USER MOD reduce.3.24.130724 H: found=0, std=0, add=821, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 819 hydrogens (0 hets) HEADER PROTEIN BINDING 07-JAN-03 1J2M TITLE SOLUTION STRUCTURE OF CPI-17(22-120) COMPND MOL_ID: 1; COMPND 2 MOLECULE: 17-KDA PKC-POTENTIATED INHIBITORY PROTEIN OF PP1; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: CPI-17; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: SUS SCROFA; SOURCE 3 ORGANISM_COMMON: PIG; SOURCE 4 ORGANISM_TAXID: 9823; SOURCE 5 STRAIN: DH5A; SOURCE 6 TISSUE: AORTA; SOURCE 7 EXPRESSION_SYSTEM: ESCHERICHIA COLI BL21; SOURCE 8 EXPRESSION_SYSTEM_TAXID: 511693; SOURCE 9 EXPRESSION_SYSTEM_STRAIN: BL21; SOURCE 0 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 1 EXPRESSION_SYSTEM_PLASMID: PET3 KEYWDS HELIX BUNDLE, PROTEIN BINDING EXPDTA SOLUTION NMR MDLTYP MINIMIZED AVERAGE AUTHOR S.OHKI,M.ETO,R.TAKADA,M.SHIMIZU,D.L.BRAUTIGAN,M.KAINOSHO REVDAT 2 24-FEB-09 1J2M 1 VERSN REVDAT 1 17-JUN-03 1J2M 0 JRNL AUTH S.OHKI,M.ETO,M.SHIMIZU,R.TAKADA,D.L.BRAUTIGAN, JRNL AUTH 2 M.KAINOSHO JRNL TITL DISTINCTIVE SOLUTION CONFORMATION OF PHOSPHATASE JRNL TITL 2 INHIBITOR CPI-17 SUBSTITUTED WITH ASPARTATE AT THE JRNL TITL 3 PHOSPHORYLATION-SITE THREONINE RESIDUE JRNL REF J.MOL.BIOL. V. 326 1539 2003 JRNL REFN ISSN 0022-2836 JRNL PMID 12595264 JRNL DOI 10.1016/S0022-2836(03)00048-2 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. NOT APPLICABLE. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.851 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: ADDITIONAL CONSTRAINTS OF NH- REMARK 3 RESIDUAL DIPOLE WERE USED. REMARK 4 REMARK 4 1J2M COMPLIES WITH FORMAT V. 3.15, 01-DEC-08 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY PDBJ ON 15-JAN-03. REMARK 100 THE RCSB ID CODE IS RCSB005552. REMARK 210 REMARK 210 EXPERIMENTAL DETAILS REMARK 210 EXPERIMENT TYPE : NMR REMARK 210 TEMPERATURE (KELVIN) : 298; 298; 298; 298 REMARK 210 PH : 6.8; 6.8; 6.8; 6.8 REMARK 210 IONIC STRENGTH : 100MM KCL; 100MM KCL; 100MM REMARK 210 KCL; 100MM KCL REMARK 210 PRESSURE : 1ATM; 1ATM; 1ATM; 1ATM REMARK 210 SAMPLE CONTENTS : U-15N,13C; U-15N,13C; U-15N; REMARK 210 UNLABELED REMARK 210 REMARK 210 NMR EXPERIMENTS CONDUCTED : 3D_13C-SEPARATED_NOESY, 3D_ REMARK 210 15N-SEPARATED_NOESY, 2D NOESY REMARK 210 SPECTROMETER FIELD STRENGTH : 800 MHZ, 600 MHZ, 500 MHZ REMARK 210 SPECTROMETER MODEL : AVANCE, DRX REMARK 210 SPECTROMETER MANUFACTURER : BRUKER REMARK 210 REMARK 210 STRUCTURE DETERMINATION. REMARK 210 SOFTWARE USED : NMRPIPE 2.2, X-PLOR 3.851 REMARK 210 METHOD USED : DISTANCE GEOMETRY SIMULATED REMARK 210 ANNEALING REMARK 210 REMARK 210 CONFORMERS, NUMBER CALCULATED : 30 REMARK 210 CONFORMERS, NUMBER SUBMITTED : 1 REMARK 210 CONFORMERS, SELECTION CRITERIA : ENERGY-MINIMIZED AVERAGE REMARK 210 STRUCTURE 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: 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 ARG A 12 58.71 -115.80 REMARK 500 HIS A 13 -168.89 -116.36 REMARK 500 ALA A 14 -79.98 -56.48 REMARK 500 ARG A 15 -113.37 -137.51 REMARK 500 LYS A 19 79.33 53.29 REMARK 500 TYR A 20 90.80 -58.51 REMARK 500 ARG A 22 -49.59 -139.54 REMARK 500 LEU A 25 -70.77 -95.20 REMARK 500 GLN A 26 17.30 -143.12 REMARK 500 LEU A 42 -76.42 -88.74 REMARK 500 PRO A 51 -82.47 -74.73 REMARK 500 ASP A 52 -41.55 -170.55 REMARK 500 GLU A 53 -121.13 -148.30 REMARK 500 CYS A 79 -72.50 -118.72 REMARK 500 LEU A 94 36.82 -96.15 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: PLANAR GROUPS REMARK 500 REMARK 500 PLANAR GROUPS IN THE FOLLOWING RESIDUES HAVE A TOTAL REMARK 500 RMS DISTANCE OF ALL ATOMS FROM THE BEST-FIT PLANE REMARK 500 BY MORE THAN AN EXPECTED VALUE OF 6*RMSD, WITH AN REMARK 500 RMSD 0.02 ANGSTROMS, OR AT LEAST ONE ATOM HAS REMARK 500 AN RMSD GREATER THAN THIS VALUE REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 M RES CSSEQI RMS TYPE REMARK 500 ARG A 12 0.25 SIDE_CHAIN REMARK 500 ARG A 15 0.30 SIDE_CHAIN REMARK 500 ARG A 22 0.23 SIDE_CHAIN REMARK 500 ARG A 23 0.32 SIDE_CHAIN REMARK 500 ARG A 27 0.30 SIDE_CHAIN REMARK 500 ARG A 28 0.26 SIDE_CHAIN REMARK 500 ARG A 38 0.32 SIDE_CHAIN REMARK 500 ARG A 44 0.32 SIDE_CHAIN REMARK 500 ARG A 46 0.31 SIDE_CHAIN REMARK 500 ARG A 68 0.25 SIDE_CHAIN REMARK 500 ARG A 70 0.31 SIDE_CHAIN REMARK 500 ARG A 95 0.29 SIDE_CHAIN REMARK 500 REMARK 500 REMARK: NULL REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 1J2N RELATED DB: PDB REMARK 900 1J2N CONTAINS THE SAME PROTEIN WITH T38D MUTATION DBREF 1J2M A 1 99 UNP O18734 PP14A_PIG 22 120 SEQRES 1 A 99 GLY PRO GLY GLY SER PRO GLY GLY LEU GLN LYS ARG HIS SEQRES 2 A 99 ALA ARG VAL THR VAL LYS TYR ASP ARG ARG GLU LEU GLN SEQRES 3 A 99 ARG ARG LEU ASP VAL GLU LYS TRP ILE ASP GLY ARG LEU SEQRES 4 A 99 GLU GLU LEU TYR ARG GLY ARG GLU ALA ASP MET PRO ASP SEQRES 5 A 99 GLU VAL ASN ILE ASP GLU LEU LEU GLU LEU GLU SER GLU SEQRES 6 A 99 GLU GLU ARG SER ARG LYS ILE GLN GLY LEU LEU LYS SER SEQRES 7 A 99 CYS THR ASN PRO THR GLU ASN PHE VAL GLN GLU LEU LEU SEQRES 8 A 99 VAL LYS LEU ARG GLY LEU HIS LYS HELIX 1 1 GLN A 26 LEU A 42 1 17 HELIX 2 2 ILE A 56 GLU A 61 1 6 HELIX 3 3 GLU A 66 SER A 78 1 13 HELIX 4 4 THR A 83 LEU A 94 1 12 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 Single : A 1 GLY N :NH3+ 145:sc= 0.0511 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 10 GLN :FLIP amide:sc= -0.495 F(o=-2.1,f=-0.5) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 HIS : no HD1:sc= -2.14 K(o=-2.1,f=-4.9!) USER MOD Single : A 17 THR OG1 : rot 180:sc= -0.221 USER MOD Single : A 19 LYS NZ :NH3+ -117:sc= 0 (180deg=-0.0365) USER MOD Single : A 20 TYR OH : rot 15:sc= -3.38! USER MOD Single : A 26 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot 146:sc= 1.15 USER MOD Single : A 50 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 ASN : amide:sc= -5.98! C(o=-6!,f=-8.2!) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= -2.06! USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 79 CYS SG : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot -120:sc= -2.29! USER MOD Single : A 81 ASN : amide:sc= -1.26 K(o=-1.3,f=-5.7!) USER MOD Single : A 83 THR OG1 : rot 42:sc= 0.458 USER MOD Single : A 85 ASN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 88 GLN : amide:sc= -1.2 K(o=-1.2,f=-4.4!) USER MOD Single : A 93 LYS NZ :NH3+ 140:sc= -1.55 (180deg=-3.87!) USER MOD Single : A 98 HIS : no HE2:sc= -7.85 K(o=-7.9,f=-19!) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 243.997 11.775 -80.044 1.00 13.74 N ATOM 2 CA GLY A 1 243.106 11.467 -81.199 1.00 13.50 C ATOM 3 C GLY A 1 242.821 9.959 -81.240 1.00 12.95 C ATOM 4 O GLY A 1 243.650 9.169 -80.835 1.00 12.65 O ATOM 0 H1 GLY A 1 244.643 12.549 -80.301 1.00 13.74 H new ATOM 0 H2 GLY A 1 243.420 12.062 -79.228 1.00 13.74 H new ATOM 0 H3 GLY A 1 244.550 10.930 -79.797 1.00 13.74 H new ATOM 0 HA2 GLY A 1 242.172 12.022 -81.109 1.00 13.50 H new ATOM 0 HA3 GLY A 1 243.577 11.784 -82.130 1.00 13.50 H new ATOM 10 N PRO A 2 241.653 9.597 -81.729 1.00 13.01 N ATOM 11 CA PRO A 2 241.287 8.160 -81.809 1.00 12.71 C ATOM 12 C PRO A 2 242.076 7.468 -82.924 1.00 12.16 C ATOM 13 O PRO A 2 242.508 6.340 -82.780 1.00 12.40 O ATOM 14 CB PRO A 2 239.796 8.184 -82.134 1.00 13.22 C ATOM 15 CG PRO A 2 239.564 9.501 -82.802 1.00 13.57 C ATOM 16 CD PRO A 2 240.579 10.464 -82.245 1.00 13.56 C ATOM 0 HA PRO A 2 241.509 7.612 -80.894 1.00 12.71 H new ATOM 0 HB2 PRO A 2 239.522 7.356 -82.788 1.00 13.22 H new ATOM 0 HB3 PRO A 2 239.194 8.089 -81.230 1.00 13.22 H new ATOM 0 HG2 PRO A 2 239.672 9.409 -83.883 1.00 13.57 H new ATOM 0 HG3 PRO A 2 238.551 9.856 -82.612 1.00 13.57 H new ATOM 0 HD2 PRO A 2 240.949 11.142 -83.014 1.00 13.56 H new ATOM 0 HD3 PRO A 2 240.151 11.081 -81.455 1.00 13.56 H new ATOM 24 N GLY A 3 242.263 8.137 -84.034 1.00 11.60 N ATOM 25 CA GLY A 3 243.022 7.525 -85.165 1.00 11.26 C ATOM 26 C GLY A 3 243.889 8.591 -85.837 1.00 10.57 C ATOM 27 O GLY A 3 243.896 8.724 -87.046 1.00 10.68 O ATOM 0 H GLY A 3 241.922 9.083 -84.205 1.00 11.60 H new ATOM 0 HA2 GLY A 3 243.647 6.711 -84.798 1.00 11.26 H new ATOM 0 HA3 GLY A 3 242.331 7.094 -85.889 1.00 11.26 H new ATOM 31 N GLY A 4 244.621 9.349 -85.060 1.00 10.06 N ATOM 32 CA GLY A 4 245.494 10.409 -85.645 1.00 9.61 C ATOM 33 C GLY A 4 246.962 10.003 -85.502 1.00 8.67 C ATOM 34 O GLY A 4 247.797 10.371 -86.307 1.00 8.65 O ATOM 0 H GLY A 4 244.651 9.278 -84.043 1.00 10.06 H new ATOM 0 HA2 GLY A 4 245.248 10.557 -86.697 1.00 9.61 H new ATOM 0 HA3 GLY A 4 245.318 11.359 -85.140 1.00 9.61 H new ATOM 38 N SER A 5 247.281 9.246 -84.482 1.00 8.14 N ATOM 39 CA SER A 5 248.696 8.810 -84.278 1.00 7.45 C ATOM 40 C SER A 5 249.098 7.766 -85.335 1.00 6.87 C ATOM 41 O SER A 5 250.071 7.956 -86.037 1.00 6.70 O ATOM 42 CB SER A 5 248.731 8.195 -82.878 1.00 7.46 C ATOM 43 OG SER A 5 249.210 9.162 -81.953 1.00 7.78 O ATOM 0 H SER A 5 246.621 8.911 -83.781 1.00 8.14 H new ATOM 0 HA SER A 5 249.394 9.641 -84.375 1.00 7.45 H new ATOM 0 HB2 SER A 5 247.734 7.861 -82.590 1.00 7.46 H new ATOM 0 HB3 SER A 5 249.376 7.316 -82.870 1.00 7.46 H new ATOM 0 HG SER A 5 249.232 8.772 -81.054 1.00 7.78 H new ATOM 49 N PRO A 6 248.345 6.686 -85.419 1.00 6.92 N ATOM 50 CA PRO A 6 248.668 5.627 -86.408 1.00 6.79 C ATOM 51 C PRO A 6 248.312 6.079 -87.827 1.00 6.07 C ATOM 52 O PRO A 6 247.545 7.003 -88.021 1.00 6.19 O ATOM 53 CB PRO A 6 247.794 4.452 -85.980 1.00 7.48 C ATOM 54 CG PRO A 6 246.650 5.064 -85.239 1.00 7.67 C ATOM 55 CD PRO A 6 247.148 6.347 -84.627 1.00 7.49 C ATOM 0 HA PRO A 6 249.729 5.380 -86.429 1.00 6.79 H new ATOM 0 HB2 PRO A 6 247.446 3.885 -86.843 1.00 7.48 H new ATOM 0 HB3 PRO A 6 248.348 3.759 -85.346 1.00 7.48 H new ATOM 0 HG2 PRO A 6 245.816 5.258 -85.913 1.00 7.67 H new ATOM 0 HG3 PRO A 6 246.285 4.386 -84.467 1.00 7.67 H new ATOM 0 HD2 PRO A 6 246.396 7.134 -84.685 1.00 7.49 H new ATOM 0 HD3 PRO A 6 247.392 6.217 -83.573 1.00 7.49 H new ATOM 63 N GLY A 7 248.867 5.427 -88.818 1.00 5.63 N ATOM 64 CA GLY A 7 248.571 5.802 -90.232 1.00 5.24 C ATOM 65 C GLY A 7 248.281 4.537 -91.042 1.00 4.88 C ATOM 66 O GLY A 7 247.348 3.809 -90.756 1.00 4.97 O ATOM 0 H GLY A 7 249.515 4.648 -88.706 1.00 5.63 H new ATOM 0 HA2 GLY A 7 247.715 6.476 -90.270 1.00 5.24 H new ATOM 0 HA3 GLY A 7 249.417 6.337 -90.663 1.00 5.24 H new ATOM 70 N GLY A 8 249.074 4.271 -92.049 1.00 4.94 N ATOM 71 CA GLY A 8 248.853 3.052 -92.883 1.00 5.17 C ATOM 72 C GLY A 8 249.017 1.803 -92.016 1.00 4.98 C ATOM 73 O GLY A 8 248.050 1.227 -91.554 1.00 5.50 O ATOM 0 H GLY A 8 249.867 4.848 -92.330 1.00 4.94 H new ATOM 0 HA2 GLY A 8 247.855 3.075 -93.322 1.00 5.17 H new ATOM 0 HA3 GLY A 8 249.564 3.030 -93.709 1.00 5.17 H new ATOM 77 N LEU A 9 250.237 1.385 -91.787 1.00 4.61 N ATOM 78 CA LEU A 9 250.473 0.174 -90.943 1.00 4.83 C ATOM 79 C LEU A 9 250.323 0.534 -89.463 1.00 4.36 C ATOM 80 O LEU A 9 250.753 1.586 -89.026 1.00 4.74 O ATOM 81 CB LEU A 9 251.910 -0.256 -91.251 1.00 5.55 C ATOM 82 CG LEU A 9 251.899 -1.393 -92.277 1.00 6.51 C ATOM 83 CD1 LEU A 9 252.032 -0.813 -93.686 1.00 7.18 C ATOM 84 CD2 LEU A 9 253.072 -2.338 -92.004 1.00 6.96 C ATOM 0 H LEU A 9 251.080 1.831 -92.149 1.00 4.61 H new ATOM 0 HA LEU A 9 249.761 -0.624 -91.153 1.00 4.83 H new ATOM 0 HB2 LEU A 9 252.478 0.590 -91.637 1.00 5.55 H new ATOM 0 HB3 LEU A 9 252.406 -0.583 -90.337 1.00 5.55 H new ATOM 0 HG LEU A 9 250.961 -1.943 -92.197 1.00 6.51 H new ATOM 0 HD11 LEU A 9 252.024 -1.623 -94.415 1.00 7.18 H new ATOM 0 HD12 LEU A 9 251.198 -0.140 -93.883 1.00 7.18 H new ATOM 0 HD13 LEU A 9 252.969 -0.262 -93.766 1.00 7.18 H new ATOM 0 HD21 LEU A 9 253.065 -3.147 -92.734 1.00 6.96 H new ATOM 0 HD22 LEU A 9 254.009 -1.787 -92.083 1.00 6.96 H new ATOM 0 HD23 LEU A 9 252.979 -2.753 -91.001 1.00 6.96 H new ATOM 96 N GLN A 10 249.712 -0.328 -88.690 1.00 4.03 N ATOM 97 CA GLN A 10 249.526 -0.040 -87.235 1.00 4.11 C ATOM 98 C GLN A 10 250.774 -0.448 -86.446 1.00 3.95 C ATOM 99 O GLN A 10 250.701 -1.214 -85.504 1.00 4.44 O ATOM 100 CB GLN A 10 248.322 -0.888 -86.817 1.00 4.75 C ATOM 101 CG GLN A 10 247.792 -0.399 -85.465 1.00 5.45 C ATOM 102 CD GLN A 10 246.588 0.520 -85.687 1.00 6.40 C ATOM 103 OE1 GLN A 10 246.768 1.690 -86.235 1.00 6.80 O flip ATOM 104 NE2 GLN A 10 245.472 0.169 -85.357 1.00 7.07 N flip ATOM 0 H GLN A 10 249.333 -1.221 -89.005 1.00 4.03 H new ATOM 0 HA GLN A 10 249.366 1.021 -87.041 1.00 4.11 H new ATOM 0 HB2 GLN A 10 247.538 -0.821 -87.572 1.00 4.75 H new ATOM 0 HB3 GLN A 10 248.610 -1.937 -86.748 1.00 4.75 H new ATOM 0 HG2 GLN A 10 247.504 -1.249 -84.847 1.00 5.45 H new ATOM 0 HG3 GLN A 10 248.576 0.135 -84.927 1.00 5.45 H new ATOM 0 HE21 GLN A 10 245.331 -0.746 -84.928 1.00 7.07 H new ATOM 0 HE22 GLN A 10 244.677 0.789 -85.509 1.00 7.07 H new ATOM 113 N LYS A 11 251.924 0.061 -86.824 1.00 3.76 N ATOM 114 CA LYS A 11 253.194 -0.286 -86.103 1.00 4.09 C ATOM 115 C LYS A 11 253.347 -1.807 -85.967 1.00 3.59 C ATOM 116 O LYS A 11 253.999 -2.295 -85.063 1.00 3.96 O ATOM 117 CB LYS A 11 253.066 0.367 -84.723 1.00 4.85 C ATOM 118 CG LYS A 11 253.871 1.669 -84.693 1.00 5.78 C ATOM 119 CD LYS A 11 253.240 2.640 -83.693 1.00 6.67 C ATOM 120 CE LYS A 11 253.848 4.034 -83.877 1.00 7.39 C ATOM 121 NZ LYS A 11 254.078 4.541 -82.495 1.00 8.11 N ATOM 0 H LYS A 11 252.039 0.706 -87.606 1.00 3.76 H new ATOM 0 HA LYS A 11 254.073 0.067 -86.642 1.00 4.09 H new ATOM 0 HB2 LYS A 11 252.018 0.570 -84.502 1.00 4.85 H new ATOM 0 HB3 LYS A 11 253.428 -0.314 -83.953 1.00 4.85 H new ATOM 0 HG2 LYS A 11 254.904 1.463 -84.413 1.00 5.78 H new ATOM 0 HG3 LYS A 11 253.893 2.118 -85.686 1.00 5.78 H new ATOM 0 HD2 LYS A 11 252.161 2.680 -83.841 1.00 6.67 H new ATOM 0 HD3 LYS A 11 253.409 2.290 -82.675 1.00 6.67 H new ATOM 0 HE2 LYS A 11 254.780 3.987 -84.440 1.00 7.39 H new ATOM 0 HE3 LYS A 11 253.174 4.688 -84.430 1.00 7.39 H new ATOM 0 HZ1 LYS A 11 254.494 5.493 -82.539 1.00 8.11 H new ATOM 0 HZ2 LYS A 11 253.173 4.582 -81.985 1.00 8.11 H new ATOM 0 HZ3 LYS A 11 254.728 3.902 -81.995 1.00 8.11 H new ATOM 135 N ARG A 12 252.748 -2.554 -86.860 1.00 3.19 N ATOM 136 CA ARG A 12 252.852 -4.043 -86.792 1.00 3.02 C ATOM 137 C ARG A 12 253.590 -4.577 -88.023 1.00 2.27 C ATOM 138 O ARG A 12 253.065 -5.377 -88.775 1.00 2.45 O ATOM 139 CB ARG A 12 251.404 -4.549 -86.759 1.00 3.75 C ATOM 140 CG ARG A 12 250.642 -4.055 -87.995 1.00 4.51 C ATOM 141 CD ARG A 12 249.533 -5.051 -88.341 1.00 5.21 C ATOM 142 NE ARG A 12 248.365 -4.626 -87.521 1.00 5.82 N ATOM 143 CZ ARG A 12 248.008 -5.329 -86.481 1.00 6.53 C ATOM 144 NH1 ARG A 12 247.807 -6.613 -86.600 1.00 7.06 N ATOM 145 NH2 ARG A 12 247.851 -4.748 -85.323 1.00 6.97 N ATOM 0 H ARG A 12 252.190 -2.196 -87.635 1.00 3.19 H new ATOM 0 HA ARG A 12 253.412 -4.378 -85.919 1.00 3.02 H new ATOM 0 HB2 ARG A 12 251.392 -5.638 -86.727 1.00 3.75 H new ATOM 0 HB3 ARG A 12 250.909 -4.198 -85.853 1.00 3.75 H new ATOM 0 HG2 ARG A 12 250.215 -3.071 -87.803 1.00 4.51 H new ATOM 0 HG3 ARG A 12 251.325 -3.947 -88.838 1.00 4.51 H new ATOM 0 HD2 ARG A 12 249.298 -5.026 -89.405 1.00 5.21 H new ATOM 0 HD3 ARG A 12 249.831 -6.072 -88.104 1.00 5.21 H new ATOM 0 HE ARG A 12 247.844 -3.786 -87.772 1.00 5.82 H new ATOM 0 HH11 ARG A 12 247.929 -7.067 -87.505 1.00 7.06 H new ATOM 0 HH12 ARG A 12 247.528 -7.163 -85.788 1.00 7.06 H new ATOM 0 HH21 ARG A 12 248.007 -3.744 -85.231 1.00 6.97 H new ATOM 0 HH22 ARG A 12 247.572 -5.298 -84.510 1.00 6.97 H new ATOM 159 N HIS A 13 254.806 -4.139 -88.229 1.00 1.98 N ATOM 160 CA HIS A 13 255.590 -4.616 -89.410 1.00 1.90 C ATOM 161 C HIS A 13 256.830 -5.391 -88.951 1.00 1.65 C ATOM 162 O HIS A 13 256.959 -5.743 -87.794 1.00 1.62 O ATOM 163 CB HIS A 13 255.981 -3.358 -90.207 1.00 2.55 C ATOM 164 CG HIS A 13 256.598 -2.317 -89.306 1.00 2.81 C ATOM 165 ND1 HIS A 13 255.827 -1.448 -88.548 1.00 3.59 N ATOM 166 CD2 HIS A 13 257.903 -1.985 -89.044 1.00 2.62 C ATOM 167 CE1 HIS A 13 256.667 -0.643 -87.874 1.00 3.78 C ATOM 168 NE2 HIS A 13 257.944 -0.927 -88.139 1.00 3.23 N ATOM 0 H HIS A 13 255.291 -3.471 -87.630 1.00 1.98 H new ATOM 0 HA HIS A 13 255.007 -5.298 -90.029 1.00 1.90 H new ATOM 0 HB2 HIS A 13 256.686 -3.626 -90.994 1.00 2.55 H new ATOM 0 HB3 HIS A 13 255.099 -2.944 -90.696 1.00 2.55 H new ATOM 0 HD2 HIS A 13 258.767 -2.470 -89.474 1.00 2.62 H new ATOM 0 HE1 HIS A 13 256.347 0.138 -87.200 1.00 3.78 H new ATOM 0 HE2 HIS A 13 258.772 -0.468 -87.760 1.00 3.23 H new ATOM 176 N ALA A 14 257.729 -5.678 -89.858 1.00 1.51 N ATOM 177 CA ALA A 14 258.955 -6.458 -89.494 1.00 1.30 C ATOM 178 C ALA A 14 259.743 -5.782 -88.364 1.00 1.23 C ATOM 179 O ALA A 14 259.661 -6.187 -87.222 1.00 1.18 O ATOM 180 CB ALA A 14 259.792 -6.514 -90.774 1.00 1.21 C ATOM 0 H ALA A 14 257.668 -5.405 -90.839 1.00 1.51 H new ATOM 0 HA ALA A 14 258.695 -7.451 -89.126 1.00 1.30 H new ATOM 0 HB1 ALA A 14 260.709 -7.072 -90.585 1.00 1.21 H new ATOM 0 HB2 ALA A 14 259.222 -7.009 -91.560 1.00 1.21 H new ATOM 0 HB3 ALA A 14 260.042 -5.501 -91.090 1.00 1.21 H new ATOM 186 N ARG A 15 260.523 -4.778 -88.676 1.00 1.29 N ATOM 187 CA ARG A 15 261.341 -4.100 -87.621 1.00 1.25 C ATOM 188 C ARG A 15 261.296 -2.567 -87.808 1.00 1.27 C ATOM 189 O ARG A 15 260.253 -1.965 -87.644 1.00 1.41 O ATOM 190 CB ARG A 15 262.768 -4.682 -87.771 1.00 1.09 C ATOM 191 CG ARG A 15 263.182 -4.747 -89.257 1.00 1.04 C ATOM 192 CD ARG A 15 264.647 -4.325 -89.435 1.00 0.89 C ATOM 193 NE ARG A 15 265.430 -5.169 -88.489 1.00 1.38 N ATOM 194 CZ ARG A 15 266.656 -4.843 -88.185 1.00 1.27 C ATOM 195 NH1 ARG A 15 266.885 -3.825 -87.401 1.00 1.69 N ATOM 196 NH2 ARG A 15 267.652 -5.534 -88.665 1.00 1.71 N ATOM 0 H ARG A 15 260.630 -4.397 -89.616 1.00 1.29 H new ATOM 0 HA ARG A 15 260.963 -4.278 -86.614 1.00 1.25 H new ATOM 0 HB2 ARG A 15 263.477 -4.065 -87.218 1.00 1.09 H new ATOM 0 HB3 ARG A 15 262.806 -5.680 -87.335 1.00 1.09 H new ATOM 0 HG2 ARG A 15 263.043 -5.760 -89.634 1.00 1.04 H new ATOM 0 HG3 ARG A 15 262.537 -4.096 -89.847 1.00 1.04 H new ATOM 0 HD2 ARG A 15 264.977 -4.480 -90.462 1.00 0.89 H new ATOM 0 HD3 ARG A 15 264.778 -3.266 -89.215 1.00 0.89 H new ATOM 0 HE ARG A 15 265.007 -6.002 -88.079 1.00 1.38 H new ATOM 0 HH11 ARG A 15 266.105 -3.285 -87.026 1.00 1.69 H new ATOM 0 HH12 ARG A 15 267.844 -3.570 -87.163 1.00 1.69 H new ATOM 0 HH21 ARG A 15 267.472 -6.329 -89.278 1.00 1.71 H new ATOM 0 HH22 ARG A 15 268.611 -5.279 -88.428 1.00 1.71 H new ATOM 210 N VAL A 16 262.395 -1.922 -88.148 1.00 1.19 N ATOM 211 CA VAL A 16 262.366 -0.438 -88.335 1.00 1.26 C ATOM 212 C VAL A 16 262.205 -0.105 -89.822 1.00 1.28 C ATOM 213 O VAL A 16 262.672 0.915 -90.294 1.00 1.47 O ATOM 214 CB VAL A 16 263.718 0.065 -87.807 1.00 1.17 C ATOM 215 CG1 VAL A 16 263.846 -0.284 -86.323 1.00 1.60 C ATOM 216 CG2 VAL A 16 264.871 -0.591 -88.578 1.00 1.70 C ATOM 0 H VAL A 16 263.303 -2.361 -88.302 1.00 1.19 H new ATOM 0 HA VAL A 16 261.534 0.030 -87.809 1.00 1.26 H new ATOM 0 HB VAL A 16 263.767 1.145 -87.943 1.00 1.17 H new ATOM 0 HG11 VAL A 16 264.805 0.072 -85.947 1.00 1.60 H new ATOM 0 HG12 VAL A 16 263.038 0.192 -85.766 1.00 1.60 H new ATOM 0 HG13 VAL A 16 263.786 -1.365 -86.197 1.00 1.60 H new ATOM 0 HG21 VAL A 16 265.822 -0.224 -88.192 1.00 1.70 H new ATOM 0 HG22 VAL A 16 264.822 -1.673 -88.454 1.00 1.70 H new ATOM 0 HG23 VAL A 16 264.789 -0.343 -89.636 1.00 1.70 H new ATOM 226 N THR A 17 261.555 -0.969 -90.561 1.00 1.29 N ATOM 227 CA THR A 17 261.367 -0.724 -92.022 1.00 1.35 C ATOM 228 C THR A 17 260.342 0.385 -92.259 1.00 1.52 C ATOM 229 O THR A 17 260.658 1.423 -92.809 1.00 1.72 O ATOM 230 CB THR A 17 260.854 -2.051 -92.588 1.00 1.35 C ATOM 231 OG1 THR A 17 261.608 -3.123 -92.037 1.00 1.86 O ATOM 232 CG2 THR A 17 260.998 -2.048 -94.110 1.00 1.62 C ATOM 0 H THR A 17 261.146 -1.836 -90.213 1.00 1.29 H new ATOM 0 HA THR A 17 262.293 -0.403 -92.499 1.00 1.35 H new ATOM 0 HB THR A 17 259.803 -2.177 -92.327 1.00 1.35 H new ATOM 0 HG1 THR A 17 261.280 -3.973 -92.397 1.00 1.86 H new ATOM 0 HG21 THR A 17 260.633 -2.993 -94.512 1.00 1.62 H new ATOM 0 HG22 THR A 17 260.417 -1.227 -94.529 1.00 1.62 H new ATOM 0 HG23 THR A 17 262.048 -1.922 -94.376 1.00 1.62 H new ATOM 240 N VAL A 18 259.107 0.169 -91.865 1.00 1.66 N ATOM 241 CA VAL A 18 258.042 1.205 -92.082 1.00 1.93 C ATOM 242 C VAL A 18 258.009 1.619 -93.562 1.00 1.97 C ATOM 243 O VAL A 18 257.619 2.718 -93.905 1.00 2.15 O ATOM 244 CB VAL A 18 258.432 2.393 -91.190 1.00 2.13 C ATOM 245 CG1 VAL A 18 257.369 3.488 -91.300 1.00 2.56 C ATOM 246 CG2 VAL A 18 258.529 1.932 -89.733 1.00 2.11 C ATOM 0 H VAL A 18 258.790 -0.682 -91.401 1.00 1.66 H new ATOM 0 HA VAL A 18 257.049 0.833 -91.831 1.00 1.93 H new ATOM 0 HB VAL A 18 259.396 2.784 -91.515 1.00 2.13 H new ATOM 0 HG11 VAL A 18 257.647 4.330 -90.666 1.00 2.56 H new ATOM 0 HG12 VAL A 18 257.296 3.821 -92.335 1.00 2.56 H new ATOM 0 HG13 VAL A 18 256.406 3.094 -90.977 1.00 2.56 H new ATOM 0 HG21 VAL A 18 258.806 2.776 -89.102 1.00 2.11 H new ATOM 0 HG22 VAL A 18 257.565 1.539 -89.411 1.00 2.11 H new ATOM 0 HG23 VAL A 18 259.286 1.152 -89.648 1.00 2.11 H new ATOM 256 N LYS A 19 258.429 0.735 -94.441 1.00 1.86 N ATOM 257 CA LYS A 19 258.443 1.050 -95.906 1.00 1.96 C ATOM 258 C LYS A 19 259.204 2.355 -96.168 1.00 1.98 C ATOM 259 O LYS A 19 258.612 3.400 -96.359 1.00 2.20 O ATOM 260 CB LYS A 19 256.973 1.190 -96.313 1.00 2.19 C ATOM 261 CG LYS A 19 256.478 -0.129 -96.910 1.00 2.25 C ATOM 262 CD LYS A 19 256.269 -1.150 -95.790 1.00 2.28 C ATOM 263 CE LYS A 19 256.211 -2.559 -96.387 1.00 2.07 C ATOM 264 NZ LYS A 19 254.854 -2.664 -96.992 1.00 2.32 N ATOM 0 H LYS A 19 258.765 -0.198 -94.202 1.00 1.86 H new ATOM 0 HA LYS A 19 258.945 0.272 -96.481 1.00 1.96 H new ATOM 0 HB2 LYS A 19 256.369 1.458 -95.446 1.00 2.19 H new ATOM 0 HB3 LYS A 19 256.861 1.994 -97.040 1.00 2.19 H new ATOM 0 HG2 LYS A 19 255.544 0.031 -97.449 1.00 2.25 H new ATOM 0 HG3 LYS A 19 257.202 -0.508 -97.632 1.00 2.25 H new ATOM 0 HD2 LYS A 19 257.082 -1.083 -95.067 1.00 2.28 H new ATOM 0 HD3 LYS A 19 255.346 -0.933 -95.253 1.00 2.28 H new ATOM 0 HE2 LYS A 19 256.990 -2.703 -97.136 1.00 2.07 H new ATOM 0 HE3 LYS A 19 256.362 -3.319 -95.621 1.00 2.07 H new ATOM 0 HZ1 LYS A 19 254.315 -3.411 -96.509 1.00 2.32 H new ATOM 0 HZ2 LYS A 19 254.357 -1.757 -96.889 1.00 2.32 H new ATOM 0 HZ3 LYS A 19 254.941 -2.898 -98.002 1.00 2.32 H new ATOM 278 N TYR A 20 260.513 2.295 -96.177 1.00 1.88 N ATOM 279 CA TYR A 20 261.327 3.528 -96.426 1.00 1.95 C ATOM 280 C TYR A 20 260.963 4.134 -97.787 1.00 2.22 C ATOM 281 O TYR A 20 261.541 3.791 -98.801 1.00 2.66 O ATOM 282 CB TYR A 20 262.788 3.053 -96.429 1.00 2.05 C ATOM 283 CG TYR A 20 263.489 3.457 -95.146 1.00 1.56 C ATOM 284 CD1 TYR A 20 263.381 4.767 -94.658 1.00 1.78 C ATOM 285 CD2 TYR A 20 264.263 2.517 -94.452 1.00 1.89 C ATOM 286 CE1 TYR A 20 264.045 5.134 -93.480 1.00 1.73 C ATOM 287 CE2 TYR A 20 264.926 2.883 -93.274 1.00 1.67 C ATOM 288 CZ TYR A 20 264.817 4.192 -92.788 1.00 1.21 C ATOM 289 OH TYR A 20 265.470 4.555 -91.629 1.00 1.43 O ATOM 0 H TYR A 20 261.055 1.445 -96.023 1.00 1.88 H new ATOM 0 HA TYR A 20 261.150 4.296 -95.673 1.00 1.95 H new ATOM 0 HB2 TYR A 20 262.822 1.969 -96.542 1.00 2.05 H new ATOM 0 HB3 TYR A 20 263.312 3.479 -97.285 1.00 2.05 H new ATOM 0 HD1 TYR A 20 262.786 5.494 -95.191 1.00 1.78 H new ATOM 0 HD2 TYR A 20 264.348 1.508 -94.827 1.00 1.89 H new ATOM 0 HE1 TYR A 20 263.962 6.144 -93.105 1.00 1.73 H new ATOM 0 HE2 TYR A 20 265.521 2.156 -92.741 1.00 1.67 H new ATOM 0 HH TYR A 20 265.110 5.406 -91.303 1.00 1.43 H new ATOM 299 N ASP A 21 260.008 5.030 -97.814 1.00 2.55 N ATOM 300 CA ASP A 21 259.601 5.660 -99.110 1.00 2.91 C ATOM 301 C ASP A 21 260.790 6.391 -99.739 1.00 2.60 C ATOM 302 O ASP A 21 261.154 7.475 -99.321 1.00 2.80 O ATOM 303 CB ASP A 21 258.494 6.653 -98.746 1.00 3.52 C ATOM 304 CG ASP A 21 257.714 7.033-100.006 1.00 4.34 C ATOM 305 OD1 ASP A 21 256.790 6.312-100.346 1.00 4.76 O ATOM 306 OD2 ASP A 21 258.053 8.037-100.609 1.00 4.89 O ATOM 0 H ASP A 21 259.492 5.353 -96.995 1.00 2.55 H new ATOM 0 HA ASP A 21 259.260 4.921 -99.835 1.00 2.91 H new ATOM 0 HB2 ASP A 21 257.823 6.212 -98.009 1.00 3.52 H new ATOM 0 HB3 ASP A 21 258.926 7.544 -98.290 1.00 3.52 H new ATOM 311 N ARG A 22 261.399 5.802-100.737 1.00 2.49 N ATOM 312 CA ARG A 22 262.570 6.455-101.396 1.00 2.55 C ATOM 313 C ARG A 22 262.504 6.264-102.915 1.00 2.37 C ATOM 314 O ARG A 22 262.641 7.208-103.670 1.00 2.85 O ATOM 315 CB ARG A 22 263.794 5.748-100.814 1.00 2.92 C ATOM 316 CG ARG A 22 264.114 6.341 -99.439 1.00 3.09 C ATOM 317 CD ARG A 22 264.641 7.771 -99.604 1.00 3.76 C ATOM 318 NE ARG A 22 266.114 7.665 -99.406 1.00 4.18 N ATOM 319 CZ ARG A 22 266.902 8.597 -99.868 1.00 4.63 C ATOM 320 NH1 ARG A 22 266.768 9.015-101.097 1.00 5.09 N ATOM 321 NH2 ARG A 22 267.825 9.110 -99.102 1.00 4.97 N ATOM 0 H ARG A 22 261.135 4.896-101.124 1.00 2.49 H new ATOM 0 HA ARG A 22 262.597 7.530-101.218 1.00 2.55 H new ATOM 0 HB2 ARG A 22 263.603 4.678-100.726 1.00 2.92 H new ATOM 0 HB3 ARG A 22 264.648 5.866-101.481 1.00 2.92 H new ATOM 0 HG2 ARG A 22 263.220 6.342 -98.816 1.00 3.09 H new ATOM 0 HG3 ARG A 22 264.856 5.726 -98.931 1.00 3.09 H new ATOM 0 HD2 ARG A 22 264.403 8.168-100.591 1.00 3.76 H new ATOM 0 HD3 ARG A 22 264.192 8.444 -98.873 1.00 3.76 H new ATOM 0 HE ARG A 22 266.506 6.865 -98.910 1.00 4.18 H new ATOM 0 HH11 ARG A 22 266.047 8.613-101.697 1.00 5.09 H new ATOM 0 HH12 ARG A 22 267.384 9.743-101.458 1.00 5.09 H new ATOM 0 HH21 ARG A 22 267.931 8.783 -98.142 1.00 4.97 H new ATOM 0 HH22 ARG A 22 268.441 9.838 -99.463 1.00 4.97 H new ATOM 335 N ARG A 23 262.297 5.052-103.364 1.00 2.27 N ATOM 336 CA ARG A 23 262.223 4.798-104.835 1.00 2.28 C ATOM 337 C ARG A 23 261.406 3.536-105.120 1.00 2.33 C ATOM 338 O ARG A 23 261.383 2.612-104.332 1.00 2.58 O ATOM 339 CB ARG A 23 263.673 4.609-105.279 1.00 2.74 C ATOM 340 CG ARG A 23 263.724 4.439-106.799 1.00 3.55 C ATOM 341 CD ARG A 23 263.434 5.781-107.477 1.00 4.48 C ATOM 342 NE ARG A 23 264.424 5.877-108.586 1.00 5.37 N ATOM 343 CZ ARG A 23 264.195 6.668-109.599 1.00 6.19 C ATOM 344 NH1 ARG A 23 264.584 7.913-109.555 1.00 6.79 N ATOM 345 NH2 ARG A 23 263.577 6.214-110.655 1.00 6.66 N ATOM 0 H ARG A 23 262.176 4.228-102.776 1.00 2.27 H new ATOM 0 HA ARG A 23 261.736 5.615-105.367 1.00 2.28 H new ATOM 0 HB2 ARG A 23 264.271 5.469-104.978 1.00 2.74 H new ATOM 0 HB3 ARG A 23 264.103 3.735-104.790 1.00 2.74 H new ATOM 0 HG2 ARG A 23 264.705 4.072-107.101 1.00 3.55 H new ATOM 0 HG3 ARG A 23 262.994 3.695-107.116 1.00 3.55 H new ATOM 0 HD2 ARG A 23 262.413 5.819-107.856 1.00 4.48 H new ATOM 0 HD3 ARG A 23 263.545 6.609-106.777 1.00 4.48 H new ATOM 0 HE ARG A 23 265.281 5.325-108.554 1.00 5.37 H new ATOM 0 HH11 ARG A 23 265.067 8.268-108.729 1.00 6.79 H new ATOM 0 HH12 ARG A 23 264.405 8.531-110.346 1.00 6.79 H new ATOM 0 HH21 ARG A 23 263.273 5.241-110.689 1.00 6.66 H new ATOM 0 HH22 ARG A 23 263.398 6.832-111.446 1.00 6.66 H new ATOM 359 N GLU A 24 260.740 3.495-106.245 1.00 2.45 N ATOM 360 CA GLU A 24 259.924 2.295-106.596 1.00 2.64 C ATOM 361 C GLU A 24 260.534 1.585-107.807 1.00 2.60 C ATOM 362 O GLU A 24 259.833 1.159-108.706 1.00 2.87 O ATOM 363 CB GLU A 24 258.538 2.843-106.937 1.00 2.86 C ATOM 364 CG GLU A 24 257.660 2.827-105.684 1.00 3.39 C ATOM 365 CD GLU A 24 256.190 2.715-106.092 1.00 3.70 C ATOM 366 OE1 GLU A 24 255.839 1.719-106.703 1.00 4.08 O ATOM 367 OE2 GLU A 24 255.440 3.628-105.787 1.00 4.01 O ATOM 0 H GLU A 24 260.726 4.244-106.938 1.00 2.45 H new ATOM 0 HA GLU A 24 259.884 1.568-105.785 1.00 2.64 H new ATOM 0 HB2 GLU A 24 258.622 3.859-107.322 1.00 2.86 H new ATOM 0 HB3 GLU A 24 258.080 2.241-107.722 1.00 2.86 H new ATOM 0 HG2 GLU A 24 257.936 1.988-105.045 1.00 3.39 H new ATOM 0 HG3 GLU A 24 257.819 3.736-105.104 1.00 3.39 H new ATOM 374 N LEU A 25 261.836 1.460-107.833 1.00 2.44 N ATOM 375 CA LEU A 25 262.507 0.782-108.981 1.00 2.49 C ATOM 376 C LEU A 25 262.754 -0.694-108.653 1.00 2.29 C ATOM 377 O LEU A 25 262.118 -1.573-109.203 1.00 2.24 O ATOM 378 CB LEU A 25 263.830 1.540-109.162 1.00 2.86 C ATOM 379 CG LEU A 25 264.656 0.901-110.293 1.00 3.29 C ATOM 380 CD1 LEU A 25 265.165 1.991-111.241 1.00 3.82 C ATOM 381 CD2 LEU A 25 265.853 0.148-109.696 1.00 3.68 C ATOM 0 H LEU A 25 262.465 1.800-107.105 1.00 2.44 H new ATOM 0 HA LEU A 25 261.905 0.798-109.890 1.00 2.49 H new ATOM 0 HB2 LEU A 25 263.630 2.586-109.394 1.00 2.86 H new ATOM 0 HB3 LEU A 25 264.398 1.523-108.232 1.00 2.86 H new ATOM 0 HG LEU A 25 264.026 0.204-110.846 1.00 3.29 H new ATOM 0 HD11 LEU A 25 265.749 1.535-112.040 1.00 3.82 H new ATOM 0 HD12 LEU A 25 264.317 2.525-111.671 1.00 3.82 H new ATOM 0 HD13 LEU A 25 265.791 2.691-110.688 1.00 3.82 H new ATOM 0 HD21 LEU A 25 266.436 -0.303-110.499 1.00 3.68 H new ATOM 0 HD22 LEU A 25 266.480 0.844-109.139 1.00 3.68 H new ATOM 0 HD23 LEU A 25 265.494 -0.633-109.025 1.00 3.68 H new ATOM 393 N GLN A 26 263.670 -0.968-107.760 1.00 2.26 N ATOM 394 CA GLN A 26 263.962 -2.384-107.390 1.00 2.17 C ATOM 395 C GLN A 26 264.273 -2.498-105.893 1.00 1.87 C ATOM 396 O GLN A 26 264.830 -3.484-105.447 1.00 1.81 O ATOM 397 CB GLN A 26 265.188 -2.765-108.221 1.00 2.35 C ATOM 398 CG GLN A 26 265.276 -4.289-108.330 1.00 2.73 C ATOM 399 CD GLN A 26 266.094 -4.666-109.567 1.00 3.32 C ATOM 400 OE1 GLN A 26 265.580 -4.678-110.668 1.00 3.64 O ATOM 401 NE2 GLN A 26 267.354 -4.977-109.432 1.00 4.03 N ATOM 0 H GLN A 26 264.229 -0.270-107.270 1.00 2.26 H new ATOM 0 HA GLN A 26 263.113 -3.040-107.584 1.00 2.17 H new ATOM 0 HB2 GLN A 26 265.119 -2.322-109.215 1.00 2.35 H new ATOM 0 HB3 GLN A 26 266.092 -2.370-107.758 1.00 2.35 H new ATOM 0 HG2 GLN A 26 265.740 -4.702-107.434 1.00 2.73 H new ATOM 0 HG3 GLN A 26 264.276 -4.718-108.398 1.00 2.73 H new ATOM 0 HE21 GLN A 26 267.786 -4.967-108.508 1.00 4.03 H new ATOM 0 HE22 GLN A 26 267.907 -5.230-110.251 1.00 4.03 H new ATOM 410 N ARG A 27 263.916 -1.504-105.114 1.00 1.75 N ATOM 411 CA ARG A 27 264.192 -1.566-103.649 1.00 1.56 C ATOM 412 C ARG A 27 262.991 -2.170-102.909 1.00 1.53 C ATOM 413 O ARG A 27 263.134 -2.737-101.841 1.00 1.50 O ATOM 414 CB ARG A 27 264.443 -0.112-103.220 1.00 1.65 C ATOM 415 CG ARG A 27 263.191 0.746-103.458 1.00 2.47 C ATOM 416 CD ARG A 27 262.591 1.171-102.113 1.00 3.12 C ATOM 417 NE ARG A 27 261.118 1.048-102.292 1.00 4.09 N ATOM 418 CZ ARG A 27 260.313 1.836-101.633 1.00 4.99 C ATOM 419 NH1 ARG A 27 260.177 1.699-100.343 1.00 5.60 N ATOM 420 NH2 ARG A 27 259.646 2.763-102.265 1.00 5.60 N ATOM 0 H ARG A 27 263.447 -0.656-105.431 1.00 1.75 H new ATOM 0 HA ARG A 27 265.048 -2.199-103.414 1.00 1.56 H new ATOM 0 HB2 ARG A 27 264.717 -0.080-102.165 1.00 1.65 H new ATOM 0 HB3 ARG A 27 265.283 0.298-103.780 1.00 1.65 H new ATOM 0 HG2 ARG A 27 263.449 1.627-104.046 1.00 2.47 H new ATOM 0 HG3 ARG A 27 262.456 0.182-104.033 1.00 2.47 H new ATOM 0 HD2 ARG A 27 262.945 0.532-101.304 1.00 3.12 H new ATOM 0 HD3 ARG A 27 262.874 2.193-101.860 1.00 3.12 H new ATOM 0 HE ARG A 27 260.738 0.348-102.929 1.00 4.09 H new ATOM 0 HH11 ARG A 27 260.700 0.976 -99.849 1.00 5.60 H new ATOM 0 HH12 ARG A 27 259.548 2.315 -99.828 1.00 5.60 H new ATOM 0 HH21 ARG A 27 259.754 2.871-103.273 1.00 5.60 H new ATOM 0 HH22 ARG A 27 259.017 3.379-101.750 1.00 5.60 H new ATOM 434 N ARG A 28 261.810 -2.060-103.472 1.00 1.62 N ATOM 435 CA ARG A 28 260.604 -2.633-102.799 1.00 1.71 C ATOM 436 C ARG A 28 260.603 -4.157-102.924 1.00 1.70 C ATOM 437 O ARG A 28 260.222 -4.861-102.006 1.00 1.67 O ATOM 438 CB ARG A 28 259.402 -2.023-103.522 1.00 1.96 C ATOM 439 CG ARG A 28 258.242 -1.856-102.534 1.00 2.17 C ATOM 440 CD ARG A 28 258.631 -0.859-101.432 1.00 2.14 C ATOM 441 NE ARG A 28 257.806 0.353-101.696 1.00 2.41 N ATOM 442 CZ ARG A 28 256.753 0.598-100.966 1.00 2.56 C ATOM 443 NH1 ARG A 28 255.804 -0.292-100.870 1.00 3.18 N ATOM 444 NH2 ARG A 28 256.649 1.734-100.332 1.00 2.81 N ATOM 0 H ARG A 28 261.631 -1.600-104.365 1.00 1.62 H new ATOM 0 HA ARG A 28 260.583 -2.405-101.733 1.00 1.71 H new ATOM 0 HB2 ARG A 28 259.672 -1.057-103.948 1.00 1.96 H new ATOM 0 HB3 ARG A 28 259.099 -2.663-104.350 1.00 1.96 H new ATOM 0 HG2 ARG A 28 257.354 -1.503-103.059 1.00 2.17 H new ATOM 0 HG3 ARG A 28 257.989 -2.819-102.092 1.00 2.17 H new ATOM 0 HD2 ARG A 28 258.427 -1.267-100.442 1.00 2.14 H new ATOM 0 HD3 ARG A 28 259.695 -0.627-101.468 1.00 2.14 H new ATOM 0 HE ARG A 28 258.065 0.992-102.448 1.00 2.41 H new ATOM 0 HH11 ARG A 28 255.885 -1.180-101.366 1.00 3.18 H new ATOM 0 HH12 ARG A 28 254.981 -0.100-100.299 1.00 3.18 H new ATOM 0 HH21 ARG A 28 257.391 2.430-100.407 1.00 2.81 H new ATOM 0 HH22 ARG A 28 255.826 1.926 -99.761 1.00 2.81 H new ATOM 458 N LEU A 29 261.043 -4.678-104.045 1.00 1.80 N ATOM 459 CA LEU A 29 261.085 -6.163-104.216 1.00 1.88 C ATOM 460 C LEU A 29 261.976 -6.767-103.128 1.00 1.67 C ATOM 461 O LEU A 29 261.641 -7.762-102.506 1.00 1.66 O ATOM 462 CB LEU A 29 261.693 -6.397-105.601 1.00 2.03 C ATOM 463 CG LEU A 29 261.710 -7.896-105.905 1.00 2.32 C ATOM 464 CD1 LEU A 29 260.431 -8.281-106.650 1.00 2.60 C ATOM 465 CD2 LEU A 29 262.924 -8.224-106.777 1.00 2.92 C ATOM 0 H LEU A 29 261.374 -4.140-104.846 1.00 1.80 H new ATOM 0 HA LEU A 29 260.101 -6.624-104.134 1.00 1.88 H new ATOM 0 HB2 LEU A 29 261.114 -5.868-106.358 1.00 2.03 H new ATOM 0 HB3 LEU A 29 262.706 -5.996-105.637 1.00 2.03 H new ATOM 0 HG LEU A 29 261.769 -8.455-104.971 1.00 2.32 H new ATOM 0 HD11 LEU A 29 260.444 -9.349-106.866 1.00 2.60 H new ATOM 0 HD12 LEU A 29 259.565 -8.046-106.031 1.00 2.60 H new ATOM 0 HD13 LEU A 29 260.372 -7.722-107.584 1.00 2.60 H new ATOM 0 HD21 LEU A 29 262.938 -9.292-106.995 1.00 2.92 H new ATOM 0 HD22 LEU A 29 262.863 -7.664-107.710 1.00 2.92 H new ATOM 0 HD23 LEU A 29 263.837 -7.950-106.248 1.00 2.92 H new ATOM 477 N ASP A 30 263.101 -6.146-102.882 1.00 1.54 N ATOM 478 CA ASP A 30 264.023 -6.647-101.823 1.00 1.36 C ATOM 479 C ASP A 30 263.324 -6.581-100.465 1.00 1.23 C ATOM 480 O ASP A 30 263.411 -7.497 -99.672 1.00 1.16 O ATOM 481 CB ASP A 30 265.229 -5.705-101.852 1.00 1.32 C ATOM 482 CG ASP A 30 266.506 -6.499-101.571 1.00 1.56 C ATOM 483 OD1 ASP A 30 266.450 -7.401-100.751 1.00 1.89 O ATOM 484 OD2 ASP A 30 267.517 -6.192-102.180 1.00 2.10 O ATOM 0 H ASP A 30 263.420 -5.310-103.372 1.00 1.54 H new ATOM 0 HA ASP A 30 264.322 -7.682-101.988 1.00 1.36 H new ATOM 0 HB2 ASP A 30 265.299 -5.217-102.824 1.00 1.32 H new ATOM 0 HB3 ASP A 30 265.107 -4.918-101.108 1.00 1.32 H new ATOM 489 N VAL A 31 262.616 -5.503-100.196 1.00 1.24 N ATOM 490 CA VAL A 31 261.895 -5.371 -98.884 1.00 1.21 C ATOM 491 C VAL A 31 261.054 -6.624 -98.605 1.00 1.27 C ATOM 492 O VAL A 31 261.307 -7.349 -97.664 1.00 1.19 O ATOM 493 CB VAL A 31 260.996 -4.135 -99.032 1.00 1.38 C ATOM 494 CG1 VAL A 31 260.169 -3.934 -97.756 1.00 1.54 C ATOM 495 CG2 VAL A 31 261.866 -2.897 -99.265 1.00 1.40 C ATOM 0 H VAL A 31 262.507 -4.710-100.828 1.00 1.24 H new ATOM 0 HA VAL A 31 262.588 -5.266 -98.049 1.00 1.21 H new ATOM 0 HB VAL A 31 260.326 -4.282 -99.879 1.00 1.38 H new ATOM 0 HG11 VAL A 31 259.534 -3.055 -97.869 1.00 1.54 H new ATOM 0 HG12 VAL A 31 259.547 -4.812 -97.584 1.00 1.54 H new ATOM 0 HG13 VAL A 31 260.838 -3.792 -96.907 1.00 1.54 H new ATOM 0 HG21 VAL A 31 261.229 -2.019 -99.370 1.00 1.40 H new ATOM 0 HG22 VAL A 31 262.537 -2.759 -98.417 1.00 1.40 H new ATOM 0 HG23 VAL A 31 262.453 -3.030-100.174 1.00 1.40 H new ATOM 505 N GLU A 32 260.065 -6.883 -99.423 1.00 1.44 N ATOM 506 CA GLU A 32 259.200 -8.092 -99.215 1.00 1.53 C ATOM 507 C GLU A 32 260.053 -9.362 -99.060 1.00 1.45 C ATOM 508 O GLU A 32 259.690 -10.283 -98.352 1.00 1.46 O ATOM 509 CB GLU A 32 258.340 -8.186-100.478 1.00 1.72 C ATOM 510 CG GLU A 32 257.173 -9.143-100.231 1.00 2.02 C ATOM 511 CD GLU A 32 255.976 -8.360 -99.688 1.00 2.54 C ATOM 512 OE1 GLU A 32 255.277 -7.756-100.485 1.00 3.14 O ATOM 513 OE2 GLU A 32 255.779 -8.378 -98.484 1.00 2.91 O ATOM 0 H GLU A 32 259.816 -6.310-100.229 1.00 1.44 H new ATOM 0 HA GLU A 32 258.602 -8.006 -98.308 1.00 1.53 H new ATOM 0 HB2 GLU A 32 257.964 -7.199-100.749 1.00 1.72 H new ATOM 0 HB3 GLU A 32 258.942 -8.539-101.315 1.00 1.72 H new ATOM 0 HG2 GLU A 32 256.901 -9.648-101.158 1.00 2.02 H new ATOM 0 HG3 GLU A 32 257.467 -9.916 -99.521 1.00 2.02 H new ATOM 520 N LYS A 33 261.173 -9.416 -99.736 1.00 1.41 N ATOM 521 CA LYS A 33 262.050 -10.630 -99.661 1.00 1.40 C ATOM 522 C LYS A 33 262.565 -10.898 -98.234 1.00 1.25 C ATOM 523 O LYS A 33 262.212 -11.892 -97.624 1.00 1.32 O ATOM 524 CB LYS A 33 263.222 -10.334-100.602 1.00 1.42 C ATOM 525 CG LYS A 33 263.591 -11.600-101.378 1.00 1.65 C ATOM 526 CD LYS A 33 264.237 -12.612-100.429 1.00 2.21 C ATOM 527 CE LYS A 33 265.160 -13.540-101.222 1.00 2.76 C ATOM 528 NZ LYS A 33 265.164 -14.820-100.460 1.00 3.42 N ATOM 0 H LYS A 33 261.521 -8.671-100.339 1.00 1.41 H new ATOM 0 HA LYS A 33 261.495 -11.524 -99.944 1.00 1.40 H new ATOM 0 HB2 LYS A 33 262.953 -9.537-101.295 1.00 1.42 H new ATOM 0 HB3 LYS A 33 264.081 -9.983-100.030 1.00 1.42 H new ATOM 0 HG2 LYS A 33 262.700 -12.031-101.835 1.00 1.65 H new ATOM 0 HG3 LYS A 33 264.278 -11.355-102.188 1.00 1.65 H new ATOM 0 HD2 LYS A 33 264.803 -12.092 -99.657 1.00 2.21 H new ATOM 0 HD3 LYS A 33 263.467 -13.194 -99.922 1.00 2.21 H new ATOM 0 HE2 LYS A 33 264.794 -13.687-102.238 1.00 2.76 H new ATOM 0 HE3 LYS A 33 266.165 -13.124-101.301 1.00 2.76 H new ATOM 0 HZ1 LYS A 33 265.776 -15.509-100.942 1.00 3.42 H new ATOM 0 HZ2 LYS A 33 265.523 -14.651 -99.499 1.00 3.42 H new ATOM 0 HZ3 LYS A 33 264.196 -15.195-100.407 1.00 3.42 H new ATOM 542 N TRP A 34 263.421 -10.049 -97.713 1.00 1.09 N ATOM 543 CA TRP A 34 263.985 -10.296 -96.342 1.00 0.97 C ATOM 544 C TRP A 34 262.991 -9.933 -95.239 1.00 0.95 C ATOM 545 O TRP A 34 263.073 -10.453 -94.141 1.00 0.95 O ATOM 546 CB TRP A 34 265.243 -9.419 -96.236 1.00 0.87 C ATOM 547 CG TRP A 34 264.903 -7.979 -96.473 1.00 0.83 C ATOM 548 CD1 TRP A 34 265.170 -7.305 -97.613 1.00 0.91 C ATOM 549 CD2 TRP A 34 264.254 -7.025 -95.577 1.00 0.78 C ATOM 550 NE1 TRP A 34 264.714 -6.006 -97.484 1.00 0.91 N ATOM 551 CE2 TRP A 34 264.143 -5.784 -96.248 1.00 0.84 C ATOM 552 CE3 TRP A 34 263.750 -7.114 -94.266 1.00 0.77 C ATOM 553 CZ2 TRP A 34 263.553 -4.673 -95.643 1.00 0.91 C ATOM 554 CZ3 TRP A 34 263.159 -5.997 -93.654 1.00 0.85 C ATOM 555 CH2 TRP A 34 263.060 -4.781 -94.342 1.00 0.91 C ATOM 0 H TRP A 34 263.753 -9.201 -98.173 1.00 1.09 H new ATOM 0 HA TRP A 34 264.210 -11.354 -96.210 1.00 0.97 H new ATOM 0 HB2 TRP A 34 265.692 -9.535 -95.249 1.00 0.87 H new ATOM 0 HB3 TRP A 34 265.985 -9.748 -96.964 1.00 0.87 H new ATOM 0 HD1 TRP A 34 265.660 -7.714 -98.484 1.00 0.91 H new ATOM 0 HE1 TRP A 34 264.791 -5.298 -98.214 1.00 0.91 H new ATOM 0 HE3 TRP A 34 263.818 -8.048 -93.727 1.00 0.77 H new ATOM 0 HZ2 TRP A 34 263.479 -3.737 -96.177 1.00 0.91 H new ATOM 0 HZ3 TRP A 34 262.778 -6.076 -92.646 1.00 0.85 H new ATOM 0 HH2 TRP A 34 262.602 -3.927 -93.866 1.00 0.91 H new ATOM 566 N ILE A 35 262.067 -9.047 -95.503 1.00 1.01 N ATOM 567 CA ILE A 35 261.093 -8.659 -94.440 1.00 1.09 C ATOM 568 C ILE A 35 260.161 -9.837 -94.093 1.00 1.20 C ATOM 569 O ILE A 35 259.937 -10.133 -92.933 1.00 1.24 O ATOM 570 CB ILE A 35 260.336 -7.433 -95.004 1.00 1.21 C ATOM 571 CG1 ILE A 35 259.744 -6.640 -93.841 1.00 1.40 C ATOM 572 CG2 ILE A 35 259.211 -7.846 -95.965 1.00 1.67 C ATOM 573 CD1 ILE A 35 259.135 -5.334 -94.360 1.00 1.67 C ATOM 0 H ILE A 35 261.945 -8.578 -96.401 1.00 1.01 H new ATOM 0 HA ILE A 35 261.581 -8.403 -93.499 1.00 1.09 H new ATOM 0 HB ILE A 35 261.044 -6.824 -95.566 1.00 1.21 H new ATOM 0 HG12 ILE A 35 258.981 -7.232 -93.336 1.00 1.40 H new ATOM 0 HG13 ILE A 35 260.518 -6.424 -93.105 1.00 1.40 H new ATOM 0 HG21 ILE A 35 258.705 -6.955 -96.338 1.00 1.67 H new ATOM 0 HG22 ILE A 35 259.633 -8.401 -96.803 1.00 1.67 H new ATOM 0 HG23 ILE A 35 258.495 -8.476 -95.437 1.00 1.67 H new ATOM 0 HD11 ILE A 35 258.714 -4.772 -93.526 1.00 1.67 H new ATOM 0 HD12 ILE A 35 259.909 -4.739 -94.845 1.00 1.67 H new ATOM 0 HD13 ILE A 35 258.348 -5.560 -95.079 1.00 1.67 H new ATOM 585 N ASP A 36 259.622 -10.507 -95.085 1.00 1.32 N ATOM 586 CA ASP A 36 258.702 -11.655 -94.810 1.00 1.44 C ATOM 587 C ASP A 36 259.491 -12.913 -94.438 1.00 1.37 C ATOM 588 O ASP A 36 259.112 -13.645 -93.543 1.00 1.43 O ATOM 589 CB ASP A 36 257.934 -11.871 -96.114 1.00 1.61 C ATOM 590 CG ASP A 36 256.652 -12.655 -95.828 1.00 1.98 C ATOM 591 OD1 ASP A 36 255.907 -12.237 -94.957 1.00 2.26 O ATOM 592 OD2 ASP A 36 256.436 -13.660 -96.485 1.00 2.63 O ATOM 0 H ASP A 36 259.780 -10.308 -96.073 1.00 1.32 H new ATOM 0 HA ASP A 36 258.038 -11.448 -93.971 1.00 1.44 H new ATOM 0 HB2 ASP A 36 257.692 -10.911 -96.569 1.00 1.61 H new ATOM 0 HB3 ASP A 36 258.554 -12.414 -96.827 1.00 1.61 H new ATOM 597 N GLY A 37 260.580 -13.176 -95.119 1.00 1.27 N ATOM 598 CA GLY A 37 261.391 -14.396 -94.807 1.00 1.26 C ATOM 599 C GLY A 37 261.792 -14.395 -93.327 1.00 1.21 C ATOM 600 O GLY A 37 261.471 -15.309 -92.581 1.00 1.31 O ATOM 0 H GLY A 37 260.943 -12.599 -95.878 1.00 1.27 H new ATOM 0 HA2 GLY A 37 260.816 -15.293 -95.036 1.00 1.26 H new ATOM 0 HA3 GLY A 37 262.282 -14.420 -95.434 1.00 1.26 H new ATOM 604 N ARG A 38 262.487 -13.372 -92.896 1.00 1.10 N ATOM 605 CA ARG A 38 262.911 -13.304 -91.465 1.00 1.11 C ATOM 606 C ARG A 38 261.691 -13.358 -90.543 1.00 1.22 C ATOM 607 O ARG A 38 261.643 -14.157 -89.631 1.00 1.33 O ATOM 608 CB ARG A 38 263.644 -11.969 -91.317 1.00 1.02 C ATOM 609 CG ARG A 38 265.151 -12.191 -91.497 1.00 1.18 C ATOM 610 CD ARG A 38 265.560 -11.815 -92.925 1.00 1.35 C ATOM 611 NE ARG A 38 267.049 -11.876 -92.929 1.00 1.56 N ATOM 612 CZ ARG A 38 267.656 -13.031 -92.909 1.00 1.82 C ATOM 613 NH1 ARG A 38 267.900 -13.619 -91.770 1.00 2.49 N ATOM 614 NH2 ARG A 38 268.020 -13.596 -94.027 1.00 2.25 N ATOM 0 H ARG A 38 262.778 -12.583 -93.473 1.00 1.10 H new ATOM 0 HA ARG A 38 263.550 -14.144 -91.191 1.00 1.11 H new ATOM 0 HB2 ARG A 38 263.279 -11.257 -92.058 1.00 1.02 H new ATOM 0 HB3 ARG A 38 263.444 -11.539 -90.336 1.00 1.02 H new ATOM 0 HG2 ARG A 38 265.706 -11.588 -90.778 1.00 1.18 H new ATOM 0 HG3 ARG A 38 265.401 -13.233 -91.299 1.00 1.18 H new ATOM 0 HD2 ARG A 38 265.135 -12.507 -93.652 1.00 1.35 H new ATOM 0 HD3 ARG A 38 265.205 -10.818 -93.188 1.00 1.35 H new ATOM 0 HE ARG A 38 267.594 -11.014 -92.947 1.00 1.56 H new ATOM 0 HH11 ARG A 38 267.616 -13.176 -90.896 1.00 2.49 H new ATOM 0 HH12 ARG A 38 268.374 -14.522 -91.753 1.00 2.49 H new ATOM 0 HH21 ARG A 38 267.830 -13.135 -94.917 1.00 2.25 H new ATOM 0 HH22 ARG A 38 268.494 -14.499 -94.011 1.00 2.25 H new ATOM 628 N LEU A 39 260.699 -12.525 -90.774 1.00 1.23 N ATOM 629 CA LEU A 39 259.480 -12.547 -89.896 1.00 1.40 C ATOM 630 C LEU A 39 258.871 -13.951 -89.856 1.00 1.51 C ATOM 631 O LEU A 39 258.387 -14.398 -88.833 1.00 1.65 O ATOM 632 CB LEU A 39 258.501 -11.564 -90.541 1.00 1.46 C ATOM 633 CG LEU A 39 258.537 -10.221 -89.802 1.00 1.44 C ATOM 634 CD1 LEU A 39 259.941 -9.608 -89.881 1.00 1.42 C ATOM 635 CD2 LEU A 39 257.536 -9.268 -90.453 1.00 1.56 C ATOM 0 H LEU A 39 260.680 -11.836 -91.526 1.00 1.23 H new ATOM 0 HA LEU A 39 259.718 -12.274 -88.868 1.00 1.40 H new ATOM 0 HB2 LEU A 39 258.759 -11.418 -91.590 1.00 1.46 H new ATOM 0 HB3 LEU A 39 257.492 -11.975 -90.515 1.00 1.46 H new ATOM 0 HG LEU A 39 258.279 -10.382 -88.755 1.00 1.44 H new ATOM 0 HD11 LEU A 39 259.952 -8.655 -89.352 1.00 1.42 H new ATOM 0 HD12 LEU A 39 260.660 -10.286 -89.422 1.00 1.42 H new ATOM 0 HD13 LEU A 39 260.209 -9.447 -90.925 1.00 1.42 H new ATOM 0 HD21 LEU A 39 257.555 -8.310 -89.933 1.00 1.56 H new ATOM 0 HD22 LEU A 39 257.803 -9.119 -91.499 1.00 1.56 H new ATOM 0 HD23 LEU A 39 256.535 -9.694 -90.391 1.00 1.56 H new ATOM 647 N GLU A 40 258.893 -14.645 -90.965 1.00 1.49 N ATOM 648 CA GLU A 40 258.319 -16.022 -91.005 1.00 1.61 C ATOM 649 C GLU A 40 259.046 -16.925 -90.006 1.00 1.61 C ATOM 650 O GLU A 40 258.447 -17.784 -89.385 1.00 1.73 O ATOM 651 CB GLU A 40 258.545 -16.517 -92.435 1.00 1.62 C ATOM 652 CG GLU A 40 257.603 -17.687 -92.726 1.00 2.09 C ATOM 653 CD GLU A 40 257.758 -18.116 -94.186 1.00 2.30 C ATOM 654 OE1 GLU A 40 258.865 -18.459 -94.569 1.00 2.72 O ATOM 655 OE2 GLU A 40 256.767 -18.096 -94.898 1.00 2.74 O ATOM 0 H GLU A 40 259.285 -14.315 -91.847 1.00 1.49 H new ATOM 0 HA GLU A 40 257.262 -16.032 -90.738 1.00 1.61 H new ATOM 0 HB2 GLU A 40 258.367 -15.708 -93.143 1.00 1.62 H new ATOM 0 HB3 GLU A 40 259.581 -16.830 -92.563 1.00 1.62 H new ATOM 0 HG2 GLU A 40 257.829 -18.523 -92.064 1.00 2.09 H new ATOM 0 HG3 GLU A 40 256.571 -17.395 -92.529 1.00 2.09 H new ATOM 662 N GLU A 41 260.334 -16.741 -89.854 1.00 1.51 N ATOM 663 CA GLU A 41 261.105 -17.599 -88.900 1.00 1.56 C ATOM 664 C GLU A 41 261.387 -16.869 -87.576 1.00 1.54 C ATOM 665 O GLU A 41 261.783 -17.485 -86.604 1.00 1.56 O ATOM 666 CB GLU A 41 262.416 -17.912 -89.625 1.00 1.53 C ATOM 667 CG GLU A 41 262.326 -19.294 -90.278 1.00 1.66 C ATOM 668 CD GLU A 41 263.534 -19.506 -91.193 1.00 1.86 C ATOM 669 OE1 GLU A 41 264.646 -19.450 -90.696 1.00 2.32 O ATOM 670 OE2 GLU A 41 263.325 -19.722 -92.376 1.00 2.28 O ATOM 0 H GLU A 41 260.884 -16.037 -90.347 1.00 1.51 H new ATOM 0 HA GLU A 41 260.546 -18.496 -88.634 1.00 1.56 H new ATOM 0 HB2 GLU A 41 262.614 -17.153 -90.382 1.00 1.53 H new ATOM 0 HB3 GLU A 41 263.248 -17.885 -88.921 1.00 1.53 H new ATOM 0 HG2 GLU A 41 262.296 -20.069 -89.512 1.00 1.66 H new ATOM 0 HG3 GLU A 41 261.403 -19.377 -90.852 1.00 1.66 H new ATOM 677 N LEU A 42 261.193 -15.572 -87.523 1.00 1.54 N ATOM 678 CA LEU A 42 261.461 -14.825 -86.252 1.00 1.54 C ATOM 679 C LEU A 42 260.208 -14.806 -85.370 1.00 1.66 C ATOM 680 O LEU A 42 260.117 -15.528 -84.394 1.00 1.76 O ATOM 681 CB LEU A 42 261.834 -13.404 -86.685 1.00 1.38 C ATOM 682 CG LEU A 42 263.358 -13.260 -86.743 1.00 1.37 C ATOM 683 CD1 LEU A 42 263.929 -14.194 -87.813 1.00 1.45 C ATOM 684 CD2 LEU A 42 263.717 -11.813 -87.091 1.00 1.21 C ATOM 0 H LEU A 42 260.862 -15.001 -88.301 1.00 1.54 H new ATOM 0 HA LEU A 42 262.254 -15.290 -85.667 1.00 1.54 H new ATOM 0 HB2 LEU A 42 261.402 -13.187 -87.662 1.00 1.38 H new ATOM 0 HB3 LEU A 42 261.418 -12.680 -85.984 1.00 1.38 H new ATOM 0 HG LEU A 42 263.781 -13.523 -85.773 1.00 1.37 H new ATOM 0 HD11 LEU A 42 265.013 -14.086 -87.849 1.00 1.45 H new ATOM 0 HD12 LEU A 42 263.675 -15.225 -87.569 1.00 1.45 H new ATOM 0 HD13 LEU A 42 263.507 -13.936 -88.784 1.00 1.45 H new ATOM 0 HD21 LEU A 42 264.801 -11.707 -87.133 1.00 1.21 H new ATOM 0 HD22 LEU A 42 263.289 -11.555 -88.060 1.00 1.21 H new ATOM 0 HD23 LEU A 42 263.317 -11.145 -86.328 1.00 1.21 H new ATOM 696 N TYR A 43 259.246 -13.983 -85.704 1.00 1.68 N ATOM 697 CA TYR A 43 257.999 -13.906 -84.888 1.00 1.83 C ATOM 698 C TYR A 43 256.771 -14.087 -85.786 1.00 1.92 C ATOM 699 O TYR A 43 256.074 -13.141 -86.098 1.00 2.03 O ATOM 700 CB TYR A 43 258.019 -12.506 -84.271 1.00 1.78 C ATOM 701 CG TYR A 43 259.072 -12.449 -83.189 1.00 1.77 C ATOM 702 CD1 TYR A 43 259.017 -13.339 -82.111 1.00 2.15 C ATOM 703 CD2 TYR A 43 260.104 -11.505 -83.265 1.00 2.15 C ATOM 704 CE1 TYR A 43 259.992 -13.286 -81.109 1.00 2.18 C ATOM 705 CE2 TYR A 43 261.079 -11.452 -82.264 1.00 2.16 C ATOM 706 CZ TYR A 43 261.024 -12.343 -81.185 1.00 1.82 C ATOM 707 OH TYR A 43 261.985 -12.291 -80.196 1.00 1.87 O ATOM 0 H TYR A 43 259.272 -13.359 -86.510 1.00 1.68 H new ATOM 0 HA TYR A 43 257.950 -14.684 -84.126 1.00 1.83 H new ATOM 0 HB2 TYR A 43 258.230 -11.761 -85.039 1.00 1.78 H new ATOM 0 HB3 TYR A 43 257.041 -12.266 -83.855 1.00 1.78 H new ATOM 0 HD1 TYR A 43 258.222 -14.067 -82.052 1.00 2.15 H new ATOM 0 HD2 TYR A 43 260.147 -10.818 -84.097 1.00 2.15 H new ATOM 0 HE1 TYR A 43 259.949 -13.973 -80.277 1.00 2.18 H new ATOM 0 HE2 TYR A 43 261.874 -10.724 -82.323 1.00 2.16 H new ATOM 0 HH TYR A 43 262.845 -12.034 -80.589 1.00 1.87 H new ATOM 717 N ARG A 44 256.511 -15.300 -86.208 1.00 1.89 N ATOM 718 CA ARG A 44 255.332 -15.560 -87.098 1.00 2.00 C ATOM 719 C ARG A 44 254.035 -15.031 -86.468 1.00 2.19 C ATOM 720 O ARG A 44 253.073 -14.759 -87.161 1.00 2.30 O ATOM 721 CB ARG A 44 255.269 -17.085 -87.243 1.00 1.97 C ATOM 722 CG ARG A 44 255.830 -17.500 -88.606 1.00 2.26 C ATOM 723 CD ARG A 44 254.682 -17.667 -89.604 1.00 2.61 C ATOM 724 NE ARG A 44 255.130 -18.745 -90.528 1.00 3.00 N ATOM 725 CZ ARG A 44 254.486 -19.880 -90.570 1.00 3.55 C ATOM 726 NH1 ARG A 44 254.805 -20.841 -89.747 1.00 4.00 N ATOM 727 NH2 ARG A 44 253.523 -20.052 -91.433 1.00 4.11 N ATOM 0 H ARG A 44 257.065 -16.124 -85.975 1.00 1.89 H new ATOM 0 HA ARG A 44 255.437 -15.056 -88.059 1.00 2.00 H new ATOM 0 HB2 ARG A 44 255.840 -17.559 -86.445 1.00 1.97 H new ATOM 0 HB3 ARG A 44 254.239 -17.427 -87.144 1.00 1.97 H new ATOM 0 HG2 ARG A 44 256.532 -16.748 -88.966 1.00 2.26 H new ATOM 0 HG3 ARG A 44 256.384 -18.434 -88.514 1.00 2.26 H new ATOM 0 HD2 ARG A 44 253.756 -17.940 -89.098 1.00 2.61 H new ATOM 0 HD3 ARG A 44 254.489 -16.739 -90.143 1.00 2.61 H new ATOM 0 HE ARG A 44 255.941 -18.597 -91.129 1.00 3.00 H new ATOM 0 HH11 ARG A 44 255.557 -20.705 -89.071 1.00 4.00 H new ATOM 0 HH12 ARG A 44 254.302 -21.728 -89.779 1.00 4.00 H new ATOM 0 HH21 ARG A 44 253.273 -19.300 -92.075 1.00 4.11 H new ATOM 0 HH22 ARG A 44 253.020 -20.939 -91.466 1.00 4.11 H new ATOM 741 N GLY A 45 254.001 -14.887 -85.165 1.00 2.26 N ATOM 742 CA GLY A 45 252.762 -14.379 -84.502 1.00 2.46 C ATOM 743 C GLY A 45 253.073 -13.935 -83.071 1.00 2.53 C ATOM 744 O GLY A 45 252.365 -14.275 -82.142 1.00 2.69 O ATOM 0 H GLY A 45 254.775 -15.099 -84.535 1.00 2.26 H new ATOM 0 HA2 GLY A 45 252.354 -13.543 -85.069 1.00 2.46 H new ATOM 0 HA3 GLY A 45 252.001 -15.159 -84.491 1.00 2.46 H new ATOM 748 N ARG A 46 254.123 -13.175 -82.887 1.00 2.44 N ATOM 749 CA ARG A 46 254.479 -12.702 -81.513 1.00 2.52 C ATOM 750 C ARG A 46 254.479 -11.167 -81.439 1.00 2.41 C ATOM 751 O ARG A 46 254.513 -10.596 -80.365 1.00 2.51 O ATOM 752 CB ARG A 46 255.882 -13.258 -81.253 1.00 2.50 C ATOM 753 CG ARG A 46 255.848 -14.790 -81.300 1.00 2.31 C ATOM 754 CD ARG A 46 254.929 -15.320 -80.195 1.00 2.48 C ATOM 755 NE ARG A 46 255.095 -16.800 -80.231 1.00 2.47 N ATOM 756 CZ ARG A 46 256.129 -17.354 -79.661 1.00 2.79 C ATOM 757 NH1 ARG A 46 256.183 -17.451 -78.360 1.00 3.19 N ATOM 758 NH2 ARG A 46 257.109 -17.813 -80.390 1.00 3.28 N ATOM 0 H ARG A 46 254.749 -12.861 -83.628 1.00 2.44 H new ATOM 0 HA ARG A 46 253.759 -13.042 -80.769 1.00 2.52 H new ATOM 0 HB2 ARG A 46 256.579 -12.877 -82.000 1.00 2.50 H new ATOM 0 HB3 ARG A 46 256.242 -12.922 -80.281 1.00 2.50 H new ATOM 0 HG2 ARG A 46 255.493 -15.126 -82.274 1.00 2.31 H new ATOM 0 HG3 ARG A 46 256.854 -15.190 -81.173 1.00 2.31 H new ATOM 0 HD2 ARG A 46 255.208 -14.915 -79.222 1.00 2.48 H new ATOM 0 HD3 ARG A 46 253.892 -15.035 -80.374 1.00 2.48 H new ATOM 0 HE ARG A 46 254.400 -17.380 -80.701 1.00 2.47 H new ATOM 0 HH11 ARG A 46 255.417 -17.094 -77.790 1.00 3.19 H new ATOM 0 HH12 ARG A 46 256.992 -17.884 -77.914 1.00 3.19 H new ATOM 0 HH21 ARG A 46 257.067 -17.739 -81.406 1.00 3.28 H new ATOM 0 HH22 ARG A 46 257.917 -18.246 -79.943 1.00 3.28 H new ATOM 772 N GLU A 47 254.436 -10.492 -82.566 1.00 2.21 N ATOM 773 CA GLU A 47 254.427 -8.990 -82.566 1.00 2.12 C ATOM 774 C GLU A 47 255.599 -8.434 -81.748 1.00 2.12 C ATOM 775 O GLU A 47 255.445 -7.496 -80.988 1.00 2.11 O ATOM 776 CB GLU A 47 253.092 -8.591 -81.929 1.00 2.28 C ATOM 777 CG GLU A 47 252.004 -8.554 -83.004 1.00 2.32 C ATOM 778 CD GLU A 47 250.803 -7.758 -82.488 1.00 2.60 C ATOM 779 OE1 GLU A 47 250.944 -6.560 -82.309 1.00 2.99 O ATOM 780 OE2 GLU A 47 249.763 -8.361 -82.282 1.00 2.93 O ATOM 0 H GLU A 47 254.407 -10.919 -83.492 1.00 2.21 H new ATOM 0 HA GLU A 47 254.534 -8.590 -83.574 1.00 2.12 H new ATOM 0 HB2 GLU A 47 252.823 -9.302 -81.148 1.00 2.28 H new ATOM 0 HB3 GLU A 47 253.181 -7.614 -81.453 1.00 2.28 H new ATOM 0 HG2 GLU A 47 252.393 -8.097 -83.914 1.00 2.32 H new ATOM 0 HG3 GLU A 47 251.698 -9.568 -83.262 1.00 2.32 H new ATOM 787 N ALA A 48 256.766 -9.006 -81.903 1.00 2.15 N ATOM 788 CA ALA A 48 257.954 -8.515 -81.140 1.00 2.17 C ATOM 789 C ALA A 48 259.025 -7.987 -82.100 1.00 1.95 C ATOM 790 O ALA A 48 259.787 -7.100 -81.764 1.00 1.93 O ATOM 791 CB ALA A 48 258.471 -9.737 -80.381 1.00 2.32 C ATOM 0 H ALA A 48 256.948 -9.793 -82.526 1.00 2.15 H new ATOM 0 HA ALA A 48 257.700 -7.694 -80.469 1.00 2.17 H new ATOM 0 HB1 ALA A 48 259.346 -9.458 -79.794 1.00 2.32 H new ATOM 0 HB2 ALA A 48 257.692 -10.109 -79.716 1.00 2.32 H new ATOM 0 HB3 ALA A 48 258.744 -10.518 -81.091 1.00 2.32 H new ATOM 797 N ASP A 49 259.087 -8.527 -83.292 1.00 1.79 N ATOM 798 CA ASP A 49 260.106 -8.065 -84.285 1.00 1.58 C ATOM 799 C ASP A 49 259.979 -6.557 -84.533 1.00 1.56 C ATOM 800 O ASP A 49 260.915 -5.912 -84.964 1.00 1.46 O ATOM 801 CB ASP A 49 259.792 -8.837 -85.574 1.00 1.45 C ATOM 802 CG ASP A 49 261.091 -9.344 -86.202 1.00 1.50 C ATOM 803 OD1 ASP A 49 261.984 -8.536 -86.401 1.00 2.07 O ATOM 804 OD2 ASP A 49 261.171 -10.530 -86.474 1.00 1.99 O ATOM 0 H ASP A 49 258.473 -9.272 -83.622 1.00 1.79 H new ATOM 0 HA ASP A 49 261.121 -8.245 -83.931 1.00 1.58 H new ATOM 0 HB2 ASP A 49 259.131 -9.676 -85.355 1.00 1.45 H new ATOM 0 HB3 ASP A 49 259.265 -8.191 -86.277 1.00 1.45 H new ATOM 809 N MET A 50 258.819 -6.004 -84.289 1.00 1.71 N ATOM 810 CA MET A 50 258.611 -4.541 -84.536 1.00 1.75 C ATOM 811 C MET A 50 259.018 -3.691 -83.312 1.00 1.73 C ATOM 812 O MET A 50 258.355 -3.728 -82.295 1.00 1.82 O ATOM 813 CB MET A 50 257.108 -4.397 -84.816 1.00 2.01 C ATOM 814 CG MET A 50 256.287 -4.892 -83.610 1.00 2.28 C ATOM 815 SD MET A 50 255.437 -3.500 -82.818 1.00 2.65 S ATOM 816 CE MET A 50 254.987 -4.352 -81.286 1.00 3.05 C ATOM 0 H MET A 50 258.004 -6.501 -83.929 1.00 1.71 H new ATOM 0 HA MET A 50 259.226 -4.186 -85.363 1.00 1.75 H new ATOM 0 HB2 MET A 50 256.869 -3.354 -85.024 1.00 2.01 H new ATOM 0 HB3 MET A 50 256.841 -4.968 -85.705 1.00 2.01 H new ATOM 0 HG2 MET A 50 255.559 -5.634 -83.937 1.00 2.28 H new ATOM 0 HG3 MET A 50 256.943 -5.384 -82.891 1.00 2.28 H new ATOM 0 HE1 MET A 50 254.443 -3.667 -80.635 1.00 3.05 H new ATOM 0 HE2 MET A 50 254.356 -5.210 -81.519 1.00 3.05 H new ATOM 0 HE3 MET A 50 255.890 -4.693 -80.780 1.00 3.05 H new ATOM 826 N PRO A 51 260.089 -2.927 -83.447 1.00 1.78 N ATOM 827 CA PRO A 51 260.529 -2.060 -82.329 1.00 1.79 C ATOM 828 C PRO A 51 259.597 -0.844 -82.207 1.00 1.91 C ATOM 829 O PRO A 51 258.680 -0.847 -81.406 1.00 2.17 O ATOM 830 CB PRO A 51 261.950 -1.654 -82.715 1.00 2.05 C ATOM 831 CG PRO A 51 262.015 -1.788 -84.205 1.00 2.27 C ATOM 832 CD PRO A 51 260.976 -2.800 -84.617 1.00 2.03 C ATOM 0 HA PRO A 51 260.501 -2.554 -81.358 1.00 1.79 H new ATOM 0 HB2 PRO A 51 262.164 -0.632 -82.403 1.00 2.05 H new ATOM 0 HB3 PRO A 51 262.686 -2.296 -82.231 1.00 2.05 H new ATOM 0 HG2 PRO A 51 261.826 -0.828 -84.685 1.00 2.27 H new ATOM 0 HG3 PRO A 51 263.008 -2.110 -84.518 1.00 2.27 H new ATOM 0 HD2 PRO A 51 260.425 -2.466 -85.496 1.00 2.03 H new ATOM 0 HD3 PRO A 51 261.434 -3.756 -84.872 1.00 2.03 H new ATOM 840 N ASP A 52 259.807 0.190 -82.995 1.00 2.10 N ATOM 841 CA ASP A 52 258.912 1.387 -82.915 1.00 2.42 C ATOM 842 C ASP A 52 259.184 2.366 -84.065 1.00 2.42 C ATOM 843 O ASP A 52 258.264 2.916 -84.642 1.00 2.73 O ATOM 844 CB ASP A 52 259.219 2.042 -81.562 1.00 2.74 C ATOM 845 CG ASP A 52 260.702 2.419 -81.488 1.00 3.13 C ATOM 846 OD1 ASP A 52 261.490 1.571 -81.105 1.00 3.57 O ATOM 847 OD2 ASP A 52 261.023 3.550 -81.816 1.00 3.41 O ATOM 0 H ASP A 52 260.556 0.253 -83.685 1.00 2.10 H new ATOM 0 HA ASP A 52 257.863 1.102 -83.000 1.00 2.42 H new ATOM 0 HB2 ASP A 52 258.602 2.931 -81.431 1.00 2.74 H new ATOM 0 HB3 ASP A 52 258.968 1.357 -80.752 1.00 2.74 H new ATOM 852 N GLU A 53 260.430 2.593 -84.399 1.00 2.20 N ATOM 853 CA GLU A 53 260.746 3.543 -85.507 1.00 2.30 C ATOM 854 C GLU A 53 262.035 3.095 -86.232 1.00 2.11 C ATOM 855 O GLU A 53 262.088 1.997 -86.750 1.00 2.34 O ATOM 856 CB GLU A 53 260.892 4.902 -84.809 1.00 2.44 C ATOM 857 CG GLU A 53 260.846 6.020 -85.853 1.00 3.03 C ATOM 858 CD GLU A 53 261.415 7.305 -85.250 1.00 3.34 C ATOM 859 OE1 GLU A 53 260.902 7.735 -84.230 1.00 3.90 O ATOM 860 OE2 GLU A 53 262.354 7.838 -85.818 1.00 3.56 O ATOM 0 H GLU A 53 261.240 2.162 -83.953 1.00 2.20 H new ATOM 0 HA GLU A 53 259.981 3.586 -86.282 1.00 2.30 H new ATOM 0 HB2 GLU A 53 260.092 5.037 -84.081 1.00 2.44 H new ATOM 0 HB3 GLU A 53 261.833 4.941 -84.260 1.00 2.44 H new ATOM 0 HG2 GLU A 53 261.421 5.733 -86.734 1.00 3.03 H new ATOM 0 HG3 GLU A 53 259.820 6.183 -86.181 1.00 3.03 H new ATOM 867 N VAL A 54 263.067 3.916 -86.284 1.00 2.00 N ATOM 868 CA VAL A 54 264.323 3.503 -86.982 1.00 1.81 C ATOM 869 C VAL A 54 265.460 4.473 -86.633 1.00 1.99 C ATOM 870 O VAL A 54 265.234 5.524 -86.062 1.00 2.27 O ATOM 871 CB VAL A 54 263.986 3.559 -88.478 1.00 1.73 C ATOM 872 CG1 VAL A 54 263.577 4.982 -88.873 1.00 1.87 C ATOM 873 CG2 VAL A 54 265.210 3.135 -89.296 1.00 1.80 C ATOM 0 H VAL A 54 263.088 4.849 -85.873 1.00 2.00 H new ATOM 0 HA VAL A 54 264.659 2.509 -86.687 1.00 1.81 H new ATOM 0 HB VAL A 54 263.157 2.880 -88.680 1.00 1.73 H new ATOM 0 HG11 VAL A 54 263.340 5.010 -89.937 1.00 1.87 H new ATOM 0 HG12 VAL A 54 262.701 5.282 -88.298 1.00 1.87 H new ATOM 0 HG13 VAL A 54 264.399 5.667 -88.666 1.00 1.87 H new ATOM 0 HG21 VAL A 54 264.969 3.175 -90.358 1.00 1.80 H new ATOM 0 HG22 VAL A 54 266.040 3.810 -89.086 1.00 1.80 H new ATOM 0 HG23 VAL A 54 265.493 2.118 -89.026 1.00 1.80 H new ATOM 883 N ASN A 55 266.676 4.123 -86.966 1.00 1.89 N ATOM 884 CA ASN A 55 267.832 5.017 -86.650 1.00 2.10 C ATOM 885 C ASN A 55 267.753 6.314 -87.460 1.00 1.99 C ATOM 886 O ASN A 55 266.934 6.457 -88.348 1.00 1.81 O ATOM 887 CB ASN A 55 269.077 4.223 -87.045 1.00 2.30 C ATOM 888 CG ASN A 55 270.303 4.852 -86.386 1.00 2.22 C ATOM 889 OD1 ASN A 55 271.012 5.621 -87.004 1.00 2.74 O ATOM 890 ND2 ASN A 55 270.583 4.559 -85.146 1.00 2.13 N ATOM 0 H ASN A 55 266.919 3.255 -87.444 1.00 1.89 H new ATOM 0 HA ASN A 55 267.843 5.302 -85.598 1.00 2.10 H new ATOM 0 HB2 ASN A 55 268.974 3.184 -86.733 1.00 2.30 H new ATOM 0 HB3 ASN A 55 269.193 4.220 -88.129 1.00 2.30 H new ATOM 0 HD21 ASN A 55 271.397 4.976 -84.695 1.00 2.13 H new ATOM 0 HD22 ASN A 55 269.987 3.913 -84.628 1.00 2.13 H new ATOM 897 N ILE A 56 268.608 7.257 -87.153 1.00 2.12 N ATOM 898 CA ILE A 56 268.603 8.557 -87.895 1.00 2.08 C ATOM 899 C ILE A 56 269.949 8.796 -88.591 1.00 1.87 C ATOM 900 O ILE A 56 270.023 9.482 -89.592 1.00 1.81 O ATOM 901 CB ILE A 56 268.343 9.638 -86.839 1.00 2.27 C ATOM 902 CG1 ILE A 56 269.457 9.640 -85.774 1.00 2.41 C ATOM 903 CG2 ILE A 56 266.992 9.379 -86.168 1.00 2.68 C ATOM 904 CD1 ILE A 56 270.357 10.864 -85.970 1.00 2.42 C ATOM 0 H ILE A 56 269.312 7.183 -86.418 1.00 2.12 H new ATOM 0 HA ILE A 56 267.843 8.565 -88.676 1.00 2.08 H new ATOM 0 HB ILE A 56 268.332 10.611 -87.330 1.00 2.27 H new ATOM 0 HG12 ILE A 56 269.019 9.655 -84.776 1.00 2.41 H new ATOM 0 HG13 ILE A 56 270.047 8.727 -85.850 1.00 2.41 H new ATOM 0 HG21 ILE A 56 266.806 10.147 -85.417 1.00 2.68 H new ATOM 0 HG22 ILE A 56 266.202 9.406 -86.918 1.00 2.68 H new ATOM 0 HG23 ILE A 56 267.005 8.399 -85.690 1.00 2.68 H new ATOM 0 HD11 ILE A 56 271.143 10.862 -85.215 1.00 2.42 H new ATOM 0 HD12 ILE A 56 270.806 10.830 -86.962 1.00 2.42 H new ATOM 0 HD13 ILE A 56 269.762 11.772 -85.872 1.00 2.42 H new ATOM 916 N ASP A 57 271.010 8.236 -88.068 1.00 1.79 N ATOM 917 CA ASP A 57 272.361 8.426 -88.692 1.00 1.63 C ATOM 918 C ASP A 57 272.330 8.043 -90.178 1.00 1.48 C ATOM 919 O ASP A 57 273.123 8.523 -90.966 1.00 1.46 O ATOM 920 CB ASP A 57 273.296 7.490 -87.922 1.00 1.62 C ATOM 921 CG ASP A 57 273.444 7.989 -86.483 1.00 1.93 C ATOM 922 OD1 ASP A 57 274.068 9.020 -86.295 1.00 2.51 O ATOM 923 OD2 ASP A 57 272.930 7.331 -85.593 1.00 2.34 O ATOM 0 H ASP A 57 271.002 7.652 -87.232 1.00 1.79 H new ATOM 0 HA ASP A 57 272.687 9.465 -88.640 1.00 1.63 H new ATOM 0 HB2 ASP A 57 272.898 6.475 -87.927 1.00 1.62 H new ATOM 0 HB3 ASP A 57 274.271 7.452 -88.407 1.00 1.62 H new ATOM 928 N GLU A 58 271.413 7.190 -90.562 1.00 1.45 N ATOM 929 CA GLU A 58 271.318 6.779 -91.998 1.00 1.34 C ATOM 930 C GLU A 58 271.070 8.005 -92.885 1.00 1.48 C ATOM 931 O GLU A 58 271.378 8.000 -94.062 1.00 1.51 O ATOM 932 CB GLU A 58 270.123 5.825 -92.067 1.00 1.34 C ATOM 933 CG GLU A 58 270.391 4.600 -91.191 1.00 1.61 C ATOM 934 CD GLU A 58 269.303 3.552 -91.433 1.00 1.87 C ATOM 935 OE1 GLU A 58 268.873 3.424 -92.568 1.00 2.25 O ATOM 936 OE2 GLU A 58 268.919 2.895 -90.480 1.00 2.46 O ATOM 0 H GLU A 58 270.726 6.760 -89.943 1.00 1.45 H new ATOM 0 HA GLU A 58 272.236 6.308 -92.349 1.00 1.34 H new ATOM 0 HB2 GLU A 58 269.219 6.334 -91.731 1.00 1.34 H new ATOM 0 HB3 GLU A 58 269.951 5.516 -93.098 1.00 1.34 H new ATOM 0 HG2 GLU A 58 271.371 4.182 -91.422 1.00 1.61 H new ATOM 0 HG3 GLU A 58 270.406 4.888 -90.140 1.00 1.61 H new ATOM 943 N LEU A 59 270.515 9.054 -92.326 1.00 1.64 N ATOM 944 CA LEU A 59 270.244 10.282 -93.131 1.00 1.83 C ATOM 945 C LEU A 59 271.102 11.447 -92.627 1.00 1.88 C ATOM 946 O LEU A 59 271.506 12.305 -93.388 1.00 2.04 O ATOM 947 CB LEU A 59 268.760 10.578 -92.914 1.00 2.02 C ATOM 948 CG LEU A 59 268.316 11.693 -93.862 1.00 2.41 C ATOM 949 CD1 LEU A 59 268.106 11.118 -95.264 1.00 2.89 C ATOM 950 CD2 LEU A 59 267.004 12.297 -93.358 1.00 3.06 C ATOM 0 H LEU A 59 270.239 9.110 -91.346 1.00 1.64 H new ATOM 0 HA LEU A 59 270.483 10.145 -94.185 1.00 1.83 H new ATOM 0 HB2 LEU A 59 268.170 9.679 -93.092 1.00 2.02 H new ATOM 0 HB3 LEU A 59 268.585 10.875 -91.880 1.00 2.02 H new ATOM 0 HG LEU A 59 269.083 12.466 -93.898 1.00 2.41 H new ATOM 0 HD11 LEU A 59 267.790 11.913 -95.940 1.00 2.89 H new ATOM 0 HD12 LEU A 59 269.040 10.686 -95.624 1.00 2.89 H new ATOM 0 HD13 LEU A 59 267.339 10.345 -95.229 1.00 2.89 H new ATOM 0 HD21 LEU A 59 266.686 13.092 -94.033 1.00 3.06 H new ATOM 0 HD22 LEU A 59 266.237 11.523 -93.323 1.00 3.06 H new ATOM 0 HD23 LEU A 59 267.152 12.707 -92.359 1.00 3.06 H new ATOM 962 N LEU A 60 271.378 11.479 -91.349 1.00 1.81 N ATOM 963 CA LEU A 60 272.210 12.587 -90.782 1.00 1.93 C ATOM 964 C LEU A 60 273.593 12.618 -91.444 1.00 1.84 C ATOM 965 O LEU A 60 274.266 13.631 -91.438 1.00 1.93 O ATOM 966 CB LEU A 60 272.340 12.271 -89.290 1.00 2.10 C ATOM 967 CG LEU A 60 272.537 13.570 -88.508 1.00 2.14 C ATOM 968 CD1 LEU A 60 271.245 14.387 -88.539 1.00 2.67 C ATOM 969 CD2 LEU A 60 272.895 13.240 -87.057 1.00 2.46 C ATOM 0 H LEU A 60 271.063 10.785 -90.671 1.00 1.81 H new ATOM 0 HA LEU A 60 271.756 13.563 -90.955 1.00 1.93 H new ATOM 0 HB2 LEU A 60 271.447 11.754 -88.938 1.00 2.10 H new ATOM 0 HB3 LEU A 60 273.183 11.601 -89.122 1.00 2.10 H new ATOM 0 HG LEU A 60 273.342 14.148 -88.961 1.00 2.14 H new ATOM 0 HD11 LEU A 60 271.386 15.313 -87.981 1.00 2.67 H new ATOM 0 HD12 LEU A 60 270.987 14.621 -89.572 1.00 2.67 H new ATOM 0 HD13 LEU A 60 270.439 13.810 -88.086 1.00 2.67 H new ATOM 0 HD21 LEU A 60 273.036 14.165 -86.498 1.00 2.46 H new ATOM 0 HD22 LEU A 60 272.088 12.662 -86.606 1.00 2.46 H new ATOM 0 HD23 LEU A 60 273.816 12.658 -87.033 1.00 2.46 H new ATOM 981 N GLU A 61 274.026 11.515 -92.016 1.00 1.74 N ATOM 982 CA GLU A 61 275.370 11.471 -92.683 1.00 1.74 C ATOM 983 C GLU A 61 276.465 11.965 -91.728 1.00 1.95 C ATOM 984 O GLU A 61 277.422 12.594 -92.140 1.00 2.26 O ATOM 985 CB GLU A 61 275.255 12.402 -93.894 1.00 1.73 C ATOM 986 CG GLU A 61 274.601 11.651 -95.055 1.00 2.00 C ATOM 987 CD GLU A 61 274.527 12.566 -96.279 1.00 2.17 C ATOM 988 OE1 GLU A 61 273.708 13.469 -96.270 1.00 2.70 O ATOM 989 OE2 GLU A 61 275.292 12.347 -97.205 1.00 2.35 O ATOM 0 H GLU A 61 273.503 10.640 -92.049 1.00 1.74 H new ATOM 0 HA GLU A 61 275.642 10.457 -92.975 1.00 1.74 H new ATOM 0 HB2 GLU A 61 274.663 13.280 -93.636 1.00 1.73 H new ATOM 0 HB3 GLU A 61 276.243 12.758 -94.188 1.00 1.73 H new ATOM 0 HG2 GLU A 61 275.175 10.755 -95.292 1.00 2.00 H new ATOM 0 HG3 GLU A 61 273.601 11.323 -94.772 1.00 2.00 H new ATOM 996 N LEU A 62 276.326 11.682 -90.458 1.00 1.96 N ATOM 997 CA LEU A 62 277.353 12.132 -89.466 1.00 2.16 C ATOM 998 C LEU A 62 278.717 11.522 -89.804 1.00 2.13 C ATOM 999 O LEU A 62 278.829 10.670 -90.665 1.00 2.24 O ATOM 1000 CB LEU A 62 276.856 11.618 -88.111 1.00 2.27 C ATOM 1001 CG LEU A 62 277.092 12.685 -87.040 1.00 2.06 C ATOM 1002 CD1 LEU A 62 276.212 13.903 -87.329 1.00 2.43 C ATOM 1003 CD2 LEU A 62 276.733 12.114 -85.666 1.00 2.22 C ATOM 0 H LEU A 62 275.545 11.158 -90.063 1.00 1.96 H new ATOM 0 HA LEU A 62 277.479 13.215 -89.467 1.00 2.16 H new ATOM 0 HB2 LEU A 62 275.795 11.375 -88.170 1.00 2.27 H new ATOM 0 HB3 LEU A 62 277.379 10.699 -87.845 1.00 2.27 H new ATOM 0 HG LEU A 62 278.140 12.983 -87.050 1.00 2.06 H new ATOM 0 HD11 LEU A 62 276.380 14.663 -86.566 1.00 2.43 H new ATOM 0 HD12 LEU A 62 276.464 14.310 -88.308 1.00 2.43 H new ATOM 0 HD13 LEU A 62 275.164 13.605 -87.319 1.00 2.43 H new ATOM 0 HD21 LEU A 62 276.901 12.873 -84.902 1.00 2.22 H new ATOM 0 HD22 LEU A 62 275.684 11.816 -85.658 1.00 2.22 H new ATOM 0 HD23 LEU A 62 277.358 11.246 -85.458 1.00 2.22 H new ATOM 1015 N GLU A 63 279.752 11.955 -89.129 1.00 2.11 N ATOM 1016 CA GLU A 63 281.117 11.405 -89.403 1.00 2.16 C ATOM 1017 C GLU A 63 281.139 9.891 -89.166 1.00 2.01 C ATOM 1018 O GLU A 63 281.922 9.174 -89.758 1.00 2.08 O ATOM 1019 CB GLU A 63 282.045 12.114 -88.413 1.00 2.32 C ATOM 1020 CG GLU A 63 283.501 11.825 -88.781 1.00 2.79 C ATOM 1021 CD GLU A 63 284.428 12.551 -87.805 1.00 3.12 C ATOM 1022 OE1 GLU A 63 284.343 12.274 -86.620 1.00 3.43 O ATOM 1023 OE2 GLU A 63 285.208 13.373 -88.259 1.00 3.55 O ATOM 0 H GLU A 63 279.712 12.666 -88.399 1.00 2.11 H new ATOM 0 HA GLU A 63 281.423 11.570 -90.436 1.00 2.16 H new ATOM 0 HB2 GLU A 63 281.861 13.188 -88.431 1.00 2.32 H new ATOM 0 HB3 GLU A 63 281.841 11.772 -87.398 1.00 2.32 H new ATOM 0 HG2 GLU A 63 283.689 10.752 -88.748 1.00 2.79 H new ATOM 0 HG3 GLU A 63 283.701 12.153 -89.801 1.00 2.79 H new ATOM 1030 N SER A 64 280.283 9.405 -88.302 1.00 1.85 N ATOM 1031 CA SER A 64 280.245 7.939 -88.019 1.00 1.77 C ATOM 1032 C SER A 64 278.863 7.371 -88.358 1.00 1.62 C ATOM 1033 O SER A 64 278.204 6.777 -87.525 1.00 1.55 O ATOM 1034 CB SER A 64 280.525 7.821 -86.522 1.00 1.84 C ATOM 1035 OG SER A 64 281.930 7.759 -86.310 1.00 1.95 O ATOM 0 H SER A 64 279.607 9.963 -87.780 1.00 1.85 H new ATOM 0 HA SER A 64 280.969 7.382 -88.614 1.00 1.77 H new ATOM 0 HB2 SER A 64 280.103 8.676 -85.993 1.00 1.84 H new ATOM 0 HB3 SER A 64 280.045 6.929 -86.120 1.00 1.84 H new ATOM 0 HG SER A 64 282.113 7.685 -85.350 1.00 1.95 H new ATOM 1041 N GLU A 65 278.422 7.549 -89.579 1.00 1.64 N ATOM 1042 CA GLU A 65 277.079 7.022 -89.984 1.00 1.53 C ATOM 1043 C GLU A 65 277.005 5.504 -89.768 1.00 1.42 C ATOM 1044 O GLU A 65 275.933 4.943 -89.639 1.00 1.40 O ATOM 1045 CB GLU A 65 276.946 7.358 -91.471 1.00 1.59 C ATOM 1046 CG GLU A 65 275.560 6.942 -91.969 1.00 1.68 C ATOM 1047 CD GLU A 65 275.155 7.824 -93.152 1.00 1.98 C ATOM 1048 OE1 GLU A 65 276.031 8.193 -93.918 1.00 2.44 O ATOM 1049 OE2 GLU A 65 273.977 8.116 -93.271 1.00 2.43 O ATOM 0 H GLU A 65 278.934 8.037 -90.314 1.00 1.64 H new ATOM 0 HA GLU A 65 276.276 7.462 -89.393 1.00 1.53 H new ATOM 0 HB2 GLU A 65 277.094 8.426 -91.627 1.00 1.59 H new ATOM 0 HB3 GLU A 65 277.718 6.842 -92.041 1.00 1.59 H new ATOM 0 HG2 GLU A 65 275.570 5.894 -92.270 1.00 1.68 H new ATOM 0 HG3 GLU A 65 274.830 7.036 -91.165 1.00 1.68 H new ATOM 1056 N GLU A 66 278.134 4.838 -89.726 1.00 1.42 N ATOM 1057 CA GLU A 66 278.130 3.354 -89.516 1.00 1.38 C ATOM 1058 C GLU A 66 277.403 2.992 -88.212 1.00 1.36 C ATOM 1059 O GLU A 66 276.946 1.877 -88.040 1.00 1.33 O ATOM 1060 CB GLU A 66 279.606 2.956 -89.430 1.00 1.57 C ATOM 1061 CG GLU A 66 279.726 1.430 -89.453 1.00 1.98 C ATOM 1062 CD GLU A 66 281.106 1.019 -88.938 1.00 2.43 C ATOM 1063 OE1 GLU A 66 282.081 1.597 -89.388 1.00 2.91 O ATOM 1064 OE2 GLU A 66 281.165 0.131 -88.102 1.00 2.89 O ATOM 0 H GLU A 66 279.058 5.257 -89.828 1.00 1.42 H new ATOM 0 HA GLU A 66 277.611 2.834 -90.321 1.00 1.38 H new ATOM 0 HB2 GLU A 66 280.159 3.387 -90.264 1.00 1.57 H new ATOM 0 HB3 GLU A 66 280.048 3.352 -88.516 1.00 1.57 H new ATOM 0 HG2 GLU A 66 278.947 0.984 -88.834 1.00 1.98 H new ATOM 0 HG3 GLU A 66 279.579 1.058 -90.467 1.00 1.98 H new ATOM 1071 N GLU A 67 277.290 3.925 -87.299 1.00 1.44 N ATOM 1072 CA GLU A 67 276.589 3.638 -86.008 1.00 1.50 C ATOM 1073 C GLU A 67 275.110 3.300 -86.253 1.00 1.43 C ATOM 1074 O GLU A 67 274.452 2.723 -85.409 1.00 1.53 O ATOM 1075 CB GLU A 67 276.719 4.926 -85.180 1.00 1.62 C ATOM 1076 CG GLU A 67 276.018 6.092 -85.895 1.00 1.54 C ATOM 1077 CD GLU A 67 276.597 7.417 -85.397 1.00 2.14 C ATOM 1078 OE1 GLU A 67 276.879 7.510 -84.213 1.00 2.78 O ATOM 1079 OE2 GLU A 67 276.748 8.317 -86.207 1.00 2.59 O ATOM 0 H GLU A 67 277.653 4.874 -87.392 1.00 1.44 H new ATOM 0 HA GLU A 67 277.023 2.779 -85.496 1.00 1.50 H new ATOM 0 HB2 GLU A 67 276.280 4.778 -84.194 1.00 1.62 H new ATOM 0 HB3 GLU A 67 277.772 5.164 -85.028 1.00 1.62 H new ATOM 0 HG2 GLU A 67 276.154 6.006 -86.973 1.00 1.54 H new ATOM 0 HG3 GLU A 67 274.945 6.057 -85.705 1.00 1.54 H new ATOM 1086 N ARG A 68 274.581 3.672 -87.394 1.00 1.33 N ATOM 1087 CA ARG A 68 273.140 3.393 -87.689 1.00 1.32 C ATOM 1088 C ARG A 68 272.821 1.898 -87.552 1.00 1.26 C ATOM 1089 O ARG A 68 271.785 1.527 -87.029 1.00 1.36 O ATOM 1090 CB ARG A 68 272.918 3.865 -89.132 1.00 1.27 C ATOM 1091 CG ARG A 68 273.847 3.105 -90.085 1.00 1.20 C ATOM 1092 CD ARG A 68 274.038 3.916 -91.369 1.00 1.19 C ATOM 1093 NE ARG A 68 275.306 3.406 -91.963 1.00 1.62 N ATOM 1094 CZ ARG A 68 275.541 3.569 -93.236 1.00 1.96 C ATOM 1095 NH1 ARG A 68 274.671 3.159 -94.118 1.00 2.48 N ATOM 1096 NH2 ARG A 68 276.647 4.141 -93.627 1.00 2.59 N ATOM 0 H ARG A 68 275.086 4.158 -88.135 1.00 1.33 H new ATOM 0 HA ARG A 68 272.485 3.909 -86.987 1.00 1.32 H new ATOM 0 HB2 ARG A 68 271.879 3.704 -89.419 1.00 1.27 H new ATOM 0 HB3 ARG A 68 273.107 4.936 -89.205 1.00 1.27 H new ATOM 0 HG2 ARG A 68 274.811 2.929 -89.607 1.00 1.20 H new ATOM 0 HG3 ARG A 68 273.424 2.128 -90.319 1.00 1.20 H new ATOM 0 HD2 ARG A 68 273.199 3.778 -92.051 1.00 1.19 H new ATOM 0 HD3 ARG A 68 274.103 4.983 -91.156 1.00 1.19 H new ATOM 0 HE ARG A 68 275.990 2.930 -91.375 1.00 1.62 H new ATOM 0 HH11 ARG A 68 273.807 2.711 -93.812 1.00 2.48 H new ATOM 0 HH12 ARG A 68 274.855 3.287 -95.113 1.00 2.48 H new ATOM 0 HH21 ARG A 68 277.327 4.460 -92.937 1.00 2.59 H new ATOM 0 HH22 ARG A 68 276.831 4.269 -94.622 1.00 2.59 H new ATOM 1110 N SER A 69 273.695 1.042 -88.020 1.00 1.19 N ATOM 1111 CA SER A 69 273.433 -0.427 -87.922 1.00 1.20 C ATOM 1112 C SER A 69 273.620 -0.911 -86.482 1.00 1.35 C ATOM 1113 O SER A 69 272.836 -1.692 -85.977 1.00 1.41 O ATOM 1114 CB SER A 69 274.460 -1.082 -88.846 1.00 1.19 C ATOM 1115 OG SER A 69 274.448 -0.422 -90.105 1.00 1.65 O ATOM 0 H SER A 69 274.577 1.296 -88.465 1.00 1.19 H new ATOM 0 HA SER A 69 272.411 -0.678 -88.208 1.00 1.20 H new ATOM 0 HB2 SER A 69 275.454 -1.025 -88.402 1.00 1.19 H new ATOM 0 HB3 SER A 69 274.228 -2.139 -88.975 1.00 1.19 H new ATOM 0 HG SER A 69 275.107 -0.839 -90.699 1.00 1.65 H new ATOM 1121 N ARG A 70 274.651 -0.451 -85.819 1.00 1.46 N ATOM 1122 CA ARG A 70 274.891 -0.884 -84.406 1.00 1.63 C ATOM 1123 C ARG A 70 273.708 -0.473 -83.525 1.00 1.69 C ATOM 1124 O ARG A 70 273.285 -1.209 -82.652 1.00 1.76 O ATOM 1125 CB ARG A 70 276.163 -0.154 -83.969 1.00 1.74 C ATOM 1126 CG ARG A 70 276.806 -0.904 -82.800 1.00 1.98 C ATOM 1127 CD ARG A 70 276.068 -0.561 -81.504 1.00 2.26 C ATOM 1128 NE ARG A 70 277.048 -0.843 -80.419 1.00 2.44 N ATOM 1129 CZ ARG A 70 277.192 0.001 -79.434 1.00 2.84 C ATOM 1130 NH1 ARG A 70 276.287 0.068 -78.495 1.00 3.29 N ATOM 1131 NH2 ARG A 70 278.240 0.777 -79.387 1.00 3.39 N ATOM 0 H ARG A 70 275.337 0.205 -86.193 1.00 1.46 H new ATOM 0 HA ARG A 70 274.997 -1.965 -84.319 1.00 1.63 H new ATOM 0 HB2 ARG A 70 276.863 -0.090 -84.802 1.00 1.74 H new ATOM 0 HB3 ARG A 70 275.925 0.868 -83.673 1.00 1.74 H new ATOM 0 HG2 ARG A 70 276.768 -1.979 -82.979 1.00 1.98 H new ATOM 0 HG3 ARG A 70 277.858 -0.632 -82.715 1.00 1.98 H new ATOM 0 HD2 ARG A 70 275.755 0.483 -81.492 1.00 2.26 H new ATOM 0 HD3 ARG A 70 275.168 -1.165 -81.390 1.00 2.26 H new ATOM 0 HE ARG A 70 277.607 -1.696 -80.446 1.00 2.44 H new ATOM 0 HH11 ARG A 70 275.468 -0.539 -78.532 1.00 3.29 H new ATOM 0 HH12 ARG A 70 276.399 0.727 -77.725 1.00 3.29 H new ATOM 0 HH21 ARG A 70 278.947 0.724 -80.120 1.00 3.39 H new ATOM 0 HH22 ARG A 70 278.352 1.436 -78.617 1.00 3.39 H new ATOM 1145 N LYS A 71 273.173 0.700 -83.753 1.00 1.70 N ATOM 1146 CA LYS A 71 272.014 1.172 -82.936 1.00 1.82 C ATOM 1147 C LYS A 71 270.803 0.263 -83.161 1.00 1.76 C ATOM 1148 O LYS A 71 270.255 -0.289 -82.225 1.00 1.85 O ATOM 1149 CB LYS A 71 271.719 2.590 -83.428 1.00 1.86 C ATOM 1150 CG LYS A 71 272.734 3.562 -82.824 1.00 2.24 C ATOM 1151 CD LYS A 71 272.252 4.010 -81.443 1.00 2.31 C ATOM 1152 CE LYS A 71 273.065 5.225 -80.988 1.00 2.57 C ATOM 1153 NZ LYS A 71 272.538 5.554 -79.634 1.00 3.13 N ATOM 0 H LYS A 71 273.489 1.352 -84.471 1.00 1.70 H new ATOM 0 HA LYS A 71 272.233 1.154 -81.868 1.00 1.82 H new ATOM 0 HB2 LYS A 71 271.768 2.626 -84.516 1.00 1.86 H new ATOM 0 HB3 LYS A 71 270.708 2.881 -83.145 1.00 1.86 H new ATOM 0 HG2 LYS A 71 273.709 3.082 -82.742 1.00 2.24 H new ATOM 0 HG3 LYS A 71 272.858 4.427 -83.476 1.00 2.24 H new ATOM 0 HD2 LYS A 71 271.192 4.261 -81.480 1.00 2.31 H new ATOM 0 HD3 LYS A 71 272.362 3.196 -80.726 1.00 2.31 H new ATOM 0 HE2 LYS A 71 274.130 4.997 -80.953 1.00 2.57 H new ATOM 0 HE3 LYS A 71 272.941 6.063 -81.674 1.00 2.57 H new ATOM 0 HZ1 LYS A 71 273.046 6.378 -79.254 1.00 3.13 H new ATOM 0 HZ2 LYS A 71 271.524 5.773 -79.700 1.00 3.13 H new ATOM 0 HZ3 LYS A 71 272.676 4.741 -79.001 1.00 3.13 H new ATOM 1167 N ILE A 72 270.380 0.104 -84.393 1.00 1.63 N ATOM 1168 CA ILE A 72 269.197 -0.771 -84.671 1.00 1.60 C ATOM 1169 C ILE A 72 269.478 -2.204 -84.208 1.00 1.62 C ATOM 1170 O ILE A 72 268.584 -2.922 -83.801 1.00 1.72 O ATOM 1171 CB ILE A 72 268.988 -0.722 -86.189 1.00 1.48 C ATOM 1172 CG1 ILE A 72 270.237 -1.234 -86.918 1.00 1.41 C ATOM 1173 CG2 ILE A 72 268.705 0.720 -86.615 1.00 1.69 C ATOM 1174 CD1 ILE A 72 269.951 -1.314 -88.420 1.00 1.76 C ATOM 0 H ILE A 72 270.800 0.540 -85.214 1.00 1.63 H new ATOM 0 HA ILE A 72 268.309 -0.432 -84.138 1.00 1.60 H new ATOM 0 HB ILE A 72 268.143 -1.359 -86.450 1.00 1.48 H new ATOM 0 HG12 ILE A 72 271.079 -0.568 -86.732 1.00 1.41 H new ATOM 0 HG13 ILE A 72 270.517 -2.216 -86.537 1.00 1.41 H new ATOM 0 HG21 ILE A 72 268.556 0.758 -87.694 1.00 1.69 H new ATOM 0 HG22 ILE A 72 267.807 1.078 -86.112 1.00 1.69 H new ATOM 0 HG23 ILE A 72 269.550 1.352 -86.343 1.00 1.69 H new ATOM 0 HD11 ILE A 72 270.837 -1.678 -88.940 1.00 1.76 H new ATOM 0 HD12 ILE A 72 269.121 -1.998 -88.596 1.00 1.76 H new ATOM 0 HD13 ILE A 72 269.691 -0.324 -88.794 1.00 1.76 H new ATOM 1186 N GLN A 73 270.716 -2.619 -84.269 1.00 1.56 N ATOM 1187 CA GLN A 73 271.075 -4.007 -83.837 1.00 1.63 C ATOM 1188 C GLN A 73 270.659 -4.242 -82.381 1.00 1.79 C ATOM 1189 O GLN A 73 269.856 -5.108 -82.093 1.00 1.87 O ATOM 1190 CB GLN A 73 272.597 -4.092 -83.977 1.00 1.66 C ATOM 1191 CG GLN A 73 273.046 -5.544 -83.797 1.00 1.92 C ATOM 1192 CD GLN A 73 274.499 -5.690 -84.251 1.00 2.32 C ATOM 1193 OE1 GLN A 73 274.764 -6.187 -85.328 1.00 2.67 O ATOM 1194 NE2 GLN A 73 275.459 -5.274 -83.471 1.00 2.78 N ATOM 0 H GLN A 73 271.499 -2.056 -84.601 1.00 1.56 H new ATOM 0 HA GLN A 73 270.567 -4.762 -84.437 1.00 1.63 H new ATOM 0 HB2 GLN A 73 272.904 -3.724 -84.956 1.00 1.66 H new ATOM 0 HB3 GLN A 73 273.077 -3.457 -83.233 1.00 1.66 H new ATOM 0 HG2 GLN A 73 272.949 -5.839 -82.752 1.00 1.92 H new ATOM 0 HG3 GLN A 73 272.405 -6.208 -84.376 1.00 1.92 H new ATOM 0 HE21 GLN A 73 275.237 -4.857 -82.567 1.00 2.78 H new ATOM 0 HE22 GLN A 73 276.431 -5.366 -83.765 1.00 2.78 H new ATOM 1203 N GLY A 74 271.198 -3.475 -81.466 1.00 1.86 N ATOM 1204 CA GLY A 74 270.835 -3.650 -80.026 1.00 2.04 C ATOM 1205 C GLY A 74 269.368 -3.275 -79.818 1.00 2.07 C ATOM 1206 O GLY A 74 268.664 -3.904 -79.050 1.00 2.12 O ATOM 0 H GLY A 74 271.874 -2.735 -81.654 1.00 1.86 H new ATOM 0 HA2 GLY A 74 271.004 -4.683 -79.721 1.00 2.04 H new ATOM 0 HA3 GLY A 74 271.473 -3.025 -79.401 1.00 2.04 H new ATOM 1210 N LEU A 75 268.900 -2.257 -80.499 1.00 2.07 N ATOM 1211 CA LEU A 75 267.471 -1.840 -80.346 1.00 2.14 C ATOM 1212 C LEU A 75 266.542 -3.008 -80.687 1.00 2.01 C ATOM 1213 O LEU A 75 265.452 -3.122 -80.160 1.00 2.12 O ATOM 1214 CB LEU A 75 267.274 -0.692 -81.338 1.00 2.16 C ATOM 1215 CG LEU A 75 266.122 0.197 -80.867 1.00 2.39 C ATOM 1216 CD1 LEU A 75 266.613 1.123 -79.754 1.00 2.60 C ATOM 1217 CD2 LEU A 75 265.615 1.038 -82.041 1.00 2.79 C ATOM 0 H LEU A 75 269.446 -1.697 -81.154 1.00 2.07 H new ATOM 0 HA LEU A 75 267.241 -1.535 -79.325 1.00 2.14 H new ATOM 0 HB2 LEU A 75 268.190 -0.106 -81.419 1.00 2.16 H new ATOM 0 HB3 LEU A 75 267.060 -1.088 -82.331 1.00 2.16 H new ATOM 0 HG LEU A 75 265.313 -0.428 -80.489 1.00 2.39 H new ATOM 0 HD11 LEU A 75 265.792 1.756 -79.419 1.00 2.60 H new ATOM 0 HD12 LEU A 75 266.976 0.526 -78.917 1.00 2.60 H new ATOM 0 HD13 LEU A 75 267.422 1.748 -80.131 1.00 2.60 H new ATOM 0 HD21 LEU A 75 264.794 1.672 -81.707 1.00 2.79 H new ATOM 0 HD22 LEU A 75 266.425 1.662 -82.418 1.00 2.79 H new ATOM 0 HD23 LEU A 75 265.264 0.379 -82.836 1.00 2.79 H new ATOM 1229 N LEU A 76 266.977 -3.878 -81.563 1.00 1.81 N ATOM 1230 CA LEU A 76 266.136 -5.050 -81.945 1.00 1.68 C ATOM 1231 C LEU A 76 266.676 -6.331 -81.298 1.00 1.73 C ATOM 1232 O LEU A 76 265.969 -7.313 -81.177 1.00 1.78 O ATOM 1233 CB LEU A 76 266.235 -5.135 -83.469 1.00 1.49 C ATOM 1234 CG LEU A 76 265.003 -4.479 -84.100 1.00 1.32 C ATOM 1235 CD1 LEU A 76 265.329 -3.030 -84.473 1.00 1.51 C ATOM 1236 CD2 LEU A 76 264.601 -5.252 -85.358 1.00 1.40 C ATOM 0 H LEU A 76 267.882 -3.826 -82.031 1.00 1.81 H new ATOM 0 HA LEU A 76 265.105 -4.939 -81.610 1.00 1.68 H new ATOM 0 HB2 LEU A 76 267.141 -4.637 -83.813 1.00 1.49 H new ATOM 0 HB3 LEU A 76 266.305 -6.177 -83.782 1.00 1.49 H new ATOM 0 HG LEU A 76 264.179 -4.493 -83.386 1.00 1.32 H new ATOM 0 HD11 LEU A 76 264.452 -2.564 -84.922 1.00 1.51 H new ATOM 0 HD12 LEU A 76 265.614 -2.479 -83.577 1.00 1.51 H new ATOM 0 HD13 LEU A 76 266.153 -3.014 -85.186 1.00 1.51 H new ATOM 0 HD21 LEU A 76 263.724 -4.785 -85.807 1.00 1.40 H new ATOM 0 HD22 LEU A 76 265.425 -5.239 -86.072 1.00 1.40 H new ATOM 0 HD23 LEU A 76 264.367 -6.283 -85.092 1.00 1.40 H new ATOM 1248 N LYS A 77 267.924 -6.332 -80.876 1.00 1.74 N ATOM 1249 CA LYS A 77 268.507 -7.553 -80.232 1.00 1.82 C ATOM 1250 C LYS A 77 267.602 -8.038 -79.094 1.00 1.99 C ATOM 1251 O LYS A 77 267.547 -9.215 -78.789 1.00 2.04 O ATOM 1252 CB LYS A 77 269.865 -7.114 -79.679 1.00 1.90 C ATOM 1253 CG LYS A 77 270.738 -8.345 -79.431 1.00 2.41 C ATOM 1254 CD LYS A 77 271.679 -8.078 -78.254 1.00 2.52 C ATOM 1255 CE LYS A 77 271.057 -8.624 -76.966 1.00 2.69 C ATOM 1256 NZ LYS A 77 272.170 -8.635 -75.977 1.00 3.04 N ATOM 0 H LYS A 77 268.561 -5.539 -80.951 1.00 1.74 H new ATOM 0 HA LYS A 77 268.604 -8.377 -80.939 1.00 1.82 H new ATOM 0 HB2 LYS A 77 270.356 -6.443 -80.383 1.00 1.90 H new ATOM 0 HB3 LYS A 77 269.729 -6.559 -78.751 1.00 1.90 H new ATOM 0 HG2 LYS A 77 270.111 -9.211 -79.219 1.00 2.41 H new ATOM 0 HG3 LYS A 77 271.315 -8.580 -80.325 1.00 2.41 H new ATOM 0 HD2 LYS A 77 272.645 -8.551 -78.433 1.00 2.52 H new ATOM 0 HD3 LYS A 77 271.862 -7.008 -78.157 1.00 2.52 H new ATOM 0 HE2 LYS A 77 270.234 -7.995 -76.627 1.00 2.69 H new ATOM 0 HE3 LYS A 77 270.652 -9.625 -77.116 1.00 2.69 H new ATOM 0 HZ1 LYS A 77 271.822 -8.997 -75.067 1.00 3.04 H new ATOM 0 HZ2 LYS A 77 272.936 -9.247 -76.323 1.00 3.04 H new ATOM 0 HZ3 LYS A 77 272.531 -7.668 -75.849 1.00 3.04 H new ATOM 1270 N SER A 78 266.883 -7.133 -78.480 1.00 2.11 N ATOM 1271 CA SER A 78 265.964 -7.527 -77.373 1.00 2.30 C ATOM 1272 C SER A 78 264.765 -8.299 -77.941 1.00 2.23 C ATOM 1273 O SER A 78 264.146 -9.093 -77.258 1.00 2.33 O ATOM 1274 CB SER A 78 265.505 -6.213 -76.739 1.00 2.44 C ATOM 1275 OG SER A 78 266.492 -5.766 -75.819 1.00 2.71 O ATOM 0 H SER A 78 266.894 -6.137 -78.699 1.00 2.11 H new ATOM 0 HA SER A 78 266.450 -8.175 -76.644 1.00 2.30 H new ATOM 0 HB2 SER A 78 265.343 -5.460 -77.511 1.00 2.44 H new ATOM 0 HB3 SER A 78 264.553 -6.355 -76.228 1.00 2.44 H new ATOM 0 HG SER A 78 266.202 -4.923 -75.412 1.00 2.71 H new ATOM 1281 N CYS A 79 264.442 -8.072 -79.192 1.00 2.10 N ATOM 1282 CA CYS A 79 263.295 -8.789 -79.825 1.00 2.05 C ATOM 1283 C CYS A 79 263.795 -9.623 -81.006 1.00 1.86 C ATOM 1284 O CYS A 79 263.862 -10.836 -80.934 1.00 1.83 O ATOM 1285 CB CYS A 79 262.352 -7.685 -80.305 1.00 2.14 C ATOM 1286 SG CYS A 79 261.442 -7.012 -78.893 1.00 2.65 S ATOM 0 H CYS A 79 264.928 -7.416 -79.804 1.00 2.10 H new ATOM 0 HA CYS A 79 262.798 -9.472 -79.136 1.00 2.05 H new ATOM 0 HB2 CYS A 79 262.920 -6.894 -80.795 1.00 2.14 H new ATOM 0 HB3 CYS A 79 261.656 -8.082 -81.044 1.00 2.14 H new ATOM 0 HG CYS A 79 260.642 -6.072 -79.301 1.00 2.65 H new ATOM 1292 N THR A 80 264.154 -8.980 -82.089 1.00 1.74 N ATOM 1293 CA THR A 80 264.662 -9.733 -83.276 1.00 1.57 C ATOM 1294 C THR A 80 266.021 -10.354 -82.951 1.00 1.54 C ATOM 1295 O THR A 80 266.882 -9.713 -82.377 1.00 1.42 O ATOM 1296 CB THR A 80 264.803 -8.690 -84.391 1.00 1.45 C ATOM 1297 OG1 THR A 80 263.633 -7.886 -84.435 1.00 1.54 O ATOM 1298 CG2 THR A 80 264.992 -9.392 -85.741 1.00 1.26 C ATOM 0 H THR A 80 264.117 -7.967 -82.202 1.00 1.74 H new ATOM 0 HA THR A 80 263.994 -10.544 -83.567 1.00 1.57 H new ATOM 0 HB THR A 80 265.672 -8.063 -84.189 1.00 1.45 H new ATOM 0 HG1 THR A 80 263.214 -7.966 -85.317 1.00 1.54 H new ATOM 0 HG21 THR A 80 265.091 -8.645 -86.529 1.00 1.26 H new ATOM 0 HG22 THR A 80 265.891 -10.007 -85.708 1.00 1.26 H new ATOM 0 HG23 THR A 80 264.128 -10.023 -85.947 1.00 1.26 H new ATOM 1306 N ASN A 81 266.220 -11.596 -83.313 1.00 1.68 N ATOM 1307 CA ASN A 81 267.528 -12.269 -83.025 1.00 1.70 C ATOM 1308 C ASN A 81 268.693 -11.462 -83.629 1.00 1.60 C ATOM 1309 O ASN A 81 268.493 -10.703 -84.557 1.00 1.47 O ATOM 1310 CB ASN A 81 267.428 -13.651 -83.683 1.00 1.69 C ATOM 1311 CG ASN A 81 267.188 -13.505 -85.192 1.00 1.96 C ATOM 1312 OD1 ASN A 81 266.855 -12.439 -85.670 1.00 2.58 O ATOM 1313 ND2 ASN A 81 267.347 -14.543 -85.966 1.00 2.01 N ATOM 0 H ASN A 81 265.534 -12.176 -83.796 1.00 1.68 H new ATOM 0 HA ASN A 81 267.720 -12.345 -81.955 1.00 1.70 H new ATOM 0 HB2 ASN A 81 268.345 -14.213 -83.506 1.00 1.69 H new ATOM 0 HB3 ASN A 81 266.614 -14.219 -83.231 1.00 1.69 H new ATOM 0 HD21 ASN A 81 267.192 -14.459 -86.971 1.00 2.01 H new ATOM 0 HD22 ASN A 81 267.627 -15.439 -85.567 1.00 2.01 H new ATOM 1320 N PRO A 82 269.878 -11.648 -83.088 1.00 1.69 N ATOM 1321 CA PRO A 82 271.060 -10.913 -83.604 1.00 1.64 C ATOM 1322 C PRO A 82 271.457 -11.452 -84.980 1.00 1.51 C ATOM 1323 O PRO A 82 271.923 -12.569 -85.105 1.00 1.63 O ATOM 1324 CB PRO A 82 272.145 -11.200 -82.570 1.00 1.84 C ATOM 1325 CG PRO A 82 271.738 -12.488 -81.930 1.00 1.95 C ATOM 1326 CD PRO A 82 270.234 -12.539 -81.970 1.00 1.87 C ATOM 0 HA PRO A 82 270.880 -9.846 -83.734 1.00 1.64 H new ATOM 0 HB2 PRO A 82 273.125 -11.285 -83.039 1.00 1.84 H new ATOM 0 HB3 PRO A 82 272.212 -10.398 -81.835 1.00 1.84 H new ATOM 0 HG2 PRO A 82 272.168 -13.337 -82.462 1.00 1.95 H new ATOM 0 HG3 PRO A 82 272.099 -12.540 -80.903 1.00 1.95 H new ATOM 0 HD2 PRO A 82 269.873 -13.554 -82.138 1.00 1.87 H new ATOM 0 HD3 PRO A 82 269.798 -12.196 -81.032 1.00 1.87 H new ATOM 1334 N THR A 83 271.271 -10.667 -86.011 1.00 1.34 N ATOM 1335 CA THR A 83 271.631 -11.125 -87.379 1.00 1.26 C ATOM 1336 C THR A 83 272.107 -9.946 -88.232 1.00 1.18 C ATOM 1337 O THR A 83 271.331 -9.088 -88.617 1.00 1.03 O ATOM 1338 CB THR A 83 270.343 -11.719 -87.950 1.00 1.16 C ATOM 1339 OG1 THR A 83 269.292 -10.771 -87.830 1.00 1.76 O ATOM 1340 CG2 THR A 83 269.979 -12.989 -87.179 1.00 1.87 C ATOM 0 H THR A 83 270.883 -9.725 -85.959 1.00 1.34 H new ATOM 0 HA THR A 83 272.445 -11.850 -87.368 1.00 1.26 H new ATOM 0 HB THR A 83 270.491 -11.966 -89.001 1.00 1.16 H new ATOM 0 HG1 THR A 83 269.625 -9.881 -88.070 1.00 1.76 H new ATOM 0 HG21 THR A 83 269.061 -13.412 -87.587 1.00 1.87 H new ATOM 0 HG22 THR A 83 270.786 -13.716 -87.273 1.00 1.87 H new ATOM 0 HG23 THR A 83 269.831 -12.746 -86.127 1.00 1.87 H new ATOM 1348 N GLU A 84 273.381 -9.905 -88.535 1.00 1.31 N ATOM 1349 CA GLU A 84 273.923 -8.789 -89.372 1.00 1.29 C ATOM 1350 C GLU A 84 273.208 -8.751 -90.726 1.00 1.19 C ATOM 1351 O GLU A 84 273.095 -7.712 -91.347 1.00 1.14 O ATOM 1352 CB GLU A 84 275.408 -9.109 -89.561 1.00 1.52 C ATOM 1353 CG GLU A 84 276.130 -8.999 -88.216 1.00 1.93 C ATOM 1354 CD GLU A 84 277.390 -9.867 -88.241 1.00 2.49 C ATOM 1355 OE1 GLU A 84 277.259 -11.060 -88.460 1.00 3.10 O ATOM 1356 OE2 GLU A 84 278.464 -9.323 -88.041 1.00 2.84 O ATOM 0 H GLU A 84 274.070 -10.596 -88.239 1.00 1.31 H new ATOM 0 HA GLU A 84 273.775 -7.816 -88.903 1.00 1.29 H new ATOM 0 HB2 GLU A 84 275.525 -10.114 -89.968 1.00 1.52 H new ATOM 0 HB3 GLU A 84 275.851 -8.420 -90.281 1.00 1.52 H new ATOM 0 HG2 GLU A 84 276.395 -7.961 -88.017 1.00 1.93 H new ATOM 0 HG3 GLU A 84 275.470 -9.320 -87.410 1.00 1.93 H new ATOM 1363 N ASN A 85 272.722 -9.880 -91.182 1.00 1.21 N ATOM 1364 CA ASN A 85 272.008 -9.917 -92.495 1.00 1.16 C ATOM 1365 C ASN A 85 270.775 -9.012 -92.447 1.00 0.95 C ATOM 1366 O ASN A 85 270.582 -8.175 -93.305 1.00 0.91 O ATOM 1367 CB ASN A 85 271.596 -11.377 -92.694 1.00 1.27 C ATOM 1368 CG ASN A 85 272.839 -12.227 -92.967 1.00 1.81 C ATOM 1369 OD1 ASN A 85 273.542 -12.608 -92.052 1.00 2.31 O ATOM 1370 ND2 ASN A 85 273.142 -12.542 -94.197 1.00 2.36 N ATOM 0 H ASN A 85 272.789 -10.777 -90.701 1.00 1.21 H new ATOM 0 HA ASN A 85 272.635 -9.562 -93.313 1.00 1.16 H new ATOM 0 HB2 ASN A 85 271.079 -11.744 -91.807 1.00 1.27 H new ATOM 0 HB3 ASN A 85 270.897 -11.458 -93.527 1.00 1.27 H new ATOM 0 HD21 ASN A 85 273.969 -13.108 -94.390 1.00 2.36 H new ATOM 0 HD22 ASN A 85 272.552 -12.222 -94.965 1.00 2.36 H new ATOM 1377 N PHE A 86 269.946 -9.169 -91.446 1.00 0.86 N ATOM 1378 CA PHE A 86 268.725 -8.308 -91.337 1.00 0.71 C ATOM 1379 C PHE A 86 269.141 -6.838 -91.218 1.00 0.63 C ATOM 1380 O PHE A 86 268.641 -5.980 -91.923 1.00 0.58 O ATOM 1381 CB PHE A 86 268.016 -8.776 -90.057 1.00 0.77 C ATOM 1382 CG PHE A 86 266.508 -8.677 -90.207 1.00 0.73 C ATOM 1383 CD1 PHE A 86 265.872 -9.164 -91.358 1.00 1.39 C ATOM 1384 CD2 PHE A 86 265.743 -8.107 -89.180 1.00 1.42 C ATOM 1385 CE1 PHE A 86 264.480 -9.081 -91.480 1.00 1.43 C ATOM 1386 CE2 PHE A 86 264.350 -8.022 -89.305 1.00 1.44 C ATOM 1387 CZ PHE A 86 263.717 -8.510 -90.454 1.00 0.84 C ATOM 0 H PHE A 86 270.060 -9.855 -90.700 1.00 0.86 H new ATOM 0 HA PHE A 86 268.075 -8.391 -92.208 1.00 0.71 H new ATOM 0 HB2 PHE A 86 268.297 -9.806 -89.836 1.00 0.77 H new ATOM 0 HB3 PHE A 86 268.342 -8.169 -89.213 1.00 0.77 H new ATOM 0 HD1 PHE A 86 266.457 -9.604 -92.152 1.00 1.39 H new ATOM 0 HD2 PHE A 86 266.228 -7.733 -88.291 1.00 1.42 H new ATOM 0 HE1 PHE A 86 263.993 -9.458 -92.367 1.00 1.43 H new ATOM 0 HE2 PHE A 86 263.764 -7.579 -88.513 1.00 1.44 H new ATOM 0 HZ PHE A 86 262.643 -8.446 -90.549 1.00 0.84 H new ATOM 1397 N VAL A 87 270.064 -6.548 -90.336 1.00 0.69 N ATOM 1398 CA VAL A 87 270.528 -5.135 -90.168 1.00 0.67 C ATOM 1399 C VAL A 87 271.154 -4.631 -91.474 1.00 0.67 C ATOM 1400 O VAL A 87 270.845 -3.550 -91.946 1.00 0.64 O ATOM 1401 CB VAL A 87 271.580 -5.182 -89.049 1.00 0.82 C ATOM 1402 CG1 VAL A 87 272.117 -3.773 -88.779 1.00 0.94 C ATOM 1403 CG2 VAL A 87 270.950 -5.729 -87.763 1.00 0.87 C ATOM 0 H VAL A 87 270.517 -7.228 -89.725 1.00 0.69 H new ATOM 0 HA VAL A 87 269.709 -4.459 -89.921 1.00 0.67 H new ATOM 0 HB VAL A 87 272.396 -5.832 -89.363 1.00 0.82 H new ATOM 0 HG11 VAL A 87 272.862 -3.814 -87.985 1.00 0.94 H new ATOM 0 HG12 VAL A 87 272.575 -3.378 -89.686 1.00 0.94 H new ATOM 0 HG13 VAL A 87 271.297 -3.123 -88.474 1.00 0.94 H new ATOM 0 HG21 VAL A 87 271.702 -5.760 -86.974 1.00 0.87 H new ATOM 0 HG22 VAL A 87 270.128 -5.082 -87.457 1.00 0.87 H new ATOM 0 HG23 VAL A 87 270.572 -6.735 -87.943 1.00 0.87 H new ATOM 1413 N GLN A 88 272.040 -5.403 -92.050 1.00 0.80 N ATOM 1414 CA GLN A 88 272.704 -4.975 -93.315 1.00 0.90 C ATOM 1415 C GLN A 88 271.713 -4.961 -94.481 1.00 0.83 C ATOM 1416 O GLN A 88 271.637 -4.003 -95.221 1.00 0.84 O ATOM 1417 CB GLN A 88 273.805 -6.010 -93.566 1.00 1.11 C ATOM 1418 CG GLN A 88 274.941 -5.801 -92.562 1.00 1.60 C ATOM 1419 CD GLN A 88 276.126 -6.692 -92.941 1.00 2.03 C ATOM 1420 OE1 GLN A 88 276.631 -7.433 -92.121 1.00 2.63 O ATOM 1421 NE2 GLN A 88 276.595 -6.650 -94.158 1.00 2.37 N ATOM 0 H GLN A 88 272.332 -6.314 -91.696 1.00 0.80 H new ATOM 0 HA GLN A 88 273.101 -3.963 -93.233 1.00 0.90 H new ATOM 0 HB2 GLN A 88 273.401 -7.018 -93.469 1.00 1.11 H new ATOM 0 HB3 GLN A 88 274.183 -5.915 -94.584 1.00 1.11 H new ATOM 0 HG2 GLN A 88 275.246 -4.755 -92.555 1.00 1.60 H new ATOM 0 HG3 GLN A 88 274.599 -6.040 -91.555 1.00 1.60 H new ATOM 0 HE21 GLN A 88 276.171 -6.028 -94.847 1.00 2.37 H new ATOM 0 HE22 GLN A 88 277.385 -7.239 -94.421 1.00 2.37 H new ATOM 1430 N GLU A 89 270.958 -6.018 -94.657 1.00 0.80 N ATOM 1431 CA GLU A 89 269.977 -6.073 -95.793 1.00 0.80 C ATOM 1432 C GLU A 89 269.086 -4.831 -95.806 1.00 0.70 C ATOM 1433 O GLU A 89 268.675 -4.367 -96.851 1.00 0.80 O ATOM 1434 CB GLU A 89 269.136 -7.328 -95.546 1.00 0.79 C ATOM 1435 CG GLU A 89 269.941 -8.568 -95.940 1.00 1.02 C ATOM 1436 CD GLU A 89 269.270 -9.817 -95.364 1.00 1.37 C ATOM 1437 OE1 GLU A 89 268.796 -9.747 -94.242 1.00 2.01 O ATOM 1438 OE2 GLU A 89 269.241 -10.821 -96.056 1.00 1.93 O ATOM 0 H GLU A 89 270.977 -6.848 -94.064 1.00 0.80 H new ATOM 0 HA GLU A 89 270.485 -6.104 -96.757 1.00 0.80 H new ATOM 0 HB2 GLU A 89 268.850 -7.386 -94.496 1.00 0.79 H new ATOM 0 HB3 GLU A 89 268.214 -7.281 -96.126 1.00 0.79 H new ATOM 0 HG2 GLU A 89 270.004 -8.644 -97.026 1.00 1.02 H new ATOM 0 HG3 GLU A 89 270.962 -8.486 -95.567 1.00 1.02 H new ATOM 1445 N LEU A 90 268.795 -4.288 -94.655 1.00 0.57 N ATOM 1446 CA LEU A 90 267.937 -3.067 -94.602 1.00 0.59 C ATOM 1447 C LEU A 90 268.741 -1.847 -95.061 1.00 0.69 C ATOM 1448 O LEU A 90 268.429 -1.213 -96.060 1.00 0.82 O ATOM 1449 CB LEU A 90 267.536 -2.924 -93.128 1.00 0.57 C ATOM 1450 CG LEU A 90 266.107 -3.443 -92.906 1.00 0.57 C ATOM 1451 CD1 LEU A 90 265.120 -2.619 -93.738 1.00 0.79 C ATOM 1452 CD2 LEU A 90 266.019 -4.919 -93.316 1.00 0.53 C ATOM 0 H LEU A 90 269.113 -4.635 -93.750 1.00 0.57 H new ATOM 0 HA LEU A 90 267.066 -3.142 -95.252 1.00 0.59 H new ATOM 0 HB2 LEU A 90 268.233 -3.479 -92.500 1.00 0.57 H new ATOM 0 HB3 LEU A 90 267.600 -1.878 -92.827 1.00 0.57 H new ATOM 0 HG LEU A 90 265.855 -3.348 -91.850 1.00 0.57 H new ATOM 0 HD11 LEU A 90 264.108 -2.992 -93.577 1.00 0.79 H new ATOM 0 HD12 LEU A 90 265.174 -1.573 -93.436 1.00 0.79 H new ATOM 0 HD13 LEU A 90 265.374 -2.705 -94.794 1.00 0.79 H new ATOM 0 HD21 LEU A 90 265.003 -5.281 -93.156 1.00 0.53 H new ATOM 0 HD22 LEU A 90 266.279 -5.020 -94.370 1.00 0.53 H new ATOM 0 HD23 LEU A 90 266.712 -5.506 -92.714 1.00 0.53 H new ATOM 1464 N LEU A 91 269.777 -1.522 -94.334 1.00 0.70 N ATOM 1465 CA LEU A 91 270.618 -0.344 -94.704 1.00 0.82 C ATOM 1466 C LEU A 91 271.250 -0.547 -96.087 1.00 0.94 C ATOM 1467 O LEU A 91 271.568 0.407 -96.773 1.00 1.07 O ATOM 1468 CB LEU A 91 271.692 -0.263 -93.617 1.00 0.84 C ATOM 1469 CG LEU A 91 271.098 0.395 -92.359 1.00 0.86 C ATOM 1470 CD1 LEU A 91 271.508 -0.402 -91.118 1.00 0.97 C ATOM 1471 CD2 LEU A 91 271.621 1.829 -92.231 1.00 0.97 C ATOM 0 H LEU A 91 270.078 -2.022 -93.498 1.00 0.70 H new ATOM 0 HA LEU A 91 270.035 0.575 -94.764 1.00 0.82 H new ATOM 0 HB2 LEU A 91 272.060 -1.261 -93.379 1.00 0.84 H new ATOM 0 HB3 LEU A 91 272.544 0.315 -93.975 1.00 0.84 H new ATOM 0 HG LEU A 91 270.011 0.408 -92.443 1.00 0.86 H new ATOM 0 HD11 LEU A 91 271.086 0.066 -90.229 1.00 0.97 H new ATOM 0 HD12 LEU A 91 271.136 -1.423 -91.202 1.00 0.97 H new ATOM 0 HD13 LEU A 91 272.595 -0.418 -91.038 1.00 0.97 H new ATOM 0 HD21 LEU A 91 271.199 2.292 -91.339 1.00 0.97 H new ATOM 0 HD22 LEU A 91 272.708 1.814 -92.152 1.00 0.97 H new ATOM 0 HD23 LEU A 91 271.329 2.403 -93.111 1.00 0.97 H new ATOM 1483 N VAL A 92 271.426 -1.779 -96.506 1.00 0.93 N ATOM 1484 CA VAL A 92 272.029 -2.035 -97.851 1.00 1.09 C ATOM 1485 C VAL A 92 270.939 -1.964 -98.928 1.00 1.14 C ATOM 1486 O VAL A 92 271.184 -1.524-100.035 1.00 1.31 O ATOM 1487 CB VAL A 92 272.642 -3.441 -97.764 1.00 1.10 C ATOM 1488 CG1 VAL A 92 273.181 -3.869 -99.134 1.00 1.27 C ATOM 1489 CG2 VAL A 92 273.799 -3.424 -96.761 1.00 1.23 C ATOM 0 H VAL A 92 271.179 -2.614 -95.976 1.00 0.93 H new ATOM 0 HA VAL A 92 272.785 -1.297 -98.119 1.00 1.09 H new ATOM 0 HB VAL A 92 271.873 -4.144 -97.443 1.00 1.10 H new ATOM 0 HG11 VAL A 92 273.613 -4.867 -99.059 1.00 1.27 H new ATOM 0 HG12 VAL A 92 272.367 -3.879 -99.858 1.00 1.27 H new ATOM 0 HG13 VAL A 92 273.947 -3.165 -99.460 1.00 1.27 H new ATOM 0 HG21 VAL A 92 274.238 -4.419 -96.695 1.00 1.23 H new ATOM 0 HG22 VAL A 92 274.557 -2.714 -97.092 1.00 1.23 H new ATOM 0 HG23 VAL A 92 273.427 -3.126 -95.781 1.00 1.23 H new ATOM 1499 N LYS A 93 269.732 -2.378 -98.608 1.00 1.04 N ATOM 1500 CA LYS A 93 268.625 -2.313 -99.617 1.00 1.16 C ATOM 1501 C LYS A 93 268.435 -0.858-100.059 1.00 1.27 C ATOM 1502 O LYS A 93 268.181 -0.578-101.216 1.00 1.43 O ATOM 1503 CB LYS A 93 267.375 -2.840 -98.892 1.00 1.11 C ATOM 1504 CG LYS A 93 266.135 -2.672 -99.777 1.00 1.29 C ATOM 1505 CD LYS A 93 265.424 -1.368 -99.411 1.00 1.83 C ATOM 1506 CE LYS A 93 264.401 -1.634 -98.300 1.00 2.44 C ATOM 1507 NZ LYS A 93 265.077 -1.242 -97.028 1.00 3.04 N ATOM 0 H LYS A 93 269.468 -2.755 -97.698 1.00 1.04 H new ATOM 0 HA LYS A 93 268.832 -2.901-100.511 1.00 1.16 H new ATOM 0 HB2 LYS A 93 267.510 -3.892 -98.639 1.00 1.11 H new ATOM 0 HB3 LYS A 93 267.236 -2.302 -97.954 1.00 1.11 H new ATOM 0 HG2 LYS A 93 266.424 -2.659-100.828 1.00 1.29 H new ATOM 0 HG3 LYS A 93 265.461 -3.517 -99.642 1.00 1.29 H new ATOM 0 HD2 LYS A 93 266.151 -0.626 -99.080 1.00 1.83 H new ATOM 0 HD3 LYS A 93 264.925 -0.956-100.288 1.00 1.83 H new ATOM 0 HE2 LYS A 93 263.493 -1.052 -98.456 1.00 2.44 H new ATOM 0 HE3 LYS A 93 264.108 -2.684 -98.281 1.00 2.44 H new ATOM 0 HZ1 LYS A 93 264.397 -0.755 -96.410 1.00 3.04 H new ATOM 0 HZ2 LYS A 93 265.434 -2.093 -96.548 1.00 3.04 H new ATOM 0 HZ3 LYS A 93 265.871 -0.605 -97.239 1.00 3.04 H new ATOM 1521 N LEU A 94 268.571 0.067 -99.141 1.00 1.22 N ATOM 1522 CA LEU A 94 268.415 1.508 -99.503 1.00 1.38 C ATOM 1523 C LEU A 94 269.784 2.138 -99.772 1.00 1.52 C ATOM 1524 O LEU A 94 270.024 3.285 -99.443 1.00 1.95 O ATOM 1525 CB LEU A 94 267.757 2.158 -98.288 1.00 1.42 C ATOM 1526 CG LEU A 94 266.243 2.182 -98.485 1.00 1.49 C ATOM 1527 CD1 LEU A 94 265.552 2.132 -97.124 1.00 1.69 C ATOM 1528 CD2 LEU A 94 265.846 3.467 -99.214 1.00 1.73 C ATOM 0 H LEU A 94 268.783 -0.114 -98.160 1.00 1.22 H new ATOM 0 HA LEU A 94 267.820 1.641-100.407 1.00 1.38 H new ATOM 0 HB2 LEU A 94 268.009 1.604 -97.384 1.00 1.42 H new ATOM 0 HB3 LEU A 94 268.134 3.172 -98.155 1.00 1.42 H new ATOM 0 HG LEU A 94 265.938 1.319 -99.078 1.00 1.49 H new ATOM 0 HD11 LEU A 94 264.471 2.149 -97.264 1.00 1.69 H new ATOM 0 HD12 LEU A 94 265.836 1.217 -96.605 1.00 1.69 H new ATOM 0 HD13 LEU A 94 265.855 2.995 -96.530 1.00 1.69 H new ATOM 0 HD21 LEU A 94 264.765 3.486 -99.356 1.00 1.73 H new ATOM 0 HD22 LEU A 94 266.150 4.330 -98.621 1.00 1.73 H new ATOM 0 HD23 LEU A 94 266.340 3.502-100.185 1.00 1.73 H new ATOM 1540 N ARG A 95 270.680 1.395-100.370 1.00 1.46 N ATOM 1541 CA ARG A 95 272.038 1.942-100.669 1.00 1.63 C ATOM 1542 C ARG A 95 272.018 2.786-101.953 1.00 1.79 C ATOM 1543 O ARG A 95 273.002 3.414-102.297 1.00 2.00 O ATOM 1544 CB ARG A 95 272.927 0.712-100.854 1.00 1.80 C ATOM 1545 CG ARG A 95 274.389 1.149-100.963 1.00 2.00 C ATOM 1546 CD ARG A 95 275.302 -0.059-100.736 1.00 2.21 C ATOM 1547 NE ARG A 95 276.662 0.517-100.551 1.00 2.65 N ATOM 1548 CZ ARG A 95 277.327 0.283 -99.453 1.00 3.10 C ATOM 1549 NH1 ARG A 95 276.909 0.778 -98.320 1.00 3.62 N ATOM 1550 NH2 ARG A 95 278.408 -0.447 -99.487 1.00 3.57 N ATOM 0 H ARG A 95 270.529 0.430-100.665 1.00 1.46 H new ATOM 0 HA ARG A 95 272.396 2.595 -99.873 1.00 1.63 H new ATOM 0 HB2 ARG A 95 272.802 0.030-100.013 1.00 1.80 H new ATOM 0 HB3 ARG A 95 272.631 0.168-101.751 1.00 1.80 H new ATOM 0 HG2 ARG A 95 274.578 1.581-101.946 1.00 2.00 H new ATOM 0 HG3 ARG A 95 274.604 1.924-100.227 1.00 2.00 H new ATOM 0 HD2 ARG A 95 274.992 -0.629 -99.860 1.00 2.21 H new ATOM 0 HD3 ARG A 95 275.274 -0.740-101.586 1.00 2.21 H new ATOM 0 HE ARG A 95 277.074 1.095-101.283 1.00 2.65 H new ATOM 0 HH11 ARG A 95 276.063 1.347 -98.293 1.00 3.62 H new ATOM 0 HH12 ARG A 95 277.428 0.596 -97.461 1.00 3.62 H new ATOM 0 HH21 ARG A 95 278.734 -0.835-100.372 1.00 3.57 H new ATOM 0 HH22 ARG A 95 278.927 -0.630 -98.628 1.00 3.57 H new ATOM 1564 N GLY A 96 270.913 2.808-102.665 1.00 1.82 N ATOM 1565 CA GLY A 96 270.843 3.608-103.916 1.00 2.06 C ATOM 1566 C GLY A 96 270.141 4.935-103.632 1.00 1.96 C ATOM 1567 O GLY A 96 270.431 5.944-104.247 1.00 2.16 O ATOM 0 H GLY A 96 270.059 2.303-102.427 1.00 1.82 H new ATOM 0 HA2 GLY A 96 271.846 3.790-104.301 1.00 2.06 H new ATOM 0 HA3 GLY A 96 270.302 3.055-104.684 1.00 2.06 H new ATOM 1571 N LEU A 97 269.220 4.937-102.704 1.00 1.82 N ATOM 1572 CA LEU A 97 268.489 6.195-102.370 1.00 1.93 C ATOM 1573 C LEU A 97 269.067 6.814-101.095 1.00 1.85 C ATOM 1574 O LEU A 97 269.382 7.989-101.052 1.00 2.15 O ATOM 1575 CB LEU A 97 267.034 5.767-102.143 1.00 2.19 C ATOM 1576 CG LEU A 97 266.284 5.651-103.481 1.00 2.13 C ATOM 1577 CD1 LEU A 97 266.298 6.997-104.213 1.00 2.70 C ATOM 1578 CD2 LEU A 97 266.946 4.584-104.358 1.00 1.88 C ATOM 0 H LEU A 97 268.942 4.119-102.162 1.00 1.82 H new ATOM 0 HA LEU A 97 268.574 6.942-103.159 1.00 1.93 H new ATOM 0 HB2 LEU A 97 267.009 4.810-101.623 1.00 2.19 H new ATOM 0 HB3 LEU A 97 266.533 6.492-101.502 1.00 2.19 H new ATOM 0 HG LEU A 97 265.251 5.365-103.280 1.00 2.13 H new ATOM 0 HD11 LEU A 97 265.764 6.902-105.159 1.00 2.70 H new ATOM 0 HD12 LEU A 97 265.811 7.752-103.596 1.00 2.70 H new ATOM 0 HD13 LEU A 97 267.328 7.295-104.406 1.00 2.70 H new ATOM 0 HD21 LEU A 97 266.410 4.507-105.304 1.00 1.88 H new ATOM 0 HD22 LEU A 97 267.982 4.862-104.550 1.00 1.88 H new ATOM 0 HD23 LEU A 97 266.917 3.623-103.845 1.00 1.88 H new ATOM 1590 N HIS A 98 269.205 6.029-100.057 1.00 1.68 N ATOM 1591 CA HIS A 98 269.761 6.559 -98.777 1.00 1.72 C ATOM 1592 C HIS A 98 271.250 6.223 -98.668 1.00 1.64 C ATOM 1593 O HIS A 98 271.626 5.083 -98.476 1.00 1.95 O ATOM 1594 CB HIS A 98 268.969 5.848 -97.679 1.00 1.99 C ATOM 1595 CG HIS A 98 268.770 6.781 -96.517 1.00 2.61 C ATOM 1596 ND1 HIS A 98 267.691 6.668 -95.654 1.00 3.25 N ATOM 1597 CD2 HIS A 98 269.503 7.849 -96.062 1.00 3.27 C ATOM 1598 CE1 HIS A 98 267.804 7.643 -94.734 1.00 3.91 C ATOM 1599 NE2 HIS A 98 268.892 8.392 -94.936 1.00 3.97 N ATOM 0 H HIS A 98 268.955 5.040-100.042 1.00 1.68 H new ATOM 0 HA HIS A 98 269.675 7.643 -98.706 1.00 1.72 H new ATOM 0 HB2 HIS A 98 268.004 5.522 -98.066 1.00 1.99 H new ATOM 0 HB3 HIS A 98 269.501 4.954 -97.354 1.00 1.99 H new ATOM 0 HD1 HIS A 98 266.947 5.972 -95.707 1.00 3.25 H new ATOM 0 HD2 HIS A 98 270.416 8.213 -96.510 1.00 3.27 H new ATOM 0 HE1 HIS A 98 267.101 7.801 -93.930 1.00 3.91 H new ATOM 1607 N LYS A 99 272.104 7.213 -98.789 1.00 1.42 N ATOM 1608 CA LYS A 99 273.582 6.972 -98.695 1.00 1.54 C ATOM 1609 C LYS A 99 274.016 5.871 -99.671 1.00 1.85 C ATOM 1610 O LYS A 99 274.945 5.150 -99.345 1.00 2.24 O ATOM 1611 CB LYS A 99 273.834 6.538 -97.246 1.00 1.31 C ATOM 1612 CG LYS A 99 275.095 7.224 -96.714 1.00 1.35 C ATOM 1613 CD LYS A 99 276.325 6.651 -97.419 1.00 1.78 C ATOM 1614 CE LYS A 99 277.590 7.286 -96.836 1.00 2.02 C ATOM 1615 NZ LYS A 99 278.506 7.456 -97.999 1.00 2.64 N ATOM 1616 OXT LYS A 99 273.412 5.770-100.726 1.00 2.30 O ATOM 0 H LYS A 99 271.839 8.185 -98.950 1.00 1.42 H new ATOM 0 HA LYS A 99 274.153 7.863 -98.956 1.00 1.54 H new ATOM 0 HB2 LYS A 99 272.977 6.798 -96.624 1.00 1.31 H new ATOM 0 HB3 LYS A 99 273.948 5.455 -97.195 1.00 1.31 H new ATOM 0 HG2 LYS A 99 275.035 8.299 -96.882 1.00 1.35 H new ATOM 0 HG3 LYS A 99 275.177 7.073 -95.638 1.00 1.35 H new ATOM 0 HD2 LYS A 99 276.358 5.569 -97.294 1.00 1.78 H new ATOM 0 HD3 LYS A 99 276.268 6.846 -98.490 1.00 1.78 H new ATOM 0 HE2 LYS A 99 277.370 8.243 -96.364 1.00 2.02 H new ATOM 0 HE3 LYS A 99 278.036 6.649 -96.072 1.00 2.02 H new ATOM 0 HZ1 LYS A 99 279.397 7.887 -97.679 1.00 2.64 H new ATOM 0 HZ2 LYS A 99 278.703 6.528 -98.424 1.00 2.64 H new ATOM 0 HZ3 LYS A 99 278.058 8.073 -98.707 1.00 2.64 H new TER 1630 LYS A 99 END