Browse entries in the PDBbind-CN Database
HEADER OXIDOREDUCTASE/DNA 30-OCT-09 3KHC TITLE CRYSTAL STRUCTURE OF ESCHERICHIA COLI ALKB IN COMPLEX WITH SSDNA TITLE 2 CONTAINING A 1-METHYLGUANINE LESION COMPND MOL_ID: 1; COMPND 2 MOLECULE: ALPHA-KETOGLUTARATE-DEPENDENT DIOXYGENASE ALKB; COMPND 3 CHAIN: A, B; COMPND 4 SYNONYM: ALKYLATED DNA REPAIR PROTEIN ALKB; COMPND 5 EC: 1.14.11.-; COMPND 6 ENGINEERED: YES; COMPND 7 MUTATION: YES; COMPND 8 MOL_ID: 2; COMPND 9 MOLECULE: DNA (5'-D(P*TP*AP*(MG1)P*TP*GP*CP*CP*T)-3'); COMPND 10 CHAIN: C; COMPND 11 ENGINEERED: YES; COMPND 12 MOL_ID: 3; COMPND 13 MOLECULE: DNA (5'-D(P*GP*CP*AP*T)-3'); COMPND 14 CHAIN: D; COMPND 15 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI K-12; SOURCE 3 ORGANISM_TAXID: 83333; SOURCE 4 STRAIN: K12; SOURCE 5 GENE: AIDD, ALKB, B2212, JW2200; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: C41(DE3); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PET-19B; SOURCE 11 MOL_ID: 2; SOURCE 12 SYNTHETIC: YES; SOURCE 13 MOL_ID: 3; SOURCE 14 SYNTHETIC: YES KEYWDS OXIDOREDUCTASE, 1-METHYLGUANINE, ALKB, 2-OXOGLUTARATE, DIOXYGENASE, KEYWDS 2 DNA DAMAGE, DNA REPAIR, IRON, METAL-BINDING, OXIDOREDUCTASE-DNA KEYWDS 3 COMPLEX EXPDTA X-RAY DIFFRACTION AUTHOR T.HOLLIS,P.J.HOLLAND REVDAT 3 13-JUL-11 3KHC 1 VERSN REVDAT 2 02-FEB-10 3KHC 1 JRNL REVDAT 1 12-JAN-10 3KHC 0 JRNL AUTH P.J.HOLLAND,T.HOLLIS JRNL TITL STRUCTURAL AND MUTATIONAL ANALYSIS OF ESCHERICHIA COLI ALKB JRNL TITL 2 PROVIDES INSIGHT INTO SUBSTRATE SPECIFICITY AND DNA DAMAGE JRNL TITL 3 SEARCHING. JRNL REF PLOS ONE V. 5 E8680 2010 JRNL REFN ESSN 1932-6203 JRNL PMID 20084272 JRNL DOI 10.1371/JOURNAL.PONE.0008680 REMARK 2 REMARK 2 RESOLUTION. 2.20 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.5.0063 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.20 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 23.74 REMARK 3 DATA CUTOFF (SIGMA(F)) : NULL REMARK 3 COMPLETENESS FOR RANGE (%) : 99.7 REMARK 3 NUMBER OF REFLECTIONS : 21726 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : THROUGHOUT REMARK 3 FREE R VALUE TEST SET SELECTION : RANDOM REMARK 3 R VALUE (WORKING + TEST SET) : 0.214 REMARK 3 R VALUE (WORKING SET) : 0.211 REMARK 3 FREE R VALUE : 0.273 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.100 REMARK 3 FREE R VALUE TEST SET COUNT : 1156 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 20 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.20 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.26 REMARK 3 REFLECTION IN BIN (WORKING SET) : 1587 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 99.94 REMARK 3 BIN R VALUE (WORKING SET) : 0.2410 REMARK 3 BIN FREE R VALUE SET COUNT : 74 REMARK 3 BIN FREE R VALUE : 0.2890 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 3243 REMARK 3 NUCLEIC ACID ATOMS : 246 REMARK 3 HETEROGEN ATOMS : 22 REMARK 3 SOLVENT ATOMS : 269 REMARK 3 REMARK 3 B VALUES. REMARK 3 B VALUE TYPE : LIKELY RESIDUAL REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 18.16 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : -0.19000 REMARK 3 B22 (A**2) : -0.13000 REMARK 3 B33 (A**2) : 0.48000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.15000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.372 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.258 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.191 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 15.380 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.945 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.900 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 3712 ; 0.009 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 5112 ; 1.619 ; 2.048 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 431 ; 6.632 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 159 ;34.975 ;22.956 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 535 ;16.879 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 28 ;17.682 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 543 ; 0.087 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 2834 ; 0.005 ; 0.021 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) OTHERS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 POTENTIAL METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION REFINED ATOMS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY METAL-ION OTHERS (A): NULL ; NULL ; NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 MAIN-CHAIN BOND REFINED ATOMS (A**2): 2099 ; 0.396 ; 1.500 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 3385 ; 0.734 ; 2.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 1613 ; 1.191 ; 3.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 1717 ; 1.998 ; 4.500 REMARK 3 REMARK 3 ANISOTROPIC THERMAL FACTOR RESTRAINTS. COUNT RMS WEIGHT REMARK 3 RIGID-BOND RESTRAINTS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; FREE ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 SPHERICITY; BONDED ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 REMARK 3 NCS RESTRAINTS STATISTICS REMARK 3 NUMBER OF DIFFERENT NCS GROUPS : NULL REMARK 3 REMARK 3 TLS DETAILS REMARK 3 NUMBER OF TLS GROUPS : 40 REMARK 3 REMARK 3 TLS GROUP : 1 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 11 A 15 REMARK 3 ORIGIN FOR THE GROUP (A): -40.2570 18.6820 14.5010 REMARK 3 T TENSOR REMARK 3 T11: 0.3343 T22: 0.3221 REMARK 3 T33: 0.3072 T12: -0.0572 REMARK 3 T13: 0.0358 T23: -0.0407 REMARK 3 L TENSOR REMARK 3 L11: 10.6820 L22: 1.4566 REMARK 3 L33: 6.1669 L12: -1.1389 REMARK 3 L13: -4.8227 L23: -1.7070 REMARK 3 S TENSOR REMARK 3 S11: 0.0497 S12: 0.1327 S13: -0.2301 REMARK 3 S21: 0.0594 S22: 0.3328 S23: 0.4376 REMARK 3 S31: 0.0273 S32: -0.8567 S33: -0.3824 REMARK 3 REMARK 3 TLS GROUP : 2 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 16 A 28 REMARK 3 ORIGIN FOR THE GROUP (A): -36.5770 14.3460 17.6030 REMARK 3 T TENSOR REMARK 3 T11: 0.2489 T22: 0.3644 REMARK 3 T33: 0.1795 T12: -0.0504 REMARK 3 T13: -0.0349 T23: 0.0052 REMARK 3 L TENSOR REMARK 3 L11: 3.1324 L22: 2.8026 REMARK 3 L33: 4.1576 L12: 0.5741 REMARK 3 L13: -0.9879 L23: -2.1552 REMARK 3 S TENSOR REMARK 3 S11: 0.1604 S12: -0.0062 S13: -0.1649 REMARK 3 S21: -0.2505 S22: 0.2478 S23: 0.6028 REMARK 3 S31: 0.3536 S32: -0.7088 S33: -0.4082 REMARK 3 REMARK 3 TLS GROUP : 3 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 29 A 45 REMARK 3 ORIGIN FOR THE GROUP (A): -22.6420 4.0000 28.7280 REMARK 3 T TENSOR REMARK 3 T11: 0.4015 T22: 0.1481 REMARK 3 T33: 0.0970 T12: -0.0253 REMARK 3 T13: -0.0367 T23: 0.0346 REMARK 3 L TENSOR REMARK 3 L11: 9.5131 L22: 5.3896 REMARK 3 L33: 1.1230 L12: -1.4656 REMARK 3 L13: 1.4239 L23: 0.6178 REMARK 3 S TENSOR REMARK 3 S11: 0.1438 S12: -0.5547 S13: -0.9260 REMARK 3 S21: 0.2374 S22: 0.0214 S23: 0.2366 REMARK 3 S31: 0.6101 S32: -0.0999 S33: -0.1652 REMARK 3 REMARK 3 TLS GROUP : 4 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 46 A 54 REMARK 3 ORIGIN FOR THE GROUP (A): -9.7760 19.5560 25.1650 REMARK 3 T TENSOR REMARK 3 T11: 0.2727 T22: 0.1980 REMARK 3 T33: 0.0907 T12: -0.0171 REMARK 3 T13: 0.0406 T23: -0.0121 REMARK 3 L TENSOR REMARK 3 L11: 2.8764 L22: 8.6712 REMARK 3 L33: 2.1413 L12: 0.3122 REMARK 3 L13: -0.0137 L23: -1.1689 REMARK 3 S TENSOR REMARK 3 S11: 0.0846 S12: -0.1853 S13: 0.3760 REMARK 3 S21: -0.3540 S22: -0.1445 S23: -0.4078 REMARK 3 S31: -0.4144 S32: 0.4363 S33: 0.0599 REMARK 3 REMARK 3 TLS GROUP : 5 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 55 A 66 REMARK 3 ORIGIN FOR THE GROUP (A): -14.0230 16.2590 23.2890 REMARK 3 T TENSOR REMARK 3 T11: 0.2150 T22: 0.1991 REMARK 3 T33: 0.0472 T12: 0.0025 REMARK 3 T13: 0.0394 T23: 0.0274 REMARK 3 L TENSOR REMARK 3 L11: 3.5798 L22: 7.2002 REMARK 3 L33: 5.9530 L12: 0.6020 REMARK 3 L13: 1.9448 L23: 5.3672 REMARK 3 S TENSOR REMARK 3 S11: -0.0992 S12: 0.0748 S13: 0.2062 REMARK 3 S21: -0.5531 S22: 0.1115 S23: -0.3067 REMARK 3 S31: -0.3789 S32: 0.4461 S33: -0.0123 REMARK 3 REMARK 3 TLS GROUP : 6 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 67 A 71 REMARK 3 ORIGIN FOR THE GROUP (A): -11.6210 13.8850 17.3110 REMARK 3 T TENSOR REMARK 3 T11: 0.3151 T22: 0.1911 REMARK 3 T33: 0.2630 T12: 0.1052 REMARK 3 T13: 0.0111 T23: -0.0424 REMARK 3 L TENSOR REMARK 3 L11: 5.1959 L22: 1.8389 REMARK 3 L33: 3.1154 L12: 2.7775 REMARK 3 L13: 2.4359 L23: 2.1293 REMARK 3 S TENSOR REMARK 3 S11: 0.0573 S12: -0.0831 S13: 0.2331 REMARK 3 S21: 0.0730 S22: -0.0073 S23: 0.0140 REMARK 3 S31: 0.1071 S32: -0.0183 S33: -0.0501 REMARK 3 REMARK 3 TLS GROUP : 7 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 72 A 78 REMARK 3 ORIGIN FOR THE GROUP (A): -6.4920 18.0910 16.4120 REMARK 3 T TENSOR REMARK 3 T11: 0.2345 T22: 0.2568 REMARK 3 T33: 0.2145 T12: 0.0014 REMARK 3 T13: 0.0953 T23: -0.0057 REMARK 3 L TENSOR REMARK 3 L11: 9.3907 L22: 7.3961 REMARK 3 L33: 4.6726 L12: -1.2717 REMARK 3 L13: -2.9674 L23: -0.7585 REMARK 3 S TENSOR REMARK 3 S11: 0.4795 S12: 0.3324 S13: 0.9532 REMARK 3 S21: 0.2552 S22: -0.2939 S23: -0.6966 REMARK 3 S31: -0.3814 S32: 0.5595 S33: -0.1856 REMARK 3 REMARK 3 TLS GROUP : 8 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 79 A 85 REMARK 3 ORIGIN FOR THE GROUP (A): -6.5750 7.3910 21.2870 REMARK 3 T TENSOR REMARK 3 T11: 0.1633 T22: 0.1240 REMARK 3 T33: 0.1495 T12: 0.0342 REMARK 3 T13: 0.0090 T23: -0.0102 REMARK 3 L TENSOR REMARK 3 L11: 4.3903 L22: 0.8837 REMARK 3 L33: 11.2251 L12: -0.2546 REMARK 3 L13: -1.3594 L23: 0.1719 REMARK 3 S TENSOR REMARK 3 S11: -0.0173 S12: -0.0324 S13: -0.1502 REMARK 3 S21: -0.0481 S22: -0.0252 S23: -0.1171 REMARK 3 S31: -0.1785 S32: -0.0410 S33: 0.0425 REMARK 3 REMARK 3 TLS GROUP : 9 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 86 A 93 REMARK 3 ORIGIN FOR THE GROUP (A): -12.2900 2.7570 21.1590 REMARK 3 T TENSOR REMARK 3 T11: 0.4311 T22: 0.1344 REMARK 3 T33: 0.3289 T12: 0.0369 REMARK 3 T13: -0.0907 T23: -0.0574 REMARK 3 L TENSOR REMARK 3 L11: 7.9900 L22: 0.7587 REMARK 3 L33: 2.8538 L12: 2.3264 REMARK 3 L13: -2.4046 L23: -0.4739 REMARK 3 S TENSOR REMARK 3 S11: 0.2824 S12: 0.1116 S13: -0.5208 REMARK 3 S21: 0.2521 S22: 0.0083 S23: -0.1480 REMARK 3 S31: 0.6363 S32: 0.0576 S33: -0.2907 REMARK 3 REMARK 3 TLS GROUP : 10 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 94 A 102 REMARK 3 ORIGIN FOR THE GROUP (A): -28.7320 2.6740 17.0070 REMARK 3 T TENSOR REMARK 3 T11: 0.3381 T22: 0.1412 REMARK 3 T33: 0.1910 T12: -0.0671 REMARK 3 T13: -0.0181 T23: -0.0920 REMARK 3 L TENSOR REMARK 3 L11: 5.8710 L22: 0.1321 REMARK 3 L33: 8.8489 L12: -0.2204 REMARK 3 L13: 1.9144 L23: -1.0762 REMARK 3 S TENSOR REMARK 3 S11: -0.0427 S12: 0.2429 S13: -0.7246 REMARK 3 S21: -0.1073 S22: 0.0886 S23: 0.0003 REMARK 3 S31: 0.8103 S32: -0.6372 S33: -0.0459 REMARK 3 REMARK 3 TLS GROUP : 11 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 103 A 112 REMARK 3 ORIGIN FOR THE GROUP (A): -31.5980 8.6860 7.6970 REMARK 3 T TENSOR REMARK 3 T11: 0.2711 T22: 0.3203 REMARK 3 T33: 0.0775 T12: -0.0218 REMARK 3 T13: -0.0547 T23: -0.1114 REMARK 3 L TENSOR REMARK 3 L11: 7.7775 L22: 1.0850 REMARK 3 L33: 5.2155 L12: 0.2122 REMARK 3 L13: -0.9929 L23: -2.3705 REMARK 3 S TENSOR REMARK 3 S11: 0.1195 S12: 0.3979 S13: -0.4226 REMARK 3 S21: -0.2331 S22: 0.1167 S23: 0.1186 REMARK 3 S31: 0.4962 S32: -0.2839 S33: -0.2361 REMARK 3 REMARK 3 TLS GROUP : 12 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 113 A 127 REMARK 3 ORIGIN FOR THE GROUP (A): -20.8190 14.9870 22.8780 REMARK 3 T TENSOR REMARK 3 T11: 0.2687 T22: 0.2003 REMARK 3 T33: 0.1024 T12: 0.0375 REMARK 3 T13: 0.0136 T23: -0.0336 REMARK 3 L TENSOR REMARK 3 L11: 2.2923 L22: 0.3705 REMARK 3 L33: 2.4348 L12: -0.5546 REMARK 3 L13: 0.9951 L23: -0.2870 REMARK 3 S TENSOR REMARK 3 S11: -0.0166 S12: -0.0306 S13: -0.1184 REMARK 3 S21: 0.1431 S22: 0.1285 S23: -0.0457 REMARK 3 S31: 0.3292 S32: 0.1557 S33: -0.1119 REMARK 3 REMARK 3 TLS GROUP : 13 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 128 A 154 REMARK 3 ORIGIN FOR THE GROUP (A): -23.4980 18.6500 14.9260 REMARK 3 T TENSOR REMARK 3 T11: 0.1744 T22: 0.2066 REMARK 3 T33: 0.0233 T12: 0.0114 REMARK 3 T13: 0.0195 T23: -0.0107 REMARK 3 L TENSOR REMARK 3 L11: 0.5606 L22: 1.4784 REMARK 3 L33: 2.2196 L12: -0.4035 REMARK 3 L13: 0.6433 L23: 0.2742 REMARK 3 S TENSOR REMARK 3 S11: 0.0166 S12: 0.1035 S13: 0.0444 REMARK 3 S21: -0.1092 S22: -0.0304 S23: -0.0787 REMARK 3 S31: -0.0952 S32: -0.0260 S33: 0.0138 REMARK 3 REMARK 3 TLS GROUP : 14 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 155 A 160 REMARK 3 ORIGIN FOR THE GROUP (A): -26.1100 28.6880 10.6530 REMARK 3 T TENSOR REMARK 3 T11: 0.3278 T22: 0.2285 REMARK 3 T33: 0.1690 T12: 0.0395 REMARK 3 T13: -0.0791 T23: -0.0599 REMARK 3 L TENSOR REMARK 3 L11: 5.8882 L22: 3.3059 REMARK 3 L33: 8.2188 L12: -2.0073 REMARK 3 L13: -5.5272 L23: 0.0403 REMARK 3 S TENSOR REMARK 3 S11: 0.0646 S12: -0.0045 S13: 0.1556 REMARK 3 S21: -0.3806 S22: -0.2283 S23: 0.1202 REMARK 3 S31: -0.3226 S32: -0.0283 S33: 0.1637 REMARK 3 REMARK 3 TLS GROUP : 15 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 161 A 169 REMARK 3 ORIGIN FOR THE GROUP (A): -29.0150 30.9930 15.0960 REMARK 3 T TENSOR REMARK 3 T11: 0.4186 T22: 0.2663 REMARK 3 T33: 0.4078 T12: 0.1095 REMARK 3 T13: 0.1065 T23: 0.0015 REMARK 3 L TENSOR REMARK 3 L11: 0.4457 L22: 8.1849 REMARK 3 L33: 8.7013 L12: -1.8935 REMARK 3 L13: 1.0675 L23: -4.8246 REMARK 3 S TENSOR REMARK 3 S11: 0.0278 S12: -0.0634 S13: 0.0578 REMARK 3 S21: 0.0592 S22: 0.3468 S23: -0.0299 REMARK 3 S31: -0.9416 S32: -0.6864 S33: -0.3746 REMARK 3 REMARK 3 TLS GROUP : 16 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 170 A 181 REMARK 3 ORIGIN FOR THE GROUP (A): -31.6400 17.3750 16.3290 REMARK 3 T TENSOR REMARK 3 T11: 0.2264 T22: 0.2426 REMARK 3 T33: 0.1441 T12: 0.0374 REMARK 3 T13: -0.0108 T23: -0.0570 REMARK 3 L TENSOR REMARK 3 L11: 2.4338 L22: 2.5095 REMARK 3 L33: 8.0274 L12: 1.8397 REMARK 3 L13: -2.4635 L23: -1.1735 REMARK 3 S TENSOR REMARK 3 S11: 0.0848 S12: 0.2379 S13: -0.2981 REMARK 3 S21: -0.0931 S22: -0.0995 S23: 0.0245 REMARK 3 S31: -0.1853 S32: -0.4334 S33: 0.0147 REMARK 3 REMARK 3 TLS GROUP : 17 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 182 A 189 REMARK 3 ORIGIN FOR THE GROUP (A): -24.0580 23.8190 11.2480 REMARK 3 T TENSOR REMARK 3 T11: 0.2452 T22: 0.2991 REMARK 3 T33: 0.0859 T12: 0.0086 REMARK 3 T13: 0.0227 T23: 0.0367 REMARK 3 L TENSOR REMARK 3 L11: 2.6654 L22: 1.6632 REMARK 3 L33: 0.6909 L12: -2.0860 REMARK 3 L13: -1.1621 L23: 0.8347 REMARK 3 S TENSOR REMARK 3 S11: 0.1842 S12: 0.2831 S13: -0.0461 REMARK 3 S21: -0.1236 S22: -0.2848 S23: 0.0060 REMARK 3 S31: -0.1169 S32: 0.0484 S33: 0.1006 REMARK 3 REMARK 3 TLS GROUP : 18 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 190 A 200 REMARK 3 ORIGIN FOR THE GROUP (A): -29.8530 19.4290 33.2920 REMARK 3 T TENSOR REMARK 3 T11: 0.2279 T22: 0.2148 REMARK 3 T33: 0.0674 T12: 0.0066 REMARK 3 T13: 0.0003 T23: -0.0159 REMARK 3 L TENSOR REMARK 3 L11: 8.6480 L22: 6.3937 REMARK 3 L33: 1.7562 L12: 3.6303 REMARK 3 L13: -1.8300 L23: -0.3659 REMARK 3 S TENSOR REMARK 3 S11: 0.2431 S12: -0.2150 S13: 0.0939 REMARK 3 S21: 0.2213 S22: -0.1668 S23: 0.5528 REMARK 3 S31: -0.0458 S32: -0.2313 S33: -0.0763 REMARK 3 REMARK 3 TLS GROUP : 19 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 201 A 210 REMARK 3 ORIGIN FOR THE GROUP (A): -24.4870 14.0570 25.3240 REMARK 3 T TENSOR REMARK 3 T11: 0.1731 T22: 0.1594 REMARK 3 T33: 0.0692 T12: -0.0122 REMARK 3 T13: 0.0256 T23: 0.0314 REMARK 3 L TENSOR REMARK 3 L11: 2.3266 L22: 2.1695 REMARK 3 L33: 6.1351 L12: 0.0297 REMARK 3 L13: -0.5814 L23: 0.8575 REMARK 3 S TENSOR REMARK 3 S11: 0.0508 S12: 0.0078 S13: -0.0915 REMARK 3 S21: -0.1425 S22: 0.0587 S23: -0.1059 REMARK 3 S31: -0.1388 S32: 0.5563 S33: -0.1095 REMARK 3 REMARK 3 TLS GROUP : 20 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : A 211 A 216 REMARK 3 ORIGIN FOR THE GROUP (A): -17.3780 6.1980 4.7400 REMARK 3 T TENSOR REMARK 3 T11: 0.4662 T22: 0.3154 REMARK 3 T33: 0.3137 T12: 0.1540 REMARK 3 T13: 0.0881 T23: -0.0220 REMARK 3 L TENSOR REMARK 3 L11: 6.2429 L22: 8.6340 REMARK 3 L33: 0.6498 L12: 3.5620 REMARK 3 L13: 0.6141 L23: 1.4886 REMARK 3 S TENSOR REMARK 3 S11: -0.2942 S12: 0.4213 S13: -0.7728 REMARK 3 S21: -0.1855 S22: 0.0765 S23: -0.1199 REMARK 3 S31: 0.2525 S32: 0.1868 S33: 0.2177 REMARK 3 REMARK 3 TLS GROUP : 21 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 9 B 18 REMARK 3 ORIGIN FOR THE GROUP (A): -34.0500 7.7410 -18.2860 REMARK 3 T TENSOR REMARK 3 T11: 0.1871 T22: 0.2123 REMARK 3 T33: 0.0679 T12: -0.0535 REMARK 3 T13: 0.0745 T23: -0.0300 REMARK 3 L TENSOR REMARK 3 L11: 4.3047 L22: 1.2386 REMARK 3 L33: 9.3440 L12: 0.7634 REMARK 3 L13: 3.9943 L23: 1.7568 REMARK 3 S TENSOR REMARK 3 S11: -0.1697 S12: -0.1226 S13: 0.2961 REMARK 3 S21: 0.0714 S22: -0.0527 S23: 0.0320 REMARK 3 S31: -0.2249 S32: -0.6050 S33: 0.2224 REMARK 3 REMARK 3 TLS GROUP : 22 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 19 B 23 REMARK 3 ORIGIN FOR THE GROUP (A): -30.8610 8.8230 -18.1070 REMARK 3 T TENSOR REMARK 3 T11: 0.3195 T22: 0.2824 REMARK 3 T33: 0.1426 T12: -0.0426 REMARK 3 T13: 0.0282 T23: -0.0397 REMARK 3 L TENSOR REMARK 3 L11: 6.2586 L22: 2.9780 REMARK 3 L33: 0.1754 L12: -3.0558 REMARK 3 L13: 0.3388 L23: -0.6482 REMARK 3 S TENSOR REMARK 3 S11: 0.1563 S12: 0.0154 S13: -0.6172 REMARK 3 S21: 0.0736 S22: 0.0035 S23: 0.6345 REMARK 3 S31: -0.0425 S32: 0.0000 S33: -0.1598 REMARK 3 REMARK 3 TLS GROUP : 23 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 24 B 36 REMARK 3 ORIGIN FOR THE GROUP (A): -27.2600 20.6380 -28.6840 REMARK 3 T TENSOR REMARK 3 T11: 0.3085 T22: 0.5714 REMARK 3 T33: 0.1791 T12: -0.0422 REMARK 3 T13: -0.0312 T23: 0.1362 REMARK 3 L TENSOR REMARK 3 L11: 1.5159 L22: 1.1272 REMARK 3 L33: 4.8355 L12: -1.0220 REMARK 3 L13: -0.7104 L23: 1.8764 REMARK 3 S TENSOR REMARK 3 S11: 0.1600 S12: 0.6431 S13: 0.3277 REMARK 3 S21: -0.3080 S22: -0.3575 S23: -0.0941 REMARK 3 S31: -0.6276 S32: -0.0469 S33: 0.1975 REMARK 3 REMARK 3 TLS GROUP : 24 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 37 B 45 REMARK 3 ORIGIN FOR THE GROUP (A): -12.4330 26.8660 -27.2560 REMARK 3 T TENSOR REMARK 3 T11: 0.3207 T22: 0.2212 REMARK 3 T33: 0.3578 T12: -0.1002 REMARK 3 T13: 0.0135 T23: 0.1124 REMARK 3 L TENSOR REMARK 3 L11: 3.1661 L22: 0.9029 REMARK 3 L33: 9.5607 L12: -1.6693 REMARK 3 L13: -3.8508 L23: 2.3407 REMARK 3 S TENSOR REMARK 3 S11: 0.0229 S12: -0.0292 S13: 0.4636 REMARK 3 S21: -0.0745 S22: 0.0101 S23: -0.2165 REMARK 3 S31: -0.5471 S32: -0.2215 S33: -0.0329 REMARK 3 REMARK 3 TLS GROUP : 25 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 46 B 50 REMARK 3 ORIGIN FOR THE GROUP (A): -4.8200 17.0500 -23.5470 REMARK 3 T TENSOR REMARK 3 T11: 0.2978 T22: 0.3050 REMARK 3 T33: 0.1764 T12: -0.1065 REMARK 3 T13: 0.0673 T23: -0.0195 REMARK 3 L TENSOR REMARK 3 L11: 5.6054 L22: 4.8722 REMARK 3 L33: 1.2034 L12: -0.5158 REMARK 3 L13: 0.0852 L23: -2.4137 REMARK 3 S TENSOR REMARK 3 S11: -0.1611 S12: 0.6812 S13: 0.4021 REMARK 3 S21: -0.0764 S22: -0.1688 S23: -0.6874 REMARK 3 S31: 0.0621 S32: 0.0383 S33: 0.3298 REMARK 3 REMARK 3 TLS GROUP : 26 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 51 B 68 REMARK 3 ORIGIN FOR THE GROUP (A): -6.8460 15.9440 -18.6680 REMARK 3 T TENSOR REMARK 3 T11: 0.2220 T22: 0.1957 REMARK 3 T33: 0.0403 T12: -0.1123 REMARK 3 T13: 0.0563 T23: -0.0240 REMARK 3 L TENSOR REMARK 3 L11: 6.1932 L22: 0.8865 REMARK 3 L33: 1.3240 L12: 0.7181 REMARK 3 L13: -0.4620 L23: -0.0976 REMARK 3 S TENSOR REMARK 3 S11: 0.0317 S12: 0.1278 S13: 0.0764 REMARK 3 S21: 0.0702 S22: -0.0365 S23: -0.1045 REMARK 3 S31: -0.2021 S32: 0.0675 S33: 0.0048 REMARK 3 REMARK 3 TLS GROUP : 27 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 69 B 74 REMARK 3 ORIGIN FOR THE GROUP (A): -0.8380 16.9980 -12.0180 REMARK 3 T TENSOR REMARK 3 T11: 0.2236 T22: 0.2400 REMARK 3 T33: 0.1574 T12: -0.0457 REMARK 3 T13: 0.0175 T23: -0.0489 REMARK 3 L TENSOR REMARK 3 L11: 25.6960 L22: 0.6235 REMARK 3 L33: 3.9527 L12: -3.9946 REMARK 3 L13: 10.0756 L23: -1.5656 REMARK 3 S TENSOR REMARK 3 S11: -0.2356 S12: -0.2230 S13: 0.5455 REMARK 3 S21: 0.0472 S22: 0.0248 S23: -0.0669 REMARK 3 S31: -0.0707 S32: -0.0909 S33: 0.2108 REMARK 3 REMARK 3 TLS GROUP : 28 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 75 B 84 REMARK 3 ORIGIN FOR THE GROUP (A): -5.4550 22.0890 -13.8800 REMARK 3 T TENSOR REMARK 3 T11: 0.2342 T22: 0.1683 REMARK 3 T33: 0.1159 T12: -0.0911 REMARK 3 T13: 0.0303 T23: -0.0831 REMARK 3 L TENSOR REMARK 3 L11: 7.2752 L22: 5.9469 REMARK 3 L33: 3.3974 L12: -2.1097 REMARK 3 L13: -1.9661 L23: 4.4801 REMARK 3 S TENSOR REMARK 3 S11: 0.1789 S12: -0.1313 S13: 0.5642 REMARK 3 S21: 0.3261 S22: 0.2599 S23: -0.5652 REMARK 3 S31: 0.2226 S32: 0.1898 S33: -0.4388 REMARK 3 REMARK 3 TLS GROUP : 29 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 85 B 93 REMARK 3 ORIGIN FOR THE GROUP (A): -10.1450 29.3700 -19.1760 REMARK 3 T TENSOR REMARK 3 T11: 0.2728 T22: 0.1422 REMARK 3 T33: 0.2479 T12: -0.0923 REMARK 3 T13: 0.0720 T23: 0.0140 REMARK 3 L TENSOR REMARK 3 L11: 0.2556 L22: 8.8943 REMARK 3 L33: 5.5107 L12: 1.5042 REMARK 3 L13: -0.0036 L23: 0.1618 REMARK 3 S TENSOR REMARK 3 S11: 0.0495 S12: 0.0020 S13: 0.0011 REMARK 3 S21: 0.0675 S22: 0.0410 S23: -0.0142 REMARK 3 S31: -0.2614 S32: 0.1596 S33: -0.0904 REMARK 3 REMARK 3 TLS GROUP : 30 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 94 B 102 REMARK 3 ORIGIN FOR THE GROUP (A): -27.3510 24.9040 -19.0130 REMARK 3 T TENSOR REMARK 3 T11: 0.5876 T22: 0.3871 REMARK 3 T33: 0.3337 T12: -0.0304 REMARK 3 T13: -0.0598 T23: -0.0260 REMARK 3 L TENSOR REMARK 3 L11: 10.0845 L22: 5.1443 REMARK 3 L33: 3.4597 L12: 7.1968 REMARK 3 L13: -5.9003 L23: -4.2108 REMARK 3 S TENSOR REMARK 3 S11: 0.2466 S12: 0.3766 S13: 0.7361 REMARK 3 S21: 0.2285 S22: 0.1883 S23: 0.5241 REMARK 3 S31: -0.2168 S32: -0.2403 S33: -0.4349 REMARK 3 REMARK 3 TLS GROUP : 31 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 103 B 119 REMARK 3 ORIGIN FOR THE GROUP (A): -25.3470 20.1850 -12.1040 REMARK 3 T TENSOR REMARK 3 T11: 0.1756 T22: 0.1744 REMARK 3 T33: 0.0973 T12: -0.0303 REMARK 3 T13: 0.0121 T23: -0.0254 REMARK 3 L TENSOR REMARK 3 L11: 6.3480 L22: 3.2005 REMARK 3 L33: 3.7636 L12: 1.0868 REMARK 3 L13: -2.6145 L23: 0.6853 REMARK 3 S TENSOR REMARK 3 S11: -0.0049 S12: -0.0799 S13: 0.7306 REMARK 3 S21: 0.2028 S22: 0.1373 S23: 0.2505 REMARK 3 S31: -0.1168 S32: -0.2002 S33: -0.1324 REMARK 3 REMARK 3 TLS GROUP : 32 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 120 B 130 REMARK 3 ORIGIN FOR THE GROUP (A): -11.7270 8.3620 -24.9240 REMARK 3 T TENSOR REMARK 3 T11: 0.2253 T22: 0.3638 REMARK 3 T33: 0.0953 T12: -0.1251 REMARK 3 T13: 0.0791 T23: -0.1618 REMARK 3 L TENSOR REMARK 3 L11: 4.7553 L22: 0.0878 REMARK 3 L33: 3.4969 L12: 0.2057 REMARK 3 L13: -2.2306 L23: 0.3232 REMARK 3 S TENSOR REMARK 3 S11: -0.1202 S12: 0.5486 S13: -0.4322 REMARK 3 S21: -0.0277 S22: 0.0750 S23: -0.0642 REMARK 3 S31: 0.0647 S32: -0.2480 S33: 0.0453 REMARK 3 REMARK 3 TLS GROUP : 33 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 131 B 140 REMARK 3 ORIGIN FOR THE GROUP (A): -15.8970 13.2110 -6.0990 REMARK 3 T TENSOR REMARK 3 T11: 0.2918 T22: 0.2234 REMARK 3 T33: 0.1779 T12: 0.0624 REMARK 3 T13: -0.0408 T23: -0.1098 REMARK 3 L TENSOR REMARK 3 L11: 0.8289 L22: 3.6482 REMARK 3 L33: 6.1539 L12: -0.2535 REMARK 3 L13: -1.4905 L23: 3.9770 REMARK 3 S TENSOR REMARK 3 S11: 0.0885 S12: -0.1490 S13: -0.0934 REMARK 3 S21: 0.1251 S22: 0.3310 S23: -0.5808 REMARK 3 S31: -0.0037 S32: 0.5337 S33: -0.4195 REMARK 3 REMARK 3 TLS GROUP : 34 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 141 B 159 REMARK 3 ORIGIN FOR THE GROUP (A): -21.5070 8.4350 -19.0720 REMARK 3 T TENSOR REMARK 3 T11: 0.1961 T22: 0.2319 REMARK 3 T33: 0.0658 T12: -0.0565 REMARK 3 T13: 0.0595 T23: -0.0855 REMARK 3 L TENSOR REMARK 3 L11: 3.2689 L22: 0.9401 REMARK 3 L33: 4.2959 L12: -0.4239 REMARK 3 L13: 0.2619 L23: 1.2349 REMARK 3 S TENSOR REMARK 3 S11: -0.0816 S12: 0.3495 S13: -0.2495 REMARK 3 S21: 0.0532 S22: 0.2155 S23: 0.0097 REMARK 3 S31: 0.1873 S32: 0.1608 S33: -0.1339 REMARK 3 REMARK 3 TLS GROUP : 35 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 160 B 164 REMARK 3 ORIGIN FOR THE GROUP (A): -15.9980 -3.6450 -8.7660 REMARK 3 T TENSOR REMARK 3 T11: 0.4128 T22: 0.2455 REMARK 3 T33: 0.3479 T12: 0.0198 REMARK 3 T13: 0.0579 T23: -0.0427 REMARK 3 L TENSOR REMARK 3 L11: 5.2990 L22: 8.3863 REMARK 3 L33: 17.1344 L12: -1.4500 REMARK 3 L13: 9.5238 L23: -2.5575 REMARK 3 S TENSOR REMARK 3 S11: 0.0634 S12: -0.2594 S13: -0.0378 REMARK 3 S21: 0.2079 S22: -0.0312 S23: -0.1831 REMARK 3 S31: 0.1852 S32: -0.4360 S33: -0.0322 REMARK 3 REMARK 3 TLS GROUP : 36 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 165 B 172 REMARK 3 ORIGIN FOR THE GROUP (A): -24.2310 3.0260 -23.0680 REMARK 3 T TENSOR REMARK 3 T11: 0.1952 T22: 0.2813 REMARK 3 T33: 0.2585 T12: -0.1086 REMARK 3 T13: 0.0126 T23: -0.1620 REMARK 3 L TENSOR REMARK 3 L11: 3.9523 L22: 9.6622 REMARK 3 L33: 7.2223 L12: -0.1512 REMARK 3 L13: 0.5079 L23: -5.5994 REMARK 3 S TENSOR REMARK 3 S11: 0.0672 S12: 0.6118 S13: -0.9486 REMARK 3 S21: -0.2027 S22: 0.2233 S23: 0.5009 REMARK 3 S31: 0.3734 S32: -0.3251 S33: -0.2905 REMARK 3 REMARK 3 TLS GROUP : 37 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 173 B 181 REMARK 3 ORIGIN FOR THE GROUP (A): -25.9110 10.2880 -14.2540 REMARK 3 T TENSOR REMARK 3 T11: 0.2791 T22: 0.3336 REMARK 3 T33: 0.0848 T12: -0.0878 REMARK 3 T13: 0.0379 T23: -0.0169 REMARK 3 L TENSOR REMARK 3 L11: 4.0840 L22: 2.5860 REMARK 3 L33: 8.6525 L12: -1.8054 REMARK 3 L13: 4.3989 L23: 0.6347 REMARK 3 S TENSOR REMARK 3 S11: -0.0656 S12: -0.3885 S13: -0.0680 REMARK 3 S21: 0.3215 S22: 0.1531 S23: 0.0543 REMARK 3 S31: 0.4887 S32: -0.6130 S33: -0.0875 REMARK 3 REMARK 3 TLS GROUP : 38 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 182 B 193 REMARK 3 ORIGIN FOR THE GROUP (A): -17.2600 4.8330 -16.7320 REMARK 3 T TENSOR REMARK 3 T11: 0.3394 T22: 0.1923 REMARK 3 T33: 0.1602 T12: -0.0017 REMARK 3 T13: 0.0147 T23: -0.1220 REMARK 3 L TENSOR REMARK 3 L11: 2.6732 L22: 0.4325 REMARK 3 L33: 2.2113 L12: 0.5451 REMARK 3 L13: 0.3979 L23: -0.5444 REMARK 3 S TENSOR REMARK 3 S11: -0.0605 S12: 0.2950 S13: -0.4778 REMARK 3 S21: 0.0427 S22: 0.0813 S23: -0.1716 REMARK 3 S31: 0.3632 S32: 0.1327 S33: -0.0208 REMARK 3 REMARK 3 TLS GROUP : 39 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 194 B 205 REMARK 3 ORIGIN FOR THE GROUP (A): -19.1350 13.1780 -34.9320 REMARK 3 T TENSOR REMARK 3 T11: 0.3647 T22: 0.9467 REMARK 3 T33: 0.1036 T12: -0.1828 REMARK 3 T13: 0.0647 T23: -0.0053 REMARK 3 L TENSOR REMARK 3 L11: 2.3924 L22: 7.6950 REMARK 3 L33: 1.7902 L12: -0.8725 REMARK 3 L13: -1.8055 L23: 2.4022 REMARK 3 S TENSOR REMARK 3 S11: 0.2490 S12: 0.8407 S13: -0.0111 REMARK 3 S21: -0.4908 S22: -0.0719 S23: -0.8503 REMARK 3 S31: -0.3108 S32: -0.4824 S33: -0.1770 REMARK 3 REMARK 3 TLS GROUP : 40 REMARK 3 NUMBER OF COMPONENTS GROUP : 1 REMARK 3 COMPONENTS C SSSEQI TO C SSSEQI REMARK 3 RESIDUE RANGE : B 206 B 215 REMARK 3 ORIGIN FOR THE GROUP (A): -18.5340 20.1180 -11.5750 REMARK 3 T TENSOR REMARK 3 T11: 0.2439 T22: 0.1449 REMARK 3 T33: 0.1511 T12: -0.0313 REMARK 3 T13: 0.0280 T23: -0.0621 REMARK 3 L TENSOR REMARK 3 L11: 2.4769 L22: 0.6182 REMARK 3 L33: 9.1970 L12: -0.1502 REMARK 3 L13: -1.6299 L23: -2.1250 REMARK 3 S TENSOR REMARK 3 S11: -0.2241 S12: 0.0189 S13: 0.3483 REMARK 3 S21: 0.1064 S22: -0.0203 S23: -0.1466 REMARK 3 S31: -0.1945 S32: 0.0309 S33: 0.2444 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADED IN THE RIDING REMARK 3 POSITIONS REMARK 4 REMARK 4 3KHC COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 06-NOV-09. REMARK 100 THE RCSB ID CODE IS RCSB055993. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 12-MAY-09 REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 6.0 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : ROTATING ANODE REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : RIGAKU MICROMAX-007 REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.54 REMARK 200 MONOCHROMATOR : GRAPHITE REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : RIGAKU SATURN 92 REMARK 200 INTENSITY-INTEGRATION SOFTWARE : D*TREK REMARK 200 DATA SCALING SOFTWARE : D*TREK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 21726 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.200 REMARK 200 RESOLUTION RANGE LOW (A) : 42.690 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.6 REMARK 200 DATA REDUNDANCY : 6.940 REMARK 200 R MERGE (I) : 0.10400 REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : 9.4000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.20 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.23 REMARK 200 COMPLETENESS FOR SHELL (%) : 99.9 REMARK 200 DATA REDUNDANCY IN SHELL : 6.27 REMARK 200 R MERGE FOR SHELL (I) : 0.39600 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : 9.400 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: PHASER REMARK 200 STARTING MODEL: PDB ENTRY 2FD8 REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 42.75 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.15 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 10-20% PEG 8000, 0.1M MES, 0.1M SODIUM REMARK 280 CHLORIDE, 0.1M MAGNESIUM CHLORIDE, PH 6.0, VAPOR DIFFUSION, REMARK 280 SITTING DROP, TEMPERATURE 288K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 1 2 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,Y,-Z REMARK 290 3555 X+1/2,Y+1/2,Z REMARK 290 4555 -X+1/2,Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 3 1.000000 0.000000 0.000000 73.90450 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 20.72050 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 73.90450 REMARK 290 SMTRY2 4 0.000000 1.000000 0.000000 20.72050 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: TETRAMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A, B, C, D REMARK 350 BIOMT1 1 1.000000 0.000000 0.000000 0.00000 REMARK 350 BIOMT2 1 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 1 0.000000 0.000000 1.000000 0.00000 REMARK 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY A -2 REMARK 465 PRO A -1 REMARK 465 HIS A 0 REMARK 465 MET A 1 REMARK 465 LEU A 2 REMARK 465 ASP A 3 REMARK 465 LEU A 4 REMARK 465 PHE A 5 REMARK 465 ALA A 6 REMARK 465 ASP A 7 REMARK 465 ALA A 8 REMARK 465 GLU A 9 REMARK 465 GLY B -2 REMARK 465 PRO B -1 REMARK 465 HIS B 0 REMARK 465 MET B 1 REMARK 465 LEU B 2 REMARK 465 ASP B 3 REMARK 465 LEU B 4 REMARK 465 PHE B 5 REMARK 465 ALA B 6 REMARK 465 ASP B 7 REMARK 465 ALA B 8 REMARK 465 GLU B 216 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 TYR A 55 CG CD1 CD2 CE1 CE2 CZ OH REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 DT C 2 N3 - C2 - O2 ANGL. DEV. = -3.7 DEGREES REMARK 500 DG C 6 O4' - C1' - N9 ANGL. DEV. = 1.9 DEGREES REMARK 500 DC C 7 O4' - C1' - N1 ANGL. DEV. = 3.0 DEGREES REMARK 500 DT C 9 O4' - C1' - N1 ANGL. DEV. = 3.6 DEGREES REMARK 500 DG D 4 OP1 - P - OP2 ANGL. DEV. = 19.1 DEGREES REMARK 500 DG D 4 O5' - P - OP1 ANGL. DEV. = -20.9 DEGREES REMARK 500 DG D 4 O5' - P - OP2 ANGL. DEV. = -20.4 DEGREES REMARK 500 DG D 4 O5' - C5' - C4' ANGL. DEV. = -8.5 DEGREES REMARK 500 DC D 5 O4' - C1' - N1 ANGL. DEV. = 2.1 DEGREES REMARK 500 DT D 7 O4' - C1' - N1 ANGL. DEV. = 2.8 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 TRP A 11 172.61 171.66 REMARK 500 TYR A 109 77.54 -119.50 REMARK 500 ILE A 201 -69.08 70.30 REMARK 500 ASP A 202 19.82 -148.34 REMARK 500 TYR B 109 78.30 -118.15 REMARK 500 PRO B 164 129.10 -36.61 REMARK 500 PRO B 191 123.84 -37.93 REMARK 500 ILE B 201 -84.03 71.92 REMARK 500 REMARK 500 REMARK: NULL REMARK 525 REMARK 525 SOLVENT REMARK 525 REMARK 525 THE SOLVENT MOLECULES HAVE CHAIN IDENTIFIERS THAT REMARK 525 INDICATE THE POLYMER CHAIN WITH WHICH THEY ARE MOST REMARK 525 CLOSELY ASSOCIATED. THE REMARK LISTS ALL THE SOLVENT REMARK 525 MOLECULES WHICH ARE MORE THAN 5A AWAY FROM THE REMARK 525 NEAREST POLYMER CHAIN (M = MODEL NUMBER; REMARK 525 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE REMARK 525 NUMBER; I=INSERTION CODE): REMARK 525 REMARK 525 M RES CSSEQI REMARK 525 HOH A 222 DISTANCE = 5.92 ANGSTROMS REMARK 525 HOH A 251 DISTANCE = 5.59 ANGSTROMS REMARK 525 HOH A 303 DISTANCE = 5.09 ANGSTROMS REMARK 525 HOH A 329 DISTANCE = 5.89 ANGSTROMS REMARK 525 HOH B 259 DISTANCE = 5.07 ANGSTROMS REMARK 620 REMARK 620 METAL COORDINATION REMARK 620 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 620 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE): REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CO A 217 CO REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS A 131 NE2 REMARK 620 2 ASP A 133 OD1 82.1 REMARK 620 3 HIS A 187 NE2 89.5 93.6 REMARK 620 4 AKG A 400 O2 89.3 105.9 160.0 REMARK 620 5 AKG A 400 O5 96.0 177.6 87.9 72.4 REMARK 620 6 HOH A 245 O 175.4 94.3 87.8 94.5 87.6 REMARK 620 N 1 2 3 4 5 REMARK 620 REMARK 620 COORDINATION ANGLES FOR: M RES CSSEQI METAL REMARK 620 CO B 217 CO REMARK 620 N RES CSSEQI ATOM REMARK 620 1 HIS B 131 NE2 REMARK 620 2 ASP B 133 OD1 93.2 REMARK 620 3 HIS B 187 NE2 92.8 91.1 REMARK 620 4 AKG B 401 O2 103.9 103.6 156.8 REMARK 620 5 AKG B 401 O5 92.2 172.2 94.3 69.5 REMARK 620 6 HOH B 260 O 173.6 86.9 80.8 82.2 88.3 REMARK 620 N 1 2 3 4 5 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CO A 217 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE AKG A 400 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE CO B 217 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE AKG B 401 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 3KHB RELATED DB: PDB DBREF 3KHC A 1 216 UNP P05050 ALKB_ECOLI 1 216 DBREF 3KHC B 1 216 UNP P05050 ALKB_ECOLI 1 216 DBREF 3KHC C 2 9 PDB 3KHC 3KHC 2 9 DBREF 3KHC D 4 7 PDB 3KHC 3KHC 4 7 SEQADV 3KHC GLY A -2 UNP P05050 EXPRESSION TAG SEQADV 3KHC PRO A -1 UNP P05050 EXPRESSION TAG SEQADV 3KHC HIS A 0 UNP P05050 EXPRESSION TAG SEQADV 3KHC ALA A 135 UNP P05050 ASP 135 ENGINEERED SEQADV 3KHC GLY B -2 UNP P05050 EXPRESSION TAG SEQADV 3KHC PRO B -1 UNP P05050 EXPRESSION TAG SEQADV 3KHC HIS B 0 UNP P05050 EXPRESSION TAG SEQADV 3KHC ALA B 135 UNP P05050 ASP 135 ENGINEERED SEQRES 1 A 219 GLY PRO HIS MET LEU ASP LEU PHE ALA ASP ALA GLU PRO SEQRES 2 A 219 TRP GLN GLU PRO LEU ALA ALA GLY ALA VAL ILE LEU ARG SEQRES 3 A 219 ARG PHE ALA PHE ASN ALA ALA GLU GLN LEU ILE ARG ASP SEQRES 4 A 219 ILE ASN ASP VAL ALA SER GLN SER PRO PHE ARG GLN MET SEQRES 5 A 219 VAL THR PRO GLY GLY TYR THR MET SER VAL ALA MET THR SEQRES 6 A 219 ASN CYS GLY HIS LEU GLY TRP THR THR HIS ARG GLN GLY SEQRES 7 A 219 TYR LEU TYR SER PRO ILE ASP PRO GLN THR ASN LYS PRO SEQRES 8 A 219 TRP PRO ALA MET PRO GLN SER PHE HIS ASN LEU CYS GLN SEQRES 9 A 219 ARG ALA ALA THR ALA ALA GLY TYR PRO ASP PHE GLN PRO SEQRES 10 A 219 ASP ALA CYS LEU ILE ASN ARG TYR ALA PRO GLY ALA LYS SEQRES 11 A 219 LEU SER LEU HIS GLN ASP LYS ALA GLU PRO ASP LEU ARG SEQRES 12 A 219 ALA PRO ILE VAL SER VAL SER LEU GLY LEU PRO ALA ILE SEQRES 13 A 219 PHE GLN PHE GLY GLY LEU LYS ARG ASN ASP PRO LEU LYS SEQRES 14 A 219 ARG LEU LEU LEU GLU HIS GLY ASP VAL VAL VAL TRP GLY SEQRES 15 A 219 GLY GLU SER ARG LEU PHE TYR HIS GLY ILE GLN PRO LEU SEQRES 16 A 219 LYS ALA GLY PHE HIS PRO LEU THR ILE ASP CYS ARG TYR SEQRES 17 A 219 ASN LEU THR PHE ARG GLN ALA GLY LYS LYS GLU SEQRES 1 B 219 GLY PRO HIS MET LEU ASP LEU PHE ALA ASP ALA GLU PRO SEQRES 2 B 219 TRP GLN GLU PRO LEU ALA ALA GLY ALA VAL ILE LEU ARG SEQRES 3 B 219 ARG PHE ALA PHE ASN ALA ALA GLU GLN LEU ILE ARG ASP SEQRES 4 B 219 ILE ASN ASP VAL ALA SER GLN SER PRO PHE ARG GLN MET SEQRES 5 B 219 VAL THR PRO GLY GLY TYR THR MET SER VAL ALA MET THR SEQRES 6 B 219 ASN CYS GLY HIS LEU GLY TRP THR THR HIS ARG GLN GLY SEQRES 7 B 219 TYR LEU TYR SER PRO ILE ASP PRO GLN THR ASN LYS PRO SEQRES 8 B 219 TRP PRO ALA MET PRO GLN SER PHE HIS ASN LEU CYS GLN SEQRES 9 B 219 ARG ALA ALA THR ALA ALA GLY TYR PRO ASP PHE GLN PRO SEQRES 10 B 219 ASP ALA CYS LEU ILE ASN ARG TYR ALA PRO GLY ALA LYS SEQRES 11 B 219 LEU SER LEU HIS GLN ASP LYS ALA GLU PRO ASP LEU ARG SEQRES 12 B 219 ALA PRO ILE VAL SER VAL SER LEU GLY LEU PRO ALA ILE SEQRES 13 B 219 PHE GLN PHE GLY GLY LEU LYS ARG ASN ASP PRO LEU LYS SEQRES 14 B 219 ARG LEU LEU LEU GLU HIS GLY ASP VAL VAL VAL TRP GLY SEQRES 15 B 219 GLY GLU SER ARG LEU PHE TYR HIS GLY ILE GLN PRO LEU SEQRES 16 B 219 LYS ALA GLY PHE HIS PRO LEU THR ILE ASP CYS ARG TYR SEQRES 17 B 219 ASN LEU THR PHE ARG GLN ALA GLY LYS LYS GLU SEQRES 1 C 8 DT DA MG1 DT DG DC DC DT SEQRES 1 D 4 DG DC DA DT MODRES 3KHC MG1 C 4 DG HET MG1 C 4 23 HET CO A 217 1 HET AKG A 400 10 HET CO B 217 1 HET AKG B 401 10 HETNAM MG1 2'-DEOXY-1-METHYLGUANOSINE 5'-(DIHYDROGEN PHOSPHATE) HETNAM CO COBALT (II) ION HETNAM AKG 2-OXOGLUTARIC ACID FORMUL 3 MG1 C11 H16 N5 O7 P FORMUL 5 CO 2(CO 2+) FORMUL 6 AKG 2(C5 H6 O5) FORMUL 9 HOH *269(H2 O) HELIX 1 1 ALA A 29 SER A 42 1 14 HELIX 2 2 PRO A 93 ALA A 107 1 15 HELIX 3 3 GLY A 179 ARG A 183 5 5 HELIX 4 4 ALA B 29 SER B 44 1 16 HELIX 5 5 PRO B 93 ALA B 107 1 15 HELIX 6 6 GLY B 179 ARG B 183 5 5 SHEET 1 A 7 TRP A 11 ALA A 16 0 SHEET 2 A 7 ALA A 19 ARG A 23 -1 O ALA A 19 N ALA A 16 SHEET 3 A 7 VAL A 175 TRP A 178 -1 O VAL A 175 N LEU A 22 SHEET 4 A 7 ILE A 143 GLY A 149 -1 N SER A 145 O VAL A 176 SHEET 5 A 7 ARG A 204 ARG A 210 -1 O PHE A 209 N VAL A 144 SHEET 6 A 7 ALA A 116 TYR A 122 -1 N TYR A 122 O ARG A 204 SHEET 7 A 7 ALA A 60 CYS A 64 -1 N THR A 62 O ILE A 119 SHEET 1 B 2 GLY A 68 THR A 70 0 SHEET 2 B 2 LEU A 77 SER A 79 -1 O LEU A 77 N THR A 70 SHEET 1 C 4 LEU A 128 HIS A 131 0 SHEET 2 C 4 HIS A 187 ILE A 189 -1 O ILE A 189 N LEU A 128 SHEET 3 C 4 ALA A 152 PHE A 156 -1 N GLN A 155 O GLY A 188 SHEET 4 C 4 LYS A 166 LEU A 170 -1 O LEU A 168 N PHE A 154 SHEET 1 D 7 TRP B 11 ALA B 16 0 SHEET 2 D 7 ALA B 19 ARG B 23 -1 O ILE B 21 N GLU B 13 SHEET 3 D 7 VAL B 175 TRP B 178 -1 O VAL B 175 N LEU B 22 SHEET 4 D 7 ILE B 143 GLY B 149 -1 N ILE B 143 O TRP B 178 SHEET 5 D 7 ARG B 204 ARG B 210 -1 O PHE B 209 N VAL B 144 SHEET 6 D 7 ALA B 116 TYR B 122 -1 N TYR B 122 O ARG B 204 SHEET 7 D 7 ALA B 60 CYS B 64 -1 N THR B 62 O ILE B 119 SHEET 1 E 2 GLY B 68 THR B 70 0 SHEET 2 E 2 LEU B 77 SER B 79 -1 O LEU B 77 N THR B 70 SHEET 1 F 4 LEU B 128 HIS B 131 0 SHEET 2 F 4 HIS B 187 ILE B 189 -1 O ILE B 189 N LEU B 128 SHEET 3 F 4 ALA B 152 PHE B 156 -1 N GLN B 155 O GLY B 188 SHEET 4 F 4 LYS B 166 LEU B 170 -1 O LEU B 168 N PHE B 154 LINK O3' DA C 3 P MG1 C 4 1555 1555 1.59 LINK O3' MG1 C 4 P DT C 5 1555 1555 1.61 LINK NE2 HIS A 131 CO CO A 217 1555 1555 2.24 LINK OD1 ASP A 133 CO CO A 217 1555 1555 2.35 LINK NE2 HIS A 187 CO CO A 217 1555 1555 2.11 LINK NE2 HIS B 131 CO CO B 217 1555 1555 2.11 LINK OD1 ASP B 133 CO CO B 217 1555 1555 2.34 LINK NE2 HIS B 187 CO CO B 217 1555 1555 2.12 LINK CO CO B 217 O2 AKG B 401 1555 1555 2.08 LINK CO CO B 217 O5 AKG B 401 1555 1555 2.48 LINK CO CO A 217 O2 AKG A 400 1555 1555 2.13 LINK CO CO A 217 O5 AKG A 400 1555 1555 2.44 LINK CO CO A 217 O HOH A 245 1555 1555 2.04 LINK CO CO B 217 O HOH B 260 1555 1555 1.90 CISPEP 1 GLY B 157 GLY B 158 0 0.89 SITE 1 AC1 5 HIS A 131 ASP A 133 HIS A 187 HOH A 245 SITE 2 AC1 5 AKG A 400 SITE 1 AC2 16 LEU A 118 ASN A 120 TYR A 122 LEU A 128 SITE 2 AC2 16 HIS A 131 ASP A 133 SER A 145 HIS A 187 SITE 3 AC2 16 ILE A 189 ARG A 204 ASN A 206 THR A 208 SITE 4 AC2 16 CO A 217 HOH A 220 HOH A 230 HOH A 245 SITE 1 AC3 5 HIS B 131 ASP B 133 HIS B 187 HOH B 260 SITE 2 AC3 5 AKG B 401 SITE 1 AC4 16 LEU B 118 ASN B 120 TYR B 122 LEU B 128 SITE 2 AC4 16 HIS B 131 ASP B 133 HIS B 187 ILE B 189 SITE 3 AC4 16 ARG B 204 ASN B 206 THR B 208 ARG B 210 SITE 4 AC4 16 CO B 217 HOH B 260 HOH B 298 MG1 C 4 CRYST1 147.809 41.441 85.622 90.00 120.98 90.00 C 1 2 1 8 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.006765 0.000000 0.004061 0.00000 SCALE2 0.000000 0.024131 0.000000 0.00000 SCALE3 0.000000 0.000000 0.013622 0.00000 ATOM 1 N PRO A 10 -43.071 12.412 21.418 1.00 20.00 N ATOM 2 CA PRO A 10 -42.326 12.106 20.194 1.00 20.00 C ATOM 3 C PRO A 10 -43.017 12.683 18.966 1.00 20.00 C ATOM 4 O PRO A 10 -44.235 12.560 18.876 1.00 20.00 O ATOM 5 CB PRO A 10 -42.338 10.573 20.149 1.00 20.00 C ATOM 6 CG PRO A 10 -43.439 10.160 21.030 1.00 20.00 C ATOM 7 CD PRO A 10 -43.575 11.199 22.084 1.00 20.00 C ATOM 8 N TRP A 11 -42.265 13.284 18.041 1.00 19.19 N ATOM 9 CA TRP A 11 -42.832 13.853 16.809 1.00 19.17 C ATOM 10 C TRP A 11 -41.791 14.660 16.021 1.00 18.92 C ATOM 11 O TRP A 11 -40.683 14.878 16.510 1.00 19.07 O ATOM 12 CB TRP A 11 -44.045 14.729 17.131 1.00 19.29 C ATOM 13 CG TRP A 11 -43.684 16.103 17.606 1.00 19.76 C ATOM 14 CD1 TRP A 11 -43.447 17.202 16.833 1.00 20.23 C ATOM 15 CD2 TRP A 11 -43.519 16.525 18.965 1.00 20.59 C ATOM 16 NE1 TRP A 11 -43.144 18.282 17.626 1.00 20.96 N ATOM 17 CE2 TRP A 11 -43.182 17.893 18.939 1.00 20.77 C ATOM 18 CE3 TRP A 11 -43.623 15.880 20.201 1.00 20.73 C ATOM 19 CZ2 TRP A 11 -42.948 18.627 20.100 1.00 20.27 C ATOM 20 CZ3 TRP A 11 -43.391 16.610 21.353 1.00 20.40 C ATOM 21 CH2 TRP A 11 -43.058 17.969 21.294 1.00 20.79 C ATOM 22 N GLN A 12 -42.134 15.104 14.808 1.00 18.24 N ATOM 23 CA GLN A 12 -41.172 15.885 14.007 1.00 17.51 C ATOM 24 C GLN A 12 -41.487 17.366 13.874 1.00 16.74 C ATOM 25 O GLN A 12 -42.651 17.755 13.839 1.00 17.28 O ATOM 26 CB GLN A 12 -41.088 15.294 12.599 1.00 17.65 C ATOM 27 CG GLN A 12 -40.838 13.801 12.552 1.00 18.07 C ATOM 28 CD GLN A 12 -40.513 13.312 11.158 1.00 18.49 C ATOM 29 OE1 GLN A 12 -39.933 14.038 10.344 1.00 18.41 O ATOM 30 NE2 GLN A 12 -40.877 12.067 10.877 1.00 19.16 N ATOM 31 N GLU A 13 -40.439 18.180 13.793 1.00 15.61 N ATOM 32 CA GLU A 13 -40.563 19.615 13.542 1.00 14.53 C ATOM 33 C GLU A 13 -39.576 20.026 12.458 1.00 13.77 C ATOM 34 O GLU A 13 -38.411 19.651 12.518 1.00 13.59 O ATOM 35 CB GLU A 13 -40.278 20.424 14.810 1.00 14.25 C ATOM 36 CG GLU A 13 -41.357 20.334 15.874 1.00 14.68 C ATOM 37 CD GLU A 13 -41.082 21.238 17.066 1.00 14.21 C ATOM 38 OE1 GLU A 13 -39.901 21.537 17.344 1.00 12.20 O ATOM 39 OE2 GLU A 13 -42.057 21.654 17.719 1.00 14.63 O ATOM 40 N PRO A 14 -40.031 20.813 11.467 1.00 13.38 N ATOM 41 CA PRO A 14 -39.080 21.199 10.427 1.00 12.80 C ATOM 42 C PRO A 14 -38.063 22.162 11.001 1.00 11.98 C ATOM 43 O PRO A 14 -38.420 22.990 11.821 1.00 12.62 O ATOM 44 CB PRO A 14 -39.961 21.907 9.397 1.00 12.94 C ATOM 45 CG PRO A 14 -41.114 22.472 10.206 1.00 13.01 C ATOM 46 CD PRO A 14 -41.352 21.458 11.294 1.00 13.42 C ATOM 47 N LEU A 15 -36.805 22.046 10.606 1.00 11.30 N ATOM 48 CA LEU A 15 -35.802 23.004 11.054 1.00 10.64 C ATOM 49 C LEU A 15 -35.189 23.808 9.897 1.00 10.49 C ATOM 50 O LEU A 15 -35.043 25.031 9.988 1.00 10.68 O ATOM 51 CB LEU A 15 -34.728 22.309 11.889 1.00 10.72 C ATOM 52 CG LEU A 15 -33.560 23.152 12.411 1.00 10.96 C ATOM 53 CD1 LEU A 15 -34.050 24.399 13.156 1.00 10.62 C ATOM 54 CD2 LEU A 15 -32.644 22.309 13.282 1.00 11.68 C ATOM 55 N ALA A 16 -34.831 23.112 8.822 1.00 9.96 N ATOM 56 CA ALA A 16 -34.312 23.718 7.596 1.00 9.37 C ATOM 57 C ALA A 16 -34.372 22.644 6.516 1.00 9.17 C ATOM 58 O ALA A 16 -34.704 21.488 6.805 1.00 9.29 O ATOM 59 CB ALA A 16 -32.867 24.196 7.793 1.00 9.08 C ATOM 60 N ALA A 17 -34.041 23.012 5.281 1.00 8.42 N ATOM 61 CA ALA A 17 -33.934 22.034 4.215 1.00 8.10 C ATOM 62 C ALA A 17 -32.903 20.973 4.612 1.00 7.78 C ATOM 63 O ALA A 17 -31.745 21.292 4.905 1.00 7.30 O ATOM 64 CB ALA A 17 -33.560 22.711 2.884 1.00 7.75 C ATOM 65 N GLY A 18 -33.351 19.718 4.640 1.00 7.70 N ATOM 66 CA GLY A 18 -32.530 18.593 5.072 1.00 7.81 C ATOM 67 C GLY A 18 -32.350 18.454 6.580 1.00 7.62 C ATOM 68 O GLY A 18 -31.575 17.617 7.025 1.00 7.99 O ATOM 69 N ALA A 19 -33.062 19.255 7.368 1.00 7.54 N ATOM 70 CA ALA A 19 -32.903 19.237 8.832 1.00 7.74 C ATOM 71 C ALA A 19 -34.239 19.135 9.557 1.00 8.19 C ATOM 72 O ALA A 19 -35.180 19.866 9.234 1.00 8.24 O ATOM 73 CB ALA A 19 -32.152 20.476 9.301 1.00 7.72 C ATOM 74 N VAL A 20 -34.316 18.228 10.534 1.00 8.33 N ATOM 75 CA AVAL A 20 -35.543 18.049 11.315 0.50 8.60 C ATOM 76 CA BVAL A 20 -35.544 17.979 11.294 0.50 8.64 C ATOM 77 C VAL A 20 -35.217 17.846 12.783 1.00 8.81 C ATOM 78 O VAL A 20 -34.093 17.496 13.146 1.00 9.07 O ATOM 79 CB AVAL A 20 -36.417 16.851 10.833 0.50 8.43 C ATOM 80 CB BVAL A 20 -36.265 16.673 10.836 0.50 8.46 C ATOM 81 CG1AVAL A 20 -36.974 17.088 9.431 0.50 8.98 C ATOM 82 CG1BVAL A 20 -37.736 16.712 11.218 0.50 8.41 C ATOM 83 CG2AVAL A 20 -35.648 15.544 10.914 0.50 7.91 C ATOM 84 CG2BVAL A 20 -36.133 16.450 9.333 0.50 8.82 C ATOM 85 N ILE A 21 -36.200 18.096 13.631 1.00 9.11 N ATOM 86 CA ILE A 21 -36.063 17.781 15.033 1.00 9.63 C ATOM 87 C ILE A 21 -37.045 16.661 15.320 1.00 9.76 C ATOM 88 O ILE A 21 -38.244 16.800 15.065 1.00 9.84 O ATOM 89 CB ILE A 21 -36.355 18.975 15.952 1.00 9.68 C ATOM 90 CG1 ILE A 21 -35.428 20.141 15.634 1.00 10.38 C ATOM 91 CG2 ILE A 21 -36.165 18.564 17.424 1.00 9.80 C ATOM 92 CD1 ILE A 21 -35.832 21.452 16.336 1.00 13.81 C ATOM 93 N LEU A 22 -36.515 15.553 15.836 1.00 9.67 N ATOM 94 CA LEU A 22 -37.308 14.426 16.281 1.00 9.51 C ATOM 95 C LEU A 22 -37.459 14.556 17.795 1.00 10.02 C ATOM 96 O LEU A 22 -36.722 13.950 18.585 1.00 10.19 O ATOM 97 CB LEU A 22 -36.642 13.105 15.876 1.00 9.53 C ATOM 98 CG LEU A 22 -36.125 13.014 14.424 1.00 8.81 C ATOM 99 CD1 LEU A 22 -35.276 11.778 14.214 1.00 9.12 C ATOM 100 CD2 LEU A 22 -37.264 13.071 13.413 1.00 7.80 C ATOM 101 N ARG A 23 -38.404 15.403 18.180 1.00 10.08 N ATOM 102 CA ARG A 23 -38.736 15.638 19.569 1.00 10.65 C ATOM 103 C ARG A 23 -38.930 14.319 20.319 1.00 10.40 C ATOM 104 O ARG A 23 -39.762 13.500 19.926 1.00 10.26 O ATOM 105 CB ARG A 23 -40.007 16.483 19.623 1.00 10.45 C ATOM 106 CG ARG A 23 -39.839 17.875 20.182 1.00 12.06 C ATOM 107 CD ARG A 23 -39.127 18.897 19.310 1.00 12.26 C ATOM 108 NE ARG A 23 -38.118 19.532 20.152 1.00 14.11 N ATOM 109 CZ ARG A 23 -37.717 20.798 20.121 1.00 13.92 C ATOM 110 NH1 ARG A 23 -38.215 21.679 19.276 1.00 12.82 N ATOM 111 NH2 ARG A 23 -36.787 21.180 20.979 1.00 16.12 N ATOM 112 N ARG A 24 -38.135 14.102 21.369 1.00 10.54 N ATOM 113 CA ARG A 24 -38.330 12.954 22.294 1.00 10.81 C ATOM 114 C ARG A 24 -38.062 11.568 21.684 1.00 10.79 C ATOM 115 O ARG A 24 -38.449 10.536 22.253 1.00 10.70 O ATOM 116 CB ARG A 24 -39.736 12.996 22.924 1.00 10.76 C ATOM 117 CG ARG A 24 -39.837 13.674 24.275 1.00 11.43 C ATOM 118 CD ARG A 24 -38.929 14.893 24.432 1.00 11.76 C ATOM 119 NE ARG A 24 -39.583 15.932 25.229 1.00 10.92 N ATOM 120 CZ ARG A 24 -39.776 17.182 24.821 1.00 11.55 C ATOM 121 NH1 ARG A 24 -39.329 17.582 23.629 1.00 10.64 N ATOM 122 NH2 ARG A 24 -40.396 18.040 25.617 1.00 10.46 N ATOM 123 N PHE A 25 -37.368 11.554 20.548 1.00 10.98 N ATOM 124 CA PHE A 25 -37.066 10.328 19.812 1.00 10.92 C ATOM 125 C PHE A 25 -36.221 9.312 20.579 1.00 10.93 C ATOM 126 O PHE A 25 -36.392 8.113 20.384 1.00 11.04 O ATOM 127 CB PHE A 25 -36.391 10.658 18.476 1.00 10.94 C ATOM 128 CG PHE A 25 -36.378 9.512 17.511 1.00 10.71 C ATOM 129 CD1 PHE A 25 -37.465 9.286 16.668 1.00 11.12 C ATOM 130 CD2 PHE A 25 -35.286 8.651 17.448 1.00 10.28 C ATOM 131 CE1 PHE A 25 -37.467 8.218 15.763 1.00 11.18 C ATOM 132 CE2 PHE A 25 -35.277 7.581 16.562 1.00 11.00 C ATOM 133 CZ PHE A 25 -36.373 7.360 15.709 1.00 11.64 C ATOM 134 N ALA A 26 -35.311 9.784 21.429 1.00 11.31 N ATOM 135 CA ALA A 26 -34.471 8.891 22.253 1.00 11.81 C ATOM 136 C ALA A 26 -34.921 8.760 23.725 1.00 12.40 C ATOM 137 O ALA A 26 -34.154 8.286 24.575 1.00 12.20 O ATOM 138 CB ALA A 26 -32.996 9.313 22.185 1.00 11.64 C ATOM 139 N PHE A 27 -36.156 9.168 24.017 1.00 12.99 N ATOM 140 CA PHE A 27 -36.693 9.109 25.379 1.00 13.90 C ATOM 141 C PHE A 27 -36.784 7.674 25.897 1.00 14.67 C ATOM 142 O PHE A 27 -36.385 7.398 27.035 1.00 14.63 O ATOM 143 CB PHE A 27 -38.066 9.789 25.455 1.00 13.67 C ATOM 144 CG PHE A 27 -38.579 9.986 26.861 1.00 13.86 C ATOM 145 CD1 PHE A 27 -38.245 11.133 27.583 1.00 13.50 C ATOM 146 CD2 PHE A 27 -39.399 9.033 27.456 1.00 12.89 C ATOM 147 CE1 PHE A 27 -38.720 11.330 28.877 1.00 14.14 C ATOM 148 CE2 PHE A 27 -39.878 9.213 28.756 1.00 14.24 C ATOM 149 CZ PHE A 27 -39.540 10.370 29.470 1.00 14.27 C ATOM 150 N ASN A 28 -37.297 6.775 25.055 1.00 15.57 N ATOM 151 CA ASN A 28 -37.497 5.364 25.411 1.00 16.61 C ATOM 152 C ASN A 28 -36.188 4.628 25.666 1.00 16.85 C ATOM 153 O ASN A 28 -36.116 3.779 26.556 1.00 16.94 O ATOM 154 CB ASN A 28 -38.302 4.648 24.319 1.00 16.86 C ATOM 155 CG ASN A 28 -38.843 3.290 24.765 1.00 18.87 C ATOM 156 OD1 ASN A 28 -38.093 2.322 24.929 1.00 20.81 O ATOM 157 ND2 ASN A 28 -40.160 3.208 24.931 1.00 20.38 N ATOM 158 N ALA A 29 -35.159 4.975 24.891 1.00 17.47 N ATOM 159 CA ALA A 29 -33.847 4.317 24.939 1.00 17.84 C ATOM 160 C ALA A 29 -32.826 4.981 25.870 1.00 18.20 C ATOM 161 O ALA A 29 -31.728 4.453 26.047 1.00 18.69 O ATOM 162 CB ALA A 29 -33.269 4.226 23.534 1.00 17.75 C ATOM 163 N ALA A 30 -33.186 6.121 26.462 1.00 18.45 N ATOM 164 CA ALA A 30 -32.230 6.998 27.180 1.00 18.49 C ATOM 165 C ALA A 30 -31.474 6.324 28.317 1.00 18.64 C ATOM 166 O ALA A 30 -30.268 6.549 28.493 1.00 18.68 O ATOM 167 CB ALA A 30 -32.934 8.245 27.697 1.00 18.23 C ATOM 168 N GLU A 31 -32.189 5.511 29.090 1.00 18.42 N ATOM 169 CA GLU A 31 -31.609 4.813 30.231 1.00 18.74 C ATOM 170 C GLU A 31 -30.516 3.837 29.795 1.00 18.66 C ATOM 171 O GLU A 31 -29.481 3.719 30.456 1.00 18.15 O ATOM 172 CB GLU A 31 -32.703 4.093 31.008 1.00 18.52 C ATOM 173 CG GLU A 31 -32.286 3.623 32.377 1.00 19.68 C ATOM 174 CD GLU A 31 -33.374 2.815 33.044 1.00 20.68 C ATOM 175 OE1 GLU A 31 -34.516 3.318 33.145 1.00 21.21 O ATOM 176 OE2 GLU A 31 -33.090 1.670 33.454 1.00 21.43 O ATOM 177 N GLN A 32 -30.748 3.159 28.673 1.00 18.94 N ATOM 178 CA GLN A 32 -29.767 2.226 28.111 1.00 19.25 C ATOM 179 C GLN A 32 -28.576 2.971 27.493 1.00 19.06 C ATOM 180 O GLN A 32 -27.430 2.535 27.611 1.00 19.27 O ATOM 181 CB GLN A 32 -30.426 1.298 27.083 1.00 19.25 C ATOM 182 CG GLN A 32 -29.445 0.452 26.256 1.00 20.35 C ATOM 183 CD GLN A 32 -28.749 -0.634 27.063 1.00 21.86 C ATOM 184 OE1 GLN A 32 -29.356 -1.266 27.930 1.00 23.11 O ATOM 185 NE2 GLN A 32 -27.476 -0.871 26.768 1.00 21.69 N ATOM 186 N LEU A 33 -28.855 4.091 26.836 1.00 18.90 N ATOM 187 CA LEU A 33 -27.804 4.912 26.237 1.00 18.50 C ATOM 188 C LEU A 33 -26.815 5.393 27.301 1.00 18.32 C ATOM 189 O LEU A 33 -25.591 5.359 27.094 1.00 18.04 O ATOM 190 CB LEU A 33 -28.404 6.103 25.472 1.00 18.28 C ATOM 191 CG LEU A 33 -29.239 5.845 24.201 1.00 17.94 C ATOM 192 CD1 LEU A 33 -29.924 7.139 23.804 1.00 17.86 C ATOM 193 CD2 LEU A 33 -28.428 5.300 23.027 1.00 15.15 C ATOM 194 N ILE A 34 -27.350 5.822 28.440 1.00 18.10 N ATOM 195 CA ILE A 34 -26.522 6.330 29.535 1.00 18.12 C ATOM 196 C ILE A 34 -25.657 5.225 30.156 1.00 18.24 C ATOM 197 O ILE A 34 -24.474 5.439 30.455 1.00 18.38 O ATOM 198 CB ILE A 34 -27.361 7.095 30.588 1.00 17.87 C ATOM 199 CG1 ILE A 34 -27.910 8.376 29.956 1.00 17.43 C ATOM 200 CG2 ILE A 34 -26.508 7.464 31.808 1.00 17.96 C ATOM 201 CD1 ILE A 34 -28.986 9.090 30.763 1.00 17.17 C ATOM 202 N ARG A 35 -26.237 4.041 30.329 1.00 18.28 N ATOM 203 CA ARG A 35 -25.457 2.887 30.759 1.00 18.45 C ATOM 204 C ARG A 35 -24.343 2.568 29.756 1.00 18.34 C ATOM 205 O ARG A 35 -23.232 2.193 30.153 1.00 18.58 O ATOM 206 CB ARG A 35 -26.353 1.672 30.995 1.00 18.63 C ATOM 207 CG ARG A 35 -26.964 1.654 32.394 1.00 19.44 C ATOM 208 CD ARG A 35 -27.640 0.340 32.714 1.00 20.64 C ATOM 209 NE ARG A 35 -29.040 0.346 32.300 1.00 21.92 N ATOM 210 CZ ARG A 35 -29.488 -0.226 31.189 1.00 22.88 C ATOM 211 NH1 ARG A 35 -28.637 -0.855 30.385 1.00 23.66 N ATOM 212 NH2 ARG A 35 -30.779 -0.171 30.881 1.00 21.95 N ATOM 213 N ASP A 36 -24.651 2.725 28.467 1.00 17.94 N ATOM 214 CA ASP A 36 -23.685 2.497 27.409 1.00 17.65 C ATOM 215 C ASP A 36 -22.610 3.583 27.373 1.00 17.59 C ATOM 216 O ASP A 36 -21.444 3.276 27.117 1.00 17.85 O ATOM 217 CB ASP A 36 -24.382 2.307 26.052 1.00 17.76 C ATOM 218 CG ASP A 36 -24.950 0.903 25.883 1.00 17.81 C ATOM 219 OD1 ASP A 36 -24.397 -0.030 26.496 1.00 18.84 O ATOM 220 OD2 ASP A 36 -25.956 0.723 25.163 1.00 17.46 O ATOM 221 N ILE A 37 -22.999 4.831 27.658 1.00 17.16 N ATOM 222 CA ILE A 37 -22.037 5.911 27.909 1.00 16.99 C ATOM 223 C ILE A 37 -21.051 5.532 29.030 1.00 17.31 C ATOM 224 O ILE A 37 -19.830 5.608 28.848 1.00 17.17 O ATOM 225 CB ILE A 37 -22.720 7.257 28.254 1.00 16.77 C ATOM 226 CG1 ILE A 37 -23.550 7.770 27.065 1.00 17.82 C ATOM 227 CG2 ILE A 37 -21.667 8.301 28.656 1.00 15.93 C ATOM 228 CD1 ILE A 37 -24.327 9.070 27.350 1.00 17.98 C ATOM 229 N ASN A 38 -21.579 5.108 30.177 1.00 17.36 N ATOM 230 CA ASN A 38 -20.729 4.775 31.316 1.00 17.57 C ATOM 231 C ASN A 38 -19.700 3.708 30.959 1.00 17.70 C ATOM 232 O ASN A 38 -18.512 3.871 31.239 1.00 17.72 O ATOM 233 CB ASN A 38 -21.571 4.366 32.525 1.00 17.46 C ATOM 234 CG ASN A 38 -22.487 5.482 32.998 1.00 18.13 C ATOM 235 OD1 ASN A 38 -22.282 6.659 32.668 1.00 17.60 O ATOM 236 ND2 ASN A 38 -23.508 5.119 33.773 1.00 17.29 N ATOM 237 N ASP A 39 -20.158 2.640 30.307 1.00 17.78 N ATOM 238 CA ASP A 39 -19.270 1.587 29.827 1.00 17.87 C ATOM 239 C ASP A 39 -18.209 2.092 28.834 1.00 17.68 C ATOM 240 O ASP A 39 -17.032 1.757 28.970 1.00 17.90 O ATOM 241 CB ASP A 39 -20.074 0.445 29.214 1.00 18.11 C ATOM 242 CG ASP A 39 -19.230 -0.774 28.946 1.00 19.44 C ATOM 243 OD1 ASP A 39 -19.408 -1.407 27.884 1.00 21.75 O ATOM 244 OD2 ASP A 39 -18.379 -1.107 29.798 1.00 21.68 O ATOM 245 N VAL A 40 -18.618 2.897 27.851 1.00 17.11 N ATOM 246 CA VAL A 40 -17.660 3.497 26.917 1.00 16.86 C ATOM 247 C VAL A 40 -16.620 4.333 27.667 1.00 16.91 C ATOM 248 O VAL A 40 -15.423 4.300 27.339 1.00 17.05 O ATOM 249 CB VAL A 40 -18.351 4.354 25.822 1.00 16.43 C ATOM 250 CG1 VAL A 40 -17.329 5.120 25.010 1.00 15.90 C ATOM 251 CG2 VAL A 40 -19.159 3.479 24.896 1.00 17.04 C ATOM 252 N ALA A 41 -17.079 5.065 28.677 1.00 16.61 N ATOM 253 CA ALA A 41 -16.204 5.936 29.440 1.00 17.05 C ATOM 254 C ALA A 41 -15.219 5.137 30.287 1.00 17.09 C ATOM 255 O ALA A 41 -14.130 5.619 30.574 1.00 17.04 O ATOM 256 CB ALA A 41 -17.019 6.901 30.322 1.00 17.36 C ATOM 257 N SER A 42 -15.590 3.915 30.668 1.00 17.07 N ATOM 258 CA SER A 42 -14.732 3.102 31.532 1.00 17.06 C ATOM 259 C SER A 42 -13.511 2.562 30.780 1.00 17.13 C ATOM 260 O SER A 42 -12.616 1.978 31.385 1.00 17.17 O ATOM 261 CB SER A 42 -15.525 1.980 32.229 1.00 16.97 C ATOM 262 OG SER A 42 -15.950 0.974 31.324 1.00 17.39 O ATOM 263 N GLN A 43 -13.480 2.787 29.467 1.00 17.26 N ATOM 264 CA GLN A 43 -12.365 2.384 28.609 1.00 17.18 C ATOM 265 C GLN A 43 -11.637 3.623 28.069 1.00 16.90 C ATOM 266 O GLN A 43 -10.429 3.761 28.250 1.00 16.70 O ATOM 267 CB GLN A 43 -12.872 1.516 27.455 1.00 17.20 C ATOM 268 CG GLN A 43 -13.604 0.232 27.886 1.00 19.10 C ATOM 269 CD GLN A 43 -14.590 -0.258 26.828 1.00 21.99 C ATOM 270 OE1 GLN A 43 -14.194 -0.666 25.726 1.00 22.62 O ATOM 271 NE2 GLN A 43 -15.883 -0.214 27.158 1.00 21.42 N ATOM 272 N SER A 44 -12.383 4.505 27.396 1.00 16.51 N ATOM 273 CA SER A 44 -11.886 5.811 26.973 1.00 16.27 C ATOM 274 C SER A 44 -12.605 6.874 27.816 1.00 16.62 C ATOM 275 O SER A 44 -13.754 7.219 27.541 1.00 16.38 O ATOM 276 CB SER A 44 -12.116 6.040 25.473 1.00 16.26 C ATOM 277 OG SER A 44 -11.255 5.221 24.678 1.00 15.86 O ATOM 278 N PRO A 45 -11.940 7.359 28.879 1.00 16.69 N ATOM 279 CA PRO A 45 -12.544 8.299 29.808 1.00 16.75 C ATOM 280 C PRO A 45 -12.831 9.654 29.177 1.00 16.75 C ATOM 281 O PRO A 45 -12.203 10.043 28.176 1.00 17.03 O ATOM 282 CB PRO A 45 -11.478 8.445 30.907 1.00 16.62 C ATOM 283 CG PRO A 45 -10.214 8.048 30.275 1.00 16.91 C ATOM 284 CD PRO A 45 -10.575 6.985 29.290 1.00 17.05 C ATOM 285 N PHE A 46 -13.787 10.365 29.758 1.00 16.57 N ATOM 286 CA PHE A 46 -14.023 11.753 29.374 1.00 16.40 C ATOM 287 C PHE A 46 -12.750 12.545 29.651 1.00 16.03 C ATOM 288 O PHE A 46 -12.025 12.237 30.599 1.00 16.00 O ATOM 289 CB PHE A 46 -15.205 12.332 30.153 1.00 15.64 C ATOM 290 CG PHE A 46 -16.535 11.914 29.613 1.00 15.76 C ATOM 291 CD1 PHE A 46 -17.202 10.813 30.148 1.00 15.11 C ATOM 292 CD2 PHE A 46 -17.128 12.617 28.552 1.00 13.56 C ATOM 293 CE1 PHE A 46 -18.444 10.419 29.639 1.00 14.09 C ATOM 294 CE2 PHE A 46 -18.366 12.230 28.047 1.00 14.28 C ATOM 295 CZ PHE A 46 -19.025 11.126 28.587 1.00 13.11 C ATOM 296 N ARG A 47 -12.455 13.526 28.807 1.00 15.96 N ATOM 297 CA ARG A 47 -11.260 14.356 29.009 1.00 16.36 C ATOM 298 C ARG A 47 -11.486 15.792 28.546 1.00 16.67 C ATOM 299 O ARG A 47 -12.418 16.062 27.797 1.00 16.74 O ATOM 300 CB ARG A 47 -9.999 13.713 28.391 1.00 15.90 C ATOM 301 CG ARG A 47 -9.746 13.914 26.895 1.00 15.55 C ATOM 302 CD ARG A 47 -10.776 13.254 25.989 1.00 15.18 C ATOM 303 NE ARG A 47 -10.921 11.819 26.231 1.00 16.08 N ATOM 304 CZ ARG A 47 -10.239 10.864 25.600 1.00 15.80 C ATOM 305 NH1 ARG A 47 -9.324 11.175 24.674 1.00 14.65 N ATOM 306 NH2 ARG A 47 -10.463 9.592 25.912 1.00 13.82 N ATOM 307 N GLN A 48 -10.676 16.716 29.046 1.00 17.40 N ATOM 308 CA GLN A 48 -10.729 18.095 28.580 1.00 18.21 C ATOM 309 C GLN A 48 -9.902 18.230 27.319 1.00 18.57 C ATOM 310 O GLN A 48 -8.901 17.521 27.140 1.00 19.11 O ATOM 311 CB GLN A 48 -10.169 19.044 29.625 1.00 18.48 C ATOM 312 CG GLN A 48 -11.128 19.409 30.723 1.00 19.53 C ATOM 313 CD GLN A 48 -10.591 20.516 31.594 1.00 20.70 C ATOM 314 OE1 GLN A 48 -11.306 21.464 31.927 1.00 21.60 O ATOM 315 NE2 GLN A 48 -9.319 20.413 31.964 1.00 20.48 N ATOM 316 N MET A 49 -10.313 19.130 26.437 1.00 18.54 N ATOM 317 CA MET A 49 -9.487 19.433 25.281 1.00 19.04 C ATOM 318 C MET A 49 -9.161 20.909 25.180 1.00 19.01 C ATOM 319 O MET A 49 -9.957 21.771 25.574 1.00 18.63 O ATOM 320 CB MET A 49 -10.107 18.887 23.997 1.00 19.01 C ATOM 321 CG MET A 49 -10.175 17.370 24.014 1.00 20.56 C ATOM 322 SD MET A 49 -10.954 16.712 22.571 1.00 24.20 S ATOM 323 CE MET A 49 -11.424 15.077 23.126 1.00 23.76 C ATOM 324 N VAL A 50 -7.954 21.172 24.691 1.00 19.11 N ATOM 325 CA VAL A 50 -7.494 22.516 24.413 1.00 19.36 C ATOM 326 C VAL A 50 -7.489 22.636 22.893 1.00 19.63 C ATOM 327 O VAL A 50 -7.031 21.727 22.195 1.00 19.73 O ATOM 328 CB VAL A 50 -6.084 22.760 25.008 1.00 19.51 C ATOM 329 CG1 VAL A 50 -5.648 24.205 24.808 1.00 19.41 C ATOM 330 CG2 VAL A 50 -6.056 22.398 26.504 1.00 19.00 C ATOM 331 N THR A 51 -8.030 23.742 22.390 1.00 19.75 N ATOM 332 CA THR A 51 -8.162 23.962 20.953 1.00 20.01 C ATOM 333 C THR A 51 -6.890 24.611 20.407 1.00 19.97 C ATOM 334 O THR A 51 -6.006 24.987 21.188 1.00 20.34 O ATOM 335 CB THR A 51 -9.355 24.889 20.626 1.00 19.92 C ATOM 336 OG1 THR A 51 -9.114 26.186 21.178 1.00 20.77 O ATOM 337 CG2 THR A 51 -10.660 24.331 21.172 1.00 19.54 C ATOM 338 N PRO A 52 -6.791 24.749 19.069 1.00 19.60 N ATOM 339 CA PRO A 52 -5.682 25.534 18.516 1.00 19.51 C ATOM 340 C PRO A 52 -5.613 26.999 19.004 1.00 19.44 C ATOM 341 O PRO A 52 -4.554 27.619 18.919 1.00 19.32 O ATOM 342 CB PRO A 52 -5.918 25.454 17.005 1.00 19.42 C ATOM 343 CG PRO A 52 -6.618 24.135 16.811 1.00 19.15 C ATOM 344 CD PRO A 52 -7.535 24.033 18.011 1.00 19.63 C ATOM 345 N GLY A 53 -6.717 27.530 19.527 1.00 19.33 N ATOM 346 CA GLY A 53 -6.744 28.903 20.050 1.00 19.48 C ATOM 347 C GLY A 53 -6.091 29.068 21.418 1.00 19.31 C ATOM 348 O GLY A 53 -5.691 30.170 21.801 1.00 19.29 O ATOM 349 N GLY A 54 -5.985 27.969 22.158 1.00 18.99 N ATOM 350 CA GLY A 54 -5.372 27.991 23.476 1.00 18.58 C ATOM 351 C GLY A 54 -6.400 27.879 24.579 1.00 18.36 C ATOM 352 O GLY A 54 -6.045 27.770 25.755 1.00 18.27 O ATOM 353 N TYR A 55 -7.676 27.907 24.201 1.00 18.11 N ATOM 354 CA TYR A 55 -8.747 27.782 25.179 1.00 17.94 C ATOM 355 C TYR A 55 -9.100 26.335 25.481 1.00 17.07 C ATOM 356 O TYR A 55 -9.254 25.508 24.577 1.00 16.81 O ATOM 357 CB TYR A 55 -9.981 28.530 24.697 1.00 20.00 C ATOM 358 N THR A 56 -9.192 26.038 26.771 1.00 15.99 N ATOM 359 CA THR A 56 -9.670 24.752 27.214 1.00 15.38 C ATOM 360 C THR A 56 -11.185 24.776 27.043 1.00 15.05 C ATOM 361 O THR A 56 -11.852 25.743 27.427 1.00 14.80 O ATOM 362 CB THR A 56 -9.284 24.472 28.689 1.00 15.41 C ATOM 363 OG1 THR A 56 -7.884 24.687 28.861 1.00 14.96 O ATOM 364 CG2 THR A 56 -9.596 23.046 29.068 1.00 14.57 C ATOM 365 N MET A 57 -11.713 23.724 26.431 1.00 14.48 N ATOM 366 CA MET A 57 -13.147 23.594 26.230 1.00 14.58 C ATOM 367 C MET A 57 -13.833 23.318 27.555 1.00 14.01 C ATOM 368 O MET A 57 -13.297 22.595 28.389 1.00 13.99 O ATOM 369 CB MET A 57 -13.425 22.491 25.219 1.00 14.47 C ATOM 370 CG MET A 57 -12.740 22.799 23.884 1.00 16.50 C ATOM 371 SD MET A 57 -13.063 21.612 22.586 1.00 17.05 S ATOM 372 CE MET A 57 -14.823 21.865 22.381 1.00 15.54 C ATOM 373 N SER A 58 -15.000 23.921 27.763 1.00 13.98 N ATOM 374 CA SER A 58 -15.762 23.682 28.993 1.00 13.68 C ATOM 375 C SER A 58 -16.497 22.342 28.939 1.00 13.43 C ATOM 376 O SER A 58 -16.849 21.784 29.980 1.00 13.49 O ATOM 377 CB SER A 58 -16.696 24.855 29.334 1.00 13.46 C ATOM 378 OG SER A 58 -17.501 25.252 28.231 1.00 14.62 O ATOM 379 N VAL A 59 -16.708 21.820 27.733 1.00 13.28 N ATOM 380 CA AVAL A 59 -17.293 20.480 27.544 0.50 13.43 C ATOM 381 CA BVAL A 59 -17.286 20.481 27.564 0.50 13.42 C ATOM 382 C VAL A 59 -16.218 19.400 27.721 1.00 13.44 C ATOM 383 O VAL A 59 -15.066 19.589 27.314 1.00 13.22 O ATOM 384 CB AVAL A 59 -17.916 20.301 26.125 0.50 13.40 C ATOM 385 CB BVAL A 59 -17.997 20.311 26.194 0.50 13.37 C ATOM 386 CG1AVAL A 59 -18.952 19.192 26.119 0.50 12.83 C ATOM 387 CG1BVAL A 59 -19.153 21.239 26.107 0.50 13.48 C ATOM 388 CG2AVAL A 59 -18.541 21.579 25.644 0.50 13.76 C ATOM 389 CG2BVAL A 59 -17.042 20.571 25.031 0.50 13.14 C ATOM 390 N ALA A 60 -16.595 18.277 28.330 1.00 13.29 N ATOM 391 CA ALA A 60 -15.708 17.119 28.390 1.00 12.95 C ATOM 392 C ALA A 60 -16.166 16.148 27.295 1.00 13.41 C ATOM 393 O ALA A 60 -17.342 16.141 26.919 1.00 13.22 O ATOM 394 CB ALA A 60 -15.769 16.481 29.733 1.00 12.78 C ATOM 395 N MET A 61 -15.247 15.348 26.764 1.00 13.60 N ATOM 396 CA MET A 61 -15.584 14.492 25.632 1.00 14.18 C ATOM 397 C MET A 61 -14.953 13.126 25.709 1.00 13.97 C ATOM 398 O MET A 61 -13.910 12.946 26.327 1.00 13.69 O ATOM 399 CB MET A 61 -15.160 15.132 24.299 1.00 14.15 C ATOM 400 CG MET A 61 -15.904 16.409 23.926 1.00 14.83 C ATOM 401 SD MET A 61 -14.882 17.347 22.781 1.00 15.86 S ATOM 402 CE MET A 61 -16.091 18.498 22.080 1.00 14.80 C ATOM 403 N THR A 62 -15.608 12.172 25.053 1.00 14.02 N ATOM 404 CA THR A 62 -14.970 10.920 24.648 1.00 13.92 C ATOM 405 C THR A 62 -15.543 10.441 23.295 1.00 13.89 C ATOM 406 O THR A 62 -16.397 11.105 22.710 1.00 13.58 O ATOM 407 CB THR A 62 -15.026 9.826 25.766 1.00 13.93 C ATOM 408 OG1 THR A 62 -14.131 8.768 25.426 1.00 13.90 O ATOM 409 CG2 THR A 62 -16.433 9.262 25.973 1.00 13.70 C ATOM 410 N ASN A 63 -15.048 9.319 22.782 1.00 13.89 N ATOM 411 CA ASN A 63 -15.596 8.751 21.553 1.00 14.26 C ATOM 412 C ASN A 63 -15.755 7.241 21.647 1.00 13.94 C ATOM 413 O ASN A 63 -15.150 6.592 22.499 1.00 14.07 O ATOM 414 CB ASN A 63 -14.724 9.067 20.335 1.00 14.17 C ATOM 415 CG ASN A 63 -14.537 10.555 20.099 1.00 14.77 C ATOM 416 OD1 ASN A 63 -15.200 11.131 19.243 1.00 16.31 O ATOM 417 ND2 ASN A 63 -13.593 11.169 20.810 1.00 12.75 N ATOM 418 N CYS A 64 -16.578 6.705 20.752 1.00 13.53 N ATOM 419 CA CYS A 64 -16.706 5.268 20.534 1.00 12.97 C ATOM 420 C CYS A 64 -17.028 5.115 19.058 1.00 12.72 C ATOM 421 O CYS A 64 -17.476 6.068 18.424 1.00 13.40 O ATOM 422 CB CYS A 64 -17.817 4.680 21.409 1.00 12.75 C ATOM 423 SG CYS A 64 -19.489 5.280 21.042 1.00 11.18 S ATOM 424 N GLY A 65 -16.805 3.938 18.488 1.00 13.11 N ATOM 425 CA GLY A 65 -16.937 3.783 17.029 1.00 11.65 C ATOM 426 C GLY A 65 -15.548 3.716 16.449 1.00 11.52 C ATOM 427 O GLY A 65 -14.564 3.835 17.185 1.00 11.31 O ATOM 428 N HIS A 66 -15.448 3.502 15.141 1.00 10.99 N ATOM 429 CA HIS A 66 -14.138 3.327 14.514 1.00 10.53 C ATOM 430 C HIS A 66 -13.267 4.575 14.636 1.00 10.06 C ATOM 431 O HIS A 66 -12.060 4.471 14.894 1.00 10.22 O ATOM 432 CB HIS A 66 -14.270 2.928 13.038 1.00 10.34 C ATOM 433 CG HIS A 66 -12.960 2.604 12.389 1.00 12.02 C ATOM 434 ND1 HIS A 66 -12.584 3.118 11.164 1.00 13.80 N ATOM 435 CD2 HIS A 66 -11.926 1.831 12.803 1.00 13.00 C ATOM 436 CE1 HIS A 66 -11.385 2.663 10.845 1.00 13.82 C ATOM 437 NE2 HIS A 66 -10.963 1.882 11.824 1.00 14.48 N ATOM 438 N LEU A 67 -13.881 5.743 14.431 1.00 9.36 N ATOM 439 CA LEU A 67 -13.163 7.025 14.423 1.00 8.31 C ATOM 440 C LEU A 67 -13.602 7.955 15.544 1.00 8.06 C ATOM 441 O LEU A 67 -14.796 8.207 15.741 1.00 7.44 O ATOM 442 CB LEU A 67 -13.284 7.713 13.062 1.00 7.90 C ATOM 443 CG LEU A 67 -12.573 6.987 11.904 1.00 7.32 C ATOM 444 CD1 LEU A 67 -12.953 7.604 10.573 1.00 3.99 C ATOM 445 CD2 LEU A 67 -11.056 6.988 12.085 1.00 5.63 C ATOM 446 N GLY A 68 -12.623 8.440 16.298 1.00 8.22 N ATOM 447 CA GLY A 68 -12.883 9.405 17.356 1.00 8.35 C ATOM 448 C GLY A 68 -12.307 10.764 17.021 1.00 8.55 C ATOM 449 O GLY A 68 -11.220 10.856 16.439 1.00 8.97 O ATOM 450 N TRP A 69 -13.036 11.817 17.391 1.00 8.13 N ATOM 451 CA TRP A 69 -12.597 13.185 17.181 1.00 7.91 C ATOM 452 C TRP A 69 -11.963 13.729 18.450 1.00 8.43 C ATOM 453 O TRP A 69 -12.557 13.644 19.536 1.00 8.45 O ATOM 454 CB TRP A 69 -13.793 14.051 16.807 1.00 7.89 C ATOM 455 CG TRP A 69 -13.467 15.479 16.455 1.00 7.80 C ATOM 456 CD1 TRP A 69 -13.240 15.981 15.204 1.00 7.05 C ATOM 457 CD2 TRP A 69 -13.377 16.596 17.358 1.00 7.06 C ATOM 458 NE1 TRP A 69 -12.993 17.333 15.273 1.00 7.17 N ATOM 459 CE2 TRP A 69 -13.073 17.737 16.580 1.00 6.38 C ATOM 460 CE3 TRP A 69 -13.515 16.738 18.745 1.00 7.18 C ATOM 461 CZ2 TRP A 69 -12.900 19.008 17.142 1.00 7.52 C ATOM 462 CZ3 TRP A 69 -13.348 18.004 19.312 1.00 8.90 C ATOM 463 CH2 TRP A 69 -13.043 19.127 18.505 1.00 8.94 C ATOM 464 N THR A 70 -10.752 14.270 18.323 1.00 8.27 N ATOM 465 CA THR A 70 -10.148 15.035 19.404 1.00 8.54 C ATOM 466 C THR A 70 -9.540 16.320 18.854 1.00 9.31 C ATOM 467 O THR A 70 -9.223 16.411 17.660 1.00 8.96 O ATOM 468 CB THR A 70 -9.055 14.255 20.153 1.00 8.37 C ATOM 469 OG1 THR A 70 -7.938 14.056 19.285 1.00 7.93 O ATOM 470 CG2 THR A 70 -9.569 12.909 20.651 1.00 7.70 C ATOM 471 N THR A 71 -9.390 17.318 19.719 1.00 10.06 N ATOM 472 CA THR A 71 -8.685 18.527 19.327 1.00 10.67 C ATOM 473 C THR A 71 -7.522 18.813 20.270 1.00 11.86 C ATOM 474 O THR A 71 -7.498 18.340 21.420 1.00 11.70 O ATOM 475 CB THR A 71 -9.613 19.749 19.177 1.00 10.61 C ATOM 476 OG1 THR A 71 -8.895 20.803 18.517 1.00 9.67 O ATOM 477 CG2 THR A 71 -10.144 20.236 20.546 1.00 9.64 C ATOM 478 N HIS A 72 -6.552 19.569 19.758 1.00 12.68 N ATOM 479 CA HIS A 72 -5.283 19.790 20.440 1.00 13.62 C ATOM 480 C HIS A 72 -4.719 21.141 20.030 1.00 14.08 C ATOM 481 O HIS A 72 -5.330 21.867 19.246 1.00 13.84 O ATOM 482 CB HIS A 72 -4.274 18.672 20.111 1.00 13.86 C ATOM 483 CG HIS A 72 -4.841 17.288 20.205 1.00 14.22 C ATOM 484 ND1 HIS A 72 -4.814 16.551 21.371 1.00 14.21 N ATOM 485 CD2 HIS A 72 -5.452 16.510 19.279 1.00 13.68 C ATOM 486 CE1 HIS A 72 -5.385 15.377 21.159 1.00 14.08 C ATOM 487 NE2 HIS A 72 -5.783 15.327 19.899 1.00 14.62 N ATOM 488 N ARG A 73 -3.636 21.537 20.672 1.00 15.06 N ATOM 489 CA ARG A 73 -2.976 22.770 20.303 1.00 16.09 C ATOM 490 C ARG A 73 -2.199 22.415 19.054 1.00 16.56 C ATOM 491 O ARG A 73 -1.384 23.185 18.566 1.00 17.07 O ATOM 492 CB ARG A 73 -2.046 23.239 21.409 1.00 15.90 C ATOM 493 CG ARG A 73 -2.662 24.250 22.333 1.00 16.88 C ATOM 494 CD ARG A 73 -1.573 25.075 23.007 1.00 17.46 C ATOM 495 NE ARG A 73 -1.740 25.153 24.452 1.00 17.34 N ATOM 496 CZ ARG A 73 -2.809 25.657 25.054 1.00 17.47 C ATOM 497 NH1 ARG A 73 -3.827 26.117 24.339 1.00 17.34 N ATOM 498 NH2 ARG A 73 -2.863 25.694 26.376 1.00 17.25 N ATOM 499 N GLN A 74 -2.469 21.216 18.559 1.00 16.92 N ATOM 500 CA GLN A 74 -1.896 20.740 17.316 1.00 17.45 C ATOM 501 C GLN A 74 -2.898 20.935 16.193 1.00 17.65 C ATOM 502 O GLN A 74 -2.551 20.757 15.023 1.00 17.85 O ATOM 503 CB GLN A 74 -1.625 19.236 17.400 1.00 17.35 C ATOM 504 CG GLN A 74 -0.181 18.801 17.638 1.00 17.67 C ATOM 505 CD GLN A 74 -0.080 17.350 18.146 1.00 18.37 C ATOM 506 OE1 GLN A 74 -0.796 16.469 17.679 1.00 18.62 O ATOM 507 NE2 GLN A 74 0.802 17.114 19.113 1.00 17.89 N ATOM 508 N GLY A 75 -4.161 21.234 16.499 1.00 17.57 N ATOM 509 CA GLY A 75 -5.096 20.839 15.456 1.00 17.39 C ATOM 510 C GLY A 75 -6.015 19.703 15.850 1.00 17.43 C ATOM 511 O GLY A 75 -5.626 18.823 16.630 1.00 17.86 O ATOM 512 N TYR A 76 -7.232 19.722 15.305 1.00 17.05 N ATOM 513 CA TYR A 76 -8.195 18.628 15.480 1.00 17.10 C ATOM 514 C TYR A 76 -7.721 17.349 14.763 1.00 17.21 C ATOM 515 O TYR A 76 -6.868 17.392 13.869 1.00 17.04 O ATOM 516 CB TYR A 76 -9.590 19.028 14.963 1.00 17.04 C ATOM 517 CG TYR A 76 -9.729 18.848 13.470 1.00 18.11 C ATOM 518 CD1 TYR A 76 -9.382 19.870 12.588 1.00 18.84 C ATOM 519 CD2 TYR A 76 -10.178 17.636 12.935 1.00 18.53 C ATOM 520 CE1 TYR A 76 -9.489 19.693 11.200 1.00 19.76 C ATOM 521 CE2 TYR A 76 -10.285 17.446 11.566 1.00 18.63 C ATOM 522 CZ TYR A 76 -9.941 18.473 10.701 1.00 19.53 C ATOM 523 OH TYR A 76 -10.055 18.275 9.339 1.00 19.76 O ATOM 524 N LEU A 77 -8.308 16.219 15.139 1.00 17.10 N ATOM 525 CA LEU A 77 -7.901 14.933 14.598 1.00 17.03 C ATOM 526 C LEU A 77 -9.048 13.950 14.666 1.00 16.27 C ATOM 527 O LEU A 77 -9.672 13.807 15.717 1.00 15.74 O ATOM 528 CB LEU A 77 -6.704 14.375 15.393 1.00 17.40 C ATOM 529 CG LEU A 77 -5.968 13.154 14.839 1.00 18.24 C ATOM 530 CD1 LEU A 77 -5.028 13.572 13.730 1.00 19.69 C ATOM 531 CD2 LEU A 77 -5.177 12.456 15.934 1.00 18.66 C ATOM 532 N TYR A 78 -9.328 13.300 13.535 1.00 15.33 N ATOM 533 CA TYR A 78 -10.065 12.043 13.523 1.00 15.07 C ATOM 534 C TYR A 78 -9.032 10.917 13.539 1.00 15.42 C ATOM 535 O TYR A 78 -8.143 10.880 12.690 1.00 15.84 O ATOM 536 CB TYR A 78 -10.961 11.935 12.282 1.00 14.44 C ATOM 537 CG TYR A 78 -12.347 12.540 12.440 1.00 13.67 C ATOM 538 CD1 TYR A 78 -12.742 13.658 11.694 1.00 12.68 C ATOM 539 CD2 TYR A 78 -13.262 11.994 13.345 1.00 12.62 C ATOM 540 CE1 TYR A 78 -14.023 14.211 11.848 1.00 11.86 C ATOM 541 CE2 TYR A 78 -14.524 12.532 13.513 1.00 12.29 C ATOM 542 CZ TYR A 78 -14.908 13.626 12.756 1.00 13.09 C ATOM 543 OH TYR A 78 -16.176 14.128 12.941 1.00 12.55 O ATOM 544 N SER A 79 -9.130 10.007 14.502 1.00 15.59 N ATOM 545 CA SER A 79 -8.170 8.904 14.601 1.00 15.90 C ATOM 546 C SER A 79 -8.836 7.603 15.040 1.00 16.16 C ATOM 547 O SER A 79 -9.864 7.631 15.711 1.00 16.33 O ATOM 548 CB SER A 79 -7.007 9.264 15.538 1.00 15.79 C ATOM 549 OG SER A 79 -7.465 9.595 16.842 1.00 15.96 O ATOM 550 N PRO A 80 -8.263 6.449 14.641 1.00 16.63 N ATOM 551 CA PRO A 80 -8.823 5.193 15.158 1.00 16.55 C ATOM 552 C PRO A 80 -8.320 4.881 16.565 1.00 16.89 C ATOM 553 O PRO A 80 -8.843 3.968 17.218 1.00 16.95 O ATOM 554 CB PRO A 80 -8.330 4.144 14.158 1.00 16.34 C ATOM 555 CG PRO A 80 -7.084 4.728 13.563 1.00 15.87 C ATOM 556 CD PRO A 80 -7.243 6.224 13.594 1.00 16.19 C ATOM 557 N ILE A 81 -7.325 5.654 17.017 1.00 16.99 N ATOM 558 CA ILE A 81 -6.696 5.487 18.331 1.00 16.95 C ATOM 559 C ILE A 81 -7.032 6.652 19.272 1.00 17.01 C ATOM 560 O ILE A 81 -7.007 7.819 18.866 1.00 17.50 O ATOM 561 CB ILE A 81 -5.136 5.364 18.201 1.00 17.00 C ATOM 562 CG1 ILE A 81 -4.730 4.082 17.457 1.00 16.46 C ATOM 563 CG2 ILE A 81 -4.453 5.432 19.568 1.00 16.75 C ATOM 564 CD1 ILE A 81 -5.072 2.780 18.180 1.00 16.03 C ATOM 565 N ASP A 82 -7.344 6.316 20.520 1.00 16.58 N ATOM 566 CA ASP A 82 -7.564 7.287 21.582 1.00 16.09 C ATOM 567 C ASP A 82 -6.214 7.731 22.172 1.00 16.14 C ATOM 568 O ASP A 82 -5.500 6.922 22.770 1.00 15.71 O ATOM 569 CB ASP A 82 -8.461 6.667 22.668 1.00 15.76 C ATOM 570 CG ASP A 82 -8.713 7.605 23.854 1.00 14.25 C ATOM 571 OD1 ASP A 82 -8.130 8.706 23.918 1.00 14.06 O ATOM 572 OD2 ASP A 82 -9.507 7.236 24.735 1.00 11.53 O ATOM 573 N PRO A 83 -5.874 9.025 22.025 1.00 16.28 N ATOM 574 CA PRO A 83 -4.610 9.577 22.528 1.00 16.45 C ATOM 575 C PRO A 83 -4.367 9.343 24.022 1.00 16.82 C ATOM 576 O PRO A 83 -3.205 9.270 24.442 1.00 16.42 O ATOM 577 CB PRO A 83 -4.750 11.082 22.249 1.00 16.37 C ATOM 578 CG PRO A 83 -5.662 11.155 21.070 1.00 16.74 C ATOM 579 CD PRO A 83 -6.679 10.060 21.350 1.00 16.76 C ATOM 580 N GLN A 84 -5.447 9.234 24.806 1.00 16.85 N ATOM 581 CA GLN A 84 -5.336 9.038 26.256 1.00 17.38 C ATOM 582 C GLN A 84 -4.976 7.606 26.635 1.00 16.93 C ATOM 583 O GLN A 84 -4.467 7.375 27.730 1.00 16.87 O ATOM 584 CB GLN A 84 -6.633 9.428 26.987 1.00 17.93 C ATOM 585 CG GLN A 84 -7.054 10.900 26.852 1.00 19.54 C ATOM 586 CD GLN A 84 -6.201 11.877 27.653 1.00 21.80 C ATOM 587 OE1 GLN A 84 -5.862 11.629 28.815 1.00 23.71 O ATOM 588 NE2 GLN A 84 -5.873 13.008 27.038 1.00 21.12 N ATOM 589 N THR A 85 -5.250 6.649 25.745 1.00 16.21 N ATOM 590 CA THR A 85 -5.024 5.236 26.057 1.00 15.56 C ATOM 591 C THR A 85 -4.013 4.549 25.136 1.00 15.11 C ATOM 592 O THR A 85 -3.502 3.476 25.478 1.00 15.48 O ATOM 593 CB THR A 85 -6.326 4.421 25.990 1.00 15.70 C ATOM 594 OG1 THR A 85 -6.885 4.514 24.664 1.00 15.52 O ATOM 595 CG2 THR A 85 -7.338 4.899 27.044 1.00 14.89 C ATOM 596 N ASN A 86 -3.739 5.166 23.982 1.00 14.21 N ATOM 597 CA ASN A 86 -2.967 4.555 22.882 1.00 13.13 C ATOM 598 C ASN A 86 -3.545 3.218 22.450 1.00 12.76 C ATOM 599 O ASN A 86 -2.821 2.302 22.058 1.00 12.75 O ATOM 600 CB ASN A 86 -1.477 4.435 23.217 1.00 13.12 C ATOM 601 CG ASN A 86 -0.739 5.753 23.082 1.00 12.12 C ATOM 602 OD1 ASN A 86 -1.343 6.805 22.854 1.00 9.73 O ATOM 603 ND2 ASN A 86 0.579 5.700 23.215 1.00 9.72 N ATOM 604 N LYS A 87 -4.868 3.140 22.543 1.00 12.12 N ATOM 605 CA LYS A 87 -5.659 1.977 22.183 1.00 11.49 C ATOM 606 C LYS A 87 -6.828 2.444 21.304 1.00 11.10 C ATOM 607 O LYS A 87 -7.153 3.635 21.281 1.00 10.79 O ATOM 608 CB LYS A 87 -6.196 1.290 23.445 1.00 11.42 C ATOM 609 CG LYS A 87 -5.144 0.590 24.296 1.00 12.26 C ATOM 610 CD LYS A 87 -5.785 -0.298 25.365 1.00 13.79 C ATOM 611 CE LYS A 87 -5.075 -1.639 25.504 1.00 15.05 C ATOM 612 NZ LYS A 87 -3.585 -1.535 25.623 1.00 16.44 N ATOM 613 N PRO A 88 -7.457 1.514 20.563 1.00 10.96 N ATOM 614 CA PRO A 88 -8.644 1.905 19.801 1.00 10.65 C ATOM 615 C PRO A 88 -9.746 2.466 20.706 1.00 10.56 C ATOM 616 O PRO A 88 -9.806 2.124 21.891 1.00 10.59 O ATOM 617 CB PRO A 88 -9.107 0.597 19.144 1.00 10.61 C ATOM 618 CG PRO A 88 -8.210 -0.478 19.637 1.00 10.79 C ATOM 619 CD PRO A 88 -7.009 0.142 20.259 1.00 10.64 C ATOM 620 N TRP A 89 -10.585 3.347 20.164 1.00 10.37 N ATOM 621 CA TRP A 89 -11.780 3.794 20.877 1.00 9.97 C ATOM 622 C TRP A 89 -12.656 2.577 21.083 1.00 10.37 C ATOM 623 O TRP A 89 -12.598 1.641 20.283 1.00 9.92 O ATOM 624 CB TRP A 89 -12.565 4.832 20.079 1.00 9.56 C ATOM 625 CG TRP A 89 -11.773 6.033 19.750 1.00 7.87 C ATOM 626 CD1 TRP A 89 -11.107 6.262 18.592 1.00 5.42 C ATOM 627 CD2 TRP A 89 -11.542 7.175 20.589 1.00 5.99 C ATOM 628 NE1 TRP A 89 -10.474 7.469 18.644 1.00 6.14 N ATOM 629 CE2 TRP A 89 -10.727 8.065 19.854 1.00 5.70 C ATOM 630 CE3 TRP A 89 -11.948 7.536 21.883 1.00 5.52 C ATOM 631 CZ2 TRP A 89 -10.292 9.304 20.370 1.00 3.52 C ATOM 632 CZ3 TRP A 89 -11.518 8.784 22.407 1.00 5.36 C ATOM 633 CH2 TRP A 89 -10.694 9.643 21.649 1.00 4.37 C ATOM 634 N PRO A 90 -13.465 2.581 22.156 1.00 10.80 N ATOM 635 CA PRO A 90 -14.387 1.480 22.400 1.00 11.03 C ATOM 636 C PRO A 90 -15.344 1.355 21.219 1.00 11.45 C ATOM 637 O PRO A 90 -15.678 2.361 20.590 1.00 11.27 O ATOM 638 CB PRO A 90 -15.127 1.921 23.672 1.00 11.15 C ATOM 639 CG PRO A 90 -14.192 2.893 24.333 1.00 10.94 C ATOM 640 CD PRO A 90 -13.569 3.624 23.193 1.00 10.73 C ATOM 641 N ALA A 91 -15.750 0.131 20.896 1.00 11.90 N ATOM 642 CA ALA A 91 -16.643 -0.098 19.765 1.00 12.41 C ATOM 643 C ALA A 91 -17.992 0.567 20.012 1.00 12.73 C ATOM 644 O ALA A 91 -18.397 0.765 21.154 1.00 12.87 O ATOM 645 CB ALA A 91 -16.820 -1.590 19.505 1.00 12.16 C ATOM 646 N MET A 92 -18.661 0.922 18.926 1.00 13.28 N ATOM 647 CA MET A 92 -19.977 1.537 18.954 1.00 13.94 C ATOM 648 C MET A 92 -20.983 0.585 19.595 1.00 14.05 C ATOM 649 O MET A 92 -21.201 -0.504 19.081 1.00 14.23 O ATOM 650 CB MET A 92 -20.381 1.866 17.515 1.00 14.09 C ATOM 651 CG MET A 92 -21.829 2.213 17.284 1.00 15.15 C ATOM 652 SD MET A 92 -22.112 3.967 17.115 1.00 19.62 S ATOM 653 CE MET A 92 -21.089 4.441 15.718 1.00 18.19 C ATOM 654 N PRO A 93 -21.584 0.983 20.734 1.00 14.52 N ATOM 655 CA PRO A 93 -22.598 0.142 21.387 1.00 14.84 C ATOM 656 C PRO A 93 -23.816 -0.050 20.499 1.00 15.47 C ATOM 657 O PRO A 93 -24.174 0.854 19.747 1.00 15.83 O ATOM 658 CB PRO A 93 -22.982 0.947 22.632 1.00 14.59 C ATOM 659 CG PRO A 93 -21.787 1.814 22.901 1.00 14.27 C ATOM 660 CD PRO A 93 -21.260 2.177 21.539 1.00 14.46 C ATOM 661 N GLN A 94 -24.442 -1.219 20.588 1.00 15.96 N ATOM 662 CA GLN A 94 -25.600 -1.545 19.760 1.00 16.68 C ATOM 663 C GLN A 94 -26.747 -0.550 19.930 1.00 16.83 C ATOM 664 O GLN A 94 -27.406 -0.199 18.948 1.00 16.62 O ATOM 665 CB GLN A 94 -26.067 -2.992 20.005 1.00 16.89 C ATOM 666 CG GLN A 94 -25.108 -4.043 19.417 1.00 17.89 C ATOM 667 CD GLN A 94 -25.481 -5.498 19.738 1.00 19.48 C ATOM 668 OE1 GLN A 94 -26.455 -5.777 20.441 1.00 19.94 O ATOM 669 NE2 GLN A 94 -24.691 -6.429 19.217 1.00 19.32 N ATOM 670 N SER A 95 -26.968 -0.090 21.166 1.00 17.10 N ATOM 671 CA SER A 95 -28.041 0.867 21.460 1.00 16.89 C ATOM 672 C SER A 95 -27.818 2.156 20.687 1.00 17.43 C ATOM 673 O SER A 95 -28.747 2.686 20.081 1.00 18.00 O ATOM 674 CB SER A 95 -28.113 1.178 22.951 1.00 17.05 C ATOM 675 OG SER A 95 -27.128 2.133 23.328 1.00 15.35 O ATOM 676 N PHE A 96 -26.579 2.647 20.725 1.00 17.30 N ATOM 677 CA PHE A 96 -26.149 3.800 19.955 1.00 17.23 C ATOM 678 C PHE A 96 -26.454 3.589 18.467 1.00 17.69 C ATOM 679 O PHE A 96 -27.089 4.435 17.833 1.00 17.79 O ATOM 680 CB PHE A 96 -24.641 4.020 20.135 1.00 16.98 C ATOM 681 CG PHE A 96 -24.249 4.684 21.439 1.00 16.35 C ATOM 682 CD1 PHE A 96 -24.941 4.434 22.625 1.00 15.20 C ATOM 683 CD2 PHE A 96 -23.153 5.544 21.481 1.00 15.11 C ATOM 684 CE1 PHE A 96 -24.561 5.045 23.826 1.00 13.01 C ATOM 685 CE2 PHE A 96 -22.763 6.159 22.685 1.00 14.51 C ATOM 686 CZ PHE A 96 -23.468 5.902 23.857 1.00 13.03 C ATOM 687 N HIS A 97 -26.019 2.454 17.923 1.00 17.83 N ATOM 688 CA HIS A 97 -26.111 2.200 16.492 1.00 18.19 C ATOM 689 C HIS A 97 -27.557 2.063 16.008 1.00 18.38 C ATOM 690 O HIS A 97 -27.912 2.559 14.937 1.00 18.00 O ATOM 691 CB HIS A 97 -25.310 0.955 16.132 1.00 18.54 C ATOM 692 CG HIS A 97 -25.165 0.738 14.661 1.00 18.93 C ATOM 693 ND1 HIS A 97 -25.806 -0.281 13.992 1.00 19.54 N ATOM 694 CD2 HIS A 97 -24.450 1.410 13.728 1.00 19.51 C ATOM 695 CE1 HIS A 97 -25.494 -0.230 12.710 1.00 19.40 C ATOM 696 NE2 HIS A 97 -24.673 0.788 12.523 1.00 19.09 N ATOM 697 N ASN A 98 -28.384 1.393 16.807 1.00 18.53 N ATOM 698 CA ASN A 98 -29.777 1.188 16.454 1.00 18.70 C ATOM 699 C ASN A 98 -30.540 2.498 16.494 1.00 18.95 C ATOM 700 O ASN A 98 -31.278 2.819 15.562 1.00 18.88 O ATOM 701 CB ASN A 98 -30.434 0.151 17.366 1.00 18.72 C ATOM 702 CG ASN A 98 -29.810 -1.240 17.234 1.00 18.75 C ATOM 703 OD1 ASN A 98 -29.984 -2.089 18.115 1.00 19.71 O ATOM 704 ND2 ASN A 98 -29.085 -1.480 16.141 1.00 17.56 N ATOM 705 N LEU A 99 -30.346 3.262 17.566 1.00 19.01 N ATOM 706 CA LEU A 99 -31.037 4.537 17.712 1.00 19.20 C ATOM 707 C LEU A 99 -30.663 5.513 16.595 1.00 18.93 C ATOM 708 O LEU A 99 -31.534 6.138 16.002 1.00 19.10 O ATOM 709 CB LEU A 99 -30.775 5.163 19.085 1.00 18.83 C ATOM 710 CG LEU A 99 -31.296 6.595 19.238 1.00 19.00 C ATOM 711 CD1 LEU A 99 -32.808 6.633 19.449 1.00 18.51 C ATOM 712 CD2 LEU A 99 -30.581 7.258 20.376 1.00 20.19 C ATOM 713 N CYS A 100 -29.368 5.631 16.321 1.00 19.07 N ATOM 714 CA CYS A 100 -28.870 6.529 15.286 1.00 18.92 C ATOM 715 C CYS A 100 -29.513 6.228 13.937 1.00 19.09 C ATOM 716 O CYS A 100 -30.036 7.122 13.280 1.00 19.19 O ATOM 717 CB CYS A 100 -27.349 6.439 15.178 1.00 18.78 C ATOM 718 SG CYS A 100 -26.693 7.359 13.766 1.00 19.08 S ATOM 719 N GLN A 101 -29.489 4.960 13.543 1.00 19.48 N ATOM 720 CA GLN A 101 -30.041 4.543 12.266 1.00 20.09 C ATOM 721 C GLN A 101 -31.554 4.769 12.201 1.00 20.22 C ATOM 722 O GLN A 101 -32.068 5.210 11.172 1.00 20.09 O ATOM 723 CB GLN A 101 -29.678 3.088 11.973 1.00 20.27 C ATOM 724 CG GLN A 101 -28.194 2.878 11.638 1.00 21.79 C ATOM 725 CD GLN A 101 -27.943 1.706 10.688 1.00 23.21 C ATOM 726 OE1 GLN A 101 -26.910 1.651 10.008 1.00 23.41 O ATOM 727 NE2 GLN A 101 -28.890 0.774 10.627 1.00 23.61 N ATOM 728 N ARG A 102 -32.260 4.482 13.299 1.00 20.50 N ATOM 729 CA ARG A 102 -33.705 4.737 13.357 1.00 20.61 C ATOM 730 C ARG A 102 -33.995 6.227 13.196 1.00 20.31 C ATOM 731 O ARG A 102 -34.904 6.609 12.454 1.00 20.46 O ATOM 732 CB ARG A 102 -34.342 4.201 14.641 1.00 20.79 C ATOM 733 CG ARG A 102 -34.405 2.680 14.740 1.00 21.34 C ATOM 734 CD ARG A 102 -35.543 2.198 15.645 1.00 23.27 C ATOM 735 NE ARG A 102 -35.672 2.953 16.894 1.00 24.48 N ATOM 736 CZ ARG A 102 -36.652 3.820 17.156 1.00 24.40 C ATOM 737 NH1 ARG A 102 -37.602 4.058 16.259 1.00 24.62 N ATOM 738 NH2 ARG A 102 -36.685 4.456 18.317 1.00 23.90 N ATOM 739 N ALA A 103 -33.204 7.057 13.872 1.00 19.73 N ATOM 740 CA ALA A 103 -33.317 8.508 13.742 1.00 19.25 C ATOM 741 C ALA A 103 -33.079 8.974 12.297 1.00 18.90 C ATOM 742 O ALA A 103 -33.892 9.712 11.727 1.00 18.40 O ATOM 743 CB ALA A 103 -32.362 9.208 14.704 1.00 19.25 C ATOM 744 N ALA A 104 -31.965 8.535 11.718 1.00 18.49 N ATOM 745 CA ALA A 104 -31.577 8.947 10.375 1.00 18.37 C ATOM 746 C ALA A 104 -32.612 8.566 9.303 1.00 18.34 C ATOM 747 O ALA A 104 -32.846 9.340 8.374 1.00 18.13 O ATOM 748 CB ALA A 104 -30.199 8.403 10.024 1.00 18.00 C ATOM 749 N THR A 105 -33.229 7.389 9.444 1.00 18.38 N ATOM 750 CA THR A 105 -34.271 6.933 8.508 1.00 18.57 C ATOM 751 C THR A 105 -35.550 7.765 8.664 1.00 18.81 C ATOM 752 O THR A 105 -36.225 8.073 7.672 1.00 19.05 O ATOM 753 CB THR A 105 -34.615 5.418 8.668 1.00 18.42 C ATOM 754 OG1 THR A 105 -33.416 4.646 8.782 1.00 17.95 O ATOM 755 CG2 THR A 105 -35.411 4.910 7.473 1.00 18.59 C ATOM 756 N ALA A 106 -35.873 8.123 9.907 1.00 18.67 N ATOM 757 CA ALA A 106 -37.042 8.944 10.205 1.00 18.69 C ATOM 758 C ALA A 106 -36.858 10.355 9.661 1.00 18.99 C ATOM 759 O ALA A 106 -37.840 11.052 9.367 1.00 19.26 O ATOM 760 CB ALA A 106 -37.314 8.980 11.729 1.00 18.30 C ATOM 761 N ALA A 107 -35.599 10.765 9.526 1.00 18.95 N ATOM 762 CA ALA A 107 -35.268 12.111 9.080 1.00 19.41 C ATOM 763 C ALA A 107 -35.057 12.199 7.564 1.00 19.78 C ATOM 764 O ALA A 107 -34.819 13.289 7.023 1.00 19.91 O ATOM 765 CB ALA A 107 -34.045 12.614 9.813 1.00 19.36 C ATOM 766 N GLY A 108 -35.144 11.057 6.884 1.00 19.65 N ATOM 767 CA GLY A 108 -35.045 11.033 5.429 1.00 19.51 C ATOM 768 C GLY A 108 -33.675 10.629 4.922 1.00 19.32 C ATOM 769 O GLY A 108 -33.352 10.840 3.757 1.00 19.33 O ATOM 770 N TYR A 109 -32.877 10.038 5.804 1.00 19.12 N ATOM 771 CA TYR A 109 -31.553 9.544 5.447 1.00 19.02 C ATOM 772 C TYR A 109 -31.456 8.030 5.682 1.00 19.03 C ATOM 773 O TYR A 109 -30.836 7.593 6.656 1.00 19.37 O ATOM 774 CB TYR A 109 -30.477 10.292 6.235 1.00 18.46 C ATOM 775 CG TYR A 109 -30.493 11.783 6.006 1.00 18.08 C ATOM 776 CD1 TYR A 109 -31.189 12.630 6.867 1.00 17.21 C ATOM 777 CD2 TYR A 109 -29.796 12.353 4.932 1.00 17.41 C ATOM 778 CE1 TYR A 109 -31.198 14.008 6.667 1.00 17.42 C ATOM 779 CE2 TYR A 109 -29.804 13.724 4.718 1.00 16.84 C ATOM 780 CZ TYR A 109 -30.507 14.547 5.591 1.00 16.72 C ATOM 781 OH TYR A 109 -30.520 15.908 5.388 1.00 16.00 O ATOM 782 N PRO A 110 -32.032 7.230 4.760 1.00 19.14 N ATOM 783 CA PRO A 110 -32.193 5.792 4.973 1.00 19.24 C ATOM 784 C PRO A 110 -30.880 5.024 4.972 1.00 19.37 C ATOM 785 O PRO A 110 -30.843 3.888 5.439 1.00 19.56 O ATOM 786 CB PRO A 110 -33.043 5.337 3.775 1.00 19.23 C ATOM 787 CG PRO A 110 -33.244 6.544 2.908 1.00 19.27 C ATOM 788 CD PRO A 110 -32.319 7.609 3.364 1.00 18.92 C ATOM 789 N ASP A 111 -29.814 5.639 4.470 1.00 19.35 N ATOM 790 CA ASP A 111 -28.575 4.908 4.225 1.00 19.70 C ATOM 791 C ASP A 111 -27.387 5.305 5.093 1.00 18.75 C ATOM 792 O ASP A 111 -26.254 4.874 4.840 1.00 18.53 O ATOM 793 CB ASP A 111 -28.214 4.971 2.735 1.00 20.17 C ATOM 794 CG ASP A 111 -28.979 3.964 1.929 1.00 22.55 C ATOM 795 OD1 ASP A 111 -28.949 2.772 2.318 1.00 25.63 O ATOM 796 OD2 ASP A 111 -29.613 4.351 0.917 1.00 24.85 O ATOM 797 N PHE A 112 -27.658 6.104 6.122 1.00 18.02 N ATOM 798 CA PHE A 112 -26.626 6.582 7.034 1.00 16.92 C ATOM 799 C PHE A 112 -25.969 5.417 7.762 1.00 16.37 C ATOM 800 O PHE A 112 -26.638 4.590 8.387 1.00 16.04 O ATOM 801 CB PHE A 112 -27.203 7.605 8.030 1.00 16.80 C ATOM 802 CG PHE A 112 -26.161 8.265 8.928 1.00 16.45 C ATOM 803 CD1 PHE A 112 -24.877 8.547 8.463 1.00 15.27 C ATOM 804 CD2 PHE A 112 -26.483 8.630 10.236 1.00 16.52 C ATOM 805 CE1 PHE A 112 -23.935 9.161 9.292 1.00 15.87 C ATOM 806 CE2 PHE A 112 -25.545 9.250 11.068 1.00 14.73 C ATOM 807 CZ PHE A 112 -24.268 9.511 10.596 1.00 14.44 C ATOM 808 N GLN A 113 -24.649 5.353 7.637 1.00 15.68 N ATOM 809 CA GLN A 113 -23.841 4.398 8.364 1.00 15.09 C ATOM 810 C GLN A 113 -22.762 5.129 9.161 1.00 14.33 C ATOM 811 O GLN A 113 -21.665 5.361 8.647 1.00 14.14 O ATOM 812 CB GLN A 113 -23.205 3.404 7.396 1.00 15.30 C ATOM 813 CG GLN A 113 -24.206 2.684 6.525 1.00 16.12 C ATOM 814 CD GLN A 113 -23.971 1.208 6.521 1.00 18.33 C ATOM 815 OE1 GLN A 113 -23.578 0.628 5.504 1.00 19.71 O ATOM 816 NE2 GLN A 113 -24.195 0.577 7.668 1.00 19.38 N ATOM 817 N PRO A 114 -23.067 5.502 10.420 1.00 13.56 N ATOM 818 CA PRO A 114 -22.054 6.151 11.247 1.00 12.87 C ATOM 819 C PRO A 114 -20.835 5.252 11.469 1.00 12.22 C ATOM 820 O PRO A 114 -20.976 4.034 11.564 1.00 12.35 O ATOM 821 CB PRO A 114 -22.784 6.385 12.571 1.00 12.82 C ATOM 822 CG PRO A 114 -23.852 5.391 12.594 1.00 13.44 C ATOM 823 CD PRO A 114 -24.312 5.284 11.172 1.00 13.45 C ATOM 824 N ASP A 115 -19.652 5.858 11.511 1.00 11.19 N ATOM 825 CA ASP A 115 -18.423 5.161 11.884 1.00 10.47 C ATOM 826 C ASP A 115 -17.768 5.890 13.065 1.00 9.56 C ATOM 827 O ASP A 115 -16.625 5.611 13.443 1.00 9.31 O ATOM 828 CB ASP A 115 -17.458 5.062 10.686 1.00 10.60 C ATOM 829 CG ASP A 115 -17.087 6.421 10.098 1.00 11.50 C ATOM 830 OD1 ASP A 115 -17.460 7.477 10.666 1.00 12.26 O ATOM 831 OD2 ASP A 115 -16.410 6.429 9.049 1.00 13.16 O ATOM 832 N ALA A 116 -18.520 6.826 13.634 1.00 8.31 N ATOM 833 CA ALA A 116 -18.006 7.752 14.613 1.00 7.57 C ATOM 834 C ALA A 116 -19.126 8.279 15.499 1.00 7.40 C ATOM 835 O ALA A 116 -20.172 8.696 15.010 1.00 7.17 O ATOM 836 CB ALA A 116 -17.303 8.903 13.924 1.00 7.14 C ATOM 837 N CYS A 117 -18.894 8.253 16.806 1.00 7.33 N ATOM 838 CA CYS A 117 -19.784 8.910 17.755 1.00 7.51 C ATOM 839 C CYS A 117 -18.964 9.687 18.784 1.00 7.28 C ATOM 840 O CYS A 117 -18.203 9.099 19.542 1.00 6.78 O ATOM 841 CB CYS A 117 -20.678 7.886 18.448 1.00 6.99 C ATOM 842 SG CYS A 117 -21.858 8.561 19.631 1.00 8.46 S ATOM 843 N LEU A 118 -19.110 11.009 18.794 1.00 7.73 N ATOM 844 CA LEU A 118 -18.504 11.826 19.838 1.00 7.85 C ATOM 845 C LEU A 118 -19.516 11.984 20.972 1.00 7.88 C ATOM 846 O LEU A 118 -20.684 12.297 20.734 1.00 8.19 O ATOM 847 CB LEU A 118 -18.080 13.199 19.304 1.00 7.87 C ATOM 848 CG LEU A 118 -17.522 14.115 20.406 1.00 9.04 C ATOM 849 CD1 LEU A 118 -16.013 13.957 20.605 1.00 9.34 C ATOM 850 CD2 LEU A 118 -17.870 15.559 20.167 1.00 10.67 C ATOM 851 N ILE A 119 -19.069 11.763 22.202 1.00 7.68 N ATOM 852 CA ILE A 119 -19.935 11.960 23.357 1.00 7.29 C ATOM 853 C ILE A 119 -19.490 13.217 24.068 1.00 7.40 C ATOM 854 O ILE A 119 -18.327 13.323 24.460 1.00 8.18 O ATOM 855 CB ILE A 119 -19.936 10.739 24.332 1.00 7.46 C ATOM 856 CG1 ILE A 119 -20.246 9.443 23.567 1.00 6.17 C ATOM 857 CG2 ILE A 119 -20.963 10.955 25.471 1.00 5.84 C ATOM 858 CD1 ILE A 119 -19.802 8.155 24.270 1.00 6.75 C ATOM 859 N ASN A 120 -20.410 14.172 24.202 1.00 6.70 N ATOM 860 CA ASN A 120 -20.187 15.393 24.986 1.00 6.55 C ATOM 861 C ASN A 120 -20.883 15.302 26.335 1.00 6.41 C ATOM 862 O ASN A 120 -22.007 14.807 26.419 1.00 6.26 O ATOM 863 CB ASN A 120 -20.754 16.610 24.251 1.00 6.07 C ATOM 864 CG ASN A 120 -20.051 16.882 22.944 1.00 7.21 C ATOM 865 OD1 ASN A 120 -18.841 17.102 22.917 1.00 9.38 O ATOM 866 ND2 ASN A 120 -20.806 16.892 21.853 1.00 5.69 N ATOM 867 N ARG A 121 -20.226 15.807 27.377 1.00 6.33 N ATOM 868 CA ARG A 121 -20.847 15.956 28.669 1.00 5.74 C ATOM 869 C ARG A 121 -20.681 17.406 29.136 1.00 5.84 C ATOM 870 O ARG A 121 -19.566 17.874 29.357 1.00 5.47 O ATOM 871 CB ARG A 121 -20.242 14.967 29.665 1.00 6.11 C ATOM 872 CG ARG A 121 -20.933 14.975 31.043 1.00 6.51 C ATOM 873 CD ARG A 121 -20.265 14.046 32.031 1.00 4.95 C ATOM 874 NE ARG A 121 -20.413 14.512 33.416 1.00 7.42 N ATOM 875 CZ ARG A 121 -20.890 13.784 34.429 1.00 7.90 C ATOM 876 NH1 ARG A 121 -21.278 12.525 34.240 1.00 7.80 N ATOM 877 NH2 ARG A 121 -20.956 14.315 35.648 1.00 7.29 N ATOM 878 N TYR A 122 -21.806 18.101 29.281 1.00 6.03 N ATOM 879 CA TYR A 122 -21.846 19.507 29.685 1.00 5.92 C ATOM 880 C TYR A 122 -22.269 19.630 31.143 1.00 6.28 C ATOM 881 O TYR A 122 -23.313 19.092 31.528 1.00 6.50 O ATOM 882 CB TYR A 122 -22.887 20.275 28.858 1.00 6.00 C ATOM 883 CG TYR A 122 -22.692 20.316 27.346 1.00 5.56 C ATOM 884 CD1 TYR A 122 -23.073 19.250 26.541 1.00 5.18 C ATOM 885 CD2 TYR A 122 -22.198 21.461 26.721 1.00 6.95 C ATOM 886 CE1 TYR A 122 -22.920 19.302 25.165 1.00 6.03 C ATOM 887 CE2 TYR A 122 -22.058 21.525 25.329 1.00 7.57 C ATOM 888 CZ TYR A 122 -22.415 20.445 24.568 1.00 6.48 C ATOM 889 OH TYR A 122 -22.266 20.496 23.204 1.00 9.89 O ATOM 890 N ALA A 123 -21.476 20.352 31.937 1.00 6.10 N ATOM 891 CA ALA A 123 -21.862 20.755 33.298 1.00 6.20 C ATOM 892 C ALA A 123 -22.507 22.141 33.245 1.00 6.21 C ATOM 893 O ALA A 123 -22.363 22.837 32.245 1.00 6.67 O ATOM 894 CB ALA A 123 -20.638 20.770 34.219 1.00 5.60 C ATOM 895 N PRO A 124 -23.235 22.549 34.303 1.00 6.36 N ATOM 896 CA PRO A 124 -23.778 23.904 34.270 1.00 6.76 C ATOM 897 C PRO A 124 -22.686 24.927 33.956 1.00 7.14 C ATOM 898 O PRO A 124 -21.558 24.805 34.438 1.00 6.71 O ATOM 899 CB PRO A 124 -24.301 24.111 35.697 1.00 6.77 C ATOM 900 CG PRO A 124 -24.613 22.761 36.180 1.00 6.38 C ATOM 901 CD PRO A 124 -23.712 21.792 35.475 1.00 6.45 C ATOM 902 N GLY A 125 -23.032 25.920 33.147 1.00 7.71 N ATOM 903 CA GLY A 125 -22.060 26.887 32.650 1.00 8.25 C ATOM 904 C GLY A 125 -21.329 26.470 31.376 1.00 8.18 C ATOM 905 O GLY A 125 -20.821 27.323 30.670 1.00 8.53 O ATOM 906 N ALA A 126 -21.267 25.173 31.076 1.00 8.37 N ATOM 907 CA ALA A 126 -20.531 24.688 29.887 1.00 8.83 C ATOM 908 C ALA A 126 -21.238 24.998 28.558 1.00 8.98 C ATOM 909 O ALA A 126 -22.470 25.018 28.481 1.00 9.09 O ATOM 910 CB ALA A 126 -20.221 23.189 29.994 1.00 8.25 C ATOM 911 N LYS A 127 -20.442 25.216 27.514 1.00 9.39 N ATOM 912 CA LYS A 127 -20.957 25.619 26.214 1.00 10.03 C ATOM 913 C LYS A 127 -20.143 25.018 25.060 1.00 10.31 C ATOM 914 O LYS A 127 -19.058 24.481 25.262 1.00 9.91 O ATOM 915 CB LYS A 127 -20.999 27.146 26.110 1.00 10.13 C ATOM 916 CG LYS A 127 -19.629 27.815 26.094 1.00 12.27 C ATOM 917 CD LYS A 127 -19.718 29.199 25.485 1.00 15.24 C ATOM 918 CE LYS A 127 -18.357 29.666 24.978 1.00 17.98 C ATOM 919 NZ LYS A 127 -17.472 30.102 26.103 1.00 19.47 N ATOM 920 N LEU A 128 -20.703 25.069 23.857 1.00 10.91 N ATOM 921 CA LEU A 128 -19.954 24.715 22.649 1.00 11.49 C ATOM 922 C LEU A 128 -20.152 25.821 21.623 1.00 11.35 C ATOM 923 O LEU A 128 -21.242 26.003 21.089 1.00 11.00 O ATOM 924 CB LEU A 128 -20.394 23.367 22.089 1.00 11.27 C ATOM 925 CG LEU A 128 -19.699 22.867 20.816 1.00 12.87 C ATOM 926 CD1 LEU A 128 -18.179 22.657 20.989 1.00 13.34 C ATOM 927 CD2 LEU A 128 -20.339 21.581 20.384 1.00 13.18 C ATOM 928 N SER A 129 -19.085 26.567 21.381 1.00 11.88 N ATOM 929 CA SER A 129 -19.119 27.723 20.501 1.00 12.28 C ATOM 930 C SER A 129 -19.591 27.387 19.084 1.00 12.39 C ATOM 931 O SER A 129 -19.342 26.304 18.569 1.00 12.34 O ATOM 932 CB SER A 129 -17.730 28.360 20.458 1.00 12.36 C ATOM 933 OG SER A 129 -17.483 29.078 21.651 1.00 14.17 O ATOM 934 N LEU A 130 -20.264 28.349 18.474 1.00 12.81 N ATOM 935 CA LEU A 130 -20.750 28.277 17.106 1.00 13.28 C ATOM 936 C LEU A 130 -19.632 27.797 16.174 1.00 13.26 C ATOM 937 O LEU A 130 -18.496 28.281 16.241 1.00 13.32 O ATOM 938 CB LEU A 130 -21.235 29.676 16.704 1.00 13.67 C ATOM 939 CG LEU A 130 -22.492 30.038 15.891 1.00 14.67 C ATOM 940 CD1 LEU A 130 -22.138 30.425 14.477 1.00 14.85 C ATOM 941 CD2 LEU A 130 -23.616 29.007 15.937 1.00 13.96 C ATOM 942 N HIS A 131 -19.964 26.826 15.329 1.00 12.73 N ATOM 943 CA HIS A 131 -19.005 26.177 14.453 1.00 12.54 C ATOM 944 C HIS A 131 -19.773 25.426 13.368 1.00 12.70 C ATOM 945 O HIS A 131 -20.986 25.229 13.480 1.00 12.28 O ATOM 946 CB HIS A 131 -18.170 25.164 15.250 1.00 12.32 C ATOM 947 CG HIS A 131 -18.965 23.985 15.717 1.00 11.04 C ATOM 948 ND1 HIS A 131 -19.784 24.036 16.823 1.00 10.39 N ATOM 949 CD2 HIS A 131 -19.104 22.738 15.203 1.00 9.59 C ATOM 950 CE1 HIS A 131 -20.382 22.867 16.982 1.00 10.39 C ATOM 951 NE2 HIS A 131 -19.991 22.064 16.011 1.00 9.00 N ATOM 952 N GLN A 132 -19.053 25.010 12.329 1.00 12.90 N ATOM 953 CA GLN A 132 -19.569 24.069 11.336 1.00 13.31 C ATOM 954 C GLN A 132 -18.931 22.709 11.568 1.00 13.49 C ATOM 955 O GLN A 132 -17.764 22.635 11.967 1.00 13.21 O ATOM 956 CB GLN A 132 -19.184 24.517 9.926 1.00 13.16 C ATOM 957 CG GLN A 132 -19.852 25.768 9.427 1.00 13.49 C ATOM 958 CD GLN A 132 -19.204 26.256 8.147 1.00 15.58 C ATOM 959 OE1 GLN A 132 -18.080 26.767 8.178 1.00 16.51 O ATOM 960 NE2 GLN A 132 -19.904 26.100 7.010 1.00 13.05 N ATOM 961 N ASP A 133 -19.688 21.639 11.327 1.00 13.76 N ATOM 962 CA ASP A 133 -19.098 20.310 11.220 1.00 14.11 C ATOM 963 C ASP A 133 -18.591 20.149 9.807 1.00 14.66 C ATOM 964 O ASP A 133 -19.348 19.747 8.928 1.00 15.20 O ATOM 965 CB ASP A 133 -20.118 19.210 11.535 1.00 14.14 C ATOM 966 CG ASP A 133 -20.452 19.133 13.013 1.00 13.62 C ATOM 967 OD1 ASP A 133 -20.148 20.114 13.717 1.00 14.14 O ATOM 968 OD2 ASP A 133 -20.996 18.096 13.465 1.00 10.13 O ATOM 969 N LYS A 134 -17.316 20.467 9.587 1.00 15.10 N ATOM 970 CA LYS A 134 -16.752 20.485 8.236 1.00 15.58 C ATOM 971 C LYS A 134 -15.522 19.583 8.072 1.00 15.75 C ATOM 972 O LYS A 134 -14.938 19.516 6.986 1.00 16.29 O ATOM 973 CB LYS A 134 -16.451 21.918 7.781 1.00 15.44 C ATOM 974 CG LYS A 134 -15.447 22.681 8.638 1.00 17.25 C ATOM 975 CD LYS A 134 -15.130 24.068 8.052 1.00 19.08 C ATOM 976 CE LYS A 134 -14.157 24.835 8.968 1.00 20.56 C ATOM 977 NZ LYS A 134 -13.763 26.176 8.436 1.00 19.90 N ATOM 978 N ALA A 135 -15.173 18.861 9.131 1.00 15.67 N ATOM 979 CA ALA A 135 -13.973 18.016 9.152 1.00 15.76 C ATOM 980 C ALA A 135 -14.122 16.697 8.374 1.00 15.56 C ATOM 981 O ALA A 135 -13.128 16.080 7.994 1.00 15.95 O ATOM 982 CB ALA A 135 -13.555 17.742 10.592 1.00 15.60 C ATOM 983 N GLU A 136 -15.359 16.279 8.136 1.00 15.30 N ATOM 984 CA GLU A 136 -15.650 15.001 7.491 1.00 14.91 C ATOM 985 C GLU A 136 -15.569 15.141 5.971 1.00 14.89 C ATOM 986 O GLU A 136 -16.151 16.067 5.413 1.00 14.95 O ATOM 987 CB GLU A 136 -17.035 14.500 7.905 1.00 14.65 C ATOM 988 CG GLU A 136 -17.249 14.397 9.415 1.00 15.26 C ATOM 989 CD GLU A 136 -17.367 15.754 10.117 1.00 14.27 C ATOM 990 OE1 GLU A 136 -16.751 15.911 11.178 1.00 15.54 O ATOM 991 OE2 GLU A 136 -18.058 16.664 9.620 1.00 14.84 O ATOM 992 N PRO A 137 -14.845 14.223 5.297 1.00 14.75 N ATOM 993 CA PRO A 137 -14.643 14.334 3.853 1.00 14.61 C ATOM 994 C PRO A 137 -15.873 13.985 3.007 1.00 14.42 C ATOM 995 O PRO A 137 -15.976 14.462 1.884 1.00 15.27 O ATOM 996 CB PRO A 137 -13.501 13.346 3.582 1.00 14.00 C ATOM 997 CG PRO A 137 -13.646 12.327 4.630 1.00 14.96 C ATOM 998 CD PRO A 137 -14.122 13.065 5.861 1.00 14.70 C ATOM 999 N ASP A 138 -16.777 13.159 3.529 1.00 14.23 N ATOM 1000 CA ASP A 138 -17.978 12.745 2.799 1.00 14.11 C ATOM 1001 C ASP A 138 -19.204 13.499 3.329 1.00 13.88 C ATOM 1002 O ASP A 138 -19.826 13.094 4.313 1.00 13.79 O ATOM 1003 CB ASP A 138 -18.172 11.220 2.893 1.00 14.25 C ATOM 1004 CG ASP A 138 -19.177 10.671 1.863 1.00 16.01 C ATOM 1005 OD1 ASP A 138 -19.925 11.468 1.239 1.00 17.82 O ATOM 1006 OD2 ASP A 138 -19.213 9.427 1.673 1.00 15.09 O ATOM 1007 N LEU A 139 -19.540 14.599 2.662 1.00 13.55 N ATOM 1008 CA LEU A 139 -20.606 15.483 3.111 1.00 13.24 C ATOM 1009 C LEU A 139 -22.021 14.972 2.824 1.00 13.57 C ATOM 1010 O LEU A 139 -22.999 15.602 3.248 1.00 13.18 O ATOM 1011 CB LEU A 139 -20.411 16.899 2.539 1.00 12.71 C ATOM 1012 CG LEU A 139 -19.160 17.671 2.979 1.00 13.12 C ATOM 1013 CD1 LEU A 139 -19.078 19.003 2.264 1.00 14.01 C ATOM 1014 CD2 LEU A 139 -19.108 17.884 4.501 1.00 12.17 C ATOM 1015 N ARG A 140 -22.142 13.842 2.117 1.00 13.42 N ATOM 1016 CA ARG A 140 -23.469 13.230 1.886 1.00 13.80 C ATOM 1017 C ARG A 140 -24.084 12.643 3.174 1.00 13.71 C ATOM 1018 O ARG A 140 -25.305 12.526 3.295 1.00 13.70 O ATOM 1019 CB ARG A 140 -23.420 12.146 0.802 1.00 13.43 C ATOM 1020 CG ARG A 140 -22.853 12.591 -0.543 1.00 14.06 C ATOM 1021 CD ARG A 140 -22.570 11.396 -1.455 1.00 13.89 C ATOM 1022 NE ARG A 140 -21.688 10.404 -0.832 1.00 14.33 N ATOM 1023 CZ ARG A 140 -21.357 9.234 -1.382 1.00 14.44 C ATOM 1024 NH1 ARG A 140 -21.820 8.890 -2.583 1.00 13.74 N ATOM 1025 NH2 ARG A 140 -20.557 8.402 -0.728 1.00 14.70 N ATOM 1026 N ALA A 141 -23.236 12.254 4.119 1.00 13.85 N ATOM 1027 CA ALA A 141 -23.712 11.706 5.388 1.00 14.25 C ATOM 1028 C ALA A 141 -24.235 12.821 6.287 1.00 13.93 C ATOM 1029 O ALA A 141 -23.571 13.848 6.442 1.00 14.91 O ATOM 1030 CB ALA A 141 -22.613 10.926 6.086 1.00 13.94 C ATOM 1031 N PRO A 142 -25.429 12.635 6.866 1.00 13.61 N ATOM 1032 CA PRO A 142 -25.972 13.632 7.784 1.00 14.01 C ATOM 1033 C PRO A 142 -25.292 13.597 9.164 1.00 14.05 C ATOM 1034 O PRO A 142 -24.497 12.694 9.446 1.00 13.89 O ATOM 1035 CB PRO A 142 -27.434 13.202 7.922 1.00 13.86 C ATOM 1036 CG PRO A 142 -27.373 11.721 7.790 1.00 13.85 C ATOM 1037 CD PRO A 142 -26.313 11.461 6.751 1.00 13.35 C ATOM 1038 N ILE A 143 -25.590 14.594 9.992 1.00 14.40 N ATOM 1039 CA ILE A 143 -25.218 14.587 11.418 1.00 14.93 C ATOM 1040 C ILE A 143 -26.461 14.190 12.207 1.00 15.11 C ATOM 1041 O ILE A 143 -27.535 14.754 11.990 1.00 15.38 O ATOM 1042 CB ILE A 143 -24.750 15.992 11.931 1.00 14.83 C ATOM 1043 CG1 ILE A 143 -23.631 16.580 11.049 1.00 13.94 C ATOM 1044 CG2 ILE A 143 -24.344 15.935 13.422 1.00 15.49 C ATOM 1045 CD1 ILE A 143 -22.324 15.793 11.056 1.00 12.16 C ATOM 1046 N VAL A 144 -26.312 13.217 13.104 1.00 15.08 N ATOM 1047 CA VAL A 144 -27.372 12.850 14.027 1.00 14.68 C ATOM 1048 C VAL A 144 -26.951 13.249 15.438 1.00 14.88 C ATOM 1049 O VAL A 144 -25.889 12.856 15.915 1.00 15.27 O ATOM 1050 CB VAL A 144 -27.736 11.341 13.929 1.00 14.34 C ATOM 1051 CG1 VAL A 144 -28.787 10.971 14.944 1.00 13.29 C ATOM 1052 CG2 VAL A 144 -28.258 11.006 12.512 1.00 14.28 C ATOM 1053 N SER A 145 -27.800 14.028 16.101 1.00 14.76 N ATOM 1054 CA SER A 145 -27.412 14.738 17.308 1.00 14.50 C ATOM 1055 C SER A 145 -28.446 14.526 18.413 1.00 14.58 C ATOM 1056 O SER A 145 -29.575 15.022 18.315 1.00 14.26 O ATOM 1057 CB SER A 145 -27.225 16.220 16.999 1.00 14.23 C ATOM 1058 OG SER A 145 -26.532 16.883 18.049 1.00 15.41 O ATOM 1059 N VAL A 146 -28.038 13.782 19.448 1.00 14.37 N ATOM 1060 CA VAL A 146 -28.937 13.283 20.504 1.00 14.62 C ATOM 1061 C VAL A 146 -28.754 14.040 21.830 1.00 14.52 C ATOM 1062 O VAL A 146 -27.646 14.154 22.337 1.00 14.86 O ATOM 1063 CB VAL A 146 -28.718 11.751 20.759 1.00 14.22 C ATOM 1064 CG1 VAL A 146 -29.796 11.174 21.670 1.00 14.98 C ATOM 1065 CG2 VAL A 146 -28.670 10.974 19.450 1.00 14.75 C ATOM 1066 N SER A 147 -29.851 14.521 22.402 1.00 14.72 N ATOM 1067 CA SER A 147 -29.812 15.224 23.687 1.00 14.64 C ATOM 1068 C SER A 147 -30.241 14.324 24.814 1.00 14.66 C ATOM 1069 O SER A 147 -31.242 13.628 24.685 1.00 15.45 O ATOM 1070 CB SER A 147 -30.725 16.453 23.665 1.00 14.52 C ATOM 1071 OG SER A 147 -30.241 17.434 22.757 1.00 14.22 O ATOM 1072 N LEU A 148 -29.494 14.356 25.918 1.00 14.46 N ATOM 1073 CA LEU A 148 -29.861 13.655 27.149 1.00 14.34 C ATOM 1074 C LEU A 148 -29.615 14.499 28.409 1.00 14.41 C ATOM 1075 O LEU A 148 -28.623 15.230 28.495 1.00 14.33 O ATOM 1076 CB LEU A 148 -29.100 12.331 27.271 1.00 14.52 C ATOM 1077 CG LEU A 148 -29.278 11.276 26.176 1.00 14.95 C ATOM 1078 CD1 LEU A 148 -28.338 10.116 26.425 1.00 15.11 C ATOM 1079 CD2 LEU A 148 -30.713 10.794 26.093 1.00 14.05 C ATOM 1080 N GLY A 149 -30.520 14.391 29.384 1.00 14.00 N ATOM 1081 CA GLY A 149 -30.391 15.109 30.657 1.00 13.87 C ATOM 1082 C GLY A 149 -30.981 16.508 30.661 1.00 13.60 C ATOM 1083 O GLY A 149 -32.082 16.728 30.149 1.00 14.06 O ATOM 1084 N LEU A 150 -30.236 17.454 31.221 1.00 12.83 N ATOM 1085 CA LEU A 150 -30.659 18.854 31.293 1.00 12.70 C ATOM 1086 C LEU A 150 -30.956 19.499 29.924 1.00 12.65 C ATOM 1087 O LEU A 150 -30.338 19.138 28.917 1.00 13.07 O ATOM 1088 CB LEU A 150 -29.626 19.686 32.073 1.00 12.46 C ATOM 1089 CG LEU A 150 -29.450 19.376 33.563 1.00 11.89 C ATOM 1090 CD1 LEU A 150 -28.422 20.287 34.197 1.00 12.55 C ATOM 1091 CD2 LEU A 150 -30.768 19.530 34.287 1.00 13.46 C ATOM 1092 N PRO A 151 -31.902 20.466 29.889 1.00 12.51 N ATOM 1093 CA PRO A 151 -32.241 21.162 28.643 1.00 11.87 C ATOM 1094 C PRO A 151 -31.168 22.187 28.259 1.00 11.60 C ATOM 1095 O PRO A 151 -30.511 22.752 29.129 1.00 11.39 O ATOM 1096 CB PRO A 151 -33.561 21.858 28.984 1.00 12.09 C ATOM 1097 CG PRO A 151 -33.472 22.136 30.453 1.00 12.11 C ATOM 1098 CD PRO A 151 -32.662 21.001 31.046 1.00 12.57 C ATOM 1099 N ALA A 152 -30.972 22.395 26.961 1.00 10.86 N ATOM 1100 CA ALA A 152 -30.009 23.378 26.487 1.00 10.70 C ATOM 1101 C ALA A 152 -30.550 24.132 25.286 1.00 10.95 C ATOM 1102 O ALA A 152 -31.335 23.598 24.492 1.00 10.89 O ATOM 1103 CB ALA A 152 -28.673 22.717 26.137 1.00 10.21 C ATOM 1104 N ILE A 153 -30.126 25.382 25.157 1.00 10.95 N ATOM 1105 CA ILE A 153 -30.382 26.123 23.947 1.00 11.23 C ATOM 1106 C ILE A 153 -29.340 25.742 22.903 1.00 11.32 C ATOM 1107 O ILE A 153 -28.140 25.936 23.118 1.00 11.95 O ATOM 1108 CB ILE A 153 -30.368 27.650 24.187 1.00 11.32 C ATOM 1109 CG1 ILE A 153 -31.503 28.050 25.132 1.00 10.83 C ATOM 1110 CG2 ILE A 153 -30.438 28.403 22.837 1.00 11.44 C ATOM 1111 CD1 ILE A 153 -32.925 27.874 24.544 1.00 11.27 C ATOM 1112 N PHE A 154 -29.828 25.176 21.798 1.00 11.39 N ATOM 1113 CA PHE A 154 -29.053 24.839 20.603 1.00 11.16 C ATOM 1114 C PHE A 154 -29.260 25.927 19.550 1.00 10.83 C ATOM 1115 O PHE A 154 -30.382 26.179 19.117 1.00 10.80 O ATOM 1116 CB PHE A 154 -29.536 23.483 20.071 1.00 11.03 C ATOM 1117 CG PHE A 154 -28.807 22.981 18.827 1.00 12.12 C ATOM 1118 CD1 PHE A 154 -27.451 22.645 18.869 1.00 11.26 C ATOM 1119 CD2 PHE A 154 -29.507 22.789 17.623 1.00 12.30 C ATOM 1120 CE1 PHE A 154 -26.792 22.161 17.735 1.00 11.35 C ATOM 1121 CE2 PHE A 154 -28.861 22.311 16.485 1.00 11.85 C ATOM 1122 CZ PHE A 154 -27.497 21.990 16.543 1.00 11.86 C ATOM 1123 N GLN A 155 -28.185 26.597 19.168 1.00 10.49 N ATOM 1124 CA GLN A 155 -28.243 27.587 18.097 1.00 10.28 C ATOM 1125 C GLN A 155 -28.105 26.866 16.759 1.00 9.91 C ATOM 1126 O GLN A 155 -27.304 25.945 16.627 1.00 9.54 O ATOM 1127 CB GLN A 155 -27.127 28.626 18.252 1.00 10.24 C ATOM 1128 CG GLN A 155 -27.273 29.575 19.450 1.00 11.94 C ATOM 1129 CD GLN A 155 -25.995 30.354 19.709 1.00 12.88 C ATOM 1130 OE1 GLN A 155 -24.901 29.826 19.550 1.00 16.83 O ATOM 1131 NE2 GLN A 155 -26.127 31.606 20.098 1.00 13.49 N ATOM 1132 N PHE A 156 -28.903 27.267 15.779 1.00 9.66 N ATOM 1133 CA PHE A 156 -28.809 26.689 14.437 1.00 9.76 C ATOM 1134 C PHE A 156 -29.026 27.798 13.416 1.00 9.75 C ATOM 1135 O PHE A 156 -30.066 28.451 13.411 1.00 9.95 O ATOM 1136 CB PHE A 156 -29.829 25.565 14.259 1.00 9.54 C ATOM 1137 CG PHE A 156 -29.541 24.652 13.097 1.00 9.57 C ATOM 1138 CD1 PHE A 156 -28.621 23.619 13.215 1.00 9.54 C ATOM 1139 CD2 PHE A 156 -30.201 24.819 11.878 1.00 9.49 C ATOM 1140 CE1 PHE A 156 -28.364 22.761 12.140 1.00 9.50 C ATOM 1141 CE2 PHE A 156 -29.951 23.959 10.803 1.00 7.85 C ATOM 1142 CZ PHE A 156 -29.030 22.937 10.940 1.00 8.85 C ATOM 1143 N GLY A 157 -28.022 28.024 12.573 1.00 9.92 N ATOM 1144 CA GLY A 157 -28.024 29.157 11.645 1.00 9.67 C ATOM 1145 C GLY A 157 -27.999 28.735 10.192 1.00 9.25 C ATOM 1146 O GLY A 157 -28.723 27.830 9.800 1.00 9.21 O ATOM 1147 N GLY A 158 -27.159 29.410 9.409 1.00 9.19 N ATOM 1148 CA GLY A 158 -26.999 29.153 7.982 1.00 8.70 C ATOM 1149 C GLY A 158 -25.548 28.870 7.629 1.00 8.52 C ATOM 1150 O GLY A 158 -24.743 28.575 8.504 1.00 8.28 O ATOM 1151 N LEU A 159 -25.232 28.989 6.338 1.00 8.57 N ATOM 1152 CA ALEU A 159 -23.900 28.675 5.810 0.50 8.19 C ATOM 1153 CA BLEU A 159 -23.893 28.696 5.796 0.50 8.39 C ATOM 1154 C LEU A 159 -22.816 29.649 6.283 1.00 8.27 C ATOM 1155 O LEU A 159 -21.662 29.262 6.440 1.00 8.06 O ATOM 1156 CB ALEU A 159 -23.944 28.642 4.276 0.50 7.87 C ATOM 1157 CB BLEU A 159 -23.920 28.743 4.264 0.50 8.19 C ATOM 1158 CG ALEU A 159 -22.688 28.147 3.568 0.50 7.03 C ATOM 1159 CG BLEU A 159 -24.415 27.471 3.599 0.50 8.27 C ATOM 1160 CD1ALEU A 159 -22.288 26.813 4.160 0.50 6.30 C ATOM 1161 CD1BLEU A 159 -24.355 27.571 2.079 0.50 7.89 C ATOM 1162 CD2ALEU A 159 -22.903 28.066 2.052 0.50 7.25 C ATOM 1163 CD2BLEU A 159 -23.577 26.326 4.121 0.50 8.32 C ATOM 1164 N LYS A 160 -23.188 30.908 6.485 1.00 8.66 N ATOM 1165 CA LYS A 160 -22.234 31.921 6.931 1.00 9.57 C ATOM 1166 C LYS A 160 -22.370 32.245 8.409 1.00 9.76 C ATOM 1167 O LYS A 160 -23.476 32.220 8.964 1.00 9.94 O ATOM 1168 CB LYS A 160 -22.303 33.200 6.081 1.00 9.94 C ATOM 1169 CG LYS A 160 -23.429 33.231 5.067 1.00 11.08 C ATOM 1170 CD LYS A 160 -23.400 34.494 4.227 1.00 12.97 C ATOM 1171 CE LYS A 160 -22.650 34.282 2.930 1.00 14.60 C ATOM 1172 NZ LYS A 160 -23.116 35.242 1.896 1.00 14.69 N ATOM 1173 N ARG A 161 -21.223 32.550 9.016 1.00 9.59 N ATOM 1174 CA ARG A 161 -21.100 32.834 10.442 1.00 9.58 C ATOM 1175 C ARG A 161 -22.190 33.757 10.978 1.00 9.14 C ATOM 1176 O ARG A 161 -22.755 33.493 12.040 1.00 9.17 O ATOM 1177 CB ARG A 161 -19.707 33.401 10.767 1.00 9.57 C ATOM 1178 CG ARG A 161 -19.434 33.527 12.269 1.00 9.59 C ATOM 1179 CD ARG A 161 -17.948 33.522 12.596 1.00 9.06 C ATOM 1180 NE ARG A 161 -17.338 32.202 12.426 1.00 9.36 N ATOM 1181 CZ ARG A 161 -17.261 31.265 13.371 1.00 8.93 C ATOM 1182 NH1 ARG A 161 -17.764 31.474 14.583 1.00 7.49 N ATOM 1183 NH2 ARG A 161 -16.674 30.107 13.099 1.00 8.85 N ATOM 1184 N ASN A 162 -22.489 34.814 10.226 1.00 8.78 N ATOM 1185 CA ASN A 162 -23.450 35.836 10.635 1.00 8.19 C ATOM 1186 C ASN A 162 -24.906 35.620 10.186 1.00 8.04 C ATOM 1187 O ASN A 162 -25.760 36.465 10.446 1.00 8.42 O ATOM 1188 CB ASN A 162 -22.964 37.212 10.167 1.00 8.27 C ATOM 1189 CG ASN A 162 -22.865 37.315 8.652 1.00 8.55 C ATOM 1190 OD1 ASN A 162 -22.815 36.301 7.943 1.00 8.35 O ATOM 1191 ND2 ASN A 162 -22.829 38.547 8.146 1.00 7.34 N ATOM 1192 N ASP A 163 -25.198 34.516 9.498 1.00 7.76 N ATOM 1193 CA ASP A 163 -26.581 34.210 9.120 1.00 7.35 C ATOM 1194 C ASP A 163 -27.466 34.139 10.359 1.00 7.55 C ATOM 1195 O ASP A 163 -27.014 33.676 11.412 1.00 7.85 O ATOM 1196 CB ASP A 163 -26.663 32.894 8.347 1.00 7.17 C ATOM 1197 CG ASP A 163 -26.396 33.065 6.850 1.00 6.47 C ATOM 1198 OD1 ASP A 163 -26.422 34.210 6.335 1.00 4.76 O ATOM 1199 OD2 ASP A 163 -26.173 32.036 6.187 1.00 4.36 O ATOM 1200 N PRO A 164 -28.726 34.600 10.251 1.00 7.58 N ATOM 1201 CA PRO A 164 -29.630 34.600 11.410 1.00 7.41 C ATOM 1202 C PRO A 164 -29.667 33.245 12.114 1.00 7.28 C ATOM 1203 O PRO A 164 -29.650 32.204 11.449 1.00 7.33 O ATOM 1204 CB PRO A 164 -31.003 34.932 10.800 1.00 7.53 C ATOM 1205 CG PRO A 164 -30.796 35.030 9.304 1.00 7.82 C ATOM 1206 CD PRO A 164 -29.341 35.232 9.070 1.00 7.57 C ATOM 1207 N LEU A 165 -29.710 33.265 13.447 1.00 6.74 N ATOM 1208 CA LEU A 165 -29.681 32.038 14.256 1.00 6.02 C ATOM 1209 C LEU A 165 -31.033 31.742 14.884 1.00 5.33 C ATOM 1210 O LEU A 165 -31.703 32.637 15.400 1.00 5.41 O ATOM 1211 CB LEU A 165 -28.642 32.141 15.380 1.00 6.11 C ATOM 1212 CG LEU A 165 -27.173 32.441 15.079 1.00 6.73 C ATOM 1213 CD1 LEU A 165 -26.427 32.697 16.384 1.00 7.36 C ATOM 1214 CD2 LEU A 165 -26.522 31.309 14.311 1.00 6.30 C ATOM 1215 N LYS A 166 -31.427 30.478 14.842 1.00 4.50 N ATOM 1216 CA LYS A 166 -32.613 30.024 15.544 1.00 3.63 C ATOM 1217 C LYS A 166 -32.153 29.478 16.893 1.00 2.92 C ATOM 1218 O LYS A 166 -31.231 28.656 16.941 1.00 2.33 O ATOM 1219 CB LYS A 166 -33.306 28.912 14.746 1.00 3.69 C ATOM 1220 CG LYS A 166 -34.007 29.355 13.457 1.00 4.14 C ATOM 1221 CD LYS A 166 -34.356 28.137 12.595 1.00 4.65 C ATOM 1222 CE LYS A 166 -35.783 28.187 12.066 1.00 5.04 C ATOM 1223 NZ LYS A 166 -36.000 29.302 11.097 1.00 4.28 N ATOM 1224 N ARG A 167 -32.752 29.961 17.980 1.00 2.27 N ATOM 1225 CA AARG A 167 -32.513 29.405 19.321 0.50 2.10 C ATOM 1226 CA BARG A 167 -32.486 29.371 19.283 0.50 2.04 C ATOM 1227 C ARG A 167 -33.535 28.313 19.583 1.00 2.00 C ATOM 1228 O ARG A 167 -34.730 28.600 19.690 1.00 2.14 O ATOM 1229 CB AARG A 167 -32.651 30.469 20.418 0.50 2.00 C ATOM 1230 CB BARG A 167 -32.380 30.443 20.373 0.50 2.00 C ATOM 1231 CG AARG A 167 -31.730 31.670 20.301 0.50 2.21 C ATOM 1232 CG BARG A 167 -31.003 31.111 20.394 0.50 2.00 C ATOM 1233 CD AARG A 167 -32.115 32.750 21.314 0.50 2.00 C ATOM 1234 CD BARG A 167 -31.047 32.576 20.827 0.50 2.00 C ATOM 1235 NE AARG A 167 -31.312 32.678 22.530 0.50 2.00 N ATOM 1236 NE BARG A 167 -29.799 33.257 20.484 0.50 2.00 N ATOM 1237 CZ AARG A 167 -31.762 32.278 23.713 0.50 2.00 C ATOM 1238 CZ BARG A 167 -29.577 33.873 19.326 0.50 2.00 C ATOM 1239 NH1AARG A 167 -33.024 31.912 23.866 0.50 2.00 N ATOM 1240 NH1BARG A 167 -30.521 33.908 18.398 0.50 2.00 N ATOM 1241 NH2AARG A 167 -30.945 32.251 24.751 0.50 2.00 N ATOM 1242 NH2BARG A 167 -28.411 34.454 19.092 0.50 2.16 N ATOM 1243 N LEU A 168 -33.069 27.075 19.682 1.00 2.00 N ATOM 1244 CA ALEU A 168 -33.943 25.937 19.918 0.50 2.00 C ATOM 1245 CA BLEU A 168 -33.939 25.927 19.915 0.50 2.00 C ATOM 1246 C LEU A 168 -33.686 25.358 21.302 1.00 2.00 C ATOM 1247 O LEU A 168 -32.541 25.159 21.691 1.00 2.00 O ATOM 1248 CB ALEU A 168 -33.710 24.875 18.845 0.50 2.00 C ATOM 1249 CB BLEU A 168 -33.678 24.843 18.869 0.50 2.00 C ATOM 1250 CG ALEU A 168 -33.832 25.380 17.401 0.50 2.00 C ATOM 1251 CG BLEU A 168 -34.318 24.886 17.473 0.50 2.00 C ATOM 1252 CD1ALEU A 168 -32.920 24.592 16.484 0.50 2.00 C ATOM 1253 CD1BLEU A 168 -34.674 26.283 16.995 0.50 2.00 C ATOM 1254 CD2ALEU A 168 -35.278 25.335 16.928 0.50 2.00 C ATOM 1255 CD2BLEU A 168 -33.371 24.209 16.496 0.50 2.00 C ATOM 1256 N LEU A 169 -34.754 25.099 22.045 1.00 2.00 N ATOM 1257 CA LEU A 169 -34.611 24.468 23.348 1.00 2.11 C ATOM 1258 C LEU A 169 -34.696 22.955 23.203 1.00 2.59 C ATOM 1259 O LEU A 169 -35.765 22.400 22.991 1.00 2.68 O ATOM 1260 CB LEU A 169 -35.636 25.003 24.359 1.00 2.00 C ATOM 1261 CG LEU A 169 -35.528 24.416 25.782 1.00 2.00 C ATOM 1262 CD1 LEU A 169 -34.232 24.844 26.490 1.00 2.00 C ATOM 1263 CD2 LEU A 169 -36.749 24.766 26.616 1.00 2.00 C ATOM 1264 N LEU A 170 -33.552 22.294 23.301 1.00 4.03 N ATOM 1265 CA LEU A 170 -33.482 20.831 23.166 1.00 4.82 C ATOM 1266 C LEU A 170 -33.589 20.190 24.529 1.00 5.38 C ATOM 1267 O LEU A 170 -32.886 20.588 25.452 1.00 5.66 O ATOM 1268 CB LEU A 170 -32.171 20.384 22.509 1.00 4.42 C ATOM 1269 CG LEU A 170 -31.820 20.881 21.101 1.00 5.97 C ATOM 1270 CD1 LEU A 170 -30.595 20.124 20.611 1.00 5.14 C ATOM 1271 CD2 LEU A 170 -32.989 20.708 20.115 1.00 6.98 C ATOM 1272 N GLU A 171 -34.446 19.177 24.634 1.00 6.47 N ATOM 1273 CA GLU A 171 -34.756 18.540 25.905 1.00 7.27 C ATOM 1274 C GLU A 171 -34.425 17.061 25.860 1.00 7.29 C ATOM 1275 O GLU A 171 -34.198 16.497 24.782 1.00 7.44 O ATOM 1276 CB GLU A 171 -36.230 18.770 26.279 1.00 7.55 C ATOM 1277 CG GLU A 171 -36.594 20.251 26.388 1.00 9.68 C ATOM 1278 CD GLU A 171 -38.027 20.501 26.813 1.00 12.31 C ATOM 1279 OE1 GLU A 171 -38.559 19.751 27.663 1.00 14.93 O ATOM 1280 OE2 GLU A 171 -38.623 21.474 26.311 1.00 14.27 O ATOM 1281 N HIS A 172 -34.377 16.451 27.043 1.00 6.99 N ATOM 1282 CA HIS A 172 -34.039 15.044 27.215 1.00 7.20 C ATOM 1283 C HIS A 172 -34.764 14.170 26.186 1.00 7.13 C ATOM 1284 O HIS A 172 -35.982 14.151 26.138 1.00 6.74 O ATOM 1285 CB HIS A 172 -34.408 14.613 28.639 1.00 6.91 C ATOM 1286 CG HIS A 172 -34.185 13.161 28.912 1.00 7.21 C ATOM 1287 ND1 HIS A 172 -32.937 12.633 29.163 1.00 7.30 N ATOM 1288 CD2 HIS A 172 -35.053 12.126 28.989 1.00 7.91 C ATOM 1289 CE1 HIS A 172 -33.045 11.336 29.380 1.00 6.82 C ATOM 1290 NE2 HIS A 172 -34.317 11.001 29.269 1.00 7.42 N ATOM 1291 N GLY A 173 -34.001 13.479 25.346 1.00 7.61 N ATOM 1292 CA GLY A 173 -34.581 12.604 24.317 1.00 8.10 C ATOM 1293 C GLY A 173 -34.708 13.193 22.922 1.00 8.13 C ATOM 1294 O GLY A 173 -34.921 12.449 21.961 1.00 8.64 O ATOM 1295 N ASP A 174 -34.602 14.519 22.804 1.00 8.09 N ATOM 1296 CA ASP A 174 -34.649 15.192 21.499 1.00 7.75 C ATOM 1297 C ASP A 174 -33.463 14.818 20.626 1.00 8.44 C ATOM 1298 O ASP A 174 -32.310 14.848 21.075 1.00 8.27 O ATOM 1299 CB ASP A 174 -34.662 16.715 21.654 1.00 7.20 C ATOM 1300 CG ASP A 174 -35.967 17.244 22.220 1.00 5.84 C ATOM 1301 OD1 ASP A 174 -36.018 18.460 22.495 1.00 2.19 O ATOM 1302 OD2 ASP A 174 -36.938 16.467 22.381 1.00 4.49 O ATOM 1303 N VAL A 175 -33.755 14.498 19.368 1.00 8.81 N ATOM 1304 CA VAL A 175 -32.727 14.202 18.390 1.00 9.18 C ATOM 1305 C VAL A 175 -32.833 15.183 17.218 1.00 9.23 C ATOM 1306 O VAL A 175 -33.918 15.372 16.658 1.00 8.85 O ATOM 1307 CB VAL A 175 -32.858 12.766 17.878 1.00 9.36 C ATOM 1308 CG1 VAL A 175 -31.823 12.486 16.772 1.00 9.62 C ATOM 1309 CG2 VAL A 175 -32.731 11.776 19.043 1.00 9.92 C ATOM 1310 N VAL A 176 -31.708 15.814 16.873 1.00 9.53 N ATOM 1311 CA VAL A 176 -31.650 16.730 15.731 1.00 9.51 C ATOM 1312 C VAL A 176 -30.863 16.053 14.614 1.00 9.64 C ATOM 1313 O VAL A 176 -29.872 15.373 14.860 1.00 9.83 O ATOM 1314 CB VAL A 176 -31.022 18.113 16.095 1.00 10.08 C ATOM 1315 CG1 VAL A 176 -31.122 19.081 14.925 1.00 8.04 C ATOM 1316 CG2 VAL A 176 -31.693 18.719 17.348 1.00 8.53 C ATOM 1317 N VAL A 177 -31.334 16.203 13.384 1.00 9.60 N ATOM 1318 CA VAL A 177 -30.693 15.548 12.249 1.00 9.34 C ATOM 1319 C VAL A 177 -30.607 16.600 11.185 1.00 9.27 C ATOM 1320 O VAL A 177 -31.618 17.210 10.842 1.00 9.53 O ATOM 1321 CB VAL A 177 -31.529 14.368 11.691 1.00 9.25 C ATOM 1322 CG1 VAL A 177 -30.794 13.696 10.518 1.00 9.36 C ATOM 1323 CG2 VAL A 177 -31.851 13.346 12.771 1.00 8.50 C ATOM 1324 N TRP A 178 -29.401 16.851 10.697 1.00 8.74 N ATOM 1325 CA TRP A 178 -29.238 17.747 9.564 1.00 8.57 C ATOM 1326 C TRP A 178 -28.274 17.172 8.531 1.00 8.63 C ATOM 1327 O TRP A 178 -27.422 16.349 8.862 1.00 8.87 O ATOM 1328 CB TRP A 178 -28.883 19.175 9.998 1.00 8.25 C ATOM 1329 CG TRP A 178 -27.569 19.381 10.683 1.00 7.57 C ATOM 1330 CD1 TRP A 178 -26.422 19.839 10.115 1.00 7.60 C ATOM 1331 CD2 TRP A 178 -27.275 19.176 12.076 1.00 6.80 C ATOM 1332 NE1 TRP A 178 -25.423 19.926 11.061 1.00 7.47 N ATOM 1333 CE2 TRP A 178 -25.923 19.531 12.275 1.00 6.70 C ATOM 1334 CE3 TRP A 178 -28.027 18.735 13.178 1.00 7.61 C ATOM 1335 CZ2 TRP A 178 -25.294 19.456 13.540 1.00 7.59 C ATOM 1336 CZ3 TRP A 178 -27.400 18.665 14.445 1.00 6.59 C ATOM 1337 CH2 TRP A 178 -26.052 19.016 14.606 1.00 5.96 C ATOM 1338 N GLY A 179 -28.439 17.600 7.282 1.00 8.33 N ATOM 1339 CA GLY A 179 -27.645 17.095 6.165 1.00 7.68 C ATOM 1340 C GLY A 179 -28.148 17.671 4.850 1.00 7.61 C ATOM 1341 O GLY A 179 -29.033 18.531 4.841 1.00 7.08 O ATOM 1342 N GLY A 180 -27.603 17.188 3.732 1.00 7.90 N ATOM 1343 CA GLY A 180 -27.926 17.756 2.421 1.00 8.00 C ATOM 1344 C GLY A 180 -27.624 19.250 2.416 1.00 8.37 C ATOM 1345 O GLY A 180 -26.503 19.660 2.715 1.00 8.14 O ATOM 1346 N GLU A 181 -28.632 20.064 2.112 1.00 8.51 N ATOM 1347 CA GLU A 181 -28.439 21.509 1.998 1.00 9.01 C ATOM 1348 C GLU A 181 -28.059 22.181 3.328 1.00 9.01 C ATOM 1349 O GLU A 181 -27.322 23.169 3.338 1.00 8.42 O ATOM 1350 CB GLU A 181 -29.673 22.170 1.375 1.00 9.44 C ATOM 1351 CG GLU A 181 -29.893 21.839 -0.119 1.00 11.24 C ATOM 1352 CD GLU A 181 -29.195 22.819 -1.066 1.00 14.92 C ATOM 1353 OE1 GLU A 181 -28.946 23.975 -0.661 1.00 17.44 O ATOM 1354 OE2 GLU A 181 -28.906 22.444 -2.229 1.00 16.95 O ATOM 1355 N SER A 182 -28.546 21.647 4.447 1.00 9.32 N ATOM 1356 CA SER A 182 -28.148 22.172 5.760 1.00 9.53 C ATOM 1357 C SER A 182 -26.905 21.508 6.371 1.00 9.48 C ATOM 1358 O SER A 182 -26.609 21.735 7.558 1.00 10.43 O ATOM 1359 CB SER A 182 -29.319 22.099 6.755 1.00 9.50 C ATOM 1360 OG SER A 182 -29.780 20.768 6.903 1.00 10.03 O ATOM 1361 N ARG A 183 -26.173 20.703 5.594 1.00 9.09 N ATOM 1362 CA ARG A 183 -25.124 19.837 6.174 1.00 9.08 C ATOM 1363 C ARG A 183 -23.994 20.595 6.866 1.00 9.27 C ATOM 1364 O ARG A 183 -23.507 20.172 7.928 1.00 8.98 O ATOM 1365 CB ARG A 183 -24.562 18.827 5.161 1.00 9.05 C ATOM 1366 CG ARG A 183 -23.343 18.004 5.652 1.00 9.36 C ATOM 1367 CD ARG A 183 -23.640 17.093 6.858 1.00 9.61 C ATOM 1368 NE ARG A 183 -22.469 16.288 7.226 1.00 8.81 N ATOM 1369 CZ ARG A 183 -21.400 16.736 7.894 1.00 6.59 C ATOM 1370 NH1 ARG A 183 -21.317 18.001 8.294 1.00 4.50 N ATOM 1371 NH2 ARG A 183 -20.397 15.912 8.149 1.00 4.69 N ATOM 1372 N LEU A 184 -23.604 21.715 6.265 1.00 9.20 N ATOM 1373 CA LEU A 184 -22.510 22.532 6.763 1.00 9.09 C ATOM 1374 C LEU A 184 -23.001 23.762 7.544 1.00 9.16 C ATOM 1375 O LEU A 184 -22.271 24.737 7.695 1.00 9.11 O ATOM 1376 CB LEU A 184 -21.626 22.964 5.582 1.00 8.81 C ATOM 1377 CG LEU A 184 -20.739 21.892 4.937 1.00 8.10 C ATOM 1378 CD1 LEU A 184 -20.045 22.429 3.708 1.00 6.23 C ATOM 1379 CD2 LEU A 184 -19.701 21.362 5.919 1.00 6.25 C ATOM 1380 N PHE A 185 -24.232 23.719 8.040 1.00 9.36 N ATOM 1381 CA PHE A 185 -24.805 24.883 8.728 1.00 9.40 C ATOM 1382 C PHE A 185 -24.141 25.143 10.082 1.00 9.79 C ATOM 1383 O PHE A 185 -23.736 24.197 10.779 1.00 10.02 O ATOM 1384 CB PHE A 185 -26.335 24.774 8.810 1.00 9.21 C ATOM 1385 CG PHE A 185 -27.053 25.231 7.541 1.00 10.13 C ATOM 1386 CD1 PHE A 185 -28.417 25.504 7.558 1.00 10.37 C ATOM 1387 CD2 PHE A 185 -26.353 25.422 6.349 1.00 8.54 C ATOM 1388 CE1 PHE A 185 -29.079 25.933 6.402 1.00 10.08 C ATOM 1389 CE2 PHE A 185 -27.007 25.852 5.193 1.00 10.43 C ATOM 1390 CZ PHE A 185 -28.369 26.110 5.219 1.00 10.66 C ATOM 1391 N TYR A 186 -23.981 26.425 10.423 1.00 9.58 N ATOM 1392 CA TYR A 186 -23.410 26.828 11.712 1.00 9.44 C ATOM 1393 C TYR A 186 -24.376 26.484 12.830 1.00 9.34 C ATOM 1394 O TYR A 186 -25.589 26.604 12.655 1.00 9.14 O ATOM 1395 CB TYR A 186 -23.104 28.331 11.748 1.00 9.21 C ATOM 1396 CG TYR A 186 -21.761 28.700 11.168 1.00 10.52 C ATOM 1397 CD1 TYR A 186 -20.606 28.672 11.955 1.00 11.52 C ATOM 1398 CD2 TYR A 186 -21.643 29.073 9.827 1.00 11.19 C ATOM 1399 CE1 TYR A 186 -19.368 29.001 11.419 1.00 12.29 C ATOM 1400 CE2 TYR A 186 -20.411 29.405 9.285 1.00 12.32 C ATOM 1401 CZ TYR A 186 -19.283 29.367 10.083 1.00 12.49 C ATOM 1402 OH TYR A 186 -18.070 29.692 9.537 1.00 13.38 O ATOM 1403 N HIS A 187 -23.831 26.087 13.979 1.00 8.71 N ATOM 1404 CA HIS A 187 -24.638 25.631 15.092 1.00 8.65 C ATOM 1405 C HIS A 187 -23.804 25.581 16.375 1.00 8.56 C ATOM 1406 O HIS A 187 -22.563 25.660 16.327 1.00 8.49 O ATOM 1407 CB HIS A 187 -25.238 24.257 14.787 1.00 8.65 C ATOM 1408 CG HIS A 187 -24.218 23.173 14.676 1.00 10.19 C ATOM 1409 ND1 HIS A 187 -23.511 22.936 13.514 1.00 9.41 N ATOM 1410 CD2 HIS A 187 -23.767 22.276 15.587 1.00 10.23 C ATOM 1411 CE1 HIS A 187 -22.669 21.937 13.714 1.00 10.43 C ATOM 1412 NE2 HIS A 187 -22.809 21.514 14.961 1.00 12.04 N ATOM 1413 N GLY A 188 -24.473 25.430 17.517 1.00 7.80 N ATOM 1414 CA GLY A 188 -23.764 25.450 18.783 1.00 7.43 C ATOM 1415 C GLY A 188 -24.670 25.350 19.984 1.00 7.26 C ATOM 1416 O GLY A 188 -25.894 25.288 19.840 1.00 7.24 O ATOM 1417 N ILE A 189 -24.050 25.325 21.166 1.00 6.52 N ATOM 1418 CA ILE A 189 -24.749 25.203 22.435 1.00 6.38 C ATOM 1419 C ILE A 189 -24.400 26.372 23.367 1.00 6.96 C ATOM 1420 O ILE A 189 -23.218 26.658 23.594 1.00 6.99 O ATOM 1421 CB ILE A 189 -24.440 23.831 23.112 1.00 5.96 C ATOM 1422 CG1 ILE A 189 -25.106 22.686 22.332 1.00 5.59 C ATOM 1423 CG2 ILE A 189 -24.883 23.815 24.568 1.00 3.58 C ATOM 1424 CD1 ILE A 189 -26.644 22.578 22.475 1.00 4.90 C ATOM 1425 N GLN A 190 -25.434 27.050 23.878 1.00 7.27 N ATOM 1426 CA GLN A 190 -25.261 28.188 24.807 1.00 7.72 C ATOM 1427 C GLN A 190 -24.961 27.650 26.211 1.00 7.52 C ATOM 1428 O GLN A 190 -25.306 26.512 26.495 1.00 7.03 O ATOM 1429 CB GLN A 190 -26.528 29.036 24.856 1.00 7.82 C ATOM 1430 CG GLN A 190 -26.680 30.042 23.718 1.00 10.27 C ATOM 1431 CD GLN A 190 -28.051 30.703 23.710 1.00 14.19 C ATOM 1432 OE1 GLN A 190 -28.835 30.549 24.654 1.00 16.93 O ATOM 1433 NE2 GLN A 190 -28.350 31.444 22.646 1.00 15.04 N ATOM 1434 N PRO A 191 -24.319 28.465 27.083 1.00 7.79 N ATOM 1435 CA PRO A 191 -23.983 28.029 28.457 1.00 8.37 C ATOM 1436 C PRO A 191 -25.146 27.356 29.166 1.00 8.89 C ATOM 1437 O PRO A 191 -26.226 27.942 29.296 1.00 8.43 O ATOM 1438 CB PRO A 191 -23.615 29.343 29.163 1.00 8.03 C ATOM 1439 CG PRO A 191 -23.032 30.160 28.084 1.00 8.10 C ATOM 1440 CD PRO A 191 -23.774 29.808 26.805 1.00 7.17 C ATOM 1441 N LEU A 192 -24.917 26.120 29.601 1.00 9.59 N ATOM 1442 CA LEU A 192 -25.960 25.320 30.227 1.00 10.69 C ATOM 1443 C LEU A 192 -26.395 25.909 31.565 1.00 11.77 C ATOM 1444 O LEU A 192 -25.558 26.201 32.432 1.00 12.12 O ATOM 1445 CB LEU A 192 -25.487 23.876 30.413 1.00 10.32 C ATOM 1446 CG LEU A 192 -26.517 22.810 30.758 1.00 9.99 C ATOM 1447 CD1 LEU A 192 -27.196 22.301 29.493 1.00 11.09 C ATOM 1448 CD2 LEU A 192 -25.829 21.676 31.474 1.00 9.29 C ATOM 1449 N LYS A 193 -27.706 26.091 31.716 1.00 12.56 N ATOM 1450 CA LYS A 193 -28.284 26.521 32.989 1.00 13.35 C ATOM 1451 C LYS A 193 -28.281 25.358 33.969 1.00 13.37 C ATOM 1452 O LYS A 193 -28.494 24.198 33.578 1.00 13.98 O ATOM 1453 CB LYS A 193 -29.711 27.037 32.797 1.00 13.58 C ATOM 1454 CG LYS A 193 -29.891 27.842 31.512 1.00 15.73 C ATOM 1455 CD LYS A 193 -30.720 29.105 31.705 1.00 19.48 C ATOM 1456 CE LYS A 193 -30.495 30.073 30.541 1.00 21.36 C ATOM 1457 NZ LYS A 193 -29.033 30.351 30.298 1.00 24.06 N ATOM 1458 N ALA A 194 -28.030 25.661 35.238 1.00 12.80 N ATOM 1459 CA ALA A 194 -28.098 24.648 36.275 1.00 12.41 C ATOM 1460 C ALA A 194 -29.527 24.119 36.358 1.00 12.26 C ATOM 1461 O ALA A 194 -30.488 24.849 36.105 1.00 12.29 O ATOM 1462 CB ALA A 194 -27.659 25.229 37.633 1.00 12.74 C ATOM 1463 N GLY A 195 -29.655 22.845 36.701 1.00 11.93 N ATOM 1464 CA GLY A 195 -30.947 22.233 36.949 1.00 11.98 C ATOM 1465 C GLY A 195 -30.753 20.821 37.449 1.00 12.39 C ATOM 1466 O GLY A 195 -29.632 20.397 37.740 1.00 12.51 O ATOM 1467 N PHE A 196 -31.850 20.084 37.529 1.00 12.99 N ATOM 1468 CA PHE A 196 -31.818 18.680 37.908 1.00 13.21 C ATOM 1469 C PHE A 196 -32.527 17.860 36.861 1.00 13.38 C ATOM 1470 O PHE A 196 -33.532 18.294 36.297 1.00 13.35 O ATOM 1471 CB PHE A 196 -32.516 18.469 39.256 1.00 13.41 C ATOM 1472 CG PHE A 196 -32.613 17.027 39.672 1.00 13.14 C ATOM 1473 CD1 PHE A 196 -31.562 16.414 40.346 1.00 12.94 C ATOM 1474 CD2 PHE A 196 -33.757 16.288 39.394 1.00 12.62 C ATOM 1475 CE1 PHE A 196 -31.650 15.084 40.740 1.00 13.79 C ATOM 1476 CE2 PHE A 196 -33.854 14.961 39.771 1.00 13.55 C ATOM 1477 CZ PHE A 196 -32.801 14.354 40.449 1.00 14.09 C ATOM 1478 N HIS A 197 -31.992 16.675 36.606 1.00 13.67 N ATOM 1479 CA HIS A 197 -32.672 15.691 35.796 1.00 14.20 C ATOM 1480 C HIS A 197 -32.482 14.340 36.478 1.00 14.64 C ATOM 1481 O HIS A 197 -31.370 14.035 36.914 1.00 14.99 O ATOM 1482 CB HIS A 197 -32.130 15.647 34.358 1.00 14.04 C ATOM 1483 CG HIS A 197 -32.994 14.843 33.437 1.00 13.84 C ATOM 1484 ND1 HIS A 197 -32.842 13.483 33.273 1.00 13.10 N ATOM 1485 CD2 HIS A 197 -34.069 15.196 32.690 1.00 13.84 C ATOM 1486 CE1 HIS A 197 -33.777 13.035 32.453 1.00 12.56 C ATOM 1487 NE2 HIS A 197 -34.533 14.054 32.082 1.00 11.95 N ATOM 1488 N PRO A 198 -33.558 13.531 36.574 1.00 14.74 N ATOM 1489 CA PRO A 198 -33.484 12.243 37.274 1.00 14.70 C ATOM 1490 C PRO A 198 -32.432 11.278 36.736 1.00 14.40 C ATOM 1491 O PRO A 198 -31.858 10.530 37.518 1.00 14.43 O ATOM 1492 CB PRO A 198 -34.877 11.632 37.057 1.00 14.57 C ATOM 1493 CG PRO A 198 -35.755 12.766 36.728 1.00 15.14 C ATOM 1494 CD PRO A 198 -34.907 13.784 36.034 1.00 14.77 C ATOM 1495 N LEU A 199 -32.178 11.296 35.425 1.00 14.31 N ATOM 1496 CA ALEU A 199 -31.321 10.278 34.800 0.50 13.99 C ATOM 1497 CA BLEU A 199 -31.322 10.280 34.799 0.50 14.00 C ATOM 1498 C LEU A 199 -29.862 10.710 34.661 1.00 13.89 C ATOM 1499 O LEU A 199 -28.973 9.868 34.514 1.00 14.30 O ATOM 1500 CB ALEU A 199 -31.890 9.825 33.447 0.50 13.87 C ATOM 1501 CB BLEU A 199 -31.890 9.857 33.443 0.50 13.93 C ATOM 1502 CG ALEU A 199 -33.280 9.172 33.462 0.50 13.86 C ATOM 1503 CG BLEU A 199 -31.756 8.377 33.082 0.50 13.83 C ATOM 1504 CD1ALEU A 199 -33.625 8.566 32.108 0.50 13.30 C ATOM 1505 CD1BLEU A 199 -32.263 7.493 34.217 0.50 14.29 C ATOM 1506 CD2ALEU A 199 -33.377 8.115 34.555 0.50 13.39 C ATOM 1507 CD2BLEU A 199 -32.513 8.079 31.798 0.50 13.79 C ATOM 1508 N THR A 200 -29.616 12.016 34.710 1.00 13.44 N ATOM 1509 CA THR A 200 -28.256 12.542 34.631 1.00 12.94 C ATOM 1510 C THR A 200 -27.842 13.382 35.854 1.00 13.51 C ATOM 1511 O THR A 200 -26.679 13.786 35.944 1.00 13.54 O ATOM 1512 CB THR A 200 -28.035 13.386 33.356 1.00 12.87 C ATOM 1513 OG1 THR A 200 -28.828 14.572 33.431 1.00 11.48 O ATOM 1514 CG2 THR A 200 -28.381 12.596 32.073 1.00 12.38 C ATOM 1515 N ILE A 201 -28.785 13.615 36.781 1.00 13.55 N ATOM 1516 CA ILE A 201 -28.606 14.443 38.003 1.00 13.67 C ATOM 1517 C ILE A 201 -28.473 15.959 37.731 1.00 14.10 C ATOM 1518 O ILE A 201 -29.377 16.736 38.062 1.00 14.41 O ATOM 1519 CB ILE A 201 -27.459 13.949 38.949 1.00 14.03 C ATOM 1520 CG1 ILE A 201 -27.500 12.429 39.142 1.00 12.97 C ATOM 1521 CG2 ILE A 201 -27.521 14.666 40.331 1.00 13.08 C ATOM 1522 CD1 ILE A 201 -26.177 11.855 39.632 1.00 12.19 C ATOM 1523 N ASP A 202 -27.367 16.379 37.125 1.00 13.43 N ATOM 1524 CA ASP A 202 -27.050 17.807 37.042 1.00 13.25 C ATOM 1525 C ASP A 202 -26.283 18.167 35.773 1.00 12.70 C ATOM 1526 O ASP A 202 -25.648 19.219 35.708 1.00 13.02 O ATOM 1527 CB ASP A 202 -26.220 18.223 38.270 1.00 13.16 C ATOM 1528 CG ASP A 202 -24.963 17.360 38.454 1.00 13.85 C ATOM 1529 OD1 ASP A 202 -24.514 17.194 39.603 1.00 13.14 O ATOM 1530 OD2 ASP A 202 -24.434 16.827 37.456 1.00 13.50 O ATOM 1531 N CYS A 203 -26.367 17.293 34.771 1.00 12.35 N ATOM 1532 CA ACYS A 203 -25.571 17.457 33.554 0.50 11.03 C ATOM 1533 CA BCYS A 203 -25.541 17.355 33.580 0.50 12.79 C ATOM 1534 C CYS A 203 -26.352 17.038 32.305 1.00 11.85 C ATOM 1535 O CYS A 203 -27.465 16.520 32.391 1.00 11.70 O ATOM 1536 CB ACYS A 203 -24.235 16.699 33.664 0.50 10.63 C ATOM 1537 CB BCYS A 203 -24.442 16.317 33.758 0.50 12.80 C ATOM 1538 SG ACYS A 203 -24.296 14.911 33.335 0.50 4.68 S ATOM 1539 SG BCYS A 203 -23.001 16.661 32.844 0.50 17.04 S ATOM 1540 N ARG A 204 -25.773 17.317 31.136 1.00 11.71 N ATOM 1541 CA ARG A 204 -26.388 17.009 29.860 1.00 11.05 C ATOM 1542 C ARG A 204 -25.400 16.239 29.003 1.00 11.03 C ATOM 1543 O ARG A 204 -24.231 16.637 28.880 1.00 10.85 O ATOM 1544 CB ARG A 204 -26.831 18.284 29.126 1.00 11.08 C ATOM 1545 CG ARG A 204 -27.174 18.048 27.631 1.00 10.10 C ATOM 1546 CD ARG A 204 -27.382 19.324 26.847 1.00 9.74 C ATOM 1547 NE ARG A 204 -27.915 19.074 25.506 1.00 9.17 N ATOM 1548 CZ ARG A 204 -27.195 19.128 24.379 1.00 9.25 C ATOM 1549 NH1 ARG A 204 -25.903 19.439 24.412 1.00 5.48 N ATOM 1550 NH2 ARG A 204 -27.771 18.870 23.210 1.00 7.56 N ATOM 1551 N TYR A 205 -25.866 15.137 28.422 1.00 10.69 N ATOM 1552 CA TYR A 205 -25.074 14.416 27.439 1.00 10.91 C ATOM 1553 C TYR A 205 -25.582 14.733 26.046 1.00 10.98 C ATOM 1554 O TYR A 205 -26.771 14.993 25.855 1.00 10.18 O ATOM 1555 CB TYR A 205 -25.129 12.896 27.653 1.00 11.24 C ATOM 1556 CG TYR A 205 -24.357 12.375 28.851 1.00 11.79 C ATOM 1557 CD1 TYR A 205 -25.032 11.820 29.942 1.00 11.73 C ATOM 1558 CD2 TYR A 205 -22.956 12.410 28.880 1.00 11.51 C ATOM 1559 CE1 TYR A 205 -24.341 11.328 31.040 1.00 13.46 C ATOM 1560 CE2 TYR A 205 -22.251 11.913 29.975 1.00 13.16 C ATOM 1561 CZ TYR A 205 -22.952 11.383 31.056 1.00 13.60 C ATOM 1562 OH TYR A 205 -22.278 10.900 32.148 1.00 15.43 O ATOM 1563 N ASN A 206 -24.662 14.698 25.079 1.00 11.61 N ATOM 1564 CA ASN A 206 -25.005 14.735 23.652 1.00 11.54 C ATOM 1565 C ASN A 206 -24.225 13.648 22.926 1.00 11.83 C ATOM 1566 O ASN A 206 -23.027 13.459 23.168 1.00 12.00 O ATOM 1567 CB ASN A 206 -24.744 16.127 23.067 1.00 11.46 C ATOM 1568 CG ASN A 206 -24.409 16.106 21.565 1.00 12.16 C ATOM 1569 OD1 ASN A 206 -23.251 15.940 21.172 1.00 10.48 O ATOM 1570 ND2 ASN A 206 -25.418 16.316 20.734 1.00 12.43 N ATOM 1571 N LEU A 207 -24.921 12.902 22.076 1.00 11.95 N ATOM 1572 CA LEU A 207 -24.273 11.977 21.156 1.00 11.71 C ATOM 1573 C LEU A 207 -24.254 12.601 19.765 1.00 11.53 C ATOM 1574 O LEU A 207 -25.304 12.964 19.225 1.00 12.13 O ATOM 1575 CB LEU A 207 -25.020 10.636 21.122 1.00 12.13 C ATOM 1576 CG LEU A 207 -25.380 9.913 22.426 1.00 11.33 C ATOM 1577 CD1 LEU A 207 -26.155 8.638 22.109 1.00 12.52 C ATOM 1578 CD2 LEU A 207 -24.140 9.589 23.223 1.00 11.00 C ATOM 1579 N THR A 208 -23.067 12.754 19.197 1.00 11.27 N ATOM 1580 CA THR A 208 -22.938 13.246 17.831 1.00 11.44 C ATOM 1581 C THR A 208 -22.438 12.115 16.932 1.00 11.57 C ATOM 1582 O THR A 208 -21.258 11.777 16.966 1.00 11.76 O ATOM 1583 CB THR A 208 -21.999 14.494 17.755 1.00 11.72 C ATOM 1584 OG1 THR A 208 -22.529 15.543 18.580 1.00 11.25 O ATOM 1585 CG2 THR A 208 -21.855 15.012 16.322 1.00 9.88 C ATOM 1586 N PHE A 209 -23.349 11.520 16.155 1.00 11.46 N ATOM 1587 CA PHE A 209 -22.993 10.460 15.206 1.00 11.31 C ATOM 1588 C PHE A 209 -22.603 11.048 13.870 1.00 11.06 C ATOM 1589 O PHE A 209 -23.272 11.945 13.350 1.00 10.60 O ATOM 1590 CB PHE A 209 -24.154 9.488 14.996 1.00 11.66 C ATOM 1591 CG PHE A 209 -24.617 8.806 16.247 1.00 12.69 C ATOM 1592 CD1 PHE A 209 -25.661 9.336 17.001 1.00 12.39 C ATOM 1593 CD2 PHE A 209 -24.026 7.618 16.666 1.00 13.42 C ATOM 1594 CE1 PHE A 209 -26.099 8.694 18.160 1.00 11.89 C ATOM 1595 CE2 PHE A 209 -24.469 6.976 17.822 1.00 13.68 C ATOM 1596 CZ PHE A 209 -25.498 7.520 18.572 1.00 12.01 C ATOM 1597 N ARG A 210 -21.517 10.532 13.306 1.00 11.47 N ATOM 1598 CA ARG A 210 -21.032 11.007 12.017 1.00 11.34 C ATOM 1599 C ARG A 210 -20.480 9.877 11.165 1.00 11.08 C ATOM 1600 O ARG A 210 -20.035 8.854 11.692 1.00 11.44 O ATOM 1601 CB ARG A 210 -19.948 12.080 12.216 1.00 11.79 C ATOM 1602 CG ARG A 210 -20.448 13.382 12.823 1.00 12.18 C ATOM 1603 CD ARG A 210 -19.389 14.464 12.813 1.00 13.58 C ATOM 1604 NE ARG A 210 -18.600 14.390 14.030 1.00 17.10 N ATOM 1605 CZ ARG A 210 -18.527 15.332 14.966 1.00 16.44 C ATOM 1606 NH1 ARG A 210 -19.165 16.492 14.838 1.00 15.07 N ATOM 1607 NH2 ARG A 210 -17.777 15.107 16.026 1.00 15.53 N ATOM 1608 N GLN A 211 -20.534 10.058 9.847 1.00 10.24 N ATOM 1609 CA GLN A 211 -19.625 9.341 8.963 1.00 9.77 C ATOM 1610 C GLN A 211 -18.384 10.218 8.798 1.00 9.35 C ATOM 1611 O GLN A 211 -18.424 11.263 8.147 1.00 8.70 O ATOM 1612 CB GLN A 211 -20.258 9.008 7.605 1.00 9.65 C ATOM 1613 CG GLN A 211 -19.355 8.156 6.714 1.00 9.48 C ATOM 1614 CD GLN A 211 -19.739 8.196 5.239 1.00 9.79 C ATOM 1615 OE1 GLN A 211 -18.874 8.286 4.366 1.00 10.66 O ATOM 1616 NE2 GLN A 211 -21.036 8.119 4.956 1.00 9.18 N ATOM 1617 N ALA A 212 -17.296 9.770 9.413 1.00 9.39 N ATOM 1618 CA ALA A 212 -16.055 10.522 9.500 1.00 9.87 C ATOM 1619 C ALA A 212 -14.989 10.021 8.528 1.00 10.19 C ATOM 1620 O ALA A 212 -14.070 10.767 8.184 1.00 10.20 O ATOM 1621 CB ALA A 212 -15.527 10.470 10.918 1.00 9.54 C ATOM 1622 N GLY A 213 -15.102 8.756 8.119 1.00 10.92 N ATOM 1623 CA GLY A 213 -14.246 8.178 7.077 1.00 12.05 C ATOM 1624 C GLY A 213 -14.982 7.958 5.757 1.00 13.07 C ATOM 1625 O GLY A 213 -15.948 8.658 5.440 1.00 12.87 O ATOM 1626 N LYS A 214 -14.526 6.972 4.991 1.00 14.64 N ATOM 1627 CA LYS A 214 -15.105 6.658 3.677 1.00 15.90 C ATOM 1628 C LYS A 214 -16.206 5.592 3.749 1.00 16.35 C ATOM 1629 O LYS A 214 -16.101 4.630 4.513 1.00 16.31 O ATOM 1630 CB LYS A 214 -14.016 6.229 2.682 1.00 16.10 C ATOM 1631 CG LYS A 214 -12.788 7.150 2.599 1.00 17.40 C ATOM 1632 CD LYS A 214 -13.136 8.616 2.326 1.00 19.10 C ATOM 1633 CE LYS A 214 -11.882 9.402 1.942 1.00 20.77 C ATOM 1634 NZ LYS A 214 -12.173 10.685 1.237 1.00 21.98 N ATOM 1635 N LYS A 215 -17.256 5.774 2.947 1.00 17.04 N ATOM 1636 CA LYS A 215 -18.409 4.868 2.950 1.00 17.56 C ATOM 1637 C LYS A 215 -18.178 3.643 2.062 1.00 18.20 C ATOM 1638 O LYS A 215 -17.504 3.730 1.032 1.00 18.36 O ATOM 1639 CB LYS A 215 -19.678 5.606 2.509 1.00 17.33 C ATOM 1640 CG LYS A 215 -20.969 4.881 2.855 1.00 17.02 C ATOM 1641 CD LYS A 215 -22.171 5.469 2.124 1.00 16.24 C ATOM 1642 CE LYS A 215 -23.474 5.130 2.840 1.00 15.92 C ATOM 1643 NZ LYS A 215 -23.490 3.739 3.377 1.00 15.64 N ATOM 1644 N GLU A 216 -18.752 2.512 2.477 1.00 18.88 N ATOM 1645 CA GLU A 216 -18.702 1.251 1.732 1.00 19.39 C ATOM 1646 C GLU A 216 -20.029 0.914 1.052 1.00 19.62 C ATOM 1647 O GLU A 216 -20.996 1.681 1.119 1.00 19.99 O ATOM 1648 CB GLU A 216 -18.301 0.109 2.660 1.00 19.48 C ATOM 1649 CG GLU A 216 -16.852 0.177 3.098 1.00 20.56 C ATOM 1650 CD GLU A 216 -16.485 -0.923 4.053 1.00 21.77 C ATOM 1651 OE1 GLU A 216 -17.283 -1.196 4.972 1.00 22.76 O ATOM 1652 OE2 GLU A 216 -15.395 -1.512 3.887 1.00 22.62 O TER 1653 GLU A 216 ATOM 1654 N GLU B 9 -40.093 12.658 -27.774 1.00 20.56 N ATOM 1655 CA GLU B 9 -39.023 13.571 -27.390 1.00 20.76 C ATOM 1656 C GLU B 9 -37.997 12.876 -26.502 1.00 20.05 C ATOM 1657 O GLU B 9 -37.528 11.783 -26.818 1.00 20.53 O ATOM 1658 CB GLU B 9 -39.596 14.796 -26.673 1.00 20.88 C ATOM 1659 CG GLU B 9 -41.028 14.622 -26.195 1.00 22.18 C ATOM 1660 CD GLU B 9 -41.946 15.721 -26.693 1.00 24.80 C ATOM 1661 OE1 GLU B 9 -41.434 16.775 -27.126 1.00 25.78 O ATOM 1662 OE2 GLU B 9 -43.180 15.531 -26.652 1.00 25.38 O ATOM 1663 N PRO B 10 -37.653 13.517 -25.390 1.00 19.31 N ATOM 1664 CA PRO B 10 -36.676 12.958 -24.449 1.00 18.55 C ATOM 1665 C PRO B 10 -37.347 12.119 -23.367 1.00 18.03 C ATOM 1666 O PRO B 10 -38.379 12.520 -22.827 1.00 17.52 O ATOM 1667 CB PRO B 10 -36.041 14.204 -23.830 1.00 18.38 C ATOM 1668 CG PRO B 10 -37.099 15.245 -23.924 1.00 18.78 C ATOM 1669 CD PRO B 10 -37.836 14.967 -25.202 1.00 19.34 C ATOM 1670 N TRP B 11 -36.762 10.967 -23.057 1.00 17.82 N ATOM 1671 CA TRP B 11 -37.308 10.080 -22.039 1.00 17.75 C ATOM 1672 C TRP B 11 -36.246 9.761 -20.986 1.00 18.01 C ATOM 1673 O TRP B 11 -35.112 10.248 -21.075 1.00 17.74 O ATOM 1674 CB TRP B 11 -37.904 8.804 -22.653 1.00 17.45 C ATOM 1675 CG TRP B 11 -36.903 7.904 -23.307 1.00 16.14 C ATOM 1676 CD1 TRP B 11 -36.317 6.809 -22.756 1.00 14.33 C ATOM 1677 CD2 TRP B 11 -36.378 8.016 -24.643 1.00 14.80 C ATOM 1678 NE1 TRP B 11 -35.460 6.229 -23.655 1.00 14.52 N ATOM 1679 CE2 TRP B 11 -35.474 6.947 -24.822 1.00 14.08 C ATOM 1680 CE3 TRP B 11 -36.586 8.912 -25.701 1.00 15.00 C ATOM 1681 CZ2 TRP B 11 -34.764 6.747 -26.013 1.00 14.17 C ATOM 1682 CZ3 TRP B 11 -35.875 8.719 -26.896 1.00 15.68 C ATOM 1683 CH2 TRP B 11 -34.978 7.635 -27.038 1.00 15.90 C ATOM 1684 N GLN B 12 -36.639 8.976 -19.983 1.00 18.03 N ATOM 1685 CA GLN B 12 -35.768 8.599 -18.874 1.00 18.60 C ATOM 1686 C GLN B 12 -35.480 7.120 -18.903 1.00 18.51 C ATOM 1687 O GLN B 12 -36.321 6.313 -19.320 1.00 18.07 O ATOM 1688 CB GLN B 12 -36.445 8.853 -17.531 1.00 18.87 C ATOM 1689 CG GLN B 12 -36.479 10.263 -17.062 1.00 20.25 C ATOM 1690 CD GLN B 12 -37.099 10.346 -15.686 1.00 22.21 C ATOM 1691 OE1 GLN B 12 -36.603 9.737 -14.730 1.00 23.84 O ATOM 1692 NE2 GLN B 12 -38.194 11.087 -15.574 1.00 23.30 N ATOM 1693 N GLU B 13 -34.302 6.780 -18.387 1.00 18.83 N ATOM 1694 CA GLU B 13 -33.900 5.407 -18.138 1.00 18.44 C ATOM 1695 C GLU B 13 -33.111 5.345 -16.824 1.00 18.12 C ATOM 1696 O GLU B 13 -31.922 5.650 -16.804 1.00 17.59 O ATOM 1697 CB GLU B 13 -33.044 4.918 -19.299 1.00 18.74 C ATOM 1698 CG GLU B 13 -32.693 3.456 -19.225 1.00 19.27 C ATOM 1699 CD GLU B 13 -31.812 3.019 -20.378 1.00 20.51 C ATOM 1700 OE1 GLU B 13 -31.046 2.057 -20.201 1.00 21.39 O ATOM 1701 OE2 GLU B 13 -31.890 3.624 -21.464 1.00 20.84 O ATOM 1702 N PRO B 14 -33.772 4.949 -15.716 1.00 18.53 N ATOM 1703 CA PRO B 14 -33.052 4.792 -14.445 1.00 18.24 C ATOM 1704 C PRO B 14 -31.901 3.784 -14.571 1.00 18.38 C ATOM 1705 O PRO B 14 -31.988 2.844 -15.376 1.00 17.96 O ATOM 1706 CB PRO B 14 -34.129 4.273 -13.490 1.00 18.48 C ATOM 1707 CG PRO B 14 -35.433 4.736 -14.090 1.00 18.67 C ATOM 1708 CD PRO B 14 -35.208 4.626 -15.577 1.00 18.43 C ATOM 1709 N LEU B 15 -30.842 3.997 -13.788 1.00 18.06 N ATOM 1710 CA LEU B 15 -29.617 3.194 -13.839 1.00 18.38 C ATOM 1711 C LEU B 15 -29.317 2.495 -12.516 1.00 18.46 C ATOM 1712 O LEU B 15 -29.049 1.291 -12.492 1.00 19.21 O ATOM 1713 CB LEU B 15 -28.429 4.093 -14.150 1.00 18.42 C ATOM 1714 CG LEU B 15 -27.866 4.223 -15.553 1.00 20.72 C ATOM 1715 CD1 LEU B 15 -27.100 5.535 -15.594 1.00 22.68 C ATOM 1716 CD2 LEU B 15 -26.938 3.063 -15.866 1.00 21.72 C ATOM 1717 N ALA B 16 -29.338 3.281 -11.436 1.00 17.64 N ATOM 1718 CA ALA B 16 -29.001 2.861 -10.079 1.00 17.00 C ATOM 1719 C ALA B 16 -29.560 3.945 -9.147 1.00 16.57 C ATOM 1720 O ALA B 16 -30.122 4.933 -9.632 1.00 16.95 O ATOM 1721 CB ALA B 16 -27.495 2.755 -9.929 1.00 16.92 C ATOM 1722 N ALA B 17 -29.423 3.777 -7.828 1.00 15.73 N ATOM 1723 CA ALA B 17 -29.906 4.799 -6.880 1.00 14.63 C ATOM 1724 C ALA B 17 -29.144 6.099 -7.115 1.00 13.97 C ATOM 1725 O ALA B 17 -27.916 6.104 -7.097 1.00 14.02 O ATOM 1726 CB ALA B 17 -29.740 4.337 -5.439 1.00 14.36 C ATOM 1727 N GLY B 18 -29.873 7.185 -7.372 1.00 13.13 N ATOM 1728 CA GLY B 18 -29.261 8.481 -7.669 1.00 11.90 C ATOM 1729 C GLY B 18 -28.787 8.681 -9.109 1.00 11.77 C ATOM 1730 O GLY B 18 -28.212 9.731 -9.428 1.00 11.91 O ATOM 1731 N ALA B 19 -29.037 7.695 -9.981 1.00 10.09 N ATOM 1732 CA ALA B 19 -28.509 7.708 -11.349 1.00 9.15 C ATOM 1733 C ALA B 19 -29.570 7.492 -12.439 1.00 8.35 C ATOM 1734 O ALA B 19 -30.352 6.540 -12.372 1.00 7.83 O ATOM 1735 CB ALA B 19 -27.373 6.684 -11.497 1.00 9.25 C ATOM 1736 N VAL B 20 -29.590 8.386 -13.429 1.00 7.72 N ATOM 1737 CA AVAL B 20 -30.536 8.299 -14.547 0.50 7.56 C ATOM 1738 CA BVAL B 20 -30.518 8.271 -14.559 0.50 7.63 C ATOM 1739 C VAL B 20 -29.857 8.605 -15.884 1.00 7.39 C ATOM 1740 O VAL B 20 -28.944 9.430 -15.944 1.00 7.28 O ATOM 1741 CB AVAL B 20 -31.712 9.313 -14.409 0.50 7.38 C ATOM 1742 CB BVAL B 20 -31.758 9.201 -14.430 0.50 7.46 C ATOM 1743 CG1AVAL B 20 -32.976 8.760 -15.061 0.50 6.73 C ATOM 1744 CG1BVAL B 20 -32.882 8.514 -13.688 0.50 8.37 C ATOM 1745 CG2AVAL B 20 -31.971 9.687 -12.957 0.50 8.06 C ATOM 1746 CG2BVAL B 20 -31.386 10.540 -13.801 0.50 7.06 C ATOM 1747 N ILE B 21 -30.325 7.953 -16.947 1.00 7.28 N ATOM 1748 CA ILE B 21 -29.998 8.390 -18.298 1.00 7.10 C ATOM 1749 C ILE B 21 -31.202 9.188 -18.774 1.00 7.23 C ATOM 1750 O ILE B 21 -32.336 8.674 -18.804 1.00 7.21 O ATOM 1751 CB ILE B 21 -29.713 7.229 -19.287 1.00 7.15 C ATOM 1752 CG1 ILE B 21 -28.588 6.319 -18.773 1.00 6.88 C ATOM 1753 CG2 ILE B 21 -29.353 7.788 -20.653 1.00 5.99 C ATOM 1754 CD1 ILE B 21 -28.164 5.235 -19.779 1.00 6.37 C ATOM 1755 N LEU B 22 -30.958 10.458 -19.090 1.00 7.05 N ATOM 1756 CA LEU B 22 -31.954 11.303 -19.724 1.00 6.89 C ATOM 1757 C LEU B 22 -31.763 11.177 -21.248 1.00 7.73 C ATOM 1758 O LEU B 22 -31.007 11.939 -21.866 1.00 7.68 O ATOM 1759 CB LEU B 22 -31.807 12.744 -19.252 1.00 6.41 C ATOM 1760 CG LEU B 22 -31.845 13.031 -17.734 1.00 6.69 C ATOM 1761 CD1 LEU B 22 -31.515 14.497 -17.452 1.00 4.35 C ATOM 1762 CD2 LEU B 22 -33.186 12.626 -17.086 1.00 5.18 C ATOM 1763 N ARG B 23 -32.429 10.192 -21.844 1.00 7.71 N ATOM 1764 CA ARG B 23 -32.234 9.909 -23.270 1.00 8.65 C ATOM 1765 C ARG B 23 -32.657 11.061 -24.181 1.00 9.54 C ATOM 1766 O ARG B 23 -33.788 11.557 -24.096 1.00 9.41 O ATOM 1767 CB ARG B 23 -32.932 8.613 -23.670 1.00 8.09 C ATOM 1768 CG ARG B 23 -32.381 7.366 -22.984 1.00 6.77 C ATOM 1769 CD ARG B 23 -31.057 6.922 -23.570 1.00 5.17 C ATOM 1770 NE ARG B 23 -30.753 5.556 -23.157 1.00 3.28 N ATOM 1771 CZ ARG B 23 -29.667 4.879 -23.499 1.00 4.31 C ATOM 1772 NH1 ARG B 23 -28.729 5.438 -24.260 1.00 5.72 N ATOM 1773 NH2 ARG B 23 -29.510 3.636 -23.065 1.00 4.35 N ATOM 1774 N ARG B 24 -31.716 11.479 -25.033 1.00 10.53 N ATOM 1775 CA ARG B 24 -31.901 12.551 -26.033 1.00 11.51 C ATOM 1776 C ARG B 24 -32.186 13.937 -25.444 1.00 11.78 C ATOM 1777 O ARG B 24 -32.579 14.854 -26.163 1.00 11.88 O ATOM 1778 CB ARG B 24 -32.980 12.184 -27.065 1.00 11.28 C ATOM 1779 CG ARG B 24 -32.912 10.757 -27.613 1.00 12.72 C ATOM 1780 CD ARG B 24 -31.623 10.427 -28.377 1.00 13.84 C ATOM 1781 NE ARG B 24 -31.725 9.103 -28.995 1.00 14.60 N ATOM 1782 CZ ARG B 24 -31.408 7.959 -28.393 1.00 15.24 C ATOM 1783 NH1 ARG B 24 -30.947 7.952 -27.139 1.00 14.98 N ATOM 1784 NH2 ARG B 24 -31.551 6.814 -29.046 1.00 12.52 N ATOM 1785 N PHE B 25 -31.964 14.087 -24.146 1.00 12.48 N ATOM 1786 CA PHE B 25 -32.276 15.328 -23.425 1.00 13.17 C ATOM 1787 C PHE B 25 -31.613 16.567 -24.050 1.00 13.63 C ATOM 1788 O PHE B 25 -32.205 17.653 -24.085 1.00 13.30 O ATOM 1789 CB PHE B 25 -31.876 15.188 -21.952 1.00 12.87 C ATOM 1790 CG PHE B 25 -32.382 16.300 -21.075 1.00 13.17 C ATOM 1791 CD1 PHE B 25 -33.668 16.252 -20.538 1.00 12.73 C ATOM 1792 CD2 PHE B 25 -31.578 17.405 -20.798 1.00 12.61 C ATOM 1793 CE1 PHE B 25 -34.147 17.290 -19.729 1.00 13.45 C ATOM 1794 CE2 PHE B 25 -32.044 18.446 -19.989 1.00 13.24 C ATOM 1795 CZ PHE B 25 -33.328 18.389 -19.452 1.00 12.96 C ATOM 1796 N ALA B 26 -30.392 16.380 -24.553 1.00 14.22 N ATOM 1797 CA ALA B 26 -29.592 17.460 -25.120 1.00 14.69 C ATOM 1798 C ALA B 26 -29.638 17.493 -26.651 1.00 15.06 C ATOM 1799 O ALA B 26 -28.936 18.295 -27.264 1.00 15.09 O ATOM 1800 CB ALA B 26 -28.152 17.337 -24.655 1.00 14.46 C ATOM 1801 N PHE B 27 -30.448 16.626 -27.260 1.00 15.38 N ATOM 1802 CA PHE B 27 -30.524 16.539 -28.735 1.00 15.92 C ATOM 1803 C PHE B 27 -30.855 17.880 -29.375 1.00 16.18 C ATOM 1804 O PHE B 27 -30.182 18.291 -30.314 1.00 16.33 O ATOM 1805 CB PHE B 27 -31.522 15.473 -29.197 1.00 15.51 C ATOM 1806 CG PHE B 27 -31.561 15.282 -30.692 1.00 15.79 C ATOM 1807 CD1 PHE B 27 -30.820 14.266 -31.295 1.00 15.54 C ATOM 1808 CD2 PHE B 27 -32.342 16.112 -31.501 1.00 15.05 C ATOM 1809 CE1 PHE B 27 -30.853 14.085 -32.680 1.00 14.83 C ATOM 1810 CE2 PHE B 27 -32.376 15.939 -32.885 1.00 15.03 C ATOM 1811 CZ PHE B 27 -31.635 14.922 -33.471 1.00 14.52 C ATOM 1812 N ASN B 28 -31.877 18.561 -28.852 1.00 16.70 N ATOM 1813 CA ASN B 28 -32.309 19.860 -29.388 1.00 16.96 C ATOM 1814 C ASN B 28 -31.267 20.969 -29.262 1.00 16.95 C ATOM 1815 O ASN B 28 -31.081 21.763 -30.183 1.00 17.35 O ATOM 1816 CB ASN B 28 -33.631 20.294 -28.753 1.00 17.21 C ATOM 1817 CG ASN B 28 -34.838 19.641 -29.409 1.00 18.16 C ATOM 1818 OD1 ASN B 28 -34.702 18.809 -30.312 1.00 19.06 O ATOM 1819 ND2 ASN B 28 -36.032 20.025 -28.963 1.00 19.40 N ATOM 1820 N ALA B 29 -30.573 21.001 -28.130 1.00 16.93 N ATOM 1821 CA ALA B 29 -29.556 22.014 -27.862 1.00 16.86 C ATOM 1822 C ALA B 29 -28.172 21.691 -28.460 1.00 16.98 C ATOM 1823 O ALA B 29 -27.253 22.505 -28.358 1.00 17.19 O ATOM 1824 CB ALA B 29 -29.444 22.246 -26.357 1.00 16.71 C ATOM 1825 N ALA B 30 -28.036 20.524 -29.091 1.00 16.94 N ATOM 1826 CA ALA B 30 -26.732 19.999 -29.523 1.00 17.16 C ATOM 1827 C ALA B 30 -25.877 20.933 -30.401 1.00 17.31 C ATOM 1828 O ALA B 30 -24.687 21.102 -30.139 1.00 17.34 O ATOM 1829 CB ALA B 30 -26.900 18.642 -30.190 1.00 17.08 C ATOM 1830 N GLU B 31 -26.473 21.527 -31.433 1.00 17.57 N ATOM 1831 CA GLU B 31 -25.748 22.474 -32.295 1.00 17.93 C ATOM 1832 C GLU B 31 -25.102 23.618 -31.511 1.00 17.83 C ATOM 1833 O GLU B 31 -23.909 23.883 -31.665 1.00 17.96 O ATOM 1834 CB GLU B 31 -26.662 23.053 -33.382 1.00 18.09 C ATOM 1835 CG GLU B 31 -26.546 22.384 -34.743 1.00 18.82 C ATOM 1836 CD GLU B 31 -27.703 22.736 -35.666 1.00 20.38 C ATOM 1837 OE1 GLU B 31 -27.885 23.931 -35.997 1.00 20.31 O ATOM 1838 OE2 GLU B 31 -28.436 21.805 -36.061 1.00 21.55 O ATOM 1839 N GLN B 32 -25.898 24.280 -30.672 1.00 17.81 N ATOM 1840 CA GLN B 32 -25.445 25.440 -29.901 1.00 17.44 C ATOM 1841 C GLN B 32 -24.289 25.085 -28.966 1.00 17.07 C ATOM 1842 O GLN B 32 -23.329 25.851 -28.835 1.00 16.90 O ATOM 1843 CB GLN B 32 -26.618 26.070 -29.135 1.00 17.38 C ATOM 1844 CG GLN B 32 -26.300 27.383 -28.396 1.00 17.85 C ATOM 1845 CD GLN B 32 -25.504 28.384 -29.231 1.00 18.29 C ATOM 1846 OE1 GLN B 32 -25.859 28.695 -30.372 1.00 18.91 O ATOM 1847 NE2 GLN B 32 -24.426 28.901 -28.653 1.00 18.12 N ATOM 1848 N LEU B 33 -24.376 23.908 -28.355 1.00 16.62 N ATOM 1849 CA LEU B 33 -23.325 23.407 -27.471 1.00 16.45 C ATOM 1850 C LEU B 33 -22.028 23.126 -28.235 1.00 16.29 C ATOM 1851 O LEU B 33 -20.940 23.476 -27.762 1.00 16.15 O ATOM 1852 CB LEU B 33 -23.787 22.140 -26.740 1.00 16.39 C ATOM 1853 CG LEU B 33 -25.018 22.170 -25.825 1.00 16.43 C ATOM 1854 CD1 LEU B 33 -25.514 20.752 -25.574 1.00 16.54 C ATOM 1855 CD2 LEU B 33 -24.739 22.881 -24.502 1.00 15.60 C ATOM 1856 N ILE B 34 -22.151 22.491 -29.403 1.00 15.91 N ATOM 1857 CA ILE B 34 -20.988 22.112 -30.220 1.00 15.92 C ATOM 1858 C ILE B 34 -20.272 23.361 -30.741 1.00 16.05 C ATOM 1859 O ILE B 34 -19.043 23.424 -30.763 1.00 15.92 O ATOM 1860 CB ILE B 34 -21.386 21.156 -31.375 1.00 15.78 C ATOM 1861 CG1 ILE B 34 -21.819 19.803 -30.803 1.00 15.35 C ATOM 1862 CG2 ILE B 34 -20.231 20.982 -32.369 1.00 15.44 C ATOM 1863 CD1 ILE B 34 -22.646 18.972 -31.745 1.00 14.61 C ATOM 1864 N ARG B 35 -21.068 24.347 -31.143 1.00 16.24 N ATOM 1865 CA ARG B 35 -20.603 25.692 -31.436 1.00 16.57 C ATOM 1866 C ARG B 35 -19.809 26.256 -30.244 1.00 16.57 C ATOM 1867 O ARG B 35 -18.705 26.782 -30.412 1.00 16.51 O ATOM 1868 CB ARG B 35 -21.817 26.572 -31.764 1.00 16.64 C ATOM 1869 CG ARG B 35 -21.518 28.011 -32.144 1.00 17.65 C ATOM 1870 CD ARG B 35 -22.805 28.785 -32.478 1.00 19.29 C ATOM 1871 NE ARG B 35 -23.466 28.298 -33.692 1.00 19.93 N ATOM 1872 CZ ARG B 35 -24.594 27.587 -33.714 1.00 20.47 C ATOM 1873 NH1 ARG B 35 -25.214 27.272 -32.588 1.00 21.81 N ATOM 1874 NH2 ARG B 35 -25.110 27.193 -34.870 1.00 21.15 N ATOM 1875 N ASP B 36 -20.366 26.129 -29.041 1.00 16.59 N ATOM 1876 CA ASP B 36 -19.702 26.614 -27.827 1.00 16.63 C ATOM 1877 C ASP B 36 -18.443 25.825 -27.475 1.00 16.51 C ATOM 1878 O ASP B 36 -17.469 26.402 -26.984 1.00 16.23 O ATOM 1879 CB ASP B 36 -20.678 26.636 -26.649 1.00 16.98 C ATOM 1880 CG ASP B 36 -21.632 27.810 -26.711 1.00 17.43 C ATOM 1881 OD1 ASP B 36 -21.201 28.893 -27.163 1.00 18.92 O ATOM 1882 OD2 ASP B 36 -22.805 27.653 -26.306 1.00 17.24 O ATOM 1883 N ILE B 37 -18.475 24.513 -27.725 1.00 16.56 N ATOM 1884 CA ILE B 37 -17.286 23.657 -27.624 1.00 16.89 C ATOM 1885 C ILE B 37 -16.124 24.228 -28.449 1.00 17.24 C ATOM 1886 O ILE B 37 -14.970 24.215 -28.006 1.00 17.22 O ATOM 1887 CB ILE B 37 -17.576 22.204 -28.090 1.00 16.74 C ATOM 1888 CG1 ILE B 37 -18.474 21.484 -27.082 1.00 17.31 C ATOM 1889 CG2 ILE B 37 -16.272 21.421 -28.287 1.00 16.32 C ATOM 1890 CD1 ILE B 37 -19.038 20.166 -27.574 1.00 17.14 C ATOM 1891 N ASN B 38 -16.441 24.723 -29.647 1.00 17.68 N ATOM 1892 CA ASN B 38 -15.454 25.358 -30.525 1.00 18.21 C ATOM 1893 C ASN B 38 -14.915 26.667 -29.951 1.00 18.23 C ATOM 1894 O ASN B 38 -13.711 26.914 -29.990 1.00 18.19 O ATOM 1895 CB ASN B 38 -16.050 25.593 -31.913 1.00 18.26 C ATOM 1896 CG ASN B 38 -16.570 24.318 -32.548 1.00 19.33 C ATOM 1897 OD1 ASN B 38 -15.925 23.270 -32.482 1.00 21.60 O ATOM 1898 ND2 ASN B 38 -17.738 24.401 -33.176 1.00 19.89 N ATOM 1899 N ASP B 39 -15.815 27.484 -29.402 1.00 18.49 N ATOM 1900 CA ASP B 39 -15.458 28.774 -28.815 1.00 18.72 C ATOM 1901 C ASP B 39 -14.581 28.611 -27.573 1.00 18.87 C ATOM 1902 O ASP B 39 -13.594 29.330 -27.408 1.00 19.34 O ATOM 1903 CB ASP B 39 -16.720 29.569 -28.480 1.00 18.92 C ATOM 1904 CG ASP B 39 -16.433 31.040 -28.196 1.00 19.68 C ATOM 1905 OD1 ASP B 39 -16.707 31.483 -27.061 1.00 19.80 O ATOM 1906 OD2 ASP B 39 -15.938 31.754 -29.101 1.00 20.63 O ATOM 1907 N VAL B 40 -14.941 27.666 -26.707 1.00 18.75 N ATOM 1908 CA VAL B 40 -14.115 27.319 -25.554 1.00 18.54 C ATOM 1909 C VAL B 40 -12.728 26.889 -26.034 1.00 18.83 C ATOM 1910 O VAL B 40 -11.713 27.332 -25.482 1.00 18.68 O ATOM 1911 CB VAL B 40 -14.770 26.195 -24.686 1.00 18.54 C ATOM 1912 CG1 VAL B 40 -13.773 25.593 -23.697 1.00 17.62 C ATOM 1913 CG2 VAL B 40 -15.998 26.727 -23.949 1.00 17.73 C ATOM 1914 N ALA B 41 -12.706 26.050 -27.073 1.00 19.01 N ATOM 1915 CA ALA B 41 -11.489 25.398 -27.563 1.00 19.51 C ATOM 1916 C ALA B 41 -10.552 26.377 -28.237 1.00 19.89 C ATOM 1917 O ALA B 41 -9.351 26.119 -28.328 1.00 20.00 O ATOM 1918 CB ALA B 41 -11.829 24.254 -28.522 1.00 19.29 C ATOM 1919 N SER B 42 -11.108 27.493 -28.706 1.00 20.25 N ATOM 1920 CA SER B 42 -10.324 28.556 -29.328 1.00 20.73 C ATOM 1921 C SER B 42 -9.498 29.310 -28.285 1.00 20.71 C ATOM 1922 O SER B 42 -8.433 29.829 -28.594 1.00 21.05 O ATOM 1923 CB SER B 42 -11.233 29.522 -30.104 1.00 20.78 C ATOM 1924 OG SER B 42 -11.748 30.555 -29.273 1.00 21.69 O ATOM 1925 N GLN B 43 -10.005 29.367 -27.056 1.00 20.56 N ATOM 1926 CA GLN B 43 -9.308 30.019 -25.947 1.00 20.40 C ATOM 1927 C GLN B 43 -8.350 29.074 -25.236 1.00 19.92 C ATOM 1928 O GLN B 43 -7.263 29.488 -24.810 1.00 19.91 O ATOM 1929 CB GLN B 43 -10.308 30.549 -24.923 1.00 20.76 C ATOM 1930 CG GLN B 43 -11.290 31.580 -25.445 1.00 21.71 C ATOM 1931 CD GLN B 43 -12.008 32.284 -24.314 1.00 23.31 C ATOM 1932 OE1 GLN B 43 -11.405 33.070 -23.581 1.00 24.84 O ATOM 1933 NE2 GLN B 43 -13.300 32.008 -24.164 1.00 23.46 N ATOM 1934 N SER B 44 -8.777 27.816 -25.098 1.00 19.07 N ATOM 1935 CA SER B 44 -8.043 26.782 -24.371 1.00 18.32 C ATOM 1936 C SER B 44 -8.117 25.488 -25.172 1.00 17.76 C ATOM 1937 O SER B 44 -9.073 24.729 -25.024 1.00 18.04 O ATOM 1938 CB SER B 44 -8.655 26.568 -22.977 1.00 18.58 C ATOM 1939 OG SER B 44 -8.180 27.510 -22.028 1.00 18.36 O ATOM 1940 N PRO B 45 -7.117 25.234 -26.038 1.00 17.18 N ATOM 1941 CA PRO B 45 -7.191 24.120 -26.981 1.00 16.65 C ATOM 1942 C PRO B 45 -7.327 22.767 -26.296 1.00 16.30 C ATOM 1943 O PRO B 45 -6.909 22.612 -25.145 1.00 16.14 O ATOM 1944 CB PRO B 45 -5.836 24.187 -27.698 1.00 16.46 C ATOM 1945 CG PRO B 45 -5.420 25.577 -27.569 1.00 16.64 C ATOM 1946 CD PRO B 45 -5.857 25.979 -26.200 1.00 17.06 C ATOM 1947 N PHE B 46 -7.903 21.801 -27.013 1.00 15.69 N ATOM 1948 CA PHE B 46 -7.839 20.405 -26.613 1.00 14.99 C ATOM 1949 C PHE B 46 -6.383 19.962 -26.566 1.00 14.73 C ATOM 1950 O PHE B 46 -5.596 20.273 -27.461 1.00 14.87 O ATOM 1951 CB PHE B 46 -8.629 19.513 -27.581 1.00 14.97 C ATOM 1952 CG PHE B 46 -10.134 19.610 -27.420 1.00 14.45 C ATOM 1953 CD1 PHE B 46 -10.902 20.331 -28.337 1.00 14.03 C ATOM 1954 CD2 PHE B 46 -10.783 18.982 -26.359 1.00 13.60 C ATOM 1955 CE1 PHE B 46 -12.291 20.426 -28.193 1.00 13.17 C ATOM 1956 CE2 PHE B 46 -12.174 19.069 -26.213 1.00 11.91 C ATOM 1957 CZ PHE B 46 -12.926 19.790 -27.131 1.00 11.24 C ATOM 1958 N ARG B 47 -6.026 19.248 -25.508 1.00 14.47 N ATOM 1959 CA ARG B 47 -4.705 18.644 -25.398 1.00 14.03 C ATOM 1960 C ARG B 47 -4.850 17.279 -24.740 1.00 13.70 C ATOM 1961 O ARG B 47 -5.780 17.070 -23.971 1.00 13.36 O ATOM 1962 CB ARG B 47 -3.750 19.573 -24.626 1.00 13.98 C ATOM 1963 CG ARG B 47 -3.804 19.517 -23.085 1.00 13.97 C ATOM 1964 CD ARG B 47 -5.163 19.880 -22.479 1.00 13.67 C ATOM 1965 NE ARG B 47 -5.700 21.180 -22.900 1.00 12.61 N ATOM 1966 CZ ARG B 47 -5.630 22.299 -22.176 1.00 12.26 C ATOM 1967 NH1 ARG B 47 -5.022 22.300 -20.995 1.00 11.46 N ATOM 1968 NH2 ARG B 47 -6.160 23.428 -22.639 1.00 10.98 N ATOM 1969 N GLN B 48 -3.966 16.342 -25.080 1.00 13.93 N ATOM 1970 CA GLN B 48 -3.963 15.013 -24.458 1.00 13.87 C ATOM 1971 C GLN B 48 -3.073 15.052 -23.236 1.00 14.10 C ATOM 1972 O GLN B 48 -1.852 15.148 -23.355 1.00 14.39 O ATOM 1973 CB GLN B 48 -3.456 13.950 -25.431 1.00 13.93 C ATOM 1974 CG GLN B 48 -4.507 13.479 -26.415 1.00 13.98 C ATOM 1975 CD GLN B 48 -3.946 12.568 -27.473 1.00 13.58 C ATOM 1976 OE1 GLN B 48 -3.781 12.980 -28.614 1.00 15.45 O ATOM 1977 NE2 GLN B 48 -3.644 11.323 -27.106 1.00 12.01 N ATOM 1978 N MET B 49 -3.676 14.988 -22.057 1.00 13.92 N ATOM 1979 CA MET B 49 -2.911 15.169 -20.837 1.00 14.01 C ATOM 1980 C MET B 49 -2.073 13.940 -20.508 1.00 13.81 C ATOM 1981 O MET B 49 -2.424 12.815 -20.869 1.00 13.62 O ATOM 1982 CB MET B 49 -3.830 15.511 -19.669 1.00 14.49 C ATOM 1983 CG MET B 49 -4.463 16.894 -19.731 1.00 14.82 C ATOM 1984 SD MET B 49 -5.685 17.071 -18.408 1.00 18.52 S ATOM 1985 CE MET B 49 -6.418 18.658 -18.836 1.00 17.60 C ATOM 1986 N VAL B 50 -0.956 14.174 -19.829 1.00 13.49 N ATOM 1987 CA VAL B 50 -0.093 13.101 -19.353 1.00 12.99 C ATOM 1988 C VAL B 50 -0.364 12.877 -17.863 1.00 13.11 C ATOM 1989 O VAL B 50 -0.325 13.816 -17.065 1.00 12.45 O ATOM 1990 CB VAL B 50 1.408 13.415 -19.609 1.00 12.89 C ATOM 1991 CG1 VAL B 50 2.286 12.230 -19.237 1.00 12.18 C ATOM 1992 CG2 VAL B 50 1.638 13.802 -21.083 1.00 12.63 C ATOM 1993 N THR B 51 -0.651 11.627 -17.499 1.00 13.33 N ATOM 1994 CA THR B 51 -0.975 11.270 -16.120 1.00 13.36 C ATOM 1995 C THR B 51 0.280 11.390 -15.245 1.00 14.01 C ATOM 1996 O THR B 51 1.407 11.460 -15.783 1.00 13.90 O ATOM 1997 CB THR B 51 -1.531 9.836 -16.021 1.00 13.39 C ATOM 1998 OG1 THR B 51 -0.514 8.914 -16.417 1.00 13.53 O ATOM 1999 CG2 THR B 51 -2.746 9.664 -16.894 1.00 12.99 C ATOM 2000 N PRO B 52 0.101 11.444 -13.907 1.00 13.96 N ATOM 2001 CA PRO B 52 1.240 11.555 -12.990 1.00 14.47 C ATOM 2002 C PRO B 52 2.210 10.374 -13.075 1.00 14.91 C ATOM 2003 O PRO B 52 3.391 10.516 -12.736 1.00 15.14 O ATOM 2004 CB PRO B 52 0.586 11.611 -11.597 1.00 14.48 C ATOM 2005 CG PRO B 52 -0.874 11.341 -11.806 1.00 14.81 C ATOM 2006 CD PRO B 52 -1.181 11.680 -13.222 1.00 14.30 C ATOM 2007 N GLY B 53 1.718 9.227 -13.535 1.00 14.90 N ATOM 2008 CA GLY B 53 2.569 8.071 -13.800 1.00 15.23 C ATOM 2009 C GLY B 53 3.284 8.106 -15.146 1.00 15.68 C ATOM 2010 O GLY B 53 4.073 7.209 -15.449 1.00 15.76 O ATOM 2011 N GLY B 54 3.020 9.138 -15.948 1.00 15.86 N ATOM 2012 CA GLY B 54 3.662 9.301 -17.260 1.00 15.99 C ATOM 2013 C GLY B 54 2.938 8.763 -18.494 1.00 16.35 C ATOM 2014 O GLY B 54 3.531 8.710 -19.582 1.00 16.24 O ATOM 2015 N TYR B 55 1.671 8.364 -18.343 1.00 16.15 N ATOM 2016 CA TYR B 55 0.870 7.900 -19.485 1.00 16.34 C ATOM 2017 C TYR B 55 0.213 9.086 -20.185 1.00 16.03 C ATOM 2018 O TYR B 55 -0.382 9.947 -19.530 1.00 16.52 O ATOM 2019 CB TYR B 55 -0.231 6.913 -19.048 1.00 16.38 C ATOM 2020 CG TYR B 55 0.273 5.609 -18.484 1.00 16.90 C ATOM 2021 CD1 TYR B 55 0.366 5.416 -17.107 1.00 17.56 C ATOM 2022 CD2 TYR B 55 0.662 4.569 -19.324 1.00 17.32 C ATOM 2023 CE1 TYR B 55 0.836 4.211 -16.581 1.00 17.74 C ATOM 2024 CE2 TYR B 55 1.132 3.365 -18.808 1.00 18.11 C ATOM 2025 CZ TYR B 55 1.213 3.193 -17.435 1.00 17.92 C ATOM 2026 OH TYR B 55 1.680 2.004 -16.919 1.00 18.68 O ATOM 2027 N THR B 56 0.319 9.129 -21.507 1.00 15.48 N ATOM 2028 CA THR B 56 -0.462 10.069 -22.303 1.00 15.25 C ATOM 2029 C THR B 56 -1.862 9.481 -22.436 1.00 15.08 C ATOM 2030 O THR B 56 -2.003 8.310 -22.791 1.00 14.88 O ATOM 2031 CB THR B 56 0.174 10.295 -23.704 1.00 15.35 C ATOM 2032 OG1 THR B 56 1.458 10.907 -23.545 1.00 14.61 O ATOM 2033 CG2 THR B 56 -0.693 11.200 -24.582 1.00 15.35 C ATOM 2034 N MET B 57 -2.881 10.284 -22.142 1.00 14.79 N ATOM 2035 CA MET B 57 -4.276 9.858 -22.275 1.00 15.34 C ATOM 2036 C MET B 57 -4.700 9.878 -23.743 1.00 15.50 C ATOM 2037 O MET B 57 -4.172 10.674 -24.525 1.00 15.75 O ATOM 2038 CB MET B 57 -5.199 10.758 -21.442 1.00 15.62 C ATOM 2039 CG MET B 57 -4.875 10.743 -19.943 1.00 15.95 C ATOM 2040 SD MET B 57 -6.072 11.621 -18.919 1.00 17.65 S ATOM 2041 CE MET B 57 -7.518 10.594 -19.116 1.00 18.46 C ATOM 2042 N SER B 58 -5.630 8.997 -24.119 1.00 15.41 N ATOM 2043 CA SER B 58 -6.144 8.967 -25.502 1.00 15.19 C ATOM 2044 C SER B 58 -7.246 10.013 -25.719 1.00 15.22 C ATOM 2045 O SER B 58 -7.368 10.571 -26.824 1.00 14.99 O ATOM 2046 CB SER B 58 -6.626 7.567 -25.885 1.00 15.11 C ATOM 2047 OG SER B 58 -7.663 7.124 -25.019 1.00 14.84 O ATOM 2048 N VAL B 59 -8.040 10.284 -24.673 1.00 15.20 N ATOM 2049 CA AVAL B 59 -9.028 11.365 -24.741 0.50 15.13 C ATOM 2050 CA BVAL B 59 -9.035 11.364 -24.717 0.50 15.04 C ATOM 2051 C VAL B 59 -8.314 12.711 -24.772 1.00 15.08 C ATOM 2052 O VAL B 59 -7.328 12.926 -24.068 1.00 15.12 O ATOM 2053 CB AVAL B 59 -10.069 11.326 -23.586 0.50 15.35 C ATOM 2054 CB BVAL B 59 -9.996 11.325 -23.495 0.50 15.22 C ATOM 2055 CG1AVAL B 59 -10.808 10.002 -23.580 0.50 15.29 C ATOM 2056 CG1BVAL B 59 -11.086 12.391 -23.610 0.50 14.30 C ATOM 2057 CG2AVAL B 59 -9.421 11.580 -22.234 0.50 14.89 C ATOM 2058 CG2BVAL B 59 -10.635 9.951 -23.366 0.50 15.20 C ATOM 2059 N ALA B 60 -8.788 13.607 -25.622 1.00 15.14 N ATOM 2060 CA ALA B 60 -8.230 14.952 -25.671 1.00 15.14 C ATOM 2061 C ALA B 60 -9.180 15.820 -24.869 1.00 15.24 C ATOM 2062 O ALA B 60 -10.392 15.595 -24.891 1.00 15.68 O ATOM 2063 CB ALA B 60 -8.111 15.436 -27.112 1.00 15.12 C ATOM 2064 N MET B 61 -8.640 16.797 -24.151 1.00 15.34 N ATOM 2065 CA MET B 61 -9.406 17.480 -23.109 1.00 15.59 C ATOM 2066 C MET B 61 -9.262 19.000 -23.126 1.00 15.82 C ATOM 2067 O MET B 61 -8.209 19.544 -23.495 1.00 15.63 O ATOM 2068 CB MET B 61 -8.997 16.960 -21.727 1.00 15.48 C ATOM 2069 CG MET B 61 -9.528 15.572 -21.374 1.00 16.03 C ATOM 2070 SD MET B 61 -8.958 14.991 -19.756 1.00 18.42 S ATOM 2071 CE MET B 61 -9.958 13.522 -19.510 1.00 17.36 C ATOM 2072 N THR B 62 -10.337 19.680 -22.740 1.00 15.38 N ATOM 2073 CA THR B 62 -10.226 21.063 -22.291 1.00 15.56 C ATOM 2074 C THR B 62 -11.264 21.360 -21.199 1.00 15.61 C ATOM 2075 O THR B 62 -12.027 20.476 -20.808 1.00 15.57 O ATOM 2076 CB THR B 62 -10.237 22.076 -23.454 1.00 15.57 C ATOM 2077 OG1 THR B 62 -9.729 23.333 -22.987 1.00 16.04 O ATOM 2078 CG2 THR B 62 -11.643 22.248 -24.068 1.00 15.07 C ATOM 2079 N ASN B 63 -11.268 22.576 -20.674 1.00 15.40 N ATOM 2080 CA ASN B 63 -12.202 22.908 -19.601 1.00 15.54 C ATOM 2081 C ASN B 63 -12.771 24.287 -19.827 1.00 15.76 C ATOM 2082 O ASN B 63 -12.154 25.113 -20.490 1.00 15.64 O ATOM 2083 CB ASN B 63 -11.519 22.873 -18.219 1.00 14.89 C ATOM 2084 CG ASN B 63 -11.076 21.486 -17.804 1.00 14.43 C ATOM 2085 OD1 ASN B 63 -11.866 20.709 -17.277 1.00 12.51 O ATOM 2086 ND2 ASN B 63 -9.788 21.183 -18.001 1.00 12.32 N ATOM 2087 N CYS B 64 -13.950 24.526 -19.263 1.00 16.12 N ATOM 2088 CA CYS B 64 -14.476 25.873 -19.124 1.00 16.78 C ATOM 2089 C CYS B 64 -15.194 25.974 -17.776 1.00 16.77 C ATOM 2090 O CYS B 64 -15.471 24.955 -17.142 1.00 17.00 O ATOM 2091 CB CYS B 64 -15.396 26.225 -20.292 1.00 16.65 C ATOM 2092 SG CYS B 64 -16.906 25.257 -20.340 1.00 18.11 S ATOM 2093 N GLY B 65 -15.486 27.194 -17.337 1.00 16.77 N ATOM 2094 CA GLY B 65 -15.993 27.416 -15.988 1.00 16.63 C ATOM 2095 C GLY B 65 -14.857 27.750 -15.038 1.00 16.75 C ATOM 2096 O GLY B 65 -13.694 27.811 -15.449 1.00 16.38 O ATOM 2097 N HIS B 66 -15.193 27.948 -13.764 1.00 16.96 N ATOM 2098 CA HIS B 66 -14.239 28.431 -12.760 1.00 17.32 C ATOM 2099 C HIS B 66 -13.060 27.488 -12.498 1.00 17.01 C ATOM 2100 O HIS B 66 -11.942 27.935 -12.250 1.00 16.81 O ATOM 2101 CB HIS B 66 -14.963 28.738 -11.444 1.00 17.63 C ATOM 2102 CG HIS B 66 -15.655 30.069 -11.423 1.00 19.51 C ATOM 2103 ND1 HIS B 66 -15.047 31.235 -11.841 1.00 21.29 N ATOM 2104 CD2 HIS B 66 -16.897 30.421 -11.010 1.00 20.77 C ATOM 2105 CE1 HIS B 66 -15.887 32.245 -11.696 1.00 21.67 C ATOM 2106 NE2 HIS B 66 -17.019 31.776 -11.199 1.00 21.57 N ATOM 2107 N LEU B 67 -13.318 26.185 -12.565 1.00 16.82 N ATOM 2108 CA LEU B 67 -12.319 25.177 -12.240 1.00 16.42 C ATOM 2109 C LEU B 67 -12.191 24.159 -13.358 1.00 16.64 C ATOM 2110 O LEU B 67 -13.190 23.663 -13.879 1.00 16.93 O ATOM 2111 CB LEU B 67 -12.687 24.486 -10.921 1.00 16.36 C ATOM 2112 CG LEU B 67 -11.890 24.734 -9.626 1.00 15.59 C ATOM 2113 CD1 LEU B 67 -11.017 25.974 -9.675 1.00 12.50 C ATOM 2114 CD2 LEU B 67 -12.835 24.773 -8.404 1.00 13.43 C ATOM 2115 N GLY B 68 -10.950 23.860 -13.733 1.00 16.77 N ATOM 2116 CA GLY B 68 -10.663 22.897 -14.788 1.00 16.32 C ATOM 2117 C GLY B 68 -9.887 21.703 -14.269 1.00 16.54 C ATOM 2118 O GLY B 68 -8.942 21.856 -13.489 1.00 16.59 O ATOM 2119 N TRP B 69 -10.296 20.508 -14.689 1.00 16.61 N ATOM 2120 CA TRP B 69 -9.607 19.280 -14.311 1.00 16.70 C ATOM 2121 C TRP B 69 -8.323 19.149 -15.117 1.00 17.07 C ATOM 2122 O TRP B 69 -8.325 19.264 -16.348 1.00 16.37 O ATOM 2123 CB TRP B 69 -10.503 18.076 -14.563 1.00 16.77 C ATOM 2124 CG TRP B 69 -9.977 16.748 -14.048 1.00 17.07 C ATOM 2125 CD1 TRP B 69 -10.235 16.182 -12.826 1.00 17.58 C ATOM 2126 CD2 TRP B 69 -9.164 15.804 -14.759 1.00 16.81 C ATOM 2127 NE1 TRP B 69 -9.608 14.960 -12.726 1.00 17.51 N ATOM 2128 CE2 TRP B 69 -8.949 14.702 -13.899 1.00 17.31 C ATOM 2129 CE3 TRP B 69 -8.588 15.785 -16.034 1.00 18.13 C ATOM 2130 CZ2 TRP B 69 -8.182 13.597 -14.270 1.00 17.72 C ATOM 2131 CZ3 TRP B 69 -7.823 14.681 -16.402 1.00 18.78 C ATOM 2132 CH2 TRP B 69 -7.629 13.601 -15.521 1.00 18.52 C ATOM 2133 N THR B 70 -7.231 18.898 -14.405 1.00 17.58 N ATOM 2134 CA THR B 70 -5.909 18.855 -14.996 1.00 18.50 C ATOM 2135 C THR B 70 -5.074 17.786 -14.330 1.00 19.05 C ATOM 2136 O THR B 70 -5.238 17.496 -13.138 1.00 19.19 O ATOM 2137 CB THR B 70 -5.157 20.189 -14.796 1.00 18.53 C ATOM 2138 OG1 THR B 70 -5.033 20.464 -13.390 1.00 19.35 O ATOM 2139 CG2 THR B 70 -5.889 21.340 -15.462 1.00 18.71 C ATOM 2140 N THR B 71 -4.165 17.211 -15.102 1.00 19.51 N ATOM 2141 CA THR B 71 -3.172 16.308 -14.561 1.00 20.27 C ATOM 2142 C THR B 71 -1.984 17.152 -14.110 1.00 21.03 C ATOM 2143 O THR B 71 -1.747 18.241 -14.642 1.00 21.20 O ATOM 2144 CB THR B 71 -2.708 15.298 -15.614 1.00 20.19 C ATOM 2145 OG1 THR B 71 -2.144 16.008 -16.724 1.00 20.05 O ATOM 2146 CG2 THR B 71 -3.883 14.434 -16.096 1.00 19.56 C ATOM 2147 N HIS B 72 -1.246 16.649 -13.128 1.00 21.44 N ATOM 2148 CA HIS B 72 -0.085 17.352 -12.604 1.00 22.27 C ATOM 2149 C HIS B 72 0.847 16.308 -12.000 1.00 22.19 C ATOM 2150 O HIS B 72 0.396 15.213 -11.631 1.00 22.22 O ATOM 2151 CB HIS B 72 -0.536 18.369 -11.553 1.00 22.70 C ATOM 2152 CG HIS B 72 0.452 19.461 -11.295 1.00 23.99 C ATOM 2153 ND1 HIS B 72 1.559 19.291 -10.490 1.00 24.74 N ATOM 2154 CD2 HIS B 72 0.491 20.746 -11.722 1.00 24.85 C ATOM 2155 CE1 HIS B 72 2.244 20.421 -10.441 1.00 25.00 C ATOM 2156 NE2 HIS B 72 1.617 21.320 -11.179 1.00 25.46 N ATOM 2157 N ARG B 73 2.139 16.628 -11.929 1.00 22.15 N ATOM 2158 CA AARG B 73 3.126 15.727 -11.329 0.50 22.37 C ATOM 2159 CA BARG B 73 3.134 15.739 -11.322 0.50 22.17 C ATOM 2160 C ARG B 73 2.594 15.093 -10.039 1.00 22.59 C ATOM 2161 O ARG B 73 2.667 13.872 -9.867 1.00 22.33 O ATOM 2162 CB AARG B 73 4.444 16.467 -11.062 0.50 22.28 C ATOM 2163 CB BARG B 73 4.431 16.517 -11.049 0.50 21.93 C ATOM 2164 CG AARG B 73 5.639 15.565 -10.777 0.50 21.84 C ATOM 2165 CG BARG B 73 5.596 15.697 -10.509 0.50 20.61 C ATOM 2166 CD AARG B 73 6.853 16.390 -10.404 0.50 21.29 C ATOM 2167 CD BARG B 73 6.879 16.519 -10.501 0.50 18.04 C ATOM 2168 NE AARG B 73 8.019 15.565 -10.104 0.50 21.23 N ATOM 2169 NE BARG B 73 6.652 17.922 -10.153 0.50 15.60 N ATOM 2170 CZ AARG B 73 8.163 14.296 -10.472 0.50 20.27 C ATOM 2171 CZ BARG B 73 6.763 18.423 -8.926 0.50 15.08 C ATOM 2172 NH1AARG B 73 7.209 13.689 -11.157 0.50 20.98 N ATOM 2173 NH1BARG B 73 7.091 17.640 -7.908 0.50 14.16 N ATOM 2174 NH2AARG B 73 9.259 13.632 -10.145 0.50 19.30 N ATOM 2175 NH2BARG B 73 6.535 19.711 -8.714 0.50 14.75 N ATOM 2176 N GLN B 74 2.031 15.921 -9.152 1.00 23.25 N ATOM 2177 CA GLN B 74 1.530 15.471 -7.835 1.00 24.28 C ATOM 2178 C GLN B 74 0.131 14.855 -7.818 1.00 24.27 C ATOM 2179 O GLN B 74 -0.453 14.664 -6.743 1.00 24.65 O ATOM 2180 CB GLN B 74 1.604 16.596 -6.792 1.00 24.52 C ATOM 2181 CG GLN B 74 1.581 17.990 -7.371 1.00 26.91 C ATOM 2182 CD GLN B 74 2.962 18.611 -7.381 1.00 29.49 C ATOM 2183 OE1 GLN B 74 3.472 19.036 -6.339 1.00 31.76 O ATOM 2184 NE2 GLN B 74 3.577 18.669 -8.553 1.00 30.64 N ATOM 2185 N GLY B 75 -0.394 14.525 -8.993 1.00 24.10 N ATOM 2186 CA GLY B 75 -1.710 13.916 -9.083 1.00 24.10 C ATOM 2187 C GLY B 75 -2.724 14.785 -9.793 1.00 24.08 C ATOM 2188 O GLY B 75 -2.399 15.864 -10.296 1.00 24.19 O ATOM 2189 N TYR B 76 -3.960 14.297 -9.831 1.00 24.01 N ATOM 2190 CA TYR B 76 -5.040 14.933 -10.576 1.00 23.78 C ATOM 2191 C TYR B 76 -5.623 16.083 -9.771 1.00 23.67 C ATOM 2192 O TYR B 76 -6.004 15.906 -8.607 1.00 23.68 O ATOM 2193 CB TYR B 76 -6.136 13.912 -10.890 1.00 23.80 C ATOM 2194 CG TYR B 76 -5.653 12.670 -11.627 1.00 23.82 C ATOM 2195 CD1 TYR B 76 -5.560 11.441 -10.973 1.00 22.87 C ATOM 2196 CD2 TYR B 76 -5.298 12.731 -12.977 1.00 22.60 C ATOM 2197 CE1 TYR B 76 -5.128 10.307 -11.643 1.00 24.00 C ATOM 2198 CE2 TYR B 76 -4.862 11.609 -13.653 1.00 23.09 C ATOM 2199 CZ TYR B 76 -4.781 10.396 -12.986 1.00 23.91 C ATOM 2200 OH TYR B 76 -4.345 9.276 -13.664 1.00 24.59 O ATOM 2201 N LEU B 77 -5.710 17.258 -10.384 1.00 23.05 N ATOM 2202 CA LEU B 77 -6.160 18.426 -9.636 1.00 22.66 C ATOM 2203 C LEU B 77 -7.058 19.387 -10.405 1.00 21.78 C ATOM 2204 O LEU B 77 -7.020 19.464 -11.632 1.00 21.73 O ATOM 2205 CB LEU B 77 -4.955 19.164 -9.029 1.00 23.05 C ATOM 2206 CG LEU B 77 -3.979 19.930 -9.927 1.00 23.61 C ATOM 2207 CD1 LEU B 77 -4.474 21.350 -10.123 1.00 25.51 C ATOM 2208 CD2 LEU B 77 -2.590 19.970 -9.298 1.00 25.21 C ATOM 2209 N TYR B 78 -7.862 20.124 -9.655 1.00 20.94 N ATOM 2210 CA TYR B 78 -8.634 21.219 -10.204 1.00 20.41 C ATOM 2211 C TYR B 78 -7.870 22.526 -10.064 1.00 20.30 C ATOM 2212 O TYR B 78 -7.325 22.827 -9.003 1.00 20.24 O ATOM 2213 CB TYR B 78 -10.008 21.289 -9.537 1.00 20.20 C ATOM 2214 CG TYR B 78 -10.930 20.202 -10.049 1.00 20.24 C ATOM 2215 CD1 TYR B 78 -11.146 19.042 -9.310 1.00 19.83 C ATOM 2216 CD2 TYR B 78 -11.563 20.323 -11.291 1.00 18.89 C ATOM 2217 CE1 TYR B 78 -11.984 18.041 -9.783 1.00 20.34 C ATOM 2218 CE2 TYR B 78 -12.405 19.333 -11.764 1.00 18.80 C ATOM 2219 CZ TYR B 78 -12.606 18.196 -11.013 1.00 19.54 C ATOM 2220 OH TYR B 78 -13.437 17.208 -11.480 1.00 19.87 O ATOM 2221 N SER B 79 -7.794 23.280 -11.154 1.00 20.01 N ATOM 2222 CA SER B 79 -7.121 24.561 -11.137 1.00 19.61 C ATOM 2223 C SER B 79 -7.961 25.631 -11.814 1.00 19.62 C ATOM 2224 O SER B 79 -8.647 25.359 -12.800 1.00 19.66 O ATOM 2225 CB SER B 79 -5.761 24.484 -11.818 1.00 19.49 C ATOM 2226 OG SER B 79 -5.102 25.738 -11.733 1.00 20.06 O ATOM 2227 N PRO B 80 -7.917 26.856 -11.271 1.00 19.31 N ATOM 2228 CA PRO B 80 -8.557 27.963 -11.948 1.00 19.36 C ATOM 2229 C PRO B 80 -7.782 28.373 -13.193 1.00 19.05 C ATOM 2230 O PRO B 80 -8.312 29.126 -13.995 1.00 18.80 O ATOM 2231 CB PRO B 80 -8.528 29.087 -10.904 1.00 19.32 C ATOM 2232 CG PRO B 80 -7.491 28.698 -9.944 1.00 19.40 C ATOM 2233 CD PRO B 80 -7.447 27.221 -9.924 1.00 19.20 C ATOM 2234 N ILE B 81 -6.559 27.857 -13.347 1.00 19.08 N ATOM 2235 CA ILE B 81 -5.662 28.234 -14.452 1.00 19.15 C ATOM 2236 C ILE B 81 -5.381 27.079 -15.430 1.00 19.33 C ATOM 2237 O ILE B 81 -5.011 25.970 -15.013 1.00 19.43 O ATOM 2238 CB ILE B 81 -4.296 28.773 -13.925 1.00 19.06 C ATOM 2239 CG1 ILE B 81 -4.469 30.057 -13.100 1.00 19.25 C ATOM 2240 CG2 ILE B 81 -3.289 28.980 -15.077 1.00 19.29 C ATOM 2241 CD1 ILE B 81 -5.091 31.207 -13.853 1.00 19.79 C ATOM 2242 N ASP B 82 -5.532 27.362 -16.723 1.00 18.93 N ATOM 2243 CA ASP B 82 -5.123 26.446 -17.786 1.00 19.07 C ATOM 2244 C ASP B 82 -3.600 26.522 -17.971 1.00 18.70 C ATOM 2245 O ASP B 82 -3.097 27.522 -18.466 1.00 18.63 O ATOM 2246 CB ASP B 82 -5.837 26.815 -19.093 1.00 18.99 C ATOM 2247 CG ASP B 82 -5.554 25.841 -20.226 1.00 19.54 C ATOM 2248 OD1 ASP B 82 -4.838 24.846 -20.023 1.00 20.69 O ATOM 2249 OD2 ASP B 82 -6.058 26.073 -21.340 1.00 20.82 O ATOM 2250 N PRO B 83 -2.869 25.454 -17.589 1.00 18.49 N ATOM 2251 CA PRO B 83 -1.404 25.431 -17.743 1.00 18.22 C ATOM 2252 C PRO B 83 -0.958 25.487 -19.207 1.00 18.19 C ATOM 2253 O PRO B 83 0.188 25.844 -19.485 1.00 18.00 O ATOM 2254 CB PRO B 83 -0.999 24.094 -17.114 1.00 18.19 C ATOM 2255 CG PRO B 83 -2.232 23.236 -17.208 1.00 18.08 C ATOM 2256 CD PRO B 83 -3.390 24.181 -17.050 1.00 18.44 C ATOM 2257 N GLN B 84 -1.868 25.140 -20.119 1.00 18.07 N ATOM 2258 CA GLN B 84 -1.643 25.241 -21.560 1.00 18.32 C ATOM 2259 C GLN B 84 -1.484 26.702 -22.011 1.00 18.41 C ATOM 2260 O GLN B 84 -0.745 26.992 -22.955 1.00 17.99 O ATOM 2261 CB GLN B 84 -2.812 24.584 -22.309 1.00 18.60 C ATOM 2262 CG GLN B 84 -2.589 24.307 -23.791 1.00 18.54 C ATOM 2263 CD GLN B 84 -1.537 23.238 -24.046 1.00 19.96 C ATOM 2264 OE1 GLN B 84 -1.389 22.285 -23.274 1.00 20.84 O ATOM 2265 NE2 GLN B 84 -0.805 23.390 -25.139 1.00 19.24 N ATOM 2266 N THR B 85 -2.181 27.610 -21.326 1.00 18.45 N ATOM 2267 CA THR B 85 -2.196 29.028 -21.689 1.00 18.63 C ATOM 2268 C THR B 85 -1.724 29.944 -20.551 1.00 18.87 C ATOM 2269 O THR B 85 -1.501 31.142 -20.763 1.00 19.17 O ATOM 2270 CB THR B 85 -3.610 29.481 -22.151 1.00 18.68 C ATOM 2271 OG1 THR B 85 -4.562 29.293 -21.088 1.00 18.84 O ATOM 2272 CG2 THR B 85 -4.064 28.693 -23.382 1.00 18.84 C ATOM 2273 N ASN B 86 -1.570 29.378 -19.352 1.00 19.01 N ATOM 2274 CA ASN B 86 -1.329 30.150 -18.127 1.00 19.32 C ATOM 2275 C ASN B 86 -2.271 31.360 -18.013 1.00 19.54 C ATOM 2276 O ASN B 86 -1.851 32.475 -17.673 1.00 19.05 O ATOM 2277 CB ASN B 86 0.154 30.537 -17.988 1.00 19.36 C ATOM 2278 CG ASN B 86 1.067 29.322 -17.858 1.00 20.15 C ATOM 2279 OD1 ASN B 86 0.751 28.352 -17.155 1.00 20.46 O ATOM 2280 ND2 ASN B 86 2.208 29.365 -18.546 1.00 20.70 N ATOM 2281 N LYS B 87 -3.542 31.106 -18.342 1.00 19.81 N ATOM 2282 CA LYS B 87 -4.656 32.041 -18.174 1.00 19.95 C ATOM 2283 C LYS B 87 -5.743 31.265 -17.441 1.00 20.03 C ATOM 2284 O LYS B 87 -5.671 30.035 -17.364 1.00 19.81 O ATOM 2285 CB LYS B 87 -5.228 32.476 -19.532 1.00 19.81 C ATOM 2286 CG LYS B 87 -4.245 33.068 -20.524 1.00 20.18 C ATOM 2287 CD LYS B 87 -4.969 33.828 -21.643 1.00 20.12 C ATOM 2288 CE LYS B 87 -5.201 32.970 -22.888 1.00 20.22 C ATOM 2289 NZ LYS B 87 -6.301 31.956 -22.747 1.00 21.93 N ATOM 2290 N PRO B 88 -6.768 31.965 -16.910 1.00 20.04 N ATOM 2291 CA PRO B 88 -7.899 31.183 -16.414 1.00 19.97 C ATOM 2292 C PRO B 88 -8.613 30.501 -17.573 1.00 20.13 C ATOM 2293 O PRO B 88 -8.463 30.911 -18.731 1.00 20.39 O ATOM 2294 CB PRO B 88 -8.815 32.229 -15.765 1.00 19.62 C ATOM 2295 CG PRO B 88 -7.954 33.408 -15.514 1.00 20.08 C ATOM 2296 CD PRO B 88 -6.912 33.400 -16.607 1.00 20.01 C ATOM 2297 N TRP B 89 -9.350 29.444 -17.257 1.00 20.31 N ATOM 2298 CA TRP B 89 -10.149 28.724 -18.237 1.00 20.28 C ATOM 2299 C TRP B 89 -11.229 29.655 -18.779 1.00 20.28 C ATOM 2300 O TRP B 89 -11.573 30.637 -18.125 1.00 20.14 O ATOM 2301 CB TRP B 89 -10.789 27.502 -17.580 1.00 20.15 C ATOM 2302 CG TRP B 89 -9.800 26.530 -17.017 1.00 19.78 C ATOM 2303 CD1 TRP B 89 -9.413 26.419 -15.715 1.00 19.47 C ATOM 2304 CD2 TRP B 89 -9.067 25.531 -17.740 1.00 19.35 C ATOM 2305 NE1 TRP B 89 -8.485 25.416 -15.578 1.00 19.24 N ATOM 2306 CE2 TRP B 89 -8.255 24.851 -16.804 1.00 19.05 C ATOM 2307 CE3 TRP B 89 -9.021 25.140 -19.087 1.00 19.40 C ATOM 2308 CZ2 TRP B 89 -7.404 23.798 -17.169 1.00 18.88 C ATOM 2309 CZ3 TRP B 89 -8.171 24.086 -19.451 1.00 18.54 C ATOM 2310 CH2 TRP B 89 -7.375 23.432 -18.490 1.00 18.89 C ATOM 2311 N PRO B 90 -11.763 29.361 -19.978 1.00 20.44 N ATOM 2312 CA PRO B 90 -12.861 30.169 -20.512 1.00 20.61 C ATOM 2313 C PRO B 90 -14.071 30.174 -19.588 1.00 20.78 C ATOM 2314 O PRO B 90 -14.307 29.202 -18.867 1.00 21.01 O ATOM 2315 CB PRO B 90 -13.219 29.448 -21.808 1.00 20.59 C ATOM 2316 CG PRO B 90 -11.948 28.803 -22.225 1.00 20.63 C ATOM 2317 CD PRO B 90 -11.274 28.380 -20.963 1.00 20.45 C ATOM 2318 N ALA B 91 -14.824 31.266 -19.605 1.00 20.61 N ATOM 2319 CA ALA B 91 -16.104 31.312 -18.920 1.00 20.56 C ATOM 2320 C ALA B 91 -16.974 30.163 -19.430 1.00 20.62 C ATOM 2321 O ALA B 91 -16.796 29.695 -20.562 1.00 20.67 O ATOM 2322 CB ALA B 91 -16.788 32.649 -19.164 1.00 20.51 C ATOM 2323 N MET B 92 -17.901 29.702 -18.593 1.00 20.35 N ATOM 2324 CA MET B 92 -18.836 28.670 -19.002 1.00 20.00 C ATOM 2325 C MET B 92 -19.926 29.265 -19.893 1.00 19.75 C ATOM 2326 O MET B 92 -20.591 30.217 -19.486 1.00 19.83 O ATOM 2327 CB MET B 92 -19.456 27.983 -17.783 1.00 20.12 C ATOM 2328 CG MET B 92 -20.318 26.785 -18.146 1.00 20.24 C ATOM 2329 SD MET B 92 -20.395 25.553 -16.848 1.00 20.60 S ATOM 2330 CE MET B 92 -21.562 26.297 -15.726 1.00 21.07 C ATOM 2331 N PRO B 93 -20.108 28.712 -21.115 1.00 19.48 N ATOM 2332 CA PRO B 93 -21.146 29.204 -22.021 1.00 19.24 C ATOM 2333 C PRO B 93 -22.539 29.097 -21.398 1.00 18.97 C ATOM 2334 O PRO B 93 -22.791 28.182 -20.605 1.00 19.07 O ATOM 2335 CB PRO B 93 -21.027 28.265 -23.224 1.00 19.15 C ATOM 2336 CG PRO B 93 -19.631 27.786 -23.181 1.00 19.18 C ATOM 2337 CD PRO B 93 -19.333 27.620 -21.734 1.00 19.32 C ATOM 2338 N GLN B 94 -23.423 30.033 -21.740 1.00 18.46 N ATOM 2339 CA GLN B 94 -24.776 30.051 -21.188 1.00 17.97 C ATOM 2340 C GLN B 94 -25.544 28.776 -21.527 1.00 17.34 C ATOM 2341 O GLN B 94 -26.280 28.265 -20.685 1.00 17.39 O ATOM 2342 CB GLN B 94 -25.554 31.288 -21.647 1.00 18.13 C ATOM 2343 CG GLN B 94 -25.144 32.574 -20.944 1.00 19.23 C ATOM 2344 CD GLN B 94 -26.060 33.757 -21.269 1.00 20.67 C ATOM 2345 OE1 GLN B 94 -27.223 33.795 -20.853 1.00 21.32 O ATOM 2346 NE2 GLN B 94 -25.529 34.735 -22.000 1.00 20.70 N ATOM 2347 N SER B 95 -25.353 28.263 -22.745 1.00 16.57 N ATOM 2348 CA SER B 95 -25.989 27.013 -23.184 1.00 15.75 C ATOM 2349 C SER B 95 -25.531 25.790 -22.374 1.00 15.35 C ATOM 2350 O SER B 95 -26.315 24.868 -22.148 1.00 15.29 O ATOM 2351 CB SER B 95 -25.747 26.779 -24.672 1.00 15.52 C ATOM 2352 OG SER B 95 -24.364 26.652 -24.937 1.00 15.44 O ATOM 2353 N PHE B 96 -24.266 25.790 -21.949 1.00 14.53 N ATOM 2354 CA PHE B 96 -23.722 24.743 -21.082 1.00 13.76 C ATOM 2355 C PHE B 96 -24.451 24.785 -19.735 1.00 13.95 C ATOM 2356 O PHE B 96 -25.050 23.799 -19.299 1.00 13.96 O ATOM 2357 CB PHE B 96 -22.224 24.990 -20.850 1.00 13.34 C ATOM 2358 CG PHE B 96 -21.320 24.434 -21.924 1.00 11.37 C ATOM 2359 CD1 PHE B 96 -21.681 24.469 -23.266 1.00 9.14 C ATOM 2360 CD2 PHE B 96 -20.077 23.905 -21.583 1.00 8.97 C ATOM 2361 CE1 PHE B 96 -20.836 23.953 -24.246 1.00 8.66 C ATOM 2362 CE2 PHE B 96 -19.226 23.388 -22.556 1.00 8.53 C ATOM 2363 CZ PHE B 96 -19.602 23.415 -23.889 1.00 7.92 C ATOM 2364 N HIS B 97 -24.396 25.948 -19.093 1.00 13.85 N ATOM 2365 CA HIS B 97 -24.991 26.169 -17.779 1.00 13.85 C ATOM 2366 C HIS B 97 -26.501 25.869 -17.759 1.00 13.55 C ATOM 2367 O HIS B 97 -26.989 25.195 -16.849 1.00 13.58 O ATOM 2368 CB HIS B 97 -24.696 27.604 -17.326 1.00 13.89 C ATOM 2369 CG HIS B 97 -25.068 27.888 -15.904 1.00 14.57 C ATOM 2370 ND1 HIS B 97 -26.222 28.556 -15.557 1.00 15.10 N ATOM 2371 CD2 HIS B 97 -24.435 27.606 -14.742 1.00 15.03 C ATOM 2372 CE1 HIS B 97 -26.286 28.673 -14.243 1.00 15.42 C ATOM 2373 NE2 HIS B 97 -25.214 28.102 -13.724 1.00 15.54 N ATOM 2374 N ASN B 98 -27.216 26.357 -18.774 1.00 13.26 N ATOM 2375 CA ASN B 98 -28.662 26.160 -18.906 1.00 13.08 C ATOM 2376 C ASN B 98 -29.092 24.705 -19.066 1.00 12.79 C ATOM 2377 O ASN B 98 -29.952 24.223 -18.323 1.00 12.48 O ATOM 2378 CB ASN B 98 -29.217 27.003 -20.058 1.00 13.10 C ATOM 2379 CG ASN B 98 -29.490 28.446 -19.646 1.00 14.06 C ATOM 2380 OD1 ASN B 98 -30.299 28.705 -18.753 1.00 14.63 O ATOM 2381 ND2 ASN B 98 -28.817 29.391 -20.297 1.00 14.62 N ATOM 2382 N LEU B 99 -28.493 24.018 -20.038 1.00 12.36 N ATOM 2383 CA LEU B 99 -28.747 22.601 -20.255 1.00 12.03 C ATOM 2384 C LEU B 99 -28.396 21.775 -19.020 1.00 11.79 C ATOM 2385 O LEU B 99 -29.143 20.871 -18.640 1.00 11.86 O ATOM 2386 CB LEU B 99 -27.960 22.083 -21.457 1.00 11.66 C ATOM 2387 CG LEU B 99 -28.145 20.589 -21.726 1.00 12.27 C ATOM 2388 CD1 LEU B 99 -29.348 20.322 -22.620 1.00 10.99 C ATOM 2389 CD2 LEU B 99 -26.898 20.005 -22.334 1.00 14.02 C ATOM 2390 N CYS B 100 -27.257 22.086 -18.409 1.00 11.55 N ATOM 2391 CA CYS B 100 -26.780 21.345 -17.247 1.00 11.24 C ATOM 2392 C CYS B 100 -27.761 21.420 -16.080 1.00 11.64 C ATOM 2393 O CYS B 100 -28.102 20.388 -15.485 1.00 11.50 O ATOM 2394 CB CYS B 100 -25.408 21.851 -16.804 1.00 10.86 C ATOM 2395 SG CYS B 100 -24.826 21.149 -15.255 1.00 9.88 S ATOM 2396 N GLN B 101 -28.208 22.635 -15.756 1.00 11.83 N ATOM 2397 CA GLN B 101 -29.112 22.826 -14.625 1.00 12.12 C ATOM 2398 C GLN B 101 -30.473 22.181 -14.889 1.00 12.22 C ATOM 2399 O GLN B 101 -31.056 21.575 -13.986 1.00 12.29 O ATOM 2400 CB GLN B 101 -29.240 24.305 -14.231 1.00 12.03 C ATOM 2401 CG GLN B 101 -27.974 24.880 -13.579 1.00 12.76 C ATOM 2402 CD GLN B 101 -28.259 25.726 -12.338 1.00 14.30 C ATOM 2403 OE1 GLN B 101 -29.123 25.389 -11.524 1.00 16.17 O ATOM 2404 NE2 GLN B 101 -27.516 26.812 -12.176 1.00 13.56 N ATOM 2405 N ARG B 102 -30.952 22.282 -16.128 1.00 12.24 N ATOM 2406 CA ARG B 102 -32.166 21.586 -16.545 1.00 12.60 C ATOM 2407 C ARG B 102 -32.052 20.078 -16.319 1.00 12.66 C ATOM 2408 O ARG B 102 -32.987 19.456 -15.817 1.00 12.44 O ATOM 2409 CB ARG B 102 -32.482 21.865 -18.021 1.00 12.81 C ATOM 2410 CG ARG B 102 -33.343 23.101 -18.278 1.00 13.61 C ATOM 2411 CD ARG B 102 -33.637 23.313 -19.779 1.00 16.11 C ATOM 2412 NE ARG B 102 -34.053 22.091 -20.477 1.00 17.97 N ATOM 2413 CZ ARG B 102 -35.250 21.510 -20.360 1.00 18.79 C ATOM 2414 NH1 ARG B 102 -36.189 22.027 -19.573 1.00 19.07 N ATOM 2415 NH2 ARG B 102 -35.511 20.399 -21.034 1.00 18.82 N ATOM 2416 N ALA B 103 -30.903 19.502 -16.684 1.00 13.01 N ATOM 2417 CA ALA B 103 -30.688 18.059 -16.579 1.00 13.02 C ATOM 2418 C ALA B 103 -30.619 17.615 -15.125 1.00 13.21 C ATOM 2419 O ALA B 103 -31.256 16.627 -14.739 1.00 12.85 O ATOM 2420 CB ALA B 103 -29.426 17.643 -17.325 1.00 12.73 C ATOM 2421 N ALA B 104 -29.832 18.339 -14.329 1.00 13.40 N ATOM 2422 CA ALA B 104 -29.704 18.049 -12.906 1.00 13.96 C ATOM 2423 C ALA B 104 -31.079 18.095 -12.239 1.00 14.17 C ATOM 2424 O ALA B 104 -31.379 17.259 -11.393 1.00 15.12 O ATOM 2425 CB ALA B 104 -28.751 19.017 -12.247 1.00 13.87 C ATOM 2426 N THR B 105 -31.921 19.032 -12.666 1.00 14.27 N ATOM 2427 CA THR B 105 -33.290 19.149 -12.154 1.00 14.57 C ATOM 2428 C THR B 105 -34.187 18.008 -12.608 1.00 14.85 C ATOM 2429 O THR B 105 -34.896 17.411 -11.789 1.00 14.26 O ATOM 2430 CB THR B 105 -33.924 20.494 -12.528 1.00 14.60 C ATOM 2431 OG1 THR B 105 -33.186 21.542 -11.890 1.00 14.85 O ATOM 2432 CG2 THR B 105 -35.407 20.561 -12.085 1.00 14.03 C ATOM 2433 N ALA B 106 -34.154 17.696 -13.905 1.00 14.88 N ATOM 2434 CA ALA B 106 -34.933 16.569 -14.416 1.00 14.85 C ATOM 2435 C ALA B 106 -34.460 15.282 -13.751 1.00 14.89 C ATOM 2436 O ALA B 106 -35.229 14.341 -13.600 1.00 15.39 O ATOM 2437 CB ALA B 106 -34.832 16.468 -15.930 1.00 14.86 C ATOM 2438 N ALA B 107 -33.203 15.266 -13.315 1.00 14.86 N ATOM 2439 CA ALA B 107 -32.614 14.093 -12.678 1.00 14.80 C ATOM 2440 C ALA B 107 -32.819 14.020 -11.157 1.00 15.19 C ATOM 2441 O ALA B 107 -32.377 13.070 -10.516 1.00 14.99 O ATOM 2442 CB ALA B 107 -31.141 13.996 -13.029 1.00 14.88 C ATOM 2443 N GLY B 108 -33.507 15.013 -10.594 1.00 15.71 N ATOM 2444 CA GLY B 108 -33.801 15.063 -9.168 1.00 15.64 C ATOM 2445 C GLY B 108 -32.693 15.669 -8.328 1.00 16.02 C ATOM 2446 O GLY B 108 -32.598 15.388 -7.133 1.00 16.66 O ATOM 2447 N TYR B 109 -31.857 16.499 -8.945 1.00 16.24 N ATOM 2448 CA TYR B 109 -30.826 17.263 -8.229 1.00 16.61 C ATOM 2449 C TYR B 109 -31.078 18.763 -8.392 1.00 17.09 C ATOM 2450 O TYR B 109 -30.398 19.425 -9.178 1.00 17.27 O ATOM 2451 CB TYR B 109 -29.420 16.884 -8.713 1.00 16.28 C ATOM 2452 CG TYR B 109 -29.065 15.451 -8.416 1.00 14.81 C ATOM 2453 CD1 TYR B 109 -29.285 14.452 -9.356 1.00 12.05 C ATOM 2454 CD2 TYR B 109 -28.521 15.096 -7.187 1.00 13.98 C ATOM 2455 CE1 TYR B 109 -28.971 13.128 -9.081 1.00 13.30 C ATOM 2456 CE2 TYR B 109 -28.199 13.783 -6.901 1.00 14.60 C ATOM 2457 CZ TYR B 109 -28.423 12.801 -7.850 1.00 14.19 C ATOM 2458 OH TYR B 109 -28.113 11.497 -7.556 1.00 14.12 O ATOM 2459 N PRO B 110 -32.046 19.299 -7.619 1.00 17.64 N ATOM 2460 CA PRO B 110 -32.644 20.620 -7.832 1.00 17.97 C ATOM 2461 C PRO B 110 -31.698 21.813 -7.758 1.00 18.53 C ATOM 2462 O PRO B 110 -31.898 22.771 -8.500 1.00 18.96 O ATOM 2463 CB PRO B 110 -33.695 20.719 -6.715 1.00 17.74 C ATOM 2464 CG PRO B 110 -33.964 19.324 -6.319 1.00 17.65 C ATOM 2465 CD PRO B 110 -32.655 18.622 -6.460 1.00 17.36 C ATOM 2466 N ASP B 111 -30.696 21.788 -6.883 1.00 19.00 N ATOM 2467 CA ASP B 111 -29.877 23.001 -6.699 1.00 19.48 C ATOM 2468 C ASP B 111 -28.403 22.864 -7.123 1.00 19.34 C ATOM 2469 O ASP B 111 -27.521 23.502 -6.540 1.00 19.47 O ATOM 2470 CB ASP B 111 -30.003 23.525 -5.258 1.00 19.68 C ATOM 2471 CG ASP B 111 -30.061 25.049 -5.183 1.00 20.96 C ATOM 2472 OD1 ASP B 111 -29.252 25.731 -5.852 1.00 21.68 O ATOM 2473 OD2 ASP B 111 -30.921 25.577 -4.439 1.00 23.81 O ATOM 2474 N PHE B 112 -28.142 22.048 -8.143 1.00 19.10 N ATOM 2475 CA PHE B 112 -26.780 21.859 -8.663 1.00 18.99 C ATOM 2476 C PHE B 112 -26.208 23.172 -9.212 1.00 19.40 C ATOM 2477 O PHE B 112 -26.763 23.791 -10.123 1.00 19.84 O ATOM 2478 CB PHE B 112 -26.758 20.745 -9.724 1.00 19.05 C ATOM 2479 CG PHE B 112 -25.376 20.411 -10.274 1.00 17.61 C ATOM 2480 CD1 PHE B 112 -24.252 20.382 -9.452 1.00 15.89 C ATOM 2481 CD2 PHE B 112 -25.227 20.089 -11.625 1.00 17.29 C ATOM 2482 CE1 PHE B 112 -22.993 20.069 -9.964 1.00 16.37 C ATOM 2483 CE2 PHE B 112 -23.980 19.754 -12.161 1.00 16.71 C ATOM 2484 CZ PHE B 112 -22.860 19.746 -11.338 1.00 18.05 C ATOM 2485 N GLN B 113 -25.108 23.611 -8.625 1.00 19.30 N ATOM 2486 CA GLN B 113 -24.435 24.804 -9.091 1.00 19.46 C ATOM 2487 C GLN B 113 -23.017 24.393 -9.520 1.00 19.12 C ATOM 2488 O GLN B 113 -22.097 24.394 -8.695 1.00 19.40 O ATOM 2489 CB GLN B 113 -24.422 25.887 -7.996 1.00 19.54 C ATOM 2490 CG GLN B 113 -25.815 26.347 -7.519 1.00 21.19 C ATOM 2491 CD GLN B 113 -25.771 27.286 -6.304 1.00 24.72 C ATOM 2492 OE1 GLN B 113 -24.787 27.996 -6.078 1.00 26.47 O ATOM 2493 NE2 GLN B 113 -26.853 27.300 -5.527 1.00 25.64 N ATOM 2494 N PRO B 114 -22.846 24.013 -10.806 1.00 18.60 N ATOM 2495 CA PRO B 114 -21.531 23.610 -11.286 1.00 18.30 C ATOM 2496 C PRO B 114 -20.569 24.784 -11.343 1.00 17.78 C ATOM 2497 O PRO B 114 -20.984 25.908 -11.619 1.00 17.95 O ATOM 2498 CB PRO B 114 -21.812 23.080 -12.705 1.00 18.11 C ATOM 2499 CG PRO B 114 -23.031 23.773 -13.128 1.00 18.70 C ATOM 2500 CD PRO B 114 -23.861 23.920 -11.875 1.00 18.71 C ATOM 2501 N ASP B 115 -19.302 24.516 -11.063 1.00 17.21 N ATOM 2502 CA ASP B 115 -18.251 25.510 -11.194 1.00 17.04 C ATOM 2503 C ASP B 115 -17.153 24.964 -12.109 1.00 16.78 C ATOM 2504 O ASP B 115 -16.047 25.485 -12.151 1.00 17.35 O ATOM 2505 CB ASP B 115 -17.686 25.862 -9.814 1.00 17.09 C ATOM 2506 CG ASP B 115 -17.182 24.639 -9.051 1.00 17.73 C ATOM 2507 OD1 ASP B 115 -17.043 23.562 -9.669 1.00 16.21 O ATOM 2508 OD2 ASP B 115 -16.911 24.758 -7.830 1.00 18.26 O ATOM 2509 N ALA B 116 -17.473 23.907 -12.846 1.00 16.25 N ATOM 2510 CA ALA B 116 -16.470 23.137 -13.563 1.00 15.64 C ATOM 2511 C ALA B 116 -17.121 22.354 -14.701 1.00 15.57 C ATOM 2512 O ALA B 116 -18.120 21.647 -14.482 1.00 14.87 O ATOM 2513 CB ALA B 116 -15.768 22.177 -12.604 1.00 15.16 C ATOM 2514 N CYS B 117 -16.576 22.509 -15.910 1.00 15.31 N ATOM 2515 CA CYS B 117 -16.979 21.680 -17.041 1.00 15.53 C ATOM 2516 C CYS B 117 -15.777 21.099 -17.755 1.00 15.25 C ATOM 2517 O CYS B 117 -14.971 21.834 -18.323 1.00 15.60 O ATOM 2518 CB CYS B 117 -17.866 22.434 -18.032 1.00 15.53 C ATOM 2519 SG CYS B 117 -18.414 21.357 -19.420 1.00 17.90 S ATOM 2520 N LEU B 118 -15.651 19.776 -17.709 1.00 14.86 N ATOM 2521 CA LEU B 118 -14.610 19.093 -18.458 1.00 14.52 C ATOM 2522 C LEU B 118 -15.142 18.703 -19.830 1.00 14.24 C ATOM 2523 O LEU B 118 -16.203 18.092 -19.945 1.00 13.73 O ATOM 2524 CB LEU B 118 -14.096 17.881 -17.683 1.00 14.42 C ATOM 2525 CG LEU B 118 -13.073 16.946 -18.333 1.00 14.53 C ATOM 2526 CD1 LEU B 118 -11.777 17.678 -18.765 1.00 12.83 C ATOM 2527 CD2 LEU B 118 -12.775 15.817 -17.355 1.00 14.42 C ATOM 2528 N ILE B 119 -14.424 19.107 -20.873 1.00 14.47 N ATOM 2529 CA ILE B 119 -14.781 18.723 -22.239 1.00 14.50 C ATOM 2530 C ILE B 119 -13.838 17.619 -22.720 1.00 14.80 C ATOM 2531 O ILE B 119 -12.623 17.791 -22.767 1.00 14.97 O ATOM 2532 CB ILE B 119 -14.813 19.933 -23.227 1.00 14.27 C ATOM 2533 CG1 ILE B 119 -15.729 21.032 -22.683 1.00 14.05 C ATOM 2534 CG2 ILE B 119 -15.322 19.495 -24.614 1.00 13.57 C ATOM 2535 CD1 ILE B 119 -15.808 22.294 -23.553 1.00 13.41 C ATOM 2536 N ASN B 120 -14.420 16.480 -23.059 1.00 14.83 N ATOM 2537 CA ASN B 120 -13.671 15.358 -23.567 1.00 14.94 C ATOM 2538 C ASN B 120 -13.911 15.229 -25.052 1.00 15.40 C ATOM 2539 O ASN B 120 -15.033 15.434 -25.511 1.00 15.80 O ATOM 2540 CB ASN B 120 -14.132 14.094 -22.860 1.00 14.68 C ATOM 2541 CG ASN B 120 -13.717 14.070 -21.423 1.00 14.46 C ATOM 2542 OD1 ASN B 120 -12.546 14.240 -21.113 1.00 15.18 O ATOM 2543 ND2 ASN B 120 -14.675 13.888 -20.527 1.00 14.64 N ATOM 2544 N ARG B 121 -12.857 14.913 -25.800 1.00 15.38 N ATOM 2545 CA ARG B 121 -12.989 14.606 -27.215 1.00 15.34 C ATOM 2546 C ARG B 121 -12.397 13.237 -27.490 1.00 15.23 C ATOM 2547 O ARG B 121 -11.200 13.010 -27.271 1.00 15.66 O ATOM 2548 CB ARG B 121 -12.321 15.669 -28.093 1.00 15.34 C ATOM 2549 CG ARG B 121 -12.560 15.455 -29.600 1.00 16.44 C ATOM 2550 CD ARG B 121 -11.766 16.420 -30.470 1.00 16.45 C ATOM 2551 NE ARG B 121 -10.321 16.303 -30.276 1.00 16.93 N ATOM 2552 CZ ARG B 121 -9.431 17.195 -30.710 1.00 17.03 C ATOM 2553 NH1 ARG B 121 -9.828 18.271 -31.384 1.00 15.14 N ATOM 2554 NH2 ARG B 121 -8.135 17.002 -30.482 1.00 16.83 N ATOM 2555 N TYR B 122 -13.254 12.337 -27.972 1.00 15.17 N ATOM 2556 CA TYR B 122 -12.873 10.983 -28.376 1.00 14.76 C ATOM 2557 C TYR B 122 -12.746 10.863 -29.902 1.00 14.82 C ATOM 2558 O TYR B 122 -13.729 11.033 -30.629 1.00 14.72 O ATOM 2559 CB TYR B 122 -13.924 9.982 -27.883 1.00 14.65 C ATOM 2560 CG TYR B 122 -14.122 9.951 -26.378 1.00 13.87 C ATOM 2561 CD1 TYR B 122 -14.905 10.910 -25.731 1.00 13.56 C ATOM 2562 CD2 TYR B 122 -13.540 8.952 -25.609 1.00 13.11 C ATOM 2563 CE1 TYR B 122 -15.081 10.885 -24.344 1.00 13.85 C ATOM 2564 CE2 TYR B 122 -13.726 8.906 -24.233 1.00 15.70 C ATOM 2565 CZ TYR B 122 -14.491 9.874 -23.606 1.00 13.69 C ATOM 2566 OH TYR B 122 -14.659 9.814 -22.249 1.00 13.51 O ATOM 2567 N ALA B 123 -11.537 10.580 -30.384 1.00 15.00 N ATOM 2568 CA ALA B 123 -11.344 10.138 -31.767 1.00 14.93 C ATOM 2569 C ALA B 123 -11.465 8.611 -31.771 1.00 15.13 C ATOM 2570 O ALA B 123 -11.481 7.999 -30.692 1.00 15.08 O ATOM 2571 CB ALA B 123 -9.969 10.584 -32.284 1.00 14.93 C ATOM 2572 N PRO B 124 -11.546 7.980 -32.967 1.00 15.39 N ATOM 2573 CA PRO B 124 -11.632 6.514 -33.011 1.00 15.44 C ATOM 2574 C PRO B 124 -10.535 5.860 -32.180 1.00 15.35 C ATOM 2575 O PRO B 124 -9.401 6.330 -32.181 1.00 16.11 O ATOM 2576 CB PRO B 124 -11.423 6.194 -34.503 1.00 15.74 C ATOM 2577 CG PRO B 124 -11.918 7.396 -35.218 1.00 15.34 C ATOM 2578 CD PRO B 124 -11.535 8.562 -34.329 1.00 15.54 C ATOM 2579 N GLY B 125 -10.865 4.793 -31.467 1.00 15.15 N ATOM 2580 CA GLY B 125 -9.891 4.124 -30.615 1.00 15.17 C ATOM 2581 C GLY B 125 -9.761 4.704 -29.208 1.00 15.23 C ATOM 2582 O GLY B 125 -9.470 3.965 -28.271 1.00 15.55 O ATOM 2583 N ALA B 126 -9.971 6.013 -29.052 1.00 14.75 N ATOM 2584 CA ALA B 126 -9.835 6.657 -27.739 1.00 14.95 C ATOM 2585 C ALA B 126 -10.803 6.069 -26.717 1.00 14.94 C ATOM 2586 O ALA B 126 -11.901 5.618 -27.067 1.00 14.95 O ATOM 2587 CB ALA B 126 -10.013 8.171 -27.842 1.00 14.84 C ATOM 2588 N LYS B 127 -10.382 6.068 -25.457 1.00 14.71 N ATOM 2589 CA LYS B 127 -11.116 5.383 -24.398 1.00 14.70 C ATOM 2590 C LYS B 127 -10.891 6.101 -23.074 1.00 14.22 C ATOM 2591 O LYS B 127 -10.046 6.980 -22.972 1.00 14.32 O ATOM 2592 CB LYS B 127 -10.628 3.937 -24.267 1.00 14.65 C ATOM 2593 CG LYS B 127 -9.163 3.831 -23.813 1.00 14.25 C ATOM 2594 CD LYS B 127 -8.802 2.409 -23.418 1.00 13.87 C ATOM 2595 CE LYS B 127 -7.365 2.317 -22.919 1.00 13.37 C ATOM 2596 NZ LYS B 127 -6.358 2.896 -23.863 1.00 12.38 N ATOM 2597 N LEU B 128 -11.631 5.705 -22.052 1.00 14.03 N ATOM 2598 CA LEU B 128 -11.329 6.166 -20.696 1.00 13.38 C ATOM 2599 C LEU B 128 -11.534 4.985 -19.770 1.00 13.24 C ATOM 2600 O LEU B 128 -12.636 4.454 -19.683 1.00 12.42 O ATOM 2601 CB LEU B 128 -12.208 7.362 -20.328 1.00 13.40 C ATOM 2602 CG LEU B 128 -11.913 8.260 -19.122 1.00 13.99 C ATOM 2603 CD1 LEU B 128 -10.534 8.884 -19.178 1.00 15.22 C ATOM 2604 CD2 LEU B 128 -12.959 9.342 -19.094 1.00 14.75 C ATOM 2605 N SER B 129 -10.450 4.555 -19.118 1.00 13.42 N ATOM 2606 CA SER B 129 -10.470 3.386 -18.228 1.00 13.61 C ATOM 2607 C SER B 129 -11.437 3.574 -17.065 1.00 13.65 C ATOM 2608 O SER B 129 -11.720 4.705 -16.670 1.00 13.81 O ATOM 2609 CB SER B 129 -9.070 3.091 -17.677 1.00 13.54 C ATOM 2610 OG SER B 129 -8.102 3.081 -18.712 1.00 14.18 O ATOM 2611 N LEU B 130 -11.951 2.460 -16.541 1.00 13.58 N ATOM 2612 CA LEU B 130 -12.726 2.456 -15.308 1.00 13.75 C ATOM 2613 C LEU B 130 -12.011 3.307 -14.270 1.00 13.46 C ATOM 2614 O LEU B 130 -10.802 3.183 -14.091 1.00 13.58 O ATOM 2615 CB LEU B 130 -12.897 1.036 -14.751 1.00 13.50 C ATOM 2616 CG LEU B 130 -14.127 0.174 -15.027 1.00 14.38 C ATOM 2617 CD1 LEU B 130 -14.358 -0.724 -13.816 1.00 14.15 C ATOM 2618 CD2 LEU B 130 -15.391 0.975 -15.317 1.00 13.84 C ATOM 2619 N HIS B 131 -12.778 4.155 -13.593 1.00 12.97 N ATOM 2620 CA HIS B 131 -12.263 5.141 -12.643 1.00 12.23 C ATOM 2621 C HIS B 131 -13.446 5.750 -11.876 1.00 12.38 C ATOM 2622 O HIS B 131 -14.595 5.651 -12.314 1.00 11.97 O ATOM 2623 CB HIS B 131 -11.530 6.252 -13.388 1.00 11.66 C ATOM 2624 CG HIS B 131 -12.448 7.177 -14.121 1.00 10.02 C ATOM 2625 ND1 HIS B 131 -12.893 6.922 -15.400 1.00 7.32 N ATOM 2626 CD2 HIS B 131 -13.028 8.342 -13.744 1.00 8.97 C ATOM 2627 CE1 HIS B 131 -13.697 7.897 -15.786 1.00 7.11 C ATOM 2628 NE2 HIS B 131 -13.796 8.772 -14.799 1.00 7.52 N ATOM 2629 N GLN B 132 -13.156 6.376 -10.739 1.00 12.68 N ATOM 2630 CA GLN B 132 -14.157 7.121 -9.986 1.00 12.99 C ATOM 2631 C GLN B 132 -13.889 8.609 -10.123 1.00 13.09 C ATOM 2632 O GLN B 132 -12.736 9.021 -10.230 1.00 12.98 O ATOM 2633 CB GLN B 132 -14.075 6.767 -8.502 1.00 13.18 C ATOM 2634 CG GLN B 132 -14.522 5.376 -8.144 1.00 14.17 C ATOM 2635 CD GLN B 132 -14.140 5.019 -6.720 1.00 15.33 C ATOM 2636 OE1 GLN B 132 -12.954 4.890 -6.401 1.00 16.74 O ATOM 2637 NE2 GLN B 132 -15.141 4.852 -5.856 1.00 13.68 N ATOM 2638 N ASP B 133 -14.943 9.422 -10.094 1.00 13.23 N ATOM 2639 CA ASP B 133 -14.760 10.861 -9.926 1.00 13.57 C ATOM 2640 C ASP B 133 -14.689 11.146 -8.442 1.00 14.17 C ATOM 2641 O ASP B 133 -15.726 11.297 -7.778 1.00 14.74 O ATOM 2642 CB ASP B 133 -15.895 11.662 -10.568 1.00 13.13 C ATOM 2643 CG ASP B 133 -15.852 11.616 -12.072 1.00 12.61 C ATOM 2644 OD1 ASP B 133 -15.157 10.725 -12.603 1.00 13.31 O ATOM 2645 OD2 ASP B 133 -16.506 12.463 -12.720 1.00 10.45 O ATOM 2646 N LYS B 134 -13.469 11.201 -7.919 1.00 14.34 N ATOM 2647 CA LYS B 134 -13.269 11.408 -6.493 1.00 14.71 C ATOM 2648 C LYS B 134 -12.323 12.563 -6.167 1.00 14.93 C ATOM 2649 O LYS B 134 -11.973 12.768 -5.006 1.00 15.40 O ATOM 2650 CB LYS B 134 -12.829 10.111 -5.811 1.00 14.52 C ATOM 2651 CG LYS B 134 -11.455 9.606 -6.198 1.00 15.77 C ATOM 2652 CD LYS B 134 -11.063 8.440 -5.310 1.00 17.07 C ATOM 2653 CE LYS B 134 -9.918 7.649 -5.898 1.00 18.93 C ATOM 2654 NZ LYS B 134 -9.539 6.528 -4.983 1.00 20.27 N ATOM 2655 N ALA B 135 -11.957 13.348 -7.178 1.00 15.07 N ATOM 2656 CA ALA B 135 -11.117 14.533 -6.962 1.00 15.38 C ATOM 2657 C ALA B 135 -11.889 15.759 -6.421 1.00 15.50 C ATOM 2658 O ALA B 135 -11.299 16.815 -6.198 1.00 15.57 O ATOM 2659 CB ALA B 135 -10.358 14.887 -8.237 1.00 15.26 C ATOM 2660 N GLU B 136 -13.199 15.605 -6.219 1.00 15.44 N ATOM 2661 CA GLU B 136 -14.069 16.698 -5.788 1.00 15.00 C ATOM 2662 C GLU B 136 -14.330 16.614 -4.291 1.00 14.60 C ATOM 2663 O GLU B 136 -14.727 15.556 -3.791 1.00 14.61 O ATOM 2664 CB GLU B 136 -15.404 16.680 -6.549 1.00 15.07 C ATOM 2665 CG GLU B 136 -15.288 16.834 -8.055 1.00 15.31 C ATOM 2666 CD GLU B 136 -14.873 15.545 -8.773 1.00 16.16 C ATOM 2667 OE1 GLU B 136 -14.233 15.653 -9.835 1.00 16.56 O ATOM 2668 OE2 GLU B 136 -15.172 14.430 -8.289 1.00 15.90 O ATOM 2669 N PRO B 137 -14.111 17.730 -3.566 1.00 14.30 N ATOM 2670 CA PRO B 137 -14.227 17.725 -2.107 1.00 14.15 C ATOM 2671 C PRO B 137 -15.663 17.623 -1.579 1.00 14.24 C ATOM 2672 O PRO B 137 -15.866 17.127 -0.462 1.00 14.86 O ATOM 2673 CB PRO B 137 -13.596 19.059 -1.703 1.00 13.92 C ATOM 2674 CG PRO B 137 -13.717 19.910 -2.904 1.00 13.98 C ATOM 2675 CD PRO B 137 -13.558 19.000 -4.064 1.00 13.92 C ATOM 2676 N ASP B 138 -16.640 18.085 -2.360 1.00 13.61 N ATOM 2677 CA ASP B 138 -18.042 18.070 -1.937 1.00 13.18 C ATOM 2678 C ASP B 138 -18.876 17.033 -2.704 1.00 12.99 C ATOM 2679 O ASP B 138 -19.405 17.311 -3.785 1.00 12.32 O ATOM 2680 CB ASP B 138 -18.659 19.465 -2.069 1.00 13.00 C ATOM 2681 CG ASP B 138 -20.037 19.563 -1.433 1.00 13.55 C ATOM 2682 OD1 ASP B 138 -20.561 18.544 -0.919 1.00 14.29 O ATOM 2683 OD2 ASP B 138 -20.610 20.670 -1.454 1.00 14.14 O ATOM 2684 N LEU B 139 -19.005 15.847 -2.114 1.00 12.89 N ATOM 2685 CA LEU B 139 -19.654 14.706 -2.769 1.00 12.69 C ATOM 2686 C LEU B 139 -21.175 14.786 -2.880 1.00 12.94 C ATOM 2687 O LEU B 139 -21.795 13.896 -3.470 1.00 13.52 O ATOM 2688 CB LEU B 139 -19.237 13.390 -2.098 1.00 12.55 C ATOM 2689 CG LEU B 139 -17.739 13.096 -2.210 1.00 11.91 C ATOM 2690 CD1 LEU B 139 -17.339 11.909 -1.343 1.00 11.28 C ATOM 2691 CD2 LEU B 139 -17.346 12.896 -3.680 1.00 11.75 C ATOM 2692 N ARG B 140 -21.777 15.838 -2.331 1.00 12.59 N ATOM 2693 CA ARG B 140 -23.219 16.018 -2.434 1.00 12.71 C ATOM 2694 C ARG B 140 -23.639 16.371 -3.860 1.00 13.33 C ATOM 2695 O ARG B 140 -24.762 16.063 -4.268 1.00 13.36 O ATOM 2696 CB ARG B 140 -23.720 17.096 -1.472 1.00 12.07 C ATOM 2697 CG ARG B 140 -23.589 16.738 0.017 1.00 11.16 C ATOM 2698 CD ARG B 140 -23.891 17.947 0.896 1.00 8.97 C ATOM 2699 NE ARG B 140 -22.951 19.051 0.666 1.00 7.20 N ATOM 2700 CZ ARG B 140 -23.081 20.272 1.181 1.00 8.42 C ATOM 2701 NH1 ARG B 140 -24.119 20.565 1.974 1.00 6.37 N ATOM 2702 NH2 ARG B 140 -22.168 21.207 0.910 1.00 7.42 N ATOM 2703 N ALA B 141 -22.743 17.019 -4.606 1.00 13.32 N ATOM 2704 CA ALA B 141 -23.080 17.519 -5.924 1.00 13.93 C ATOM 2705 C ALA B 141 -23.014 16.393 -6.945 1.00 14.09 C ATOM 2706 O ALA B 141 -22.067 15.601 -6.933 1.00 14.22 O ATOM 2707 CB ALA B 141 -22.156 18.658 -6.324 1.00 14.19 C ATOM 2708 N PRO B 142 -24.023 16.315 -7.835 1.00 14.12 N ATOM 2709 CA PRO B 142 -24.054 15.239 -8.824 1.00 13.98 C ATOM 2710 C PRO B 142 -23.035 15.429 -9.958 1.00 13.92 C ATOM 2711 O PRO B 142 -22.375 16.470 -10.056 1.00 13.42 O ATOM 2712 CB PRO B 142 -25.483 15.323 -9.367 1.00 13.94 C ATOM 2713 CG PRO B 142 -25.821 16.767 -9.253 1.00 13.72 C ATOM 2714 CD PRO B 142 -25.199 17.201 -7.956 1.00 13.77 C ATOM 2715 N ILE B 143 -22.907 14.410 -10.796 1.00 13.80 N ATOM 2716 CA ILE B 143 -22.164 14.536 -12.035 1.00 14.32 C ATOM 2717 C ILE B 143 -23.195 14.566 -13.155 1.00 14.86 C ATOM 2718 O ILE B 143 -24.106 13.743 -13.174 1.00 15.32 O ATOM 2719 CB ILE B 143 -21.199 13.338 -12.251 1.00 14.30 C ATOM 2720 CG1 ILE B 143 -20.191 13.209 -11.088 1.00 13.89 C ATOM 2721 CG2 ILE B 143 -20.501 13.431 -13.620 1.00 13.83 C ATOM 2722 CD1 ILE B 143 -19.173 14.336 -10.961 1.00 12.99 C ATOM 2723 N VAL B 144 -23.072 15.536 -14.055 1.00 15.23 N ATOM 2724 CA VAL B 144 -23.914 15.608 -15.255 1.00 15.65 C ATOM 2725 C VAL B 144 -23.025 15.469 -16.493 1.00 15.74 C ATOM 2726 O VAL B 144 -22.070 16.232 -16.680 1.00 15.57 O ATOM 2727 CB VAL B 144 -24.742 16.914 -15.315 1.00 15.63 C ATOM 2728 CG1 VAL B 144 -25.538 16.988 -16.607 1.00 15.47 C ATOM 2729 CG2 VAL B 144 -25.677 17.017 -14.110 1.00 15.66 C ATOM 2730 N SER B 145 -23.350 14.478 -17.320 1.00 15.97 N ATOM 2731 CA SER B 145 -22.463 14.002 -18.373 1.00 15.98 C ATOM 2732 C SER B 145 -23.224 13.929 -19.694 1.00 16.23 C ATOM 2733 O SER B 145 -24.092 13.078 -19.867 1.00 17.21 O ATOM 2734 CB SER B 145 -21.936 12.626 -17.985 1.00 15.67 C ATOM 2735 OG SER B 145 -20.868 12.205 -18.812 1.00 17.41 O ATOM 2736 N VAL B 146 -22.918 14.849 -20.605 1.00 15.86 N ATOM 2737 CA VAL B 146 -23.623 14.980 -21.875 1.00 15.59 C ATOM 2738 C VAL B 146 -22.861 14.269 -23.000 1.00 15.85 C ATOM 2739 O VAL B 146 -21.654 14.443 -23.120 1.00 15.95 O ATOM 2740 CB VAL B 146 -23.801 16.478 -22.241 1.00 15.53 C ATOM 2741 CG1 VAL B 146 -24.644 16.642 -23.500 1.00 14.41 C ATOM 2742 CG2 VAL B 146 -24.412 17.256 -21.067 1.00 14.93 C ATOM 2743 N SER B 147 -23.569 13.467 -23.803 1.00 15.86 N ATOM 2744 CA SER B 147 -22.993 12.748 -24.946 1.00 16.10 C ATOM 2745 C SER B 147 -23.372 13.434 -26.244 1.00 15.99 C ATOM 2746 O SER B 147 -24.538 13.763 -26.455 1.00 15.75 O ATOM 2747 CB SER B 147 -23.503 11.304 -25.007 1.00 16.34 C ATOM 2748 OG SER B 147 -22.762 10.434 -24.171 1.00 17.28 O ATOM 2749 N LEU B 148 -22.384 13.635 -27.113 1.00 16.24 N ATOM 2750 CA LEU B 148 -22.581 14.338 -28.382 1.00 16.32 C ATOM 2751 C LEU B 148 -21.741 13.715 -29.493 1.00 16.18 C ATOM 2752 O LEU B 148 -20.524 13.566 -29.351 1.00 15.84 O ATOM 2753 CB LEU B 148 -22.196 15.820 -28.239 1.00 16.31 C ATOM 2754 CG LEU B 148 -22.932 16.790 -27.310 1.00 16.37 C ATOM 2755 CD1 LEU B 148 -22.115 18.054 -27.163 1.00 16.05 C ATOM 2756 CD2 LEU B 148 -24.328 17.134 -27.816 1.00 15.82 C ATOM 2757 N GLY B 149 -22.389 13.370 -30.604 1.00 16.57 N ATOM 2758 CA GLY B 149 -21.690 12.844 -31.778 1.00 16.52 C ATOM 2759 C GLY B 149 -21.766 11.333 -31.860 1.00 16.81 C ATOM 2760 O GLY B 149 -22.841 10.751 -31.697 1.00 17.10 O ATOM 2761 N LEU B 150 -20.619 10.706 -32.108 1.00 16.73 N ATOM 2762 CA LEU B 150 -20.521 9.257 -32.307 1.00 16.72 C ATOM 2763 C LEU B 150 -20.954 8.463 -31.075 1.00 16.68 C ATOM 2764 O LEU B 150 -20.679 8.884 -29.946 1.00 17.19 O ATOM 2765 CB LEU B 150 -19.092 8.864 -32.715 1.00 16.44 C ATOM 2766 CG LEU B 150 -18.586 9.301 -34.099 1.00 17.00 C ATOM 2767 CD1 LEU B 150 -17.300 8.574 -34.458 1.00 16.53 C ATOM 2768 CD2 LEU B 150 -19.629 9.078 -35.179 1.00 16.11 C ATOM 2769 N PRO B 151 -21.627 7.309 -31.284 1.00 16.62 N ATOM 2770 CA PRO B 151 -22.052 6.510 -30.133 1.00 16.51 C ATOM 2771 C PRO B 151 -20.869 5.850 -29.439 1.00 16.72 C ATOM 2772 O PRO B 151 -19.851 5.576 -30.078 1.00 17.01 O ATOM 2773 CB PRO B 151 -22.962 5.449 -30.755 1.00 16.65 C ATOM 2774 CG PRO B 151 -22.439 5.289 -32.165 1.00 16.06 C ATOM 2775 CD PRO B 151 -21.989 6.666 -32.568 1.00 16.32 C ATOM 2776 N ALA B 152 -21.003 5.621 -28.134 1.00 16.63 N ATOM 2777 CA ALA B 152 -19.969 4.977 -27.340 1.00 16.30 C ATOM 2778 C ALA B 152 -20.625 4.016 -26.381 1.00 16.27 C ATOM 2779 O ALA B 152 -21.820 4.138 -26.099 1.00 16.58 O ATOM 2780 CB ALA B 152 -19.161 6.023 -26.564 1.00 16.23 C ATOM 2781 N ILE B 153 -19.855 3.061 -25.874 1.00 16.28 N ATOM 2782 CA ILE B 153 -20.331 2.235 -24.774 1.00 16.46 C ATOM 2783 C ILE B 153 -19.764 2.759 -23.454 1.00 16.65 C ATOM 2784 O ILE B 153 -18.549 2.776 -23.246 1.00 16.75 O ATOM 2785 CB ILE B 153 -20.030 0.739 -24.982 1.00 16.29 C ATOM 2786 CG1 ILE B 153 -20.746 0.244 -26.238 1.00 16.93 C ATOM 2787 CG2 ILE B 153 -20.511 -0.069 -23.788 1.00 16.45 C ATOM 2788 CD1 ILE B 153 -20.024 -0.875 -26.984 1.00 18.41 C ATOM 2789 N PHE B 154 -20.677 3.207 -22.594 1.00 16.57 N ATOM 2790 CA PHE B 154 -20.390 3.708 -21.257 1.00 16.65 C ATOM 2791 C PHE B 154 -20.606 2.557 -20.297 1.00 17.00 C ATOM 2792 O PHE B 154 -21.670 1.941 -20.295 1.00 17.25 O ATOM 2793 CB PHE B 154 -21.373 4.846 -20.955 1.00 16.34 C ATOM 2794 CG PHE B 154 -21.176 5.534 -19.620 1.00 16.28 C ATOM 2795 CD1 PHE B 154 -20.020 6.274 -19.345 1.00 15.46 C ATOM 2796 CD2 PHE B 154 -22.188 5.491 -18.652 1.00 15.04 C ATOM 2797 CE1 PHE B 154 -19.866 6.923 -18.113 1.00 14.73 C ATOM 2798 CE2 PHE B 154 -22.045 6.147 -17.420 1.00 12.97 C ATOM 2799 CZ PHE B 154 -20.891 6.862 -17.154 1.00 13.70 C ATOM 2800 N GLN B 155 -19.614 2.240 -19.479 1.00 17.35 N ATOM 2801 CA GLN B 155 -19.892 1.260 -18.437 1.00 18.24 C ATOM 2802 C GLN B 155 -20.070 1.909 -17.075 1.00 17.85 C ATOM 2803 O GLN B 155 -19.469 2.933 -16.794 1.00 17.84 O ATOM 2804 CB GLN B 155 -18.895 0.103 -18.416 1.00 18.31 C ATOM 2805 CG GLN B 155 -17.469 0.505 -18.433 1.00 20.48 C ATOM 2806 CD GLN B 155 -16.697 -0.295 -19.427 1.00 22.01 C ATOM 2807 OE1 GLN B 155 -17.224 -0.659 -20.473 1.00 24.46 O ATOM 2808 NE2 GLN B 155 -15.443 -0.585 -19.115 1.00 22.05 N ATOM 2809 N PHE B 156 -20.933 1.325 -16.258 1.00 17.72 N ATOM 2810 CA PHE B 156 -21.340 1.946 -15.016 1.00 17.90 C ATOM 2811 C PHE B 156 -21.403 0.880 -13.928 1.00 18.39 C ATOM 2812 O PHE B 156 -22.213 -0.047 -14.008 1.00 18.79 O ATOM 2813 CB PHE B 156 -22.691 2.658 -15.213 1.00 17.23 C ATOM 2814 CG PHE B 156 -23.045 3.623 -14.105 1.00 16.50 C ATOM 2815 CD1 PHE B 156 -22.411 4.872 -14.014 1.00 13.94 C ATOM 2816 CD2 PHE B 156 -24.022 3.293 -13.160 1.00 14.10 C ATOM 2817 CE1 PHE B 156 -22.732 5.763 -12.995 1.00 12.97 C ATOM 2818 CE2 PHE B 156 -24.360 4.186 -12.131 1.00 12.86 C ATOM 2819 CZ PHE B 156 -23.716 5.417 -12.044 1.00 12.59 C ATOM 2820 N GLY B 157 -20.520 1.004 -12.938 1.00 18.97 N ATOM 2821 CA GLY B 157 -20.465 0.093 -11.774 1.00 20.09 C ATOM 2822 C GLY B 157 -21.509 0.389 -10.707 1.00 20.41 C ATOM 2823 O GLY B 157 -22.617 0.791 -11.033 1.00 20.96 O ATOM 2824 N GLY B 158 -21.195 0.200 -9.428 1.00 21.08 N ATOM 2825 CA GLY B 158 -19.911 -0.256 -8.955 1.00 21.64 C ATOM 2826 C GLY B 158 -19.225 0.726 -8.026 1.00 22.02 C ATOM 2827 O GLY B 158 -18.621 1.681 -8.488 1.00 22.23 O ATOM 2828 N LEU B 159 -19.309 0.494 -6.716 1.00 22.46 N ATOM 2829 CA LEU B 159 -18.443 1.203 -5.761 1.00 22.86 C ATOM 2830 C LEU B 159 -17.051 0.554 -5.712 1.00 23.11 C ATOM 2831 O LEU B 159 -16.056 1.222 -5.425 1.00 22.97 O ATOM 2832 CB LEU B 159 -19.051 1.228 -4.350 1.00 22.64 C ATOM 2833 CG LEU B 159 -19.106 2.566 -3.587 1.00 22.87 C ATOM 2834 CD1 LEU B 159 -19.074 2.328 -2.063 1.00 22.02 C ATOM 2835 CD2 LEU B 159 -18.016 3.568 -3.993 1.00 21.19 C ATOM 2836 N LYS B 160 -16.994 -0.752 -5.977 1.00 23.42 N ATOM 2837 CA LYS B 160 -15.720 -1.465 -6.123 1.00 23.80 C ATOM 2838 C LYS B 160 -15.359 -1.582 -7.604 1.00 23.97 C ATOM 2839 O LYS B 160 -16.229 -1.485 -8.475 1.00 24.03 O ATOM 2840 CB LYS B 160 -15.781 -2.856 -5.492 1.00 23.82 C ATOM 2841 CG LYS B 160 -16.036 -2.901 -3.986 1.00 24.57 C ATOM 2842 CD LYS B 160 -17.532 -2.952 -3.670 1.00 25.61 C ATOM 2843 CE LYS B 160 -17.878 -4.147 -2.789 1.00 25.95 C ATOM 2844 NZ LYS B 160 -17.913 -5.421 -3.568 1.00 25.26 N ATOM 2845 N ARG B 161 -14.073 -1.786 -7.880 1.00 24.12 N ATOM 2846 CA ARG B 161 -13.551 -1.871 -9.243 1.00 24.37 C ATOM 2847 C ARG B 161 -14.184 -3.045 -10.002 1.00 24.35 C ATOM 2848 O ARG B 161 -14.306 -3.021 -11.226 1.00 24.24 O ATOM 2849 CB ARG B 161 -12.015 -1.995 -9.192 1.00 24.36 C ATOM 2850 CG ARG B 161 -11.288 -2.136 -10.530 1.00 25.24 C ATOM 2851 CD ARG B 161 -11.255 -0.845 -11.356 1.00 26.77 C ATOM 2852 NE ARG B 161 -10.239 0.116 -10.919 1.00 27.71 N ATOM 2853 CZ ARG B 161 -9.625 0.987 -11.723 1.00 28.11 C ATOM 2854 NH1 ARG B 161 -9.892 1.011 -13.023 1.00 28.39 N ATOM 2855 NH2 ARG B 161 -8.723 1.830 -11.232 1.00 27.92 N ATOM 2856 N ASN B 162 -14.563 -4.085 -9.264 1.00 24.54 N ATOM 2857 CA ASN B 162 -14.951 -5.347 -9.887 1.00 24.80 C ATOM 2858 C ASN B 162 -16.347 -5.897 -9.585 1.00 24.41 C ATOM 2859 O ASN B 162 -16.552 -7.110 -9.639 1.00 24.58 O ATOM 2860 CB ASN B 162 -13.903 -6.424 -9.587 1.00 24.87 C ATOM 2861 CG ASN B 162 -13.789 -6.729 -8.106 1.00 26.28 C ATOM 2862 OD1 ASN B 162 -14.305 -5.991 -7.267 1.00 27.87 O ATOM 2863 ND2 ASN B 162 -13.110 -7.822 -7.778 1.00 27.91 N ATOM 2864 N ASP B 163 -17.310 -5.030 -9.287 1.00 23.93 N ATOM 2865 CA ASP B 163 -18.690 -5.495 -9.188 1.00 23.65 C ATOM 2866 C ASP B 163 -19.418 -5.149 -10.484 1.00 23.13 C ATOM 2867 O ASP B 163 -19.007 -4.222 -11.194 1.00 23.21 O ATOM 2868 CB ASP B 163 -19.399 -4.976 -7.925 1.00 23.74 C ATOM 2869 CG ASP B 163 -19.044 -3.553 -7.596 1.00 24.41 C ATOM 2870 OD1 ASP B 163 -18.449 -2.882 -8.464 1.00 26.03 O ATOM 2871 OD2 ASP B 163 -19.360 -3.106 -6.471 1.00 24.01 O ATOM 2872 N PRO B 164 -20.480 -5.912 -10.814 1.00 22.42 N ATOM 2873 CA PRO B 164 -21.099 -5.873 -12.134 1.00 21.91 C ATOM 2874 C PRO B 164 -21.147 -4.489 -12.791 1.00 21.34 C ATOM 2875 O PRO B 164 -21.587 -3.512 -12.178 1.00 21.27 O ATOM 2876 CB PRO B 164 -22.522 -6.415 -11.879 1.00 21.82 C ATOM 2877 CG PRO B 164 -22.597 -6.739 -10.406 1.00 22.05 C ATOM 2878 CD PRO B 164 -21.188 -6.854 -9.932 1.00 22.44 C ATOM 2879 N LEU B 165 -20.680 -4.429 -14.033 1.00 20.58 N ATOM 2880 CA LEU B 165 -20.753 -3.226 -14.844 1.00 19.83 C ATOM 2881 C LEU B 165 -21.961 -3.313 -15.761 1.00 19.58 C ATOM 2882 O LEU B 165 -22.177 -4.338 -16.414 1.00 19.77 O ATOM 2883 CB LEU B 165 -19.488 -3.079 -15.693 1.00 19.56 C ATOM 2884 CG LEU B 165 -18.120 -3.053 -15.013 1.00 19.42 C ATOM 2885 CD1 LEU B 165 -17.021 -3.221 -16.044 1.00 19.53 C ATOM 2886 CD2 LEU B 165 -17.927 -1.762 -14.235 1.00 19.93 C ATOM 2887 N LYS B 166 -22.759 -2.250 -15.798 1.00 19.16 N ATOM 2888 CA LYS B 166 -23.744 -2.084 -16.864 1.00 18.60 C ATOM 2889 C LYS B 166 -23.021 -1.484 -18.060 1.00 18.14 C ATOM 2890 O LYS B 166 -22.129 -0.642 -17.896 1.00 18.60 O ATOM 2891 CB LYS B 166 -24.890 -1.166 -16.436 1.00 18.67 C ATOM 2892 CG LYS B 166 -25.792 -1.757 -15.382 1.00 18.97 C ATOM 2893 CD LYS B 166 -27.064 -0.945 -15.217 1.00 19.88 C ATOM 2894 CE LYS B 166 -27.981 -1.605 -14.195 1.00 20.37 C ATOM 2895 NZ LYS B 166 -29.403 -1.227 -14.419 1.00 21.26 N ATOM 2896 N ARG B 167 -23.394 -1.926 -19.256 1.00 17.32 N ATOM 2897 CA ARG B 167 -22.788 -1.435 -20.490 1.00 17.00 C ATOM 2898 C ARG B 167 -23.847 -0.764 -21.340 1.00 16.40 C ATOM 2899 O ARG B 167 -24.721 -1.422 -21.883 1.00 16.21 O ATOM 2900 CB ARG B 167 -22.115 -2.576 -21.246 1.00 17.20 C ATOM 2901 CG ARG B 167 -20.764 -2.957 -20.668 1.00 18.41 C ATOM 2902 CD ARG B 167 -20.297 -4.296 -21.200 1.00 19.13 C ATOM 2903 NE ARG B 167 -18.867 -4.489 -20.961 1.00 21.32 N ATOM 2904 CZ ARG B 167 -18.345 -5.103 -19.900 1.00 21.61 C ATOM 2905 NH1 ARG B 167 -19.136 -5.598 -18.954 1.00 22.04 N ATOM 2906 NH2 ARG B 167 -17.026 -5.222 -19.786 1.00 21.12 N ATOM 2907 N LEU B 168 -23.779 0.558 -21.440 1.00 16.00 N ATOM 2908 CA LEU B 168 -24.867 1.315 -22.055 1.00 15.74 C ATOM 2909 C LEU B 168 -24.432 1.964 -23.356 1.00 14.98 C ATOM 2910 O LEU B 168 -23.344 2.519 -23.439 1.00 14.96 O ATOM 2911 CB LEU B 168 -25.394 2.375 -21.080 1.00 15.84 C ATOM 2912 CG LEU B 168 -25.704 1.876 -19.661 1.00 16.94 C ATOM 2913 CD1 LEU B 168 -25.296 2.932 -18.654 1.00 16.75 C ATOM 2914 CD2 LEU B 168 -27.172 1.509 -19.498 1.00 16.39 C ATOM 2915 N LEU B 169 -25.286 1.885 -24.371 1.00 14.21 N ATOM 2916 CA LEU B 169 -25.017 2.576 -25.625 1.00 13.47 C ATOM 2917 C LEU B 169 -25.553 3.986 -25.541 1.00 12.57 C ATOM 2918 O LEU B 169 -26.760 4.207 -25.596 1.00 12.51 O ATOM 2919 CB LEU B 169 -25.601 1.842 -26.849 1.00 13.29 C ATOM 2920 CG LEU B 169 -25.253 2.495 -28.199 1.00 13.34 C ATOM 2921 CD1 LEU B 169 -23.739 2.477 -28.454 1.00 14.04 C ATOM 2922 CD2 LEU B 169 -25.996 1.836 -29.356 1.00 13.35 C ATOM 2923 N LEU B 170 -24.628 4.927 -25.404 1.00 12.08 N ATOM 2924 CA LEU B 170 -24.935 6.339 -25.324 1.00 11.68 C ATOM 2925 C LEU B 170 -24.863 6.964 -26.693 1.00 11.85 C ATOM 2926 O LEU B 170 -23.855 6.836 -27.392 1.00 11.73 O ATOM 2927 CB LEU B 170 -23.960 7.056 -24.386 1.00 11.20 C ATOM 2928 CG LEU B 170 -24.037 6.714 -22.893 1.00 10.40 C ATOM 2929 CD1 LEU B 170 -23.113 7.651 -22.117 1.00 8.23 C ATOM 2930 CD2 LEU B 170 -25.472 6.802 -22.394 1.00 8.25 C ATOM 2931 N GLU B 171 -25.934 7.659 -27.052 1.00 11.95 N ATOM 2932 CA GLU B 171 -26.063 8.273 -28.352 1.00 11.84 C ATOM 2933 C GLU B 171 -26.120 9.797 -28.249 1.00 11.94 C ATOM 2934 O GLU B 171 -26.365 10.357 -27.162 1.00 12.46 O ATOM 2935 CB GLU B 171 -27.303 7.721 -29.047 1.00 11.72 C ATOM 2936 CG GLU B 171 -27.255 6.217 -29.228 1.00 12.64 C ATOM 2937 CD GLU B 171 -28.201 5.734 -30.290 1.00 14.68 C ATOM 2938 OE1 GLU B 171 -28.422 6.485 -31.264 1.00 16.39 O ATOM 2939 OE2 GLU B 171 -28.723 4.604 -30.158 1.00 15.65 O ATOM 2940 N HIS B 172 -25.876 10.451 -29.385 1.00 11.26 N ATOM 2941 CA HIS B 172 -25.943 11.905 -29.531 1.00 10.92 C ATOM 2942 C HIS B 172 -27.181 12.479 -28.830 1.00 10.58 C ATOM 2943 O HIS B 172 -28.302 12.115 -29.167 1.00 10.45 O ATOM 2944 CB HIS B 172 -25.939 12.247 -31.029 1.00 10.80 C ATOM 2945 CG HIS B 172 -26.110 13.704 -31.332 1.00 10.73 C ATOM 2946 ND1 HIS B 172 -25.101 14.627 -31.153 1.00 11.07 N ATOM 2947 CD2 HIS B 172 -27.167 14.392 -31.822 1.00 10.79 C ATOM 2948 CE1 HIS B 172 -25.538 15.825 -31.497 1.00 11.46 C ATOM 2949 NE2 HIS B 172 -26.786 15.708 -31.918 1.00 12.14 N ATOM 2950 N GLY B 173 -26.967 13.349 -27.842 1.00 10.34 N ATOM 2951 CA GLY B 173 -28.068 13.950 -27.074 1.00 10.26 C ATOM 2952 C GLY B 173 -28.301 13.381 -25.675 1.00 10.32 C ATOM 2953 O GLY B 173 -28.838 14.070 -24.796 1.00 10.45 O ATOM 2954 N ASP B 174 -27.917 12.125 -25.468 1.00 10.34 N ATOM 2955 CA ASP B 174 -28.062 11.467 -24.169 1.00 10.35 C ATOM 2956 C ASP B 174 -27.274 12.159 -23.079 1.00 10.37 C ATOM 2957 O ASP B 174 -26.124 12.546 -23.291 1.00 10.63 O ATOM 2958 CB ASP B 174 -27.615 10.006 -24.249 1.00 10.29 C ATOM 2959 CG ASP B 174 -28.561 9.152 -25.066 1.00 11.24 C ATOM 2960 OD1 ASP B 174 -28.237 7.968 -25.282 1.00 11.27 O ATOM 2961 OD2 ASP B 174 -29.628 9.663 -25.488 1.00 11.38 O ATOM 2962 N VAL B 175 -27.906 12.307 -21.915 1.00 10.11 N ATOM 2963 CA VAL B 175 -27.264 12.848 -20.733 1.00 9.87 C ATOM 2964 C VAL B 175 -27.395 11.822 -19.611 1.00 9.97 C ATOM 2965 O VAL B 175 -28.509 11.421 -19.255 1.00 10.48 O ATOM 2966 CB VAL B 175 -27.894 14.202 -20.295 1.00 10.02 C ATOM 2967 CG1 VAL B 175 -27.254 14.699 -19.005 1.00 9.40 C ATOM 2968 CG2 VAL B 175 -27.751 15.261 -21.407 1.00 10.08 C ATOM 2969 N VAL B 176 -26.260 11.391 -19.062 1.00 9.52 N ATOM 2970 CA VAL B 176 -26.254 10.559 -17.854 1.00 8.67 C ATOM 2971 C VAL B 176 -25.953 11.437 -16.636 1.00 8.32 C ATOM 2972 O VAL B 176 -25.032 12.259 -16.661 1.00 9.04 O ATOM 2973 CB VAL B 176 -25.233 9.404 -17.971 1.00 8.77 C ATOM 2974 CG1 VAL B 176 -25.376 8.432 -16.809 1.00 8.29 C ATOM 2975 CG2 VAL B 176 -25.414 8.657 -19.307 1.00 8.42 C ATOM 2976 N VAL B 177 -26.737 11.271 -15.576 1.00 7.99 N ATOM 2977 CA VAL B 177 -26.523 12.008 -14.328 1.00 7.17 C ATOM 2978 C VAL B 177 -26.370 10.986 -13.209 1.00 7.10 C ATOM 2979 O VAL B 177 -27.154 10.043 -13.133 1.00 7.66 O ATOM 2980 CB VAL B 177 -27.712 12.960 -14.014 1.00 7.15 C ATOM 2981 CG1 VAL B 177 -27.542 13.628 -12.626 1.00 6.35 C ATOM 2982 CG2 VAL B 177 -27.880 14.009 -15.103 1.00 5.38 C ATOM 2983 N TRP B 178 -25.361 11.154 -12.356 1.00 6.60 N ATOM 2984 CA TRP B 178 -25.246 10.311 -11.162 1.00 6.00 C ATOM 2985 C TRP B 178 -24.798 11.055 -9.903 1.00 5.95 C ATOM 2986 O TRP B 178 -24.227 12.137 -9.991 1.00 6.08 O ATOM 2987 CB TRP B 178 -24.408 9.045 -11.428 1.00 5.76 C ATOM 2988 CG TRP B 178 -22.948 9.232 -11.751 1.00 4.59 C ATOM 2989 CD1 TRP B 178 -21.914 9.057 -10.898 1.00 4.10 C ATOM 2990 CD2 TRP B 178 -22.364 9.569 -13.023 1.00 4.31 C ATOM 2991 NE1 TRP B 178 -20.728 9.275 -11.534 1.00 4.58 N ATOM 2992 CE2 TRP B 178 -20.967 9.602 -12.838 1.00 4.04 C ATOM 2993 CE3 TRP B 178 -22.885 9.853 -14.292 1.00 4.49 C ATOM 2994 CZ2 TRP B 178 -20.069 9.895 -13.874 1.00 5.00 C ATOM 2995 CZ3 TRP B 178 -21.986 10.164 -15.336 1.00 6.13 C ATOM 2996 CH2 TRP B 178 -20.598 10.178 -15.116 1.00 4.21 C ATOM 2997 N GLY B 179 -25.086 10.477 -8.735 1.00 5.44 N ATOM 2998 CA GLY B 179 -24.889 11.152 -7.463 1.00 4.90 C ATOM 2999 C GLY B 179 -25.560 10.446 -6.298 1.00 4.55 C ATOM 3000 O GLY B 179 -26.131 9.356 -6.451 1.00 4.18 O ATOM 3001 N GLY B 180 -25.501 11.075 -5.129 1.00 4.70 N ATOM 3002 CA GLY B 180 -25.996 10.460 -3.893 1.00 4.84 C ATOM 3003 C GLY B 180 -25.339 9.101 -3.775 1.00 5.29 C ATOM 3004 O GLY B 180 -24.127 8.975 -3.945 1.00 5.17 O ATOM 3005 N GLU B 181 -26.142 8.074 -3.546 1.00 5.97 N ATOM 3006 CA GLU B 181 -25.625 6.710 -3.414 1.00 7.22 C ATOM 3007 C GLU B 181 -24.666 6.242 -4.527 1.00 7.47 C ATOM 3008 O GLU B 181 -23.741 5.475 -4.248 1.00 6.82 O ATOM 3009 CB GLU B 181 -26.780 5.722 -3.247 1.00 7.56 C ATOM 3010 CG GLU B 181 -27.426 5.784 -1.870 1.00 9.79 C ATOM 3011 CD GLU B 181 -26.619 5.062 -0.804 1.00 13.96 C ATOM 3012 OE1 GLU B 181 -26.671 3.811 -0.779 1.00 15.62 O ATOM 3013 OE2 GLU B 181 -25.954 5.737 0.025 1.00 15.45 O ATOM 3014 N SER B 182 -24.879 6.712 -5.762 1.00 7.94 N ATOM 3015 CA SER B 182 -24.037 6.335 -6.910 1.00 8.86 C ATOM 3016 C SER B 182 -22.927 7.348 -7.267 1.00 9.51 C ATOM 3017 O SER B 182 -22.234 7.198 -8.289 1.00 9.85 O ATOM 3018 CB SER B 182 -24.905 6.041 -8.157 1.00 8.31 C ATOM 3019 OG SER B 182 -25.598 7.212 -8.578 1.00 8.40 O ATOM 3020 N ARG B 183 -22.748 8.365 -6.433 1.00 10.51 N ATOM 3021 CA ARG B 183 -21.765 9.414 -6.704 1.00 10.96 C ATOM 3022 C ARG B 183 -20.330 8.921 -6.965 1.00 11.32 C ATOM 3023 O ARG B 183 -19.627 9.489 -7.797 1.00 12.37 O ATOM 3024 CB ARG B 183 -21.785 10.464 -5.593 1.00 10.51 C ATOM 3025 CG ARG B 183 -20.796 11.607 -5.765 1.00 10.77 C ATOM 3026 CD ARG B 183 -21.023 12.375 -7.060 1.00 12.26 C ATOM 3027 NE ARG B 183 -20.155 13.551 -7.181 1.00 11.39 N ATOM 3028 CZ ARG B 183 -18.847 13.510 -7.433 1.00 9.96 C ATOM 3029 NH1 ARG B 183 -18.222 12.342 -7.575 1.00 7.90 N ATOM 3030 NH2 ARG B 183 -18.163 14.645 -7.525 1.00 9.19 N ATOM 3031 N LEU B 184 -19.898 7.887 -6.261 1.00 11.62 N ATOM 3032 CA LEU B 184 -18.528 7.392 -6.394 1.00 12.23 C ATOM 3033 C LEU B 184 -18.425 6.099 -7.220 1.00 12.62 C ATOM 3034 O LEU B 184 -17.395 5.419 -7.196 1.00 12.73 O ATOM 3035 CB LEU B 184 -17.882 7.208 -5.009 1.00 12.16 C ATOM 3036 CG LEU B 184 -17.473 8.481 -4.251 1.00 12.70 C ATOM 3037 CD1 LEU B 184 -17.137 8.209 -2.755 1.00 12.72 C ATOM 3038 CD2 LEU B 184 -16.315 9.173 -4.939 1.00 11.63 C ATOM 3039 N PHE B 185 -19.486 5.769 -7.953 1.00 12.71 N ATOM 3040 CA PHE B 185 -19.502 4.562 -8.765 1.00 13.04 C ATOM 3041 C PHE B 185 -18.451 4.645 -9.871 1.00 13.12 C ATOM 3042 O PHE B 185 -18.199 5.719 -10.432 1.00 12.49 O ATOM 3043 CB PHE B 185 -20.900 4.306 -9.362 1.00 13.20 C ATOM 3044 CG PHE B 185 -21.891 3.680 -8.401 1.00 13.27 C ATOM 3045 CD1 PHE B 185 -23.029 3.048 -8.887 1.00 12.99 C ATOM 3046 CD2 PHE B 185 -21.697 3.733 -7.011 1.00 14.40 C ATOM 3047 CE1 PHE B 185 -23.971 2.471 -8.011 1.00 12.38 C ATOM 3048 CE2 PHE B 185 -22.620 3.150 -6.129 1.00 13.88 C ATOM 3049 CZ PHE B 185 -23.761 2.520 -6.632 1.00 13.43 C ATOM 3050 N TYR B 186 -17.824 3.503 -10.150 1.00 13.13 N ATOM 3051 CA TYR B 186 -16.890 3.366 -11.263 1.00 13.45 C ATOM 3052 C TYR B 186 -17.643 3.464 -12.578 1.00 13.45 C ATOM 3053 O TYR B 186 -18.825 3.105 -12.657 1.00 13.39 O ATOM 3054 CB TYR B 186 -16.151 2.022 -11.188 1.00 13.65 C ATOM 3055 CG TYR B 186 -14.974 2.020 -10.244 1.00 14.45 C ATOM 3056 CD1 TYR B 186 -13.702 2.390 -10.689 1.00 15.26 C ATOM 3057 CD2 TYR B 186 -15.130 1.660 -8.899 1.00 15.67 C ATOM 3058 CE1 TYR B 186 -12.608 2.399 -9.821 1.00 16.33 C ATOM 3059 CE2 TYR B 186 -14.043 1.659 -8.020 1.00 15.97 C ATOM 3060 CZ TYR B 186 -12.785 2.031 -8.490 1.00 17.63 C ATOM 3061 OH TYR B 186 -11.700 2.039 -7.636 1.00 18.70 O ATOM 3062 N HIS B 187 -16.946 3.952 -13.602 1.00 13.41 N ATOM 3063 CA HIS B 187 -17.504 4.162 -14.927 1.00 13.10 C ATOM 3064 C HIS B 187 -16.360 4.424 -15.904 1.00 13.27 C ATOM 3065 O HIS B 187 -15.219 4.640 -15.493 1.00 13.28 O ATOM 3066 CB HIS B 187 -18.463 5.359 -14.919 1.00 12.91 C ATOM 3067 CG HIS B 187 -17.819 6.639 -14.476 1.00 13.05 C ATOM 3068 ND1 HIS B 187 -17.696 6.989 -13.145 1.00 12.51 N ATOM 3069 CD2 HIS B 187 -17.260 7.647 -15.185 1.00 11.75 C ATOM 3070 CE1 HIS B 187 -17.084 8.156 -13.056 1.00 12.78 C ATOM 3071 NE2 HIS B 187 -16.808 8.576 -14.281 1.00 13.48 N ATOM 3072 N GLY B 188 -16.675 4.416 -17.195 1.00 13.05 N ATOM 3073 CA GLY B 188 -15.665 4.579 -18.231 1.00 13.11 C ATOM 3074 C GLY B 188 -16.262 4.452 -19.619 1.00 12.94 C ATOM 3075 O GLY B 188 -17.447 4.165 -19.770 1.00 13.02 O ATOM 3076 N ILE B 189 -15.430 4.671 -20.632 1.00 12.75 N ATOM 3077 CA ILE B 189 -15.841 4.587 -22.029 1.00 12.49 C ATOM 3078 C ILE B 189 -14.894 3.648 -22.781 1.00 12.42 C ATOM 3079 O ILE B 189 -13.668 3.810 -22.708 1.00 12.32 O ATOM 3080 CB ILE B 189 -15.851 5.994 -22.700 1.00 12.43 C ATOM 3081 CG1 ILE B 189 -16.976 6.873 -22.125 1.00 12.18 C ATOM 3082 CG2 ILE B 189 -15.928 5.875 -24.237 1.00 11.84 C ATOM 3083 CD1 ILE B 189 -18.388 6.594 -22.676 1.00 10.73 C ATOM 3084 N GLN B 190 -15.471 2.675 -23.488 1.00 12.02 N ATOM 3085 CA GLN B 190 -14.703 1.707 -24.279 1.00 12.07 C ATOM 3086 C GLN B 190 -14.185 2.343 -25.561 1.00 11.89 C ATOM 3087 O GLN B 190 -14.811 3.271 -26.067 1.00 11.26 O ATOM 3088 CB GLN B 190 -15.576 0.506 -24.636 1.00 12.19 C ATOM 3089 CG GLN B 190 -16.294 -0.101 -23.448 1.00 13.32 C ATOM 3090 CD GLN B 190 -17.086 -1.336 -23.807 1.00 13.74 C ATOM 3091 OE1 GLN B 190 -17.228 -1.687 -24.983 1.00 15.17 O ATOM 3092 NE2 GLN B 190 -17.612 -2.007 -22.792 1.00 13.80 N ATOM 3093 N PRO B 191 -13.047 1.842 -26.103 1.00 12.05 N ATOM 3094 CA PRO B 191 -12.498 2.400 -27.343 1.00 12.40 C ATOM 3095 C PRO B 191 -13.594 2.788 -28.343 1.00 12.70 C ATOM 3096 O PRO B 191 -14.444 1.956 -28.694 1.00 12.34 O ATOM 3097 CB PRO B 191 -11.650 1.250 -27.895 1.00 12.41 C ATOM 3098 CG PRO B 191 -11.154 0.558 -26.668 1.00 12.45 C ATOM 3099 CD PRO B 191 -12.214 0.733 -25.597 1.00 12.15 C ATOM 3100 N LEU B 192 -13.584 4.054 -28.762 1.00 12.89 N ATOM 3101 CA LEU B 192 -14.591 4.574 -29.683 1.00 13.30 C ATOM 3102 C LEU B 192 -14.496 3.912 -31.053 1.00 13.50 C ATOM 3103 O LEU B 192 -13.413 3.830 -31.633 1.00 13.15 O ATOM 3104 CB LEU B 192 -14.447 6.091 -29.842 1.00 13.31 C ATOM 3105 CG LEU B 192 -15.719 6.809 -30.309 1.00 13.64 C ATOM 3106 CD1 LEU B 192 -16.591 7.140 -29.095 1.00 12.27 C ATOM 3107 CD2 LEU B 192 -15.399 8.067 -31.094 1.00 13.44 C ATOM 3108 N LYS B 193 -15.628 3.437 -31.566 1.00 13.71 N ATOM 3109 CA LYS B 193 -15.659 2.871 -32.916 1.00 13.91 C ATOM 3110 C LYS B 193 -15.815 3.991 -33.943 1.00 13.67 C ATOM 3111 O LYS B 193 -16.456 5.021 -33.662 1.00 13.59 O ATOM 3112 CB LYS B 193 -16.772 1.825 -33.071 1.00 14.24 C ATOM 3113 CG LYS B 193 -16.749 0.674 -32.041 1.00 15.35 C ATOM 3114 CD LYS B 193 -15.592 -0.323 -32.254 1.00 18.01 C ATOM 3115 CE LYS B 193 -14.443 -0.078 -31.263 1.00 18.25 C ATOM 3116 NZ LYS B 193 -13.429 -1.182 -31.228 1.00 18.48 N ATOM 3117 N ALA B 194 -15.210 3.791 -35.114 1.00 13.20 N ATOM 3118 CA ALA B 194 -15.226 4.773 -36.193 1.00 12.89 C ATOM 3119 C ALA B 194 -16.637 4.960 -36.741 1.00 12.74 C ATOM 3120 O ALA B 194 -17.451 4.035 -36.699 1.00 12.84 O ATOM 3121 CB ALA B 194 -14.262 4.354 -37.307 1.00 12.82 C ATOM 3122 N GLY B 195 -16.925 6.162 -37.238 1.00 12.52 N ATOM 3123 CA GLY B 195 -18.230 6.479 -37.818 1.00 12.62 C ATOM 3124 C GLY B 195 -18.334 7.937 -38.211 1.00 12.91 C ATOM 3125 O GLY B 195 -17.350 8.668 -38.157 1.00 13.15 O ATOM 3126 N PHE B 196 -19.531 8.357 -38.606 1.00 13.33 N ATOM 3127 CA PHE B 196 -19.808 9.752 -38.964 1.00 13.74 C ATOM 3128 C PHE B 196 -21.008 10.279 -38.180 1.00 14.07 C ATOM 3129 O PHE B 196 -21.936 9.527 -37.890 1.00 14.10 O ATOM 3130 CB PHE B 196 -20.088 9.872 -40.472 1.00 13.61 C ATOM 3131 CG PHE B 196 -20.526 11.252 -40.914 1.00 13.64 C ATOM 3132 CD1 PHE B 196 -19.584 12.263 -41.164 1.00 13.94 C ATOM 3133 CD2 PHE B 196 -21.882 11.539 -41.093 1.00 14.09 C ATOM 3134 CE1 PHE B 196 -19.988 13.543 -41.574 1.00 14.22 C ATOM 3135 CE2 PHE B 196 -22.297 12.812 -41.495 1.00 14.29 C ATOM 3136 CZ PHE B 196 -21.348 13.816 -41.739 1.00 13.89 C ATOM 3137 N HIS B 197 -20.977 11.564 -37.834 1.00 14.50 N ATOM 3138 CA HIS B 197 -22.174 12.270 -37.371 1.00 15.09 C ATOM 3139 C HIS B 197 -22.250 13.637 -38.059 1.00 15.38 C ATOM 3140 O HIS B 197 -21.222 14.263 -38.287 1.00 15.58 O ATOM 3141 CB HIS B 197 -22.204 12.404 -35.842 1.00 14.86 C ATOM 3142 CG HIS B 197 -23.527 12.855 -35.306 1.00 15.04 C ATOM 3143 ND1 HIS B 197 -23.886 14.184 -35.229 1.00 14.98 N ATOM 3144 CD2 HIS B 197 -24.590 12.154 -34.842 1.00 15.26 C ATOM 3145 CE1 HIS B 197 -25.107 14.282 -34.733 1.00 15.11 C ATOM 3146 NE2 HIS B 197 -25.556 13.065 -34.489 1.00 14.65 N ATOM 3147 N PRO B 198 -23.465 14.097 -38.417 1.00 15.82 N ATOM 3148 CA PRO B 198 -23.531 15.366 -39.151 1.00 16.12 C ATOM 3149 C PRO B 198 -22.947 16.558 -38.390 1.00 16.26 C ATOM 3150 O PRO B 198 -22.317 17.424 -39.000 1.00 16.27 O ATOM 3151 CB PRO B 198 -25.034 15.561 -39.374 1.00 16.19 C ATOM 3152 CG PRO B 198 -25.581 14.180 -39.388 1.00 16.22 C ATOM 3153 CD PRO B 198 -24.777 13.424 -38.372 1.00 15.71 C ATOM 3154 N LEU B 199 -23.136 16.583 -37.071 1.00 16.38 N ATOM 3155 CA LEU B 199 -22.794 17.746 -36.257 1.00 16.42 C ATOM 3156 C LEU B 199 -21.361 17.742 -35.724 1.00 16.69 C ATOM 3157 O LEU B 199 -20.766 18.805 -35.553 1.00 16.81 O ATOM 3158 CB LEU B 199 -23.795 17.908 -35.103 1.00 16.52 C ATOM 3159 CG LEU B 199 -25.273 18.071 -35.479 1.00 16.22 C ATOM 3160 CD1 LEU B 199 -26.112 18.313 -34.233 1.00 14.72 C ATOM 3161 CD2 LEU B 199 -25.474 19.193 -36.516 1.00 15.43 C ATOM 3162 N THR B 200 -20.815 16.554 -35.460 1.00 16.77 N ATOM 3163 CA THR B 200 -19.447 16.423 -34.939 1.00 16.50 C ATOM 3164 C THR B 200 -18.466 15.804 -35.940 1.00 16.68 C ATOM 3165 O THR B 200 -17.270 15.720 -35.664 1.00 16.84 O ATOM 3166 CB THR B 200 -19.394 15.577 -33.657 1.00 16.45 C ATOM 3167 OG1 THR B 200 -19.447 14.188 -34.001 1.00 15.49 O ATOM 3168 CG2 THR B 200 -20.532 15.940 -32.705 1.00 16.28 C ATOM 3169 N ILE B 201 -18.979 15.359 -37.084 1.00 16.62 N ATOM 3170 CA ILE B 201 -18.168 14.763 -38.163 1.00 16.61 C ATOM 3171 C ILE B 201 -17.634 13.359 -37.825 1.00 16.70 C ATOM 3172 O ILE B 201 -18.256 12.367 -38.193 1.00 16.92 O ATOM 3173 CB ILE B 201 -17.048 15.725 -38.690 1.00 16.54 C ATOM 3174 CG1 ILE B 201 -17.621 17.113 -39.025 1.00 16.74 C ATOM 3175 CG2 ILE B 201 -16.307 15.119 -39.885 1.00 16.28 C ATOM 3176 CD1 ILE B 201 -18.783 17.129 -40.031 1.00 16.97 C ATOM 3177 N ASP B 202 -16.510 13.271 -37.119 1.00 16.79 N ATOM 3178 CA ASP B 202 -15.826 11.984 -36.939 1.00 16.76 C ATOM 3179 C ASP B 202 -15.449 11.628 -35.489 1.00 16.44 C ATOM 3180 O ASP B 202 -14.653 10.708 -35.264 1.00 16.62 O ATOM 3181 CB ASP B 202 -14.564 11.964 -37.796 1.00 16.91 C ATOM 3182 CG ASP B 202 -13.526 12.955 -37.316 1.00 18.08 C ATOM 3183 OD1 ASP B 202 -13.321 13.982 -38.000 1.00 19.75 O ATOM 3184 OD2 ASP B 202 -12.921 12.716 -36.248 1.00 19.10 O ATOM 3185 N CYS B 203 -16.003 12.350 -34.518 1.00 15.55 N ATOM 3186 CA ACYS B 203 -15.623 12.158 -33.123 0.50 14.93 C ATOM 3187 CA BCYS B 203 -15.523 12.158 -33.123 0.50 14.93 C ATOM 3188 C CYS B 203 -16.815 12.266 -32.159 1.00 14.20 C ATOM 3189 O CYS B 203 -17.909 12.687 -32.553 1.00 13.97 O ATOM 3190 CB ACYS B 203 -14.520 13.157 -32.743 0.50 15.12 C ATOM 3191 CB BCYS B 203 -14.420 13.157 -32.743 0.50 15.12 C ATOM 3192 SG ACYS B 203 -15.102 14.850 -32.545 0.50 15.93 S ATOM 3193 SG BCYS B 203 -12.897 12.959 -33.684 0.50 15.93 S ATOM 3194 N ARG B 204 -16.593 11.864 -30.908 1.00 13.20 N ATOM 3195 CA ARG B 204 -17.585 12.023 -29.845 1.00 12.44 C ATOM 3196 C ARG B 204 -17.083 13.009 -28.790 1.00 12.31 C ATOM 3197 O ARG B 204 -15.971 12.870 -28.279 1.00 12.15 O ATOM 3198 CB ARG B 204 -17.916 10.683 -29.176 1.00 12.07 C ATOM 3199 CG ARG B 204 -18.747 10.830 -27.886 1.00 10.58 C ATOM 3200 CD ARG B 204 -18.822 9.539 -27.087 1.00 7.52 C ATOM 3201 NE ARG B 204 -19.733 9.645 -25.947 1.00 4.78 N ATOM 3202 CZ ARG B 204 -19.350 9.811 -24.678 1.00 2.00 C ATOM 3203 NH1 ARG B 204 -18.061 9.880 -24.361 1.00 2.00 N ATOM 3204 NH2 ARG B 204 -20.261 9.898 -23.721 1.00 2.00 N ATOM 3205 N TYR B 205 -17.912 14.000 -28.481 1.00 12.20 N ATOM 3206 CA TYR B 205 -17.648 14.924 -27.391 1.00 12.11 C ATOM 3207 C TYR B 205 -18.481 14.551 -26.178 1.00 12.27 C ATOM 3208 O TYR B 205 -19.598 14.053 -26.304 1.00 12.04 O ATOM 3209 CB TYR B 205 -17.964 16.363 -27.804 1.00 12.15 C ATOM 3210 CG TYR B 205 -17.087 16.919 -28.909 1.00 11.47 C ATOM 3211 CD1 TYR B 205 -15.800 17.387 -28.643 1.00 11.42 C ATOM 3212 CD2 TYR B 205 -17.558 16.999 -30.211 1.00 11.09 C ATOM 3213 CE1 TYR B 205 -14.994 17.917 -29.662 1.00 12.07 C ATOM 3214 CE2 TYR B 205 -16.767 17.517 -31.235 1.00 12.62 C ATOM 3215 CZ TYR B 205 -15.483 17.973 -30.959 1.00 12.51 C ATOM 3216 OH TYR B 205 -14.707 18.484 -31.982 1.00 12.01 O ATOM 3217 N ASN B 206 -17.916 14.793 -25.004 1.00 12.81 N ATOM 3218 CA ASN B 206 -18.618 14.640 -23.741 1.00 13.12 C ATOM 3219 C ASN B 206 -18.410 15.891 -22.889 1.00 13.33 C ATOM 3220 O ASN B 206 -17.305 16.419 -22.816 1.00 13.30 O ATOM 3221 CB ASN B 206 -18.134 13.377 -23.021 1.00 13.21 C ATOM 3222 CG ASN B 206 -18.387 13.415 -21.532 1.00 13.64 C ATOM 3223 OD1 ASN B 206 -17.509 13.789 -20.750 1.00 12.10 O ATOM 3224 ND2 ASN B 206 -19.591 13.023 -21.126 1.00 15.73 N ATOM 3225 N LEU B 207 -19.481 16.376 -22.271 1.00 14.07 N ATOM 3226 CA LEU B 207 -19.395 17.502 -21.338 1.00 14.63 C ATOM 3227 C LEU B 207 -19.706 16.994 -19.944 1.00 15.14 C ATOM 3228 O LEU B 207 -20.839 16.597 -19.669 1.00 15.60 O ATOM 3229 CB LEU B 207 -20.382 18.623 -21.704 1.00 14.36 C ATOM 3230 CG LEU B 207 -20.511 19.104 -23.148 1.00 14.13 C ATOM 3231 CD1 LEU B 207 -21.607 20.152 -23.276 1.00 13.53 C ATOM 3232 CD2 LEU B 207 -19.179 19.644 -23.649 1.00 13.81 C ATOM 3233 N THR B 208 -18.702 16.999 -19.070 1.00 15.71 N ATOM 3234 CA THR B 208 -18.897 16.590 -17.686 1.00 16.30 C ATOM 3235 C THR B 208 -18.954 17.818 -16.785 1.00 16.67 C ATOM 3236 O THR B 208 -17.960 18.534 -16.626 1.00 16.92 O ATOM 3237 CB THR B 208 -17.806 15.599 -17.209 1.00 16.55 C ATOM 3238 OG1 THR B 208 -17.762 14.467 -18.087 1.00 17.99 O ATOM 3239 CG2 THR B 208 -18.129 15.075 -15.810 1.00 16.29 C ATOM 3240 N PHE B 209 -20.130 18.076 -16.217 1.00 16.68 N ATOM 3241 CA PHE B 209 -20.298 19.196 -15.300 1.00 16.50 C ATOM 3242 C PHE B 209 -20.167 18.690 -13.891 1.00 16.66 C ATOM 3243 O PHE B 209 -20.698 17.627 -13.540 1.00 17.17 O ATOM 3244 CB PHE B 209 -21.655 19.879 -15.475 1.00 16.54 C ATOM 3245 CG PHE B 209 -21.850 20.514 -16.824 1.00 17.13 C ATOM 3246 CD1 PHE B 209 -21.456 21.825 -17.054 1.00 18.41 C ATOM 3247 CD2 PHE B 209 -22.439 19.798 -17.867 1.00 18.00 C ATOM 3248 CE1 PHE B 209 -21.636 22.416 -18.307 1.00 18.50 C ATOM 3249 CE2 PHE B 209 -22.625 20.374 -19.117 1.00 17.92 C ATOM 3250 CZ PHE B 209 -22.221 21.687 -19.340 1.00 19.03 C ATOM 3251 N ARG B 210 -19.435 19.443 -13.083 1.00 16.45 N ATOM 3252 CA ARG B 210 -19.235 19.107 -11.682 1.00 15.97 C ATOM 3253 C ARG B 210 -19.256 20.360 -10.812 1.00 15.74 C ATOM 3254 O ARG B 210 -19.060 21.482 -11.302 1.00 15.42 O ATOM 3255 CB ARG B 210 -17.886 18.407 -11.497 1.00 16.05 C ATOM 3256 CG ARG B 210 -17.657 17.208 -12.407 1.00 15.29 C ATOM 3257 CD ARG B 210 -16.378 16.497 -12.030 1.00 15.48 C ATOM 3258 NE ARG B 210 -16.088 15.347 -12.886 1.00 16.71 N ATOM 3259 CZ ARG B 210 -15.526 15.429 -14.094 1.00 17.86 C ATOM 3260 NH1 ARG B 210 -15.208 16.610 -14.623 1.00 16.36 N ATOM 3261 NH2 ARG B 210 -15.304 14.323 -14.789 1.00 17.46 N ATOM 3262 N GLN B 211 -19.499 20.166 -9.522 1.00 15.37 N ATOM 3263 CA GLN B 211 -19.099 21.171 -8.545 1.00 15.79 C ATOM 3264 C GLN B 211 -17.752 20.657 -8.049 1.00 16.19 C ATOM 3265 O GLN B 211 -17.680 19.619 -7.399 1.00 15.86 O ATOM 3266 CB GLN B 211 -20.125 21.342 -7.405 1.00 14.97 C ATOM 3267 CG GLN B 211 -19.721 22.358 -6.319 1.00 14.69 C ATOM 3268 CD GLN B 211 -20.356 22.077 -4.938 1.00 14.04 C ATOM 3269 OE1 GLN B 211 -19.649 21.968 -3.932 1.00 13.96 O ATOM 3270 NE2 GLN B 211 -21.680 21.963 -4.894 1.00 9.71 N ATOM 3271 N ALA B 212 -16.688 21.364 -8.414 1.00 16.99 N ATOM 3272 CA ALA B 212 -15.341 20.946 -8.070 1.00 18.61 C ATOM 3273 C ALA B 212 -14.776 21.693 -6.857 1.00 19.77 C ATOM 3274 O ALA B 212 -13.835 21.225 -6.220 1.00 20.01 O ATOM 3275 CB ALA B 212 -14.415 21.092 -9.277 1.00 18.18 C ATOM 3276 N GLY B 213 -15.357 22.849 -6.551 1.00 21.20 N ATOM 3277 CA GLY B 213 -14.912 23.652 -5.427 1.00 23.40 C ATOM 3278 C GLY B 213 -15.697 23.365 -4.162 1.00 25.15 C ATOM 3279 O GLY B 213 -16.167 22.247 -3.951 1.00 24.53 O ATOM 3280 N LYS B 214 -15.837 24.381 -3.316 1.00 20.00 N ATOM 3281 CA LYS B 214 -16.567 24.237 -2.062 1.00 20.00 C ATOM 3282 C LYS B 214 -17.598 25.348 -1.893 1.00 20.00 C ATOM 3283 O LYS B 214 -17.264 26.532 -1.944 1.00 20.00 O ATOM 3284 CB LYS B 214 -15.600 24.233 -0.877 1.00 20.00 C ATOM 3285 CG LYS B 214 -14.789 22.954 -0.742 1.00 20.00 C ATOM 3286 CD LYS B 214 -13.296 23.242 -0.761 1.00 20.00 C ATOM 3287 CE LYS B 214 -12.496 21.986 -1.065 1.00 20.00 C ATOM 3288 NZ LYS B 214 -11.116 22.059 -0.511 1.00 20.00 N ATOM 3289 N LYS B 215 -18.853 24.958 -1.691 1.00 20.00 N ATOM 3290 CA LYS B 215 -19.934 25.920 -1.514 1.00 20.00 C ATOM 3291 C LYS B 215 -19.663 26.843 -0.331 1.00 20.00 C ATOM 3292 O LYS B 215 -19.491 26.386 0.799 1.00 20.00 O ATOM 3293 CB LYS B 215 -21.268 25.196 -1.321 1.00 20.00 C ATOM 3294 CG LYS B 215 -21.967 24.825 -2.619 1.00 20.00 C ATOM 3295 CD LYS B 215 -23.446 24.557 -2.392 1.00 20.00 C ATOM 3296 CE LYS B 215 -24.096 23.963 -3.632 1.00 20.00 C ATOM 3297 NZ LYS B 215 -25.550 23.715 -3.432 1.00 20.00 N TER 3298 LYS B 215 ATOM 3299 P DT C 2 -1.013 10.027 -7.817 1.00 71.73 P ATOM 3300 OP1 DT C 2 0.054 11.061 -7.815 1.00 71.45 O ATOM 3301 OP2 DT C 2 -2.378 10.365 -8.295 1.00 71.16 O ATOM 3302 O5' DT C 2 -0.525 8.743 -8.649 1.00 71.22 O ATOM 3303 C5' DT C 2 0.856 8.331 -8.705 1.00 69.17 C ATOM 3304 C4' DT C 2 1.006 6.994 -9.428 1.00 67.26 C ATOM 3305 O4' DT C 2 1.168 5.941 -8.431 1.00 68.18 O ATOM 3306 C3' DT C 2 -0.165 6.594 -10.337 1.00 64.93 C ATOM 3307 O3' DT C 2 0.109 6.759 -11.755 1.00 58.73 O ATOM 3308 C2' DT C 2 -0.429 5.135 -9.957 1.00 66.69 C ATOM 3309 C1' DT C 2 0.158 4.954 -8.553 1.00 68.26 C ATOM 3310 N1 DT C 2 -0.778 5.011 -7.330 1.00 69.75 N ATOM 3311 C2 DT C 2 -2.056 5.573 -7.350 1.00 70.31 C ATOM 3312 O2 DT C 2 -2.597 6.075 -8.314 1.00 70.90 O ATOM 3313 N3 DT C 2 -2.737 5.537 -6.158 1.00 71.00 N ATOM 3314 C4 DT C 2 -2.306 5.015 -4.955 1.00 71.55 C ATOM 3315 O4 DT C 2 -3.022 5.044 -3.956 1.00 71.97 O ATOM 3316 C5 DT C 2 -0.971 4.441 -4.984 1.00 71.91 C ATOM 3317 C7 DT C 2 -0.368 3.835 -3.745 1.00 71.82 C ATOM 3318 C6 DT C 2 -0.291 4.470 -6.149 1.00 70.82 C ATOM 3319 P DA C 3 -1.051 7.126 -12.819 1.00 55.30 P ATOM 3320 OP1 DA C 3 -0.431 7.898 -13.908 1.00 56.16 O ATOM 3321 OP2 DA C 3 -2.230 7.700 -12.140 1.00 55.57 O ATOM 3322 O5' DA C 3 -1.513 5.726 -13.450 1.00 53.76 O ATOM 3323 C5' DA C 3 -2.640 5.689 -14.348 1.00 50.83 C ATOM 3324 C4' DA C 3 -3.780 4.801 -13.852 1.00 48.36 C ATOM 3325 O4' DA C 3 -3.324 3.426 -13.759 1.00 47.53 O ATOM 3326 C3' DA C 3 -4.379 5.090 -12.478 1.00 47.44 C ATOM 3327 O3' DA C 3 -5.746 4.712 -12.441 1.00 46.26 O ATOM 3328 C2' DA C 3 -3.615 4.179 -11.523 1.00 46.85 C ATOM 3329 C1' DA C 3 -3.151 3.025 -12.411 1.00 46.50 C ATOM 3330 N9 DA C 3 -1.735 2.717 -12.244 1.00 45.62 N ATOM 3331 C8 DA C 3 -0.755 2.819 -13.195 1.00 44.54 C ATOM 3332 N7 DA C 3 0.435 2.483 -12.764 1.00 44.08 N ATOM 3333 C5 DA C 3 0.223 2.128 -11.443 1.00 44.91 C ATOM 3334 C6 DA C 3 1.089 1.679 -10.421 1.00 45.17 C ATOM 3335 N6 DA C 3 2.402 1.494 -10.589 1.00 45.65 N ATOM 3336 N1 DA C 3 0.552 1.418 -9.209 1.00 45.92 N ATOM 3337 C2 DA C 3 -0.769 1.600 -9.025 1.00 45.98 C ATOM 3338 N3 DA C 3 -1.680 2.023 -9.904 1.00 45.47 N ATOM 3339 C4 DA C 3 -1.114 2.272 -11.103 1.00 45.22 C HETATM 3340 P MG1 C 4 -6.881 5.784 -12.743 1.00 45.71 P HETATM 3341 OP1 MG1 C 4 -6.492 7.081 -12.059 1.00 46.31 O HETATM 3342 OP2 MG1 C 4 -8.198 5.108 -12.449 1.00 46.67 O HETATM 3343 O5' MG1 C 4 -6.724 5.997 -14.331 1.00 45.06 O HETATM 3344 C5' MG1 C 4 -7.619 5.427 -15.284 1.00 42.22 C HETATM 3345 C4' MG1 C 4 -7.942 6.479 -16.345 1.00 40.91 C HETATM 3346 O4' MG1 C 4 -8.927 7.415 -15.881 1.00 39.86 O HETATM 3347 C3' MG1 C 4 -6.709 7.288 -16.737 1.00 39.41 C HETATM 3348 O3' MG1 C 4 -6.723 7.539 -18.149 1.00 38.09 O HETATM 3349 C2' MG1 C 4 -6.864 8.618 -16.005 1.00 40.50 C HETATM 3350 C1' MG1 C 4 -8.379 8.748 -15.862 1.00 40.76 C HETATM 3351 N9 MG1 C 4 -8.874 9.442 -14.637 1.00 41.94 N HETATM 3352 C8 MG1 C 4 -8.581 9.200 -13.339 1.00 41.55 C HETATM 3353 N7 MG1 C 4 -9.298 10.049 -12.564 1.00 41.00 N HETATM 3354 C5 MG1 C 4 -10.053 10.816 -13.383 1.00 41.00 C HETATM 3355 C6 MG1 C 4 -10.971 11.844 -13.189 1.00 41.14 C HETATM 3356 O6 MG1 C 4 -11.236 12.222 -12.027 1.00 41.02 O HETATM 3357 N1 MG1 C 4 -11.565 12.422 -14.257 1.00 40.99 N HETATM 3358 CM1 MG1 C 4 -12.524 13.509 -14.039 1.00 40.45 C HETATM 3359 C2 MG1 C 4 -11.281 12.011 -15.512 1.00 40.39 C HETATM 3360 N2 MG1 C 4 -11.853 12.568 -16.605 1.00 40.18 N HETATM 3361 N3 MG1 C 4 -10.405 11.018 -15.723 1.00 40.46 N HETATM 3362 C4 MG1 C 4 -9.780 10.421 -14.682 1.00 41.44 C ATOM 3363 P DT C 5 -6.658 6.428 -19.312 1.00 35.77 P ATOM 3364 OP1 DT C 5 -6.317 7.105 -20.579 1.00 34.98 O ATOM 3365 OP2 DT C 5 -7.893 5.622 -19.282 1.00 36.80 O ATOM 3366 O5' DT C 5 -5.478 5.472 -18.843 1.00 35.50 O ATOM 3367 C5' DT C 5 -4.129 5.883 -18.970 1.00 35.63 C ATOM 3368 C4' DT C 5 -3.249 4.657 -19.026 1.00 34.74 C ATOM 3369 O4' DT C 5 -3.288 4.018 -17.740 1.00 34.39 O ATOM 3370 C3' DT C 5 -3.663 3.602 -20.055 1.00 35.76 C ATOM 3371 O3' DT C 5 -2.624 3.499 -21.041 1.00 36.53 O ATOM 3372 C2' DT C 5 -3.837 2.309 -19.247 1.00 35.88 C ATOM 3373 C1' DT C 5 -3.116 2.629 -17.940 1.00 35.78 C ATOM 3374 N1 DT C 5 -3.614 1.952 -16.710 1.00 35.32 N ATOM 3375 C2 DT C 5 -2.708 1.300 -15.897 1.00 36.63 C ATOM 3376 O2 DT C 5 -1.514 1.233 -16.135 1.00 37.75 O ATOM 3377 N3 DT C 5 -3.250 0.713 -14.773 1.00 37.07 N ATOM 3378 C4 DT C 5 -4.587 0.733 -14.394 1.00 37.21 C ATOM 3379 O4 DT C 5 -4.966 0.187 -13.366 1.00 38.79 O ATOM 3380 C5 DT C 5 -5.489 1.437 -15.281 1.00 37.08 C ATOM 3381 C7 DT C 5 -6.963 1.524 -14.974 1.00 36.80 C ATOM 3382 C6 DT C 5 -4.960 2.010 -16.382 1.00 36.91 C ATOM 3383 P DG C 6 -2.745 2.662 -22.409 1.00 35.63 P ATOM 3384 OP1 DG C 6 -1.904 3.308 -23.432 1.00 36.32 O ATOM 3385 OP2 DG C 6 -4.160 2.361 -22.663 1.00 35.09 O ATOM 3386 O5' DG C 6 -1.999 1.287 -22.099 1.00 38.15 O ATOM 3387 C5' DG C 6 -0.660 1.251 -21.645 1.00 41.05 C ATOM 3388 C4' DG C 6 -0.404 -0.097 -20.997 1.00 44.08 C ATOM 3389 O4' DG C 6 -1.104 -0.215 -19.725 1.00 44.20 O ATOM 3390 C3' DG C 6 -0.871 -1.282 -21.838 1.00 46.02 C ATOM 3391 O3' DG C 6 0.149 -2.256 -21.833 1.00 48.89 O ATOM 3392 C2' DG C 6 -2.118 -1.785 -21.117 1.00 44.44 C ATOM 3393 C1' DG C 6 -1.662 -1.514 -19.691 1.00 44.10 C ATOM 3394 N9 DG C 6 -2.725 -1.578 -18.705 1.00 42.31 N ATOM 3395 C8 DG C 6 -4.037 -1.190 -18.827 1.00 43.03 C ATOM 3396 N7 DG C 6 -4.741 -1.383 -17.746 1.00 42.69 N ATOM 3397 C5 DG C 6 -3.824 -1.939 -16.858 1.00 41.62 C ATOM 3398 C6 DG C 6 -3.990 -2.374 -15.525 1.00 41.21 C ATOM 3399 O6 DG C 6 -5.027 -2.338 -14.852 1.00 41.76 O ATOM 3400 N1 DG C 6 -2.805 -2.878 -14.977 1.00 41.15 N ATOM 3401 C2 DG C 6 -1.601 -2.953 -15.652 1.00 41.65 C ATOM 3402 N2 DG C 6 -0.548 -3.466 -14.998 1.00 41.63 N ATOM 3403 N3 DG C 6 -1.436 -2.557 -16.906 1.00 42.52 N ATOM 3404 C4 DG C 6 -2.585 -2.066 -17.438 1.00 42.18 C ATOM 3405 P DC C 7 0.232 -3.359 -22.998 1.00 50.76 P ATOM 3406 OP1 DC C 7 1.181 -2.853 -24.023 1.00 50.22 O ATOM 3407 OP2 DC C 7 -1.138 -3.786 -23.391 1.00 50.42 O ATOM 3408 O5' DC C 7 0.863 -4.597 -22.193 1.00 51.68 O ATOM 3409 C5' DC C 7 1.759 -4.406 -21.104 1.00 53.30 C ATOM 3410 C4' DC C 7 1.538 -5.427 -20.001 1.00 54.58 C ATOM 3411 O4' DC C 7 0.436 -5.015 -19.146 1.00 53.04 O ATOM 3412 C3' DC C 7 1.209 -6.839 -20.492 1.00 56.70 C ATOM 3413 O3' DC C 7 2.009 -7.798 -19.802 1.00 61.99 O ATOM 3414 C2' DC C 7 -0.269 -7.005 -20.153 1.00 53.95 C ATOM 3415 C1' DC C 7 -0.376 -6.145 -18.898 1.00 50.68 C ATOM 3416 N1 DC C 7 -1.775 -5.743 -18.540 1.00 47.86 N ATOM 3417 C2 DC C 7 -2.186 -5.868 -17.202 1.00 46.52 C ATOM 3418 O2 DC C 7 -1.396 -6.287 -16.349 1.00 47.21 O ATOM 3419 N3 DC C 7 -3.451 -5.522 -16.863 1.00 44.79 N ATOM 3420 C4 DC C 7 -4.298 -5.073 -17.788 1.00 43.38 C ATOM 3421 N4 DC C 7 -5.523 -4.753 -17.363 1.00 40.86 N ATOM 3422 C5 DC C 7 -3.913 -4.940 -19.163 1.00 43.68 C ATOM 3423 C6 DC C 7 -2.656 -5.281 -19.490 1.00 45.33 C ATOM 3424 P DC C 8 2.964 -8.812 -20.601 1.00 65.84 P ATOM 3425 OP1 DC C 8 2.219 -9.327 -21.780 1.00 64.98 O ATOM 3426 OP2 DC C 8 3.531 -9.747 -19.599 1.00 65.83 O ATOM 3427 O5' DC C 8 4.153 -7.873 -21.117 1.00 69.06 O ATOM 3428 C5' DC C 8 5.025 -7.214 -20.203 1.00 74.13 C ATOM 3429 C4' DC C 8 5.908 -6.268 -20.990 1.00 77.74 C ATOM 3430 O4' DC C 8 5.079 -5.237 -21.572 1.00 78.02 O ATOM 3431 C3' DC C 8 6.987 -5.547 -20.194 1.00 80.11 C ATOM 3432 O3' DC C 8 8.126 -6.383 -20.246 1.00 84.07 O ATOM 3433 C2' DC C 8 7.175 -4.249 -20.980 1.00 79.58 C ATOM 3434 C1' DC C 8 5.813 -4.031 -21.651 1.00 78.79 C ATOM 3435 N1 DC C 8 4.946 -2.923 -21.096 1.00 78.47 N ATOM 3436 C2 DC C 8 4.561 -2.844 -19.735 1.00 78.35 C ATOM 3437 O2 DC C 8 4.929 -3.687 -18.907 1.00 78.20 O ATOM 3438 N3 DC C 8 3.767 -1.812 -19.341 1.00 78.29 N ATOM 3439 C4 DC C 8 3.358 -0.895 -20.226 1.00 78.31 C ATOM 3440 N4 DC C 8 2.586 0.100 -19.782 1.00 78.27 N ATOM 3441 C5 DC C 8 3.725 -0.963 -21.602 1.00 78.23 C ATOM 3442 C6 DC C 8 4.507 -1.981 -21.983 1.00 78.34 C ATOM 3443 P DT C 9 9.427 -6.268 -19.310 1.00 86.85 P ATOM 3444 OP1 DT C 9 9.036 -6.437 -17.889 1.00 86.88 O ATOM 3445 OP2 DT C 9 10.194 -5.072 -19.735 1.00 86.89 O ATOM 3446 O5' DT C 9 10.224 -7.580 -19.794 1.00 88.94 O ATOM 3447 C5' DT C 9 9.508 -8.726 -20.322 1.00 91.14 C ATOM 3448 C4' DT C 9 9.614 -8.895 -21.840 1.00 92.63 C ATOM 3449 O4' DT C 9 8.329 -9.280 -22.406 1.00 93.39 O ATOM 3450 C3' DT C 9 10.073 -7.696 -22.677 1.00 93.16 C ATOM 3451 O3' DT C 9 11.342 -7.993 -23.258 1.00 93.54 O ATOM 3452 C2' DT C 9 8.983 -7.517 -23.744 1.00 93.59 C ATOM 3453 C1' DT C 9 8.385 -8.920 -23.773 1.00 93.82 C ATOM 3454 N1 DT C 9 7.042 -9.110 -24.466 1.00 94.23 N ATOM 3455 C2 DT C 9 6.983 -9.991 -25.536 1.00 94.64 C ATOM 3456 O2 DT C 9 7.947 -10.610 -25.957 1.00 95.06 O ATOM 3457 N3 DT C 9 5.744 -10.126 -26.120 1.00 94.52 N ATOM 3458 C4 DT C 9 4.571 -9.487 -25.753 1.00 94.36 C ATOM 3459 O4 DT C 9 3.513 -9.684 -26.347 1.00 94.15 O ATOM 3460 C5 DT C 9 4.688 -8.582 -24.631 1.00 94.40 C ATOM 3461 C7 DT C 9 3.474 -7.832 -24.159 1.00 94.08 C ATOM 3462 C6 DT C 9 5.898 -8.437 -24.047 1.00 94.32 C TER 3463 DT C 9 ATOM 3464 P DG D 4 -8.363 -9.312 -8.250 1.00 73.68 P ATOM 3465 OP1 DG D 4 -7.511 -8.635 -7.224 1.00 73.72 O ATOM 3466 OP2 DG D 4 -8.744 -9.139 -9.683 1.00 73.48 O ATOM 3467 O5' DG D 4 -6.988 -9.867 -8.817 1.00 72.78 O ATOM 3468 C5' DG D 4 -6.271 -10.806 -8.017 1.00 70.99 C ATOM 3469 C4' DG D 4 -4.864 -10.357 -8.248 1.00 69.52 C ATOM 3470 O4' DG D 4 -4.837 -9.850 -9.606 1.00 68.49 O ATOM 3471 C3' DG D 4 -4.478 -9.220 -7.332 1.00 69.13 C ATOM 3472 O3' DG D 4 -3.186 -9.550 -6.913 1.00 70.61 O ATOM 3473 C2' DG D 4 -4.557 -7.962 -8.204 1.00 67.79 C ATOM 3474 C1' DG D 4 -4.383 -8.515 -9.619 1.00 66.61 C ATOM 3475 N9 DG D 4 -5.074 -7.760 -10.672 1.00 63.77 N ATOM 3476 C8 DG D 4 -6.338 -7.202 -10.671 1.00 62.48 C ATOM 3477 N7 DG D 4 -6.634 -6.572 -11.779 1.00 60.94 N ATOM 3478 C5 DG D 4 -5.489 -6.720 -12.563 1.00 60.53 C ATOM 3479 C6 DG D 4 -5.192 -6.257 -13.874 1.00 59.38 C ATOM 3480 O6 DG D 4 -5.918 -5.600 -14.626 1.00 58.72 O ATOM 3481 N1 DG D 4 -3.912 -6.625 -14.300 1.00 58.93 N ATOM 3482 C2 DG D 4 -3.021 -7.357 -13.542 1.00 59.70 C ATOM 3483 N2 DG D 4 -1.831 -7.632 -14.090 1.00 58.99 N ATOM 3484 N3 DG D 4 -3.283 -7.798 -12.315 1.00 60.74 N ATOM 3485 C4 DG D 4 -4.527 -7.444 -11.892 1.00 61.53 C ATOM 3486 P DC D 5 -2.379 -8.645 -5.882 1.00 71.60 P ATOM 3487 OP1 DC D 5 -1.524 -9.562 -5.079 1.00 71.30 O ATOM 3488 OP2 DC D 5 -3.328 -7.713 -5.217 1.00 70.92 O ATOM 3489 O5' DC D 5 -1.427 -7.837 -6.880 1.00 70.83 O ATOM 3490 C5' DC D 5 -0.906 -8.439 -8.069 1.00 70.43 C ATOM 3491 C4' DC D 5 -0.355 -7.335 -8.949 1.00 70.29 C ATOM 3492 O4' DC D 5 -1.370 -6.800 -9.845 1.00 68.73 O ATOM 3493 C3' DC D 5 0.137 -6.153 -8.125 1.00 70.95 C ATOM 3494 O3' DC D 5 1.522 -5.976 -8.363 1.00 73.39 O ATOM 3495 C2' DC D 5 -0.713 -4.972 -8.601 1.00 69.14 C ATOM 3496 C1' DC D 5 -1.135 -5.417 -9.997 1.00 66.51 C ATOM 3497 N1 DC D 5 -2.365 -4.732 -10.542 1.00 63.12 N ATOM 3498 C2 DC D 5 -2.387 -4.248 -11.869 1.00 61.02 C ATOM 3499 O2 DC D 5 -1.388 -4.384 -12.593 1.00 59.40 O ATOM 3500 N3 DC D 5 -3.518 -3.636 -12.325 1.00 59.54 N ATOM 3501 C4 DC D 5 -4.585 -3.500 -11.520 1.00 59.94 C ATOM 3502 N4 DC D 5 -5.679 -2.895 -11.998 1.00 58.87 N ATOM 3503 C5 DC D 5 -4.581 -3.981 -10.173 1.00 60.17 C ATOM 3504 C6 DC D 5 -3.465 -4.583 -9.737 1.00 61.91 C ATOM 3505 P DA D 6 2.486 -5.407 -7.216 1.00 75.16 P ATOM 3506 OP1 DA D 6 2.666 -6.483 -6.208 1.00 75.18 O ATOM 3507 OP2 DA D 6 1.988 -4.070 -6.794 1.00 75.11 O ATOM 3508 O5' DA D 6 3.855 -5.189 -8.030 1.00 74.93 O ATOM 3509 C5' DA D 6 3.941 -5.482 -9.438 1.00 74.31 C ATOM 3510 C4' DA D 6 4.074 -4.236 -10.308 1.00 73.91 C ATOM 3511 O4' DA D 6 2.767 -3.764 -10.733 1.00 72.79 O ATOM 3512 C3' DA D 6 4.764 -3.036 -9.664 1.00 74.43 C ATOM 3513 O3' DA D 6 5.806 -2.586 -10.529 1.00 77.20 O ATOM 3514 C2' DA D 6 3.650 -2.001 -9.482 1.00 72.54 C ATOM 3515 C1' DA D 6 2.707 -2.351 -10.629 1.00 70.75 C ATOM 3516 N9 DA D 6 1.306 -1.959 -10.438 1.00 67.56 N ATOM 3517 C8 DA D 6 0.588 -1.997 -9.273 1.00 66.54 C ATOM 3518 N7 DA D 6 -0.656 -1.597 -9.395 1.00 65.39 N ATOM 3519 C5 DA D 6 -0.770 -1.272 -10.738 1.00 64.94 C ATOM 3520 C6 DA D 6 -1.842 -0.776 -11.516 1.00 63.67 C ATOM 3521 N6 DA D 6 -3.051 -0.510 -11.016 1.00 62.61 N ATOM 3522 N1 DA D 6 -1.623 -0.545 -12.833 1.00 63.50 N ATOM 3523 C2 DA D 6 -0.409 -0.798 -13.338 1.00 63.31 C ATOM 3524 N3 DA D 6 0.668 -1.270 -12.710 1.00 64.35 N ATOM 3525 C4 DA D 6 0.430 -1.487 -11.399 1.00 65.77 C ATOM 3526 P DT D 7 7.008 -1.686 -9.962 1.00 79.23 P ATOM 3527 OP1 DT D 7 7.991 -1.474 -11.054 1.00 79.21 O ATOM 3528 OP2 DT D 7 7.465 -2.287 -8.684 1.00 79.42 O ATOM 3529 O5' DT D 7 6.238 -0.312 -9.650 1.00 79.97 O ATOM 3530 C5' DT D 7 6.559 0.939 -10.251 1.00 81.24 C ATOM 3531 C4' DT D 7 6.332 2.041 -9.232 1.00 82.24 C ATOM 3532 O4' DT D 7 5.072 1.806 -8.545 1.00 82.54 O ATOM 3533 C3' DT D 7 7.388 2.094 -8.134 1.00 82.60 C ATOM 3534 O3' DT D 7 8.475 2.928 -8.535 1.00 82.85 O ATOM 3535 C2' DT D 7 6.611 2.672 -6.952 1.00 82.77 C ATOM 3536 C1' DT D 7 5.183 2.159 -7.176 1.00 82.70 C ATOM 3537 N1 DT D 7 4.757 1.001 -6.274 1.00 82.85 N ATOM 3538 C2 DT D 7 3.847 1.231 -5.246 1.00 82.79 C ATOM 3539 O2 DT D 7 3.338 2.314 -4.993 1.00 83.14 O ATOM 3540 N3 DT D 7 3.537 0.125 -4.494 1.00 82.46 N ATOM 3541 C4 DT D 7 4.022 -1.162 -4.648 1.00 82.38 C ATOM 3542 O4 DT D 7 3.666 -2.073 -3.907 1.00 81.98 O ATOM 3543 C5 DT D 7 4.965 -1.347 -5.731 1.00 82.52 C ATOM 3544 C7 DT D 7 5.565 -2.699 -5.999 1.00 82.15 C ATOM 3545 C6 DT D 7 5.280 -0.272 -6.477 1.00 82.68 C TER 3546 DT D 7 HETATM 3547 CO CO A 217 -21.306 20.275 15.758 1.00 25.30 CO HETATM 3548 C1 AKG A 400 -20.720 18.859 18.219 1.00 26.57 C HETATM 3549 O1 AKG A 400 -20.234 17.947 18.952 1.00 28.28 O HETATM 3550 O2 AKG A 400 -20.119 19.233 17.188 1.00 25.10 O HETATM 3551 C2 AKG A 400 -21.994 19.515 18.571 1.00 25.47 C HETATM 3552 O5 AKG A 400 -22.418 20.467 17.921 1.00 25.01 O HETATM 3553 C3 AKG A 400 -22.798 19.021 19.750 1.00 24.20 C HETATM 3554 C4 AKG A 400 -24.038 19.891 19.922 1.00 23.16 C HETATM 3555 C5 AKG A 400 -24.866 19.385 21.077 1.00 23.87 C HETATM 3556 O3 AKG A 400 -24.330 19.275 22.204 1.00 24.18 O HETATM 3557 O4 AKG A 400 -26.062 19.104 20.859 1.00 23.42 O HETATM 3558 CO CO B 217 -15.440 10.093 -14.840 1.00 29.76 CO HETATM 3559 C1 AKG B 401 -15.159 11.964 -17.064 1.00 26.20 C HETATM 3560 O1 AKG B 401 -15.028 13.089 -17.606 1.00 27.26 O HETATM 3561 O2 AKG B 401 -14.736 11.735 -15.905 1.00 24.29 O HETATM 3562 C2 AKG B 401 -15.828 10.872 -17.775 1.00 26.76 C HETATM 3563 O5 AKG B 401 -15.771 9.755 -17.277 1.00 25.91 O HETATM 3564 C3 AKG B 401 -16.547 11.116 -19.106 1.00 27.74 C HETATM 3565 C4 AKG B 401 -17.487 9.966 -19.495 1.00 27.95 C HETATM 3566 C5 AKG B 401 -17.962 10.089 -20.928 1.00 29.31 C HETATM 3567 O3 AKG B 401 -17.167 10.495 -21.807 1.00 30.93 O HETATM 3568 O4 AKG B 401 -19.140 9.769 -21.202 1.00 28.15 O HETATM 3569 O HOH A 218 -7.399 13.621 23.950 1.00 3.79 O HETATM 3570 O HOH A 219 -23.142 -1.241 29.370 1.00 32.81 O HETATM 3571 O HOH A 220 -17.252 19.558 17.920 1.00 19.39 O HETATM 3572 O HOH A 221 -16.076 27.770 10.046 1.00 19.29 O HETATM 3573 O HOH A 222 -40.798 19.362 5.778 1.00 23.78 O HETATM 3574 O HOH A 223 -25.727 9.299 4.441 1.00 26.94 O HETATM 3575 O HOH A 224 -45.150 14.926 14.279 1.00 20.46 O HETATM 3576 O HOH A 225 -16.157 25.910 22.818 1.00 3.37 O HETATM 3577 O HOH A 226 -16.686 18.494 12.423 1.00 18.20 O HETATM 3578 O HOH A 227 -21.676 8.913 2.505 1.00 26.42 O HETATM 3579 O HOH A 228 -17.996 15.340 0.509 1.00 4.24 O HETATM 3580 O HOH A 229 -14.337 4.667 9.324 1.00 20.88 O HETATM 3581 O HOH A 230 -27.853 19.303 18.916 1.00 12.44 O HETATM 3582 O HOH A 231 -12.781 19.924 13.903 1.00 25.13 O HETATM 3583 O HOH A 232 -3.676 20.727 23.195 1.00 38.82 O HETATM 3584 O HOH A 233 -16.865 25.113 18.516 1.00 9.14 O HETATM 3585 O HOH A 234 -25.302 29.315 33.372 1.00 20.65 O HETATM 3586 O HOH A 235 -29.519 25.386 29.341 1.00 8.24 O HETATM 3587 O HOH A 236 -35.710 7.343 5.156 1.00 25.24 O HETATM 3588 O HOH A 237 -29.439 16.978 20.185 1.00 14.45 O HETATM 3589 O HOH A 238 -18.435 11.936 15.675 1.00 4.89 O HETATM 3590 O HOH A 239 -16.837 11.513 5.846 1.00 10.77 O HETATM 3591 O HOH A 240 -15.302 2.190 1.073 1.00 18.59 O HETATM 3592 O HOH A 241 -18.649 20.869 31.710 1.00 9.95 O HETATM 3593 O HOH A 242 -21.869 12.429 9.087 1.00 8.89 O HETATM 3594 O HOH A 243 -27.295 21.332 37.165 1.00 15.53 O HETATM 3595 O HOH A 244 -5.404 29.472 16.940 1.00 21.20 O HETATM 3596 O HOH A 245 -22.518 18.687 15.370 1.00 3.16 O HETATM 3597 O HOH A 246 -39.428 18.860 7.802 1.00 25.83 O HETATM 3598 O HOH A 247 -15.732 19.912 14.163 1.00 18.74 O HETATM 3599 O HOH A 248 -37.045 1.422 32.892 1.00 29.22 O HETATM 3600 O HOH A 249 -25.295 37.932 4.049 1.00 16.28 O HETATM 3601 O HOH A 250 -24.205 8.640 2.364 1.00 11.31 O HETATM 3602 O HOH A 251 -28.397 38.786 3.804 1.00 14.23 O HETATM 3603 O HOH A 252 -36.929 25.571 6.407 1.00 29.48 O HETATM 3604 O HOH A 253 -25.794 18.069 41.594 1.00 4.66 O HETATM 3605 O HOH A 254 -34.444 21.694 36.823 1.00 25.17 O HETATM 3606 O HOH A 255 -22.054 29.556 22.500 1.00 31.75 O HETATM 3607 O HOH A 256 -7.724 18.242 32.046 1.00 25.16 O HETATM 3608 O HOH A 257 -8.170 22.611 32.471 1.00 29.63 O HETATM 3609 O HOH A 258 -34.433 28.430 28.613 1.00 21.51 O HETATM 3610 O HOH A 259 -17.761 5.061 33.376 1.00 22.43 O HETATM 3611 O HOH A 260 -15.396 31.062 23.620 1.00 31.10 O HETATM 3612 O HOH A 261 -29.763 29.391 5.144 1.00 22.85 O HETATM 3613 O HOH A 262 -2.155 0.524 23.865 1.00 30.00 O HETATM 3614 O HOH A 263 -26.900 31.296 31.431 1.00 30.00 O HETATM 3615 O HOH A 264 -10.896 22.594 18.055 1.00 30.00 O HETATM 3616 O HOH A 265 -13.368 22.693 18.635 1.00 30.00 O HETATM 3617 O HOH A 266 -24.036 9.836 34.064 1.00 30.00 O HETATM 3618 O HOH A 267 -41.407 22.215 6.392 1.00 30.00 O HETATM 3619 O HOH A 268 -14.658 0.048 16.249 1.00 35.16 O HETATM 3620 O HOH A 269 -39.933 20.154 22.762 1.00 6.42 O HETATM 3621 O HOH A 270 -26.255 31.966 3.604 1.00 8.50 O HETATM 3622 O HOH A 271 -9.117 3.164 24.220 1.00 4.51 O HETATM 3623 O HOH A 272 -6.940 16.663 25.417 1.00 17.84 O HETATM 3624 O HOH A 273 -16.472 26.195 12.213 1.00 17.01 O HETATM 3625 O HOH A 274 -16.206 28.089 14.603 1.00 24.97 O HETATM 3626 O HOH A 275 -16.910 8.047 1.328 1.00 17.27 O HETATM 3627 O HOH A 276 -24.215 12.131 36.137 1.00 16.34 O HETATM 3628 O HOH A 277 -22.585 21.551 10.250 1.00 11.81 O HETATM 3629 O HOH A 278 -37.701 25.826 9.901 1.00 27.35 O HETATM 3630 O HOH A 279 -24.059 17.471 17.267 1.00 17.09 O HETATM 3631 O HOH A 280 -37.674 22.553 6.035 1.00 29.57 O HETATM 3632 O HOH A 281 -36.024 19.308 4.608 1.00 29.59 O HETATM 3633 O HOH A 282 -30.206 23.178 31.942 1.00 12.95 O HETATM 3634 O HOH A 283 -15.024 9.632 32.171 1.00 19.83 O HETATM 3635 O HOH A 284 -36.201 2.803 21.396 1.00 27.56 O HETATM 3636 O HOH A 285 -36.177 19.151 37.025 1.00 25.51 O HETATM 3637 O HOH A 286 -39.045 17.122 28.409 1.00 11.41 O HETATM 3638 O HOH A 287 -27.976 1.594 4.283 1.00 20.42 O HETATM 3639 O HOH A 288 -25.457 6.601 35.376 1.00 10.02 O HETATM 3640 O HOH A 289 -25.517 15.532 4.207 1.00 13.29 O HETATM 3641 O HOH A 290 -11.276 11.219 7.981 1.00 10.57 O HETATM 3642 O HOH A 291 -34.150 19.161 33.841 1.00 16.52 O HETATM 3643 O HOH A 292 -32.275 0.197 14.332 1.00 41.99 O HETATM 3644 O HOH A 293 -20.803 30.092 31.350 1.00 30.04 O HETATM 3645 O HOH A 294 -14.945 21.249 11.790 1.00 30.86 O HETATM 3646 O HOH A 295 -8.676 11.738 17.599 1.00 7.47 O HETATM 3647 O HOH A 296 -13.862 20.889 31.216 1.00 13.77 O HETATM 3648 O HOH A 297 -15.060 30.218 11.267 1.00 3.38 O HETATM 3649 O HOH A 298 -27.015 30.224 28.841 1.00 18.08 O HETATM 3650 O HOH A 299 -33.655 3.264 19.217 1.00 20.52 O HETATM 3651 O HOH A 300 -20.181 5.450 -1.493 1.00 16.73 O HETATM 3652 O HOH A 301 -35.843 8.931 29.686 1.00 5.59 O HETATM 3653 O HOH A 302 -25.728 32.776 28.800 1.00 26.63 O HETATM 3654 O HOH A 303 -38.455 19.192 35.392 1.00 29.11 O HETATM 3655 O HOH A 304 -24.712 22.938 3.891 1.00 2.00 O HETATM 3656 O HOH A 305 -9.610 11.885 31.405 1.00 27.11 O HETATM 3657 O HOH A 306 -29.059 29.309 27.314 1.00 18.77 O HETATM 3658 O HOH A 307 -21.053 30.625 20.065 1.00 22.56 O HETATM 3659 O HOH A 308 -9.543 28.528 28.503 1.00 11.71 O HETATM 3660 O HOH A 309 -8.456 15.872 30.823 1.00 20.53 O HETATM 3661 O HOH A 310 -34.216 18.099 29.286 1.00 17.27 O HETATM 3662 O HOH A 311 -31.859 26.572 29.337 1.00 20.68 O HETATM 3663 O HOH A 312 -26.392 22.767 39.769 1.00 8.73 O HETATM 3664 O HOH A 313 -24.218 -6.244 22.626 1.00 10.87 O HETATM 3665 O HOH A 314 -25.428 30.904 10.929 1.00 20.48 O HETATM 3666 O HOH A 315 -31.214 18.655 1.720 1.00 16.49 O HETATM 3667 O HOH A 316 -38.795 7.433 22.726 1.00 10.35 O HETATM 3668 O HOH A 317 -17.323 17.058 17.965 1.00 16.89 O HETATM 3669 O HOH A 318 -20.584 35.409 7.870 1.00 9.14 O HETATM 3670 O HOH A 319 -18.262 29.875 6.541 1.00 11.60 O HETATM 3671 O HOH A 320 -20.237 8.595 32.206 1.00 18.67 O HETATM 3672 O HOH A 321 -37.282 20.260 7.350 1.00 30.78 O HETATM 3673 O HOH A 322 -30.788 18.644 26.249 1.00 12.62 O HETATM 3674 O HOH A 323 -17.254 30.293 17.457 1.00 21.53 O HETATM 3675 O HOH A 324 -27.588 28.414 35.593 1.00 20.21 O HETATM 3676 O HOH A 325 -3.417 18.794 13.261 1.00 26.26 O HETATM 3677 O HOH A 326 -22.522 0.771 32.262 1.00 29.63 O HETATM 3678 O HOH A 327 -14.614 28.839 21.142 1.00 26.23 O HETATM 3679 O HOH A 328 -23.338 32.269 19.254 1.00 27.62 O HETATM 3680 O HOH A 329 -23.914 33.232 30.746 1.00 19.01 O HETATM 3681 O HOH A 330 -31.400 16.070 2.485 1.00 17.81 O HETATM 3682 O HOH A 331 -37.343 24.710 20.775 1.00 2.17 O HETATM 3683 O HOH A 332 -6.379 18.618 23.986 1.00 16.20 O HETATM 3684 O HOH A 333 -18.290 2.230 14.229 1.00 8.12 O HETATM 3685 O HOH A 334 -32.684 23.794 33.297 1.00 25.85 O HETATM 3686 O HOH A 335 -22.267 18.286 36.676 0.50 2.00 O HETATM 3687 O HOH A 336 -15.286 9.770 0.510 1.00 18.70 O HETATM 3688 O HOH A 337 -19.070 24.776 33.501 1.00 15.73 O HETATM 3689 O HOH A 338 -28.311 26.207 27.129 1.00 18.65 O HETATM 3690 O HOH A 339 -17.103 5.785 -0.664 1.00 23.04 O HETATM 3691 O HOH A 340 -31.546 24.569 0.564 1.00 26.20 O HETATM 3692 O HOH A 341 -12.840 1.331 17.655 1.00 19.44 O HETATM 3693 O HOH A 342 -31.666 28.138 10.828 1.00 21.47 O HETATM 3694 O HOH A 343 -29.852 1.266 34.995 1.00 13.27 O HETATM 3695 O HOH A 344 -19.952 13.248 6.941 1.00 17.37 O HETATM 3696 O HOH A 345 -16.307 10.682 16.859 1.00 18.23 O HETATM 3697 O HOH A 346 -7.539 10.009 30.099 1.00 21.96 O HETATM 3698 O HOH A 347 -33.604 30.368 26.657 1.00 25.35 O HETATM 3699 O HOH A 348 -16.475 24.256 24.938 1.00 20.43 O HETATM 3700 O HOH A 349 -41.085 20.708 27.799 1.00 20.48 O HETATM 3701 O HOH A 350 -27.357 29.672 4.238 1.00 8.84 O HETATM 3702 O HOH A 351 -17.393 5.039 7.077 1.00 18.07 O HETATM 3703 O HOH A 352 -22.761 2.219 10.643 1.00 26.69 O HETATM 3704 O HOH A 353 -38.272 22.149 23.755 1.00 8.91 O HETATM 3705 O HOH A 354 -16.025 26.863 26.546 1.00 28.98 O HETATM 3706 O HOH A 355 -17.595 0.349 16.205 1.00 21.31 O HETATM 3707 O HOH A 356 -39.284 24.636 22.563 1.00 15.99 O HETATM 3708 O HOH A 357 -23.433 6.986 5.715 1.00 17.11 O HETATM 3709 O HOH A 358 -31.080 2.542 21.538 1.00 26.79 O HETATM 3710 O HOH A 359 -41.532 14.539 27.184 1.00 22.08 O HETATM 3711 O HOH A 360 -37.064 14.531 31.023 1.00 11.72 O HETATM 3712 O HOH A 361 -3.559 17.040 15.699 1.00 15.13 O HETATM 3713 O HOH A 362 -24.034 2.412 33.888 1.00 32.28 O HETATM 3714 O HOH A 363 -10.670 2.488 16.486 1.00 23.08 O HETATM 3715 O HOH A 364 -10.719 15.531 8.905 1.00 22.47 O HETATM 3716 O HOH A 365 -27.640 28.173 1.732 1.00 15.21 O HETATM 3717 O HOH A 366 -13.488 27.719 26.334 1.00 33.22 O HETATM 3718 O HOH A 367 -14.868 -2.343 21.650 1.00 15.70 O HETATM 3719 O HOH A 368 -8.481 3.432 30.292 1.00 20.10 O HETATM 3720 O HOH A 369 -25.335 24.906 0.276 1.00 14.82 O HETATM 3721 O HOH A 370 -25.685 36.570 6.805 1.00 25.86 O HETATM 3722 O HOH A 371 -12.178 16.594 5.148 1.00 34.48 O HETATM 3723 O HOH A 372 -15.906 29.665 7.114 1.00 30.48 O HETATM 3724 O HOH A 373 -6.164 15.140 28.585 1.00 19.34 O HETATM 3725 O HOH B 218 -34.303 18.777 -22.916 1.00 19.87 O HETATM 3726 O HOH B 219 -18.116 22.472 -0.370 1.00 18.06 O HETATM 3727 O HOH B 220 -17.630 -8.492 -7.553 1.00 20.71 O HETATM 3728 O HOH B 221 -22.890 10.995 -21.540 1.00 15.20 O HETATM 3729 O HOH B 222 -13.451 26.376 -3.767 1.00 22.06 O HETATM 3730 O HOH B 223 -36.859 12.901 -19.022 1.00 35.31 O HETATM 3731 O HOH B 224 -18.811 12.019 -17.080 1.00 21.13 O HETATM 3732 O HOH B 225 -27.537 16.393 -3.579 1.00 34.12 O HETATM 3733 O HOH B 226 5.948 19.761 -11.967 1.00 30.35 O HETATM 3734 O HOH B 227 -4.439 16.569 -29.519 1.00 17.00 O HETATM 3735 O HOH B 228 -35.527 19.837 -33.058 1.00 29.02 O HETATM 3736 O HOH B 229 -2.267 17.189 -27.443 1.00 8.73 O HETATM 3737 O HOH B 230 -7.142 29.817 -21.141 1.00 8.45 O HETATM 3738 O HOH B 231 -15.789 19.378 -14.521 1.00 19.96 O HETATM 3739 O HOH B 232 -28.442 29.069 -16.860 1.00 7.46 O HETATM 3740 O HOH B 233 -7.504 0.677 -19.776 1.00 24.20 O HETATM 3741 O HOH B 234 -39.250 11.511 -18.107 1.00 16.57 O HETATM 3742 O HOH B 235 -16.634 19.243 -34.525 1.00 6.42 O HETATM 3743 O HOH B 236 -39.400 12.777 -12.997 1.00 22.38 O HETATM 3744 O HOH B 237 -10.696 15.314 -33.270 1.00 27.76 O HETATM 3745 O HOH B 238 -24.065 29.659 -24.999 1.00 18.39 O HETATM 3746 O HOH B 239 -15.781 32.186 -22.376 1.00 15.97 O HETATM 3747 O HOH B 240 -12.179 19.372 -31.707 1.00 19.06 O HETATM 3748 O HOH B 241 -6.045 14.722 -29.699 1.00 21.69 O HETATM 3749 O HOH B 242 -22.345 27.886 -5.517 1.00 16.68 O HETATM 3750 O HOH B 243 -7.246 6.525 -30.193 1.00 20.09 O HETATM 3751 O HOH B 244 -9.191 11.429 -28.500 1.00 14.94 O HETATM 3752 O HOH B 245 -19.144 -3.893 -25.611 1.00 26.06 O HETATM 3753 O HOH B 246 -24.690 8.289 -31.495 1.00 30.79 O HETATM 3754 O HOH B 247 4.307 12.132 -10.364 1.00 16.80 O HETATM 3755 O HOH B 248 -27.487 17.537 -0.717 1.00 21.13 O HETATM 3756 O HOH B 249 -23.970 13.522 -5.203 1.00 11.04 O HETATM 3757 O HOH B 250 -28.844 3.814 -27.636 1.00 7.95 O HETATM 3758 O HOH B 251 -15.276 26.874 -7.455 1.00 12.67 O HETATM 3759 O HOH B 252 -16.555 19.767 -4.633 1.00 13.09 O HETATM 3760 O HOH B 253 -28.488 13.284 -3.476 1.00 28.33 O HETATM 3761 O HOH B 254 -27.801 1.293 -6.971 1.00 16.25 O HETATM 3762 O HOH B 255 -22.381 9.133 -27.480 1.00 15.19 O HETATM 3763 O HOH B 256 -29.338 10.932 -5.396 1.00 15.30 O HETATM 3764 O HOH B 257 -17.822 8.260 -9.852 1.00 2.00 O HETATM 3765 O HOH B 258 -32.995 7.839 -7.886 1.00 29.41 O HETATM 3766 O HOH B 259 -11.856 26.523 -5.603 1.00 25.91 O HETATM 3767 O HOH B 260 -17.042 11.119 -14.821 1.00 10.01 O HETATM 3768 O HOH B 261 -6.573 5.887 -23.075 1.00 14.06 O HETATM 3769 O HOH B 262 -29.024 21.189 -31.987 1.00 20.50 O HETATM 3770 O HOH B 263 -32.602 5.795 -10.902 1.00 31.21 O HETATM 3771 O HOH B 264 -27.724 18.900 -6.002 1.00 11.07 O HETATM 3772 O HOH B 265 -23.231 35.173 -19.877 1.00 2.00 O HETATM 3773 O HOH B 266 -18.338 25.467 -6.174 1.00 20.23 O HETATM 3774 O HOH B 267 -29.323 11.007 -31.361 1.00 12.85 O HETATM 3775 O HOH B 268 -7.663 1.141 -27.295 1.00 30.00 O HETATM 3776 O HOH B 269 -17.534 2.680 -27.239 1.00 30.00 O HETATM 3777 O HOH B 270 -14.093 -2.114 -23.095 1.00 24.56 O HETATM 3778 O HOH B 271 -6.387 14.277 -21.802 1.00 6.55 O HETATM 3779 O HOH B 272 -20.072 17.540 -9.126 1.00 9.28 O HETATM 3780 O HOH B 273 -22.889 20.883 -2.843 1.00 18.94 O HETATM 3781 O HOH B 274 -15.523 -4.599 -23.109 1.00 13.99 O HETATM 3782 O HOH B 275 -18.852 17.216 -6.509 1.00 8.80 O HETATM 3783 O HOH B 276 -2.946 8.049 -27.287 1.00 15.31 O HETATM 3784 O HOH B 277 -16.783 -0.548 -27.612 1.00 32.13 O HETATM 3785 O HOH B 278 -29.234 8.430 -3.945 1.00 15.83 O HETATM 3786 O HOH B 279 -11.578 33.315 -28.567 1.00 16.14 O HETATM 3787 O HOH B 280 -34.741 13.036 -20.556 1.00 20.88 O HETATM 3788 O HOH B 281 -9.293 27.244 -6.755 1.00 12.16 O HETATM 3789 O HOH B 282 -10.855 -0.382 -17.576 1.00 23.21 O HETATM 3790 O HOH B 283 -18.163 3.394 -29.809 1.00 9.21 O HETATM 3791 O HOH B 284 -21.173 6.179 -3.981 1.00 16.91 O HETATM 3792 O HOH B 285 -10.346 6.247 -10.084 1.00 6.93 O HETATM 3793 O HOH B 286 -9.005 33.963 -19.371 1.00 22.88 O HETATM 3794 O HOH B 287 2.173 13.123 -24.651 1.00 5.38 O HETATM 3795 O HOH B 288 -20.843 26.502 -7.630 1.00 18.06 O HETATM 3796 O HOH B 289 -26.383 -0.311 -8.248 1.00 28.73 O HETATM 3797 O HOH B 290 -12.772 15.500 -35.431 1.00 20.33 O HETATM 3798 O HOH B 291 -8.207 22.126 -29.940 1.00 16.39 O HETATM 3799 O HOH B 292 -30.897 5.131 -26.755 1.00 10.96 O HETATM 3800 O HOH B 293 -32.634 3.503 -26.623 1.00 35.69 O HETATM 3801 O HOH B 294 -9.151 32.980 -27.919 1.00 17.00 O HETATM 3802 O HOH B 295 -3.738 20.760 -19.264 1.00 22.47 O HETATM 3803 O HOH B 296 -17.901 28.516 -13.397 1.00 4.05 O HETATM 3804 O HOH B 297 6.466 15.025 -6.725 1.00 34.73 O HETATM 3805 O HOH B 298 -21.351 9.759 -19.643 1.00 8.71 O HETATM 3806 O HOH B 299 -14.314 -1.166 -28.151 1.00 26.93 O HETATM 3807 O HOH B 300 -16.657 21.531 1.334 1.00 25.55 O HETATM 3808 O HOH B 301 -16.221 -5.031 -12.836 1.00 27.22 O HETATM 3809 O HOH B 302 -17.524 -1.281 -10.854 1.00 13.79 O HETATM 3810 O HOH B 303 -8.542 13.865 -30.231 1.00 15.67 O HETATM 3811 O HOH B 304 -21.999 -0.759 -5.407 1.00 10.40 O HETATM 3812 O HOH B 305 3.704 5.081 -13.950 1.00 28.58 O HETATM 3813 O HOH B 306 -32.333 8.249 -31.939 1.00 13.86 O HETATM 3814 O HOH B 307 -17.012 21.833 -34.398 1.00 11.29 O HETATM 3815 O HOH B 308 -13.002 1.353 -19.664 1.00 31.71 O HETATM 3816 O HOH B 309 -24.080 22.463 -6.376 1.00 19.98 O HETATM 3817 O HOH B 310 5.638 9.020 -12.528 1.00 28.29 O HETATM 3818 O HOH B 311 -0.294 29.262 -25.063 1.00 17.78 O HETATM 3819 O HOH B 312 -32.092 20.165 -25.565 1.00 14.17 O HETATM 3820 O HOH B 313 -20.204 29.058 -4.537 1.00 15.43 O HETATM 3821 O HOH B 314 -23.030 7.960 -35.992 1.00 15.91 O HETATM 3822 O HOH B 315 -29.836 18.512 -5.421 1.00 32.32 O HETATM 3823 O HOH B 316 -0.760 14.265 -28.106 1.00 14.65 O HETATM 3824 O HOH B 317 3.940 22.963 -10.742 1.00 35.68 O HETATM 3825 O HOH B 318 -27.755 0.996 -24.077 1.00 14.00 O HETATM 3826 O HOH B 319 -13.735 20.908 -15.134 1.00 18.92 O HETATM 3827 O HOH B 320 -25.309 20.276 -3.659 1.00 22.81 O HETATM 3828 O HOH B 321 -30.246 27.280 -1.890 1.00 22.37 O HETATM 3829 O HOH B 322 -3.446 25.643 -9.537 1.00 42.84 O HETATM 3830 O HOH C 12 -7.842 8.557 -22.171 1.00 11.31 O HETATM 3831 O HOH C 14 -12.525 13.560 -10.129 1.00 12.33 O HETATM 3832 O HOH C 44 -5.334 0.140 -21.342 1.00 18.01 O HETATM 3833 O HOH C 169 -3.687 7.297 -10.110 1.00 11.17 O HETATM 3834 O HOH C 180 -4.230 8.905 -7.829 1.00 23.00 O HETATM 3835 O HOH C 234 -10.827 11.611 -9.500 1.00 20.11 O HETATM 3836 O HOH C 243 4.324 2.267 -12.875 1.00 31.24 O HETATM 3837 O HOH D 156 2.821 -1.879 -14.012 1.00 46.60 O CONECT 951 3547 CONECT 967 3547 CONECT 1412 3547 CONECT 2628 3558 CONECT 2644 3558 CONECT 3071 3558 CONECT 3327 3340 CONECT 3340 3327 3341 3342 3343 CONECT 3341 3340 CONECT 3342 3340 CONECT 3343 3340 3344 CONECT 3344 3343 3345 CONECT 3345 3344 3346 3347 CONECT 3346 3345 3350 CONECT 3347 3345 3348 3349 CONECT 3348 3347 3363 CONECT 3349 3347 3350 CONECT 3350 3346 3349 3351 CONECT 3351 3350 3352 3362 CONECT 3352 3351 3353 CONECT 3353 3352 3354 CONECT 3354 3353 3355 3362 CONECT 3355 3354 3356 3357 CONECT 3356 3355 CONECT 3357 3355 3358 3359 CONECT 3358 3357 CONECT 3359 3357 3360 3361 CONECT 3360 3359 CONECT 3361 3359 3362 CONECT 3362 3351 3354 3361 CONECT 3363 3348 CONECT 3547 951 967 1412 3550 CONECT 3547 3552 3596 CONECT 3548 3549 3550 3551 CONECT 3549 3548 CONECT 3550 3547 3548 CONECT 3551 3548 3552 3553 CONECT 3552 3547 3551 CONECT 3553 3551 3554 CONECT 3554 3553 3555 CONECT 3555 3554 3556 3557 CONECT 3556 3555 CONECT 3557 3555 CONECT 3558 2628 2644 3071 3561 CONECT 3558 3563 3767 CONECT 3559 3560 3561 3562 CONECT 3560 3559 CONECT 3561 3558 3559 CONECT 3562 3559 3563 3564 CONECT 3563 3558 3562 CONECT 3564 3562 3565 CONECT 3565 3564 3566 CONECT 3566 3565 3567 3568 CONECT 3567 3566 CONECT 3568 3566 CONECT 3596 3547 CONECT 3767 3558 MASTER 1104 0 5 6 26 0 12 6 3780 4 57 36 END
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
3khc
Complex Type
Protein-Nucleic Acid
PDBbind Subset
general set
Protein Name
Escherichia coli Alpha-ketoglutarate-dependent dioxygenase alkB D135A mutant
Ligand Name
ssDNA containing a 1-methylguanine lesion
EC.Number
E.C.1.14.11.-
Resolution
2.2(Å)
Affinity (Kd/Ki/IC50)
Kd=0.316uM
Release Year
2010
Protein/NA Sequence
Check fasta file
Primary Reference
(2010) Plos One Vol. 5: pp. e8680-e8680
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P05050
Entrez Gene ID
NCBI Entrez Gene ID:
946708
ASD
Information of known allosteric effects of PDB entries
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