USER MOD reduce.3.24.130724 H: found=0, std=0, add=864, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 861 hydrogens (0 hets) HEADER STRUCTURAL GENOMICS, UNKNOWN FUNCTION 14-AUG-01 1JRM TITLE NMR STRUCTURE OF MTH0637. ONTARIO CENTRE FOR STRUCTURAL TITLE 2 PROTEOMICS TARGET MTH0637_1_104; NORTHEAST STRUCTURAL TITLE 3 GENOMICS TARGET TT135 COMPND MOL_ID: 1; COMPND 2 MOLECULE: CONSERVED HYPOTHETICAL PROTEIN MTH637; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: MTH0637; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: METHANOTHERMOBACTER SOURCE 3 THERMAUTOTROPHICUS; SOURCE 4 ORGANISM_TAXID: 145262; SOURCE 5 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 6 EXPRESSION_SYSTEM_TAXID: 562 KEYWDS ALPHA-BETA PROTEIN, STRUCTURAL GENOMICS, OCSP, NESG, KEYWDS 2 PROTEIN STRUCTURE INITIATIVE, PSI, NORTHEAST STRUCTURAL KEYWDS 3 GENOMICS CONSORTIUM, UNKNOWN FUNCTION EXPDTA SOLUTION NMR AUTHOR A.PINEDA-LUCENA,NORTHEAST STRUCTURAL GENOMICS CONSORTIUM AUTHOR 2 (NESG) REVDAT 5 24-FEB-09 1JRM 1 VERSN REVDAT 4 25-JAN-05 1JRM 1 AUTHOR KEYWDS REVDAT 3 12-OCT-04 1JRM 1 TITLE KEYWDS REMARK REVDAT 2 01-APR-03 1JRM 1 JRNL REVDAT 1 27-FEB-02 1JRM 0 JRNL AUTH A.YEE,X.CHANG,A.PINEDA-LUCENA,B.WU,A.SEMESI,B.LE, JRNL AUTH 2 T.RAMELOT,G.M.LEE,S.BHATTACHARYYA,P.GUTIERREZ, JRNL AUTH 3 A.DENISOV,C.H.LEE,J.R.CORT,G.KOZLOV,J.LIAO,G.FINAK, JRNL AUTH 4 L.CHEN,D.WISHART,W.LEE,L.P.MCINTOSH,K.GEHRING, JRNL AUTH 5 M.A.KENNEDY,A.M.EDWARDS,C.H.ARROWSMITH JRNL TITL AN NMR APPROACH TO STRUCTURAL PROTEOMICS. JRNL REF PROC.NATL.ACAD.SCI.USA V. 99 1825 2002 JRNL REFN ISSN 0027-8424 JRNL PMID 11854485 JRNL DOI 10.1073/PNAS.042684599 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : DYANA VER 1.5 REMARK 3 AUTHORS : GUENTERT REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 1JRM COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 16-AUG-01. REMARK 100 THE RCSB ID CODE IS RCSB014109. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298 REMARK 210 PH : 6.5 REMARK 210 IONIC STRENGTH : 450 REMARK 210 PRESSURE : AMBIENT REMARK 210 SAMPLE CONTENTS : 1MM MTH0637 U-15N,13C; 25MM REMARK 210 PHOSPHATE BUFFER, 450 MM NACL, REMARK 210 10 MM DTT, 20 UM ZN2+, 1 MM REMARK 210 BENZAMIDINE, PH 6.5 REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : HNCACB, CBCA(CO)NH, CCC-TOCSY REMARK 210 -NNH, HCCH-TOCSY, 3D_13C- REMARK 210 SEPARATED_NOESY, 3D_15N- REMARK 210 SEPARATED_NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 600 MHZ REMARK 210 SPECTROMETER MODEL : INOVA REMARK 210 SPECTROMETER MANUFACTURER : VARIAN REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NMRPIPE VER 1.8, REMARK 210 2001.030.21.27, DYANA VER 1.5 REMARK 210 METHOD USED : TORSION ANGLE DYNAMICS REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 20 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : TARGET FUNCTION REMARK 210 REMARK 210 BEST REPRESENTATIVE CONFORMER IN THIS ENSEMBLE : 1 REMARK 210 REMARK 210 REMARK: THE STRUCTURE WAS DETERMINED USING TRIPLE-RESONANCE NMR REMARK 210 SPECTROSCOPY. 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: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 N VAL A 71 O THR A 80 2.10 REMARK 500 N ARG A 8 O LEU A 15 2.13 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 THR A 3 25.53 -168.29 REMARK 500 CYS A 6 -27.97 170.44 REMARK 500 VAL A 20 89.74 -67.29 REMARK 500 SER A 21 132.63 -177.38 REMARK 500 PRO A 22 -93.50 -74.99 REMARK 500 ALA A 23 120.14 176.05 REMARK 500 LYS A 26 105.96 69.82 REMARK 500 PHE A 27 104.78 -38.76 REMARK 500 LYS A 37 24.02 44.58 REMARK 500 HIS A 44 -168.17 -72.30 REMARK 500 GLN A 48 5.44 -68.86 REMARK 500 VAL A 71 -143.34 -102.99 REMARK 500 SER A 72 -118.57 50.04 REMARK 500 ARG A 77 -47.01 71.35 REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: TT135 RELATED DB: TARGETDB DBREF 1JRM A 1 104 UNP O26734 Y637_METTH 1 104 SEQADV 1JRM VAL A 1 UNP O26734 MET 1 CLONING ARTIFACT SEQRES 1 A 104 VAL ILE THR MET ASP CYS LEU ARG GLU VAL GLY ASP ASP SEQRES 2 A 104 LEU LEU VAL ASN ILE GLU VAL SER PRO ALA SER GLY LYS SEQRES 3 A 104 PHE GLY ILE PRO SER TYR ASN GLU TRP ARG LYS ARG ILE SEQRES 4 A 104 GLU VAL LYS ILE HIS SER PRO PRO GLN LYS GLY LYS ALA SEQRES 5 A 104 ASN ARG GLU ILE ILE LYS GLU PHE SER GLU THR PHE GLY SEQRES 6 A 104 ARG ASP VAL GLU ILE VAL SER GLY GLN LYS SER ARG GLN SEQRES 7 A 104 LYS THR ILE ARG ILE GLN GLY MET GLY ARG ASP LEU PHE SEQRES 8 A 104 LEU LYS LEU VAL SER GLU LYS PHE GLY LEU GLU ILE PRO HELIX 1 1 LYS A 51 GLY A 65 1 15 HELIX 2 2 GLY A 73 SER A 76 5 4 HELIX 3 3 GLY A 87 LYS A 98 1 12 SHEET 1 A 4 LEU A 7 VAL A 10 0 SHEET 2 A 4 ASP A 13 GLU A 19 -1 O LEU A 15 N ARG A 8 SHEET 3 A 4 GLN A 78 GLN A 84 -1 O ILE A 83 N LEU A 14 SHEET 4 A 4 ASP A 67 ILE A 70 -1 N GLU A 69 O ARG A 82 CRYST1 1.000 1.000 1.000 90.00 90.00 90.00 P 1 1 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 1.000000 0.000000 0.000000 0.00000 SCALE2 0.000000 1.000000 0.000000 0.00000 SCALE3 0.000000 0.000000 1.000000 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 17 ASN :FLIP amide:sc= -1.66! C(o=-5!,f=-3.5!) USER MOD Set 1.2: A 80 THR OG1 : rot -144:sc= -1.83! USER MOD Single : A 1 VAL N :NH3+ -159:sc= -0.201 (180deg=-1.31) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.193 USER MOD Single : A 4 MET CE :methyl -107:sc= -0.339 (180deg=-2.1!) USER MOD Single : A 6 CYS SG : rot -110:sc= -13.7! USER MOD Single : A 21 SER OG : rot -170:sc= -2.55 USER MOD Single : A 24 SER OG : rot 180:sc= -1.15! USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot -130:sc= -0.649 USER MOD Single : A 32 TYR OH : rot -15:sc= -0.81 USER MOD Single : A 33 ASN : amide:sc= -0.36 K(o=-0.36,f=-1.7!) USER MOD Single : A 37 LYS NZ :NH3+ -129:sc= -0.531 (180deg=-1.18) USER MOD Single : A 42 LYS NZ :NH3+ 160:sc= 0.35! (180deg=-0.561!) USER MOD Single : A 44 HIS : no HD1:sc= 0 X(o=0,f=-0.021) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.394 K(o=-0.39,f=-3.2!) USER MOD Single : A 49 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00341) USER MOD Single : A 51 LYS NZ :NH3+ -111:sc= -0.709 (180deg=-2.3!) USER MOD Single : A 53 ASN : amide:sc= -14.4! C(o=-14!,f=-20!) USER MOD Single : A 58 LYS NZ :NH3+ -150:sc= 0 (180deg=-0.00832) USER MOD Single : A 61 SER OG : rot 53:sc= 0.566 USER MOD Single : A 63 THR OG1 : rot 150:sc= -0.972 USER MOD Single : A 72 SER OG : rot 160:sc= -0.773! USER MOD Single : A 74 GLN : amide:sc=-0.00193 X(o=-0.0019,f=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 78 GLN : amide:sc= -3.26! C(o=-3.3!,f=-4.6!) USER MOD Single : A 79 LYS NZ :NH3+ -144:sc= -9.07! (180deg=-12.8!) USER MOD Single : A 84 GLN :FLIP amide:sc= 0.605 F(o=-0.7,f=0.61) USER MOD Single : A 86 MET CE :methyl -119:sc= -17.9! (180deg=-28.5!) USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 1.325 0.000 0.000 1.00 0.00 N ATOM 2 CA VAL A 1 2.073 0.000 -1.245 1.00 0.00 C ATOM 3 C VAL A 1 1.198 0.574 -2.361 1.00 0.00 C ATOM 4 O VAL A 1 0.154 1.167 -2.093 1.00 0.00 O ATOM 5 CB VAL A 1 2.582 -1.410 -1.550 1.00 0.00 C ATOM 6 CG1 VAL A 1 3.068 -2.105 -0.277 1.00 0.00 C ATOM 7 CG2 VAL A 1 1.506 -2.242 -2.252 1.00 0.00 C ATOM 0 H1 VAL A 1 1.986 -0.041 0.802 1.00 0.00 H new ATOM 0 H2 VAL A 1 0.757 0.869 0.064 1.00 0.00 H new ATOM 0 H3 VAL A 1 0.696 -0.828 0.027 1.00 0.00 H new ATOM 0 HA VAL A 1 2.953 0.638 -1.161 1.00 0.00 H new ATOM 0 HB VAL A 1 3.431 -1.320 -2.228 1.00 0.00 H new ATOM 0 HG11 VAL A 1 3.424 -3.105 -0.522 1.00 0.00 H new ATOM 0 HG12 VAL A 1 3.881 -1.528 0.165 1.00 0.00 H new ATOM 0 HG13 VAL A 1 2.246 -2.177 0.435 1.00 0.00 H new ATOM 0 HG21 VAL A 1 1.894 -3.240 -2.457 1.00 0.00 H new ATOM 0 HG22 VAL A 1 0.629 -2.319 -1.610 1.00 0.00 H new ATOM 0 HG23 VAL A 1 1.228 -1.761 -3.190 1.00 0.00 H new ATOM 17 N ILE A 2 1.655 0.377 -3.589 1.00 0.00 N ATOM 18 CA ILE A 2 0.927 0.868 -4.747 1.00 0.00 C ATOM 19 C ILE A 2 0.208 -0.300 -5.425 1.00 0.00 C ATOM 20 O ILE A 2 0.851 -1.216 -5.936 1.00 0.00 O ATOM 21 CB ILE A 2 1.862 1.640 -5.680 1.00 0.00 C ATOM 22 CG1 ILE A 2 2.080 3.069 -5.179 1.00 0.00 C ATOM 23 CG2 ILE A 2 1.346 1.610 -7.120 1.00 0.00 C ATOM 24 CD1 ILE A 2 2.842 3.902 -6.211 1.00 0.00 C ATOM 0 H ILE A 2 2.521 -0.116 -3.807 1.00 0.00 H new ATOM 0 HA ILE A 2 0.161 1.580 -4.441 1.00 0.00 H new ATOM 0 HB ILE A 2 2.834 1.146 -5.675 1.00 0.00 H new ATOM 0 HG12 ILE A 2 1.117 3.535 -4.969 1.00 0.00 H new ATOM 0 HG13 ILE A 2 2.635 3.049 -4.241 1.00 0.00 H new ATOM 0 HG21 ILE A 2 2.029 2.166 -7.763 1.00 0.00 H new ATOM 0 HG22 ILE A 2 1.285 0.577 -7.463 1.00 0.00 H new ATOM 0 HG23 ILE A 2 0.357 2.066 -7.162 1.00 0.00 H new ATOM 0 HD11 ILE A 2 2.983 4.913 -5.830 1.00 0.00 H new ATOM 0 HD12 ILE A 2 3.814 3.446 -6.400 1.00 0.00 H new ATOM 0 HD13 ILE A 2 2.272 3.941 -7.140 1.00 0.00 H new ATOM 36 N THR A 3 -1.114 -0.230 -5.407 1.00 0.00 N ATOM 37 CA THR A 3 -1.927 -1.271 -6.014 1.00 0.00 C ATOM 38 C THR A 3 -3.385 -0.818 -6.115 1.00 0.00 C ATOM 39 O THR A 3 -4.295 -1.645 -6.146 1.00 0.00 O ATOM 40 CB THR A 3 -1.744 -2.551 -5.196 1.00 0.00 C ATOM 41 OG1 THR A 3 -1.379 -2.085 -3.899 1.00 0.00 O ATOM 42 CG2 THR A 3 -0.535 -3.369 -5.652 1.00 0.00 C ATOM 0 H THR A 3 -1.643 0.531 -4.982 1.00 0.00 H new ATOM 0 HA THR A 3 -1.611 -1.474 -7.037 1.00 0.00 H new ATOM 0 HB THR A 3 -2.644 -3.161 -5.271 1.00 0.00 H new ATOM 0 HG1 THR A 3 -1.242 -2.851 -3.303 1.00 0.00 H new ATOM 0 HG21 THR A 3 -0.451 -4.266 -5.039 1.00 0.00 H new ATOM 0 HG22 THR A 3 -0.661 -3.654 -6.697 1.00 0.00 H new ATOM 0 HG23 THR A 3 0.370 -2.771 -5.546 1.00 0.00 H new ATOM 50 N MET A 4 -3.561 0.495 -6.164 1.00 0.00 N ATOM 51 CA MET A 4 -4.893 1.068 -6.261 1.00 0.00 C ATOM 52 C MET A 4 -5.064 1.839 -7.571 1.00 0.00 C ATOM 53 O MET A 4 -4.081 2.192 -8.221 1.00 0.00 O ATOM 54 CB MET A 4 -5.131 2.009 -5.079 1.00 0.00 C ATOM 55 CG MET A 4 -4.865 1.300 -3.750 1.00 0.00 C ATOM 56 SD MET A 4 -6.263 0.281 -3.311 1.00 0.00 S ATOM 57 CE MET A 4 -5.466 -1.313 -3.210 1.00 0.00 C ATOM 0 H MET A 4 -2.804 1.178 -6.138 1.00 0.00 H new ATOM 0 HA MET A 4 -5.620 0.256 -6.242 1.00 0.00 H new ATOM 0 HB2 MET A 4 -4.481 2.880 -5.167 1.00 0.00 H new ATOM 0 HB3 MET A 4 -6.158 2.374 -5.101 1.00 0.00 H new ATOM 0 HG2 MET A 4 -3.968 0.686 -3.829 1.00 0.00 H new ATOM 0 HG3 MET A 4 -4.680 2.035 -2.967 1.00 0.00 H new ATOM 0 HE1 MET A 4 -5.753 -1.918 -4.070 1.00 0.00 H new ATOM 0 HE2 MET A 4 -4.384 -1.179 -3.205 1.00 0.00 H new ATOM 0 HE3 MET A 4 -5.773 -1.816 -2.293 1.00 0.00 H new ATOM 67 N ASP A 5 -6.319 2.078 -7.921 1.00 0.00 N ATOM 68 CA ASP A 5 -6.631 2.801 -9.142 1.00 0.00 C ATOM 69 C ASP A 5 -6.886 4.273 -8.807 1.00 0.00 C ATOM 70 O ASP A 5 -6.901 4.653 -7.638 1.00 0.00 O ATOM 71 CB ASP A 5 -7.892 2.243 -9.806 1.00 0.00 C ATOM 72 CG ASP A 5 -8.515 1.038 -9.099 1.00 0.00 C ATOM 73 OD1 ASP A 5 -7.824 -0.002 -9.033 1.00 0.00 O ATOM 74 OD2 ASP A 5 -9.669 1.184 -8.640 1.00 0.00 O ATOM 0 H ASP A 5 -7.132 1.784 -7.380 1.00 0.00 H new ATOM 0 HA ASP A 5 -5.787 2.693 -9.823 1.00 0.00 H new ATOM 0 HB2 ASP A 5 -8.637 3.037 -9.863 1.00 0.00 H new ATOM 0 HB3 ASP A 5 -7.650 1.959 -10.830 1.00 0.00 H new ATOM 79 N CYS A 6 -7.078 5.060 -9.855 1.00 0.00 N ATOM 80 CA CYS A 6 -7.331 6.481 -9.687 1.00 0.00 C ATOM 81 C CYS A 6 -7.270 7.146 -11.064 1.00 0.00 C ATOM 82 O CYS A 6 -7.917 8.166 -11.294 1.00 0.00 O ATOM 83 CB CYS A 6 -6.348 7.118 -8.703 1.00 0.00 C ATOM 84 SG CYS A 6 -4.777 7.513 -9.554 1.00 0.00 S ATOM 0 H CYS A 6 -7.063 4.741 -10.824 1.00 0.00 H new ATOM 0 HA CYS A 6 -8.322 6.628 -9.257 1.00 0.00 H new ATOM 0 HB2 CYS A 6 -6.780 8.025 -8.281 1.00 0.00 H new ATOM 0 HB3 CYS A 6 -6.160 6.438 -7.872 1.00 0.00 H new ATOM 0 HG CYS A 6 -3.841 6.718 -9.128 1.00 0.00 H new ATOM 90 N LEU A 7 -6.487 6.539 -11.945 1.00 0.00 N ATOM 91 CA LEU A 7 -6.334 7.060 -13.293 1.00 0.00 C ATOM 92 C LEU A 7 -7.476 6.540 -14.168 1.00 0.00 C ATOM 93 O LEU A 7 -7.764 5.344 -14.174 1.00 0.00 O ATOM 94 CB LEU A 7 -4.943 6.732 -13.838 1.00 0.00 C ATOM 95 CG LEU A 7 -4.225 5.552 -13.180 1.00 0.00 C ATOM 96 CD1 LEU A 7 -3.179 4.952 -14.122 1.00 0.00 C ATOM 97 CD2 LEU A 7 -3.618 5.960 -11.836 1.00 0.00 C ATOM 0 H LEU A 7 -5.952 5.692 -11.751 1.00 0.00 H new ATOM 0 HA LEU A 7 -6.403 8.148 -13.292 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -5.032 6.528 -14.905 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -4.316 7.617 -13.733 1.00 0.00 H new ATOM 0 HG LEU A 7 -4.961 4.774 -12.978 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -2.683 4.115 -13.630 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -3.667 4.601 -15.031 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -2.440 5.712 -14.377 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -3.114 5.103 -11.389 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -2.899 6.764 -11.991 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -4.409 6.304 -11.169 1.00 0.00 H new ATOM 109 N ARG A 8 -8.096 7.465 -14.887 1.00 0.00 N ATOM 110 CA ARG A 8 -9.200 7.115 -15.764 1.00 0.00 C ATOM 111 C ARG A 8 -8.779 7.255 -17.229 1.00 0.00 C ATOM 112 O ARG A 8 -8.343 8.323 -17.653 1.00 0.00 O ATOM 113 CB ARG A 8 -10.415 8.007 -15.503 1.00 0.00 C ATOM 114 CG ARG A 8 -11.717 7.214 -15.638 1.00 0.00 C ATOM 115 CD ARG A 8 -12.934 8.136 -15.545 1.00 0.00 C ATOM 116 NE ARG A 8 -13.225 8.447 -14.127 1.00 0.00 N ATOM 117 CZ ARG A 8 -12.645 9.442 -13.442 1.00 0.00 C ATOM 118 NH1 ARG A 8 -11.739 10.228 -14.040 1.00 0.00 N ATOM 119 NH2 ARG A 8 -12.971 9.651 -12.159 1.00 0.00 N ATOM 0 H ARG A 8 -7.854 8.456 -14.880 1.00 0.00 H new ATOM 0 HA ARG A 8 -9.472 6.080 -15.557 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -10.348 8.435 -14.503 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -10.417 8.839 -16.207 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -11.728 6.687 -16.592 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -11.769 6.458 -14.855 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -12.746 9.057 -16.097 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -13.799 7.659 -16.006 1.00 0.00 H new ATOM 0 HE ARG A 8 -13.910 7.868 -13.641 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -11.491 10.069 -15.017 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -11.298 10.985 -13.519 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -13.661 9.053 -11.704 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -12.530 10.408 -11.637 1.00 0.00 H new ATOM 133 N GLU A 9 -8.925 6.160 -17.960 1.00 0.00 N ATOM 134 CA GLU A 9 -8.566 6.147 -19.368 1.00 0.00 C ATOM 135 C GLU A 9 -9.702 6.729 -20.211 1.00 0.00 C ATOM 136 O GLU A 9 -10.728 6.081 -20.410 1.00 0.00 O ATOM 137 CB GLU A 9 -8.210 4.732 -19.830 1.00 0.00 C ATOM 138 CG GLU A 9 -6.868 4.717 -20.565 1.00 0.00 C ATOM 139 CD GLU A 9 -6.882 3.702 -21.710 1.00 0.00 C ATOM 140 OE1 GLU A 9 -7.277 2.547 -21.440 1.00 0.00 O ATOM 141 OE2 GLU A 9 -6.499 4.104 -22.830 1.00 0.00 O ATOM 0 H GLU A 9 -9.287 5.275 -17.604 1.00 0.00 H new ATOM 0 HA GLU A 9 -7.683 6.771 -19.503 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -8.165 4.065 -18.969 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -8.993 4.352 -20.487 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -6.653 5.711 -20.958 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -6.069 4.471 -19.866 1.00 0.00 H new ATOM 148 N VAL A 10 -9.480 7.947 -20.684 1.00 0.00 N ATOM 149 CA VAL A 10 -10.472 8.625 -21.501 1.00 0.00 C ATOM 150 C VAL A 10 -9.814 9.115 -22.793 1.00 0.00 C ATOM 151 O VAL A 10 -9.077 10.100 -22.783 1.00 0.00 O ATOM 152 CB VAL A 10 -11.130 9.750 -20.700 1.00 0.00 C ATOM 153 CG1 VAL A 10 -12.337 10.321 -21.447 1.00 0.00 C ATOM 154 CG2 VAL A 10 -11.526 9.270 -19.303 1.00 0.00 C ATOM 0 H VAL A 10 -8.628 8.482 -20.517 1.00 0.00 H new ATOM 0 HA VAL A 10 -11.269 7.937 -21.783 1.00 0.00 H new ATOM 0 HB VAL A 10 -10.399 10.550 -20.584 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -12.786 11.119 -20.856 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -12.014 10.719 -22.409 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -13.071 9.532 -21.609 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -11.991 10.089 -18.755 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -12.232 8.444 -19.389 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -10.638 8.934 -18.768 1.00 0.00 H new ATOM 164 N GLY A 11 -10.105 8.406 -23.873 1.00 0.00 N ATOM 165 CA GLY A 11 -9.550 8.757 -25.170 1.00 0.00 C ATOM 166 C GLY A 11 -8.024 8.847 -25.108 1.00 0.00 C ATOM 167 O GLY A 11 -7.388 8.135 -24.332 1.00 0.00 O ATOM 0 H GLY A 11 -10.718 7.590 -23.877 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -9.844 8.012 -25.909 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -9.961 9.711 -25.499 1.00 0.00 H new ATOM 171 N ASP A 12 -7.481 9.727 -25.936 1.00 0.00 N ATOM 172 CA ASP A 12 -6.042 9.919 -25.984 1.00 0.00 C ATOM 173 C ASP A 12 -5.588 10.662 -24.727 1.00 0.00 C ATOM 174 O ASP A 12 -4.435 11.081 -24.631 1.00 0.00 O ATOM 175 CB ASP A 12 -5.639 10.756 -27.200 1.00 0.00 C ATOM 176 CG ASP A 12 -4.740 10.039 -28.210 1.00 0.00 C ATOM 177 OD1 ASP A 12 -3.970 9.162 -27.762 1.00 0.00 O ATOM 178 OD2 ASP A 12 -4.844 10.385 -29.407 1.00 0.00 O ATOM 0 H ASP A 12 -8.012 10.315 -26.579 1.00 0.00 H new ATOM 0 HA ASP A 12 -5.573 8.937 -26.050 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -6.544 11.085 -27.711 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.126 11.652 -26.851 1.00 0.00 H new ATOM 183 N ASP A 13 -6.518 10.804 -23.794 1.00 0.00 N ATOM 184 CA ASP A 13 -6.227 11.490 -22.546 1.00 0.00 C ATOM 185 C ASP A 13 -6.501 10.545 -21.374 1.00 0.00 C ATOM 186 O ASP A 13 -7.162 9.521 -21.539 1.00 0.00 O ATOM 187 CB ASP A 13 -7.116 12.724 -22.376 1.00 0.00 C ATOM 188 CG ASP A 13 -6.962 13.787 -23.466 1.00 0.00 C ATOM 189 OD1 ASP A 13 -6.172 13.531 -24.400 1.00 0.00 O ATOM 190 OD2 ASP A 13 -7.638 14.830 -23.340 1.00 0.00 O ATOM 0 H ASP A 13 -7.473 10.456 -23.877 1.00 0.00 H new ATOM 0 HA ASP A 13 -5.182 11.798 -22.566 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -8.157 12.402 -22.348 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -6.897 13.181 -21.411 1.00 0.00 H new ATOM 195 N LEU A 14 -5.980 10.923 -20.216 1.00 0.00 N ATOM 196 CA LEU A 14 -6.160 10.122 -19.017 1.00 0.00 C ATOM 197 C LEU A 14 -6.438 11.046 -17.830 1.00 0.00 C ATOM 198 O LEU A 14 -5.824 12.105 -17.705 1.00 0.00 O ATOM 199 CB LEU A 14 -4.961 9.195 -18.808 1.00 0.00 C ATOM 200 CG LEU A 14 -4.461 9.060 -17.368 1.00 0.00 C ATOM 201 CD1 LEU A 14 -4.202 10.434 -16.747 1.00 0.00 C ATOM 202 CD2 LEU A 14 -5.428 8.224 -16.528 1.00 0.00 C ATOM 0 H LEU A 14 -5.433 11.774 -20.082 1.00 0.00 H new ATOM 0 HA LEU A 14 -7.025 9.467 -19.121 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -5.226 8.203 -19.174 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -4.138 9.554 -19.426 1.00 0.00 H new ATOM 0 HG LEU A 14 -3.509 8.530 -17.385 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -3.848 10.310 -15.724 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -3.447 10.961 -17.331 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -5.126 11.012 -16.743 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -5.049 8.144 -15.509 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -6.407 8.704 -16.514 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -5.518 7.228 -16.961 1.00 0.00 H new ATOM 214 N LEU A 15 -7.364 10.611 -16.987 1.00 0.00 N ATOM 215 CA LEU A 15 -7.731 11.385 -15.814 1.00 0.00 C ATOM 216 C LEU A 15 -7.259 10.653 -14.557 1.00 0.00 C ATOM 217 O LEU A 15 -7.447 9.444 -14.431 1.00 0.00 O ATOM 218 CB LEU A 15 -9.230 11.691 -15.821 1.00 0.00 C ATOM 219 CG LEU A 15 -9.655 12.945 -16.588 1.00 0.00 C ATOM 220 CD1 LEU A 15 -10.854 12.654 -17.492 1.00 0.00 C ATOM 221 CD2 LEU A 15 -9.928 14.107 -15.630 1.00 0.00 C ATOM 0 H LEU A 15 -7.871 9.732 -17.094 1.00 0.00 H new ATOM 0 HA LEU A 15 -7.231 12.354 -15.826 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -9.754 10.835 -16.246 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -9.565 11.790 -14.789 1.00 0.00 H new ATOM 0 HG LEU A 15 -8.830 13.247 -17.234 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -11.136 13.562 -18.026 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -10.588 11.878 -18.210 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -11.693 12.314 -16.885 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -10.228 14.986 -16.200 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -10.727 13.831 -14.942 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -9.024 14.333 -15.065 1.00 0.00 H new ATOM 233 N VAL A 16 -6.654 11.416 -13.658 1.00 0.00 N ATOM 234 CA VAL A 16 -6.153 10.854 -12.415 1.00 0.00 C ATOM 235 C VAL A 16 -6.600 11.735 -11.246 1.00 0.00 C ATOM 236 O VAL A 16 -6.667 12.956 -11.374 1.00 0.00 O ATOM 237 CB VAL A 16 -4.635 10.687 -12.490 1.00 0.00 C ATOM 238 CG1 VAL A 16 -4.192 9.385 -11.819 1.00 0.00 C ATOM 239 CG2 VAL A 16 -4.148 10.750 -13.939 1.00 0.00 C ATOM 0 H VAL A 16 -6.500 12.418 -13.766 1.00 0.00 H new ATOM 0 HA VAL A 16 -6.568 9.860 -12.251 1.00 0.00 H new ATOM 0 HB VAL A 16 -4.180 11.515 -11.947 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -3.108 9.291 -11.887 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -4.491 9.396 -10.771 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -4.661 8.539 -12.321 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -3.065 10.629 -13.964 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -4.616 9.952 -14.515 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -4.415 11.714 -14.371 1.00 0.00 H new ATOM 249 N ASN A 17 -6.895 11.080 -10.132 1.00 0.00 N ATOM 250 CA ASN A 17 -7.333 11.788 -8.942 1.00 0.00 C ATOM 251 C ASN A 17 -6.143 11.980 -8.000 1.00 0.00 C ATOM 252 O ASN A 17 -5.620 11.012 -7.449 1.00 0.00 O ATOM 253 CB ASN A 17 -8.405 10.994 -8.192 1.00 0.00 C ATOM 254 CG ASN A 17 -9.788 11.619 -8.388 1.00 0.00 C ATOM 255 OD1 ASN A 17 -10.435 11.176 -9.462 1.00 0.00 O flip ATOM 256 ND2 ASN A 17 -10.237 12.450 -7.615 1.00 0.00 N flip ATOM 0 H ASN A 17 -6.839 10.067 -10.029 1.00 0.00 H new ATOM 0 HA ASN A 17 -7.746 12.747 -9.254 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -8.414 9.963 -8.547 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -8.163 10.963 -7.130 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -9.687 12.746 -6.809 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -11.162 12.848 -7.775 1.00 0.00 H new ATOM 263 N ILE A 18 -5.749 13.235 -7.844 1.00 0.00 N ATOM 264 CA ILE A 18 -4.630 13.567 -6.979 1.00 0.00 C ATOM 265 C ILE A 18 -4.714 15.043 -6.587 1.00 0.00 C ATOM 266 O ILE A 18 -5.682 15.724 -6.921 1.00 0.00 O ATOM 267 CB ILE A 18 -3.307 13.181 -7.643 1.00 0.00 C ATOM 268 CG1 ILE A 18 -2.960 14.147 -8.778 1.00 0.00 C ATOM 269 CG2 ILE A 18 -3.334 11.727 -8.117 1.00 0.00 C ATOM 270 CD1 ILE A 18 -1.551 14.717 -8.602 1.00 0.00 C ATOM 0 H ILE A 18 -6.185 14.035 -8.302 1.00 0.00 H new ATOM 0 HA ILE A 18 -4.677 12.989 -6.056 1.00 0.00 H new ATOM 0 HB ILE A 18 -2.516 13.262 -6.898 1.00 0.00 H new ATOM 0 HG12 ILE A 18 -3.030 13.629 -9.735 1.00 0.00 H new ATOM 0 HG13 ILE A 18 -3.685 14.961 -8.802 1.00 0.00 H new ATOM 0 HG21 ILE A 18 -2.381 11.479 -8.585 1.00 0.00 H new ATOM 0 HG22 ILE A 18 -3.501 11.069 -7.264 1.00 0.00 H new ATOM 0 HG23 ILE A 18 -4.139 11.595 -8.840 1.00 0.00 H new ATOM 0 HD11 ILE A 18 -1.330 15.400 -9.422 1.00 0.00 H new ATOM 0 HD12 ILE A 18 -1.492 15.255 -7.656 1.00 0.00 H new ATOM 0 HD13 ILE A 18 -0.826 13.903 -8.603 1.00 0.00 H new ATOM 282 N GLU A 19 -3.686 15.495 -5.883 1.00 0.00 N ATOM 283 CA GLU A 19 -3.631 16.878 -5.442 1.00 0.00 C ATOM 284 C GLU A 19 -2.957 17.748 -6.504 1.00 0.00 C ATOM 285 O GLU A 19 -2.282 17.235 -7.395 1.00 0.00 O ATOM 286 CB GLU A 19 -2.910 16.997 -4.098 1.00 0.00 C ATOM 287 CG GLU A 19 -1.639 17.839 -4.230 1.00 0.00 C ATOM 288 CD GLU A 19 -0.813 17.790 -2.943 1.00 0.00 C ATOM 289 OE1 GLU A 19 -0.230 16.715 -2.683 1.00 0.00 O ATOM 290 OE2 GLU A 19 -0.782 18.828 -2.248 1.00 0.00 O ATOM 0 H GLU A 19 -2.885 14.927 -5.607 1.00 0.00 H new ATOM 0 HA GLU A 19 -4.652 17.235 -5.303 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -3.576 17.450 -3.363 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -2.656 16.004 -3.729 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -1.041 17.473 -5.064 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -1.904 18.872 -4.457 1.00 0.00 H new ATOM 297 N VAL A 20 -3.163 19.051 -6.375 1.00 0.00 N ATOM 298 CA VAL A 20 -2.584 19.997 -7.314 1.00 0.00 C ATOM 299 C VAL A 20 -1.062 20.000 -7.154 1.00 0.00 C ATOM 300 O VAL A 20 -0.519 20.772 -6.366 1.00 0.00 O ATOM 301 CB VAL A 20 -3.209 21.379 -7.116 1.00 0.00 C ATOM 302 CG1 VAL A 20 -3.035 21.858 -5.673 1.00 0.00 C ATOM 303 CG2 VAL A 20 -2.625 22.391 -8.103 1.00 0.00 C ATOM 0 H VAL A 20 -3.723 19.474 -5.634 1.00 0.00 H new ATOM 0 HA VAL A 20 -2.803 19.700 -8.340 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.277 21.295 -7.315 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -3.488 22.843 -5.559 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -3.520 21.155 -4.995 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -1.973 21.918 -5.435 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -3.086 23.365 -7.941 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.549 22.469 -7.950 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -2.823 22.061 -9.123 1.00 0.00 H new ATOM 313 N SER A 21 -0.418 19.127 -7.914 1.00 0.00 N ATOM 314 CA SER A 21 1.030 19.019 -7.867 1.00 0.00 C ATOM 315 C SER A 21 1.512 17.985 -8.887 1.00 0.00 C ATOM 316 O SER A 21 0.970 16.883 -8.961 1.00 0.00 O ATOM 317 CB SER A 21 1.509 18.644 -6.463 1.00 0.00 C ATOM 318 OG SER A 21 0.941 17.416 -6.016 1.00 0.00 O ATOM 0 H SER A 21 -0.872 18.488 -8.566 1.00 0.00 H new ATOM 0 HA SER A 21 1.454 19.991 -8.118 1.00 0.00 H new ATOM 0 HB2 SER A 21 2.596 18.563 -6.460 1.00 0.00 H new ATOM 0 HB3 SER A 21 1.247 19.440 -5.766 1.00 0.00 H new ATOM 0 HG SER A 21 1.142 17.289 -5.065 1.00 0.00 H new ATOM 324 N PRO A 22 2.551 18.386 -9.666 1.00 0.00 N ATOM 325 CA PRO A 22 3.112 17.507 -10.678 1.00 0.00 C ATOM 326 C PRO A 22 3.969 16.412 -10.039 1.00 0.00 C ATOM 327 O PRO A 22 3.455 15.365 -9.648 1.00 0.00 O ATOM 328 CB PRO A 22 3.904 18.420 -11.598 1.00 0.00 C ATOM 329 CG PRO A 22 4.142 19.699 -10.812 1.00 0.00 C ATOM 330 CD PRO A 22 3.218 19.684 -9.606 1.00 0.00 C ATOM 0 HA PRO A 22 2.347 16.968 -11.237 1.00 0.00 H new ATOM 0 HB2 PRO A 22 4.848 17.959 -11.888 1.00 0.00 H new ATOM 0 HB3 PRO A 22 3.353 18.623 -12.516 1.00 0.00 H new ATOM 0 HG2 PRO A 22 5.183 19.764 -10.495 1.00 0.00 H new ATOM 0 HG3 PRO A 22 3.944 20.572 -11.434 1.00 0.00 H new ATOM 0 HD2 PRO A 22 3.777 19.799 -8.677 1.00 0.00 H new ATOM 0 HD3 PRO A 22 2.498 20.501 -9.648 1.00 0.00 H new ATOM 338 N ALA A 23 5.261 16.692 -9.952 1.00 0.00 N ATOM 339 CA ALA A 23 6.194 15.745 -9.367 1.00 0.00 C ATOM 340 C ALA A 23 7.617 16.294 -9.491 1.00 0.00 C ATOM 341 O ALA A 23 8.097 16.538 -10.597 1.00 0.00 O ATOM 342 CB ALA A 23 6.033 14.383 -10.046 1.00 0.00 C ATOM 0 H ALA A 23 5.684 17.562 -10.277 1.00 0.00 H new ATOM 0 HA ALA A 23 5.985 15.607 -8.306 1.00 0.00 H new ATOM 0 HB1 ALA A 23 6.733 13.672 -9.607 1.00 0.00 H new ATOM 0 HB2 ALA A 23 5.014 14.024 -9.903 1.00 0.00 H new ATOM 0 HB3 ALA A 23 6.237 14.482 -11.112 1.00 0.00 H new ATOM 348 N SER A 24 8.251 16.472 -8.342 1.00 0.00 N ATOM 349 CA SER A 24 9.609 16.988 -8.308 1.00 0.00 C ATOM 350 C SER A 24 10.593 15.900 -8.746 1.00 0.00 C ATOM 351 O SER A 24 10.183 14.841 -9.218 1.00 0.00 O ATOM 352 CB SER A 24 9.970 17.498 -6.912 1.00 0.00 C ATOM 353 OG SER A 24 11.235 17.009 -6.475 1.00 0.00 O ATOM 0 H SER A 24 7.849 16.268 -7.427 1.00 0.00 H new ATOM 0 HA SER A 24 9.673 17.828 -9.000 1.00 0.00 H new ATOM 0 HB2 SER A 24 9.985 18.588 -6.917 1.00 0.00 H new ATOM 0 HB3 SER A 24 9.199 17.193 -6.204 1.00 0.00 H new ATOM 0 HG SER A 24 11.430 17.359 -5.580 1.00 0.00 H new ATOM 359 N GLY A 25 11.872 16.200 -8.575 1.00 0.00 N ATOM 360 CA GLY A 25 12.917 15.262 -8.946 1.00 0.00 C ATOM 361 C GLY A 25 12.374 13.832 -9.007 1.00 0.00 C ATOM 362 O GLY A 25 11.998 13.264 -7.983 1.00 0.00 O ATOM 0 H GLY A 25 12.208 17.080 -8.184 1.00 0.00 H new ATOM 0 HA2 GLY A 25 13.332 15.539 -9.915 1.00 0.00 H new ATOM 0 HA3 GLY A 25 13.732 15.315 -8.224 1.00 0.00 H new ATOM 366 N LYS A 26 12.351 13.293 -10.217 1.00 0.00 N ATOM 367 CA LYS A 26 11.860 11.941 -10.424 1.00 0.00 C ATOM 368 C LYS A 26 10.347 11.912 -10.200 1.00 0.00 C ATOM 369 O LYS A 26 9.883 11.980 -9.063 1.00 0.00 O ATOM 370 CB LYS A 26 12.631 10.951 -9.547 1.00 0.00 C ATOM 371 CG LYS A 26 13.914 10.488 -10.241 1.00 0.00 C ATOM 372 CD LYS A 26 14.985 10.111 -9.216 1.00 0.00 C ATOM 373 CE LYS A 26 15.807 8.914 -9.697 1.00 0.00 C ATOM 374 NZ LYS A 26 17.191 8.993 -9.177 1.00 0.00 N ATOM 0 H LYS A 26 12.664 13.768 -11.064 1.00 0.00 H new ATOM 0 HA LYS A 26 12.036 11.625 -11.452 1.00 0.00 H new ATOM 0 HB2 LYS A 26 12.877 11.419 -8.594 1.00 0.00 H new ATOM 0 HB3 LYS A 26 12.002 10.089 -9.326 1.00 0.00 H new ATOM 0 HG2 LYS A 26 13.698 9.631 -10.879 1.00 0.00 H new ATOM 0 HG3 LYS A 26 14.288 11.281 -10.889 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.643 10.962 -9.042 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.513 9.873 -8.263 1.00 0.00 H new ATOM 0 HE2 LYS A 26 15.340 7.987 -9.364 1.00 0.00 H new ATOM 0 HE3 LYS A 26 15.822 8.890 -10.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.735 8.173 -9.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 17.639 9.868 -9.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 17.172 8.993 -8.137 1.00 0.00 H new ATOM 388 N PHE A 27 9.620 11.811 -11.303 1.00 0.00 N ATOM 389 CA PHE A 27 8.169 11.772 -11.241 1.00 0.00 C ATOM 390 C PHE A 27 7.693 10.947 -10.044 1.00 0.00 C ATOM 391 O PHE A 27 7.753 9.719 -10.068 1.00 0.00 O ATOM 392 CB PHE A 27 7.684 11.105 -12.530 1.00 0.00 C ATOM 393 CG PHE A 27 6.261 10.550 -12.446 1.00 0.00 C ATOM 394 CD1 PHE A 27 5.207 11.399 -12.311 1.00 0.00 C ATOM 395 CD2 PHE A 27 6.050 9.208 -12.507 1.00 0.00 C ATOM 396 CE1 PHE A 27 3.886 10.883 -12.233 1.00 0.00 C ATOM 397 CE2 PHE A 27 4.729 8.692 -12.429 1.00 0.00 C ATOM 398 CZ PHE A 27 3.675 9.541 -12.294 1.00 0.00 C ATOM 0 H PHE A 27 10.009 11.755 -12.244 1.00 0.00 H new ATOM 0 HA PHE A 27 7.774 12.782 -11.132 1.00 0.00 H new ATOM 0 HB2 PHE A 27 7.733 11.830 -13.343 1.00 0.00 H new ATOM 0 HB3 PHE A 27 8.365 10.293 -12.785 1.00 0.00 H new ATOM 0 HD1 PHE A 27 5.374 12.465 -12.263 1.00 0.00 H new ATOM 0 HD2 PHE A 27 6.887 8.534 -12.615 1.00 0.00 H new ATOM 0 HE1 PHE A 27 3.049 11.557 -12.125 1.00 0.00 H new ATOM 0 HE2 PHE A 27 4.562 7.626 -12.477 1.00 0.00 H new ATOM 0 HZ PHE A 27 2.670 9.149 -12.235 1.00 0.00 H new ATOM 408 N GLY A 28 7.230 11.656 -9.024 1.00 0.00 N ATOM 409 CA GLY A 28 6.744 11.005 -7.820 1.00 0.00 C ATOM 410 C GLY A 28 5.230 11.178 -7.676 1.00 0.00 C ATOM 411 O GLY A 28 4.765 12.176 -7.128 1.00 0.00 O ATOM 0 H GLY A 28 7.181 12.675 -9.007 1.00 0.00 H new ATOM 0 HA2 GLY A 28 6.991 9.944 -7.851 1.00 0.00 H new ATOM 0 HA3 GLY A 28 7.246 11.424 -6.948 1.00 0.00 H new ATOM 415 N ILE A 29 4.504 10.189 -8.177 1.00 0.00 N ATOM 416 CA ILE A 29 3.053 10.219 -8.112 1.00 0.00 C ATOM 417 C ILE A 29 2.524 8.791 -7.967 1.00 0.00 C ATOM 418 O ILE A 29 2.371 8.078 -8.958 1.00 0.00 O ATOM 419 CB ILE A 29 2.477 10.969 -9.315 1.00 0.00 C ATOM 420 CG1 ILE A 29 3.162 12.326 -9.494 1.00 0.00 C ATOM 421 CG2 ILE A 29 0.958 11.105 -9.201 1.00 0.00 C ATOM 422 CD1 ILE A 29 2.408 13.192 -10.505 1.00 0.00 C ATOM 0 H ILE A 29 4.894 9.362 -8.630 1.00 0.00 H new ATOM 0 HA ILE A 29 2.723 10.773 -7.233 1.00 0.00 H new ATOM 0 HB ILE A 29 2.681 10.384 -10.212 1.00 0.00 H new ATOM 0 HG12 ILE A 29 3.212 12.841 -8.535 1.00 0.00 H new ATOM 0 HG13 ILE A 29 4.188 12.178 -9.831 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.575 11.642 -10.069 1.00 0.00 H new ATOM 0 HG22 ILE A 29 0.506 10.114 -9.159 1.00 0.00 H new ATOM 0 HG23 ILE A 29 0.709 11.656 -8.294 1.00 0.00 H new ATOM 0 HD11 ILE A 29 2.916 14.150 -10.613 1.00 0.00 H new ATOM 0 HD12 ILE A 29 2.380 12.685 -11.469 1.00 0.00 H new ATOM 0 HD13 ILE A 29 1.390 13.359 -10.153 1.00 0.00 H new ATOM 434 N PRO A 30 2.252 8.405 -6.691 1.00 0.00 N ATOM 435 CA PRO A 30 1.743 7.075 -6.404 1.00 0.00 C ATOM 436 C PRO A 30 0.267 6.957 -6.791 1.00 0.00 C ATOM 437 O PRO A 30 -0.299 7.876 -7.380 1.00 0.00 O ATOM 438 CB PRO A 30 1.985 6.874 -4.917 1.00 0.00 C ATOM 439 CG PRO A 30 2.191 8.264 -4.337 1.00 0.00 C ATOM 440 CD PRO A 30 2.421 9.222 -5.493 1.00 0.00 C ATOM 0 HA PRO A 30 2.243 6.299 -6.984 1.00 0.00 H new ATOM 0 HB2 PRO A 30 1.137 6.376 -4.447 1.00 0.00 H new ATOM 0 HB3 PRO A 30 2.859 6.245 -4.745 1.00 0.00 H new ATOM 0 HG2 PRO A 30 1.320 8.568 -3.757 1.00 0.00 H new ATOM 0 HG3 PRO A 30 3.044 8.272 -3.659 1.00 0.00 H new ATOM 0 HD2 PRO A 30 1.708 10.046 -5.472 1.00 0.00 H new ATOM 0 HD3 PRO A 30 3.418 9.661 -5.451 1.00 0.00 H new ATOM 448 N SER A 31 -0.313 5.817 -6.445 1.00 0.00 N ATOM 449 CA SER A 31 -1.712 5.567 -6.749 1.00 0.00 C ATOM 450 C SER A 31 -2.604 6.285 -5.735 1.00 0.00 C ATOM 451 O SER A 31 -2.186 6.543 -4.607 1.00 0.00 O ATOM 452 CB SER A 31 -2.015 4.067 -6.754 1.00 0.00 C ATOM 453 OG SER A 31 -2.308 3.577 -5.449 1.00 0.00 O ATOM 0 H SER A 31 0.160 5.056 -5.957 1.00 0.00 H new ATOM 0 HA SER A 31 -1.920 5.956 -7.746 1.00 0.00 H new ATOM 0 HB2 SER A 31 -2.860 3.870 -7.413 1.00 0.00 H new ATOM 0 HB3 SER A 31 -1.161 3.526 -7.161 1.00 0.00 H new ATOM 0 HG SER A 31 -1.768 2.779 -5.270 1.00 0.00 H new ATOM 459 N TYR A 32 -3.818 6.588 -6.172 1.00 0.00 N ATOM 460 CA TYR A 32 -4.773 7.271 -5.317 1.00 0.00 C ATOM 461 C TYR A 32 -5.902 6.330 -4.894 1.00 0.00 C ATOM 462 O TYR A 32 -6.167 5.333 -5.564 1.00 0.00 O ATOM 463 CB TYR A 32 -5.359 8.405 -6.160 1.00 0.00 C ATOM 464 CG TYR A 32 -6.846 8.663 -5.909 1.00 0.00 C ATOM 465 CD1 TYR A 32 -7.774 7.683 -6.195 1.00 0.00 C ATOM 466 CD2 TYR A 32 -7.259 9.876 -5.396 1.00 0.00 C ATOM 467 CE1 TYR A 32 -9.174 7.926 -5.958 1.00 0.00 C ATOM 468 CE2 TYR A 32 -8.658 10.119 -5.160 1.00 0.00 C ATOM 469 CZ TYR A 32 -9.547 9.132 -5.452 1.00 0.00 C ATOM 470 OH TYR A 32 -10.868 9.361 -5.229 1.00 0.00 O ATOM 0 H TYR A 32 -4.162 6.373 -7.108 1.00 0.00 H new ATOM 0 HA TYR A 32 -4.286 7.632 -4.411 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -4.803 9.320 -5.957 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -5.214 8.172 -7.215 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -7.451 6.734 -6.596 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -6.532 10.643 -5.172 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -9.911 7.167 -6.177 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -8.994 11.064 -4.760 1.00 0.00 H new ATOM 0 HH TYR A 32 -11.401 8.684 -5.696 1.00 0.00 H new ATOM 480 N ASN A 33 -6.537 6.679 -3.785 1.00 0.00 N ATOM 481 CA ASN A 33 -7.632 5.878 -3.266 1.00 0.00 C ATOM 482 C ASN A 33 -8.846 6.777 -3.023 1.00 0.00 C ATOM 483 O ASN A 33 -8.697 7.961 -2.727 1.00 0.00 O ATOM 484 CB ASN A 33 -7.254 5.225 -1.935 1.00 0.00 C ATOM 485 CG ASN A 33 -7.256 3.700 -2.052 1.00 0.00 C ATOM 486 OD1 ASN A 33 -7.821 3.122 -2.966 1.00 0.00 O ATOM 487 ND2 ASN A 33 -6.596 3.081 -1.077 1.00 0.00 N ATOM 0 H ASN A 33 -6.314 7.506 -3.231 1.00 0.00 H new ATOM 0 HA ASN A 33 -7.858 5.102 -3.997 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -6.267 5.568 -1.625 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -7.957 5.535 -1.161 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -6.541 2.063 -1.065 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -6.145 3.625 -0.341 1.00 0.00 H new ATOM 494 N GLU A 34 -10.021 6.179 -3.157 1.00 0.00 N ATOM 495 CA GLU A 34 -11.260 6.911 -2.956 1.00 0.00 C ATOM 496 C GLU A 34 -11.426 7.279 -1.480 1.00 0.00 C ATOM 497 O GLU A 34 -11.888 8.372 -1.157 1.00 0.00 O ATOM 498 CB GLU A 34 -12.460 6.106 -3.459 1.00 0.00 C ATOM 499 CG GLU A 34 -12.739 4.910 -2.547 1.00 0.00 C ATOM 500 CD GLU A 34 -13.615 3.874 -3.254 1.00 0.00 C ATOM 501 OE1 GLU A 34 -13.071 3.180 -4.140 1.00 0.00 O ATOM 502 OE2 GLU A 34 -14.809 3.798 -2.892 1.00 0.00 O ATOM 0 H GLU A 34 -10.141 5.196 -3.402 1.00 0.00 H new ATOM 0 HA GLU A 34 -11.213 7.832 -3.537 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -13.340 6.748 -3.503 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -12.269 5.757 -4.474 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -11.798 4.451 -2.246 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -13.234 5.250 -1.637 1.00 0.00 H new ATOM 509 N TRP A 35 -11.040 6.345 -0.624 1.00 0.00 N ATOM 510 CA TRP A 35 -11.140 6.557 0.810 1.00 0.00 C ATOM 511 C TRP A 35 -10.497 7.907 1.135 1.00 0.00 C ATOM 512 O TRP A 35 -11.108 8.749 1.790 1.00 0.00 O ATOM 513 CB TRP A 35 -10.512 5.395 1.582 1.00 0.00 C ATOM 514 CG TRP A 35 -11.039 5.238 3.010 1.00 0.00 C ATOM 515 CD1 TRP A 35 -10.781 6.011 4.073 1.00 0.00 C ATOM 516 CD2 TRP A 35 -11.930 4.210 3.489 1.00 0.00 C ATOM 517 NE1 TRP A 35 -11.438 5.558 5.199 1.00 0.00 N ATOM 518 CE2 TRP A 35 -12.159 4.428 4.833 1.00 0.00 C ATOM 519 CE3 TRP A 35 -12.523 3.131 2.811 1.00 0.00 C ATOM 520 CZ2 TRP A 35 -12.983 3.608 5.613 1.00 0.00 C ATOM 521 CZ3 TRP A 35 -13.344 2.321 3.604 1.00 0.00 C ATOM 522 CH2 TRP A 35 -13.585 2.527 4.958 1.00 0.00 C ATOM 0 H TRP A 35 -10.657 5.439 -0.896 1.00 0.00 H new ATOM 0 HA TRP A 35 -12.184 6.584 1.123 1.00 0.00 H new ATOM 0 HB2 TRP A 35 -10.693 4.469 1.035 1.00 0.00 H new ATOM 0 HB3 TRP A 35 -9.432 5.538 1.618 1.00 0.00 H new ATOM 0 HD1 TRP A 35 -10.139 6.880 4.052 1.00 0.00 H new ATOM 0 HE1 TRP A 35 -11.401 5.976 6.129 1.00 0.00 H new ATOM 0 HE3 TRP A 35 -12.358 2.942 1.761 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 -13.146 3.799 6.663 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 -13.824 1.477 3.131 1.00 0.00 H new ATOM 0 HH2 TRP A 35 -14.234 1.856 5.502 1.00 0.00 H new ATOM 533 N ARG A 36 -9.270 8.071 0.660 1.00 0.00 N ATOM 534 CA ARG A 36 -8.537 9.304 0.891 1.00 0.00 C ATOM 535 C ARG A 36 -8.910 10.349 -0.163 1.00 0.00 C ATOM 536 O ARG A 36 -8.755 11.548 0.065 1.00 0.00 O ATOM 537 CB ARG A 36 -7.027 9.063 0.849 1.00 0.00 C ATOM 538 CG ARG A 36 -6.318 9.830 1.967 1.00 0.00 C ATOM 539 CD ARG A 36 -5.004 10.435 1.470 1.00 0.00 C ATOM 540 NE ARG A 36 -4.119 10.736 2.617 1.00 0.00 N ATOM 541 CZ ARG A 36 -3.510 9.803 3.361 1.00 0.00 C ATOM 542 NH1 ARG A 36 -3.687 8.504 3.082 1.00 0.00 N ATOM 543 NH2 ARG A 36 -2.724 10.168 4.383 1.00 0.00 N ATOM 0 H ARG A 36 -8.766 7.370 0.117 1.00 0.00 H new ATOM 0 HA ARG A 36 -8.807 9.670 1.881 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -6.822 7.997 0.948 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -6.632 9.375 -0.118 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -6.969 10.621 2.339 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -6.120 9.160 2.804 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -4.509 9.741 0.790 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -5.204 11.346 0.906 1.00 0.00 H new ATOM 0 HE ARG A 36 -3.963 11.715 2.856 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -4.285 8.226 2.304 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -3.224 7.793 3.648 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -2.589 11.157 4.595 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -2.261 9.457 4.949 1.00 0.00 H new ATOM 557 N LYS A 37 -9.394 9.856 -1.293 1.00 0.00 N ATOM 558 CA LYS A 37 -9.790 10.732 -2.383 1.00 0.00 C ATOM 559 C LYS A 37 -8.720 11.806 -2.582 1.00 0.00 C ATOM 560 O LYS A 37 -9.005 12.881 -3.108 1.00 0.00 O ATOM 561 CB LYS A 37 -11.190 11.297 -2.134 1.00 0.00 C ATOM 562 CG LYS A 37 -11.146 12.448 -1.127 1.00 0.00 C ATOM 563 CD LYS A 37 -12.065 13.592 -1.562 1.00 0.00 C ATOM 564 CE LYS A 37 -11.323 14.576 -2.469 1.00 0.00 C ATOM 565 NZ LYS A 37 -12.249 15.615 -2.973 1.00 0.00 N ATOM 0 H LYS A 37 -9.521 8.861 -1.478 1.00 0.00 H new ATOM 0 HA LYS A 37 -9.858 10.173 -3.316 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -11.617 11.647 -3.074 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -11.843 10.508 -1.762 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.448 12.088 -0.144 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -10.124 12.814 -1.032 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -12.930 13.188 -2.088 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -12.442 14.115 -0.683 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -10.507 15.044 -1.918 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -10.876 14.041 -3.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -12.163 15.685 -4.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -13.226 15.360 -2.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -12.010 16.531 -2.543 1.00 0.00 H new ATOM 579 N ARG A 38 -7.510 11.479 -2.151 1.00 0.00 N ATOM 580 CA ARG A 38 -6.396 12.403 -2.276 1.00 0.00 C ATOM 581 C ARG A 38 -5.071 11.638 -2.288 1.00 0.00 C ATOM 582 O ARG A 38 -4.798 10.848 -1.385 1.00 0.00 O ATOM 583 CB ARG A 38 -6.385 13.411 -1.124 1.00 0.00 C ATOM 584 CG ARG A 38 -4.965 13.907 -0.844 1.00 0.00 C ATOM 585 CD ARG A 38 -4.402 14.666 -2.048 1.00 0.00 C ATOM 586 NE ARG A 38 -3.128 15.323 -1.681 1.00 0.00 N ATOM 587 CZ ARG A 38 -3.028 16.329 -0.801 1.00 0.00 C ATOM 588 NH1 ARG A 38 -4.125 16.798 -0.192 1.00 0.00 N ATOM 589 NH2 ARG A 38 -1.830 16.865 -0.529 1.00 0.00 N ATOM 0 H ARG A 38 -7.277 10.587 -1.715 1.00 0.00 H new ATOM 0 HA ARG A 38 -6.516 12.943 -3.215 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -7.028 14.256 -1.369 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -6.796 12.948 -0.227 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -4.969 14.557 0.031 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -4.320 13.060 -0.609 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -4.240 13.979 -2.878 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -5.121 15.412 -2.387 1.00 0.00 H new ATOM 0 HE ARG A 38 -2.273 14.990 -2.125 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -5.037 16.390 -0.398 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -4.049 17.564 0.478 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -0.994 16.507 -0.992 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -1.754 17.631 0.141 1.00 0.00 H new ATOM 603 N ILE A 39 -4.283 11.899 -3.320 1.00 0.00 N ATOM 604 CA ILE A 39 -2.993 11.245 -3.462 1.00 0.00 C ATOM 605 C ILE A 39 -1.883 12.228 -3.085 1.00 0.00 C ATOM 606 O ILE A 39 -2.071 13.441 -3.163 1.00 0.00 O ATOM 607 CB ILE A 39 -2.842 10.655 -4.865 1.00 0.00 C ATOM 608 CG1 ILE A 39 -2.486 9.169 -4.801 1.00 0.00 C ATOM 609 CG2 ILE A 39 -1.829 11.453 -5.689 1.00 0.00 C ATOM 610 CD1 ILE A 39 -0.984 8.956 -4.997 1.00 0.00 C ATOM 0 H ILE A 39 -4.513 12.555 -4.067 1.00 0.00 H new ATOM 0 HA ILE A 39 -2.917 10.400 -2.777 1.00 0.00 H new ATOM 0 HB ILE A 39 -3.803 10.733 -5.373 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.792 8.759 -3.839 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.037 8.626 -5.569 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.740 11.013 -6.682 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -2.166 12.486 -5.779 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.858 11.430 -5.194 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -0.758 7.891 -4.947 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -0.685 9.345 -5.970 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -0.437 9.480 -4.213 1.00 0.00 H new ATOM 622 N GLU A 40 -0.751 11.669 -2.685 1.00 0.00 N ATOM 623 CA GLU A 40 0.389 12.481 -2.296 1.00 0.00 C ATOM 624 C GLU A 40 1.441 12.485 -3.406 1.00 0.00 C ATOM 625 O GLU A 40 2.056 11.457 -3.687 1.00 0.00 O ATOM 626 CB GLU A 40 0.986 11.991 -0.975 1.00 0.00 C ATOM 627 CG GLU A 40 -0.080 11.323 -0.106 1.00 0.00 C ATOM 628 CD GLU A 40 0.541 10.717 1.155 1.00 0.00 C ATOM 629 OE1 GLU A 40 1.689 11.104 1.464 1.00 0.00 O ATOM 630 OE2 GLU A 40 -0.146 9.882 1.781 1.00 0.00 O ATOM 0 H GLU A 40 -0.599 10.662 -2.622 1.00 0.00 H new ATOM 0 HA GLU A 40 0.047 13.505 -2.144 1.00 0.00 H new ATOM 0 HB2 GLU A 40 1.792 11.285 -1.176 1.00 0.00 H new ATOM 0 HB3 GLU A 40 1.425 12.831 -0.437 1.00 0.00 H new ATOM 0 HG2 GLU A 40 -0.838 12.055 0.173 1.00 0.00 H new ATOM 0 HG3 GLU A 40 -0.585 10.544 -0.678 1.00 0.00 H new ATOM 637 N VAL A 41 1.617 13.652 -4.008 1.00 0.00 N ATOM 638 CA VAL A 41 2.585 13.803 -5.081 1.00 0.00 C ATOM 639 C VAL A 41 3.829 14.513 -4.544 1.00 0.00 C ATOM 640 O VAL A 41 3.784 15.134 -3.483 1.00 0.00 O ATOM 641 CB VAL A 41 1.944 14.532 -6.264 1.00 0.00 C ATOM 642 CG1 VAL A 41 2.999 15.277 -7.085 1.00 0.00 C ATOM 643 CG2 VAL A 41 1.151 13.562 -7.142 1.00 0.00 C ATOM 0 H VAL A 41 1.105 14.502 -3.773 1.00 0.00 H new ATOM 0 HA VAL A 41 2.902 12.828 -5.450 1.00 0.00 H new ATOM 0 HB VAL A 41 1.247 15.269 -5.865 1.00 0.00 H new ATOM 0 HG11 VAL A 41 2.517 15.787 -7.920 1.00 0.00 H new ATOM 0 HG12 VAL A 41 3.501 16.010 -6.453 1.00 0.00 H new ATOM 0 HG13 VAL A 41 3.731 14.566 -7.468 1.00 0.00 H new ATOM 0 HG21 VAL A 41 0.706 14.106 -7.975 1.00 0.00 H new ATOM 0 HG22 VAL A 41 1.818 12.791 -7.527 1.00 0.00 H new ATOM 0 HG23 VAL A 41 0.363 13.097 -6.550 1.00 0.00 H new ATOM 653 N LYS A 42 4.910 14.398 -5.301 1.00 0.00 N ATOM 654 CA LYS A 42 6.164 15.021 -4.915 1.00 0.00 C ATOM 655 C LYS A 42 6.441 16.213 -5.833 1.00 0.00 C ATOM 656 O LYS A 42 6.296 16.110 -7.050 1.00 0.00 O ATOM 657 CB LYS A 42 7.292 13.987 -4.892 1.00 0.00 C ATOM 658 CG LYS A 42 8.659 14.664 -5.000 1.00 0.00 C ATOM 659 CD LYS A 42 9.772 13.629 -5.172 1.00 0.00 C ATOM 660 CE LYS A 42 9.727 13.002 -6.567 1.00 0.00 C ATOM 661 NZ LYS A 42 10.562 11.781 -6.614 1.00 0.00 N ATOM 0 H LYS A 42 4.943 13.882 -6.180 1.00 0.00 H new ATOM 0 HA LYS A 42 6.099 15.410 -3.899 1.00 0.00 H new ATOM 0 HB2 LYS A 42 7.241 13.408 -3.970 1.00 0.00 H new ATOM 0 HB3 LYS A 42 7.164 13.285 -5.716 1.00 0.00 H new ATOM 0 HG2 LYS A 42 8.663 15.351 -5.846 1.00 0.00 H new ATOM 0 HG3 LYS A 42 8.846 15.259 -4.106 1.00 0.00 H new ATOM 0 HD2 LYS A 42 10.741 14.102 -5.013 1.00 0.00 H new ATOM 0 HD3 LYS A 42 9.670 12.850 -4.416 1.00 0.00 H new ATOM 0 HE2 LYS A 42 8.698 12.756 -6.829 1.00 0.00 H new ATOM 0 HE3 LYS A 42 10.081 13.720 -7.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 10.270 11.191 -7.419 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 11.561 12.048 -6.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 10.443 11.245 -5.731 1.00 0.00 H new ATOM 675 N ILE A 43 6.835 17.317 -5.215 1.00 0.00 N ATOM 676 CA ILE A 43 7.133 18.527 -5.962 1.00 0.00 C ATOM 677 C ILE A 43 7.985 19.458 -5.097 1.00 0.00 C ATOM 678 O ILE A 43 8.387 19.091 -3.993 1.00 0.00 O ATOM 679 CB ILE A 43 5.844 19.172 -6.474 1.00 0.00 C ATOM 680 CG1 ILE A 43 4.682 18.913 -5.513 1.00 0.00 C ATOM 681 CG2 ILE A 43 5.526 18.707 -7.897 1.00 0.00 C ATOM 682 CD1 ILE A 43 3.759 20.130 -5.428 1.00 0.00 C ATOM 0 H ILE A 43 6.955 17.399 -4.205 1.00 0.00 H new ATOM 0 HA ILE A 43 7.719 18.292 -6.851 1.00 0.00 H new ATOM 0 HB ILE A 43 5.994 20.251 -6.514 1.00 0.00 H new ATOM 0 HG12 ILE A 43 4.115 18.045 -5.848 1.00 0.00 H new ATOM 0 HG13 ILE A 43 5.070 18.677 -4.522 1.00 0.00 H new ATOM 0 HG21 ILE A 43 4.605 19.180 -8.237 1.00 0.00 H new ATOM 0 HG22 ILE A 43 6.344 18.985 -8.562 1.00 0.00 H new ATOM 0 HG23 ILE A 43 5.403 17.624 -7.907 1.00 0.00 H new ATOM 0 HD11 ILE A 43 2.942 19.919 -4.738 1.00 0.00 H new ATOM 0 HD12 ILE A 43 4.324 20.991 -5.069 1.00 0.00 H new ATOM 0 HD13 ILE A 43 3.353 20.349 -6.416 1.00 0.00 H new ATOM 694 N HIS A 44 8.235 20.645 -5.630 1.00 0.00 N ATOM 695 CA HIS A 44 9.032 21.631 -4.920 1.00 0.00 C ATOM 696 C HIS A 44 8.223 22.201 -3.753 1.00 0.00 C ATOM 697 O HIS A 44 7.171 21.668 -3.404 1.00 0.00 O ATOM 698 CB HIS A 44 9.535 22.713 -5.877 1.00 0.00 C ATOM 699 CG HIS A 44 10.446 22.196 -6.965 1.00 0.00 C ATOM 700 ND1 HIS A 44 10.226 22.446 -8.308 1.00 0.00 N ATOM 701 CD2 HIS A 44 11.580 21.442 -6.894 1.00 0.00 C ATOM 702 CE1 HIS A 44 11.190 21.863 -9.005 1.00 0.00 C ATOM 703 NE2 HIS A 44 12.028 21.241 -8.127 1.00 0.00 N ATOM 0 H HIS A 44 7.900 20.946 -6.545 1.00 0.00 H new ATOM 0 HA HIS A 44 9.920 21.155 -4.503 1.00 0.00 H new ATOM 0 HB2 HIS A 44 8.677 23.203 -6.338 1.00 0.00 H new ATOM 0 HB3 HIS A 44 10.066 23.473 -5.303 1.00 0.00 H new ATOM 0 HD2 HIS A 44 12.036 21.071 -5.988 1.00 0.00 H new ATOM 0 HE1 HIS A 44 11.294 21.878 -10.080 1.00 0.00 H new ATOM 0 HE2 HIS A 44 12.862 20.709 -8.377 1.00 0.00 H new ATOM 711 N SER A 45 8.745 23.277 -3.183 1.00 0.00 N ATOM 712 CA SER A 45 8.084 23.925 -2.063 1.00 0.00 C ATOM 713 C SER A 45 7.173 25.045 -2.569 1.00 0.00 C ATOM 714 O SER A 45 6.194 25.397 -1.914 1.00 0.00 O ATOM 715 CB SER A 45 9.105 24.480 -1.068 1.00 0.00 C ATOM 716 OG SER A 45 8.803 24.105 0.273 1.00 0.00 O ATOM 0 H SER A 45 9.618 23.716 -3.476 1.00 0.00 H new ATOM 0 HA SER A 45 7.479 23.180 -1.545 1.00 0.00 H new ATOM 0 HB2 SER A 45 10.100 24.119 -1.330 1.00 0.00 H new ATOM 0 HB3 SER A 45 9.130 25.567 -1.143 1.00 0.00 H new ATOM 0 HG SER A 45 9.479 24.477 0.877 1.00 0.00 H new ATOM 722 N PRO A 46 7.537 25.587 -3.762 1.00 0.00 N ATOM 723 CA PRO A 46 6.764 26.660 -4.364 1.00 0.00 C ATOM 724 C PRO A 46 5.462 26.126 -4.964 1.00 0.00 C ATOM 725 O PRO A 46 4.463 26.842 -5.025 1.00 0.00 O ATOM 726 CB PRO A 46 7.688 27.277 -5.401 1.00 0.00 C ATOM 727 CG PRO A 46 8.767 26.240 -5.667 1.00 0.00 C ATOM 728 CD PRO A 46 8.691 25.195 -4.566 1.00 0.00 C ATOM 0 HA PRO A 46 6.447 27.409 -3.638 1.00 0.00 H new ATOM 0 HB2 PRO A 46 7.144 27.518 -6.314 1.00 0.00 H new ATOM 0 HB3 PRO A 46 8.122 28.207 -5.034 1.00 0.00 H new ATOM 0 HG2 PRO A 46 8.620 25.778 -6.643 1.00 0.00 H new ATOM 0 HG3 PRO A 46 9.751 26.708 -5.682 1.00 0.00 H new ATOM 0 HD2 PRO A 46 8.565 24.194 -4.978 1.00 0.00 H new ATOM 0 HD3 PRO A 46 9.603 25.181 -3.969 1.00 0.00 H new ATOM 736 N PRO A 47 5.516 24.841 -5.405 1.00 0.00 N ATOM 737 CA PRO A 47 4.353 24.203 -5.999 1.00 0.00 C ATOM 738 C PRO A 47 3.326 23.829 -4.928 1.00 0.00 C ATOM 739 O PRO A 47 2.128 24.039 -5.112 1.00 0.00 O ATOM 740 CB PRO A 47 4.903 22.997 -6.742 1.00 0.00 C ATOM 741 CG PRO A 47 6.282 22.739 -6.156 1.00 0.00 C ATOM 742 CD PRO A 47 6.682 23.964 -5.349 1.00 0.00 C ATOM 0 HA PRO A 47 3.813 24.861 -6.680 1.00 0.00 H new ATOM 0 HB2 PRO A 47 4.255 22.130 -6.613 1.00 0.00 H new ATOM 0 HB3 PRO A 47 4.964 23.192 -7.813 1.00 0.00 H new ATOM 0 HG2 PRO A 47 6.268 21.852 -5.522 1.00 0.00 H new ATOM 0 HG3 PRO A 47 7.005 22.552 -6.950 1.00 0.00 H new ATOM 0 HD2 PRO A 47 6.929 23.698 -4.321 1.00 0.00 H new ATOM 0 HD3 PRO A 47 7.562 24.448 -5.773 1.00 0.00 H new ATOM 750 N GLN A 48 3.833 23.282 -3.833 1.00 0.00 N ATOM 751 CA GLN A 48 2.975 22.877 -2.733 1.00 0.00 C ATOM 752 C GLN A 48 2.375 24.106 -2.047 1.00 0.00 C ATOM 753 O GLN A 48 1.697 23.984 -1.028 1.00 0.00 O ATOM 754 CB GLN A 48 3.740 22.009 -1.732 1.00 0.00 C ATOM 755 CG GLN A 48 4.635 22.866 -0.835 1.00 0.00 C ATOM 756 CD GLN A 48 4.191 22.779 0.627 1.00 0.00 C ATOM 757 OE1 GLN A 48 3.208 22.142 0.967 1.00 0.00 O ATOM 758 NE2 GLN A 48 4.969 23.453 1.469 1.00 0.00 N ATOM 0 H GLN A 48 4.827 23.110 -3.684 1.00 0.00 H new ATOM 0 HA GLN A 48 2.160 22.276 -3.136 1.00 0.00 H new ATOM 0 HB2 GLN A 48 3.035 21.448 -1.119 1.00 0.00 H new ATOM 0 HB3 GLN A 48 4.348 21.280 -2.268 1.00 0.00 H new ATOM 0 HG2 GLN A 48 5.670 22.535 -0.925 1.00 0.00 H new ATOM 0 HG3 GLN A 48 4.602 23.904 -1.168 1.00 0.00 H new ATOM 0 HE21 GLN A 48 5.777 23.966 1.117 1.00 0.00 H new ATOM 0 HE22 GLN A 48 4.757 23.457 2.467 1.00 0.00 H new ATOM 767 N LYS A 49 2.646 25.263 -2.634 1.00 0.00 N ATOM 768 CA LYS A 49 2.142 26.513 -2.092 1.00 0.00 C ATOM 769 C LYS A 49 0.999 27.021 -2.973 1.00 0.00 C ATOM 770 O LYS A 49 0.401 28.056 -2.684 1.00 0.00 O ATOM 771 CB LYS A 49 3.281 27.520 -1.920 1.00 0.00 C ATOM 772 CG LYS A 49 3.021 28.443 -0.727 1.00 0.00 C ATOM 773 CD LYS A 49 3.992 29.625 -0.727 1.00 0.00 C ATOM 774 CE LYS A 49 3.284 30.917 -1.138 1.00 0.00 C ATOM 775 NZ LYS A 49 2.899 30.865 -2.566 1.00 0.00 N ATOM 0 H LYS A 49 3.208 25.361 -3.480 1.00 0.00 H new ATOM 0 HA LYS A 49 1.731 26.358 -1.094 1.00 0.00 H new ATOM 0 HB2 LYS A 49 4.222 26.989 -1.775 1.00 0.00 H new ATOM 0 HB3 LYS A 49 3.386 28.114 -2.828 1.00 0.00 H new ATOM 0 HG2 LYS A 49 1.995 28.810 -0.763 1.00 0.00 H new ATOM 0 HG3 LYS A 49 3.126 27.882 0.201 1.00 0.00 H new ATOM 0 HD2 LYS A 49 4.426 29.744 0.266 1.00 0.00 H new ATOM 0 HD3 LYS A 49 4.815 29.424 -1.412 1.00 0.00 H new ATOM 0 HE2 LYS A 49 2.397 31.065 -0.521 1.00 0.00 H new ATOM 0 HE3 LYS A 49 3.940 31.770 -0.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 2.450 31.763 -2.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 3.747 30.712 -3.149 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 2.229 30.084 -2.717 1.00 0.00 H new ATOM 789 N GLY A 50 0.730 26.269 -4.030 1.00 0.00 N ATOM 790 CA GLY A 50 -0.331 26.631 -4.955 1.00 0.00 C ATOM 791 C GLY A 50 0.160 26.572 -6.403 1.00 0.00 C ATOM 792 O GLY A 50 -0.582 26.172 -7.298 1.00 0.00 O ATOM 0 H GLY A 50 1.228 25.411 -4.267 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -1.177 25.956 -4.826 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -0.688 27.636 -4.729 1.00 0.00 H new ATOM 796 N LYS A 51 1.408 26.976 -6.587 1.00 0.00 N ATOM 797 CA LYS A 51 2.007 26.975 -7.911 1.00 0.00 C ATOM 798 C LYS A 51 1.932 25.564 -8.498 1.00 0.00 C ATOM 799 O LYS A 51 1.954 25.393 -9.716 1.00 0.00 O ATOM 800 CB LYS A 51 3.426 27.544 -7.858 1.00 0.00 C ATOM 801 CG LYS A 51 4.360 26.779 -8.798 1.00 0.00 C ATOM 802 CD LYS A 51 4.006 27.048 -10.261 1.00 0.00 C ATOM 803 CE LYS A 51 5.117 27.835 -10.959 1.00 0.00 C ATOM 804 NZ LYS A 51 5.441 27.226 -12.268 1.00 0.00 N ATOM 0 H LYS A 51 2.021 27.306 -5.842 1.00 0.00 H new ATOM 0 HA LYS A 51 1.451 27.630 -8.581 1.00 0.00 H new ATOM 0 HB2 LYS A 51 3.409 28.598 -8.135 1.00 0.00 H new ATOM 0 HB3 LYS A 51 3.806 27.488 -6.838 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.392 27.074 -8.610 1.00 0.00 H new ATOM 0 HG3 LYS A 51 4.291 25.710 -8.594 1.00 0.00 H new ATOM 0 HD2 LYS A 51 3.844 26.103 -10.779 1.00 0.00 H new ATOM 0 HD3 LYS A 51 3.071 27.606 -10.316 1.00 0.00 H new ATOM 0 HE2 LYS A 51 4.804 28.870 -11.100 1.00 0.00 H new ATOM 0 HE3 LYS A 51 6.007 27.854 -10.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 6.389 26.800 -12.228 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 4.740 26.491 -12.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 5.422 27.959 -13.006 1.00 0.00 H new ATOM 818 N ALA A 52 1.846 24.590 -7.605 1.00 0.00 N ATOM 819 CA ALA A 52 1.768 23.199 -8.019 1.00 0.00 C ATOM 820 C ALA A 52 0.766 23.069 -9.168 1.00 0.00 C ATOM 821 O ALA A 52 0.857 22.145 -9.975 1.00 0.00 O ATOM 822 CB ALA A 52 1.394 22.328 -6.818 1.00 0.00 C ATOM 0 H ALA A 52 1.829 24.736 -6.596 1.00 0.00 H new ATOM 0 HA ALA A 52 2.735 22.853 -8.384 1.00 0.00 H new ATOM 0 HB1 ALA A 52 1.336 21.285 -7.129 1.00 0.00 H new ATOM 0 HB2 ALA A 52 2.152 22.433 -6.042 1.00 0.00 H new ATOM 0 HB3 ALA A 52 0.427 22.644 -6.426 1.00 0.00 H new ATOM 828 N ASN A 53 -0.168 24.008 -9.205 1.00 0.00 N ATOM 829 CA ASN A 53 -1.186 24.011 -10.242 1.00 0.00 C ATOM 830 C ASN A 53 -0.526 24.260 -11.599 1.00 0.00 C ATOM 831 O ASN A 53 -0.600 23.419 -12.494 1.00 0.00 O ATOM 832 CB ASN A 53 -2.212 25.121 -10.005 1.00 0.00 C ATOM 833 CG ASN A 53 -3.587 24.536 -9.675 1.00 0.00 C ATOM 834 OD1 ASN A 53 -4.163 23.774 -10.433 1.00 0.00 O ATOM 835 ND2 ASN A 53 -4.078 24.935 -8.505 1.00 0.00 N ATOM 0 H ASN A 53 -0.241 24.772 -8.533 1.00 0.00 H new ATOM 0 HA ASN A 53 -1.689 23.044 -10.222 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -1.879 25.760 -9.187 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -2.284 25.750 -10.892 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -4.990 24.601 -8.194 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -3.542 25.575 -7.919 1.00 0.00 H new ATOM 842 N ARG A 54 0.107 25.419 -11.710 1.00 0.00 N ATOM 843 CA ARG A 54 0.780 25.789 -12.943 1.00 0.00 C ATOM 844 C ARG A 54 2.063 24.973 -13.113 1.00 0.00 C ATOM 845 O ARG A 54 2.480 24.692 -14.236 1.00 0.00 O ATOM 846 CB ARG A 54 1.127 27.279 -12.955 1.00 0.00 C ATOM 847 CG ARG A 54 0.333 28.019 -14.034 1.00 0.00 C ATOM 848 CD ARG A 54 1.028 29.323 -14.429 1.00 0.00 C ATOM 849 NE ARG A 54 1.711 29.909 -13.254 1.00 0.00 N ATOM 850 CZ ARG A 54 2.525 30.972 -13.311 1.00 0.00 C ATOM 851 NH1 ARG A 54 2.763 31.571 -14.486 1.00 0.00 N ATOM 852 NH2 ARG A 54 3.101 31.436 -12.194 1.00 0.00 N ATOM 0 H ARG A 54 0.168 26.114 -10.966 1.00 0.00 H new ATOM 0 HA ARG A 54 0.099 25.579 -13.768 1.00 0.00 H new ATOM 0 HB2 ARG A 54 0.913 27.714 -11.979 1.00 0.00 H new ATOM 0 HB3 ARG A 54 2.195 27.406 -13.133 1.00 0.00 H new ATOM 0 HG2 ARG A 54 0.223 27.381 -14.911 1.00 0.00 H new ATOM 0 HG3 ARG A 54 -0.671 28.234 -13.668 1.00 0.00 H new ATOM 0 HD2 ARG A 54 1.751 29.134 -15.223 1.00 0.00 H new ATOM 0 HD3 ARG A 54 0.297 30.029 -14.825 1.00 0.00 H new ATOM 0 HE ARG A 54 1.552 29.477 -12.344 1.00 0.00 H new ATOM 0 HH11 ARG A 54 2.325 31.218 -15.337 1.00 0.00 H new ATOM 0 HH12 ARG A 54 3.383 32.380 -14.530 1.00 0.00 H new ATOM 0 HH21 ARG A 54 2.920 30.980 -11.300 1.00 0.00 H new ATOM 0 HH22 ARG A 54 3.721 32.245 -12.238 1.00 0.00 H new ATOM 866 N GLU A 55 2.652 24.613 -11.983 1.00 0.00 N ATOM 867 CA GLU A 55 3.879 23.834 -11.993 1.00 0.00 C ATOM 868 C GLU A 55 3.600 22.412 -12.483 1.00 0.00 C ATOM 869 O GLU A 55 4.470 21.775 -13.075 1.00 0.00 O ATOM 870 CB GLU A 55 4.530 23.819 -10.608 1.00 0.00 C ATOM 871 CG GLU A 55 5.917 24.464 -10.647 1.00 0.00 C ATOM 872 CD GLU A 55 6.764 24.014 -9.456 1.00 0.00 C ATOM 873 OE1 GLU A 55 6.772 22.792 -9.194 1.00 0.00 O ATOM 874 OE2 GLU A 55 7.385 24.903 -8.833 1.00 0.00 O ATOM 0 H GLU A 55 2.303 24.846 -11.054 1.00 0.00 H new ATOM 0 HA GLU A 55 4.580 24.304 -12.683 1.00 0.00 H new ATOM 0 HB2 GLU A 55 3.897 24.352 -9.899 1.00 0.00 H new ATOM 0 HB3 GLU A 55 4.612 22.792 -10.252 1.00 0.00 H new ATOM 0 HG2 GLU A 55 6.420 24.198 -11.577 1.00 0.00 H new ATOM 0 HG3 GLU A 55 5.818 25.549 -10.638 1.00 0.00 H new ATOM 881 N ILE A 56 2.384 21.957 -12.219 1.00 0.00 N ATOM 882 CA ILE A 56 1.981 20.622 -12.627 1.00 0.00 C ATOM 883 C ILE A 56 2.304 20.426 -14.109 1.00 0.00 C ATOM 884 O ILE A 56 3.102 19.560 -14.465 1.00 0.00 O ATOM 885 CB ILE A 56 0.510 20.378 -12.280 1.00 0.00 C ATOM 886 CG1 ILE A 56 0.378 19.557 -10.996 1.00 0.00 C ATOM 887 CG2 ILE A 56 -0.229 19.730 -13.453 1.00 0.00 C ATOM 888 CD1 ILE A 56 -1.092 19.319 -10.646 1.00 0.00 C ATOM 0 H ILE A 56 1.665 22.489 -11.728 1.00 0.00 H new ATOM 0 HA ILE A 56 2.545 19.869 -12.076 1.00 0.00 H new ATOM 0 HB ILE A 56 0.038 21.343 -12.095 1.00 0.00 H new ATOM 0 HG12 ILE A 56 0.886 18.600 -11.118 1.00 0.00 H new ATOM 0 HG13 ILE A 56 0.871 20.077 -10.175 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -1.272 19.567 -13.181 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -0.179 20.386 -14.322 1.00 0.00 H new ATOM 0 HG23 ILE A 56 0.237 18.774 -13.693 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -1.157 18.733 -9.729 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -1.591 20.277 -10.501 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -1.576 18.777 -11.458 1.00 0.00 H new ATOM 900 N ILE A 57 1.668 21.245 -14.934 1.00 0.00 N ATOM 901 CA ILE A 57 1.878 21.172 -16.370 1.00 0.00 C ATOM 902 C ILE A 57 3.359 21.408 -16.677 1.00 0.00 C ATOM 903 O ILE A 57 3.870 20.931 -17.689 1.00 0.00 O ATOM 904 CB ILE A 57 0.939 22.136 -17.098 1.00 0.00 C ATOM 905 CG1 ILE A 57 -0.499 21.614 -17.085 1.00 0.00 C ATOM 906 CG2 ILE A 57 1.434 22.416 -18.518 1.00 0.00 C ATOM 907 CD1 ILE A 57 -1.333 22.330 -16.021 1.00 0.00 C ATOM 0 H ILE A 57 1.007 21.962 -14.635 1.00 0.00 H new ATOM 0 HA ILE A 57 1.629 20.178 -16.741 1.00 0.00 H new ATOM 0 HB ILE A 57 0.942 23.086 -16.563 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -0.951 21.760 -18.066 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -0.499 20.541 -16.891 1.00 0.00 H new ATOM 0 HG21 ILE A 57 0.749 23.104 -19.013 1.00 0.00 H new ATOM 0 HG22 ILE A 57 2.428 22.862 -18.476 1.00 0.00 H new ATOM 0 HG23 ILE A 57 1.479 21.482 -19.078 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -2.351 21.940 -16.033 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.892 22.162 -15.039 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -1.352 23.399 -16.232 1.00 0.00 H new ATOM 919 N LYS A 58 4.006 22.143 -15.784 1.00 0.00 N ATOM 920 CA LYS A 58 5.417 22.447 -15.947 1.00 0.00 C ATOM 921 C LYS A 58 6.241 21.189 -15.665 1.00 0.00 C ATOM 922 O LYS A 58 6.984 20.723 -16.527 1.00 0.00 O ATOM 923 CB LYS A 58 5.810 23.646 -15.082 1.00 0.00 C ATOM 924 CG LYS A 58 6.516 24.717 -15.917 1.00 0.00 C ATOM 925 CD LYS A 58 8.018 24.734 -15.631 1.00 0.00 C ATOM 926 CE LYS A 58 8.744 23.661 -16.446 1.00 0.00 C ATOM 927 NZ LYS A 58 8.952 24.120 -17.837 1.00 0.00 N ATOM 0 H LYS A 58 3.579 22.537 -14.946 1.00 0.00 H new ATOM 0 HA LYS A 58 5.627 22.742 -16.975 1.00 0.00 H new ATOM 0 HB2 LYS A 58 4.920 24.070 -14.617 1.00 0.00 H new ATOM 0 HB3 LYS A 58 6.466 23.318 -14.276 1.00 0.00 H new ATOM 0 HG2 LYS A 58 6.346 24.527 -16.977 1.00 0.00 H new ATOM 0 HG3 LYS A 58 6.089 25.695 -15.696 1.00 0.00 H new ATOM 0 HD2 LYS A 58 8.426 25.716 -15.871 1.00 0.00 H new ATOM 0 HD3 LYS A 58 8.191 24.567 -14.568 1.00 0.00 H new ATOM 0 HE2 LYS A 58 9.705 23.433 -15.984 1.00 0.00 H new ATOM 0 HE3 LYS A 58 8.163 22.739 -16.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 8.955 23.300 -18.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 8.184 24.767 -18.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 9.864 24.616 -17.906 1.00 0.00 H new ATOM 941 N GLU A 59 6.083 20.676 -14.454 1.00 0.00 N ATOM 942 CA GLU A 59 6.803 19.481 -14.047 1.00 0.00 C ATOM 943 C GLU A 59 6.155 18.237 -14.657 1.00 0.00 C ATOM 944 O GLU A 59 6.785 17.521 -15.433 1.00 0.00 O ATOM 945 CB GLU A 59 6.869 19.373 -12.522 1.00 0.00 C ATOM 946 CG GLU A 59 7.918 20.329 -11.950 1.00 0.00 C ATOM 947 CD GLU A 59 8.853 19.602 -10.981 1.00 0.00 C ATOM 948 OE1 GLU A 59 9.853 19.037 -11.474 1.00 0.00 O ATOM 949 OE2 GLU A 59 8.546 19.627 -9.770 1.00 0.00 O ATOM 0 H GLU A 59 5.467 21.066 -13.741 1.00 0.00 H new ATOM 0 HA GLU A 59 7.825 19.553 -14.418 1.00 0.00 H new ATOM 0 HB2 GLU A 59 5.892 19.601 -12.095 1.00 0.00 H new ATOM 0 HB3 GLU A 59 7.110 18.349 -12.236 1.00 0.00 H new ATOM 0 HG2 GLU A 59 8.499 20.766 -12.763 1.00 0.00 H new ATOM 0 HG3 GLU A 59 7.423 21.152 -11.434 1.00 0.00 H new ATOM 956 N PHE A 60 4.902 18.018 -14.283 1.00 0.00 N ATOM 957 CA PHE A 60 4.162 16.872 -14.784 1.00 0.00 C ATOM 958 C PHE A 60 4.421 16.661 -16.277 1.00 0.00 C ATOM 959 O PHE A 60 4.829 15.578 -16.692 1.00 0.00 O ATOM 960 CB PHE A 60 2.676 17.174 -14.574 1.00 0.00 C ATOM 961 CG PHE A 60 1.943 16.132 -13.727 1.00 0.00 C ATOM 962 CD1 PHE A 60 2.268 14.816 -13.836 1.00 0.00 C ATOM 963 CD2 PHE A 60 0.966 16.522 -12.865 1.00 0.00 C ATOM 964 CE1 PHE A 60 1.588 13.849 -13.049 1.00 0.00 C ATOM 965 CE2 PHE A 60 0.286 15.555 -12.078 1.00 0.00 C ATOM 966 CZ PHE A 60 0.611 14.239 -12.187 1.00 0.00 C ATOM 0 H PHE A 60 4.381 18.614 -13.640 1.00 0.00 H new ATOM 0 HA PHE A 60 4.473 15.969 -14.258 1.00 0.00 H new ATOM 0 HB2 PHE A 60 2.578 18.149 -14.097 1.00 0.00 H new ATOM 0 HB3 PHE A 60 2.189 17.244 -15.547 1.00 0.00 H new ATOM 0 HD1 PHE A 60 3.043 14.506 -14.521 1.00 0.00 H new ATOM 0 HD2 PHE A 60 0.707 17.567 -12.779 1.00 0.00 H new ATOM 0 HE1 PHE A 60 1.847 12.804 -13.135 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -0.489 15.865 -11.393 1.00 0.00 H new ATOM 0 HZ PHE A 60 0.093 13.504 -11.589 1.00 0.00 H new ATOM 976 N SER A 61 4.174 17.714 -17.042 1.00 0.00 N ATOM 977 CA SER A 61 4.376 17.658 -18.480 1.00 0.00 C ATOM 978 C SER A 61 5.848 17.378 -18.791 1.00 0.00 C ATOM 979 O SER A 61 6.161 16.683 -19.757 1.00 0.00 O ATOM 980 CB SER A 61 3.931 18.959 -19.150 1.00 0.00 C ATOM 981 OG SER A 61 3.851 18.829 -20.567 1.00 0.00 O ATOM 0 H SER A 61 3.836 18.611 -16.693 1.00 0.00 H new ATOM 0 HA SER A 61 3.766 16.848 -18.880 1.00 0.00 H new ATOM 0 HB2 SER A 61 2.958 19.255 -18.757 1.00 0.00 H new ATOM 0 HB3 SER A 61 4.632 19.755 -18.898 1.00 0.00 H new ATOM 0 HG SER A 61 3.289 18.059 -20.794 1.00 0.00 H new ATOM 987 N GLU A 62 6.713 17.932 -17.954 1.00 0.00 N ATOM 988 CA GLU A 62 8.144 17.751 -18.128 1.00 0.00 C ATOM 989 C GLU A 62 8.569 16.372 -17.620 1.00 0.00 C ATOM 990 O GLU A 62 9.378 15.695 -18.254 1.00 0.00 O ATOM 991 CB GLU A 62 8.927 18.860 -17.423 1.00 0.00 C ATOM 992 CG GLU A 62 9.113 20.069 -18.342 1.00 0.00 C ATOM 993 CD GLU A 62 10.439 20.777 -18.055 1.00 0.00 C ATOM 994 OE1 GLU A 62 10.867 20.727 -16.882 1.00 0.00 O ATOM 995 OE2 GLU A 62 10.994 21.352 -19.016 1.00 0.00 O ATOM 0 H GLU A 62 6.450 18.507 -17.153 1.00 0.00 H new ATOM 0 HA GLU A 62 8.372 17.811 -19.192 1.00 0.00 H new ATOM 0 HB2 GLU A 62 8.400 19.164 -16.519 1.00 0.00 H new ATOM 0 HB3 GLU A 62 9.901 18.482 -17.112 1.00 0.00 H new ATOM 0 HG2 GLU A 62 9.087 19.747 -19.383 1.00 0.00 H new ATOM 0 HG3 GLU A 62 8.287 20.766 -18.203 1.00 0.00 H new ATOM 1002 N THR A 63 8.006 15.996 -16.481 1.00 0.00 N ATOM 1003 CA THR A 63 8.317 14.709 -15.881 1.00 0.00 C ATOM 1004 C THR A 63 8.152 13.588 -16.909 1.00 0.00 C ATOM 1005 O THR A 63 9.055 12.775 -17.096 1.00 0.00 O ATOM 1006 CB THR A 63 7.431 14.537 -14.646 1.00 0.00 C ATOM 1007 OG1 THR A 63 8.300 13.965 -13.672 1.00 0.00 O ATOM 1008 CG2 THR A 63 6.346 13.477 -14.847 1.00 0.00 C ATOM 0 H THR A 63 7.336 16.560 -15.958 1.00 0.00 H new ATOM 0 HA THR A 63 9.358 14.663 -15.561 1.00 0.00 H new ATOM 0 HB THR A 63 6.965 15.491 -14.398 1.00 0.00 H new ATOM 0 HG1 THR A 63 8.018 14.246 -12.777 1.00 0.00 H new ATOM 0 HG21 THR A 63 5.746 13.395 -13.941 1.00 0.00 H new ATOM 0 HG22 THR A 63 5.706 13.765 -15.681 1.00 0.00 H new ATOM 0 HG23 THR A 63 6.812 12.515 -15.062 1.00 0.00 H new ATOM 1016 N PHE A 64 6.991 13.580 -17.547 1.00 0.00 N ATOM 1017 CA PHE A 64 6.695 12.571 -18.551 1.00 0.00 C ATOM 1018 C PHE A 64 6.836 13.145 -19.962 1.00 0.00 C ATOM 1019 O PHE A 64 7.380 12.490 -20.850 1.00 0.00 O ATOM 1020 CB PHE A 64 5.245 12.135 -18.333 1.00 0.00 C ATOM 1021 CG PHE A 64 4.837 10.905 -19.146 1.00 0.00 C ATOM 1022 CD1 PHE A 64 4.852 10.952 -20.505 1.00 0.00 C ATOM 1023 CD2 PHE A 64 4.459 9.764 -18.510 1.00 0.00 C ATOM 1024 CE1 PHE A 64 4.473 9.811 -21.260 1.00 0.00 C ATOM 1025 CE2 PHE A 64 4.080 8.622 -19.264 1.00 0.00 C ATOM 1026 CZ PHE A 64 4.095 8.670 -20.623 1.00 0.00 C ATOM 0 H PHE A 64 6.244 14.256 -17.389 1.00 0.00 H new ATOM 0 HA PHE A 64 7.389 11.736 -18.456 1.00 0.00 H new ATOM 0 HB2 PHE A 64 5.095 11.924 -17.274 1.00 0.00 H new ATOM 0 HB3 PHE A 64 4.585 12.963 -18.590 1.00 0.00 H new ATOM 0 HD1 PHE A 64 5.152 11.858 -21.010 1.00 0.00 H new ATOM 0 HD2 PHE A 64 4.447 9.726 -17.431 1.00 0.00 H new ATOM 0 HE1 PHE A 64 4.485 9.849 -22.339 1.00 0.00 H new ATOM 0 HE2 PHE A 64 3.780 7.716 -18.759 1.00 0.00 H new ATOM 0 HZ PHE A 64 3.807 7.802 -21.197 1.00 0.00 H new ATOM 1036 N GLY A 65 6.337 14.361 -20.125 1.00 0.00 N ATOM 1037 CA GLY A 65 6.400 15.030 -21.413 1.00 0.00 C ATOM 1038 C GLY A 65 5.019 15.087 -22.070 1.00 0.00 C ATOM 1039 O GLY A 65 4.911 15.292 -23.278 1.00 0.00 O ATOM 0 H GLY A 65 5.887 14.901 -19.386 1.00 0.00 H new ATOM 0 HA2 GLY A 65 6.787 16.041 -21.283 1.00 0.00 H new ATOM 0 HA3 GLY A 65 7.096 14.504 -22.066 1.00 0.00 H new ATOM 1043 N ARG A 66 3.999 14.902 -21.245 1.00 0.00 N ATOM 1044 CA ARG A 66 2.630 14.929 -21.731 1.00 0.00 C ATOM 1045 C ARG A 66 1.894 16.149 -21.174 1.00 0.00 C ATOM 1046 O ARG A 66 2.489 16.978 -20.487 1.00 0.00 O ATOM 1047 CB ARG A 66 1.877 13.660 -21.327 1.00 0.00 C ATOM 1048 CG ARG A 66 2.527 13.000 -20.109 1.00 0.00 C ATOM 1049 CD ARG A 66 2.255 13.808 -18.838 1.00 0.00 C ATOM 1050 NE ARG A 66 1.733 12.919 -17.776 1.00 0.00 N ATOM 1051 CZ ARG A 66 2.358 12.692 -16.613 1.00 0.00 C ATOM 1052 NH1 ARG A 66 3.531 13.286 -16.355 1.00 0.00 N ATOM 1053 NH2 ARG A 66 1.810 11.870 -15.707 1.00 0.00 N ATOM 0 H ARG A 66 4.093 14.733 -20.244 1.00 0.00 H new ATOM 0 HA ARG A 66 2.665 14.986 -22.819 1.00 0.00 H new ATOM 0 HB2 ARG A 66 0.839 13.905 -21.101 1.00 0.00 H new ATOM 0 HB3 ARG A 66 1.865 12.959 -22.162 1.00 0.00 H new ATOM 0 HG2 ARG A 66 2.141 11.987 -19.990 1.00 0.00 H new ATOM 0 HG3 ARG A 66 3.602 12.915 -20.267 1.00 0.00 H new ATOM 0 HD2 ARG A 66 3.172 14.291 -18.501 1.00 0.00 H new ATOM 0 HD3 ARG A 66 1.536 14.600 -19.047 1.00 0.00 H new ATOM 0 HE ARG A 66 0.842 12.450 -17.940 1.00 0.00 H new ATOM 0 HH11 ARG A 66 3.948 13.911 -17.044 1.00 0.00 H new ATOM 0 HH12 ARG A 66 4.006 13.113 -15.469 1.00 0.00 H new ATOM 0 HH21 ARG A 66 0.917 11.417 -15.903 1.00 0.00 H new ATOM 0 HH22 ARG A 66 2.286 11.697 -14.822 1.00 0.00 H new ATOM 1067 N ASP A 67 0.609 16.222 -21.491 1.00 0.00 N ATOM 1068 CA ASP A 67 -0.214 17.327 -21.031 1.00 0.00 C ATOM 1069 C ASP A 67 -0.885 16.942 -19.711 1.00 0.00 C ATOM 1070 O ASP A 67 -1.181 15.771 -19.479 1.00 0.00 O ATOM 1071 CB ASP A 67 -1.315 17.652 -22.043 1.00 0.00 C ATOM 1072 CG ASP A 67 -1.010 17.239 -23.485 1.00 0.00 C ATOM 1073 OD1 ASP A 67 -0.398 16.162 -23.650 1.00 0.00 O ATOM 1074 OD2 ASP A 67 -1.396 18.011 -24.389 1.00 0.00 O ATOM 0 H ASP A 67 0.118 15.533 -22.061 1.00 0.00 H new ATOM 0 HA ASP A 67 0.430 18.198 -20.906 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -2.235 17.160 -21.727 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -1.503 18.725 -22.020 1.00 0.00 H new ATOM 1079 N VAL A 68 -1.104 17.951 -18.880 1.00 0.00 N ATOM 1080 CA VAL A 68 -1.734 17.734 -17.589 1.00 0.00 C ATOM 1081 C VAL A 68 -2.626 18.931 -17.253 1.00 0.00 C ATOM 1082 O VAL A 68 -2.367 20.047 -17.702 1.00 0.00 O ATOM 1083 CB VAL A 68 -0.668 17.465 -16.525 1.00 0.00 C ATOM 1084 CG1 VAL A 68 -1.213 17.739 -15.122 1.00 0.00 C ATOM 1085 CG2 VAL A 68 -0.131 16.037 -16.636 1.00 0.00 C ATOM 0 H VAL A 68 -0.856 18.921 -19.076 1.00 0.00 H new ATOM 0 HA VAL A 68 -2.373 16.852 -17.620 1.00 0.00 H new ATOM 0 HB VAL A 68 0.162 18.149 -16.701 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -0.436 17.540 -14.384 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -1.524 18.781 -15.050 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -2.069 17.091 -14.931 1.00 0.00 H new ATOM 0 HG21 VAL A 68 0.625 15.872 -15.868 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -0.948 15.329 -16.498 1.00 0.00 H new ATOM 0 HG23 VAL A 68 0.313 15.891 -17.620 1.00 0.00 H new ATOM 1095 N GLU A 69 -3.657 18.658 -16.467 1.00 0.00 N ATOM 1096 CA GLU A 69 -4.588 19.699 -16.066 1.00 0.00 C ATOM 1097 C GLU A 69 -5.311 19.297 -14.779 1.00 0.00 C ATOM 1098 O GLU A 69 -5.821 18.183 -14.672 1.00 0.00 O ATOM 1099 CB GLU A 69 -5.586 20.003 -17.184 1.00 0.00 C ATOM 1100 CG GLU A 69 -5.103 19.433 -18.520 1.00 0.00 C ATOM 1101 CD GLU A 69 -6.194 19.540 -19.588 1.00 0.00 C ATOM 1102 OE1 GLU A 69 -7.379 19.471 -19.198 1.00 0.00 O ATOM 1103 OE2 GLU A 69 -5.817 19.689 -20.770 1.00 0.00 O ATOM 0 H GLU A 69 -3.868 17.731 -16.097 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.022 20.610 -15.872 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -6.558 19.579 -16.934 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -5.722 21.081 -17.272 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -4.213 19.970 -18.849 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -4.816 18.389 -18.392 1.00 0.00 H new ATOM 1110 N ILE A 70 -5.333 20.226 -13.835 1.00 0.00 N ATOM 1111 CA ILE A 70 -5.985 19.983 -12.560 1.00 0.00 C ATOM 1112 C ILE A 70 -7.502 20.047 -12.748 1.00 0.00 C ATOM 1113 O ILE A 70 -8.050 21.107 -13.045 1.00 0.00 O ATOM 1114 CB ILE A 70 -5.456 20.945 -11.494 1.00 0.00 C ATOM 1115 CG1 ILE A 70 -3.930 21.035 -11.546 1.00 0.00 C ATOM 1116 CG2 ILE A 70 -5.961 20.554 -10.104 1.00 0.00 C ATOM 1117 CD1 ILE A 70 -3.479 22.242 -12.372 1.00 0.00 C ATOM 0 H ILE A 70 -4.909 21.149 -13.928 1.00 0.00 H new ATOM 0 HA ILE A 70 -5.750 18.983 -12.197 1.00 0.00 H new ATOM 0 HB ILE A 70 -5.844 21.941 -11.709 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -3.532 21.113 -10.534 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -3.523 20.121 -11.979 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -5.571 21.254 -9.365 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -7.051 20.583 -10.091 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -5.622 19.546 -9.864 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -2.390 22.282 -12.393 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -3.858 22.149 -13.390 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -3.867 23.156 -11.923 1.00 0.00 H new ATOM 1129 N VAL A 71 -8.138 18.899 -12.567 1.00 0.00 N ATOM 1130 CA VAL A 71 -9.581 18.811 -12.713 1.00 0.00 C ATOM 1131 C VAL A 71 -10.228 18.766 -11.327 1.00 0.00 C ATOM 1132 O VAL A 71 -9.762 19.426 -10.399 1.00 0.00 O ATOM 1133 CB VAL A 71 -9.947 17.607 -13.582 1.00 0.00 C ATOM 1134 CG1 VAL A 71 -11.325 17.791 -14.223 1.00 0.00 C ATOM 1135 CG2 VAL A 71 -8.877 17.354 -14.646 1.00 0.00 C ATOM 0 H VAL A 71 -7.680 18.021 -12.320 1.00 0.00 H new ATOM 0 HA VAL A 71 -9.967 19.693 -13.224 1.00 0.00 H new ATOM 0 HB VAL A 71 -9.993 16.730 -12.937 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -11.561 16.921 -14.836 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -12.078 17.900 -13.442 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -11.319 18.684 -14.848 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -9.161 16.493 -15.250 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -8.785 18.232 -15.286 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -7.921 17.157 -14.161 1.00 0.00 H new ATOM 1145 N SER A 72 -11.292 17.982 -11.230 1.00 0.00 N ATOM 1146 CA SER A 72 -12.007 17.843 -9.973 1.00 0.00 C ATOM 1147 C SER A 72 -12.322 19.224 -9.394 1.00 0.00 C ATOM 1148 O SER A 72 -13.032 20.014 -10.015 1.00 0.00 O ATOM 1149 CB SER A 72 -11.200 17.018 -8.969 1.00 0.00 C ATOM 1150 OG SER A 72 -11.930 16.772 -7.770 1.00 0.00 O ATOM 0 H SER A 72 -11.676 17.437 -12.002 1.00 0.00 H new ATOM 0 HA SER A 72 -12.941 17.316 -10.168 1.00 0.00 H new ATOM 0 HB2 SER A 72 -10.919 16.068 -9.423 1.00 0.00 H new ATOM 0 HB3 SER A 72 -10.275 17.543 -8.729 1.00 0.00 H new ATOM 0 HG SER A 72 -11.541 16.004 -7.302 1.00 0.00 H new ATOM 1156 N GLY A 73 -11.778 19.473 -8.212 1.00 0.00 N ATOM 1157 CA GLY A 73 -11.993 20.744 -7.543 1.00 0.00 C ATOM 1158 C GLY A 73 -10.749 21.168 -6.759 1.00 0.00 C ATOM 1159 O GLY A 73 -10.536 20.717 -5.634 1.00 0.00 O ATOM 0 H GLY A 73 -11.189 18.816 -7.701 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -12.242 21.509 -8.279 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -12.844 20.664 -6.866 1.00 0.00 H new ATOM 1163 N GLN A 74 -9.960 22.029 -7.383 1.00 0.00 N ATOM 1164 CA GLN A 74 -8.743 22.519 -6.758 1.00 0.00 C ATOM 1165 C GLN A 74 -9.082 23.450 -5.593 1.00 0.00 C ATOM 1166 O GLN A 74 -8.258 23.667 -4.706 1.00 0.00 O ATOM 1167 CB GLN A 74 -7.846 23.222 -7.779 1.00 0.00 C ATOM 1168 CG GLN A 74 -8.676 23.823 -8.916 1.00 0.00 C ATOM 1169 CD GLN A 74 -7.917 24.957 -9.609 1.00 0.00 C ATOM 1170 OE1 GLN A 74 -7.412 24.817 -10.710 1.00 0.00 O ATOM 1171 NE2 GLN A 74 -7.867 26.083 -8.904 1.00 0.00 N ATOM 0 H GLN A 74 -10.139 22.401 -8.316 1.00 0.00 H new ATOM 0 HA GLN A 74 -8.191 21.665 -6.366 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -7.275 24.008 -7.286 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -7.126 22.512 -8.186 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -8.920 23.047 -9.642 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -9.620 24.200 -8.522 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -8.312 26.131 -7.987 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -7.384 26.899 -9.280 1.00 0.00 H new ATOM 1180 N LYS A 75 -10.297 23.977 -5.633 1.00 0.00 N ATOM 1181 CA LYS A 75 -10.755 24.881 -4.591 1.00 0.00 C ATOM 1182 C LYS A 75 -10.492 24.250 -3.223 1.00 0.00 C ATOM 1183 O LYS A 75 -10.109 24.941 -2.280 1.00 0.00 O ATOM 1184 CB LYS A 75 -12.219 25.264 -4.820 1.00 0.00 C ATOM 1185 CG LYS A 75 -12.521 25.409 -6.313 1.00 0.00 C ATOM 1186 CD LYS A 75 -13.522 26.538 -6.563 1.00 0.00 C ATOM 1187 CE LYS A 75 -14.900 26.183 -6.000 1.00 0.00 C ATOM 1188 NZ LYS A 75 -15.957 26.475 -6.995 1.00 0.00 N ATOM 0 H LYS A 75 -10.978 23.796 -6.370 1.00 0.00 H new ATOM 0 HA LYS A 75 -10.195 25.816 -4.624 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -12.869 24.505 -4.386 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -12.438 26.201 -4.308 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -11.598 25.610 -6.856 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -12.921 24.472 -6.699 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -13.162 27.457 -6.101 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -13.601 26.729 -7.633 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -14.928 25.127 -5.730 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -15.084 26.751 -5.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -16.886 26.229 -6.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -15.940 27.487 -7.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -15.789 25.915 -7.855 1.00 0.00 H new ATOM 1202 N SER A 76 -10.708 22.944 -3.157 1.00 0.00 N ATOM 1203 CA SER A 76 -10.498 22.212 -1.919 1.00 0.00 C ATOM 1204 C SER A 76 -9.178 21.442 -1.984 1.00 0.00 C ATOM 1205 O SER A 76 -8.985 20.472 -1.252 1.00 0.00 O ATOM 1206 CB SER A 76 -11.659 21.255 -1.642 1.00 0.00 C ATOM 1207 OG SER A 76 -12.201 21.435 -0.337 1.00 0.00 O ATOM 0 H SER A 76 -11.026 22.374 -3.941 1.00 0.00 H new ATOM 0 HA SER A 76 -10.452 22.930 -1.100 1.00 0.00 H new ATOM 0 HB2 SER A 76 -12.442 21.411 -2.384 1.00 0.00 H new ATOM 0 HB3 SER A 76 -11.315 20.227 -1.753 1.00 0.00 H new ATOM 0 HG SER A 76 -12.941 20.807 -0.200 1.00 0.00 H new ATOM 1213 N ARG A 77 -8.304 21.902 -2.866 1.00 0.00 N ATOM 1214 CA ARG A 77 -7.007 21.268 -3.036 1.00 0.00 C ATOM 1215 C ARG A 77 -7.166 19.910 -3.722 1.00 0.00 C ATOM 1216 O ARG A 77 -6.440 19.597 -4.664 1.00 0.00 O ATOM 1217 CB ARG A 77 -6.309 21.073 -1.689 1.00 0.00 C ATOM 1218 CG ARG A 77 -6.227 19.590 -1.323 1.00 0.00 C ATOM 1219 CD ARG A 77 -5.469 19.390 -0.010 1.00 0.00 C ATOM 1220 NE ARG A 77 -5.747 20.514 0.912 1.00 0.00 N ATOM 1221 CZ ARG A 77 -5.028 21.643 0.958 1.00 0.00 C ATOM 1222 NH1 ARG A 77 -3.982 21.805 0.136 1.00 0.00 N ATOM 1223 NH2 ARG A 77 -5.354 22.610 1.827 1.00 0.00 N ATOM 0 H ARG A 77 -8.468 22.707 -3.471 1.00 0.00 H new ATOM 0 HA ARG A 77 -6.396 21.923 -3.657 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -5.306 21.497 -1.731 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -6.851 21.613 -0.913 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -7.232 19.178 -1.233 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -5.728 19.042 -2.122 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -5.767 18.448 0.451 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -4.399 19.325 -0.205 1.00 0.00 H new ATOM 0 HE ARG A 77 -6.536 20.423 1.552 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -3.734 21.069 -0.525 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -3.434 22.665 0.171 1.00 0.00 H new ATOM 0 HH21 ARG A 77 -6.150 22.486 2.453 1.00 0.00 H new ATOM 0 HH22 ARG A 77 -4.806 23.470 1.862 1.00 0.00 H new ATOM 1237 N GLN A 78 -8.121 19.139 -3.222 1.00 0.00 N ATOM 1238 CA GLN A 78 -8.384 17.821 -3.775 1.00 0.00 C ATOM 1239 C GLN A 78 -9.102 17.944 -5.120 1.00 0.00 C ATOM 1240 O GLN A 78 -10.256 18.365 -5.176 1.00 0.00 O ATOM 1241 CB GLN A 78 -9.195 16.968 -2.797 1.00 0.00 C ATOM 1242 CG GLN A 78 -8.310 15.921 -2.118 1.00 0.00 C ATOM 1243 CD GLN A 78 -8.459 15.980 -0.596 1.00 0.00 C ATOM 1244 OE1 GLN A 78 -9.289 15.311 -0.002 1.00 0.00 O ATOM 1245 NE2 GLN A 78 -7.611 16.814 -0.002 1.00 0.00 N ATOM 0 H GLN A 78 -8.722 19.402 -2.441 1.00 0.00 H new ATOM 0 HA GLN A 78 -7.430 17.320 -3.939 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -9.651 17.608 -2.042 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -10.008 16.473 -3.328 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -8.578 14.927 -2.475 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -7.268 16.088 -2.392 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -6.941 17.344 -0.560 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -7.630 16.924 1.012 1.00 0.00 H new ATOM 1254 N LYS A 79 -8.389 17.568 -6.172 1.00 0.00 N ATOM 1255 CA LYS A 79 -8.943 17.630 -7.513 1.00 0.00 C ATOM 1256 C LYS A 79 -8.475 16.411 -8.311 1.00 0.00 C ATOM 1257 O LYS A 79 -7.949 15.457 -7.741 1.00 0.00 O ATOM 1258 CB LYS A 79 -8.598 18.967 -8.174 1.00 0.00 C ATOM 1259 CG LYS A 79 -7.543 19.722 -7.364 1.00 0.00 C ATOM 1260 CD LYS A 79 -6.228 18.942 -7.314 1.00 0.00 C ATOM 1261 CE LYS A 79 -6.101 18.003 -8.515 1.00 0.00 C ATOM 1262 NZ LYS A 79 -4.677 17.784 -8.854 1.00 0.00 N ATOM 0 H LYS A 79 -7.432 17.219 -6.122 1.00 0.00 H new ATOM 0 HA LYS A 79 -10.032 17.589 -7.477 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -8.230 18.793 -9.185 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -9.498 19.576 -8.263 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -7.372 20.703 -7.808 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -7.909 19.890 -6.351 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -5.389 19.638 -7.301 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -6.178 18.365 -6.390 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -6.578 17.049 -8.290 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -6.624 18.427 -9.372 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -4.573 17.710 -9.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -4.110 18.583 -8.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -4.345 16.905 -8.409 1.00 0.00 H new ATOM 1276 N THR A 80 -8.685 16.483 -9.617 1.00 0.00 N ATOM 1277 CA THR A 80 -8.292 15.397 -10.499 1.00 0.00 C ATOM 1278 C THR A 80 -7.383 15.919 -11.614 1.00 0.00 C ATOM 1279 O THR A 80 -7.746 16.850 -12.331 1.00 0.00 O ATOM 1280 CB THR A 80 -9.564 14.724 -11.017 1.00 0.00 C ATOM 1281 OG1 THR A 80 -9.828 13.700 -10.062 1.00 0.00 O ATOM 1282 CG2 THR A 80 -9.334 13.964 -12.325 1.00 0.00 C ATOM 0 H THR A 80 -9.122 17.276 -10.086 1.00 0.00 H new ATOM 0 HA THR A 80 -7.705 14.648 -9.967 1.00 0.00 H new ATOM 0 HB THR A 80 -10.338 15.477 -11.167 1.00 0.00 H new ATOM 0 HG1 THR A 80 -10.199 12.916 -10.518 1.00 0.00 H new ATOM 0 HG21 THR A 80 -10.268 13.505 -12.649 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.985 14.656 -13.091 1.00 0.00 H new ATOM 0 HG23 THR A 80 -8.584 13.188 -12.168 1.00 0.00 H new ATOM 1290 N ILE A 81 -6.219 15.295 -11.726 1.00 0.00 N ATOM 1291 CA ILE A 81 -5.256 15.685 -12.741 1.00 0.00 C ATOM 1292 C ILE A 81 -5.594 14.978 -14.056 1.00 0.00 C ATOM 1293 O ILE A 81 -5.507 13.755 -14.148 1.00 0.00 O ATOM 1294 CB ILE A 81 -3.829 15.426 -12.254 1.00 0.00 C ATOM 1295 CG1 ILE A 81 -3.556 13.926 -12.128 1.00 0.00 C ATOM 1296 CG2 ILE A 81 -3.554 16.170 -10.945 1.00 0.00 C ATOM 1297 CD1 ILE A 81 -2.064 13.656 -11.922 1.00 0.00 C ATOM 0 H ILE A 81 -5.922 14.522 -11.130 1.00 0.00 H new ATOM 0 HA ILE A 81 -5.314 16.757 -12.929 1.00 0.00 H new ATOM 0 HB ILE A 81 -3.137 15.817 -13.000 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -4.122 13.519 -11.290 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -3.902 13.413 -13.026 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -2.533 15.969 -10.620 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -3.681 17.241 -11.102 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -4.252 15.830 -10.180 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -1.897 12.582 -11.835 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -1.503 14.043 -12.773 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -1.727 14.150 -11.011 1.00 0.00 H new ATOM 1309 N ARG A 82 -5.973 15.780 -15.041 1.00 0.00 N ATOM 1310 CA ARG A 82 -6.324 15.247 -16.346 1.00 0.00 C ATOM 1311 C ARG A 82 -5.134 15.356 -17.302 1.00 0.00 C ATOM 1312 O ARG A 82 -4.689 16.457 -17.622 1.00 0.00 O ATOM 1313 CB ARG A 82 -7.519 15.994 -16.943 1.00 0.00 C ATOM 1314 CG ARG A 82 -7.716 15.626 -18.414 1.00 0.00 C ATOM 1315 CD ARG A 82 -8.852 16.440 -19.036 1.00 0.00 C ATOM 1316 NE ARG A 82 -10.023 15.569 -19.284 1.00 0.00 N ATOM 1317 CZ ARG A 82 -10.189 14.831 -20.390 1.00 0.00 C ATOM 1318 NH1 ARG A 82 -9.262 14.855 -21.357 1.00 0.00 N ATOM 1319 NH2 ARG A 82 -11.283 14.070 -20.529 1.00 0.00 N ATOM 0 H ARG A 82 -6.044 16.794 -14.961 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.594 14.199 -16.214 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -8.421 15.753 -16.380 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -7.363 17.069 -16.851 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -6.792 15.805 -18.964 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -7.937 14.562 -18.500 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -9.131 17.257 -18.371 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -8.518 16.890 -19.971 1.00 0.00 H new ATOM 0 HE ARG A 82 -10.749 15.528 -18.568 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -8.430 15.435 -21.251 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -9.389 14.293 -22.199 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -11.989 14.053 -19.793 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -11.410 13.508 -21.371 1.00 0.00 H new ATOM 1333 N ILE A 83 -4.653 14.198 -17.731 1.00 0.00 N ATOM 1334 CA ILE A 83 -3.523 14.150 -18.643 1.00 0.00 C ATOM 1335 C ILE A 83 -4.036 13.971 -20.074 1.00 0.00 C ATOM 1336 O ILE A 83 -4.887 13.121 -20.330 1.00 0.00 O ATOM 1337 CB ILE A 83 -2.529 13.072 -18.208 1.00 0.00 C ATOM 1338 CG1 ILE A 83 -2.353 13.070 -16.688 1.00 0.00 C ATOM 1339 CG2 ILE A 83 -1.194 13.230 -18.939 1.00 0.00 C ATOM 1340 CD1 ILE A 83 -0.937 12.638 -16.300 1.00 0.00 C ATOM 0 H ILE A 83 -5.025 13.287 -17.464 1.00 0.00 H new ATOM 0 HA ILE A 83 -2.971 15.090 -18.616 1.00 0.00 H new ATOM 0 HB ILE A 83 -2.936 12.100 -18.487 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -2.554 14.066 -16.294 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -3.080 12.396 -16.235 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -0.505 12.451 -18.611 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -1.355 13.143 -20.014 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -0.769 14.208 -18.713 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -0.839 12.645 -15.214 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -0.748 11.632 -16.675 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -0.214 13.329 -16.734 1.00 0.00 H new ATOM 1352 N GLN A 84 -3.496 14.786 -20.968 1.00 0.00 N ATOM 1353 CA GLN A 84 -3.889 14.729 -22.366 1.00 0.00 C ATOM 1354 C GLN A 84 -2.816 14.013 -23.189 1.00 0.00 C ATOM 1355 O GLN A 84 -1.624 14.251 -23.002 1.00 0.00 O ATOM 1356 CB GLN A 84 -4.159 16.130 -22.917 1.00 0.00 C ATOM 1357 CG GLN A 84 -4.825 16.059 -24.293 1.00 0.00 C ATOM 1358 CD GLN A 84 -4.804 17.424 -24.984 1.00 0.00 C ATOM 1359 OE1 GLN A 84 -6.010 17.946 -25.187 1.00 0.00 O flip ATOM 1360 NE2 GLN A 84 -3.761 17.966 -25.311 1.00 0.00 N flip ATOM 0 H GLN A 84 -2.790 15.489 -20.752 1.00 0.00 H new ATOM 0 HA GLN A 84 -4.816 14.161 -22.440 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -4.800 16.679 -22.227 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -3.222 16.683 -22.990 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -4.309 15.326 -24.913 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -5.855 15.718 -24.185 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -2.868 17.509 -25.125 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -3.782 18.876 -25.770 1.00 0.00 H new ATOM 1369 N GLY A 85 -3.278 13.151 -24.083 1.00 0.00 N ATOM 1370 CA GLY A 85 -2.373 12.400 -24.936 1.00 0.00 C ATOM 1371 C GLY A 85 -1.791 11.196 -24.191 1.00 0.00 C ATOM 1372 O GLY A 85 -1.048 10.404 -24.769 1.00 0.00 O ATOM 0 H GLY A 85 -4.268 12.956 -24.235 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -2.904 12.060 -25.826 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.565 13.048 -25.275 1.00 0.00 H new ATOM 1376 N MET A 86 -2.150 11.097 -22.920 1.00 0.00 N ATOM 1377 CA MET A 86 -1.672 10.004 -22.090 1.00 0.00 C ATOM 1378 C MET A 86 -2.814 9.053 -21.726 1.00 0.00 C ATOM 1379 O MET A 86 -3.985 9.383 -21.911 1.00 0.00 O ATOM 1380 CB MET A 86 -1.049 10.568 -20.812 1.00 0.00 C ATOM 1381 CG MET A 86 -1.380 9.686 -19.606 1.00 0.00 C ATOM 1382 SD MET A 86 -0.094 9.826 -18.376 1.00 0.00 S ATOM 1383 CE MET A 86 1.321 9.343 -19.351 1.00 0.00 C ATOM 0 H MET A 86 -2.766 11.756 -22.444 1.00 0.00 H new ATOM 0 HA MET A 86 -0.924 9.445 -22.652 1.00 0.00 H new ATOM 0 HB2 MET A 86 0.032 10.638 -20.930 1.00 0.00 H new ATOM 0 HB3 MET A 86 -1.417 11.579 -20.639 1.00 0.00 H new ATOM 0 HG2 MET A 86 -2.337 9.984 -19.179 1.00 0.00 H new ATOM 0 HG3 MET A 86 -1.481 8.648 -19.921 1.00 0.00 H new ATOM 0 HE1 MET A 86 1.773 8.450 -18.919 1.00 0.00 H new ATOM 0 HE2 MET A 86 1.004 9.131 -20.372 1.00 0.00 H new ATOM 0 HE3 MET A 86 2.051 10.152 -19.358 1.00 0.00 H new ATOM 1393 N GLY A 87 -2.434 7.892 -21.214 1.00 0.00 N ATOM 1394 CA GLY A 87 -3.411 6.891 -20.821 1.00 0.00 C ATOM 1395 C GLY A 87 -3.138 6.383 -19.404 1.00 0.00 C ATOM 1396 O GLY A 87 -2.534 7.086 -18.595 1.00 0.00 O ATOM 0 H GLY A 87 -1.462 7.622 -21.062 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -4.413 7.317 -20.871 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -3.384 6.056 -21.522 1.00 0.00 H new ATOM 1400 N ARG A 88 -3.596 5.167 -19.147 1.00 0.00 N ATOM 1401 CA ARG A 88 -3.408 4.557 -17.842 1.00 0.00 C ATOM 1402 C ARG A 88 -2.002 3.964 -17.730 1.00 0.00 C ATOM 1403 O ARG A 88 -1.226 4.356 -16.860 1.00 0.00 O ATOM 1404 CB ARG A 88 -4.440 3.455 -17.595 1.00 0.00 C ATOM 1405 CG ARG A 88 -4.979 3.519 -16.164 1.00 0.00 C ATOM 1406 CD ARG A 88 -6.147 2.549 -15.974 1.00 0.00 C ATOM 1407 NE ARG A 88 -7.060 3.055 -14.925 1.00 0.00 N ATOM 1408 CZ ARG A 88 -7.981 2.305 -14.305 1.00 0.00 C ATOM 1409 NH1 ARG A 88 -8.116 1.010 -14.624 1.00 0.00 N ATOM 1410 NH2 ARG A 88 -8.766 2.848 -13.365 1.00 0.00 N ATOM 0 H ARG A 88 -4.097 4.588 -19.821 1.00 0.00 H new ATOM 0 HA ARG A 88 -3.538 5.336 -17.091 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -5.263 3.557 -18.302 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -3.986 2.480 -17.773 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -4.182 3.277 -15.460 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -5.305 4.535 -15.939 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -6.688 2.431 -16.913 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -5.771 1.564 -15.696 1.00 0.00 H new ATOM 0 HE ARG A 88 -6.983 4.036 -14.657 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -7.518 0.596 -15.339 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -8.817 0.439 -14.152 1.00 0.00 H new ATOM 0 HH21 ARG A 88 -8.663 3.833 -13.121 1.00 0.00 H new ATOM 0 HH22 ARG A 88 -9.467 2.276 -12.893 1.00 0.00 H new ATOM 1424 N ASP A 89 -1.717 3.028 -18.624 1.00 0.00 N ATOM 1425 CA ASP A 89 -0.418 2.376 -18.636 1.00 0.00 C ATOM 1426 C ASP A 89 0.681 3.440 -18.617 1.00 0.00 C ATOM 1427 O ASP A 89 1.707 3.266 -17.960 1.00 0.00 O ATOM 1428 CB ASP A 89 -0.238 1.533 -19.900 1.00 0.00 C ATOM 1429 CG ASP A 89 -1.240 0.389 -20.063 1.00 0.00 C ATOM 1430 OD1 ASP A 89 -2.358 0.533 -19.522 1.00 0.00 O ATOM 1431 OD2 ASP A 89 -0.866 -0.604 -20.724 1.00 0.00 O ATOM 0 H ASP A 89 -2.363 2.706 -19.345 1.00 0.00 H new ATOM 0 HA ASP A 89 -0.355 1.731 -17.760 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -0.312 2.187 -20.768 1.00 0.00 H new ATOM 0 HB3 ASP A 89 0.769 1.116 -19.900 1.00 0.00 H new ATOM 1436 N LEU A 90 0.430 4.518 -19.345 1.00 0.00 N ATOM 1437 CA LEU A 90 1.386 5.610 -19.420 1.00 0.00 C ATOM 1438 C LEU A 90 1.714 6.092 -18.005 1.00 0.00 C ATOM 1439 O LEU A 90 2.843 5.940 -17.540 1.00 0.00 O ATOM 1440 CB LEU A 90 0.866 6.715 -20.341 1.00 0.00 C ATOM 1441 CG LEU A 90 0.231 6.251 -21.653 1.00 0.00 C ATOM 1442 CD1 LEU A 90 0.223 7.378 -22.688 1.00 0.00 C ATOM 1443 CD2 LEU A 90 0.921 4.992 -22.182 1.00 0.00 C ATOM 0 H LEU A 90 -0.422 4.659 -19.888 1.00 0.00 H new ATOM 0 HA LEU A 90 2.320 5.269 -19.866 1.00 0.00 H new ATOM 0 HB2 LEU A 90 0.130 7.302 -19.792 1.00 0.00 H new ATOM 0 HB3 LEU A 90 1.694 7.383 -20.578 1.00 0.00 H new ATOM 0 HG LEU A 90 -0.808 5.989 -21.454 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -0.234 7.021 -23.611 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -0.349 8.222 -22.303 1.00 0.00 H new ATOM 0 HD13 LEU A 90 1.246 7.695 -22.889 1.00 0.00 H new ATOM 0 HD21 LEU A 90 0.450 4.684 -23.115 1.00 0.00 H new ATOM 0 HD22 LEU A 90 1.976 5.203 -22.360 1.00 0.00 H new ATOM 0 HD23 LEU A 90 0.830 4.191 -21.448 1.00 0.00 H new ATOM 1455 N PHE A 91 0.708 6.664 -17.361 1.00 0.00 N ATOM 1456 CA PHE A 91 0.875 7.170 -16.009 1.00 0.00 C ATOM 1457 C PHE A 91 1.502 6.110 -15.101 1.00 0.00 C ATOM 1458 O PHE A 91 2.407 6.410 -14.324 1.00 0.00 O ATOM 1459 CB PHE A 91 -0.520 7.514 -15.484 1.00 0.00 C ATOM 1460 CG PHE A 91 -0.546 7.925 -14.011 1.00 0.00 C ATOM 1461 CD1 PHE A 91 -0.322 6.997 -13.042 1.00 0.00 C ATOM 1462 CD2 PHE A 91 -0.794 9.218 -13.670 1.00 0.00 C ATOM 1463 CE1 PHE A 91 -0.347 7.378 -11.674 1.00 0.00 C ATOM 1464 CE2 PHE A 91 -0.819 9.599 -12.302 1.00 0.00 C ATOM 1465 CZ PHE A 91 -0.595 8.671 -11.333 1.00 0.00 C ATOM 0 H PHE A 91 -0.226 6.789 -17.750 1.00 0.00 H new ATOM 0 HA PHE A 91 1.532 8.039 -16.016 1.00 0.00 H new ATOM 0 HB2 PHE A 91 -0.933 8.325 -16.084 1.00 0.00 H new ATOM 0 HB3 PHE A 91 -1.172 6.651 -15.622 1.00 0.00 H new ATOM 0 HD1 PHE A 91 -0.125 5.970 -13.313 1.00 0.00 H new ATOM 0 HD2 PHE A 91 -0.972 9.955 -14.439 1.00 0.00 H new ATOM 0 HE1 PHE A 91 -0.169 6.641 -10.905 1.00 0.00 H new ATOM 0 HE2 PHE A 91 -1.016 10.626 -12.031 1.00 0.00 H new ATOM 0 HZ PHE A 91 -0.614 8.961 -10.293 1.00 0.00 H new ATOM 1475 N LEU A 92 0.996 4.892 -15.230 1.00 0.00 N ATOM 1476 CA LEU A 92 1.495 3.786 -14.430 1.00 0.00 C ATOM 1477 C LEU A 92 2.946 3.497 -14.817 1.00 0.00 C ATOM 1478 O LEU A 92 3.800 3.316 -13.950 1.00 0.00 O ATOM 1479 CB LEU A 92 0.571 2.573 -14.559 1.00 0.00 C ATOM 1480 CG LEU A 92 -0.207 2.187 -13.299 1.00 0.00 C ATOM 1481 CD1 LEU A 92 -1.126 0.993 -13.567 1.00 0.00 C ATOM 1482 CD2 LEU A 92 0.741 1.928 -12.126 1.00 0.00 C ATOM 0 H LEU A 92 0.246 4.647 -15.876 1.00 0.00 H new ATOM 0 HA LEU A 92 1.493 4.049 -13.372 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -0.144 2.769 -15.358 1.00 0.00 H new ATOM 0 HB3 LEU A 92 1.169 1.716 -14.870 1.00 0.00 H new ATOM 0 HG LEU A 92 -0.843 3.027 -13.019 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -1.667 0.739 -12.656 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -1.837 1.250 -14.352 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -0.529 0.138 -13.885 1.00 0.00 H new ATOM 0 HD21 LEU A 92 0.162 1.656 -11.244 1.00 0.00 H new ATOM 0 HD22 LEU A 92 1.420 1.114 -12.380 1.00 0.00 H new ATOM 0 HD23 LEU A 92 1.317 2.830 -11.918 1.00 0.00 H new ATOM 1494 N LYS A 93 3.182 3.462 -16.121 1.00 0.00 N ATOM 1495 CA LYS A 93 4.516 3.198 -16.633 1.00 0.00 C ATOM 1496 C LYS A 93 5.523 4.093 -15.908 1.00 0.00 C ATOM 1497 O LYS A 93 6.506 3.605 -15.352 1.00 0.00 O ATOM 1498 CB LYS A 93 4.545 3.347 -18.155 1.00 0.00 C ATOM 1499 CG LYS A 93 5.589 2.419 -18.778 1.00 0.00 C ATOM 1500 CD LYS A 93 4.951 1.492 -19.814 1.00 0.00 C ATOM 1501 CE LYS A 93 4.325 0.268 -19.142 1.00 0.00 C ATOM 1502 NZ LYS A 93 4.732 -0.972 -19.841 1.00 0.00 N ATOM 0 H LYS A 93 2.472 3.612 -16.838 1.00 0.00 H new ATOM 0 HA LYS A 93 4.804 2.166 -16.431 1.00 0.00 H new ATOM 0 HB2 LYS A 93 3.561 3.120 -18.565 1.00 0.00 H new ATOM 0 HB3 LYS A 93 4.769 4.381 -18.418 1.00 0.00 H new ATOM 0 HG2 LYS A 93 6.373 3.012 -19.249 1.00 0.00 H new ATOM 0 HG3 LYS A 93 6.065 1.825 -17.998 1.00 0.00 H new ATOM 0 HD2 LYS A 93 4.188 2.035 -20.372 1.00 0.00 H new ATOM 0 HD3 LYS A 93 5.705 1.171 -20.533 1.00 0.00 H new ATOM 0 HE2 LYS A 93 4.633 0.222 -18.098 1.00 0.00 H new ATOM 0 HE3 LYS A 93 3.239 0.357 -19.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 4.299 -1.793 -19.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 4.416 -0.932 -20.831 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 5.768 -1.063 -19.811 1.00 0.00 H new ATOM 1516 N LEU A 94 5.243 5.388 -15.937 1.00 0.00 N ATOM 1517 CA LEU A 94 6.112 6.356 -15.290 1.00 0.00 C ATOM 1518 C LEU A 94 6.227 6.017 -13.802 1.00 0.00 C ATOM 1519 O LEU A 94 7.317 6.063 -13.234 1.00 0.00 O ATOM 1520 CB LEU A 94 5.622 7.780 -15.560 1.00 0.00 C ATOM 1521 CG LEU A 94 6.574 8.677 -16.354 1.00 0.00 C ATOM 1522 CD1 LEU A 94 6.357 10.151 -16.005 1.00 0.00 C ATOM 1523 CD2 LEU A 94 8.028 8.248 -16.153 1.00 0.00 C ATOM 0 H LEU A 94 4.427 5.789 -16.398 1.00 0.00 H new ATOM 0 HA LEU A 94 7.117 6.305 -15.708 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.676 7.722 -16.098 1.00 0.00 H new ATOM 0 HB3 LEU A 94 5.416 8.260 -14.603 1.00 0.00 H new ATOM 0 HG LEU A 94 6.349 8.561 -17.414 1.00 0.00 H new ATOM 0 HD11 LEU A 94 7.046 10.767 -16.583 1.00 0.00 H new ATOM 0 HD12 LEU A 94 5.331 10.434 -16.242 1.00 0.00 H new ATOM 0 HD13 LEU A 94 6.539 10.304 -14.941 1.00 0.00 H new ATOM 0 HD21 LEU A 94 8.683 8.902 -16.728 1.00 0.00 H new ATOM 0 HD22 LEU A 94 8.285 8.316 -15.096 1.00 0.00 H new ATOM 0 HD23 LEU A 94 8.154 7.220 -16.491 1.00 0.00 H new ATOM 1535 N VAL A 95 5.087 5.685 -13.214 1.00 0.00 N ATOM 1536 CA VAL A 95 5.046 5.338 -11.803 1.00 0.00 C ATOM 1537 C VAL A 95 5.885 4.081 -11.567 1.00 0.00 C ATOM 1538 O VAL A 95 6.641 4.007 -10.600 1.00 0.00 O ATOM 1539 CB VAL A 95 3.595 5.184 -11.344 1.00 0.00 C ATOM 1540 CG1 VAL A 95 3.514 4.391 -10.038 1.00 0.00 C ATOM 1541 CG2 VAL A 95 2.918 6.549 -11.200 1.00 0.00 C ATOM 0 H VAL A 95 4.185 5.649 -13.689 1.00 0.00 H new ATOM 0 HA VAL A 95 5.480 6.136 -11.200 1.00 0.00 H new ATOM 0 HB VAL A 95 3.059 4.623 -12.110 1.00 0.00 H new ATOM 0 HG11 VAL A 95 2.472 4.296 -9.734 1.00 0.00 H new ATOM 0 HG12 VAL A 95 3.940 3.399 -10.188 1.00 0.00 H new ATOM 0 HG13 VAL A 95 4.073 4.912 -9.261 1.00 0.00 H new ATOM 0 HG21 VAL A 95 1.887 6.411 -10.873 1.00 0.00 H new ATOM 0 HG22 VAL A 95 3.456 7.146 -10.464 1.00 0.00 H new ATOM 0 HG23 VAL A 95 2.928 7.063 -12.161 1.00 0.00 H new ATOM 1551 N SER A 96 5.722 3.122 -12.467 1.00 0.00 N ATOM 1552 CA SER A 96 6.455 1.871 -12.369 1.00 0.00 C ATOM 1553 C SER A 96 7.922 2.094 -12.741 1.00 0.00 C ATOM 1554 O SER A 96 8.807 1.410 -12.228 1.00 0.00 O ATOM 1555 CB SER A 96 5.836 0.799 -13.267 1.00 0.00 C ATOM 1556 OG SER A 96 6.220 -0.516 -12.872 1.00 0.00 O ATOM 0 H SER A 96 5.093 3.186 -13.267 1.00 0.00 H new ATOM 0 HA SER A 96 6.398 1.520 -11.339 1.00 0.00 H new ATOM 0 HB2 SER A 96 4.750 0.884 -13.237 1.00 0.00 H new ATOM 0 HB3 SER A 96 6.141 0.971 -14.299 1.00 0.00 H new ATOM 0 HG SER A 96 5.803 -1.172 -13.469 1.00 0.00 H new ATOM 1562 N GLU A 97 8.135 3.052 -13.631 1.00 0.00 N ATOM 1563 CA GLU A 97 9.480 3.373 -14.078 1.00 0.00 C ATOM 1564 C GLU A 97 10.195 4.234 -13.035 1.00 0.00 C ATOM 1565 O GLU A 97 11.317 3.929 -12.636 1.00 0.00 O ATOM 1566 CB GLU A 97 9.454 4.069 -15.440 1.00 0.00 C ATOM 1567 CG GLU A 97 9.744 3.078 -16.569 1.00 0.00 C ATOM 1568 CD GLU A 97 10.911 3.559 -17.434 1.00 0.00 C ATOM 1569 OE1 GLU A 97 10.667 4.456 -18.269 1.00 0.00 O ATOM 1570 OE2 GLU A 97 12.021 3.018 -17.240 1.00 0.00 O ATOM 0 H GLU A 97 7.399 3.616 -14.055 1.00 0.00 H new ATOM 0 HA GLU A 97 10.035 2.442 -14.194 1.00 0.00 H new ATOM 0 HB2 GLU A 97 8.479 4.530 -15.598 1.00 0.00 H new ATOM 0 HB3 GLU A 97 10.192 4.871 -15.457 1.00 0.00 H new ATOM 0 HG2 GLU A 97 9.977 2.100 -16.148 1.00 0.00 H new ATOM 0 HG3 GLU A 97 8.855 2.955 -17.187 1.00 0.00 H new ATOM 1577 N LYS A 98 9.515 5.295 -12.624 1.00 0.00 N ATOM 1578 CA LYS A 98 10.071 6.203 -11.635 1.00 0.00 C ATOM 1579 C LYS A 98 9.754 5.679 -10.233 1.00 0.00 C ATOM 1580 O LYS A 98 10.661 5.431 -9.440 1.00 0.00 O ATOM 1581 CB LYS A 98 9.580 7.631 -11.884 1.00 0.00 C ATOM 1582 CG LYS A 98 10.672 8.480 -12.537 1.00 0.00 C ATOM 1583 CD LYS A 98 10.232 8.970 -13.918 1.00 0.00 C ATOM 1584 CE LYS A 98 10.817 10.352 -14.221 1.00 0.00 C ATOM 1585 NZ LYS A 98 11.848 10.258 -15.278 1.00 0.00 N ATOM 0 H LYS A 98 8.584 5.546 -12.958 1.00 0.00 H new ATOM 0 HA LYS A 98 11.157 6.244 -11.722 1.00 0.00 H new ATOM 0 HB2 LYS A 98 8.699 7.610 -12.525 1.00 0.00 H new ATOM 0 HB3 LYS A 98 9.277 8.085 -10.940 1.00 0.00 H new ATOM 0 HG2 LYS A 98 10.903 9.334 -11.901 1.00 0.00 H new ATOM 0 HG3 LYS A 98 11.587 7.894 -12.629 1.00 0.00 H new ATOM 0 HD2 LYS A 98 10.554 8.260 -14.680 1.00 0.00 H new ATOM 0 HD3 LYS A 98 9.144 9.014 -13.963 1.00 0.00 H new ATOM 0 HE2 LYS A 98 10.023 11.028 -14.538 1.00 0.00 H new ATOM 0 HE3 LYS A 98 11.253 10.775 -13.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 12.234 11.204 -15.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 12.614 9.629 -14.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 11.422 9.874 -16.146 1.00 0.00 H new ATOM 1599 N PHE A 99 8.465 5.527 -9.970 1.00 0.00 N ATOM 1600 CA PHE A 99 8.018 5.037 -8.677 1.00 0.00 C ATOM 1601 C PHE A 99 8.313 3.543 -8.525 1.00 0.00 C ATOM 1602 O PHE A 99 8.179 2.988 -7.435 1.00 0.00 O ATOM 1603 CB PHE A 99 6.504 5.254 -8.616 1.00 0.00 C ATOM 1604 CG PHE A 99 6.039 6.051 -7.395 1.00 0.00 C ATOM 1605 CD1 PHE A 99 6.006 7.409 -7.442 1.00 0.00 C ATOM 1606 CD2 PHE A 99 5.659 5.400 -6.263 1.00 0.00 C ATOM 1607 CE1 PHE A 99 5.575 8.149 -6.310 1.00 0.00 C ATOM 1608 CE2 PHE A 99 5.227 6.140 -5.130 1.00 0.00 C ATOM 1609 CZ PHE A 99 5.194 7.499 -5.178 1.00 0.00 C ATOM 0 H PHE A 99 7.715 5.734 -10.630 1.00 0.00 H new ATOM 0 HA PHE A 99 8.538 5.566 -7.878 1.00 0.00 H new ATOM 0 HB2 PHE A 99 6.185 5.774 -9.519 1.00 0.00 H new ATOM 0 HB3 PHE A 99 6.008 4.284 -8.614 1.00 0.00 H new ATOM 0 HD1 PHE A 99 6.308 7.925 -8.341 1.00 0.00 H new ATOM 0 HD2 PHE A 99 5.686 4.321 -6.225 1.00 0.00 H new ATOM 0 HE1 PHE A 99 5.550 9.228 -6.348 1.00 0.00 H new ATOM 0 HE2 PHE A 99 4.925 5.624 -4.231 1.00 0.00 H new ATOM 0 HZ PHE A 99 4.865 8.062 -4.317 1.00 0.00 H new ATOM 1619 N GLY A 100 8.710 2.935 -9.633 1.00 0.00 N ATOM 1620 CA GLY A 100 9.026 1.517 -9.636 1.00 0.00 C ATOM 1621 C GLY A 100 7.872 0.697 -9.054 1.00 0.00 C ATOM 1622 O GLY A 100 8.077 -0.420 -8.581 1.00 0.00 O ATOM 0 H GLY A 100 8.820 3.398 -10.535 1.00 0.00 H new ATOM 0 HA2 GLY A 100 9.233 1.189 -10.655 1.00 0.00 H new ATOM 0 HA3 GLY A 100 9.931 1.341 -9.055 1.00 0.00 H new ATOM 1626 N LEU A 101 6.685 1.283 -9.109 1.00 0.00 N ATOM 1627 CA LEU A 101 5.499 0.621 -8.594 1.00 0.00 C ATOM 1628 C LEU A 101 4.468 0.485 -9.716 1.00 0.00 C ATOM 1629 O LEU A 101 4.341 1.373 -10.558 1.00 0.00 O ATOM 1630 CB LEU A 101 4.971 1.353 -7.359 1.00 0.00 C ATOM 1631 CG LEU A 101 5.340 0.739 -6.006 1.00 0.00 C ATOM 1632 CD1 LEU A 101 6.787 0.243 -6.006 1.00 0.00 C ATOM 1633 CD2 LEU A 101 5.070 1.722 -4.866 1.00 0.00 C ATOM 0 H LEU A 101 6.519 2.209 -9.503 1.00 0.00 H new ATOM 0 HA LEU A 101 5.741 -0.388 -8.259 1.00 0.00 H new ATOM 0 HB2 LEU A 101 5.340 2.378 -7.383 1.00 0.00 H new ATOM 0 HB3 LEU A 101 3.884 1.404 -7.428 1.00 0.00 H new ATOM 0 HG LEU A 101 4.702 -0.129 -5.839 1.00 0.00 H new ATOM 0 HD11 LEU A 101 7.024 -0.189 -5.033 1.00 0.00 H new ATOM 0 HD12 LEU A 101 6.912 -0.515 -6.779 1.00 0.00 H new ATOM 0 HD13 LEU A 101 7.458 1.079 -6.205 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.341 1.261 -3.916 1.00 0.00 H new ATOM 0 HD22 LEU A 101 5.665 2.623 -5.014 1.00 0.00 H new ATOM 0 HD23 LEU A 101 4.012 1.983 -4.854 1.00 0.00 H new ATOM 1645 N GLU A 102 3.758 -0.633 -9.692 1.00 0.00 N ATOM 1646 CA GLU A 102 2.742 -0.896 -10.697 1.00 0.00 C ATOM 1647 C GLU A 102 1.376 -1.087 -10.033 1.00 0.00 C ATOM 1648 O GLU A 102 1.293 -1.557 -8.900 1.00 0.00 O ATOM 1649 CB GLU A 102 3.113 -2.113 -11.546 1.00 0.00 C ATOM 1650 CG GLU A 102 2.464 -2.034 -12.930 1.00 0.00 C ATOM 1651 CD GLU A 102 1.412 -3.131 -13.105 1.00 0.00 C ATOM 1652 OE1 GLU A 102 0.447 -3.125 -12.310 1.00 0.00 O ATOM 1653 OE2 GLU A 102 1.596 -3.952 -14.030 1.00 0.00 O ATOM 0 H GLU A 102 3.866 -1.367 -8.992 1.00 0.00 H new ATOM 0 HA GLU A 102 2.684 -0.034 -11.362 1.00 0.00 H new ATOM 0 HB2 GLU A 102 4.196 -2.171 -11.651 1.00 0.00 H new ATOM 0 HB3 GLU A 102 2.792 -3.024 -11.041 1.00 0.00 H new ATOM 0 HG2 GLU A 102 2.001 -1.056 -13.063 1.00 0.00 H new ATOM 0 HG3 GLU A 102 3.229 -2.132 -13.700 1.00 0.00 H new ATOM 1660 N ILE A 103 0.339 -0.712 -10.769 1.00 0.00 N ATOM 1661 CA ILE A 103 -1.018 -0.836 -10.266 1.00 0.00 C ATOM 1662 C ILE A 103 -1.770 -1.880 -11.093 1.00 0.00 C ATOM 1663 O ILE A 103 -2.055 -1.659 -12.269 1.00 0.00 O ATOM 1664 CB ILE A 103 -1.704 0.532 -10.232 1.00 0.00 C ATOM 1665 CG1 ILE A 103 -1.013 1.467 -9.237 1.00 0.00 C ATOM 1666 CG2 ILE A 103 -3.199 0.388 -9.940 1.00 0.00 C ATOM 1667 CD1 ILE A 103 -1.332 2.930 -9.547 1.00 0.00 C ATOM 0 H ILE A 103 0.412 -0.323 -11.709 1.00 0.00 H new ATOM 0 HA ILE A 103 -1.011 -1.189 -9.235 1.00 0.00 H new ATOM 0 HB ILE A 103 -1.611 0.986 -11.219 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -1.335 1.228 -8.224 1.00 0.00 H new ATOM 0 HG13 ILE A 103 0.065 1.310 -9.274 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -3.663 1.374 -9.921 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -3.665 -0.217 -10.718 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -3.336 -0.096 -8.973 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -0.829 3.573 -8.825 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -0.987 3.173 -10.552 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -2.409 3.089 -9.485 1.00 0.00 H new ATOM 1679 N PRO A 104 -2.080 -3.026 -10.428 1.00 0.00 N ATOM 1680 CA PRO A 104 -2.793 -4.105 -11.089 1.00 0.00 C ATOM 1681 C PRO A 104 -4.275 -3.761 -11.256 1.00 0.00 C ATOM 1682 O PRO A 104 -4.678 -2.618 -11.047 1.00 0.00 O ATOM 1683 CB PRO A 104 -2.562 -5.325 -10.212 1.00 0.00 C ATOM 1684 CG PRO A 104 -2.122 -4.788 -8.860 1.00 0.00 C ATOM 1685 CD PRO A 104 -1.759 -3.323 -9.035 1.00 0.00 C ATOM 0 HA PRO A 104 -2.436 -4.286 -12.103 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -3.472 -5.918 -10.120 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -1.800 -5.976 -10.641 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -2.921 -4.898 -8.127 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -1.267 -5.351 -8.486 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -2.328 -2.690 -8.354 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -0.704 -3.149 -8.826 1.00 0.00 H new TER 1693 PRO A 104 END