEE,H.S.CHO,D.YAN,S.KUSTU,D.E.WEMMER REVDAT 2 24-FEB-09 1J56 1 VERSN REVDAT 1 19-AUG-03 1J56 0 JRNL AUTH C.A.HASTINGS,S.-Y.LEE,H.S.CHO,D.YAN,S.KUSTU, JRNL AUTH 2 D.E.WEMMER JRNL TITL HIGH-RESOLUTION SOLUTION STRUCTURE OF THE JRNL TITL 2 BERYLLOFLUORIDE-ACTIVATED NTRC RECEIVER DOMAIN JRNL REF BIOCHEMISTRY V. 42 9081 2003 JRNL REFN ISSN 0006-2960 JRNL PMID 12885241 JRNL DOI 10.1021/BI0273866 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH H.S.CHO,S.-Y.LEE,D.YAN,X.PAN,J.S.PARKINSON,S.KUSTU, REMARK 1 AUTH 2 D.E.WEMMER,J.G.PELTON REMARK 1 TITL NMR STRUCTURE OF ACTIVATED CHEY REMARK 1 REF J.MOL.BIOL. V. 297 543 2000 REMARK 1 REFN ISSN 0022-2836 REMARK 1 DOI 10.1006/JMBI.2000.3595 REMARK 1 REFERENCE 2 REMARK 1 AUTH S.-Y.LEE,H.S.CHO,J.G.PELTON,D.YAN,R.K.HENDERSON, REMARK 1 AUTH 2 D.S.KING,L.HUANG,S.KUSTU,E.A.BERRY,D.E.WEMMER REMARK 1 TITL CRYSTAL STRUCTURE OF AN ACTIVATED RESPONSE REMARK 1 TITL 2 REGULATOR BOUND TO ITS TARGET REMARK 1 REF NAT.STRUCT.BIOL. V. 8 52 2001 REMARK 1 REFN ISSN 1072-8368 REMARK 1 DOI 10.1038/NSB0901-789 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : CNS 1.0, MOLMOL REMARK 3 AUTHORS : BRUNGER ET. AL. (CNS 1.0), (MOLMOL) REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: 3 ADDITIONAL CONSTRAINTS FROM REMARK 3 CRYSTAL STRUCTURE OF BEF3-ACTIVATED CHEY WERE USED FOR REMARK 3 STRUCTURE CALCULATION. REMARK 4 REMARK 4 1J56 COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 04-FEB-02. REMARK 100 THE RCSB ID CODE IS RCSB001626. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 303; 303; 303; 303 REMARK 210 PH : 6.75; 6.75; 6.75; 6.75 REMARK 210 IONIC STRENGTH : 50MM NACL, 4.4MM BECL2, 7.2MM REMARK 210 MGCL2, 29MM NAF; 50MM NACL, REMARK 210 4.4MM BECL2, 7.2MM MGCL2, 29MM REMARK 210 NAF; 50MM NACL, 4.4MM BECL2, REMARK 210 7.2MM MGCL2, 29MM NAF; 50MM REMARK 210 NACL, 4.4MM BECL2, 7.2MM REMARK 210 MGCL2, 29MM NAF REMARK 210 PRESSURE : AMBIENT; AMBIENT; AMBIENT; REMARK 210 AMBIENT REMARK 210 SAMPLE CONTENTS : U-15N; 1.1-1.5MM NTRC REMARK 210 RECEIVER DOMAIN(1-124); 50MM REMARK 210 SODIUM PHOSPHATE REMARK 210 BUFFER(PH6.75); 50MM NACL; REMARK 210 4.4MM BECL2, 7.2MM MGCL2, 29MM REMARK 210 NAF; 95% H2O, 5% D2O; U-15N, REMARK 210 13C;1.1-1.5MM NTRC RECEIVER REMARK 210 DOMAIN(1-124); 50MM SODIUM REMARK 210 PHOSPHATE BUFFER(PH6.75); 50MM REMARK 210 NACL; 4.4MM BECL2, 7.2MM REMARK 210 MGCL2, 29MM NAF; 95% H2O, 5% REMARK 210 D2O; 10% 13C;1.1-1.5MM NTRC REMARK 210 RECEIVER DOMAIN(1-124); 50MM REMARK 210 SODIUM PHOSPHATE REMARK 210 BUFFER(PH6.75); 50MM NACL; REMARK 210 4.4MM BECL2, 7.2MM MGCL2, 29MM REMARK 210 NAF; 95% H2O, 5% D2O; U-15N; REMARK 210 1.1-1.5MM NTRC RECEIVER REMARK 210 DOMAIN(1-124); 50MM SODIUM REMARK 210 PHOSPHATE BUFFER(PH6.75); 50MM REMARK 210 NACL; 4.4MM BECL2, 7.2MM REMARK 210 MGCL2, 29MM NAF; 95% H2O, 5% REMARK 210 D2O; 30MG/ML PHAGE PF1 REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_15N-SEPARATED_NOESY, 4D_ REMARK 210 13C/15N-SEPARATED_NOESY, 4D_ REMARK 210 13C-SEPARATED_NOESY, 3D_13C- REMARK 210 SEPARATED_NOESY, HNCA-J, REMARK 210 CBCA(CO)NH, 13C,1H-HSQC, IPAP- REMARK 210 HSQC, HNHA REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ, 500 MHZ REMARK 210 SPECTROMETER MODEL : AMX, DRX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : DYANA 1.5, CNS 1.0, FELIX, REMARK 210 NMRVIEW REMARK 210 METHOD USED : DISTANCE GEOMETRY, TORSION REMARK 210 ANGLE DYNAMICS, SIMULATED REMARK 210 ANNEALING, ENERGY MINIMIZATION REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : NULL REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : NULL REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : NULL REMARK 210 REMARK 210 REMARK: MINIMIZED AVERAGE STRUCTURE OF BERYLLOFLUORIDE- REMARK 210 ACTIVATED NTRC RECEIVER DOMAIN: MODEL STRUCTURE INCORPORATING REMARK 210 ACTIVE 3 SITE CONTACTS. 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: 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 ASP A 10 109.87 -178.29 REMARK 500 ASP A 11 -53.89 68.47 REMARK 500 ASP A 12 -98.34 90.37 REMARK 500 ASN A 35 -35.90 -151.74 REMARK 500 LYS A 46 130.34 173.54 REMARK 500 ASP A 54 -168.14 -68.74 REMARK 500 ILE A 55 51.58 -157.32 REMARK 500 ARG A 56 74.54 -153.39 REMARK 500 MET A 57 -61.56 178.10 REMARK 500 PRO A 58 153.37 -48.79 REMARK 500 MET A 60 55.52 -105.95 REMARK 500 ASP A 61 -74.89 57.71 REMARK 500 PRO A 77 91.53 -67.85 REMARK 500 PHE A 99 -78.96 -64.25 REMARK 500 PHE A 106 -69.48 -143.10 REMARK 500 ASP A 107 -97.03 28.16 REMARK 500 ILE A 108 -56.61 -138.63 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 BEF A 125 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1DC7 RELATED DB: PDB REMARK 900 INACTIVE CONFORMATION OF NTRC RECEIVER DOMAIN REMARK 900 RELATED ID: 1DC8 RELATED DB: PDB REMARK 900 TRANSIENTLY PHOSPHORYLATED FORM OF NTRC RECEIVER DOMAIN REMARK 900 RELATED ID: 1DJM RELATED DB: PDB REMARK 900 SOLUTION STRUCTURE OF ACTIVE CHEY, THE HOMOLOG OF NTRC REMARK 900 RECEIVER DOMAIN REMARK 900 RELATED ID: 1F4V RELATED DB: PDB REMARK 900 CRYSTAL STRUCTURE OF ACTIVE CHEY BOUND TO ITS DOWNSTREAM REMARK 900 TARGET DOMAIN REMARK 900 RELATED ID: 1KRW RELATED DB: PDB REMARK 900 SOLUTION STRUCTURE AND BACKBONE DYNAMICS OF BERYLLOFLUORIDE REMARK 900 -ACTIVATED NTRC RECEIVER DOMAIN REMARK 900 RELATED ID: 1KRX RELATED DB: PDB REMARK 900 SOLUTION STRUCTURE OF BERYLLOFLUORIDE-ACTIVATED NTRC REMARK 900 RECEIVER DOMAIN: MODEL STRUCTURES INCORPORATING ACTIVE SITE REMARK 900 CONTACTS DBREF 1J56 A 1 124 UNP P41789 NTRC_SALTY 1 124 SEQRES 1 A 124 MET GLN ARG GLY ILE VAL TRP VAL VAL ASP ASP ASP SER SEQRES 2 A 124 SER ILE ARG TRP VAL LEU GLU ARG ALA LEU ALA GLY ALA SEQRES 3 A 124 GLY LEU THR CYS THR THR PHE GLU ASN GLY ASN GLU VAL SEQRES 4 A 124 LEU ALA ALA LEU ALA SER LYS THR PRO ASP VAL LEU LEU SEQRES 5 A 124 SER ASP ILE ARG MET PRO GLY MET ASP GLY LEU ALA LEU SEQRES 6 A 124 LEU LYS GLN ILE LYS GLN ARG HIS PRO MET LEU PRO VAL SEQRES 7 A 124 ILE ILE MET THR ALA HIS SER ASP LEU ASP ALA ALA VAL SEQRES 8 A 124 SER ALA TYR GLN GLN GLY ALA PHE ASP TYR LEU PRO LYS SEQRES 9 A 124 PRO PHE ASP ILE ASP GLU ALA VAL ALA LEU VAL GLU ARG SEQRES 10 A 124 ALA ILE SER HIS TYR GLN GLU HET BEF A 125 4 HETNAM BEF BERYLLIUM TRIFLUORIDE ION FORMUL 2 BEF BE F3 1- HELIX 1 1 ASP A 12 GLY A 27 1 16 HELIX 2 2 GLY A 36 LEU A 43 1 8 HELIX 3 3 LEU A 63 HIS A 73 1 11 HELIX 4 4 ASP A 86 GLY A 97 1 12 HELIX 5 5 ILE A 108 HIS A 121 1 14 SHEET 1 A 5 THR A 29 PHE A 33 0 SHEET 2 A 5 ILE A 5 VAL A 9 1 N VAL A 8 O THR A 31 SHEET 3 A 5 VAL A 50 SER A 53 1 O LEU A 52 N TRP A 7 SHEET 4 A 5 VAL A 78 ILE A 80 1 O ILE A 79 N SER A 53 SHEET 5 A 5 ASP A 100 TYR A 101 1 O ASP A 100 N ILE A 80 LINK OD1 ASP A 54 BE BEF A 125 1555 1555 1.61 SITE 1 AC1 6 ASP A 54 ILE A 55 ARG A 56 THR A 82 SITE 2 AC1 6 HIS A 84 LYS A 104 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 ATOM 1 N MET A 1 8.704 -18.235 -1.699 1.00 0.00 N ATOM 2 CA MET A 1 9.865 -17.512 -2.301 1.00 0.00 C ATOM 3 C MET A 1 9.396 -16.626 -3.441 1.00 0.00 C ATOM 4 O MET A 1 8.840 -17.114 -4.420 1.00 0.00 O ATOM 5 CB MET A 1 10.894 -18.544 -2.804 1.00 0.00 C ATOM 6 CG MET A 1 12.325 -18.291 -2.341 1.00 0.00 C ATOM 7 SD MET A 1 13.055 -19.741 -1.555 1.00 0.00 S ATOM 8 CE MET A 1 13.308 -20.791 -2.981 1.00 0.00 C ATOM 9 H1 MET A 1 8.307 -18.866 -2.427 1.00 0.00 H ATOM 10 H2 MET A 1 8.004 -17.518 -1.405 1.00 0.00 H ATOM 11 H3 MET A 1 9.048 -18.776 -0.885 1.00 0.00 H ATOM 12 HA MET A 1 10.322 -16.890 -1.545 1.00 0.00 H ATOM 13 HB2 MET A 1 10.603 -19.518 -2.451 1.00 0.00 H ATOM 14 HB3 MET A 1 10.886 -18.552 -3.887 1.00 0.00 H ATOM 15 HG2 MET A 1 12.930 -18.023 -3.199 1.00 0.00 H ATOM 16 HG3 MET A 1 12.329 -17.477 -1.631 1.00 0.00 H ATOM 17 HE1 MET A 1 12.492 -21.491 -3.064 1.00 0.00 H ATOM 18 HE2 MET A 1 14.234 -21.332 -2.868 1.00 0.00 H ATOM 19 HE3 MET A 1 13.354 -20.183 -3.874 1.00 0.00 H ATOM 20 N GLN A 2 9.598 -15.324 -3.296 1.00 0.00 N ATOM 21 CA GLN A 2 9.177 -14.367 -4.314 1.00 0.00 C ATOM 22 C GLN A 2 10.312 -13.400 -4.664 1.00 0.00 C ATOM 23 O GLN A 2 11.381 -13.439 -4.054 1.00 0.00 O ATOM 24 CB GLN A 2 7.942 -13.611 -3.821 1.00 0.00 C ATOM 25 CG GLN A 2 6.743 -14.522 -3.592 1.00 0.00 C ATOM 26 CD GLN A 2 6.625 -14.970 -2.147 1.00 0.00 C ATOM 27 OE1 GLN A 2 7.115 -16.039 -1.773 1.00 0.00 O ATOM 28 NE2 GLN A 2 5.996 -14.150 -1.325 1.00 0.00 N ATOM 29 H GLN A 2 10.030 -14.990 -2.478 1.00 0.00 H ATOM 30 HA GLN A 2 8.909 -14.925 -5.198 1.00 0.00 H ATOM 31 HB2 GLN A 2 8.180 -13.122 -2.886 1.00 0.00 H ATOM 32 HB3 GLN A 2 7.668 -12.861 -4.550 1.00 0.00 H ATOM 33 HG2 GLN A 2 5.841 -13.990 -3.865 1.00 0.00 H ATOM 34 HG3 GLN A 2 6.848 -15.396 -4.218 1.00 0.00 H ATOM 35 HE21 GLN A 2 5.647 -13.304 -1.692 1.00 0.00 H ATOM 36 HE22 GLN A 2 5.907 -14.412 -0.389 1.00 0.00 H ATOM 37 N ARG A 3 10.080 -12.540 -5.647 1.00 0.00 N ATOM 38 CA ARG A 3 11.098 -11.573 -6.064 1.00 0.00 C ATOM 39 C ARG A 3 10.761 -10.161 -5.579 1.00 0.00 C ATOM 40 O ARG A 3 10.995 -9.187 -6.294 1.00 0.00 O ATOM 41 CB ARG A 3 11.267 -11.585 -7.591 1.00 0.00 C ATOM 42 CG ARG A 3 10.041 -11.083 -8.337 1.00 0.00 C ATOM 43 CD ARG A 3 9.346 -12.204 -9.092 1.00 0.00 C ATOM 44 NE ARG A 3 8.802 -11.730 -10.374 1.00 0.00 N ATOM 45 CZ ARG A 3 8.272 -12.511 -11.307 1.00 0.00 C ATOM 46 NH1 ARG A 3 8.155 -13.806 -11.117 1.00 0.00 N ATOM 47 NH2 ARG A 3 7.851 -11.984 -12.433 1.00 0.00 N ATOM 48 H ARG A 3 9.212 -12.553 -6.099 1.00 0.00 H ATOM 49 HA ARG A 3 12.031 -11.872 -5.612 1.00 0.00 H ATOM 50 HB2 ARG A 3 12.105 -10.951 -7.855 1.00 0.00 H ATOM 51 HB3 ARG A 3 11.477 -12.595 -7.914 1.00 0.00 H ATOM 52 HG2 ARG A 3 9.350 -10.662 -7.622 1.00 0.00 H ATOM 53 HG3 ARG A 3 10.345 -10.316 -9.036 1.00 0.00 H ATOM 54 HD2 ARG A 3 10.065 -12.994 -9.276 1.00 0.00 H ATOM 55 HD3 ARG A 3 8.541 -12.584 -8.478 1.00 0.00 H ATOM 56 HE ARG A 3 8.855 -10.765 -10.551 1.00 0.00 H ATOM 57 HH11 ARG A 3 8.466 -14.217 -10.264 1.00 0.00 H ATOM 58 HH12 ARG A 3 7.758 -14.383 -11.830 1.00 0.00 H ATOM 59 HH21 ARG A 3 7.930 -11.002 -12.585 1.00 0.00 H ATOM 60 HH22 ARG A 3 7.461 -12.567 -13.141 1.00 0.00 H ATOM 61 N GLY A 4 10.218 -10.067 -4.360 1.00 0.00 N ATOM 62 CA GLY A 4 9.859 -8.777 -3.769 1.00 0.00 C ATOM 63 C GLY A 4 9.121 -7.843 -4.711 1.00 0.00 C ATOM 64 O GLY A 4 9.733 -7.176 -5.539 1.00 0.00 O ATOM 65 H GLY A 4 10.067 -10.886 -3.845 1.00 0.00 H ATOM 66 HA2 GLY A 4 9.231 -8.956 -2.909 1.00 0.00 H ATOM 67 HA3 GLY A 4 10.762 -8.284 -3.437 1.00 0.00 H ATOM 68 N ILE A 5 7.809 -7.773 -4.581 1.00 0.00 N ATOM 69 CA ILE A 5 7.017 -6.891 -5.428 1.00 0.00 C ATOM 70 C ILE A 5 6.223 -5.891 -4.582 1.00 0.00 C ATOM 71 O ILE A 5 5.186 -6.232 -4.017 1.00 0.00 O ATOM 72 CB ILE A 5 6.052 -7.686 -6.331 1.00 0.00 C ATOM 73 CG1 ILE A 5 6.822 -8.716 -7.168 1.00 0.00 C ATOM 74 CG2 ILE A 5 5.278 -6.729 -7.222 1.00 0.00 C ATOM 75 CD1 ILE A 5 6.473 -10.151 -6.829 1.00 0.00 C ATOM 76 H ILE A 5 7.359 -8.321 -3.898 1.00 0.00 H ATOM 77 HA ILE A 5 7.700 -6.344 -6.063 1.00 0.00 H ATOM 78 HB ILE A 5 5.346 -8.203 -5.697 1.00 0.00 H ATOM 79 HG12 ILE A 5 6.607 -8.559 -8.213 1.00 0.00 H ATOM 80 HG13 ILE A 5 7.883 -8.586 -7.000 1.00 0.00 H ATOM 81 HG21 ILE A 5 5.877 -5.848 -7.409 1.00 0.00 H ATOM 82 HG22 ILE A 5 4.366 -6.442 -6.724 1.00 0.00 H ATOM 83 HG23 ILE A 5 5.042 -7.212 -8.154 1.00 0.00 H ATOM 84 HD11 ILE A 5 7.145 -10.513 -6.064 1.00 0.00 H ATOM 85 HD12 ILE A 5 6.566 -10.766 -7.711 1.00 0.00 H ATOM 86 HD13 ILE A 5 5.458 -10.198 -6.463 1.00 0.00 H ATOM 87 N VAL A 6 6.715 -4.655 -4.495 1.00 0.00 N ATOM 88 CA VAL A 6 6.037 -3.612 -3.710 1.00 0.00 C ATOM 89 C VAL A 6 5.340 -2.590 -4.615 1.00 0.00 C ATOM 90 O VAL A 6 5.953 -2.026 -5.524 1.00 0.00 O ATOM 91 CB VAL A 6 7.019 -2.870 -2.765 1.00 0.00 C ATOM 92 CG1 VAL A 6 8.222 -2.354 -3.536 1.00 0.00 C ATOM 93 CG2 VAL A 6 6.323 -1.722 -2.037 1.00 0.00 C ATOM 94 H VAL A 6 7.548 -4.435 -4.968 1.00 0.00 H ATOM 95 HA VAL A 6 5.290 -4.099 -3.100 1.00 0.00 H ATOM 96 HB VAL A 6 7.372 -3.574 -2.024 1.00 0.00 H ATOM 97 HG11 VAL A 6 8.276 -1.280 -3.440 1.00 0.00 H ATOM 98 HG12 VAL A 6 8.121 -2.616 -4.578 1.00 0.00 H ATOM 99 HG13 VAL A 6 9.120 -2.798 -3.138 1.00 0.00 H ATOM 100 HG21 VAL A 6 6.181 -0.895 -2.717 1.00 0.00 H ATOM 101 HG22 VAL A 6 6.935 -1.400 -1.206 1.00 0.00 H ATOM 102 HG23 VAL A 6 5.364 -2.054 -1.668 1.00 0.00 H ATOM 103 N TRP A 7 4.057 -2.350 -4.359 1.00 0.00 N ATOM 104 CA TRP A 7 3.282 -1.387 -5.147 1.00 0.00 C ATOM 105 C TRP A 7 2.838 -0.209 -4.268 1.00 0.00 C ATOM 106 O TRP A 7 2.279 -0.409 -3.193 1.00 0.00 O ATOM 107 CB TRP A 7 2.073 -2.088 -5.788 1.00 0.00 C ATOM 108 CG TRP A 7 2.427 -2.923 -6.990 1.00 0.00 C ATOM 109 CD1 TRP A 7 3.683 -3.219 -7.439 1.00 0.00 C ATOM 110 CD2 TRP A 7 1.518 -3.574 -7.893 1.00 0.00 C ATOM 111 NE1 TRP A 7 3.612 -3.999 -8.568 1.00 0.00 N ATOM 112 CE2 TRP A 7 2.295 -4.231 -8.868 1.00 0.00 C ATOM 113 CE3 TRP A 7 0.123 -3.658 -7.979 1.00 0.00 C ATOM 114 CZ2 TRP A 7 1.723 -4.968 -9.905 1.00 0.00 C ATOM 115 CZ3 TRP A 7 -0.441 -4.389 -9.009 1.00 0.00 C ATOM 116 CH2 TRP A 7 0.357 -5.032 -9.962 1.00 0.00 C ATOM 117 H TRP A 7 3.620 -2.828 -3.617 1.00 0.00 H ATOM 118 HA TRP A 7 3.924 -1.009 -5.930 1.00 0.00 H ATOM 119 HB2 TRP A 7 1.615 -2.738 -5.057 1.00 0.00 H ATOM 120 HB3 TRP A 7 1.356 -1.342 -6.098 1.00 0.00 H ATOM 121 HD1 TRP A 7 4.592 -2.874 -6.967 1.00 0.00 H ATOM 122 HE1 TRP A 7 4.380 -4.332 -9.072 1.00 0.00 H ATOM 123 HE3 TRP A 7 -0.510 -3.167 -7.254 1.00 0.00 H ATOM 124 HZ2 TRP A 7 2.322 -5.468 -10.648 1.00 0.00 H ATOM 125 HZ3 TRP A 7 -1.515 -4.465 -9.090 1.00 0.00 H ATOM 126 HH2 TRP A 7 -0.129 -5.591 -10.749 1.00 0.00 H ATOM 127 N VAL A 8 3.117 1.016 -4.714 1.00 0.00 N ATOM 128 CA VAL A 8 2.767 2.222 -3.944 1.00 0.00 C ATOM 129 C VAL A 8 1.841 3.156 -4.732 1.00 0.00 C ATOM 130 O VAL A 8 1.788 3.101 -5.960 1.00 0.00 O ATOM 131 CB VAL A 8 4.040 3.007 -3.535 1.00 0.00 C ATOM 132 CG1 VAL A 8 3.813 3.812 -2.264 1.00 0.00 C ATOM 133 CG2 VAL A 8 5.218 2.065 -3.351 1.00 0.00 C ATOM 134 H VAL A 8 3.585 1.117 -5.574 1.00 0.00 H ATOM 135 HA VAL A 8 2.259 1.910 -3.044 1.00 0.00 H ATOM 136 HB VAL A 8 4.283 3.698 -4.329 1.00 0.00 H ATOM 137 HG11 VAL A 8 2.794 4.163 -2.231 1.00 0.00 H ATOM 138 HG12 VAL A 8 4.482 4.660 -2.252 1.00 0.00 H ATOM 139 HG13 VAL A 8 4.009 3.190 -1.403 1.00 0.00 H ATOM 140 HG21 VAL A 8 5.653 1.840 -4.313 1.00 0.00 H ATOM 141 HG22 VAL A 8 4.878 1.152 -2.887 1.00 0.00 H ATOM 142 HG23 VAL A 8 5.958 2.532 -2.722 1.00 0.00 H ATOM 143 N VAL A 9 1.117 4.015 -4.018 1.00 0.00 N ATOM 144 CA VAL A 9 0.204 4.966 -4.653 1.00 0.00 C ATOM 145 C VAL A 9 0.093 6.251 -3.838 1.00 0.00 C ATOM 146 O VAL A 9 -0.583 6.295 -2.810 1.00 0.00 O ATOM 147 CB VAL A 9 -1.209 4.385 -4.876 1.00 0.00 C ATOM 148 CG1 VAL A 9 -1.647 4.628 -6.303 1.00 0.00 C ATOM 149 CG2 VAL A 9 -1.270 2.902 -4.561 1.00 0.00 C ATOM 150 H VAL A 9 1.198 4.014 -3.043 1.00 0.00 H ATOM 151 HA VAL A 9 0.618 5.216 -5.620 1.00 0.00 H ATOM 152 HB VAL A 9 -1.893 4.901 -4.219 1.00 0.00 H ATOM 153 HG11 VAL A 9 -2.558 4.086 -6.498 1.00 0.00 H ATOM 154 HG12 VAL A 9 -0.875 4.292 -6.977 1.00 0.00 H ATOM 155 HG13 VAL A 9 -1.815 5.684 -6.450 1.00 0.00 H ATOM 156 HG21 VAL A 9 -2.166 2.479 -4.989 1.00 0.00 H ATOM 157 HG22 VAL A 9 -1.290 2.765 -3.494 1.00 0.00 H ATOM 158 HG23 VAL A 9 -0.405 2.406 -4.974 1.00 0.00 H ATOM 159 N ASP A 10 0.777 7.279 -4.322 1.00 0.00 N ATOM 160 CA ASP A 10 0.811 8.594 -3.689 1.00 0.00 C ATOM 161 C ASP A 10 1.660 9.526 -4.549 1.00 0.00 C ATOM 162 O ASP A 10 2.878 9.338 -4.651 1.00 0.00 O ATOM 163 CB ASP A 10 1.391 8.478 -2.274 1.00 0.00 C ATOM 164 CG ASP A 10 1.479 9.796 -1.531 1.00 0.00 C ATOM 165 OD1 ASP A 10 1.179 10.852 -2.119 1.00 0.00 O ATOM 166 OD2 ASP A 10 1.850 9.765 -0.339 1.00 0.00 O ATOM 167 H ASP A 10 1.292 7.148 -5.143 1.00 0.00 H ATOM 168 HA ASP A 10 -0.200 8.976 -3.638 1.00 0.00 H ATOM 169 HB2 ASP A 10 0.765 7.817 -1.698 1.00 0.00 H ATOM 170 HB3 ASP A 10 2.384 8.058 -2.336 1.00 0.00 H ATOM 171 N ASP A 11 1.015 10.495 -5.201 1.00 0.00 N ATOM 172 CA ASP A 11 1.711 11.437 -6.093 1.00 0.00 C ATOM 173 C ASP A 11 2.234 10.733 -7.360 1.00 0.00 C ATOM 174 O ASP A 11 1.955 11.167 -8.479 1.00 0.00 O ATOM 175 CB ASP A 11 2.877 12.112 -5.355 1.00 0.00 C ATOM 176 CG ASP A 11 3.655 13.060 -6.245 1.00 0.00 C ATOM 177 OD1 ASP A 11 4.599 12.594 -6.919 1.00 0.00 O ATOM 178 OD2 ASP A 11 3.324 14.264 -6.272 1.00 0.00 O ATOM 179 H ASP A 11 0.043 10.566 -5.100 1.00 0.00 H ATOM 180 HA ASP A 11 0.999 12.193 -6.388 1.00 0.00 H ATOM 181 HB2 ASP A 11 2.493 12.666 -4.514 1.00 0.00 H ATOM 182 HB3 ASP A 11 3.553 11.351 -4.999 1.00 0.00 H ATOM 183 N ASP A 12 3.006 9.659 -7.147 1.00 0.00 N ATOM 184 CA ASP A 12 3.619 8.852 -8.206 1.00 0.00 C ATOM 185 C ASP A 12 5.012 9.376 -8.572 1.00 0.00 C ATOM 186 O ASP A 12 5.986 9.051 -7.902 1.00 0.00 O ATOM 187 CB ASP A 12 2.724 8.738 -9.457 1.00 0.00 C ATOM 188 CG ASP A 12 3.413 8.015 -10.599 1.00 0.00 C ATOM 189 OD1 ASP A 12 3.657 6.800 -10.472 1.00 0.00 O ATOM 190 OD2 ASP A 12 3.732 8.670 -11.612 1.00 0.00 O ATOM 191 H ASP A 12 3.185 9.404 -6.219 1.00 0.00 H ATOM 192 HA ASP A 12 3.748 7.859 -7.796 1.00 0.00 H ATOM 193 HB2 ASP A 12 1.828 8.192 -9.204 1.00 0.00 H ATOM 194 HB3 ASP A 12 2.456 9.726 -9.795 1.00 0.00 H ATOM 195 N SER A 13 5.104 10.160 -9.644 1.00 0.00 N ATOM 196 CA SER A 13 6.384 10.696 -10.126 1.00 0.00 C ATOM 197 C SER A 13 7.370 11.039 -9.003 1.00 0.00 C ATOM 198 O SER A 13 8.527 10.615 -9.048 1.00 0.00 O ATOM 199 CB SER A 13 6.150 11.916 -11.016 1.00 0.00 C ATOM 200 OG SER A 13 7.232 12.092 -11.921 1.00 0.00 O ATOM 201 H SER A 13 4.286 10.368 -10.145 1.00 0.00 H ATOM 202 HA SER A 13 6.835 9.926 -10.732 1.00 0.00 H ATOM 203 HB2 SER A 13 5.240 11.772 -11.583 1.00 0.00 H ATOM 204 HB3 SER A 13 6.058 12.798 -10.400 1.00 0.00 H ATOM 205 HG SER A 13 7.133 12.925 -12.384 1.00 0.00 H ATOM 206 N SER A 14 6.929 11.798 -8.002 1.00 0.00 N ATOM 207 CA SER A 14 7.812 12.176 -6.893 1.00 0.00 C ATOM 208 C SER A 14 8.054 11.012 -5.924 1.00 0.00 C ATOM 209 O SER A 14 9.193 10.572 -5.754 1.00 0.00 O ATOM 210 CB SER A 14 7.257 13.387 -6.137 1.00 0.00 C ATOM 211 OG SER A 14 8.298 14.299 -5.810 1.00 0.00 O ATOM 212 H SER A 14 5.993 12.114 -8.005 1.00 0.00 H ATOM 213 HA SER A 14 8.763 12.452 -7.324 1.00 0.00 H ATOM 214 HB2 SER A 14 6.528 13.895 -6.753 1.00 0.00 H ATOM 215 HB3 SER A 14 6.782 13.055 -5.225 1.00 0.00 H ATOM 216 HG SER A 14 9.012 13.831 -5.366 1.00 0.00 H ATOM 217 N ILE A 15 6.989 10.515 -5.287 1.00 0.00 N ATOM 218 CA ILE A 15 7.109 9.397 -4.332 1.00 0.00 C ATOM 219 C ILE A 15 7.753 8.165 -4.981 1.00 0.00 C ATOM 220 O ILE A 15 8.579 7.482 -4.370 1.00 0.00 O ATOM 221 CB ILE A 15 5.729 8.994 -3.754 1.00 0.00 C ATOM 222 CG1 ILE A 15 5.101 10.159 -2.983 1.00 0.00 C ATOM 223 CG2 ILE A 15 5.849 7.771 -2.852 1.00 0.00 C ATOM 224 CD1 ILE A 15 5.803 10.488 -1.683 1.00 0.00 C ATOM 225 H ILE A 15 6.102 10.904 -5.461 1.00 0.00 H ATOM 226 HA ILE A 15 7.735 9.725 -3.517 1.00 0.00 H ATOM 227 HB ILE A 15 5.083 8.735 -4.581 1.00 0.00 H ATOM 228 HG12 ILE A 15 5.118 11.043 -3.602 1.00 0.00 H ATOM 229 HG13 ILE A 15 4.073 9.912 -2.752 1.00 0.00 H ATOM 230 HG21 ILE A 15 6.351 8.047 -1.936 1.00 0.00 H ATOM 231 HG22 ILE A 15 6.415 7.002 -3.356 1.00 0.00 H ATOM 232 HG23 ILE A 15 4.862 7.399 -2.622 1.00 0.00 H ATOM 233 HD11 ILE A 15 5.886 11.559 -1.583 1.00 0.00 H ATOM 234 HD12 ILE A 15 6.787 10.047 -1.683 1.00 0.00 H ATOM 235 HD13 ILE A 15 5.230 10.093 -0.858 1.00 0.00 H ATOM 236 N ARG A 16 7.357 7.890 -6.221 1.00 0.00 N ATOM 237 CA ARG A 16 7.863 6.749 -6.982 1.00 0.00 C ATOM 238 C ARG A 16 9.381 6.791 -7.146 1.00 0.00 C ATOM 239 O ARG A 16 10.074 5.929 -6.625 1.00 0.00 O ATOM 240 CB ARG A 16 7.185 6.713 -8.350 1.00 0.00 C ATOM 241 CG ARG A 16 7.654 5.591 -9.253 1.00 0.00 C ATOM 242 CD ARG A 16 7.252 5.863 -10.687 1.00 0.00 C ATOM 243 NE ARG A 16 8.219 5.300 -11.625 1.00 0.00 N ATOM 244 CZ ARG A 16 7.946 4.958 -12.866 1.00 0.00 C ATOM 245 NH1 ARG A 16 6.719 5.055 -13.332 1.00 0.00 N ATOM 246 NH2 ARG A 16 8.908 4.499 -13.630 1.00 0.00 N ATOM 247 H ARG A 16 6.690 8.478 -6.645 1.00 0.00 H ATOM 248 HA ARG A 16 7.602 5.852 -6.443 1.00 0.00 H ATOM 249 HB2 ARG A 16 6.120 6.606 -8.207 1.00 0.00 H ATOM 250 HB3 ARG A 16 7.373 7.650 -8.853 1.00 0.00 H ATOM 251 HG2 ARG A 16 8.730 5.513 -9.197 1.00 0.00 H ATOM 252 HG3 ARG A 16 7.202 4.663 -8.931 1.00 0.00 H ATOM 253 HD2 ARG A 16 6.279 5.425 -10.863 1.00 0.00 H ATOM 254 HD3 ARG A 16 7.197 6.935 -10.833 1.00 0.00 H ATOM 255 HE ARG A 16 9.146 5.175 -11.297 1.00 0.00 H ATOM 256 HH11 ARG A 16 5.986 5.393 -12.741 1.00 0.00 H ATOM 257 HH12 ARG A 16 6.518 4.792 -14.268 1.00 0.00 H ATOM 258 HH21 ARG A 16 9.836 4.415 -13.259 1.00 0.00 H ATOM 259 HH22 ARG A 16 8.721 4.238 -14.570 1.00 0.00 H ATOM 260 N TRP A 17 9.894 7.785 -7.875 1.00 0.00 N ATOM 261 CA TRP A 17 11.342 7.911 -8.105 1.00 0.00 C ATOM 262 C TRP A 17 12.151 7.594 -6.840 1.00 0.00 C ATOM 263 O TRP A 17 13.110 6.820 -6.884 1.00 0.00 O ATOM 264 CB TRP A 17 11.684 9.317 -8.603 1.00 0.00 C ATOM 265 CG TRP A 17 13.132 9.483 -8.964 1.00 0.00 C ATOM 266 CD1 TRP A 17 13.720 9.167 -10.154 1.00 0.00 C ATOM 267 CD2 TRP A 17 14.174 9.996 -8.123 1.00 0.00 C ATOM 268 NE1 TRP A 17 15.064 9.462 -10.108 1.00 0.00 N ATOM 269 CE2 TRP A 17 15.365 9.972 -8.873 1.00 0.00 C ATOM 270 CE3 TRP A 17 14.213 10.480 -6.812 1.00 0.00 C ATOM 271 CZ2 TRP A 17 16.580 10.408 -8.353 1.00 0.00 C ATOM 272 CZ3 TRP A 17 15.421 10.913 -6.296 1.00 0.00 C ATOM 273 CH2 TRP A 17 16.591 10.877 -7.066 1.00 0.00 C ATOM 274 H TRP A 17 9.288 8.446 -8.275 1.00 0.00 H ATOM 275 HA TRP A 17 11.615 7.197 -8.868 1.00 0.00 H ATOM 276 HB2 TRP A 17 11.094 9.534 -9.481 1.00 0.00 H ATOM 277 HB3 TRP A 17 11.446 10.035 -7.831 1.00 0.00 H ATOM 278 HD1 TRP A 17 13.193 8.748 -11.000 1.00 0.00 H ATOM 279 HE1 TRP A 17 15.699 9.331 -10.839 1.00 0.00 H ATOM 280 HE3 TRP A 17 13.322 10.515 -6.203 1.00 0.00 H ATOM 281 HZ2 TRP A 17 17.489 10.388 -8.935 1.00 0.00 H ATOM 282 HZ3 TRP A 17 15.471 11.288 -5.284 1.00 0.00 H ATOM 283 HH2 TRP A 17 17.512 11.225 -6.623 1.00 0.00 H ATOM 284 N VAL A 18 11.756 8.185 -5.715 1.00 0.00 N ATOM 285 CA VAL A 18 12.447 7.949 -4.444 1.00 0.00 C ATOM 286 C VAL A 18 12.286 6.491 -3.995 1.00 0.00 C ATOM 287 O VAL A 18 13.260 5.834 -3.618 1.00 0.00 O ATOM 288 CB VAL A 18 11.937 8.883 -3.313 1.00 0.00 C ATOM 289 CG1 VAL A 18 13.011 9.085 -2.259 1.00 0.00 C ATOM 290 CG2 VAL A 18 11.485 10.232 -3.855 1.00 0.00 C ATOM 291 H VAL A 18 10.979 8.785 -5.738 1.00 0.00 H ATOM 292 HA VAL A 18 13.498 8.148 -4.598 1.00 0.00 H ATOM 293 HB VAL A 18 11.088 8.408 -2.841 1.00 0.00 H ATOM 294 HG11 VAL A 18 12.564 9.037 -1.277 1.00 0.00 H ATOM 295 HG12 VAL A 18 13.473 10.051 -2.394 1.00 0.00 H ATOM 296 HG13 VAL A 18 13.760 8.312 -2.352 1.00 0.00 H ATOM 297 HG21 VAL A 18 10.412 10.226 -3.982 1.00 0.00 H ATOM 298 HG22 VAL A 18 11.958 10.420 -4.806 1.00 0.00 H ATOM 299 HG23 VAL A 18 11.758 11.010 -3.158 1.00 0.00 H ATOM 300 N LEU A 19 11.048 5.995 -4.032 1.00 0.00 N ATOM 301 CA LEU A 19 10.742 4.623 -3.621 1.00 0.00 C ATOM 302 C LEU A 19 11.245 3.579 -4.628 1.00 0.00 C ATOM 303 O LEU A 19 11.883 2.600 -4.240 1.00 0.00 O ATOM 304 CB LEU A 19 9.232 4.471 -3.412 1.00 0.00 C ATOM 305 CG LEU A 19 8.808 3.605 -2.219 1.00 0.00 C ATOM 306 CD1 LEU A 19 9.787 3.734 -1.060 1.00 0.00 C ATOM 307 CD2 LEU A 19 7.415 3.999 -1.768 1.00 0.00 C ATOM 308 H LEU A 19 10.315 6.574 -4.341 1.00 0.00 H ATOM 309 HA LEU A 19 11.238 4.449 -2.680 1.00 0.00 H ATOM 310 HB2 LEU A 19 8.812 5.458 -3.277 1.00 0.00 H ATOM 311 HB3 LEU A 19 8.809 4.042 -4.309 1.00 0.00 H ATOM 312 HG LEU A 19 8.781 2.568 -2.523 1.00 0.00 H ATOM 313 HD11 LEU A 19 10.751 3.348 -1.353 1.00 0.00 H ATOM 314 HD12 LEU A 19 9.419 3.173 -0.213 1.00 0.00 H ATOM 315 HD13 LEU A 19 9.883 4.774 -0.785 1.00 0.00 H ATOM 316 HD21 LEU A 19 7.490 4.773 -1.020 1.00 0.00 H ATOM 317 HD22 LEU A 19 6.916 3.140 -1.348 1.00 0.00 H ATOM 318 HD23 LEU A 19 6.854 4.368 -2.613 1.00 0.00 H ATOM 319 N GLU A 20 10.961 3.790 -5.913 1.00 0.00 N ATOM 320 CA GLU A 20 11.392 2.868 -6.968 1.00 0.00 C ATOM 321 C GLU A 20 12.908 2.663 -6.919 1.00 0.00 C ATOM 322 O GLU A 20 13.403 1.552 -7.107 1.00 0.00 O ATOM 323 CB GLU A 20 10.956 3.389 -8.353 1.00 0.00 C ATOM 324 CG GLU A 20 11.944 4.364 -9.001 1.00 0.00 C ATOM 325 CD GLU A 20 11.645 4.675 -10.461 1.00 0.00 C ATOM 326 OE1 GLU A 20 10.539 4.349 -10.941 1.00 0.00 O ATOM 327 OE2 GLU A 20 12.526 5.253 -11.129 1.00 0.00 O ATOM 328 H GLU A 20 10.453 4.597 -6.162 1.00 0.00 H ATOM 329 HA GLU A 20 10.914 1.919 -6.787 1.00 0.00 H ATOM 330 HB2 GLU A 20 10.828 2.547 -9.016 1.00 0.00 H ATOM 331 HB3 GLU A 20 10.005 3.895 -8.248 1.00 0.00 H ATOM 332 HG2 GLU A 20 11.924 5.291 -8.452 1.00 0.00 H ATOM 333 HG3 GLU A 20 12.934 3.939 -8.943 1.00 0.00 H ATOM 334 N ARG A 21 13.635 3.748 -6.658 1.00 0.00 N ATOM 335 CA ARG A 21 15.090 3.698 -6.579 1.00 0.00 C ATOM 336 C ARG A 21 15.570 3.092 -5.256 1.00 0.00 C ATOM 337 O ARG A 21 16.429 2.208 -5.251 1.00 0.00 O ATOM 338 CB ARG A 21 15.672 5.103 -6.771 1.00 0.00 C ATOM 339 CG ARG A 21 15.614 5.588 -8.209 1.00 0.00 C ATOM 340 CD ARG A 21 16.352 4.644 -9.137 1.00 0.00 C ATOM 341 NE ARG A 21 17.072 5.371 -10.186 1.00 0.00 N ATOM 342 CZ ARG A 21 18.077 4.873 -10.883 1.00 0.00 C ATOM 343 NH1 ARG A 21 18.494 3.646 -10.671 1.00 0.00 N ATOM 344 NH2 ARG A 21 18.658 5.609 -11.801 1.00 0.00 N ATOM 345 H ARG A 21 13.178 4.606 -6.516 1.00 0.00 H ATOM 346 HA ARG A 21 15.435 3.067 -7.385 1.00 0.00 H ATOM 347 HB2 ARG A 21 15.118 5.799 -6.158 1.00 0.00 H ATOM 348 HB3 ARG A 21 16.706 5.103 -6.455 1.00 0.00 H ATOM 349 HG2 ARG A 21 14.579 5.645 -8.520 1.00 0.00 H ATOM 350 HG3 ARG A 21 16.064 6.570 -8.270 1.00 0.00 H ATOM 351 HD2 ARG A 21 17.056 4.068 -8.552 1.00 0.00 H ATOM 352 HD3 ARG A 21 15.632 3.978 -9.596 1.00 0.00 H ATOM 353 HE ARG A 21 16.780 6.286 -10.374 1.00 0.00 H ATOM 354 HH11 ARG A 21 18.049 3.082 -9.978 1.00 0.00 H ATOM 355 HH12 ARG A 21 19.252 3.278 -11.198 1.00 0.00 H ATOM 356 HH21 ARG A 21 18.340 6.540 -11.968 1.00 0.00 H ATOM 357 HH22 ARG A 21 19.417 5.242 -12.331 1.00 0.00 H ATOM 358 N ALA A 22 15.025 3.569 -4.138 1.00 0.00 N ATOM 359 CA ALA A 22 15.418 3.070 -2.817 1.00 0.00 C ATOM 360 C ALA A 22 15.006 1.611 -2.596 1.00 0.00 C ATOM 361 O ALA A 22 15.842 0.769 -2.266 1.00 0.00 O ATOM 362 CB ALA A 22 14.838 3.959 -1.725 1.00 0.00 C ATOM 363 H ALA A 22 14.347 4.280 -4.200 1.00 0.00 H ATOM 364 HA ALA A 22 16.494 3.131 -2.753 1.00 0.00 H ATOM 365 HB1 ALA A 22 15.407 4.875 -1.666 1.00 0.00 H ATOM 366 HB2 ALA A 22 14.887 3.444 -0.777 1.00 0.00 H ATOM 367 HB3 ALA A 22 13.808 4.189 -1.956 1.00 0.00 H ATOM 368 N LEU A 23 13.720 1.319 -2.773 1.00 0.00 N ATOM 369 CA LEU A 23 13.203 -0.038 -2.583 1.00 0.00 C ATOM 370 C LEU A 23 13.931 -1.058 -3.468 1.00 0.00 C ATOM 371 O LEU A 23 14.256 -2.159 -3.017 1.00 0.00 O ATOM 372 CB LEU A 23 11.695 -0.072 -2.852 1.00 0.00 C ATOM 373 CG LEU A 23 10.890 -0.960 -1.903 1.00 0.00 C ATOM 374 CD1 LEU A 23 11.368 -2.397 -1.994 1.00 0.00 C ATOM 375 CD2 LEU A 23 11.001 -0.456 -0.472 1.00 0.00 C ATOM 376 H LEU A 23 13.099 2.034 -3.035 1.00 0.00 H ATOM 377 HA LEU A 23 13.372 -0.307 -1.550 1.00 0.00 H ATOM 378 HB2 LEU A 23 11.318 0.938 -2.777 1.00 0.00 H ATOM 379 HB3 LEU A 23 11.535 -0.423 -3.860 1.00 0.00 H ATOM 380 HG LEU A 23 9.848 -0.932 -2.190 1.00 0.00 H ATOM 381 HD11 LEU A 23 12.283 -2.509 -1.430 1.00 0.00 H ATOM 382 HD12 LEU A 23 11.553 -2.645 -3.027 1.00 0.00 H ATOM 383 HD13 LEU A 23 10.614 -3.056 -1.593 1.00 0.00 H ATOM 384 HD21 LEU A 23 11.099 -1.295 0.201 1.00 0.00 H ATOM 385 HD22 LEU A 23 10.115 0.108 -0.215 1.00 0.00 H ATOM 386 HD23 LEU A 23 11.868 0.176 -0.381 1.00 0.00 H ATOM 387 N ALA A 24 14.194 -0.691 -4.721 1.00 0.00 N ATOM 388 CA ALA A 24 14.892 -1.582 -5.652 1.00 0.00 C ATOM 389 C ALA A 24 16.251 -2.034 -5.095 1.00 0.00 C ATOM 390 O ALA A 24 16.678 -3.164 -5.337 1.00 0.00 O ATOM 391 CB ALA A 24 15.063 -0.901 -7.003 1.00 0.00 C ATOM 392 H ALA A 24 13.920 0.201 -5.027 1.00 0.00 H ATOM 393 HA ALA A 24 14.273 -2.457 -5.795 1.00 0.00 H ATOM 394 HB1 ALA A 24 15.836 -1.404 -7.565 1.00 0.00 H ATOM 395 HB2 ALA A 24 15.341 0.132 -6.854 1.00 0.00 H ATOM 396 HB3 ALA A 24 14.132 -0.946 -7.550 1.00 0.00 H ATOM 397 N GLY A 25 16.916 -1.154 -4.338 1.00 0.00 N ATOM 398 CA GLY A 25 18.211 -1.491 -3.751 1.00 0.00 C ATOM 399 C GLY A 25 18.147 -2.702 -2.835 1.00 0.00 C ATOM 400 O GLY A 25 19.069 -3.516 -2.812 1.00 0.00 O ATOM 401 H GLY A 25 16.522 -0.271 -4.170 1.00 0.00 H ATOM 402 HA2 GLY A 25 18.911 -1.698 -4.546 1.00 0.00 H ATOM 403 HA3 GLY A 25 18.568 -0.646 -3.183 1.00 0.00 H ATOM 404 N ALA A 26 17.052 -2.822 -2.084 1.00 0.00 N ATOM 405 CA ALA A 26 16.861 -3.946 -1.163 1.00 0.00 C ATOM 406 C ALA A 26 16.618 -5.265 -1.914 1.00 0.00 C ATOM 407 O ALA A 26 16.789 -6.347 -1.350 1.00 0.00 O ATOM 408 CB ALA A 26 15.706 -3.647 -0.214 1.00 0.00 C ATOM 409 H ALA A 26 16.351 -2.141 -2.153 1.00 0.00 H ATOM 410 HA ALA A 26 17.760 -4.048 -0.573 1.00 0.00 H ATOM 411 HB1 ALA A 26 16.032 -2.944 0.539 1.00 0.00 H ATOM 412 HB2 ALA A 26 15.387 -4.562 0.265 1.00 0.00 H ATOM 413 HB3 ALA A 26 14.882 -3.226 -0.769 1.00 0.00 H ATOM 414 N GLY A 27 16.227 -5.167 -3.188 1.00 0.00 N ATOM 415 CA GLY A 27 15.975 -6.356 -3.995 1.00 0.00 C ATOM 416 C GLY A 27 14.498 -6.627 -4.213 1.00 0.00 C ATOM 417 O GLY A 27 14.046 -7.763 -4.069 1.00 0.00 O ATOM 418 H GLY A 27 16.111 -4.280 -3.586 1.00 0.00 H ATOM 419 HA2 GLY A 27 16.449 -6.230 -4.957 1.00 0.00 H ATOM 420 HA3 GLY A 27 16.415 -7.211 -3.501 1.00 0.00 H ATOM 421 N LEU A 28 13.742 -5.587 -4.560 1.00 0.00 N ATOM 422 CA LEU A 28 12.303 -5.728 -4.791 1.00 0.00 C ATOM 423 C LEU A 28 11.815 -4.816 -5.920 1.00 0.00 C ATOM 424 O LEU A 28 12.308 -3.700 -6.094 1.00 0.00 O ATOM 425 CB LEU A 28 11.530 -5.412 -3.506 1.00 0.00 C ATOM 426 CG LEU A 28 12.018 -6.143 -2.253 1.00 0.00 C ATOM 427 CD1 LEU A 28 13.043 -5.303 -1.511 1.00 0.00 C ATOM 428 CD2 LEU A 28 10.851 -6.478 -1.340 1.00 0.00 C ATOM 429 H LEU A 28 14.157 -4.705 -4.657 1.00 0.00 H ATOM 430 HA LEU A 28 12.111 -6.755 -5.069 1.00 0.00 H ATOM 431 HB2 LEU A 28 11.600 -4.351 -3.327 1.00 0.00 H ATOM 432 HB3 LEU A 28 10.493 -5.665 -3.663 1.00 0.00 H ATOM 433 HG LEU A 28 12.493 -7.069 -2.545 1.00 0.00 H ATOM 434 HD11 LEU A 28 13.825 -5.945 -1.132 1.00 0.00 H ATOM 435 HD12 LEU A 28 12.564 -4.793 -0.690 1.00 0.00 H ATOM 436 HD13 LEU A 28 13.470 -4.577 -2.187 1.00 0.00 H ATOM 437 HD21 LEU A 28 9.957 -5.993 -1.703 1.00 0.00 H ATOM 438 HD22 LEU A 28 11.068 -6.131 -0.341 1.00 0.00 H ATOM 439 HD23 LEU A 28 10.703 -7.546 -1.325 1.00 0.00 H ATOM 440 N THR A 29 10.828 -5.293 -6.672 1.00 0.00 N ATOM 441 CA THR A 29 10.249 -4.521 -7.774 1.00 0.00 C ATOM 442 C THR A 29 9.222 -3.515 -7.249 1.00 0.00 C ATOM 443 O THR A 29 8.091 -3.885 -6.921 1.00 0.00 O ATOM 444 CB THR A 29 9.576 -5.449 -8.800 1.00 0.00 C ATOM 445 OG1 THR A 29 10.505 -6.343 -9.392 1.00 0.00 O ATOM 446 CG2 THR A 29 8.908 -4.701 -9.930 1.00 0.00 C ATOM 447 H THR A 29 10.467 -6.188 -6.469 1.00 0.00 H ATOM 448 HA THR A 29 11.049 -3.983 -8.259 1.00 0.00 H ATOM 449 HB THR A 29 8.817 -6.031 -8.297 1.00 0.00 H ATOM 450 HG1 THR A 29 11.305 -6.388 -8.858 1.00 0.00 H ATOM 451 HG21 THR A 29 8.383 -5.398 -10.563 1.00 0.00 H ATOM 452 HG22 THR A 29 9.659 -4.184 -10.510 1.00 0.00 H ATOM 453 HG23 THR A 29 8.211 -3.983 -9.525 1.00 0.00 H ATOM 454 N CYS A 30 9.619 -2.247 -7.173 1.00 0.00 N ATOM 455 CA CYS A 30 8.735 -1.184 -6.688 1.00 0.00 C ATOM 456 C CYS A 30 8.055 -0.449 -7.851 1.00 0.00 C ATOM 457 O CYS A 30 8.707 -0.080 -8.826 1.00 0.00 O ATOM 458 CB CYS A 30 9.531 -0.191 -5.837 1.00 0.00 C ATOM 459 SG CYS A 30 8.520 1.048 -4.994 1.00 0.00 S ATOM 460 H CYS A 30 10.532 -2.018 -7.449 1.00 0.00 H ATOM 461 HA CYS A 30 7.973 -1.639 -6.074 1.00 0.00 H ATOM 462 HB2 CYS A 30 10.080 -0.734 -5.083 1.00 0.00 H ATOM 463 HB3 CYS A 30 10.231 0.334 -6.473 1.00 0.00 H ATOM 464 HG CYS A 30 9.024 1.866 -4.954 1.00 0.00 H ATOM 465 N THR A 31 6.743 -0.232 -7.734 1.00 0.00 N ATOM 466 CA THR A 31 5.976 0.475 -8.773 1.00 0.00 C ATOM 467 C THR A 31 4.898 1.361 -8.143 1.00 0.00 C ATOM 468 O THR A 31 4.424 1.077 -7.037 1.00 0.00 O ATOM 469 CB THR A 31 5.349 -0.521 -9.762 1.00 0.00 C ATOM 470 OG1 THR A 31 5.436 -0.034 -11.090 1.00 0.00 O ATOM 471 CG2 THR A 31 3.893 -0.830 -9.491 1.00 0.00 C ATOM 472 H THR A 31 6.280 -0.544 -6.927 1.00 0.00 H ATOM 473 HA THR A 31 6.667 1.109 -9.309 1.00 0.00 H ATOM 474 HB THR A 31 5.899 -1.453 -9.707 1.00 0.00 H ATOM 475 HG1 THR A 31 4.783 0.661 -11.228 1.00 0.00 H ATOM 476 HG21 THR A 31 3.602 -1.709 -10.045 1.00 0.00 H ATOM 477 HG22 THR A 31 3.284 0.008 -9.799 1.00 0.00 H ATOM 478 HG23 THR A 31 3.754 -1.007 -8.437 1.00 0.00 H ATOM 479 N THR A 32 4.524 2.434 -8.837 1.00 0.00 N ATOM 480 CA THR A 32 3.509 3.367 -8.329 1.00 0.00 C ATOM 481 C THR A 32 2.324 3.520 -9.285 1.00 0.00 C ATOM 482 O THR A 32 2.389 3.112 -10.446 1.00 0.00 O ATOM 483 CB THR A 32 4.128 4.739 -8.074 1.00 0.00 C ATOM 484 OG1 THR A 32 4.913 5.135 -9.173 1.00 0.00 O ATOM 485 CG2 THR A 32 5.018 4.794 -6.854 1.00 0.00 C ATOM 486 H THR A 32 4.942 2.615 -9.704 1.00 0.00 H ATOM 487 HA THR A 32 3.147 2.974 -7.395 1.00 0.00 H ATOM 488 HB THR A 32 3.336 5.464 -7.938 1.00 0.00 H ATOM 489 HG1 THR A 32 4.461 5.864 -9.645 1.00 0.00 H ATOM 490 HG21 THR A 32 4.537 4.284 -6.034 1.00 0.00 H ATOM 491 HG22 THR A 32 5.194 5.826 -6.585 1.00 0.00 H ATOM 492 HG23 THR A 32 5.960 4.315 -7.074 1.00 0.00 H ATOM 493 N PHE A 33 1.244 4.120 -8.773 1.00 0.00 N ATOM 494 CA PHE A 33 0.018 4.355 -9.546 1.00 0.00 C ATOM 495 C PHE A 33 -0.623 5.698 -9.150 1.00 0.00 C ATOM 496 O PHE A 33 -0.127 6.382 -8.251 1.00 0.00 O ATOM 497 CB PHE A 33 -0.983 3.218 -9.303 1.00 0.00 C ATOM 498 CG PHE A 33 -0.408 1.837 -9.478 1.00 0.00 C ATOM 499 CD1 PHE A 33 0.283 1.220 -8.450 1.00 0.00 C ATOM 500 CD2 PHE A 33 -0.580 1.152 -10.663 1.00 0.00 C ATOM 501 CE1 PHE A 33 0.799 -0.052 -8.606 1.00 0.00 C ATOM 502 CE2 PHE A 33 -0.070 -0.121 -10.828 1.00 0.00 C ATOM 503 CZ PHE A 33 0.620 -0.727 -9.796 1.00 0.00 C ATOM 504 H PHE A 33 1.272 4.418 -7.839 1.00 0.00 H ATOM 505 HA PHE A 33 0.276 4.384 -10.595 1.00 0.00 H ATOM 506 HB2 PHE A 33 -1.361 3.290 -8.297 1.00 0.00 H ATOM 507 HB3 PHE A 33 -1.808 3.323 -9.995 1.00 0.00 H ATOM 508 HD1 PHE A 33 0.422 1.747 -7.519 1.00 0.00 H ATOM 509 HD2 PHE A 33 -1.119 1.628 -11.470 1.00 0.00 H ATOM 510 HE1 PHE A 33 1.340 -0.518 -7.799 1.00 0.00 H ATOM 511 HE2 PHE A 33 -0.211 -0.640 -11.762 1.00 0.00 H ATOM 512 HZ PHE A 33 1.023 -1.721 -9.925 1.00 0.00 H ATOM 513 N GLU A 34 -1.722 6.071 -9.821 1.00 0.00 N ATOM 514 CA GLU A 34 -2.427 7.339 -9.536 1.00 0.00 C ATOM 515 C GLU A 34 -2.678 7.560 -8.031 1.00 0.00 C ATOM 516 O GLU A 34 -2.109 8.474 -7.439 1.00 0.00 O ATOM 517 CB GLU A 34 -3.761 7.428 -10.312 1.00 0.00 C ATOM 518 CG GLU A 34 -4.529 6.112 -10.423 1.00 0.00 C ATOM 519 CD GLU A 34 -5.717 6.010 -9.486 1.00 0.00 C ATOM 520 OE1 GLU A 34 -6.701 6.746 -9.671 1.00 0.00 O ATOM 521 OE2 GLU A 34 -5.661 5.174 -8.565 1.00 0.00 O ATOM 522 H GLU A 34 -2.064 5.487 -10.531 1.00 0.00 H ATOM 523 HA GLU A 34 -1.786 8.140 -9.879 1.00 0.00 H ATOM 524 HB2 GLU A 34 -4.402 8.149 -9.825 1.00 0.00 H ATOM 525 HB3 GLU A 34 -3.551 7.777 -11.314 1.00 0.00 H ATOM 526 HG2 GLU A 34 -4.889 6.006 -11.435 1.00 0.00 H ATOM 527 HG3 GLU A 34 -3.851 5.305 -10.203 1.00 0.00 H ATOM 528 N ASN A 35 -3.543 6.737 -7.426 1.00 0.00 N ATOM 529 CA ASN A 35 -3.879 6.870 -5.993 1.00 0.00 C ATOM 530 C ASN A 35 -4.285 5.527 -5.352 1.00 0.00 C ATOM 531 O ASN A 35 -3.990 5.269 -4.180 1.00 0.00 O ATOM 532 CB ASN A 35 -5.022 7.880 -5.823 1.00 0.00 C ATOM 533 CG ASN A 35 -4.540 9.296 -5.567 1.00 0.00 C ATOM 534 OD1 ASN A 35 -3.356 9.549 -5.409 1.00 0.00 O ATOM 535 ND2 ASN A 35 -5.469 10.235 -5.521 1.00 0.00 N ATOM 536 H ASN A 35 -3.971 6.039 -7.954 1.00 0.00 H ATOM 537 HA ASN A 35 -3.004 7.246 -5.480 1.00 0.00 H ATOM 538 HB2 ASN A 35 -5.619 7.887 -6.721 1.00 0.00 H ATOM 539 HB3 ASN A 35 -5.637 7.577 -4.989 1.00 0.00 H ATOM 540 HD21 ASN A 35 -6.401 9.975 -5.652 1.00 0.00 H ATOM 541 HD22 ASN A 35 -5.180 11.156 -5.354 1.00 0.00 H ATOM 542 N GLY A 36 -4.979 4.678 -6.114 1.00 0.00 N ATOM 543 CA GLY A 36 -5.420 3.389 -5.593 1.00 0.00 C ATOM 544 C GLY A 36 -6.231 2.573 -6.592 1.00 0.00 C ATOM 545 O GLY A 36 -6.067 1.356 -6.675 1.00 0.00 O ATOM 546 H GLY A 36 -5.202 4.934 -7.038 1.00 0.00 H ATOM 547 HA2 GLY A 36 -4.554 2.814 -5.301 1.00 0.00 H ATOM 548 HA3 GLY A 36 -6.028 3.562 -4.717 1.00 0.00 H ATOM 549 N ASN A 37 -7.109 3.238 -7.350 1.00 0.00 N ATOM 550 CA ASN A 37 -7.948 2.555 -8.343 1.00 0.00 C ATOM 551 C ASN A 37 -7.104 1.873 -9.421 1.00 0.00 C ATOM 552 O ASN A 37 -7.310 0.693 -9.711 1.00 0.00 O ATOM 553 CB ASN A 37 -8.941 3.535 -8.978 1.00 0.00 C ATOM 554 CG ASN A 37 -10.358 3.300 -8.498 1.00 0.00 C ATOM 555 OD1 ASN A 37 -11.188 2.754 -9.217 1.00 0.00 O ATOM 556 ND2 ASN A 37 -10.641 3.698 -7.267 1.00 0.00 N ATOM 557 H ASN A 37 -7.191 4.209 -7.241 1.00 0.00 H ATOM 558 HA ASN A 37 -8.503 1.791 -7.823 1.00 0.00 H ATOM 559 HB2 ASN A 37 -8.656 4.546 -8.728 1.00 0.00 H ATOM 560 HB3 ASN A 37 -8.921 3.416 -10.051 1.00 0.00 H ATOM 561 HD21 ASN A 37 -9.931 4.116 -6.740 1.00 0.00 H ATOM 562 HD22 ASN A 37 -11.551 3.559 -6.940 1.00 0.00 H ATOM 563 N GLU A 38 -6.146 2.604 -9.990 1.00 0.00 N ATOM 564 CA GLU A 38 -5.257 2.042 -11.014 1.00 0.00 C ATOM 565 C GLU A 38 -4.716 0.695 -10.542 1.00 0.00 C ATOM 566 O GLU A 38 -4.730 -0.296 -11.281 1.00 0.00 O ATOM 567 CB GLU A 38 -4.098 2.996 -11.284 1.00 0.00 C ATOM 568 CG GLU A 38 -4.060 3.545 -12.702 1.00 0.00 C ATOM 569 CD GLU A 38 -2.777 4.296 -13.009 1.00 0.00 C ATOM 570 OE1 GLU A 38 -1.750 4.023 -12.350 1.00 0.00 O ATOM 571 OE2 GLU A 38 -2.802 5.159 -13.907 1.00 0.00 O ATOM 572 H GLU A 38 -6.018 3.535 -9.705 1.00 0.00 H ATOM 573 HA GLU A 38 -5.826 1.899 -11.920 1.00 0.00 H ATOM 574 HB2 GLU A 38 -4.171 3.826 -10.603 1.00 0.00 H ATOM 575 HB3 GLU A 38 -3.169 2.476 -11.100 1.00 0.00 H ATOM 576 HG2 GLU A 38 -4.149 2.726 -13.397 1.00 0.00 H ATOM 577 HG3 GLU A 38 -4.892 4.221 -12.836 1.00 0.00 H ATOM 578 N VAL A 39 -4.274 0.666 -9.285 1.00 0.00 N ATOM 579 CA VAL A 39 -3.759 -0.555 -8.672 1.00 0.00 C ATOM 580 C VAL A 39 -4.825 -1.652 -8.721 1.00 0.00 C ATOM 581 O VAL A 39 -4.535 -2.795 -9.063 1.00 0.00 O ATOM 582 CB VAL A 39 -3.320 -0.324 -7.205 1.00 0.00 C ATOM 583 CG1 VAL A 39 -2.363 -1.412 -6.757 1.00 0.00 C ATOM 584 CG2 VAL A 39 -2.674 1.044 -7.034 1.00 0.00 C ATOM 585 H VAL A 39 -4.320 1.486 -8.750 1.00 0.00 H ATOM 586 HA VAL A 39 -2.897 -0.878 -9.240 1.00 0.00 H ATOM 587 HB VAL A 39 -4.199 -0.363 -6.575 1.00 0.00 H ATOM 588 HG11 VAL A 39 -1.347 -1.058 -6.855 1.00 0.00 H ATOM 589 HG12 VAL A 39 -2.498 -2.288 -7.372 1.00 0.00 H ATOM 590 HG13 VAL A 39 -2.558 -1.661 -5.726 1.00 0.00 H ATOM 591 HG21 VAL A 39 -2.445 1.458 -8.004 1.00 0.00 H ATOM 592 HG22 VAL A 39 -1.762 0.942 -6.464 1.00 0.00 H ATOM 593 HG23 VAL A 39 -3.352 1.702 -6.512 1.00 0.00 H ATOM 594 N LEU A 40 -6.073 -1.282 -8.412 1.00 0.00 N ATOM 595 CA LEU A 40 -7.199 -2.225 -8.457 1.00 0.00 C ATOM 596 C LEU A 40 -7.355 -2.822 -9.864 1.00 0.00 C ATOM 597 O LEU A 40 -7.873 -3.934 -10.023 1.00 0.00 O ATOM 598 CB LEU A 40 -8.501 -1.531 -8.031 1.00 0.00 C ATOM 599 CG LEU A 40 -8.423 -0.725 -6.731 1.00 0.00 C ATOM 600 CD1 LEU A 40 -9.745 -0.037 -6.450 1.00 0.00 C ATOM 601 CD2 LEU A 40 -8.034 -1.617 -5.564 1.00 0.00 C ATOM 602 H LEU A 40 -6.245 -0.345 -8.174 1.00 0.00 H ATOM 603 HA LEU A 40 -6.986 -3.026 -7.766 1.00 0.00 H ATOM 604 HB2 LEU A 40 -8.801 -0.861 -8.825 1.00 0.00 H ATOM 605 HB3 LEU A 40 -9.265 -2.286 -7.914 1.00 0.00 H ATOM 606 HG LEU A 40 -7.668 0.039 -6.835 1.00 0.00 H ATOM 607 HD11 LEU A 40 -9.906 0.747 -7.175 1.00 0.00 H ATOM 608 HD12 LEU A 40 -9.725 0.388 -5.458 1.00 0.00 H ATOM 609 HD13 LEU A 40 -10.546 -0.758 -6.517 1.00 0.00 H ATOM 610 HD21 LEU A 40 -8.905 -2.146 -5.209 1.00 0.00 H ATOM 611 HD22 LEU A 40 -7.632 -1.010 -4.768 1.00 0.00 H ATOM 612 HD23 LEU A 40 -7.288 -2.326 -5.887 1.00 0.00 H ATOM 613 N ALA A 41 -6.890 -2.083 -10.877 1.00 0.00 N ATOM 614 CA ALA A 41 -6.946 -2.536 -12.264 1.00 0.00 C ATOM 615 C ALA A 41 -5.730 -3.408 -12.583 1.00 0.00 C ATOM 616 O ALA A 41 -5.875 -4.551 -13.015 1.00 0.00 O ATOM 617 CB ALA A 41 -7.020 -1.339 -13.207 1.00 0.00 C ATOM 618 H ALA A 41 -6.483 -1.211 -10.682 1.00 0.00 H ATOM 619 HA ALA A 41 -7.842 -3.126 -12.392 1.00 0.00 H ATOM 620 HB1 ALA A 41 -6.069 -0.826 -13.213 1.00 0.00 H ATOM 621 HB2 ALA A 41 -7.791 -0.661 -12.873 1.00 0.00 H ATOM 622 HB3 ALA A 41 -7.249 -1.680 -14.206 1.00 0.00 H ATOM 623 N ALA A 42 -4.532 -2.868 -12.339 1.00 0.00 N ATOM 624 CA ALA A 42 -3.287 -3.604 -12.578 1.00 0.00 C ATOM 625 C ALA A 42 -3.229 -4.876 -11.723 1.00 0.00 C ATOM 626 O ALA A 42 -2.798 -5.933 -12.190 1.00 0.00 O ATOM 627 CB ALA A 42 -2.085 -2.710 -12.295 1.00 0.00 C ATOM 628 H ALA A 42 -4.486 -1.954 -11.978 1.00 0.00 H ATOM 629 HA ALA A 42 -3.260 -3.887 -13.620 1.00 0.00 H ATOM 630 HB1 ALA A 42 -1.629 -3.000 -11.359 1.00 0.00 H ATOM 631 HB2 ALA A 42 -2.406 -1.681 -12.234 1.00 0.00 H ATOM 632 HB3 ALA A 42 -1.365 -2.813 -13.093 1.00 0.00 H ATOM 633 N LEU A 43 -3.681 -4.767 -10.472 1.00 0.00 N ATOM 634 CA LEU A 43 -3.703 -5.904 -9.547 1.00 0.00 C ATOM 635 C LEU A 43 -4.498 -7.080 -10.127 1.00 0.00 C ATOM 636 O LEU A 43 -4.254 -8.236 -9.777 1.00 0.00 O ATOM 637 CB LEU A 43 -4.302 -5.481 -8.199 1.00 0.00 C ATOM 638 CG LEU A 43 -3.317 -4.814 -7.241 1.00 0.00 C ATOM 639 CD1 LEU A 43 -4.045 -4.069 -6.138 1.00 0.00 C ATOM 640 CD2 LEU A 43 -2.383 -5.847 -6.648 1.00 0.00 C ATOM 641 H LEU A 43 -4.019 -3.897 -10.163 1.00 0.00 H ATOM 642 HA LEU A 43 -2.682 -6.224 -9.391 1.00 0.00 H ATOM 643 HB2 LEU A 43 -5.112 -4.793 -8.389 1.00 0.00 H ATOM 644 HB3 LEU A 43 -4.701 -6.359 -7.716 1.00 0.00 H ATOM 645 HG LEU A 43 -2.722 -4.099 -7.787 1.00 0.00 H ATOM 646 HD11 LEU A 43 -4.422 -4.775 -5.414 1.00 0.00 H ATOM 647 HD12 LEU A 43 -4.865 -3.510 -6.561 1.00 0.00 H ATOM 648 HD13 LEU A 43 -3.360 -3.389 -5.652 1.00 0.00 H ATOM 649 HD21 LEU A 43 -1.816 -5.400 -5.845 1.00 0.00 H ATOM 650 HD22 LEU A 43 -1.708 -6.199 -7.412 1.00 0.00 H ATOM 651 HD23 LEU A 43 -2.957 -6.677 -6.265 1.00 0.00 H ATOM 652 N ALA A 44 -5.444 -6.777 -11.021 1.00 0.00 N ATOM 653 CA ALA A 44 -6.267 -7.806 -11.657 1.00 0.00 C ATOM 654 C ALA A 44 -5.415 -8.851 -12.388 1.00 0.00 C ATOM 655 O ALA A 44 -5.854 -9.984 -12.581 1.00 0.00 O ATOM 656 CB ALA A 44 -7.259 -7.161 -12.619 1.00 0.00 C ATOM 657 H ALA A 44 -5.587 -5.839 -11.263 1.00 0.00 H ATOM 658 HA ALA A 44 -6.830 -8.304 -10.882 1.00 0.00 H ATOM 659 HB1 ALA A 44 -6.745 -6.867 -13.524 1.00 0.00 H ATOM 660 HB2 ALA A 44 -7.695 -6.289 -12.157 1.00 0.00 H ATOM 661 HB3 ALA A 44 -8.037 -7.869 -12.861 1.00 0.00 H ATOM 662 N SER A 45 -4.203 -8.470 -12.796 1.00 0.00 N ATOM 663 CA SER A 45 -3.313 -9.393 -13.506 1.00 0.00 C ATOM 664 C SER A 45 -1.969 -9.577 -12.784 1.00 0.00 C ATOM 665 O SER A 45 -0.970 -9.938 -13.409 1.00 0.00 O ATOM 666 CB SER A 45 -3.080 -8.897 -14.937 1.00 0.00 C ATOM 667 OG SER A 45 -3.383 -9.910 -15.884 1.00 0.00 O ATOM 668 H SER A 45 -3.901 -7.552 -12.622 1.00 0.00 H ATOM 669 HA SER A 45 -3.806 -10.352 -13.551 1.00 0.00 H ATOM 670 HB2 SER A 45 -3.712 -8.042 -15.127 1.00 0.00 H ATOM 671 HB3 SER A 45 -2.044 -8.611 -15.053 1.00 0.00 H ATOM 672 HG SER A 45 -4.320 -10.126 -15.840 1.00 0.00 H ATOM 673 N LYS A 46 -1.944 -9.340 -11.464 1.00 0.00 N ATOM 674 CA LYS A 46 -0.713 -9.496 -10.672 1.00 0.00 C ATOM 675 C LYS A 46 -0.890 -9.019 -9.225 1.00 0.00 C ATOM 676 O LYS A 46 -1.357 -7.908 -8.981 1.00 0.00 O ATOM 677 CB LYS A 46 0.445 -8.725 -11.317 1.00 0.00 C ATOM 678 CG LYS A 46 1.792 -9.414 -11.165 1.00 0.00 C ATOM 679 CD LYS A 46 2.737 -8.607 -10.286 1.00 0.00 C ATOM 680 CE LYS A 46 4.108 -8.471 -10.926 1.00 0.00 C ATOM 681 NZ LYS A 46 4.702 -7.123 -10.683 1.00 0.00 N ATOM 682 H LYS A 46 -2.770 -9.063 -11.012 1.00 0.00 H ATOM 683 HA LYS A 46 -0.464 -10.547 -10.658 1.00 0.00 H ATOM 684 HB2 LYS A 46 0.242 -8.605 -12.370 1.00 0.00 H ATOM 685 HB3 LYS A 46 0.506 -7.749 -10.860 1.00 0.00 H ATOM 686 HG2 LYS A 46 1.640 -10.385 -10.716 1.00 0.00 H ATOM 687 HG3 LYS A 46 2.232 -9.534 -12.144 1.00 0.00 H ATOM 688 HD2 LYS A 46 2.320 -7.623 -10.136 1.00 0.00 H ATOM 689 HD3 LYS A 46 2.840 -9.106 -9.333 1.00 0.00 H ATOM 690 HE2 LYS A 46 4.760 -9.229 -10.510 1.00 0.00 H ATOM 691 HE3 LYS A 46 4.009 -8.630 -11.992 1.00 0.00 H ATOM 692 HZ1 LYS A 46 4.957 -6.674 -11.588 1.00 0.00 H ATOM 693 HZ2 LYS A 46 5.556 -7.207 -10.097 1.00 0.00 H ATOM 694 HZ3 LYS A 46 4.018 -6.513 -10.188 1.00 0.00 H ATOM 695 N THR A 47 -0.486 -9.859 -8.270 1.00 0.00 N ATOM 696 CA THR A 47 -0.578 -9.513 -6.847 1.00 0.00 C ATOM 697 C THR A 47 0.817 -9.310 -6.243 1.00 0.00 C ATOM 698 O THR A 47 1.632 -10.234 -6.231 1.00 0.00 O ATOM 699 CB THR A 47 -1.332 -10.601 -6.069 1.00 0.00 C ATOM 700 OG1 THR A 47 -2.721 -10.541 -6.341 1.00 0.00 O ATOM 701 CG2 THR A 47 -1.171 -10.493 -4.568 1.00 0.00 C ATOM 702 H THR A 47 -0.104 -10.725 -8.528 1.00 0.00 H ATOM 703 HA THR A 47 -1.126 -8.588 -6.767 1.00 0.00 H ATOM 704 HB THR A 47 -0.963 -11.572 -6.372 1.00 0.00 H ATOM 705 HG1 THR A 47 -2.863 -10.409 -7.282 1.00 0.00 H ATOM 706 HG21 THR A 47 -0.218 -10.909 -4.278 1.00 0.00 H ATOM 707 HG22 THR A 47 -1.965 -11.037 -4.079 1.00 0.00 H ATOM 708 HG23 THR A 47 -1.213 -9.454 -4.275 1.00 0.00 H ATOM 709 N PRO A 48 1.108 -8.094 -5.740 1.00 0.00 N ATOM 710 CA PRO A 48 2.407 -7.769 -5.133 1.00 0.00 C ATOM 711 C PRO A 48 2.525 -8.256 -3.683 1.00 0.00 C ATOM 712 O PRO A 48 1.527 -8.338 -2.963 1.00 0.00 O ATOM 713 CB PRO A 48 2.422 -6.242 -5.187 1.00 0.00 C ATOM 714 CG PRO A 48 0.992 -5.858 -5.033 1.00 0.00 C ATOM 715 CD PRO A 48 0.197 -6.931 -5.728 1.00 0.00 C ATOM 716 HA PRO A 48 3.228 -8.164 -5.712 1.00 0.00 H ATOM 717 HB2 PRO A 48 3.026 -5.854 -4.378 1.00 0.00 H ATOM 718 HB3 PRO A 48 2.818 -5.911 -6.134 1.00 0.00 H ATOM 719 HG2 PRO A 48 0.734 -5.820 -3.984 1.00 0.00 H ATOM 720 HG3 PRO A 48 0.817 -4.900 -5.498 1.00 0.00 H ATOM 721 HD2 PRO A 48 -0.703 -7.153 -5.173 1.00 0.00 H ATOM 722 HD3 PRO A 48 -0.047 -6.625 -6.736 1.00 0.00 H ATOM 723 N ASP A 49 3.752 -8.560 -3.259 1.00 0.00 N ATOM 724 CA ASP A 49 4.012 -9.024 -1.893 1.00 0.00 C ATOM 725 C ASP A 49 3.595 -7.968 -0.851 1.00 0.00 C ATOM 726 O ASP A 49 3.181 -8.308 0.258 1.00 0.00 O ATOM 727 CB ASP A 49 5.499 -9.374 -1.734 1.00 0.00 C ATOM 728 CG ASP A 49 5.960 -10.441 -2.704 1.00 0.00 C ATOM 729 OD1 ASP A 49 5.714 -11.635 -2.437 1.00 0.00 O ATOM 730 OD2 ASP A 49 6.574 -10.082 -3.729 1.00 0.00 O ATOM 731 H ASP A 49 4.505 -8.464 -3.877 1.00 0.00 H ATOM 732 HA ASP A 49 3.424 -9.918 -1.731 1.00 0.00 H ATOM 733 HB2 ASP A 49 6.091 -8.489 -1.900 1.00 0.00 H ATOM 734 HB3 ASP A 49 5.671 -9.733 -0.730 1.00 0.00 H ATOM 735 N VAL A 50 3.704 -6.689 -1.223 1.00 0.00 N ATOM 736 CA VAL A 50 3.334 -5.581 -0.335 1.00 0.00 C ATOM 737 C VAL A 50 2.826 -4.377 -1.148 1.00 0.00 C ATOM 738 O VAL A 50 3.351 -4.077 -2.225 1.00 0.00 O ATOM 739 CB VAL A 50 4.522 -5.160 0.563 1.00 0.00 C ATOM 740 CG1 VAL A 50 5.714 -4.725 -0.275 1.00 0.00 C ATOM 741 CG2 VAL A 50 4.115 -4.055 1.527 1.00 0.00 C ATOM 742 H VAL A 50 4.039 -6.486 -2.120 1.00 0.00 H ATOM 743 HA VAL A 50 2.532 -5.926 0.306 1.00 0.00 H ATOM 744 HB VAL A 50 4.821 -6.020 1.147 1.00 0.00 H ATOM 745 HG11 VAL A 50 6.622 -5.111 0.165 1.00 0.00 H ATOM 746 HG12 VAL A 50 5.759 -3.647 -0.304 1.00 0.00 H ATOM 747 HG13 VAL A 50 5.609 -5.108 -1.278 1.00 0.00 H ATOM 748 HG21 VAL A 50 3.079 -4.183 1.805 1.00 0.00 H ATOM 749 HG22 VAL A 50 4.244 -3.096 1.050 1.00 0.00 H ATOM 750 HG23 VAL A 50 4.733 -4.104 2.412 1.00 0.00 H ATOM 751 N LEU A 51 1.784 -3.706 -0.651 1.00 0.00 N ATOM 752 CA LEU A 51 1.200 -2.563 -1.365 1.00 0.00 C ATOM 753 C LEU A 51 0.904 -1.368 -0.439 1.00 0.00 C ATOM 754 O LEU A 51 0.522 -1.538 0.718 1.00 0.00 O ATOM 755 CB LEU A 51 -0.077 -3.028 -2.081 1.00 0.00 C ATOM 756 CG LEU A 51 -0.963 -1.924 -2.662 1.00 0.00 C ATOM 757 CD1 LEU A 51 -0.586 -1.637 -4.103 1.00 0.00 C ATOM 758 CD2 LEU A 51 -2.423 -2.322 -2.572 1.00 0.00 C ATOM 759 H LEU A 51 1.383 -3.997 0.199 1.00 0.00 H ATOM 760 HA LEU A 51 1.913 -2.247 -2.109 1.00 0.00 H ATOM 761 HB2 LEU A 51 0.214 -3.684 -2.889 1.00 0.00 H ATOM 762 HB3 LEU A 51 -0.667 -3.599 -1.379 1.00 0.00 H ATOM 763 HG LEU A 51 -0.826 -1.016 -2.093 1.00 0.00 H ATOM 764 HD11 LEU A 51 -1.263 -0.902 -4.511 1.00 0.00 H ATOM 765 HD12 LEU A 51 -0.652 -2.547 -4.681 1.00 0.00 H ATOM 766 HD13 LEU A 51 0.423 -1.257 -4.141 1.00 0.00 H ATOM 767 HD21 LEU A 51 -2.695 -2.891 -3.448 1.00 0.00 H ATOM 768 HD22 LEU A 51 -3.034 -1.435 -2.513 1.00 0.00 H ATOM 769 HD23 LEU A 51 -2.576 -2.925 -1.689 1.00 0.00 H ATOM 770 N LEU A 52 1.081 -0.158 -0.978 1.00 0.00 N ATOM 771 CA LEU A 52 0.837 1.093 -0.247 1.00 0.00 C ATOM 772 C LEU A 52 -0.098 2.005 -1.054 1.00 0.00 C ATOM 773 O LEU A 52 0.077 2.127 -2.260 1.00 0.00 O ATOM 774 CB LEU A 52 2.168 1.812 0.009 1.00 0.00 C ATOM 775 CG LEU A 52 3.178 1.036 0.856 1.00 0.00 C ATOM 776 CD1 LEU A 52 4.568 1.126 0.248 1.00 0.00 C ATOM 777 CD2 LEU A 52 3.188 1.558 2.282 1.00 0.00 C ATOM 778 H LEU A 52 1.384 -0.103 -1.914 1.00 0.00 H ATOM 779 HA LEU A 52 0.373 0.852 0.697 1.00 0.00 H ATOM 780 HB2 LEU A 52 2.623 2.024 -0.948 1.00 0.00 H ATOM 781 HB3 LEU A 52 1.960 2.751 0.504 1.00 0.00 H ATOM 782 HG LEU A 52 2.893 -0.005 0.883 1.00 0.00 H ATOM 783 HD11 LEU A 52 5.194 0.351 0.664 1.00 0.00 H ATOM 784 HD12 LEU A 52 4.997 2.090 0.469 1.00 0.00 H ATOM 785 HD13 LEU A 52 4.501 0.999 -0.822 1.00 0.00 H ATOM 786 HD21 LEU A 52 3.281 0.730 2.967 1.00 0.00 H ATOM 787 HD22 LEU A 52 2.267 2.086 2.479 1.00 0.00 H ATOM 788 HD23 LEU A 52 4.022 2.231 2.415 1.00 0.00 H ATOM 789 N SER A 53 -1.089 2.627 -0.396 1.00 0.00 N ATOM 790 CA SER A 53 -2.049 3.514 -1.094 1.00 0.00 C ATOM 791 C SER A 53 -2.433 4.751 -0.265 1.00 0.00 C ATOM 792 O SER A 53 -2.537 4.673 0.960 1.00 0.00 O ATOM 793 CB SER A 53 -3.325 2.732 -1.436 1.00 0.00 C ATOM 794 OG SER A 53 -3.605 2.771 -2.830 1.00 0.00 O ATOM 795 H SER A 53 -1.182 2.484 0.572 1.00 0.00 H ATOM 796 HA SER A 53 -1.590 3.842 -2.014 1.00 0.00 H ATOM 797 HB2 SER A 53 -3.206 1.699 -1.134 1.00 0.00 H ATOM 798 HB3 SER A 53 -4.160 3.164 -0.901 1.00 0.00 H ATOM 799 HG SER A 53 -3.630 3.689 -3.131 1.00 0.00 H ATOM 800 N ASP A 54 -2.668 5.881 -0.953 1.00 0.00 N ATOM 801 CA ASP A 54 -3.071 7.139 -0.299 1.00 0.00 C ATOM 802 C ASP A 54 -4.492 7.021 0.279 1.00 0.00 C ATOM 803 O ASP A 54 -5.040 5.914 0.393 1.00 0.00 O ATOM 804 CB ASP A 54 -2.962 8.310 -1.305 1.00 0.00 C ATOM 805 CG ASP A 54 -2.992 9.706 -0.669 1.00 0.00 C ATOM 806 OD1 ASP A 54 -2.429 9.877 0.455 1.00 0.00 O ATOM 807 OD2 ASP A 54 -3.562 10.617 -1.321 1.00 0.00 O ATOM 808 H ASP A 54 -2.582 5.867 -1.929 1.00 0.00 H ATOM 809 HA ASP A 54 -2.392 7.323 0.515 1.00 0.00 H ATOM 810 HB2 ASP A 54 -2.031 8.217 -1.841 1.00 0.00 H ATOM 811 HB3 ASP A 54 -3.776 8.245 -2.009 1.00 0.00 H ATOM 812 N ILE A 55 -5.076 8.143 0.680 1.00 0.00 N ATOM 813 CA ILE A 55 -6.398 8.136 1.278 1.00 0.00 C ATOM 814 C ILE A 55 -7.100 9.504 1.154 1.00 0.00 C ATOM 815 O ILE A 55 -7.584 10.059 2.138 1.00 0.00 O ATOM 816 CB ILE A 55 -6.269 7.715 2.769 1.00 0.00 C ATOM 817 CG1 ILE A 55 -7.557 7.953 3.558 1.00 0.00 C ATOM 818 CG2 ILE A 55 -5.122 8.469 3.420 1.00 0.00 C ATOM 819 CD1 ILE A 55 -7.802 6.914 4.624 1.00 0.00 C ATOM 820 H ILE A 55 -4.596 8.988 0.602 1.00 0.00 H ATOM 821 HA ILE A 55 -6.980 7.395 0.763 1.00 0.00 H ATOM 822 HB ILE A 55 -6.030 6.661 2.795 1.00 0.00 H ATOM 823 HG12 ILE A 55 -7.492 8.915 4.044 1.00 0.00 H ATOM 824 HG13 ILE A 55 -8.399 7.953 2.884 1.00 0.00 H ATOM 825 HG21 ILE A 55 -4.215 7.892 3.332 1.00 0.00 H ATOM 826 HG22 ILE A 55 -5.345 8.636 4.460 1.00 0.00 H ATOM 827 HG23 ILE A 55 -4.989 9.421 2.923 1.00 0.00 H ATOM 828 HD11 ILE A 55 -8.849 6.906 4.881 1.00 0.00 H ATOM 829 HD12 ILE A 55 -7.217 7.154 5.500 1.00 0.00 H ATOM 830 HD13 ILE A 55 -7.513 5.943 4.253 1.00 0.00 H ATOM 831 N ARG A 56 -7.159 10.058 -0.054 1.00 0.00 N ATOM 832 CA ARG A 56 -7.800 11.361 -0.238 1.00 0.00 C ATOM 833 C ARG A 56 -8.357 11.551 -1.661 1.00 0.00 C ATOM 834 O ARG A 56 -7.798 12.292 -2.474 1.00 0.00 O ATOM 835 CB ARG A 56 -6.784 12.454 0.121 1.00 0.00 C ATOM 836 CG ARG A 56 -7.225 13.863 -0.222 1.00 0.00 C ATOM 837 CD ARG A 56 -6.367 14.435 -1.334 1.00 0.00 C ATOM 838 NE ARG A 56 -6.523 15.885 -1.439 1.00 0.00 N ATOM 839 CZ ARG A 56 -5.827 16.755 -0.734 1.00 0.00 C ATOM 840 NH1 ARG A 56 -4.888 16.348 0.096 1.00 0.00 N ATOM 841 NH2 ARG A 56 -6.066 18.039 -0.872 1.00 0.00 N ATOM 842 H ARG A 56 -6.757 9.600 -0.819 1.00 0.00 H ATOM 843 HA ARG A 56 -8.623 11.418 0.458 1.00 0.00 H ATOM 844 HB2 ARG A 56 -6.591 12.409 1.183 1.00 0.00 H ATOM 845 HB3 ARG A 56 -5.859 12.250 -0.404 1.00 0.00 H ATOM 846 HG2 ARG A 56 -8.256 13.846 -0.543 1.00 0.00 H ATOM 847 HG3 ARG A 56 -7.127 14.487 0.656 1.00 0.00 H ATOM 848 HD2 ARG A 56 -5.329 14.195 -1.133 1.00 0.00 H ATOM 849 HD3 ARG A 56 -6.658 13.978 -2.270 1.00 0.00 H ATOM 850 HE ARG A 56 -7.197 16.217 -2.064 1.00 0.00 H ATOM 851 HH11 ARG A 56 -4.694 15.368 0.195 1.00 0.00 H ATOM 852 HH12 ARG A 56 -4.368 17.008 0.627 1.00 0.00 H ATOM 853 HH21 ARG A 56 -6.768 18.349 -1.509 1.00 0.00 H ATOM 854 HH22 ARG A 56 -5.553 18.699 -0.335 1.00 0.00 H ATOM 855 N MET A 57 -9.475 10.888 -1.960 1.00 0.00 N ATOM 856 CA MET A 57 -10.102 10.998 -3.285 1.00 0.00 C ATOM 857 C MET A 57 -11.346 10.113 -3.410 1.00 0.00 C ATOM 858 O MET A 57 -12.449 10.617 -3.635 1.00 0.00 O ATOM 859 CB MET A 57 -9.091 10.640 -4.380 1.00 0.00 C ATOM 860 CG MET A 57 -8.918 11.728 -5.428 1.00 0.00 C ATOM 861 SD MET A 57 -10.117 11.600 -6.772 1.00 0.00 S ATOM 862 CE MET A 57 -10.905 13.205 -6.693 1.00 0.00 C ATOM 863 H MET A 57 -9.890 10.315 -1.273 1.00 0.00 H ATOM 864 HA MET A 57 -10.404 12.025 -3.417 1.00 0.00 H ATOM 865 HB2 MET A 57 -8.131 10.461 -3.916 1.00 0.00 H ATOM 866 HB3 MET A 57 -9.414 9.736 -4.877 1.00 0.00 H ATOM 867 HG2 MET A 57 -9.031 12.690 -4.950 1.00 0.00 H ATOM 868 HG3 MET A 57 -7.923 11.651 -5.839 1.00 0.00 H ATOM 869 HE1 MET A 57 -10.375 13.836 -5.995 1.00 0.00 H ATOM 870 HE2 MET A 57 -11.925 13.084 -6.364 1.00 0.00 H ATOM 871 HE3 MET A 57 -10.893 13.661 -7.673 1.00 0.00 H ATOM 872 N PRO A 58 -11.186 8.779 -3.275 1.00 0.00 N ATOM 873 CA PRO A 58 -12.304 7.833 -3.377 1.00 0.00 C ATOM 874 C PRO A 58 -13.505 8.250 -2.522 1.00 0.00 C ATOM 875 O PRO A 58 -13.345 8.934 -1.514 1.00 0.00 O ATOM 876 CB PRO A 58 -11.716 6.505 -2.866 1.00 0.00 C ATOM 877 CG PRO A 58 -10.341 6.818 -2.358 1.00 0.00 C ATOM 878 CD PRO A 58 -9.912 8.094 -3.015 1.00 0.00 C ATOM 879 HA PRO A 58 -12.624 7.718 -4.403 1.00 0.00 H ATOM 880 HB2 PRO A 58 -12.342 6.122 -2.075 1.00 0.00 H ATOM 881 HB3 PRO A 58 -11.682 5.792 -3.676 1.00 0.00 H ATOM 882 HG2 PRO A 58 -10.366 6.947 -1.286 1.00 0.00 H ATOM 883 HG3 PRO A 58 -9.664 6.020 -2.622 1.00 0.00 H ATOM 884 HD2 PRO A 58 -9.294 8.672 -2.342 1.00 0.00 H ATOM 885 HD3 PRO A 58 -9.384 7.892 -3.935 1.00 0.00 H ATOM 886 N GLY A 59 -14.709 7.823 -2.931 1.00 0.00 N ATOM 887 CA GLY A 59 -15.933 8.153 -2.189 1.00 0.00 C ATOM 888 C GLY A 59 -15.756 8.111 -0.677 1.00 0.00 C ATOM 889 O GLY A 59 -16.340 8.918 0.041 1.00 0.00 O ATOM 890 H GLY A 59 -14.769 7.277 -3.742 1.00 0.00 H ATOM 891 HA2 GLY A 59 -16.249 9.146 -2.467 1.00 0.00 H ATOM 892 HA3 GLY A 59 -16.709 7.453 -2.466 1.00 0.00 H ATOM 893 N MET A 60 -14.940 7.173 -0.200 1.00 0.00 N ATOM 894 CA MET A 60 -14.669 7.028 1.228 1.00 0.00 C ATOM 895 C MET A 60 -13.264 7.537 1.579 1.00 0.00 C ATOM 896 O MET A 60 -12.458 6.797 2.151 1.00 0.00 O ATOM 897 CB MET A 60 -14.818 5.558 1.634 1.00 0.00 C ATOM 898 CG MET A 60 -15.746 5.347 2.816 1.00 0.00 C ATOM 899 SD MET A 60 -16.705 3.826 2.691 1.00 0.00 S ATOM 900 CE MET A 60 -17.908 4.102 3.987 1.00 0.00 C ATOM 901 H MET A 60 -14.503 6.566 -0.826 1.00 0.00 H ATOM 902 HA MET A 60 -15.394 7.620 1.771 1.00 0.00 H ATOM 903 HB2 MET A 60 -15.206 5.000 0.796 1.00 0.00 H ATOM 904 HB3 MET A 60 -13.845 5.168 1.896 1.00 0.00 H ATOM 905 HG2 MET A 60 -15.153 5.311 3.721 1.00 0.00 H ATOM 906 HG3 MET A 60 -16.430 6.183 2.873 1.00 0.00 H ATOM 907 HE1 MET A 60 -17.606 4.952 4.581 1.00 0.00 H ATOM 908 HE2 MET A 60 -17.967 3.228 4.617 1.00 0.00 H ATOM 909 HE3 MET A 60 -18.873 4.300 3.549 1.00 0.00 H ATOM 910 N ASP A 61 -12.980 8.799 1.225 1.00 0.00 N ATOM 911 CA ASP A 61 -11.676 9.421 1.494 1.00 0.00 C ATOM 912 C ASP A 61 -10.525 8.624 0.858 1.00 0.00 C ATOM 913 O ASP A 61 -9.966 9.022 -0.165 1.00 0.00 O ATOM 914 CB ASP A 61 -11.475 9.554 3.012 1.00 0.00 C ATOM 915 CG ASP A 61 -10.816 10.856 3.419 1.00 0.00 C ATOM 916 OD1 ASP A 61 -10.079 11.439 2.598 1.00 0.00 O ATOM 917 OD2 ASP A 61 -11.040 11.289 4.569 1.00 0.00 O ATOM 918 H ASP A 61 -13.667 9.329 0.770 1.00 0.00 H ATOM 919 HA ASP A 61 -11.685 10.410 1.058 1.00 0.00 H ATOM 920 HB2 ASP A 61 -12.438 9.505 3.495 1.00 0.00 H ATOM 921 HB3 ASP A 61 -10.863 8.739 3.363 1.00 0.00 H ATOM 922 N GLY A 62 -10.196 7.490 1.471 1.00 0.00 N ATOM 923 CA GLY A 62 -9.131 6.628 0.976 1.00 0.00 C ATOM 924 C GLY A 62 -9.383 5.168 1.267 1.00 0.00 C ATOM 925 O GLY A 62 -9.295 4.323 0.372 1.00 0.00 O ATOM 926 H GLY A 62 -10.695 7.230 2.275 1.00 0.00 H ATOM 927 HA2 GLY A 62 -9.030 6.761 -0.089 1.00 0.00 H ATOM 928 HA3 GLY A 62 -8.214 6.913 1.454 1.00 0.00 H ATOM 929 N LEU A 63 -9.708 4.870 2.528 1.00 0.00 N ATOM 930 CA LEU A 63 -9.994 3.497 2.962 1.00 0.00 C ATOM 931 C LEU A 63 -10.882 2.769 1.947 1.00 0.00 C ATOM 932 O LEU A 63 -10.793 1.548 1.802 1.00 0.00 O ATOM 933 CB LEU A 63 -10.645 3.489 4.352 1.00 0.00 C ATOM 934 CG LEU A 63 -10.149 4.572 5.314 1.00 0.00 C ATOM 935 CD1 LEU A 63 -11.091 5.759 5.305 1.00 0.00 C ATOM 936 CD2 LEU A 63 -10.012 4.025 6.722 1.00 0.00 C ATOM 937 H LEU A 63 -9.764 5.597 3.180 1.00 0.00 H ATOM 938 HA LEU A 63 -9.050 2.973 3.020 1.00 0.00 H ATOM 939 HB2 LEU A 63 -11.712 3.610 4.227 1.00 0.00 H ATOM 940 HB3 LEU A 63 -10.460 2.527 4.806 1.00 0.00 H ATOM 941 HG LEU A 63 -9.177 4.915 4.993 1.00 0.00 H ATOM 942 HD11 LEU A 63 -10.539 6.659 5.533 1.00 0.00 H ATOM 943 HD12 LEU A 63 -11.858 5.614 6.050 1.00 0.00 H ATOM 944 HD13 LEU A 63 -11.549 5.855 4.333 1.00 0.00 H ATOM 945 HD21 LEU A 63 -10.003 4.847 7.423 1.00 0.00 H ATOM 946 HD22 LEU A 63 -9.091 3.471 6.806 1.00 0.00 H ATOM 947 HD23 LEU A 63 -10.846 3.377 6.940 1.00 0.00 H ATOM 948 N ALA A 64 -11.716 3.525 1.217 1.00 0.00 N ATOM 949 CA ALA A 64 -12.578 2.943 0.188 1.00 0.00 C ATOM 950 C ALA A 64 -11.774 1.989 -0.705 1.00 0.00 C ATOM 951 O ALA A 64 -12.265 0.928 -1.095 1.00 0.00 O ATOM 952 CB ALA A 64 -13.223 4.044 -0.650 1.00 0.00 C ATOM 953 H ALA A 64 -11.729 4.496 1.359 1.00 0.00 H ATOM 954 HA ALA A 64 -13.361 2.385 0.680 1.00 0.00 H ATOM 955 HB1 ALA A 64 -12.768 4.064 -1.628 1.00 0.00 H ATOM 956 HB2 ALA A 64 -13.078 5.000 -0.166 1.00 0.00 H ATOM 957 HB3 ALA A 64 -14.281 3.849 -0.748 1.00 0.00 H ATOM 958 N LEU A 65 -10.521 2.367 -1.000 1.00 0.00 N ATOM 959 CA LEU A 65 -9.626 1.541 -1.819 1.00 0.00 C ATOM 960 C LEU A 65 -9.518 0.132 -1.237 1.00 0.00 C ATOM 961 O LEU A 65 -9.646 -0.860 -1.957 1.00 0.00 O ATOM 962 CB LEU A 65 -8.232 2.175 -1.907 1.00 0.00 C ATOM 963 CG LEU A 65 -8.183 3.586 -2.490 1.00 0.00 C ATOM 964 CD1 LEU A 65 -6.807 4.187 -2.277 1.00 0.00 C ATOM 965 CD2 LEU A 65 -8.532 3.564 -3.966 1.00 0.00 C ATOM 966 H LEU A 65 -10.184 3.219 -0.639 1.00 0.00 H ATOM 967 HA LEU A 65 -10.047 1.474 -2.809 1.00 0.00 H ATOM 968 HB2 LEU A 65 -7.813 2.210 -0.911 1.00 0.00 H ATOM 969 HB3 LEU A 65 -7.609 1.537 -2.517 1.00 0.00 H ATOM 970 HG LEU A 65 -8.904 4.208 -1.980 1.00 0.00 H ATOM 971 HD11 LEU A 65 -6.061 3.541 -2.715 1.00 0.00 H ATOM 972 HD12 LEU A 65 -6.618 4.288 -1.218 1.00 0.00 H ATOM 973 HD13 LEU A 65 -6.760 5.159 -2.745 1.00 0.00 H ATOM 974 HD21 LEU A 65 -9.573 3.311 -4.085 1.00 0.00 H ATOM 975 HD22 LEU A 65 -7.921 2.828 -4.467 1.00 0.00 H ATOM 976 HD23 LEU A 65 -8.345 4.538 -4.393 1.00 0.00 H ATOM 977 N LEU A 66 -9.319 0.053 0.080 1.00 0.00 N ATOM 978 CA LEU A 66 -9.240 -1.231 0.774 1.00 0.00 C ATOM 979 C LEU A 66 -10.517 -2.036 0.514 1.00 0.00 C ATOM 980 O LEU A 66 -10.465 -3.239 0.250 1.00 0.00 O ATOM 981 CB LEU A 66 -9.046 -1.015 2.280 1.00 0.00 C ATOM 982 CG LEU A 66 -7.645 -0.573 2.711 1.00 0.00 C ATOM 983 CD1 LEU A 66 -6.605 -1.566 2.233 1.00 0.00 C ATOM 984 CD2 LEU A 66 -7.318 0.815 2.182 1.00 0.00 C ATOM 985 H LEU A 66 -9.253 0.882 0.600 1.00 0.00 H ATOM 986 HA LEU A 66 -8.395 -1.777 0.384 1.00 0.00 H ATOM 987 HB2 LEU A 66 -9.756 -0.269 2.615 1.00 0.00 H ATOM 988 HB3 LEU A 66 -9.270 -1.944 2.780 1.00 0.00 H ATOM 989 HG LEU A 66 -7.607 -0.540 3.790 1.00 0.00 H ATOM 990 HD11 LEU A 66 -5.744 -1.537 2.887 1.00 0.00 H ATOM 991 HD12 LEU A 66 -6.306 -1.304 1.230 1.00 0.00 H ATOM 992 HD13 LEU A 66 -7.028 -2.557 2.235 1.00 0.00 H ATOM 993 HD21 LEU A 66 -6.911 0.738 1.182 1.00 0.00 H ATOM 994 HD22 LEU A 66 -6.591 1.277 2.829 1.00 0.00 H ATOM 995 HD23 LEU A 66 -8.214 1.415 2.160 1.00 0.00 H ATOM 996 N LYS A 67 -11.662 -1.343 0.557 1.00 0.00 N ATOM 997 CA LYS A 67 -12.957 -1.972 0.294 1.00 0.00 C ATOM 998 C LYS A 67 -12.959 -2.617 -1.101 1.00 0.00 C ATOM 999 O LYS A 67 -13.607 -3.643 -1.319 1.00 0.00 O ATOM 1000 CB LYS A 67 -14.093 -0.938 0.410 1.00 0.00 C ATOM 1001 CG LYS A 67 -15.390 -1.501 0.991 1.00 0.00 C ATOM 1002 CD LYS A 67 -16.570 -0.574 0.720 1.00 0.00 C ATOM 1003 CE LYS A 67 -17.227 -0.085 2.002 1.00 0.00 C ATOM 1004 NZ LYS A 67 -18.696 -0.362 2.005 1.00 0.00 N ATOM 1005 H LYS A 67 -11.627 -0.381 0.744 1.00 0.00 H ATOM 1006 HA LYS A 67 -13.104 -2.744 1.034 1.00 0.00 H ATOM 1007 HB2 LYS A 67 -13.765 -0.124 1.045 1.00 0.00 H ATOM 1008 HB3 LYS A 67 -14.304 -0.547 -0.573 1.00 0.00 H ATOM 1009 HG2 LYS A 67 -15.597 -2.464 0.536 1.00 0.00 H ATOM 1010 HG3 LYS A 67 -15.271 -1.625 2.056 1.00 0.00 H ATOM 1011 HD2 LYS A 67 -16.225 0.282 0.161 1.00 0.00 H ATOM 1012 HD3 LYS A 67 -17.303 -1.112 0.138 1.00 0.00 H ATOM 1013 HE2 LYS A 67 -16.764 -0.581 2.843 1.00 0.00 H ATOM 1014 HE3 LYS A 67 -17.073 0.980 2.084 1.00 0.00 H ATOM 1015 HZ1 LYS A 67 -19.074 -0.294 1.038 1.00 0.00 H ATOM 1016 HZ2 LYS A 67 -19.191 0.337 2.596 1.00 0.00 H ATOM 1017 HZ3 LYS A 67 -18.887 -1.317 2.381 1.00 0.00 H ATOM 1018 N GLN A 68 -12.209 -2.015 -2.030 1.00 0.00 N ATOM 1019 CA GLN A 68 -12.093 -2.524 -3.397 1.00 0.00 C ATOM 1020 C GLN A 68 -11.048 -3.646 -3.467 1.00 0.00 C ATOM 1021 O GLN A 68 -11.293 -4.699 -4.063 1.00 0.00 O ATOM 1022 CB GLN A 68 -11.722 -1.384 -4.355 1.00 0.00 C ATOM 1023 CG GLN A 68 -12.550 -0.112 -4.158 1.00 0.00 C ATOM 1024 CD GLN A 68 -14.010 -0.282 -4.536 1.00 0.00 C ATOM 1025 OE1 GLN A 68 -14.676 -1.212 -4.091 1.00 0.00 O ATOM 1026 NE2 GLN A 68 -14.515 0.618 -5.362 1.00 0.00 N ATOM 1027 H GLN A 68 -11.706 -1.212 -1.782 1.00 0.00 H ATOM 1028 HA GLN A 68 -13.054 -2.927 -3.687 1.00 0.00 H ATOM 1029 HB2 GLN A 68 -10.680 -1.136 -4.210 1.00 0.00 H ATOM 1030 HB3 GLN A 68 -11.864 -1.726 -5.369 1.00 0.00 H ATOM 1031 HG2 GLN A 68 -12.498 0.180 -3.119 1.00 0.00 H ATOM 1032 HG3 GLN A 68 -12.129 0.671 -4.768 1.00 0.00 H ATOM 1033 HE21 GLN A 68 -13.929 1.334 -5.684 1.00 0.00 H ATOM 1034 HE22 GLN A 68 -15.456 0.534 -5.612 1.00 0.00 H ATOM 1035 N ILE A 69 -9.893 -3.418 -2.835 1.00 0.00 N ATOM 1036 CA ILE A 69 -8.813 -4.411 -2.795 1.00 0.00 C ATOM 1037 C ILE A 69 -9.344 -5.763 -2.330 1.00 0.00 C ATOM 1038 O ILE A 69 -9.186 -6.776 -3.013 1.00 0.00 O ATOM 1039 CB ILE A 69 -7.686 -3.968 -1.829 1.00 0.00 C ATOM 1040 CG1 ILE A 69 -6.926 -2.774 -2.395 1.00 0.00 C ATOM 1041 CG2 ILE A 69 -6.718 -5.112 -1.533 1.00 0.00 C ATOM 1042 CD1 ILE A 69 -6.436 -1.828 -1.324 1.00 0.00 C ATOM 1043 H ILE A 69 -9.769 -2.565 -2.368 1.00 0.00 H ATOM 1044 HA ILE A 69 -8.400 -4.514 -3.788 1.00 0.00 H ATOM 1045 HB ILE A 69 -8.146 -3.676 -0.896 1.00 0.00 H ATOM 1046 HG12 ILE A 69 -6.066 -3.128 -2.945 1.00 0.00 H ATOM 1047 HG13 ILE A 69 -7.573 -2.220 -3.060 1.00 0.00 H ATOM 1048 HG21 ILE A 69 -6.527 -5.155 -0.469 1.00 0.00 H ATOM 1049 HG22 ILE A 69 -5.791 -4.942 -2.053 1.00 0.00 H ATOM 1050 HG23 ILE A 69 -7.147 -6.048 -1.858 1.00 0.00 H ATOM 1051 HD11 ILE A 69 -5.464 -1.449 -1.595 1.00 0.00 H ATOM 1052 HD12 ILE A 69 -6.366 -2.357 -0.384 1.00 0.00 H ATOM 1053 HD13 ILE A 69 -7.129 -1.007 -1.224 1.00 0.00 H ATOM 1054 N LYS A 70 -9.971 -5.761 -1.156 1.00 0.00 N ATOM 1055 CA LYS A 70 -10.526 -6.980 -0.566 1.00 0.00 C ATOM 1056 C LYS A 70 -11.644 -7.618 -1.414 1.00 0.00 C ATOM 1057 O LYS A 70 -12.122 -8.702 -1.086 1.00 0.00 O ATOM 1058 CB LYS A 70 -11.013 -6.685 0.859 1.00 0.00 C ATOM 1059 CG LYS A 70 -12.371 -6.013 0.936 1.00 0.00 C ATOM 1060 CD LYS A 70 -13.375 -6.910 1.636 1.00 0.00 C ATOM 1061 CE LYS A 70 -14.774 -6.329 1.594 1.00 0.00 C ATOM 1062 NZ LYS A 70 -15.799 -7.395 1.394 1.00 0.00 N ATOM 1063 H LYS A 70 -10.056 -4.914 -0.667 1.00 0.00 H ATOM 1064 HA LYS A 70 -9.716 -7.692 -0.501 1.00 0.00 H ATOM 1065 HB2 LYS A 70 -11.066 -7.615 1.402 1.00 0.00 H ATOM 1066 HB3 LYS A 70 -10.293 -6.041 1.342 1.00 0.00 H ATOM 1067 HG2 LYS A 70 -12.273 -5.090 1.488 1.00 0.00 H ATOM 1068 HG3 LYS A 70 -12.718 -5.802 -0.066 1.00 0.00 H ATOM 1069 HD2 LYS A 70 -13.380 -7.874 1.147 1.00 0.00 H ATOM 1070 HD3 LYS A 70 -13.073 -7.032 2.667 1.00 0.00 H ATOM 1071 HE2 LYS A 70 -14.965 -5.820 2.529 1.00 0.00 H ATOM 1072 HE3 LYS A 70 -14.834 -5.620 0.779 1.00 0.00 H ATOM 1073 HZ1 LYS A 70 -16.713 -7.096 1.788 1.00 0.00 H ATOM 1074 HZ2 LYS A 70 -15.501 -8.273 1.870 1.00 0.00 H ATOM 1075 HZ3 LYS A 70 -15.917 -7.591 0.378 1.00 0.00 H ATOM 1076 N GLN A 71 -12.050 -6.962 -2.506 1.00 0.00 N ATOM 1077 CA GLN A 71 -13.090 -7.506 -3.382 1.00 0.00 C ATOM 1078 C GLN A 71 -12.474 -8.402 -4.465 1.00 0.00 C ATOM 1079 O GLN A 71 -13.080 -9.387 -4.890 1.00 0.00 O ATOM 1080 CB GLN A 71 -13.889 -6.372 -4.032 1.00 0.00 C ATOM 1081 CG GLN A 71 -15.280 -6.178 -3.444 1.00 0.00 C ATOM 1082 CD GLN A 71 -15.914 -4.870 -3.870 1.00 0.00 C ATOM 1083 OE1 GLN A 71 -16.892 -4.850 -4.607 1.00 0.00 O ATOM 1084 NE2 GLN A 71 -15.359 -3.767 -3.399 1.00 0.00 N ATOM 1085 H GLN A 71 -11.638 -6.105 -2.736 1.00 0.00 H ATOM 1086 HA GLN A 71 -13.755 -8.106 -2.777 1.00 0.00 H ATOM 1087 HB2 GLN A 71 -13.343 -5.449 -3.911 1.00 0.00 H ATOM 1088 HB3 GLN A 71 -13.995 -6.580 -5.088 1.00 0.00 H ATOM 1089 HG2 GLN A 71 -15.914 -6.987 -3.773 1.00 0.00 H ATOM 1090 HG3 GLN A 71 -15.209 -6.192 -2.368 1.00 0.00 H ATOM 1091 HE21 GLN A 71 -14.585 -3.854 -2.805 1.00 0.00 H ATOM 1092 HE22 GLN A 71 -15.737 -2.906 -3.676 1.00 0.00 H ATOM 1093 N ARG A 72 -11.267 -8.051 -4.906 1.00 0.00 N ATOM 1094 CA ARG A 72 -10.566 -8.823 -5.938 1.00 0.00 C ATOM 1095 C ARG A 72 -9.350 -9.559 -5.368 1.00 0.00 C ATOM 1096 O ARG A 72 -8.898 -10.558 -5.932 1.00 0.00 O ATOM 1097 CB ARG A 72 -10.115 -7.897 -7.065 1.00 0.00 C ATOM 1098 CG ARG A 72 -11.190 -6.934 -7.531 1.00 0.00 C ATOM 1099 CD ARG A 72 -10.772 -6.228 -8.805 1.00 0.00 C ATOM 1100 NE ARG A 72 -11.930 -5.870 -9.624 1.00 0.00 N ATOM 1101 CZ ARG A 72 -11.899 -5.021 -10.636 1.00 0.00 C ATOM 1102 NH1 ARG A 72 -10.779 -4.415 -10.976 1.00 0.00 N ATOM 1103 NH2 ARG A 72 -13.001 -4.781 -11.311 1.00 0.00 N ATOM 1104 H ARG A 72 -10.836 -7.257 -4.533 1.00 0.00 H ATOM 1105 HA ARG A 72 -11.256 -9.552 -6.339 1.00 0.00 H ATOM 1106 HB2 ARG A 72 -9.267 -7.320 -6.724 1.00 0.00 H ATOM 1107 HB3 ARG A 72 -9.813 -8.501 -7.908 1.00 0.00 H ATOM 1108 HG2 ARG A 72 -12.098 -7.487 -7.716 1.00 0.00 H ATOM 1109 HG3 ARG A 72 -11.364 -6.198 -6.758 1.00 0.00 H ATOM 1110 HD2 ARG A 72 -10.226 -5.331 -8.542 1.00 0.00 H ATOM 1111 HD3 ARG A 72 -10.130 -6.888 -9.371 1.00 0.00 H ATOM 1112 HE ARG A 72 -12.785 -6.293 -9.399 1.00 0.00 H ATOM 1113 HH11 ARG A 72 -9.938 -4.594 -10.466 1.00 0.00 H ATOM 1114 HH12 ARG A 72 -10.770 -3.775 -11.739 1.00 0.00 H ATOM 1115 HH21 ARG A 72 -13.852 -5.237 -11.055 1.00 0.00 H ATOM 1116 HH22 ARG A 72 -12.989 -4.146 -12.079 1.00 0.00 H ATOM 1117 N HIS A 73 -8.809 -9.046 -4.268 1.00 0.00 N ATOM 1118 CA HIS A 73 -7.632 -9.634 -3.634 1.00 0.00 C ATOM 1119 C HIS A 73 -7.975 -10.192 -2.251 1.00 0.00 C ATOM 1120 O HIS A 73 -8.131 -9.436 -1.291 1.00 0.00 O ATOM 1121 CB HIS A 73 -6.525 -8.580 -3.528 1.00 0.00 C ATOM 1122 CG HIS A 73 -6.553 -7.581 -4.644 1.00 0.00 C ATOM 1123 ND1 HIS A 73 -6.817 -7.921 -5.951 1.00 0.00 N ATOM 1124 CD2 HIS A 73 -6.392 -6.240 -4.631 1.00 0.00 C ATOM 1125 CE1 HIS A 73 -6.822 -6.831 -6.696 1.00 0.00 C ATOM 1126 NE2 HIS A 73 -6.567 -5.796 -5.918 1.00 0.00 N ATOM 1127 H HIS A 73 -9.200 -8.237 -3.876 1.00 0.00 H ATOM 1128 HA HIS A 73 -7.286 -10.441 -4.262 1.00 0.00 H ATOM 1129 HB2 HIS A 73 -6.638 -8.041 -2.596 1.00 0.00 H ATOM 1130 HB3 HIS A 73 -5.561 -9.068 -3.539 1.00 0.00 H ATOM 1131 HD1 HIS A 73 -6.972 -8.831 -6.282 1.00 0.00 H ATOM 1132 HD2 HIS A 73 -6.164 -5.631 -3.767 1.00 0.00 H ATOM 1133 HE1 HIS A 73 -7.010 -6.794 -7.759 1.00 0.00 H ATOM 1134 HE2 HIS A 73 -6.407 -4.883 -6.228 1.00 0.00 H ATOM 1135 N PRO A 74 -8.106 -11.530 -2.136 1.00 0.00 N ATOM 1136 CA PRO A 74 -8.439 -12.199 -0.871 1.00 0.00 C ATOM 1137 C PRO A 74 -7.630 -11.671 0.322 1.00 0.00 C ATOM 1138 O PRO A 74 -8.203 -11.165 1.284 1.00 0.00 O ATOM 1139 CB PRO A 74 -8.118 -13.680 -1.141 1.00 0.00 C ATOM 1140 CG PRO A 74 -7.486 -13.727 -2.499 1.00 0.00 C ATOM 1141 CD PRO A 74 -7.956 -12.502 -3.226 1.00 0.00 C ATOM 1142 HA PRO A 74 -9.491 -12.098 -0.644 1.00 0.00 H ATOM 1143 HB2 PRO A 74 -7.441 -14.045 -0.379 1.00 0.00 H ATOM 1144 HB3 PRO A 74 -9.033 -14.253 -1.115 1.00 0.00 H ATOM 1145 HG2 PRO A 74 -6.411 -13.715 -2.403 1.00 0.00 H ATOM 1146 HG3 PRO A 74 -7.807 -14.617 -3.020 1.00 0.00 H ATOM 1147 HD2 PRO A 74 -7.216 -12.178 -3.944 1.00 0.00 H ATOM 1148 HD3 PRO A 74 -8.904 -12.690 -3.712 1.00 0.00 H ATOM 1149 N MET A 75 -6.302 -11.790 0.254 1.00 0.00 N ATOM 1150 CA MET A 75 -5.432 -11.316 1.336 1.00 0.00 C ATOM 1151 C MET A 75 -4.214 -10.572 0.783 1.00 0.00 C ATOM 1152 O MET A 75 -3.130 -11.142 0.636 1.00 0.00 O ATOM 1153 CB MET A 75 -4.988 -12.484 2.219 1.00 0.00 C ATOM 1154 CG MET A 75 -6.135 -13.159 2.953 1.00 0.00 C ATOM 1155 SD MET A 75 -5.713 -14.823 3.502 1.00 0.00 S ATOM 1156 CE MET A 75 -7.291 -15.651 3.331 1.00 0.00 C ATOM 1157 H MET A 75 -5.898 -12.203 -0.537 1.00 0.00 H ATOM 1158 HA MET A 75 -6.005 -10.625 1.935 1.00 0.00 H ATOM 1159 HB2 MET A 75 -4.495 -13.222 1.602 1.00 0.00 H ATOM 1160 HB3 MET A 75 -4.285 -12.117 2.953 1.00 0.00 H ATOM 1161 HG2 MET A 75 -6.393 -12.562 3.817 1.00 0.00 H ATOM 1162 HG3 MET A 75 -6.986 -13.214 2.289 1.00 0.00 H ATOM 1163 HE1 MET A 75 -7.249 -16.338 2.501 1.00 0.00 H ATOM 1164 HE2 MET A 75 -8.068 -14.921 3.156 1.00 0.00 H ATOM 1165 HE3 MET A 75 -7.509 -16.196 4.237 1.00 0.00 H ATOM 1166 N LEU A 76 -4.404 -9.293 0.480 1.00 0.00 N ATOM 1167 CA LEU A 76 -3.329 -8.462 -0.054 1.00 0.00 C ATOM 1168 C LEU A 76 -2.858 -7.443 0.989 1.00 0.00 C ATOM 1169 O LEU A 76 -3.651 -6.634 1.480 1.00 0.00 O ATOM 1170 CB LEU A 76 -3.796 -7.741 -1.323 1.00 0.00 C ATOM 1171 CG LEU A 76 -2.674 -7.129 -2.165 1.00 0.00 C ATOM 1172 CD1 LEU A 76 -2.978 -7.255 -3.645 1.00 0.00 C ATOM 1173 CD2 LEU A 76 -2.472 -5.675 -1.801 1.00 0.00 C ATOM 1174 H LEU A 76 -5.291 -8.897 0.624 1.00 0.00 H ATOM 1175 HA LEU A 76 -2.504 -9.110 -0.304 1.00 0.00 H ATOM 1176 HB2 LEU A 76 -4.337 -8.448 -1.938 1.00 0.00 H ATOM 1177 HB3 LEU A 76 -4.470 -6.950 -1.034 1.00 0.00 H ATOM 1178 HG LEU A 76 -1.751 -7.654 -1.970 1.00 0.00 H ATOM 1179 HD11 LEU A 76 -2.120 -7.668 -4.150 1.00 0.00 H ATOM 1180 HD12 LEU A 76 -3.200 -6.280 -4.049 1.00 0.00 H ATOM 1181 HD13 LEU A 76 -3.825 -7.908 -3.787 1.00 0.00 H ATOM 1182 HD21 LEU A 76 -3.178 -5.398 -1.041 1.00 0.00 H ATOM 1183 HD22 LEU A 76 -2.624 -5.060 -2.679 1.00 0.00 H ATOM 1184 HD23 LEU A 76 -1.471 -5.536 -1.428 1.00 0.00 H ATOM 1185 N PRO A 77 -1.554 -7.459 1.336 1.00 0.00 N ATOM 1186 CA PRO A 77 -0.982 -6.531 2.324 1.00 0.00 C ATOM 1187 C PRO A 77 -0.962 -5.076 1.841 1.00 0.00 C ATOM 1188 O PRO A 77 -0.003 -4.630 1.198 1.00 0.00 O ATOM 1189 CB PRO A 77 0.450 -7.052 2.538 1.00 0.00 C ATOM 1190 CG PRO A 77 0.499 -8.393 1.880 1.00 0.00 C ATOM 1191 CD PRO A 77 -0.538 -8.376 0.797 1.00 0.00 C ATOM 1192 HA PRO A 77 -1.520 -6.579 3.256 1.00 0.00 H ATOM 1193 HB2 PRO A 77 1.158 -6.368 2.091 1.00 0.00 H ATOM 1194 HB3 PRO A 77 0.645 -7.132 3.598 1.00 0.00 H ATOM 1195 HG2 PRO A 77 1.478 -8.558 1.454 1.00 0.00 H ATOM 1196 HG3 PRO A 77 0.273 -9.164 2.601 1.00 0.00 H ATOM 1197 HD2 PRO A 77 -0.119 -7.998 -0.127 1.00 0.00 H ATOM 1198 HD3 PRO A 77 -0.950 -9.365 0.652 1.00 0.00 H ATOM 1199 N VAL A 78 -2.026 -4.340 2.152 1.00 0.00 N ATOM 1200 CA VAL A 78 -2.133 -2.936 1.753 1.00 0.00 C ATOM 1201 C VAL A 78 -1.890 -1.984 2.926 1.00 0.00 C ATOM 1202 O VAL A 78 -2.539 -2.085 3.969 1.00 0.00 O ATOM 1203 CB VAL A 78 -3.512 -2.597 1.151 1.00 0.00 C ATOM 1204 CG1 VAL A 78 -3.433 -1.290 0.380 1.00 0.00 C ATOM 1205 CG2 VAL A 78 -4.019 -3.716 0.258 1.00 0.00 C ATOM 1206 H VAL A 78 -2.758 -4.751 2.656 1.00 0.00 H ATOM 1207 HA VAL A 78 -1.386 -2.749 0.997 1.00 0.00 H ATOM 1208 HB VAL A 78 -4.214 -2.466 1.965 1.00 0.00 H ATOM 1209 HG11 VAL A 78 -4.089 -1.335 -0.474 1.00 0.00 H ATOM 1210 HG12 VAL A 78 -2.418 -1.130 0.047 1.00 0.00 H ATOM 1211 HG13 VAL A 78 -3.732 -0.474 1.022 1.00 0.00 H ATOM 1212 HG21 VAL A 78 -5.021 -3.985 0.551 1.00 0.00 H ATOM 1213 HG22 VAL A 78 -3.374 -4.573 0.356 1.00 0.00 H ATOM 1214 HG23 VAL A 78 -4.024 -3.382 -0.770 1.00 0.00 H ATOM 1215 N ILE A 79 -0.971 -1.048 2.726 1.00 0.00 N ATOM 1216 CA ILE A 79 -0.640 -0.040 3.732 1.00 0.00 C ATOM 1217 C ILE A 79 -1.092 1.342 3.252 1.00 0.00 C ATOM 1218 O ILE A 79 -0.981 1.658 2.066 1.00 0.00 O ATOM 1219 CB ILE A 79 0.878 -0.007 4.020 1.00 0.00 C ATOM 1220 CG1 ILE A 79 1.396 -1.411 4.334 1.00 0.00 C ATOM 1221 CG2 ILE A 79 1.178 0.937 5.176 1.00 0.00 C ATOM 1222 CD1 ILE A 79 2.602 -1.816 3.514 1.00 0.00 C ATOM 1223 H ILE A 79 -0.505 -1.021 1.858 1.00 0.00 H ATOM 1224 HA ILE A 79 -1.161 -0.286 4.646 1.00 0.00 H ATOM 1225 HB ILE A 79 1.380 0.369 3.140 1.00 0.00 H ATOM 1226 HG12 ILE A 79 1.676 -1.455 5.375 1.00 0.00 H ATOM 1227 HG13 ILE A 79 0.611 -2.125 4.147 1.00 0.00 H ATOM 1228 HG21 ILE A 79 2.243 0.963 5.354 1.00 0.00 H ATOM 1229 HG22 ILE A 79 0.674 0.590 6.065 1.00 0.00 H ATOM 1230 HG23 ILE A 79 0.832 1.932 4.932 1.00 0.00 H ATOM 1231 HD11 ILE A 79 2.383 -1.691 2.464 1.00 0.00 H ATOM 1232 HD12 ILE A 79 2.838 -2.850 3.712 1.00 0.00 H ATOM 1233 HD13 ILE A 79 3.446 -1.196 3.782 1.00 0.00 H ATOM 1234 N ILE A 80 -1.607 2.159 4.164 1.00 0.00 N ATOM 1235 CA ILE A 80 -2.077 3.500 3.805 1.00 0.00 C ATOM 1236 C ILE A 80 -1.156 4.582 4.368 1.00 0.00 C ATOM 1237 O ILE A 80 -0.519 4.387 5.405 1.00 0.00 O ATOM 1238 CB ILE A 80 -3.526 3.739 4.288 1.00 0.00 C ATOM 1239 CG1 ILE A 80 -4.401 2.522 3.978 1.00 0.00 C ATOM 1240 CG2 ILE A 80 -4.120 4.979 3.637 1.00 0.00 C ATOM 1241 CD1 ILE A 80 -4.294 2.041 2.544 1.00 0.00 C ATOM 1242 H ILE A 80 -1.678 1.857 5.094 1.00 0.00 H ATOM 1243 HA ILE A 80 -2.069 3.575 2.728 1.00 0.00 H ATOM 1244 HB ILE A 80 -3.506 3.896 5.356 1.00 0.00 H ATOM 1245 HG12 ILE A 80 -4.117 1.707 4.624 1.00 0.00 H ATOM 1246 HG13 ILE A 80 -5.433 2.780 4.162 1.00 0.00 H ATOM 1247 HG21 ILE A 80 -3.344 5.705 3.460 1.00 0.00 H ATOM 1248 HG22 ILE A 80 -4.869 5.405 4.287 1.00 0.00 H ATOM 1249 HG23 ILE A 80 -4.576 4.706 2.695 1.00 0.00 H ATOM 1250 HD11 ILE A 80 -3.344 2.348 2.131 1.00 0.00 H ATOM 1251 HD12 ILE A 80 -5.093 2.473 1.960 1.00 0.00 H ATOM 1252 HD13 ILE A 80 -4.368 0.965 2.519 1.00 0.00 H ATOM 1253 N MET A 81 -1.083 5.712 3.665 1.00 0.00 N ATOM 1254 CA MET A 81 -0.225 6.829 4.076 1.00 0.00 C ATOM 1255 C MET A 81 -0.907 7.766 5.076 1.00 0.00 C ATOM 1256 O MET A 81 -0.265 8.675 5.581 1.00 0.00 O ATOM 1257 CB MET A 81 0.261 7.652 2.868 1.00 0.00 C ATOM 1258 CG MET A 81 -0.221 7.153 1.516 1.00 0.00 C ATOM 1259 SD MET A 81 0.475 5.551 1.073 1.00 0.00 S ATOM 1260 CE MET A 81 1.853 6.067 0.059 1.00 0.00 C ATOM 1261 H MET A 81 -1.610 5.792 2.843 1.00 0.00 H ATOM 1262 HA MET A 81 0.640 6.404 4.562 1.00 0.00 H ATOM 1263 HB2 MET A 81 -0.084 8.668 2.985 1.00 0.00 H ATOM 1264 HB3 MET A 81 1.341 7.651 2.862 1.00 0.00 H ATOM 1265 HG2 MET A 81 -1.293 7.067 1.549 1.00 0.00 H ATOM 1266 HG3 MET A 81 0.056 7.874 0.758 1.00 0.00 H ATOM 1267 HE1 MET A 81 2.650 6.424 0.692 1.00 0.00 H ATOM 1268 HE2 MET A 81 1.535 6.859 -0.598 1.00 0.00 H ATOM 1269 HE3 MET A 81 2.203 5.232 -0.527 1.00 0.00 H ATOM 1270 N THR A 82 -2.192 7.554 5.371 1.00 0.00 N ATOM 1271 CA THR A 82 -2.892 8.416 6.333 1.00 0.00 C ATOM 1272 C THR A 82 -4.232 7.830 6.775 1.00 0.00 C ATOM 1273 O THR A 82 -4.832 7.000 6.089 1.00 0.00 O ATOM 1274 CB THR A 82 -3.108 9.822 5.759 1.00 0.00 C ATOM 1275 OG1 THR A 82 -1.912 10.569 5.797 1.00 0.00 O ATOM 1276 CG2 THR A 82 -4.129 10.634 6.508 1.00 0.00 C ATOM 1277 H THR A 82 -2.671 6.816 4.948 1.00 0.00 H ATOM 1278 HA THR A 82 -2.259 8.500 7.204 1.00 0.00 H ATOM 1279 HB THR A 82 -3.434 9.741 4.729 1.00 0.00 H ATOM 1280 HG1 THR A 82 -1.492 10.522 4.933 1.00 0.00 H ATOM 1281 HG21 THR A 82 -5.056 10.083 6.568 1.00 0.00 H ATOM 1282 HG22 THR A 82 -4.291 11.562 5.983 1.00 0.00 H ATOM 1283 HG23 THR A 82 -3.765 10.840 7.502 1.00 0.00 H ATOM 1284 N ALA A 83 -4.700 8.291 7.932 1.00 0.00 N ATOM 1285 CA ALA A 83 -5.973 7.853 8.490 1.00 0.00 C ATOM 1286 C ALA A 83 -6.744 9.049 9.076 1.00 0.00 C ATOM 1287 O ALA A 83 -6.728 9.271 10.289 1.00 0.00 O ATOM 1288 CB ALA A 83 -5.730 6.775 9.548 1.00 0.00 C ATOM 1289 H ALA A 83 -4.173 8.956 8.421 1.00 0.00 H ATOM 1290 HA ALA A 83 -6.559 7.419 7.692 1.00 0.00 H ATOM 1291 HB1 ALA A 83 -5.912 7.183 10.532 1.00 0.00 H ATOM 1292 HB2 ALA A 83 -4.707 6.434 9.486 1.00 0.00 H ATOM 1293 HB3 ALA A 83 -6.395 5.943 9.374 1.00 0.00 H ATOM 1294 N HIS A 84 -7.408 9.829 8.213 1.00 0.00 N ATOM 1295 CA HIS A 84 -8.166 10.999 8.684 1.00 0.00 C ATOM 1296 C HIS A 84 -9.593 10.619 9.096 1.00 0.00 C ATOM 1297 O HIS A 84 -9.962 10.770 10.261 1.00 0.00 O ATOM 1298 CB HIS A 84 -8.200 12.152 7.651 1.00 0.00 C ATOM 1299 CG HIS A 84 -7.630 11.834 6.302 1.00 0.00 C ATOM 1300 ND1 HIS A 84 -6.372 12.224 5.907 1.00 0.00 N ATOM 1301 CD2 HIS A 84 -8.164 11.181 5.248 1.00 0.00 C ATOM 1302 CE1 HIS A 84 -6.157 11.824 4.663 1.00 0.00 C ATOM 1303 NE2 HIS A 84 -7.230 11.190 4.244 1.00 0.00 N ATOM 1304 H HIS A 84 -7.382 9.617 7.255 1.00 0.00 H ATOM 1305 HA HIS A 84 -7.660 11.359 9.570 1.00 0.00 H ATOM 1306 HB2 HIS A 84 -9.226 12.457 7.502 1.00 0.00 H ATOM 1307 HB3 HIS A 84 -7.646 12.988 8.051 1.00 0.00 H ATOM 1308 HD1 HIS A 84 -5.729 12.712 6.454 1.00 0.00 H ATOM 1309 HD2 HIS A 84 -9.145 10.737 5.203 1.00 0.00 H ATOM 1310 HE1 HIS A 84 -5.247 11.973 4.094 1.00 0.00 H ATOM 1311 HE2 HIS A 84 -7.380 10.870 3.314 1.00 0.00 H ATOM 1312 N SER A 85 -10.393 10.139 8.143 1.00 0.00 N ATOM 1313 CA SER A 85 -11.786 9.761 8.429 1.00 0.00 C ATOM 1314 C SER A 85 -12.092 8.300 8.074 1.00 0.00 C ATOM 1315 O SER A 85 -11.218 7.562 7.622 1.00 0.00 O ATOM 1316 CB SER A 85 -12.735 10.682 7.662 1.00 0.00 C ATOM 1317 OG SER A 85 -13.134 11.780 8.468 1.00 0.00 O ATOM 1318 H SER A 85 -10.051 10.051 7.228 1.00 0.00 H ATOM 1319 HA SER A 85 -11.954 9.901 9.485 1.00 0.00 H ATOM 1320 HB2 SER A 85 -12.232 11.059 6.784 1.00 0.00 H ATOM 1321 HB3 SER A 85 -13.613 10.126 7.362 1.00 0.00 H ATOM 1322 HG SER A 85 -13.535 12.453 7.912 1.00 0.00 H ATOM 1323 N ASP A 86 -13.360 7.909 8.278 1.00 0.00 N ATOM 1324 CA ASP A 86 -13.850 6.554 7.979 1.00 0.00 C ATOM 1325 C ASP A 86 -12.889 5.447 8.450 1.00 0.00 C ATOM 1326 O ASP A 86 -12.619 4.488 7.723 1.00 0.00 O ATOM 1327 CB ASP A 86 -14.127 6.439 6.478 1.00 0.00 C ATOM 1328 CG ASP A 86 -15.432 7.093 6.090 1.00 0.00 C ATOM 1329 OD1 ASP A 86 -15.587 8.305 6.340 1.00 0.00 O ATOM 1330 OD2 ASP A 86 -16.301 6.391 5.542 1.00 0.00 O ATOM 1331 H ASP A 86 -14.000 8.565 8.627 1.00 0.00 H ATOM 1332 HA ASP A 86 -14.786 6.429 8.506 1.00 0.00 H ATOM 1333 HB2 ASP A 86 -13.332 6.921 5.929 1.00 0.00 H ATOM 1334 HB3 ASP A 86 -14.173 5.397 6.201 1.00 0.00 H ATOM 1335 N LEU A 87 -12.390 5.578 9.677 1.00 0.00 N ATOM 1336 CA LEU A 87 -11.464 4.593 10.248 1.00 0.00 C ATOM 1337 C LEU A 87 -12.027 3.163 10.221 1.00 0.00 C ATOM 1338 O LEU A 87 -11.263 2.199 10.125 1.00 0.00 O ATOM 1339 CB LEU A 87 -11.086 4.994 11.679 1.00 0.00 C ATOM 1340 CG LEU A 87 -9.587 4.957 12.000 1.00 0.00 C ATOM 1341 CD1 LEU A 87 -9.178 3.562 12.435 1.00 0.00 C ATOM 1342 CD2 LEU A 87 -8.758 5.405 10.803 1.00 0.00 C ATOM 1343 H LEU A 87 -12.651 6.354 10.214 1.00 0.00 H ATOM 1344 HA LEU A 87 -10.571 4.606 9.643 1.00 0.00 H ATOM 1345 HB2 LEU A 87 -11.446 5.997 11.853 1.00 0.00 H ATOM 1346 HB3 LEU A 87 -11.592 4.326 12.360 1.00 0.00 H ATOM 1347 HG LEU A 87 -9.386 5.634 12.819 1.00 0.00 H ATOM 1348 HD11 LEU A 87 -9.604 2.835 11.758 1.00 0.00 H ATOM 1349 HD12 LEU A 87 -9.539 3.378 13.435 1.00 0.00 H ATOM 1350 HD13 LEU A 87 -8.102 3.483 12.420 1.00 0.00 H ATOM 1351 HD21 LEU A 87 -7.775 5.700 11.137 1.00 0.00 H ATOM 1352 HD22 LEU A 87 -9.241 6.243 10.321 1.00 0.00 H ATOM 1353 HD23 LEU A 87 -8.670 4.589 10.102 1.00 0.00 H ATOM 1354 N ASP A 88 -13.351 3.017 10.294 1.00 0.00 N ATOM 1355 CA ASP A 88 -13.972 1.690 10.261 1.00 0.00 C ATOM 1356 C ASP A 88 -13.505 0.893 9.035 1.00 0.00 C ATOM 1357 O ASP A 88 -13.303 -0.327 9.108 1.00 0.00 O ATOM 1358 CB ASP A 88 -15.495 1.825 10.269 1.00 0.00 C ATOM 1359 CG ASP A 88 -16.021 2.194 11.637 1.00 0.00 C ATOM 1360 OD1 ASP A 88 -16.033 3.397 11.961 1.00 0.00 O ATOM 1361 OD2 ASP A 88 -16.412 1.276 12.385 1.00 0.00 O ATOM 1362 H ASP A 88 -13.921 3.811 10.365 1.00 0.00 H ATOM 1363 HA ASP A 88 -13.664 1.162 11.152 1.00 0.00 H ATOM 1364 HB2 ASP A 88 -15.792 2.594 9.572 1.00 0.00 H ATOM 1365 HB3 ASP A 88 -15.938 0.885 9.978 1.00 0.00 H ATOM 1366 N ALA A 89 -13.302 1.588 7.916 1.00 0.00 N ATOM 1367 CA ALA A 89 -12.826 0.946 6.695 1.00 0.00 C ATOM 1368 C ALA A 89 -11.401 0.408 6.886 1.00 0.00 C ATOM 1369 O ALA A 89 -11.017 -0.596 6.278 1.00 0.00 O ATOM 1370 CB ALA A 89 -12.906 1.915 5.528 1.00 0.00 C ATOM 1371 H ALA A 89 -13.456 2.558 7.918 1.00 0.00 H ATOM 1372 HA ALA A 89 -13.481 0.111 6.485 1.00 0.00 H ATOM 1373 HB1 ALA A 89 -12.329 1.534 4.700 1.00 0.00 H ATOM 1374 HB2 ALA A 89 -12.515 2.875 5.832 1.00 0.00 H ATOM 1375 HB3 ALA A 89 -13.937 2.028 5.227 1.00 0.00 H ATOM 1376 N ALA A 90 -10.631 1.055 7.767 1.00 0.00 N ATOM 1377 CA ALA A 90 -9.274 0.611 8.072 1.00 0.00 C ATOM 1378 C ALA A 90 -9.335 -0.712 8.832 1.00 0.00 C ATOM 1379 O ALA A 90 -8.661 -1.680 8.473 1.00 0.00 O ATOM 1380 CB ALA A 90 -8.531 1.663 8.888 1.00 0.00 C ATOM 1381 H ALA A 90 -10.997 1.829 8.245 1.00 0.00 H ATOM 1382 HA ALA A 90 -8.746 0.461 7.140 1.00 0.00 H ATOM 1383 HB1 ALA A 90 -9.075 1.865 9.798 1.00 0.00 H ATOM 1384 HB2 ALA A 90 -8.442 2.571 8.313 1.00 0.00 H ATOM 1385 HB3 ALA A 90 -7.544 1.295 9.135 1.00 0.00 H ATOM 1386 N VAL A 91 -10.183 -0.753 9.865 1.00 0.00 N ATOM 1387 CA VAL A 91 -10.370 -1.968 10.664 1.00 0.00 C ATOM 1388 C VAL A 91 -10.747 -3.147 9.766 1.00 0.00 C ATOM 1389 O VAL A 91 -10.240 -4.258 9.934 1.00 0.00 O ATOM 1390 CB VAL A 91 -11.456 -1.788 11.750 1.00 0.00 C ATOM 1391 CG1 VAL A 91 -11.467 -2.984 12.687 1.00 0.00 C ATOM 1392 CG2 VAL A 91 -11.232 -0.506 12.539 1.00 0.00 C ATOM 1393 H VAL A 91 -10.711 0.047 10.079 1.00 0.00 H ATOM 1394 HA VAL A 91 -9.434 -2.191 11.154 1.00 0.00 H ATOM 1395 HB VAL A 91 -12.422 -1.726 11.265 1.00 0.00 H ATOM 1396 HG11 VAL A 91 -12.413 -3.027 13.205 1.00 0.00 H ATOM 1397 HG12 VAL A 91 -10.668 -2.883 13.406 1.00 0.00 H ATOM 1398 HG13 VAL A 91 -11.325 -3.891 12.118 1.00 0.00 H ATOM 1399 HG21 VAL A 91 -10.271 -0.085 12.282 1.00 0.00 H ATOM 1400 HG22 VAL A 91 -11.257 -0.725 13.596 1.00 0.00 H ATOM 1401 HG23 VAL A 91 -12.011 0.203 12.302 1.00 0.00 H ATOM 1402 N SER A 92 -11.623 -2.893 8.790 1.00 0.00 N ATOM 1403 CA SER A 92 -12.042 -3.936 7.848 1.00 0.00 C ATOM 1404 C SER A 92 -10.882 -4.331 6.925 1.00 0.00 C ATOM 1405 O SER A 92 -10.836 -5.459 6.427 1.00 0.00 O ATOM 1406 CB SER A 92 -13.264 -3.505 7.018 1.00 0.00 C ATOM 1407 OG SER A 92 -13.338 -2.094 6.870 1.00 0.00 O ATOM 1408 H SER A 92 -11.979 -1.982 8.693 1.00 0.00 H ATOM 1409 HA SER A 92 -12.312 -4.804 8.434 1.00 0.00 H ATOM 1410 HB2 SER A 92 -13.199 -3.952 6.035 1.00 0.00 H ATOM 1411 HB3 SER A 92 -14.165 -3.853 7.505 1.00 0.00 H ATOM 1412 HG SER A 92 -13.585 -1.686 7.712 1.00 0.00 H ATOM 1413 N ALA A 93 -9.932 -3.411 6.722 1.00 0.00 N ATOM 1414 CA ALA A 93 -8.761 -3.685 5.887 1.00 0.00 C ATOM 1415 C ALA A 93 -7.901 -4.779 6.531 1.00 0.00 C ATOM 1416 O ALA A 93 -7.467 -5.716 5.862 1.00 0.00 O ATOM 1417 CB ALA A 93 -7.946 -2.414 5.674 1.00 0.00 C ATOM 1418 H ALA A 93 -10.012 -2.535 7.157 1.00 0.00 H ATOM 1419 HA ALA A 93 -9.107 -4.035 4.925 1.00 0.00 H ATOM 1420 HB1 ALA A 93 -8.602 -1.555 5.695 1.00 0.00 H ATOM 1421 HB2 ALA A 93 -7.446 -2.461 4.718 1.00 0.00 H ATOM 1422 HB3 ALA A 93 -7.210 -2.323 6.460 1.00 0.00 H ATOM 1423 N TYR A 94 -7.683 -4.666 7.839 1.00 0.00 N ATOM 1424 CA TYR A 94 -6.902 -5.661 8.578 1.00 0.00 C ATOM 1425 C TYR A 94 -7.592 -7.029 8.524 1.00 0.00 C ATOM 1426 O TYR A 94 -6.936 -8.069 8.545 1.00 0.00 O ATOM 1427 CB TYR A 94 -6.715 -5.213 10.034 1.00 0.00 C ATOM 1428 CG TYR A 94 -6.337 -3.752 10.177 1.00 0.00 C ATOM 1429 CD1 TYR A 94 -5.292 -3.209 9.441 1.00 0.00 C ATOM 1430 CD2 TYR A 94 -7.027 -2.917 11.044 1.00 0.00 C ATOM 1431 CE1 TYR A 94 -4.946 -1.877 9.566 1.00 0.00 C ATOM 1432 CE2 TYR A 94 -6.686 -1.582 11.172 1.00 0.00 C ATOM 1433 CZ TYR A 94 -5.645 -1.069 10.431 1.00 0.00 C ATOM 1434 OH TYR A 94 -5.296 0.253 10.561 1.00 0.00 O ATOM 1435 H TYR A 94 -8.070 -3.904 8.323 1.00 0.00 H ATOM 1436 HA TYR A 94 -5.933 -5.742 8.108 1.00 0.00 H ATOM 1437 HB2 TYR A 94 -7.638 -5.373 10.573 1.00 0.00 H ATOM 1438 HB3 TYR A 94 -5.932 -5.804 10.487 1.00 0.00 H ATOM 1439 HD1 TYR A 94 -4.744 -3.845 8.762 1.00 0.00 H ATOM 1440 HD2 TYR A 94 -7.844 -3.323 11.623 1.00 0.00 H ATOM 1441 HE1 TYR A 94 -4.136 -1.474 8.986 1.00 0.00 H ATOM 1442 HE2 TYR A 94 -7.233 -0.948 11.848 1.00 0.00 H ATOM 1443 HH TYR A 94 -4.467 0.309 11.048 1.00 0.00 H ATOM 1444 N GLN A 95 -8.925 -7.009 8.443 1.00 0.00 N ATOM 1445 CA GLN A 95 -9.728 -8.233 8.373 1.00 0.00 C ATOM 1446 C GLN A 95 -9.461 -9.016 7.076 1.00 0.00 C ATOM 1447 O GLN A 95 -9.449 -10.245 7.084 1.00 0.00 O ATOM 1448 CB GLN A 95 -11.219 -7.873 8.489 1.00 0.00 C ATOM 1449 CG GLN A 95 -12.172 -8.855 7.801 1.00 0.00 C ATOM 1450 CD GLN A 95 -13.257 -8.171 6.983 1.00 0.00 C ATOM 1451 OE1 GLN A 95 -14.418 -8.558 7.025 1.00 0.00 O ATOM 1452 NE2 GLN A 95 -12.888 -7.150 6.225 1.00 0.00 N ATOM 1453 H GLN A 95 -9.383 -6.144 8.429 1.00 0.00 H ATOM 1454 HA GLN A 95 -9.454 -8.856 9.212 1.00 0.00 H ATOM 1455 HB2 GLN A 95 -11.482 -7.830 9.535 1.00 0.00 H ATOM 1456 HB3 GLN A 95 -11.370 -6.896 8.055 1.00 0.00 H ATOM 1457 HG2 GLN A 95 -11.605 -9.494 7.143 1.00 0.00 H ATOM 1458 HG3 GLN A 95 -12.647 -9.460 8.558 1.00 0.00 H ATOM 1459 HE21 GLN A 95 -11.944 -6.885 6.223 1.00 0.00 H ATOM 1460 HE22 GLN A 95 -13.577 -6.701 5.699 1.00 0.00 H ATOM 1461 N GLN A 96 -9.265 -8.298 5.966 1.00 0.00 N ATOM 1462 CA GLN A 96 -9.011 -8.934 4.664 1.00 0.00 C ATOM 1463 C GLN A 96 -7.535 -9.323 4.500 1.00 0.00 C ATOM 1464 O GLN A 96 -7.218 -10.338 3.881 1.00 0.00 O ATOM 1465 CB GLN A 96 -9.442 -8.000 3.521 1.00 0.00 C ATOM 1466 CG GLN A 96 -8.704 -6.663 3.510 1.00 0.00 C ATOM 1467 CD GLN A 96 -8.187 -6.263 2.141 1.00 0.00 C ATOM 1468 OE1 GLN A 96 -8.014 -7.095 1.260 1.00 0.00 O ATOM 1469 NE2 GLN A 96 -7.936 -4.980 1.957 1.00 0.00 N ATOM 1470 H GLN A 96 -9.299 -7.320 6.020 1.00 0.00 H ATOM 1471 HA GLN A 96 -9.605 -9.836 4.618 1.00 0.00 H ATOM 1472 HB2 GLN A 96 -9.257 -8.496 2.578 1.00 0.00 H ATOM 1473 HB3 GLN A 96 -10.500 -7.802 3.611 1.00 0.00 H ATOM 1474 HG2 GLN A 96 -9.374 -5.895 3.860 1.00 0.00 H ATOM 1475 HG3 GLN A 96 -7.865 -6.735 4.179 1.00 0.00 H ATOM 1476 HE21 GLN A 96 -8.091 -4.365 2.701 1.00 0.00 H ATOM 1477 HE22 GLN A 96 -7.604 -4.700 1.081 1.00 0.00 H ATOM 1478 N GLY A 97 -6.638 -8.514 5.060 1.00 0.00 N ATOM 1479 CA GLY A 97 -5.207 -8.795 4.961 1.00 0.00 C ATOM 1480 C GLY A 97 -4.353 -7.549 4.773 1.00 0.00 C ATOM 1481 O GLY A 97 -3.289 -7.612 4.157 1.00 0.00 O ATOM 1482 H GLY A 97 -6.949 -7.725 5.545 1.00 0.00 H ATOM 1483 HA2 GLY A 97 -4.888 -9.297 5.860 1.00 0.00 H ATOM 1484 HA3 GLY A 97 -5.041 -9.454 4.121 1.00 0.00 H ATOM 1485 N ALA A 98 -4.806 -6.418 5.312 1.00 0.00 N ATOM 1486 CA ALA A 98 -4.067 -5.166 5.208 1.00 0.00 C ATOM 1487 C ALA A 98 -3.047 -5.052 6.342 1.00 0.00 C ATOM 1488 O ALA A 98 -3.323 -5.453 7.471 1.00 0.00 O ATOM 1489 CB ALA A 98 -5.029 -3.986 5.215 1.00 0.00 C ATOM 1490 H ALA A 98 -5.651 -6.426 5.804 1.00 0.00 H ATOM 1491 HA ALA A 98 -3.541 -5.168 4.265 1.00 0.00 H ATOM 1492 HB1 ALA A 98 -4.538 -3.117 4.802 1.00 0.00 H ATOM 1493 HB2 ALA A 98 -5.337 -3.777 6.229 1.00 0.00 H ATOM 1494 HB3 ALA A 98 -5.897 -4.225 4.618 1.00 0.00 H ATOM 1495 N PHE A 99 -1.867 -4.525 6.029 1.00 0.00 N ATOM 1496 CA PHE A 99 -0.804 -4.382 7.024 1.00 0.00 C ATOM 1497 C PHE A 99 -1.191 -3.412 8.148 1.00 0.00 C ATOM 1498 O PHE A 99 -1.563 -3.843 9.238 1.00 0.00 O ATOM 1499 CB PHE A 99 0.498 -3.936 6.348 1.00 0.00 C ATOM 1500 CG PHE A 99 1.704 -4.054 7.237 1.00 0.00 C ATOM 1501 CD1 PHE A 99 1.986 -5.247 7.879 1.00 0.00 C ATOM 1502 CD2 PHE A 99 2.549 -2.975 7.432 1.00 0.00 C ATOM 1503 CE1 PHE A 99 3.089 -5.363 8.702 1.00 0.00 C ATOM 1504 CE2 PHE A 99 3.654 -3.084 8.253 1.00 0.00 C ATOM 1505 CZ PHE A 99 3.924 -4.280 8.890 1.00 0.00 C ATOM 1506 H PHE A 99 -1.704 -4.235 5.108 1.00 0.00 H ATOM 1507 HA PHE A 99 -0.645 -5.356 7.466 1.00 0.00 H ATOM 1508 HB2 PHE A 99 0.671 -4.548 5.475 1.00 0.00 H ATOM 1509 HB3 PHE A 99 0.406 -2.905 6.045 1.00 0.00 H ATOM 1510 HD1 PHE A 99 1.333 -6.094 7.733 1.00 0.00 H ATOM 1511 HD2 PHE A 99 2.338 -2.040 6.937 1.00 0.00 H ATOM 1512 HE1 PHE A 99 3.296 -6.299 9.198 1.00 0.00 H ATOM 1513 HE2 PHE A 99 4.305 -2.235 8.398 1.00 0.00 H ATOM 1514 HZ PHE A 99 4.787 -4.367 9.533 1.00 0.00 H ATOM 1515 N ASP A 100 -1.094 -2.109 7.882 1.00 0.00 N ATOM 1516 CA ASP A 100 -1.424 -1.100 8.886 1.00 0.00 C ATOM 1517 C ASP A 100 -1.673 0.278 8.257 1.00 0.00 C ATOM 1518 O ASP A 100 -1.579 0.450 7.036 1.00 0.00 O ATOM 1519 CB ASP A 100 -0.287 -1.008 9.913 1.00 0.00 C ATOM 1520 CG ASP A 100 -0.785 -0.831 11.334 1.00 0.00 C ATOM 1521 OD1 ASP A 100 -1.955 -0.422 11.514 1.00 0.00 O ATOM 1522 OD2 ASP A 100 0.003 -1.089 12.266 1.00 0.00 O ATOM 1523 H ASP A 100 -0.787 -1.821 7.001 1.00 0.00 H ATOM 1524 HA ASP A 100 -2.324 -1.417 9.393 1.00 0.00 H ATOM 1525 HB2 ASP A 100 0.298 -1.913 9.874 1.00 0.00 H ATOM 1526 HB3 ASP A 100 0.343 -0.167 9.669 1.00 0.00 H ATOM 1527 N TYR A 101 -1.981 1.255 9.109 1.00 0.00 N ATOM 1528 CA TYR A 101 -2.236 2.626 8.669 1.00 0.00 C ATOM 1529 C TYR A 101 -1.155 3.578 9.203 1.00 0.00 C ATOM 1530 O TYR A 101 -1.117 3.888 10.395 1.00 0.00 O ATOM 1531 CB TYR A 101 -3.627 3.074 9.136 1.00 0.00 C ATOM 1532 CG TYR A 101 -4.700 2.940 8.076 1.00 0.00 C ATOM 1533 CD1 TYR A 101 -5.235 1.699 7.755 1.00 0.00 C ATOM 1534 CD2 TYR A 101 -5.177 4.054 7.399 1.00 0.00 C ATOM 1535 CE1 TYR A 101 -6.217 1.573 6.788 1.00 0.00 C ATOM 1536 CE2 TYR A 101 -6.158 3.936 6.433 1.00 0.00 C ATOM 1537 CZ TYR A 101 -6.674 2.693 6.132 1.00 0.00 C ATOM 1538 OH TYR A 101 -7.650 2.566 5.168 1.00 0.00 O ATOM 1539 H TYR A 101 -2.030 1.045 10.069 1.00 0.00 H ATOM 1540 HA TYR A 101 -2.207 2.639 7.589 1.00 0.00 H ATOM 1541 HB2 TYR A 101 -3.924 2.474 9.983 1.00 0.00 H ATOM 1542 HB3 TYR A 101 -3.582 4.111 9.435 1.00 0.00 H ATOM 1543 HD1 TYR A 101 -4.875 0.822 8.275 1.00 0.00 H ATOM 1544 HD2 TYR A 101 -4.769 5.026 7.635 1.00 0.00 H ATOM 1545 HE1 TYR A 101 -6.620 0.601 6.553 1.00 0.00 H ATOM 1546 HE2 TYR A 101 -6.515 4.815 5.918 1.00 0.00 H ATOM 1547 HH TYR A 101 -7.645 3.340 4.601 1.00 0.00 H ATOM 1548 N LEU A 102 -0.278 4.028 8.310 1.00 0.00 N ATOM 1549 CA LEU A 102 0.819 4.934 8.673 1.00 0.00 C ATOM 1550 C LEU A 102 0.460 6.398 8.364 1.00 0.00 C ATOM 1551 O LEU A 102 -0.343 6.663 7.473 1.00 0.00 O ATOM 1552 CB LEU A 102 2.081 4.513 7.898 1.00 0.00 C ATOM 1553 CG LEU A 102 3.217 5.541 7.842 1.00 0.00 C ATOM 1554 CD1 LEU A 102 4.372 5.115 8.729 1.00 0.00 C ATOM 1555 CD2 LEU A 102 3.695 5.733 6.417 1.00 0.00 C ATOM 1556 H LEU A 102 -0.362 3.740 7.376 1.00 0.00 H ATOM 1557 HA LEU A 102 1.002 4.834 9.731 1.00 0.00 H ATOM 1558 HB2 LEU A 102 2.466 3.611 8.350 1.00 0.00 H ATOM 1559 HB3 LEU A 102 1.789 4.284 6.883 1.00 0.00 H ATOM 1560 HG LEU A 102 2.857 6.492 8.199 1.00 0.00 H ATOM 1561 HD11 LEU A 102 5.243 4.928 8.118 1.00 0.00 H ATOM 1562 HD12 LEU A 102 4.109 4.216 9.264 1.00 0.00 H ATOM 1563 HD13 LEU A 102 4.593 5.903 9.434 1.00 0.00 H ATOM 1564 HD21 LEU A 102 4.682 6.170 6.428 1.00 0.00 H ATOM 1565 HD22 LEU A 102 3.018 6.395 5.898 1.00 0.00 H ATOM 1566 HD23 LEU A 102 3.728 4.780 5.913 1.00 0.00 H ATOM 1567 N PRO A 103 1.053 7.376 9.096 1.00 0.00 N ATOM 1568 CA PRO A 103 0.789 8.809 8.858 1.00 0.00 C ATOM 1569 C PRO A 103 1.397 9.281 7.524 1.00 0.00 C ATOM 1570 O PRO A 103 2.211 8.572 6.937 1.00 0.00 O ATOM 1571 CB PRO A 103 1.467 9.488 10.056 1.00 0.00 C ATOM 1572 CG PRO A 103 2.564 8.555 10.435 1.00 0.00 C ATOM 1573 CD PRO A 103 2.025 7.172 10.194 1.00 0.00 C ATOM 1574 HA PRO A 103 -0.270 9.024 8.862 1.00 0.00 H ATOM 1575 HB2 PRO A 103 1.849 10.454 9.762 1.00 0.00 H ATOM 1576 HB3 PRO A 103 0.755 9.603 10.858 1.00 0.00 H ATOM 1577 HG2 PRO A 103 3.433 8.732 9.812 1.00 0.00 H ATOM 1578 HG3 PRO A 103 2.818 8.684 11.477 1.00 0.00 H ATOM 1579 HD2 PRO A 103 2.819 6.505 9.895 1.00 0.00 H ATOM 1580 HD3 PRO A 103 1.533 6.798 11.081 1.00 0.00 H ATOM 1581 N LYS A 104 0.982 10.465 7.037 1.00 0.00 N ATOM 1582 CA LYS A 104 1.476 10.997 5.748 1.00 0.00 C ATOM 1583 C LYS A 104 2.973 10.737 5.519 1.00 0.00 C ATOM 1584 O LYS A 104 3.356 10.353 4.410 1.00 0.00 O ATOM 1585 CB LYS A 104 1.159 12.490 5.590 1.00 0.00 C ATOM 1586 CG LYS A 104 1.103 12.950 4.131 1.00 0.00 C ATOM 1587 CD LYS A 104 0.143 12.104 3.296 1.00 0.00 C ATOM 1588 CE LYS A 104 0.874 11.098 2.422 1.00 0.00 C ATOM 1589 NZ LYS A 104 0.059 10.709 1.240 1.00 0.00 N ATOM 1590 H LYS A 104 0.313 10.975 7.535 1.00 0.00 H ATOM 1591 HA LYS A 104 0.941 10.462 4.976 1.00 0.00 H ATOM 1592 HB2 LYS A 104 0.199 12.693 6.046 1.00 0.00 H ATOM 1593 HB3 LYS A 104 1.919 13.064 6.097 1.00 0.00 H ATOM 1594 HG2 LYS A 104 0.769 13.977 4.100 1.00 0.00 H ATOM 1595 HG3 LYS A 104 2.094 12.882 3.704 1.00 0.00 H ATOM 1596 HD2 LYS A 104 -0.517 11.569 3.955 1.00 0.00 H ATOM 1597 HD3 LYS A 104 -0.441 12.755 2.659 1.00 0.00 H ATOM 1598 HE2 LYS A 104 1.803 11.538 2.083 1.00 0.00 H ATOM 1599 HE3 LYS A 104 1.090 10.216 3.010 1.00 0.00 H ATOM 1600 HZ1 LYS A 104 -0.347 11.547 0.780 1.00 0.00 H ATOM 1601 HZ2 LYS A 104 -0.730 10.089 1.525 1.00 0.00 H ATOM 1602 HZ3 LYS A 104 0.648 10.199 0.546 1.00 0.00 H ATOM 1603 N PRO A 105 3.852 10.928 6.545 1.00 0.00 N ATOM 1604 CA PRO A 105 5.288 10.668 6.391 1.00 0.00 C ATOM 1605 C PRO A 105 5.521 9.395 5.579 1.00 0.00 C ATOM 1606 O PRO A 105 5.013 8.331 5.927 1.00 0.00 O ATOM 1607 CB PRO A 105 5.760 10.477 7.830 1.00 0.00 C ATOM 1608 CG PRO A 105 4.834 11.305 8.657 1.00 0.00 C ATOM 1609 CD PRO A 105 3.523 11.383 7.910 1.00 0.00 C ATOM 1610 HA PRO A 105 5.805 11.498 5.933 1.00 0.00 H ATOM 1611 HB2 PRO A 105 5.697 9.429 8.094 1.00 0.00 H ATOM 1612 HB3 PRO A 105 6.783 10.812 7.926 1.00 0.00 H ATOM 1613 HG2 PRO A 105 4.685 10.830 9.616 1.00 0.00 H ATOM 1614 HG3 PRO A 105 5.247 12.294 8.792 1.00 0.00 H ATOM 1615 HD2 PRO A 105 2.798 10.732 8.367 1.00 0.00 H ATOM 1616 HD3 PRO A 105 3.158 12.399 7.898 1.00 0.00 H ATOM 1617 N PHE A 106 6.247 9.504 4.476 1.00 0.00 N ATOM 1618 CA PHE A 106 6.471 8.342 3.627 1.00 0.00 C ATOM 1619 C PHE A 106 7.870 8.317 3.023 1.00 0.00 C ATOM 1620 O PHE A 106 8.678 7.460 3.380 1.00 0.00 O ATOM 1621 CB PHE A 106 5.414 8.318 2.519 1.00 0.00 C ATOM 1622 CG PHE A 106 5.019 6.941 2.087 1.00 0.00 C ATOM 1623 CD1 PHE A 106 4.142 6.190 2.847 1.00 0.00 C ATOM 1624 CD2 PHE A 106 5.519 6.403 0.917 1.00 0.00 C ATOM 1625 CE1 PHE A 106 3.765 4.923 2.444 1.00 0.00 C ATOM 1626 CE2 PHE A 106 5.152 5.138 0.506 1.00 0.00 C ATOM 1627 CZ PHE A 106 4.273 4.395 1.271 1.00 0.00 C ATOM 1628 H PHE A 106 6.611 10.376 4.219 1.00 0.00 H ATOM 1629 HA PHE A 106 6.348 7.461 4.239 1.00 0.00 H ATOM 1630 HB2 PHE A 106 4.525 8.820 2.870 1.00 0.00 H ATOM 1631 HB3 PHE A 106 5.796 8.840 1.655 1.00 0.00 H ATOM 1632 HD1 PHE A 106 3.747 6.607 3.763 1.00 0.00 H ATOM 1633 HD2 PHE A 106 6.207 6.985 0.322 1.00 0.00 H ATOM 1634 HE1 PHE A 106 3.077 4.346 3.046 1.00 0.00 H ATOM 1635 HE2 PHE A 106 5.551 4.731 -0.410 1.00 0.00 H ATOM 1636 HZ PHE A 106 3.979 3.407 0.951 1.00 0.00 H ATOM 1637 N ASP A 107 8.128 9.248 2.095 1.00 0.00 N ATOM 1638 CA ASP A 107 9.416 9.348 1.399 1.00 0.00 C ATOM 1639 C ASP A 107 10.118 7.980 1.302 1.00 0.00 C ATOM 1640 O ASP A 107 9.795 7.186 0.414 1.00 0.00 O ATOM 1641 CB ASP A 107 10.308 10.408 2.066 1.00 0.00 C ATOM 1642 CG ASP A 107 10.193 10.420 3.572 1.00 0.00 C ATOM 1643 OD1 ASP A 107 9.284 11.100 4.092 1.00 0.00 O ATOM 1644 OD2 ASP A 107 11.014 9.750 4.226 1.00 0.00 O ATOM 1645 H ASP A 107 7.423 9.884 1.863 1.00 0.00 H ATOM 1646 HA ASP A 107 9.201 9.673 0.391 1.00 0.00 H ATOM 1647 HB2 ASP A 107 11.337 10.219 1.809 1.00 0.00 H ATOM 1648 HB3 ASP A 107 10.026 11.383 1.698 1.00 0.00 H ATOM 1649 N ILE A 108 11.051 7.692 2.218 1.00 0.00 N ATOM 1650 CA ILE A 108 11.750 6.404 2.212 1.00 0.00 C ATOM 1651 C ILE A 108 11.922 5.840 3.625 1.00 0.00 C ATOM 1652 O ILE A 108 11.500 4.715 3.890 1.00 0.00 O ATOM 1653 CB ILE A 108 13.128 6.493 1.501 1.00 0.00 C ATOM 1654 CG1 ILE A 108 13.051 5.826 0.131 1.00 0.00 C ATOM 1655 CG2 ILE A 108 14.233 5.836 2.325 1.00 0.00 C ATOM 1656 CD1 ILE A 108 12.169 6.556 -0.853 1.00 0.00 C ATOM 1657 H ILE A 108 11.255 8.349 2.920 1.00 0.00 H ATOM 1658 HA ILE A 108 11.137 5.712 1.652 1.00 0.00 H ATOM 1659 HB ILE A 108 13.378 7.536 1.372 1.00 0.00 H ATOM 1660 HG12 ILE A 108 14.040 5.771 -0.291 1.00 0.00 H ATOM 1661 HG13 ILE A 108 12.659 4.825 0.248 1.00 0.00 H ATOM 1662 HG21 ILE A 108 13.946 4.823 2.569 1.00 0.00 H ATOM 1663 HG22 ILE A 108 14.385 6.395 3.238 1.00 0.00 H ATOM 1664 HG23 ILE A 108 15.149 5.824 1.756 1.00 0.00 H ATOM 1665 HD11 ILE A 108 12.715 6.726 -1.764 1.00 0.00 H ATOM 1666 HD12 ILE A 108 11.867 7.503 -0.434 1.00 0.00 H ATOM 1667 HD13 ILE A 108 11.294 5.962 -1.064 1.00 0.00 H ATOM 1668 N ASP A 109 12.552 6.607 4.516 1.00 0.00 N ATOM 1669 CA ASP A 109 12.785 6.158 5.888 1.00 0.00 C ATOM 1670 C ASP A 109 11.518 5.548 6.496 1.00 0.00 C ATOM 1671 O ASP A 109 11.524 4.392 6.918 1.00 0.00 O ATOM 1672 CB ASP A 109 13.300 7.321 6.742 1.00 0.00 C ATOM 1673 CG ASP A 109 14.812 7.343 6.826 1.00 0.00 C ATOM 1674 OD1 ASP A 109 15.460 7.639 5.799 1.00 0.00 O ATOM 1675 OD2 ASP A 109 15.349 7.057 7.915 1.00 0.00 O ATOM 1676 H ASP A 109 12.878 7.489 4.242 1.00 0.00 H ATOM 1677 HA ASP A 109 13.546 5.392 5.855 1.00 0.00 H ATOM 1678 HB2 ASP A 109 12.971 8.253 6.307 1.00 0.00 H ATOM 1679 HB3 ASP A 109 12.904 7.234 7.742 1.00 0.00 H ATOM 1680 N GLU A 110 10.435 6.320 6.517 1.00 0.00 N ATOM 1681 CA GLU A 110 9.160 5.840 7.056 1.00 0.00 C ATOM 1682 C GLU A 110 8.575 4.724 6.178 1.00 0.00 C ATOM 1683 O GLU A 110 8.263 3.631 6.663 1.00 0.00 O ATOM 1684 CB GLU A 110 8.164 7.002 7.173 1.00 0.00 C ATOM 1685 CG GLU A 110 8.445 7.935 8.350 1.00 0.00 C ATOM 1686 CD GLU A 110 7.448 7.796 9.491 1.00 0.00 C ATOM 1687 OE1 GLU A 110 6.865 6.703 9.652 1.00 0.00 O ATOM 1688 OE2 GLU A 110 7.256 8.784 10.231 1.00 0.00 O ATOM 1689 H GLU A 110 10.489 7.228 6.151 1.00 0.00 H ATOM 1690 HA GLU A 110 9.349 5.440 8.042 1.00 0.00 H ATOM 1691 HB2 GLU A 110 8.199 7.584 6.263 1.00 0.00 H ATOM 1692 HB3 GLU A 110 7.168 6.597 7.292 1.00 0.00 H ATOM 1693 HG2 GLU A 110 9.430 7.721 8.733 1.00 0.00 H ATOM 1694 HG3 GLU A 110 8.416 8.954 7.994 1.00 0.00 H ATOM 1695 N ALA A 111 8.430 5.012 4.883 1.00 0.00 N ATOM 1696 CA ALA A 111 7.881 4.052 3.918 1.00 0.00 C ATOM 1697 C ALA A 111 8.621 2.705 3.929 1.00 0.00 C ATOM 1698 O ALA A 111 7.999 1.643 4.044 1.00 0.00 O ATOM 1699 CB ALA A 111 7.918 4.661 2.521 1.00 0.00 C ATOM 1700 H ALA A 111 8.697 5.902 4.566 1.00 0.00 H ATOM 1701 HA ALA A 111 6.846 3.880 4.177 1.00 0.00 H ATOM 1702 HB1 ALA A 111 7.642 5.703 2.576 1.00 0.00 H ATOM 1703 HB2 ALA A 111 7.226 4.139 1.879 1.00 0.00 H ATOM 1704 HB3 ALA A 111 8.918 4.577 2.119 1.00 0.00 H ATOM 1705 N VAL A 112 9.945 2.754 3.792 1.00 0.00 N ATOM 1706 CA VAL A 112 10.770 1.542 3.767 1.00 0.00 C ATOM 1707 C VAL A 112 10.843 0.874 5.139 1.00 0.00 C ATOM 1708 O VAL A 112 10.614 -0.335 5.254 1.00 0.00 O ATOM 1709 CB VAL A 112 12.198 1.844 3.260 1.00 0.00 C ATOM 1710 CG1 VAL A 112 13.070 0.597 3.316 1.00 0.00 C ATOM 1711 CG2 VAL A 112 12.153 2.393 1.843 1.00 0.00 C ATOM 1712 H VAL A 112 10.383 3.631 3.695 1.00 0.00 H ATOM 1713 HA VAL A 112 10.312 0.850 3.076 1.00 0.00 H ATOM 1714 HB VAL A 112 12.637 2.596 3.902 1.00 0.00 H ATOM 1715 HG11 VAL A 112 12.453 -0.269 3.503 1.00 0.00 H ATOM 1716 HG12 VAL A 112 13.793 0.700 4.112 1.00 0.00 H ATOM 1717 HG13 VAL A 112 13.586 0.476 2.376 1.00 0.00 H ATOM 1718 HG21 VAL A 112 11.489 1.789 1.243 1.00 0.00 H ATOM 1719 HG22 VAL A 112 13.144 2.370 1.417 1.00 0.00 H ATOM 1720 HG23 VAL A 112 11.794 3.412 1.864 1.00 0.00 H ATOM 1721 N ALA A 113 11.139 1.656 6.183 1.00 0.00 N ATOM 1722 CA ALA A 113 11.217 1.118 7.546 1.00 0.00 C ATOM 1723 C ALA A 113 9.963 0.309 7.903 1.00 0.00 C ATOM 1724 O ALA A 113 9.996 -0.533 8.802 1.00 0.00 O ATOM 1725 CB ALA A 113 11.429 2.243 8.551 1.00 0.00 C ATOM 1726 H ALA A 113 11.297 2.616 6.037 1.00 0.00 H ATOM 1727 HA ALA A 113 12.075 0.463 7.593 1.00 0.00 H ATOM 1728 HB1 ALA A 113 12.416 2.661 8.422 1.00 0.00 H ATOM 1729 HB2 ALA A 113 11.330 1.857 9.553 1.00 0.00 H ATOM 1730 HB3 ALA A 113 10.689 3.014 8.389 1.00 0.00 H ATOM 1731 N LEU A 114 8.863 0.570 7.193 1.00 0.00 N ATOM 1732 CA LEU A 114 7.605 -0.132 7.421 1.00 0.00 C ATOM 1733 C LEU A 114 7.440 -1.313 6.455 1.00 0.00 C ATOM 1734 O LEU A 114 7.122 -2.427 6.879 1.00 0.00 O ATOM 1735 CB LEU A 114 6.436 0.843 7.271 1.00 0.00 C ATOM 1736 CG LEU A 114 5.089 0.327 7.773 1.00 0.00 C ATOM 1737 CD1 LEU A 114 5.103 0.178 9.285 1.00 0.00 C ATOM 1738 CD2 LEU A 114 3.979 1.267 7.344 1.00 0.00 C ATOM 1739 H LEU A 114 8.900 1.257 6.494 1.00 0.00 H ATOM 1740 HA LEU A 114 7.618 -0.513 8.430 1.00 0.00 H ATOM 1741 HB2 LEU A 114 6.678 1.746 7.815 1.00 0.00 H ATOM 1742 HB3 LEU A 114 6.334 1.092 6.226 1.00 0.00 H ATOM 1743 HG LEU A 114 4.894 -0.643 7.341 1.00 0.00 H ATOM 1744 HD11 LEU A 114 4.575 1.008 9.731 1.00 0.00 H ATOM 1745 HD12 LEU A 114 6.123 0.171 9.636 1.00 0.00 H ATOM 1746 HD13 LEU A 114 4.619 -0.745 9.559 1.00 0.00 H ATOM 1747 HD21 LEU A 114 3.026 0.769 7.444 1.00 0.00 H ATOM 1748 HD22 LEU A 114 4.130 1.555 6.316 1.00 0.00 H ATOM 1749 HD23 LEU A 114 3.992 2.146 7.970 1.00 0.00 H ATOM 1750 N VAL A 115 7.656 -1.068 5.158 1.00 0.00 N ATOM 1751 CA VAL A 115 7.527 -2.120 4.142 1.00 0.00 C ATOM 1752 C VAL A 115 8.401 -3.341 4.479 1.00 0.00 C ATOM 1753 O VAL A 115 7.962 -4.483 4.329 1.00 0.00 O ATOM 1754 CB VAL A 115 7.869 -1.592 2.725 1.00 0.00 C ATOM 1755 CG1 VAL A 115 9.369 -1.572 2.481 1.00 0.00 C ATOM 1756 CG2 VAL A 115 7.175 -2.427 1.660 1.00 0.00 C ATOM 1757 H VAL A 115 7.906 -0.159 4.877 1.00 0.00 H ATOM 1758 HA VAL A 115 6.494 -2.440 4.137 1.00 0.00 H ATOM 1759 HB VAL A 115 7.503 -0.577 2.646 1.00 0.00 H ATOM 1760 HG11 VAL A 115 9.864 -1.112 3.321 1.00 0.00 H ATOM 1761 HG12 VAL A 115 9.580 -1.006 1.586 1.00 0.00 H ATOM 1762 HG13 VAL A 115 9.727 -2.583 2.359 1.00 0.00 H ATOM 1763 HG21 VAL A 115 7.536 -2.135 0.685 1.00 0.00 H ATOM 1764 HG22 VAL A 115 6.110 -2.265 1.712 1.00 0.00 H ATOM 1765 HG23 VAL A 115 7.390 -3.472 1.825 1.00 0.00 H ATOM 1766 N GLU A 116 9.628 -3.091 4.946 1.00 0.00 N ATOM 1767 CA GLU A 116 10.554 -4.169 5.315 1.00 0.00 C ATOM 1768 C GLU A 116 9.951 -5.071 6.393 1.00 0.00 C ATOM 1769 O GLU A 116 9.715 -6.261 6.165 1.00 0.00 O ATOM 1770 CB GLU A 116 11.876 -3.580 5.809 1.00 0.00 C ATOM 1771 CG GLU A 116 12.785 -3.096 4.691 1.00 0.00 C ATOM 1772 CD GLU A 116 14.241 -3.060 5.099 1.00 0.00 C ATOM 1773 OE1 GLU A 116 14.582 -2.278 6.008 1.00 0.00 O ATOM 1774 OE2 GLU A 116 15.036 -3.819 4.513 1.00 0.00 O ATOM 1775 H GLU A 116 9.917 -2.158 5.053 1.00 0.00 H ATOM 1776 HA GLU A 116 10.742 -4.763 4.433 1.00 0.00 H ATOM 1777 HB2 GLU A 116 11.667 -2.743 6.460 1.00 0.00 H ATOM 1778 HB3 GLU A 116 12.406 -4.336 6.371 1.00 0.00 H ATOM 1779 HG2 GLU A 116 12.684 -3.761 3.846 1.00 0.00 H ATOM 1780 HG3 GLU A 116 12.485 -2.102 4.403 1.00 0.00 H ATOM 1781 N ARG A 117 9.695 -4.498 7.571 1.00 0.00 N ATOM 1782 CA ARG A 117 9.105 -5.260 8.677 1.00 0.00 C ATOM 1783 C ARG A 117 7.817 -5.954 8.229 1.00 0.00 C ATOM 1784 O ARG A 117 7.512 -7.051 8.697 1.00 0.00 O ATOM 1785 CB ARG A 117 8.832 -4.376 9.902 1.00 0.00 C ATOM 1786 CG ARG A 117 8.603 -2.909 9.580 1.00 0.00 C ATOM 1787 CD ARG A 117 8.221 -2.121 10.820 1.00 0.00 C ATOM 1788 NE ARG A 117 9.382 -1.871 11.681 1.00 0.00 N ATOM 1789 CZ ARG A 117 9.310 -1.375 12.901 1.00 0.00 C ATOM 1790 NH1 ARG A 117 8.149 -1.046 13.421 1.00 0.00 N ATOM 1791 NH2 ARG A 117 10.410 -1.189 13.595 1.00 0.00 N ATOM 1792 H ARG A 117 9.899 -3.548 7.690 1.00 0.00 H ATOM 1793 HA ARG A 117 9.819 -6.024 8.954 1.00 0.00 H ATOM 1794 HB2 ARG A 117 7.953 -4.748 10.407 1.00 0.00 H ATOM 1795 HB3 ARG A 117 9.676 -4.446 10.572 1.00 0.00 H ATOM 1796 HG2 ARG A 117 9.512 -2.494 9.171 1.00 0.00 H ATOM 1797 HG3 ARG A 117 7.809 -2.830 8.852 1.00 0.00 H ATOM 1798 HD2 ARG A 117 7.796 -1.172 10.511 1.00 0.00 H ATOM 1799 HD3 ARG A 117 7.481 -2.683 11.372 1.00 0.00 H ATOM 1800 HE ARG A 117 10.268 -2.085 11.316 1.00 0.00 H ATOM 1801 HH11 ARG A 117 7.313 -1.169 12.891 1.00 0.00 H ATOM 1802 HH12 ARG A 117 8.099 -0.674 14.346 1.00 0.00 H ATOM 1803 HH21 ARG A 117 11.297 -1.420 13.198 1.00 0.00 H ATOM 1804 HH22 ARG A 117 10.360 -0.819 14.519 1.00 0.00 H ATOM 1805 N ALA A 118 7.081 -5.323 7.305 1.00 0.00 N ATOM 1806 CA ALA A 118 5.844 -5.900 6.778 1.00 0.00 C ATOM 1807 C ALA A 118 6.120 -7.282 6.178 1.00 0.00 C ATOM 1808 O ALA A 118 5.491 -8.271 6.558 1.00 0.00 O ATOM 1809 CB ALA A 118 5.222 -4.973 5.740 1.00 0.00 C ATOM 1810 H ALA A 118 7.389 -4.458 6.961 1.00 0.00 H ATOM 1811 HA ALA A 118 5.148 -6.010 7.600 1.00 0.00 H ATOM 1812 HB1 ALA A 118 5.232 -5.455 4.775 1.00 0.00 H ATOM 1813 HB2 ALA A 118 5.788 -4.055 5.690 1.00 0.00 H ATOM 1814 HB3 ALA A 118 4.202 -4.751 6.022 1.00 0.00 H ATOM 1815 N ILE A 119 7.093 -7.344 5.263 1.00 0.00 N ATOM 1816 CA ILE A 119 7.481 -8.612 4.635 1.00 0.00 C ATOM 1817 C ILE A 119 8.199 -9.501 5.648 1.00 0.00 C ATOM 1818 O ILE A 119 7.994 -10.711 5.678 1.00 0.00 O ATOM 1819 CB ILE A 119 8.398 -8.409 3.405 1.00 0.00 C ATOM 1820 CG1 ILE A 119 7.782 -7.419 2.414 1.00 0.00 C ATOM 1821 CG2 ILE A 119 8.659 -9.739 2.709 1.00 0.00 C ATOM 1822 CD1 ILE A 119 8.795 -6.480 1.796 1.00 0.00 C ATOM 1823 H ILE A 119 7.575 -6.521 5.021 1.00 0.00 H ATOM 1824 HA ILE A 119 6.580 -9.114 4.310 1.00 0.00 H ATOM 1825 HB ILE A 119 9.345 -8.018 3.749 1.00 0.00 H ATOM 1826 HG12 ILE A 119 7.311 -7.969 1.612 1.00 0.00 H ATOM 1827 HG13 ILE A 119 7.039 -6.821 2.920 1.00 0.00 H ATOM 1828 HG21 ILE A 119 8.353 -9.671 1.675 1.00 0.00 H ATOM 1829 HG22 ILE A 119 8.097 -10.519 3.199 1.00 0.00 H ATOM 1830 HG23 ILE A 119 9.713 -9.970 2.755 1.00 0.00 H ATOM 1831 HD11 ILE A 119 8.721 -5.511 2.268 1.00 0.00 H ATOM 1832 HD12 ILE A 119 8.599 -6.382 0.740 1.00 0.00 H ATOM 1833 HD13 ILE A 119 9.790 -6.876 1.942 1.00 0.00 H ATOM 1834 N SER A 120 9.029 -8.885 6.493 1.00 0.00 N ATOM 1835 CA SER A 120 9.761 -9.620 7.529 1.00 0.00 C ATOM 1836 C SER A 120 8.790 -10.355 8.463 1.00 0.00 C ATOM 1837 O SER A 120 9.020 -11.502 8.831 1.00 0.00 O ATOM 1838 CB SER A 120 10.632 -8.659 8.346 1.00 0.00 C ATOM 1839 OG SER A 120 11.581 -9.364 9.134 1.00 0.00 O ATOM 1840 H SER A 120 9.141 -7.908 6.428 1.00 0.00 H ATOM 1841 HA SER A 120 10.397 -10.343 7.041 1.00 0.00 H ATOM 1842 HB2 SER A 120 11.159 -7.992 7.677 1.00 0.00 H ATOM 1843 HB3 SER A 120 9.999 -8.080 9.003 1.00 0.00 H ATOM 1844 HG SER A 120 11.895 -10.136 8.653 1.00 0.00 H ATOM 1845 N HIS A 121 7.698 -9.670 8.832 1.00 0.00 N ATOM 1846 CA HIS A 121 6.665 -10.233 9.716 1.00 0.00 C ATOM 1847 C HIS A 121 5.782 -11.259 8.986 1.00 0.00 C ATOM 1848 O HIS A 121 4.981 -11.956 9.615 1.00 0.00 O ATOM 1849 CB HIS A 121 5.789 -9.106 10.280 1.00 0.00 C ATOM 1850 CG HIS A 121 6.362 -8.417 11.483 1.00 0.00 C ATOM 1851 ND1 HIS A 121 7.561 -7.743 11.477 1.00 0.00 N ATOM 1852 CD2 HIS A 121 5.875 -8.299 12.738 1.00 0.00 C ATOM 1853 CE1 HIS A 121 7.787 -7.238 12.679 1.00 0.00 C ATOM 1854 NE2 HIS A 121 6.779 -7.566 13.470 1.00 0.00 N ATOM 1855 H HIS A 121 7.580 -8.757 8.494 1.00 0.00 H ATOM 1856 HA HIS A 121 7.161 -10.735 10.531 1.00 0.00 H ATOM 1857 HB2 HIS A 121 5.638 -8.362 9.514 1.00 0.00 H ATOM 1858 HB3 HIS A 121 4.831 -9.520 10.561 1.00 0.00 H ATOM 1859 HD1 HIS A 121 8.162 -7.658 10.707 1.00 0.00 H ATOM 1860 HD2 HIS A 121 4.930 -8.690 13.092 1.00 0.00 H ATOM 1861 HE1 HIS A 121 8.635 -6.628 12.960 1.00 0.00 H ATOM 1862 HE2 HIS A 121 6.838 -7.594 14.450 1.00 0.00 H ATOM 1863 N TYR A 122 5.935 -11.350 7.660 1.00 0.00 N ATOM 1864 CA TYR A 122 5.166 -12.296 6.855 1.00 0.00 C ATOM 1865 C TYR A 122 6.064 -13.453 6.366 1.00 0.00 C ATOM 1866 O TYR A 122 5.608 -14.597 6.277 1.00 0.00 O ATOM 1867 CB TYR A 122 4.497 -11.572 5.676 1.00 0.00 C ATOM 1868 CG TYR A 122 2.974 -11.606 5.670 1.00 0.00 C ATOM 1869 CD1 TYR A 122 2.256 -12.462 6.493 1.00 0.00 C ATOM 1870 CD2 TYR A 122 2.254 -10.780 4.819 1.00 0.00 C ATOM 1871 CE1 TYR A 122 0.872 -12.490 6.468 1.00 0.00 C ATOM 1872 CE2 TYR A 122 0.872 -10.806 4.785 1.00 0.00 C ATOM 1873 CZ TYR A 122 0.188 -11.660 5.612 1.00 0.00 C ATOM 1874 OH TYR A 122 -1.190 -11.704 5.574 1.00 0.00 O ATOM 1875 H TYR A 122 6.583 -10.774 7.214 1.00 0.00 H ATOM 1876 HA TYR A 122 4.399 -12.715 7.489 1.00 0.00 H ATOM 1877 HB2 TYR A 122 4.797 -10.537 5.693 1.00 0.00 H ATOM 1878 HB3 TYR A 122 4.835 -12.022 4.757 1.00 0.00 H ATOM 1879 HD1 TYR A 122 2.789 -13.112 7.170 1.00 0.00 H ATOM 1880 HD2 TYR A 122 2.788 -10.103 4.177 1.00 0.00 H ATOM 1881 HE1 TYR A 122 0.331 -13.169 7.120 1.00 0.00 H ATOM 1882 HE2 TYR A 122 0.332 -10.158 4.105 1.00 0.00 H ATOM 1883 HH TYR A 122 -1.526 -10.974 5.045 1.00 0.00 H ATOM 1884 N GLN A 123 7.341 -13.175 6.070 1.00 0.00 N ATOM 1885 CA GLN A 123 8.261 -14.233 5.624 1.00 0.00 C ATOM 1886 C GLN A 123 8.890 -14.965 6.818 1.00 0.00 C ATOM 1887 O GLN A 123 9.654 -14.379 7.580 1.00 0.00 O ATOM 1888 CB GLN A 123 9.364 -13.680 4.712 1.00 0.00 C ATOM 1889 CG GLN A 123 10.132 -14.773 3.979 1.00 0.00 C ATOM 1890 CD GLN A 123 11.575 -14.401 3.705 1.00 0.00 C ATOM 1891 OE1 GLN A 123 11.864 -13.318 3.205 1.00 0.00 O ATOM 1892 NE2 GLN A 123 12.487 -15.303 4.024 1.00 0.00 N ATOM 1893 H GLN A 123 7.671 -12.255 6.167 1.00 0.00 H ATOM 1894 HA GLN A 123 7.676 -14.948 5.059 1.00 0.00 H ATOM 1895 HB2 GLN A 123 8.922 -13.019 3.975 1.00 0.00 H ATOM 1896 HB3 GLN A 123 10.066 -13.121 5.311 1.00 0.00 H ATOM 1897 HG2 GLN A 123 10.121 -15.664 4.588 1.00 0.00 H ATOM 1898 HG3 GLN A 123 9.643 -14.980 3.036 1.00 0.00 H ATOM 1899 HE21 GLN A 123 12.185 -16.148 4.415 1.00 0.00 H ATOM 1900 HE22 GLN A 123 13.427 -15.087 3.858 1.00 0.00 H ATOM 1901 N GLU A 124 8.559 -16.245 6.949 1.00 0.00 N ATOM 1902 CA GLU A 124 9.074 -17.088 8.026 1.00 0.00 C ATOM 1903 C GLU A 124 9.833 -18.290 7.456 1.00 0.00 C ATOM 1904 O GLU A 124 10.339 -18.266 6.315 1.00 0.00 O ATOM 1905 CB GLU A 124 7.905 -17.558 8.905 1.00 0.00 C ATOM 1906 CG GLU A 124 8.262 -17.857 10.358 1.00 0.00 C ATOM 1907 CD GLU A 124 9.141 -19.083 10.540 1.00 0.00 C ATOM 1908 OE1 GLU A 124 10.312 -19.055 10.109 1.00 0.00 O ATOM 1909 OE2 GLU A 124 8.655 -20.074 11.123 1.00 0.00 O ATOM 1910 H GLU A 124 7.944 -16.641 6.294 1.00 0.00 H ATOM 1911 HA GLU A 124 9.758 -16.505 8.622 1.00 0.00 H ATOM 1912 HB2 GLU A 124 7.155 -16.783 8.912 1.00 0.00 H ATOM 1913 HB3 GLU A 124 7.477 -18.453 8.471 1.00 0.00 H ATOM 1914 HG2 GLU A 124 8.763 -17.003 10.782 1.00 0.00 H ATOM 1915 HG3 GLU A 124 7.342 -18.022 10.898 1.00 0.00 H TER 1916 GLU A 124 HETATM 1917 BE BEF A 125 -3.019 10.866 1.585 1.00 0.00 BE HETATM 1918 F1 BEF A 125 -4.497 10.939 1.500 1.00 0.00 F HETATM 1919 F2 BEF A 125 -2.444 12.222 1.414 1.00 0.00 F HETATM 1920 F3 BEF A 125 -2.620 10.346 2.913 1.00 0.00 F CONECT 806 1917 CONECT 1917 806 1918 1919 1920 CONECT 1918 1917 CONECT 1919 1917 CONECT 1920 1917 MASTER 159 0 1 5 5 0 2 6 1919 1 5 10 END