USER MOD reduce.3.24.130724 H: found=0, std=0, add=1865, rem=0, adj=55 USER MOD reduce.3.24.130724 removed 23 hydrogens (23 hets) HEADER GENE REGULATION 05-DEC-05 2F97 TITLE EFFECTOR BINDING DOMAIN OF BENM (CRYSTALS GENERATED FROM HIGH PH TITLE 2 CONDITIONS) COMPND MOL_ID: 1; COMPND 2 MOLECULE: HTH-TYPE TRANSCRIPTIONAL REGULATOR BENM; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: BEN AND CAT OPERON TRANSCRIPTIONAL REGULATOR; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: ACINETOBACTER BAYLYI; SOURCE 3 ORGANISM_TAXID: 202950; SOURCE 4 STRAIN: ADP1; SOURCE 5 GENE: BENM, BENR; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: DE3(BL21); SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 0 EXPRESSION_SYSTEM_PLASMID: PET21B KEYWDS BENM, LYSR-TYPE REGULATOR, TETRAMERIZATION, EFFECTOR BINDING DOMAIN, KEYWDS 2 INDUCER BINDING DOMAIN, GENE REGULATION EXPDTA X-RAY DIFFRACTION AUTHOR O.C.EZEZIKA,S.HADDAD,E.L.NEIDLE,C.MOMANY REVDAT 4 13-JUL-11 2F97 1 VERSN REVDAT 3 08-SEP-10 2F97 1 JRNL REVDAT 2 24-FEB-09 2F97 1 VERSN REVDAT 1 19-DEC-06 2F97 0 JRNL AUTH O.C.EZEZIKA,S.HADDAD,E.L.NEIDLE,C.MOMANY JRNL TITL OLIGOMERIZATION OF BENM, A LYSR-TYPE TRANSCRIPTIONAL JRNL TITL 2 REGULATOR: STRUCTURAL BASIS FOR THE AGGREGATION OF PROTEINS JRNL TITL 3 IN THIS FAMILY. JRNL REF ACTA CRYSTALLOGR.,SECT.F V. 63 361 2007 JRNL REFN ESSN 1744-3091 JRNL PMID 17565172 JRNL DOI 10.1107/S1744309107019185 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 TITL CRYSTALLIZATION OF THE EFFECTOR-BINDING DOMAINS OF BENM AND REMARK 1 TITL 2 CATM, LYSR-TYPE TRANSCRIPTIONAL REGULATORS FROM REMARK 1 TITL 3 ACINETOBACTER SP. ADP1. REMARK 1 REF ACTA CRYSTALLOGR.,SECT.D V. 60 105 2004 REMARK 1 REFN ISSN 0907-4449 REMARK 2 REMARK 2 RESOLUTION. 2.20 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.2.0005 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : ENGH & HUBER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.20 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 70.01 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 99.6 REMARK 3 NUMBER OF REFLECTIONS : 23294 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) : 0.178 REMARK 3 R VALUE (WORKING SET) : 0.176 REMARK 3 FREE R VALUE : 0.209 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 4.969 REMARK 3 FREE R VALUE TEST SET COUNT : 1218 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) : 1625 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 96.07 REMARK 3 BIN R VALUE (WORKING SET) : 0.2420 REMARK 3 BIN FREE R VALUE SET COUNT : 86 REMARK 3 BIN FREE R VALUE : 0.3060 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1722 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 44 REMARK 3 SOLVENT ATOMS : 252 REMARK 3 REMARK 3 B VALUES. REMARK 3 B VALUE TYPE : LIKELY RESIDUAL REMARK 3 FROM WILSON PLOT (A**2) : 43.75 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 42.30 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 0.22300 REMARK 3 B22 (A**2) : 0.22300 REMARK 3 B33 (A**2) : -0.44700 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.00000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.146 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.140 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.090 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 6.520 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.958 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.954 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 1846 ; 0.007 ; 0.022 REMARK 3 BOND LENGTHS OTHERS (A): 23 ; 0.001 ; 0.020 REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 2495 ; 0.915 ; 1.996 REMARK 3 BOND ANGLES OTHERS (DEGREES): 50 ; 0.309 ; 3.000 REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 225 ; 4.812 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 80 ;36.267 ;23.875 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 320 ;12.528 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 12 ;14.525 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 278 ; 0.057 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 1373 ; 0.002 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 851 ; 0.162 ; 0.200 REMARK 3 NON-BONDED CONTACTS OTHERS (A): 24 ; 0.097 ; 0.200 REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 1265 ; 0.295 ; 0.200 REMARK 3 NON-BONDED TORSION OTHERS (A): 4 ; 0.075 ; 0.200 REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 191 ; 0.099 ; 0.200 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): 54 ; 0.152 ; 0.200 REMARK 3 SYMMETRY VDW OTHERS (A): 1 ; 0.217 ; 0.200 REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 33 ; 0.100 ; 0.200 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): 1155 ; 0.515 ; 2.000 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 1813 ; 1.072 ; 5.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 779 ; 2.099 ; 7.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 682 ; 3.242 ;10.000 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 : 14 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 89 A 98 REMARK 3 ORIGIN FOR THE GROUP (A): 14.8470 26.6240 -4.1530 REMARK 3 T TENSOR REMARK 3 T11: -0.1784 T22: 0.1153 REMARK 3 T33: -0.0323 T12: 0.0136 REMARK 3 T13: -0.0172 T23: 0.0201 REMARK 3 L TENSOR REMARK 3 L11: 12.7714 L22: 4.8933 REMARK 3 L33: 6.1801 L12: -3.0005 REMARK 3 L13: 3.7733 L23: -3.4545 REMARK 3 S TENSOR REMARK 3 S11: 0.0414 S12: 0.9866 S13: 0.0051 REMARK 3 S21: -0.2401 S22: 0.0111 S23: 0.3117 REMARK 3 S31: 0.0516 S32: -0.3357 S33: -0.0524 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 99 A 113 REMARK 3 ORIGIN FOR THE GROUP (A): 19.5000 15.6760 -1.4800 REMARK 3 T TENSOR REMARK 3 T11: -0.1227 T22: 0.0217 REMARK 3 T33: -0.0309 T12: -0.0446 REMARK 3 T13: 0.0245 T23: 0.0012 REMARK 3 L TENSOR REMARK 3 L11: 3.2913 L22: 2.6535 REMARK 3 L33: 3.7175 L12: -0.7757 REMARK 3 L13: 0.2296 L23: -0.0681 REMARK 3 S TENSOR REMARK 3 S11: -0.1124 S12: 0.3522 S13: -0.2240 REMARK 3 S21: -0.0904 S22: 0.0214 S23: 0.0413 REMARK 3 S31: 0.2962 S32: -0.1827 S33: 0.0911 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 114 A 147 REMARK 3 ORIGIN FOR THE GROUP (A): 15.9850 27.8040 0.0540 REMARK 3 T TENSOR REMARK 3 T11: -0.1819 T22: 0.0521 REMARK 3 T33: -0.0418 T12: 0.0098 REMARK 3 T13: -0.0192 T23: 0.0460 REMARK 3 L TENSOR REMARK 3 L11: 2.4072 L22: 4.0503 REMARK 3 L33: 3.3054 L12: -1.0521 REMARK 3 L13: -0.0035 L23: -0.4539 REMARK 3 S TENSOR REMARK 3 S11: -0.1343 S12: 0.3108 S13: 0.1645 REMARK 3 S21: -0.0629 S22: 0.1122 S23: 0.0415 REMARK 3 S31: -0.2612 S32: -0.2966 S33: 0.0220 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 148 A 155 REMARK 3 ORIGIN FOR THE GROUP (A): 13.0030 31.2530 14.0440 REMARK 3 T TENSOR REMARK 3 T11: 0.0011 T22: 0.1616 REMARK 3 T33: -0.0279 T12: 0.1372 REMARK 3 T13: -0.0065 T23: -0.0092 REMARK 3 L TENSOR REMARK 3 L11: 5.6930 L22: 2.4971 REMARK 3 L33: 8.4255 L12: -0.7818 REMARK 3 L13: 6.6716 L23: 0.2883 REMARK 3 S TENSOR REMARK 3 S11: -0.4786 S12: -0.0876 S13: -0.1042 REMARK 3 S21: 0.8069 S22: 0.3919 S23: 0.2971 REMARK 3 S31: -0.6824 S32: -0.2222 S33: 0.0867 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 156 A 180 REMARK 3 ORIGIN FOR THE GROUP (A): 33.3200 11.1980 15.5080 REMARK 3 T TENSOR REMARK 3 T11: 0.0057 T22: -0.0162 REMARK 3 T33: -0.0379 T12: 0.0428 REMARK 3 T13: 0.0311 T23: 0.0616 REMARK 3 L TENSOR REMARK 3 L11: 6.4853 L22: 1.3190 REMARK 3 L33: 1.4216 L12: -2.1320 REMARK 3 L13: 0.6286 L23: -0.0326 REMARK 3 S TENSOR REMARK 3 S11: -0.2559 S12: -0.2744 S13: -0.3668 REMARK 3 S21: 0.1844 S22: 0.1384 S23: 0.0583 REMARK 3 S31: 0.3490 S32: -0.0057 S33: 0.1175 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 181 A 198 REMARK 3 ORIGIN FOR THE GROUP (A): 38.8260 19.5050 18.7270 REMARK 3 T TENSOR REMARK 3 T11: -0.0851 T22: 0.0095 REMARK 3 T33: -0.0615 T12: 0.0707 REMARK 3 T13: -0.0015 T23: 0.0097 REMARK 3 L TENSOR REMARK 3 L11: 2.6130 L22: 3.3739 REMARK 3 L33: 5.3761 L12: -0.0688 REMARK 3 L13: 0.6723 L23: -1.7364 REMARK 3 S TENSOR REMARK 3 S11: -0.1497 S12: -0.1970 S13: 0.1057 REMARK 3 S21: 0.4634 S22: 0.1105 S23: -0.1459 REMARK 3 S31: -0.1066 S32: 0.3204 S33: 0.0392 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 199 A 203 REMARK 3 ORIGIN FOR THE GROUP (A): 29.1460 29.4990 11.2400 REMARK 3 T TENSOR REMARK 3 T11: -0.0603 T22: 0.0117 REMARK 3 T33: 0.0249 T12: 0.0606 REMARK 3 T13: -0.0160 T23: 0.0482 REMARK 3 L TENSOR REMARK 3 L11: 8.4812 L22: 14.9217 REMARK 3 L33: 6.3217 L12: -10.2871 REMARK 3 L13: 2.9821 L23: -0.0269 REMARK 3 S TENSOR REMARK 3 S11: -0.1353 S12: 0.3285 S13: 0.4585 REMARK 3 S21: 0.2174 S22: -0.0277 S23: -0.2271 REMARK 3 S31: -0.4168 S32: -0.0362 S33: 0.1631 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 204 A 216 REMARK 3 ORIGIN FOR THE GROUP (A): 30.9910 23.3560 22.0670 REMARK 3 T TENSOR REMARK 3 T11: -0.0070 T22: 0.0167 REMARK 3 T33: -0.0429 T12: 0.0904 REMARK 3 T13: 0.0103 T23: 0.0008 REMARK 3 L TENSOR REMARK 3 L11: 0.0706 L22: 6.0767 REMARK 3 L33: 11.0070 L12: -0.5995 REMARK 3 L13: 0.1755 L23: -4.7176 REMARK 3 S TENSOR REMARK 3 S11: -0.1246 S12: -0.1555 S13: 0.1777 REMARK 3 S21: 0.4320 S22: 0.2504 S23: 0.1815 REMARK 3 S31: -0.1801 S32: -0.1606 S33: -0.1257 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 217 A 236 REMARK 3 ORIGIN FOR THE GROUP (A): 41.0160 23.4110 10.8070 REMARK 3 T TENSOR REMARK 3 T11: -0.1191 T22: -0.0058 REMARK 3 T33: -0.0237 T12: 0.0302 REMARK 3 T13: -0.0190 T23: 0.0049 REMARK 3 L TENSOR REMARK 3 L11: 1.9328 L22: 3.5037 REMARK 3 L33: 4.4695 L12: 0.0527 REMARK 3 L13: -0.6612 L23: -0.8133 REMARK 3 S TENSOR REMARK 3 S11: -0.0655 S12: -0.0661 S13: 0.2937 REMARK 3 S21: 0.1833 S22: 0.0920 S23: -0.0372 REMARK 3 S31: -0.1677 S32: 0.2414 S33: -0.0265 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 237 A 268 REMARK 3 ORIGIN FOR THE GROUP (A): 35.2270 12.8910 12.3070 REMARK 3 T TENSOR REMARK 3 T11: -0.0470 T22: -0.0367 REMARK 3 T33: -0.0416 T12: 0.0341 REMARK 3 T13: 0.0128 T23: 0.0422 REMARK 3 L TENSOR REMARK 3 L11: 2.0484 L22: 1.2369 REMARK 3 L33: 2.8247 L12: -0.1877 REMARK 3 L13: -0.3636 L23: 0.1643 REMARK 3 S TENSOR REMARK 3 S11: -0.1558 S12: -0.1064 S13: -0.1937 REMARK 3 S21: 0.0670 S22: 0.0460 S23: 0.0236 REMARK 3 S31: 0.3304 S32: 0.0236 S33: 0.1099 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 269 A 277 REMARK 3 ORIGIN FOR THE GROUP (A): 10.3740 26.2400 8.4390 REMARK 3 T TENSOR REMARK 3 T11: -0.1449 T22: 0.0899 REMARK 3 T33: -0.0556 T12: 0.0258 REMARK 3 T13: 0.0287 T23: -0.0042 REMARK 3 L TENSOR REMARK 3 L11: 15.4661 L22: 7.5059 REMARK 3 L33: 5.7545 L12: -6.9214 REMARK 3 L13: 7.7277 L23: -3.0213 REMARK 3 S TENSOR REMARK 3 S11: -0.4495 S12: -0.2699 S13: 0.5757 REMARK 3 S21: 0.4620 S22: 0.0438 S23: 0.0086 REMARK 3 S31: -0.1922 S32: -0.7696 S33: 0.4056 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 278 A 286 REMARK 3 ORIGIN FOR THE GROUP (A): 5.0080 20.9930 0.9000 REMARK 3 T TENSOR REMARK 3 T11: -0.1991 T22: 0.2572 REMARK 3 T33: 0.0224 T12: -0.0607 REMARK 3 T13: -0.0065 T23: -0.0120 REMARK 3 L TENSOR REMARK 3 L11: 12.5920 L22: 10.4245 REMARK 3 L33: 3.8881 L12: -5.4235 REMARK 3 L13: 4.0993 L23: -2.0083 REMARK 3 S TENSOR REMARK 3 S11: -0.1057 S12: 0.2119 S13: -0.2173 REMARK 3 S21: -0.0716 S22: 0.1165 S23: 0.6445 REMARK 3 S31: 0.1532 S32: -0.6534 S33: -0.0107 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 287 A 294 REMARK 3 ORIGIN FOR THE GROUP (A): 11.0530 11.1050 4.0280 REMARK 3 T TENSOR REMARK 3 T11: -0.1123 T22: 0.0981 REMARK 3 T33: 0.0772 T12: -0.1185 REMARK 3 T13: 0.0393 T23: -0.0018 REMARK 3 L TENSOR REMARK 3 L11: 6.3539 L22: 10.9460 REMARK 3 L33: 10.6229 L12: -4.0770 REMARK 3 L13: -2.5497 L23: -5.0960 REMARK 3 S TENSOR REMARK 3 S11: -0.2597 S12: 0.3418 S13: -0.9128 REMARK 3 S21: 0.3962 S22: 0.2068 S23: 0.9332 REMARK 3 S31: 0.5301 S32: -1.0321 S33: 0.0529 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 295 A 304 REMARK 3 ORIGIN FOR THE GROUP (A): 12.4770 8.5600 8.7700 REMARK 3 T TENSOR REMARK 3 T11: -0.0801 T22: 0.0183 REMARK 3 T33: 0.0599 T12: -0.1176 REMARK 3 T13: 0.0386 T23: 0.0108 REMARK 3 L TENSOR REMARK 3 L11: 7.9356 L22: 26.6616 REMARK 3 L33: 9.0383 L12: -3.5073 REMARK 3 L13: -6.5431 L23: 0.6413 REMARK 3 S TENSOR REMARK 3 S11: -0.4354 S12: 0.0726 S13: -1.2085 REMARK 3 S21: 0.6133 S22: -0.1079 S23: 1.0119 REMARK 3 S31: 0.8810 S32: -0.6399 S33: 0.5434 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : BABINET MODEL PLUS 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 ADDED IN THE RIDING REMARK 3 POSITIONS REMARK 4 REMARK 4 2F97 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 16-DEC-05. REMARK 100 THE RCSB ID CODE IS RCSB035608. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : NULL REMARK 200 TEMPERATURE (KELVIN) : 100 REMARK 200 PH : 9 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y REMARK 200 RADIATION SOURCE : APS REMARK 200 BEAMLINE : 19-BM REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : .97935 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : CCD REMARK 200 DETECTOR MANUFACTURER : MARRESEARCH REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : SCALEPACK REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 24724 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.200 REMARK 200 RESOLUTION RANGE LOW (A) : 70.014 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.9 REMARK 200 DATA REDUNDANCY : 20.900 REMARK 200 R MERGE (I) : 0.06300 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : 65.9600 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) : 2.28 REMARK 200 COMPLETENESS FOR SHELL (%) : 99.9 REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : 0.76900 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : 5.920 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: MOLREP REMARK 200 STARTING MODEL: PDB ENTRY 2F6G REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 71.77 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 4.36 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: PEG 8000, TAPS, LICL, IMIDAZOLE, TRIS, REMARK 280 NACL, CIS,CIS-MUCONATE, GLYCEROL, PH 9, MICROBATCH UNDER OIL REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 43 2 2 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,-Y,Z+1/2 REMARK 290 3555 -Y,X,Z+3/4 REMARK 290 4555 Y,-X,Z+1/4 REMARK 290 5555 -X,Y,-Z REMARK 290 6555 X,-Y,-Z+1/2 REMARK 290 7555 Y,X,-Z+1/4 REMARK 290 8555 -Y,-X,-Z+3/4 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 93.84150 REMARK 290 SMTRY1 3 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 3 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 140.76225 REMARK 290 SMTRY1 4 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 46.92075 REMARK 290 SMTRY1 5 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 5 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 6 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 6 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 93.84150 REMARK 290 SMTRY1 7 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY2 7 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 7 0.000000 0.000000 -1.000000 46.92075 REMARK 290 SMTRY1 8 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY2 8 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY3 8 0.000000 0.000000 -1.000000 140.76225 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 300 REMARK: THE BIOLOGICAL ASSEMBLY IS A DIMER GENERATED FROM THE REMARK 300 MONOMER IN THE ASYMMETRIC UNIT BY APPLYING THE CRYSTALLOGRAPHIC REMARK 300 SYMMETRY OPERATION -X, Y,-Z. 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: DIMERIC REMARK 350 APPLY THE FOLLOWING TO CHAINS: A 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 350 BIOMT1 2 -1.000000 0.000000 0.000000 70.04800 REMARK 350 BIOMT2 2 0.000000 1.000000 0.000000 0.00000 REMARK 350 BIOMT3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 375 REMARK 375 SPECIAL POSITION REMARK 375 THE FOLLOWING ATOMS ARE FOUND TO BE WITHIN 0.15 ANGSTROMS REMARK 375 OF A SYMMETRY RELATED ATOM AND ARE ASSUMED TO BE ON SPECIAL REMARK 375 POSITIONS. REMARK 375 REMARK 375 ATOM RES CSSEQI REMARK 375 HOH A1040 LIES ON A SPECIAL POSITION. 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 MET A 81 REMARK 465 THR A 82 REMARK 465 LYS A 83 REMARK 465 ARG A 84 REMARK 465 ILE A 85 REMARK 465 ALA A 86 REMARK 465 SER A 87 REMARK 465 VAL A 88 REMARK 465 LEU A 305 REMARK 465 GLU A 306 REMARK 465 HIS A 307 REMARK 465 HIS A 308 REMARK 465 HIS A 309 REMARK 465 HIS A 310 REMARK 465 HIS A 311 REMARK 465 HIS A 312 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 A1167 DISTANCE = 5.11 ANGSTROMS REMARK 525 HOH A1178 DISTANCE = 5.61 ANGSTROMS REMARK 525 HOH A1185 DISTANCE = 5.03 ANGSTROMS REMARK 525 HOH A1219 DISTANCE = 5.16 ANGSTROMS REMARK 525 HOH A1237 DISTANCE = 6.63 ANGSTROMS REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: AC1 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE ACT A 1003 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC2 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PG4 A 1001 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC3 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PG4 A 1002 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC4 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PEG A 1004 REMARK 800 REMARK 800 SITE_IDENTIFIER: AC5 REMARK 800 EVIDENCE_CODE: SOFTWARE REMARK 800 SITE_DESCRIPTION: BINDING SITE FOR RESIDUE PEG A 1005 REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 RELATED ID: 2F6G RELATED DB: PDB REMARK 900 RELATED ID: 2F6P RELATED DB: PDB REMARK 900 RELATED ID: 2F78 RELATED DB: PDB REMARK 900 RELATED ID: 2F7A RELATED DB: PDB REMARK 900 RELATED ID: 2F7B RELATED DB: PDB REMARK 900 RELATED ID: 2F7C RELATED DB: PDB REMARK 900 RELATED ID: 2F8D RELATED DB: PDB DBREF 2F97 A 81 304 UNP O68014 BENM_ACIAD 81 304 SEQADV 2F97 LEU A 305 UNP O68014 CLONING ARTIFACT SEQADV 2F97 GLU A 306 UNP O68014 CLONING ARTIFACT SEQADV 2F97 HIS A 307 UNP O68014 EXPRESSION TAG SEQADV 2F97 HIS A 308 UNP O68014 EXPRESSION TAG SEQADV 2F97 HIS A 309 UNP O68014 EXPRESSION TAG SEQADV 2F97 HIS A 310 UNP O68014 EXPRESSION TAG SEQADV 2F97 HIS A 311 UNP O68014 EXPRESSION TAG SEQADV 2F97 HIS A 312 UNP O68014 EXPRESSION TAG SEQRES 1 A 232 MET THR LYS ARG ILE ALA SER VAL GLU LYS THR ILE ARG SEQRES 2 A 232 ILE GLY PHE VAL GLY SER LEU LEU PHE GLY LEU LEU PRO SEQRES 3 A 232 ARG ILE ILE HIS LEU TYR ARG GLN ALA HIS PRO ASN LEU SEQRES 4 A 232 ARG ILE GLU LEU TYR GLU MET GLY THR LYS ALA GLN THR SEQRES 5 A 232 GLU ALA LEU LYS GLU GLY ARG ILE ASP ALA GLY PHE GLY SEQRES 6 A 232 ARG LEU LYS ILE SER ASP PRO ALA ILE LYS ARG THR LEU SEQRES 7 A 232 LEU ARG ASN GLU ARG LEU MET VAL ALA VAL HIS ALA SER SEQRES 8 A 232 HIS PRO LEU ASN GLN MET LYS ASP LYS GLY VAL HIS LEU SEQRES 9 A 232 ASN ASP LEU ILE ASP GLU LYS ILE LEU LEU TYR PRO SER SEQRES 10 A 232 SER PRO LYS PRO ASN PHE SER THR HIS VAL MET ASN ILE SEQRES 11 A 232 PHE SER ASP HIS GLY LEU GLU PRO THR LYS ILE ASN GLU SEQRES 12 A 232 VAL ARG GLU VAL GLN LEU ALA LEU GLY LEU VAL ALA ALA SEQRES 13 A 232 GLY GLU GLY ILE SER LEU VAL PRO ALA SER THR GLN SER SEQRES 14 A 232 ILE GLN LEU PHE ASN LEU SER TYR VAL PRO LEU LEU ASP SEQRES 15 A 232 PRO ASP ALA ILE THR PRO ILE TYR ILE ALA VAL ARG ASN SEQRES 16 A 232 MET GLU GLU SER THR TYR ILE TYR SER LEU TYR GLU THR SEQRES 17 A 232 ILE ARG GLN ILE TYR ALA TYR GLU GLY PHE THR GLU PRO SEQRES 18 A 232 PRO ASN TRP LEU GLU HIS HIS HIS HIS HIS HIS HET ACT A1003 7 HET PG4 A1001 13 HET PG4 A1002 13 HET PEG A1004 17 HET PEG A1005 17 HETNAM ACT ACETATE ION HETNAM PG4 TETRAETHYLENE GLYCOL HETNAM PEG DI(HYDROXYETHYL)ETHER FORMUL 2 ACT C2 H3 O2 1- FORMUL 3 PG4 2(C8 H18 O5) FORMUL 5 PEG 2(C4 H10 O3) FORMUL 7 HOH *252(H2 O) HELIX 1 1 GLY A 98 LEU A 101 5 4 HELIX 2 2 LEU A 104 HIS A 116 1 13 HELIX 3 3 GLY A 127 GLU A 137 1 11 HELIX 4 4 HIS A 172 LYS A 178 5 7 HELIX 5 5 HIS A 183 ILE A 188 5 6 HELIX 6 6 ASN A 202 HIS A 214 1 13 HELIX 7 7 GLU A 226 ALA A 236 1 11 HELIX 8 8 SER A 246 ILE A 250 5 5 HELIX 9 9 SER A 279 GLY A 297 1 19 SHEET 1 A 8 ARG A 120 GLU A 125 0 SHEET 2 A 8 THR A 91 PHE A 96 1 N ILE A 94 O GLU A 122 SHEET 3 A 8 ALA A 142 GLY A 145 1 O ALA A 142 N GLY A 95 SHEET 4 A 8 ILE A 266 ARG A 274 -1 O TYR A 270 N GLY A 145 SHEET 5 A 8 ILE A 154 HIS A 169 -1 N GLU A 162 O THR A 267 SHEET 6 A 8 ILE A 240 PRO A 244 -1 O SER A 241 N ALA A 167 SHEET 7 A 8 ILE A 192 LEU A 194 1 N LEU A 193 O ILE A 240 SHEET 8 A 8 ILE A 221 GLU A 223 1 O ASN A 222 N LEU A 194 SHEET 1 B 6 ARG A 120 GLU A 125 0 SHEET 2 B 6 THR A 91 PHE A 96 1 N ILE A 94 O GLU A 122 SHEET 3 B 6 ALA A 142 GLY A 145 1 O ALA A 142 N GLY A 95 SHEET 4 B 6 ILE A 266 ARG A 274 -1 O TYR A 270 N GLY A 145 SHEET 5 B 6 ILE A 154 HIS A 169 -1 N GLU A 162 O THR A 267 SHEET 6 B 6 LEU A 255 PRO A 259 -1 O VAL A 258 N VAL A 166 CISPEP 1 TYR A 195 PRO A 196 0 -7.15 CISPEP 2 LYS A 200 PRO A 201 0 -2.42 SITE *** AC1 6 LEU A 105 ILE A 108 PHE A 144 LEU A 159 SITE *** AC1 6 TYR A 293 HOH A1014 SITE *** AC2 10 GLY A 98 GLU A 125 MET A 126 GLY A 127 SITE *** AC2 10 SER A 197 SER A 198 PRO A 199 ARG A 225 SITE *** AC2 10 HOH A1135 HOH A1164 SITE *** AC3 5 ARG A 93 TYR A 124 GLY A 138 ARG A 139 SITE *** AC3 5 HOH A1118 SITE *** AC4 2 HIS A 116 TYR A 283 SITE *** AC5 5 LYS A 155 ASN A 275 GLU A 277 TYR A 286 SITE *** AC5 5 TRP A 304 CRYST1 70.048 70.048 187.683 90.00 90.00 90.00 P 43 2 2 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 0.014280 0.000000 0.000000 0.00000 SCALE2 0.000000 0.014280 0.000000 0.00000 SCALE3 0.000000 0.000000 0.005330 0.00000 USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 198 SER OG : rot -150:sc= -0.066 USER MOD Set 1.2: A 200 LYS NZ :NH3+ -137:sc= 0.0442 (180deg=0.746) USER MOD Set 1.3: A 202 ASN : amide:sc= -0.0909 K(o=1.1,f=-1.3!) USER MOD Set 1.4: A 204 SER OG : rot -50:sc= 1.21 USER MOD Set 2.1: A 175 ASN : amide:sc= 1.17 K(o=5.3,f=0.71) USER MOD Set 2.2: A 178 LYS NZ :NH3+ 169:sc= 2.09 (180deg=0.834) USER MOD Set 2.3: A 256 SER OG : rot -137:sc= 2.07 USER MOD Set 3.1: A 169 HIS : no HD1:sc= 2.19 K(o=3.6,f=-8.1!) USER MOD Set 3.2: A 171 SER OG : rot -60:sc= 1.39 USER MOD Set 4.1: A 165 MET CE C:methyl 176:sc= 0 (180deg=-0.0055) USER MOD Set 4.2: A 248 GLN : amide:sc= -0.684 X(o=-0.68,f=-0.94) USER MOD Set 5.1: A 116 HIS : no HE2:sc= 0.81 K(o=2.3,f=-7!) USER MOD Set 5.2: A 284 SER OG : rot 170:sc= 1.45 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 99 SER OG : rot -155:sc= 1.02 USER MOD Single : A 110 HIS : no HD1:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 112 TYR OH : rot 31:sc= 1.14 USER MOD Single : A 114 GLN A: amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 114 GLN B: amide:sc= -0.0188 X(o=-0.019,f=0.1) USER MOD Single : A 118 ASN : amide:sc= -0.0032 K(o=-0.0032,f=-0.71) USER MOD Single : A 124 TYR OH : rot 143:sc= 1.34 USER MOD Single : A 126 MET CE :methyl -136:sc=-0.00471 (180deg=-0.0303) USER MOD Single : A 128 THR OG1 : rot 170:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ 153:sc= 0.00112 (180deg=0) USER MOD Single : A 131 GLN : amide:sc= 1.11 K(o=1.1,f=-0.78) USER MOD Single : A 132 THR OG1 : rot 71:sc= 0.486 USER MOD Single : A 136 LYS NZ :NH3+ -168:sc= 0.849 (180deg=0.769) USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 155 LYS NZ :NH3+ 150:sc= 0 (180deg=-0.454) USER MOD Single : A 157 THR OG1 : rot 180:sc= 0 USER MOD Single : A 161 ASN : amide:sc= -0.0293 K(o=-0.029,f=-0.65) USER MOD Single : A 165 MET CE A:methyl -145:sc= -0.0158 (180deg=-0.561) USER MOD Single : A 165 MET CE B:methyl -145:sc= -0.0158 (180deg=-0.561) USER MOD Single : A 172 HIS : no HD1:sc= 0.667 K(o=0.67,f=-7.5!) USER MOD Single : A 176 GLN : amide:sc= -0.182 X(o=-0.18,f=-0.18) USER MOD Single : A 177 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 180 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 183 HIS : no HD1:sc= 1.19 K(o=1.2,f=-2.4!) USER MOD Single : A 185 ASN : amide:sc= -0.0107 X(o=-0.011,f=-0.34) USER MOD Single : A 191 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 195 TYR OH : rot -105:sc= 0.945 USER MOD Single : A 197 SER OG : rot 180:sc= -0.182 USER MOD Single : A 205 THR OG1 : rot -130:sc= 0.185 USER MOD Single : A 206 HIS : no HD1:sc= 0.581 K(o=0.58,f=-2.6!) USER MOD Single : A 208 MET CE :methyl -165:sc= 0 (180deg=-0.351) USER MOD Single : A 209 ASN : amide:sc= -0.0539 K(o=-0.054,f=-1.1) USER MOD Single : A 212 SER OG : rot 180:sc= 0 USER MOD Single : A 214 HIS : no HE2:sc= 2.4 K(o=2.4,f=-6.2!) USER MOD Single : A 219 THR OG1 : rot 180:sc= 0 USER MOD Single : A 220 LYS NZ :NH3+ -169:sc= 0.231 (180deg=0.204) USER MOD Single : A 222 ASN A: amide:sc= -0.377 X(o=-0.38,f=0) USER MOD Single : A 222 ASN B: amide:sc= 0 X(o=0,f=-0.011) USER MOD Single : A 228 GLN : amide:sc= 0.636 K(o=0.64,f=-5.2!) USER MOD Single : A 241 SER OG : rot 65:sc= 1.07 USER MOD Single : A 246 SER OG : rot -73:sc= 3.38 USER MOD Single : A 247 THR OG1 : rot -158:sc= 1.68 USER MOD Single : A 249 SER OG : rot 148:sc= 0.363 USER MOD Single : A 251 GLN : amide:sc= 0.758 K(o=0.76,f=0.12) USER MOD Single : A 254 ASN : amide:sc= 0.843 K(o=0.84,f=-1.5!) USER MOD Single : A 257 TYR OH : rot -163:sc= 1.14 USER MOD Single : A 267 THR OG1 : rot 110:sc= -0.978 USER MOD Single : A 270 TYR OH : rot 180:sc= 0 USER MOD Single : A 275 ASN : amide:sc= -0.264 X(o=-0.26,f=-0.034) USER MOD Single : A 276 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 279 SER OG : rot 180:sc= 0 USER MOD Single : A 280 THR OG1 : rot 180:sc= 0 USER MOD Single : A 281 TYR OH : rot 180:sc= 0 USER MOD Single : A 283 TYR OH : rot 180:sc= 0 USER MOD Single : A 286 TYR OH : rot -177:sc= 0.611 USER MOD Single : A 288 THR OG1 : rot 69:sc= 1.13 USER MOD Single : A 291 GLN : amide:sc= -1.24 K(o=-1.2,f=-0.00063) USER MOD Single : A 293 TYR OH : rot -7:sc= 0.685 USER MOD Single : A 295 TYR OH : rot 180:sc= 0 USER MOD Single : A 299 THR OG1 : rot 180:sc= 0 USER MOD Single : A 303 ASN : amide:sc= -0.15 X(o=-0.15,f=-0.0064) USER MOD Single : A1001 PG4 O1 : rot 18:sc= 1.4 USER MOD Single : A1001 PG4 O5 : rot 180:sc= 0 USER MOD Single : A1002 PG4 O1 : rot -26:sc= 0.0071 USER MOD Single : A1002 PG4 O5 : rot 180:sc= 0 USER MOD Single : A1004 PEG O1 : rot -83:sc= 0.0958 USER MOD Single : A1004 PEG O4 : rot 180:sc= 0 USER MOD Single : A1005 PEG O1 : rot 170:sc= 0 USER MOD Single : A1005 PEG O4 : rot -38:sc= 0.0599 USER MOD ----------------------------------------------------------------- ATOM 1 N GLU A 89 5.046 28.499 -14.918 1.00 51.77 N ATOM 2 CA GLU A 89 6.205 27.741 -14.367 1.00 51.70 C ATOM 3 C GLU A 89 6.518 28.177 -12.932 1.00 51.04 C ATOM 4 O GLU A 89 7.051 29.267 -12.703 1.00 51.34 O ATOM 5 CB GLU A 89 7.434 27.909 -15.270 1.00 51.78 C ATOM 6 CG GLU A 89 8.675 27.137 -14.814 1.00 52.56 C ATOM 7 CD GLU A 89 9.889 27.390 -15.694 1.00 52.33 C ATOM 8 OE1 GLU A 89 10.996 27.571 -15.142 1.00 54.45 O ATOM 9 OE2 GLU A 89 9.741 27.411 -16.937 1.00 55.06 O ATOM 0 HA GLU A 89 5.968 26.801 -14.345 1.00 51.70 H new ATOM 0 HB2 GLU A 89 7.202 27.623 -16.167 1.00 51.78 H new ATOM 0 HB3 GLU A 89 7.656 28.852 -15.321 1.00 51.78 H new ATOM 0 HG2 GLU A 89 8.887 27.385 -13.901 1.00 52.56 H new ATOM 0 HG3 GLU A 89 8.476 26.188 -14.811 1.00 52.56 H new ATOM 10 N LYS A 90 6.179 27.316 -11.976 1.00 49.98 N ATOM 11 CA LYS A 90 6.438 27.575 -10.561 1.00 48.96 C ATOM 12 C LYS A 90 7.916 27.378 -10.221 1.00 47.82 C ATOM 13 O LYS A 90 8.556 26.446 -10.712 1.00 47.68 O ATOM 14 CB LYS A 90 5.558 26.671 -9.685 1.00 49.05 C ATOM 15 CG LYS A 90 5.770 26.807 -8.174 1.00 49.22 C ATOM 16 CD LYS A 90 5.281 28.145 -7.636 1.00 50.01 C ATOM 17 CE LYS A 90 5.574 28.274 -6.153 1.00 49.50 C ATOM 18 NZ LYS A 90 5.181 29.608 -5.625 1.00 50.84 N ATOM 0 H LYS A 90 5.792 26.564 -12.129 1.00 49.98 H new ATOM 0 HA LYS A 90 6.214 28.501 -10.379 1.00 48.96 H new ATOM 0 HB2 LYS A 90 4.628 26.861 -9.884 1.00 49.05 H new ATOM 0 HB3 LYS A 90 5.719 25.748 -9.936 1.00 49.05 H new ATOM 0 HG2 LYS A 90 5.304 26.089 -7.719 1.00 49.22 H new ATOM 0 HG3 LYS A 90 6.713 26.706 -7.972 1.00 49.22 H new ATOM 0 HD2 LYS A 90 5.711 28.868 -8.118 1.00 50.01 H new ATOM 0 HD3 LYS A 90 4.327 28.230 -7.789 1.00 50.01 H new ATOM 0 HE2 LYS A 90 5.098 27.582 -5.668 1.00 49.50 H new ATOM 0 HE3 LYS A 90 6.521 28.131 -5.997 1.00 49.50 H new ATOM 0 HZ1 LYS A 90 5.366 29.650 -4.755 1.00 50.84 H new ATOM 0 HZ2 LYS A 90 5.633 30.243 -6.055 1.00 50.84 H new ATOM 0 HZ3 LYS A 90 4.308 29.731 -5.748 1.00 50.84 H new ATOM 19 N THR A 91 8.446 28.270 -9.386 1.00 46.75 N ATOM 20 CA THR A 91 9.813 28.154 -8.882 1.00 45.71 C ATOM 21 C THR A 91 9.816 27.969 -7.365 1.00 44.80 C ATOM 22 O THR A 91 9.172 28.726 -6.634 1.00 44.96 O ATOM 23 CB THR A 91 10.677 29.380 -9.275 1.00 45.82 C ATOM 24 OG1 THR A 91 10.722 29.497 -10.701 1.00 46.62 O ATOM 25 CG2 THR A 91 12.104 29.244 -8.749 1.00 45.46 C ATOM 0 H THR A 91 8.023 28.960 -9.096 1.00 46.75 H new ATOM 0 HA THR A 91 10.207 27.370 -9.295 1.00 45.71 H new ATOM 0 HB THR A 91 10.273 30.169 -8.881 1.00 45.82 H new ATOM 0 HG1 THR A 91 11.189 30.162 -10.913 1.00 46.62 H new ATOM 0 HG21 THR A 91 12.620 30.023 -9.009 1.00 45.46 H new ATOM 0 HG22 THR A 91 12.087 29.176 -7.782 1.00 45.46 H new ATOM 0 HG23 THR A 91 12.512 28.447 -9.122 1.00 45.46 H new ATOM 26 N ILE A 92 10.532 26.945 -6.908 1.00 43.62 N ATOM 27 CA ILE A 92 10.765 26.721 -5.486 1.00 42.49 C ATOM 28 C ILE A 92 12.254 26.910 -5.197 1.00 41.64 C ATOM 29 O ILE A 92 13.105 26.326 -5.872 1.00 41.09 O ATOM 30 CB ILE A 92 10.272 25.313 -5.036 1.00 42.63 C ATOM 31 CG1 ILE A 92 8.736 25.239 -5.059 1.00 43.81 C ATOM 32 CG2 ILE A 92 10.830 24.929 -3.657 1.00 41.41 C ATOM 33 CD1 ILE A 92 8.012 26.213 -4.113 1.00 45.45 C ATOM 0 H ILE A 92 10.898 26.358 -7.418 1.00 43.62 H new ATOM 0 HA ILE A 92 10.252 27.366 -4.974 1.00 42.49 H new ATOM 0 HB ILE A 92 10.614 24.665 -5.672 1.00 42.63 H new ATOM 0 HG12 ILE A 92 8.433 25.407 -5.965 1.00 43.81 H new ATOM 0 HG13 ILE A 92 8.468 24.334 -4.834 1.00 43.81 H new ATOM 0 HG21 ILE A 92 10.504 24.050 -3.409 1.00 41.41 H new ATOM 0 HG22 ILE A 92 11.799 24.916 -3.692 1.00 41.41 H new ATOM 0 HG23 ILE A 92 10.540 25.579 -2.998 1.00 41.41 H new ATOM 0 HD11 ILE A 92 7.053 26.093 -4.197 1.00 45.45 H new ATOM 0 HD12 ILE A 92 8.281 26.035 -3.198 1.00 45.45 H new ATOM 0 HD13 ILE A 92 8.245 27.125 -4.347 1.00 45.45 H new ATOM 34 N ARG A 93 12.554 27.738 -4.200 1.00 40.99 N ATOM 35 CA ARG A 93 13.932 28.067 -3.853 1.00 40.23 C ATOM 36 C ARG A 93 14.306 27.482 -2.494 1.00 40.09 C ATOM 37 O ARG A 93 13.602 27.682 -1.497 1.00 39.76 O ATOM 38 CB ARG A 93 14.152 29.582 -3.898 1.00 40.13 C ATOM 39 CG ARG A 93 13.874 30.188 -5.276 1.00 40.22 C ATOM 40 CD ARG A 93 14.054 31.697 -5.300 1.00 40.00 C ATOM 41 NE ARG A 93 13.613 32.273 -6.569 1.00 40.73 N ATOM 42 CZ ARG A 93 12.355 32.609 -6.853 1.00 40.44 C ATOM 43 NH1 ARG A 93 11.386 32.434 -5.960 1.00 38.51 N ATOM 44 NH2 ARG A 93 12.062 33.122 -8.039 1.00 41.89 N ATOM 0 H ARG A 93 11.965 28.124 -3.707 1.00 40.99 H new ATOM 0 HA ARG A 93 14.520 27.665 -4.512 1.00 40.23 H new ATOM 0 HB2 ARG A 93 13.577 30.007 -3.242 1.00 40.13 H new ATOM 0 HB3 ARG A 93 15.067 29.778 -3.643 1.00 40.13 H new ATOM 0 HG2 ARG A 93 14.468 29.785 -5.928 1.00 40.22 H new ATOM 0 HG3 ARG A 93 12.968 29.970 -5.544 1.00 40.22 H new ATOM 0 HD2 ARG A 93 13.552 32.095 -4.572 1.00 40.00 H new ATOM 0 HD3 ARG A 93 14.988 31.914 -5.153 1.00 40.00 H new ATOM 0 HE ARG A 93 14.208 32.404 -7.176 1.00 40.73 H new ATOM 0 HH11 ARG A 93 11.567 32.100 -5.188 1.00 38.51 H new ATOM 0 HH12 ARG A 93 10.578 32.654 -6.154 1.00 38.51 H new ATOM 0 HH21 ARG A 93 12.683 33.237 -8.623 1.00 41.89 H new ATOM 0 HH22 ARG A 93 11.251 33.340 -8.225 1.00 41.89 H new ATOM 45 N ILE A 94 15.408 26.738 -2.477 1.00 39.56 N ATOM 46 CA ILE A 94 15.845 26.014 -1.286 1.00 39.49 C ATOM 47 C ILE A 94 17.244 26.462 -0.867 1.00 39.65 C ATOM 48 O ILE A 94 18.189 26.409 -1.662 1.00 39.21 O ATOM 49 CB ILE A 94 15.807 24.470 -1.506 1.00 39.66 C ATOM 50 CG1 ILE A 94 14.381 24.002 -1.826 1.00 38.38 C ATOM 51 CG2 ILE A 94 16.354 23.724 -0.285 1.00 39.71 C ATOM 52 CD1 ILE A 94 14.295 22.612 -2.435 1.00 39.40 C ATOM 0 H ILE A 94 15.925 26.638 -3.157 1.00 39.56 H new ATOM 0 HA ILE A 94 15.224 26.224 -0.571 1.00 39.49 H new ATOM 0 HB ILE A 94 16.376 24.265 -2.264 1.00 39.66 H new ATOM 0 HG12 ILE A 94 13.857 24.018 -1.010 1.00 38.38 H new ATOM 0 HG13 ILE A 94 13.974 24.636 -2.437 1.00 38.38 H new ATOM 0 HG21 ILE A 94 16.319 22.768 -0.447 1.00 39.71 H new ATOM 0 HG22 ILE A 94 17.273 23.992 -0.127 1.00 39.71 H new ATOM 0 HG23 ILE A 94 15.817 23.939 0.493 1.00 39.71 H new ATOM 0 HD11 ILE A 94 13.366 22.391 -2.607 1.00 39.40 H new ATOM 0 HD12 ILE A 94 14.791 22.592 -3.268 1.00 39.40 H new ATOM 0 HD13 ILE A 94 14.672 21.965 -1.819 1.00 39.40 H new ATOM 53 N GLY A 95 17.355 26.920 0.379 1.00 39.57 N ATOM 54 CA GLY A 95 18.643 27.274 0.973 1.00 39.12 C ATOM 55 C GLY A 95 19.203 26.111 1.770 1.00 39.33 C ATOM 56 O GLY A 95 18.444 25.324 2.341 1.00 39.59 O ATOM 0 H GLY A 95 16.684 27.034 0.905 1.00 39.57 H new ATOM 0 HA2 GLY A 95 19.268 27.525 0.275 1.00 39.12 H new ATOM 0 HA3 GLY A 95 18.537 28.046 1.550 1.00 39.12 H new ATOM 57 N PHE A 96 20.530 25.995 1.805 1.00 38.74 N ATOM 58 CA PHE A 96 21.195 24.899 2.511 1.00 38.62 C ATOM 59 C PHE A 96 22.623 25.279 2.902 1.00 38.21 C ATOM 60 O PHE A 96 23.259 26.104 2.237 1.00 37.81 O ATOM 61 CB PHE A 96 21.218 23.636 1.633 1.00 38.66 C ATOM 62 CG PHE A 96 22.045 23.789 0.384 1.00 40.27 C ATOM 63 CD1 PHE A 96 23.401 23.466 0.387 1.00 37.78 C ATOM 64 CD2 PHE A 96 21.477 24.287 -0.786 1.00 40.39 C ATOM 65 CE1 PHE A 96 24.176 23.627 -0.757 1.00 39.68 C ATOM 66 CE2 PHE A 96 22.245 24.450 -1.938 1.00 40.81 C ATOM 67 CZ PHE A 96 23.594 24.119 -1.923 1.00 39.80 C ATOM 0 H PHE A 96 21.068 26.546 1.422 1.00 38.74 H new ATOM 0 HA PHE A 96 20.692 24.720 3.321 1.00 38.62 H new ATOM 0 HB2 PHE A 96 21.565 22.895 2.154 1.00 38.66 H new ATOM 0 HB3 PHE A 96 20.309 23.407 1.384 1.00 38.66 H new ATOM 0 HD1 PHE A 96 23.793 23.138 1.164 1.00 37.78 H new ATOM 0 HD2 PHE A 96 20.575 24.513 -0.799 1.00 40.39 H new ATOM 0 HE1 PHE A 96 25.079 23.407 -0.743 1.00 39.68 H new ATOM 0 HE2 PHE A 96 21.855 24.780 -2.715 1.00 40.81 H new ATOM 0 HZ PHE A 96 24.108 24.226 -2.691 1.00 39.80 H new ATOM 68 N VAL A 97 23.124 24.672 3.976 1.00 37.87 N ATOM 69 CA VAL A 97 24.542 24.787 4.330 1.00 37.37 C ATOM 70 C VAL A 97 25.325 23.649 3.667 1.00 37.20 C ATOM 71 O VAL A 97 24.792 22.553 3.468 1.00 37.21 O ATOM 72 CB VAL A 97 24.784 24.832 5.866 1.00 37.18 C ATOM 73 CG1 VAL A 97 24.053 26.012 6.487 1.00 38.27 C ATOM 74 CG2 VAL A 97 24.364 23.529 6.543 1.00 35.86 C ATOM 0 H VAL A 97 22.661 24.188 4.515 1.00 37.87 H new ATOM 0 HA VAL A 97 24.865 25.638 3.994 1.00 37.37 H new ATOM 0 HB VAL A 97 25.737 24.943 6.008 1.00 37.18 H new ATOM 0 HG11 VAL A 97 24.214 26.026 7.443 1.00 38.27 H new ATOM 0 HG12 VAL A 97 24.377 26.837 6.093 1.00 38.27 H new ATOM 0 HG13 VAL A 97 23.101 25.927 6.321 1.00 38.27 H new ATOM 0 HG21 VAL A 97 24.528 23.592 7.497 1.00 35.86 H new ATOM 0 HG22 VAL A 97 23.419 23.373 6.388 1.00 35.86 H new ATOM 0 HG23 VAL A 97 24.877 22.793 6.175 1.00 35.86 H new ATOM 75 N GLY A 98 26.582 23.926 3.325 1.00 36.96 N ATOM 76 CA GLY A 98 27.431 22.993 2.581 1.00 36.81 C ATOM 77 C GLY A 98 27.709 21.663 3.258 1.00 37.15 C ATOM 78 O GLY A 98 27.907 20.654 2.582 1.00 37.11 O ATOM 0 H GLY A 98 26.971 24.668 3.520 1.00 36.96 H new ATOM 0 HA2 GLY A 98 27.014 22.818 1.723 1.00 36.81 H new ATOM 0 HA3 GLY A 98 28.279 23.428 2.401 1.00 36.81 H new ATOM 79 N SER A 99 27.716 21.653 4.591 1.00 37.52 N ATOM 80 CA SER A 99 27.974 20.429 5.354 1.00 38.08 C ATOM 81 C SER A 99 26.892 19.361 5.148 1.00 38.33 C ATOM 82 O SER A 99 27.095 18.194 5.485 1.00 40.02 O ATOM 83 CB SER A 99 28.145 20.741 6.846 1.00 37.84 C ATOM 84 OG SER A 99 26.915 21.107 7.447 1.00 38.48 O ATOM 0 H SER A 99 27.573 22.349 5.076 1.00 37.52 H new ATOM 0 HA SER A 99 28.803 20.060 5.012 1.00 38.08 H new ATOM 0 HB2 SER A 99 28.509 19.965 7.300 1.00 37.84 H new ATOM 0 HB3 SER A 99 28.786 21.461 6.955 1.00 37.84 H new ATOM 0 HG SER A 99 27.064 21.583 8.123 1.00 38.48 H new ATOM 85 N LEU A 100 25.758 19.763 4.581 1.00 37.18 N ATOM 86 CA LEU A 100 24.642 18.847 4.347 1.00 36.77 C ATOM 87 C LEU A 100 24.704 18.134 2.991 1.00 36.70 C ATOM 88 O LEU A 100 23.955 17.188 2.751 1.00 36.53 O ATOM 89 CB LEU A 100 23.305 19.573 4.511 1.00 36.20 C ATOM 90 CG LEU A 100 22.982 20.101 5.913 1.00 36.56 C ATOM 91 CD1 LEU A 100 21.710 20.929 5.867 1.00 36.57 C ATOM 92 CD2 LEU A 100 22.855 18.967 6.938 1.00 36.20 C ATOM 0 H LEU A 100 25.613 20.570 4.322 1.00 37.18 H new ATOM 0 HA LEU A 100 24.719 18.153 5.021 1.00 36.77 H new ATOM 0 HB2 LEU A 100 23.288 20.321 3.893 1.00 36.20 H new ATOM 0 HB3 LEU A 100 22.596 18.968 4.244 1.00 36.20 H new ATOM 0 HG LEU A 100 23.720 20.661 6.201 1.00 36.56 H new ATOM 0 HD11 LEU A 100 21.508 21.262 6.755 1.00 36.57 H new ATOM 0 HD12 LEU A 100 21.832 21.677 5.262 1.00 36.57 H new ATOM 0 HD13 LEU A 100 20.976 20.378 5.554 1.00 36.57 H new ATOM 0 HD21 LEU A 100 22.651 19.340 7.810 1.00 36.20 H new ATOM 0 HD22 LEU A 100 22.143 18.366 6.669 1.00 36.20 H new ATOM 0 HD23 LEU A 100 23.691 18.477 6.984 1.00 36.20 H new ATOM 93 N LEU A 101 25.609 18.578 2.122 1.00 36.53 N ATOM 94 CA LEU A 101 25.794 17.962 0.806 1.00 36.42 C ATOM 95 C LEU A 101 26.419 16.566 0.867 1.00 35.76 C ATOM 96 O LEU A 101 26.321 15.798 -0.095 1.00 35.58 O ATOM 97 CB LEU A 101 26.623 18.874 -0.104 1.00 36.74 C ATOM 98 CG LEU A 101 25.962 20.203 -0.492 1.00 39.89 C ATOM 99 CD1 LEU A 101 26.953 21.086 -1.202 1.00 43.34 C ATOM 100 CD2 LEU A 101 24.707 19.998 -1.340 1.00 42.49 C ATOM 0 H LEU A 101 26.132 19.243 2.276 1.00 36.53 H new ATOM 0 HA LEU A 101 24.905 17.850 0.434 1.00 36.42 H new ATOM 0 HB2 LEU A 101 27.464 19.067 0.339 1.00 36.74 H new ATOM 0 HB3 LEU A 101 26.835 18.387 -0.916 1.00 36.74 H new ATOM 0 HG LEU A 101 25.679 20.641 0.326 1.00 39.89 H new ATOM 0 HD11 LEU A 101 26.526 21.923 -1.443 1.00 43.34 H new ATOM 0 HD12 LEU A 101 27.706 21.264 -0.617 1.00 43.34 H new ATOM 0 HD13 LEU A 101 27.267 20.641 -2.005 1.00 43.34 H new ATOM 0 HD21 LEU A 101 24.322 20.860 -1.562 1.00 42.49 H new ATOM 0 HD22 LEU A 101 24.941 19.529 -2.156 1.00 42.49 H new ATOM 0 HD23 LEU A 101 24.061 19.475 -0.841 1.00 42.49 H new ATOM 101 N PHE A 102 27.050 16.247 1.998 1.00 34.67 N ATOM 102 CA PHE A 102 27.699 14.951 2.196 1.00 33.77 C ATOM 103 C PHE A 102 26.741 13.890 2.737 1.00 33.76 C ATOM 104 O PHE A 102 27.092 12.708 2.817 1.00 34.18 O ATOM 105 CB PHE A 102 28.914 15.092 3.122 1.00 33.45 C ATOM 106 CG PHE A 102 29.925 16.100 2.648 1.00 33.05 C ATOM 107 CD1 PHE A 102 30.705 15.849 1.522 1.00 31.81 C ATOM 108 CD2 PHE A 102 30.097 17.301 3.329 1.00 33.29 C ATOM 109 CE1 PHE A 102 31.641 16.783 1.079 1.00 34.76 C ATOM 110 CE2 PHE A 102 31.031 18.244 2.897 1.00 34.20 C ATOM 111 CZ PHE A 102 31.805 17.984 1.771 1.00 34.72 C ATOM 0 H PHE A 102 27.113 16.777 2.672 1.00 34.67 H new ATOM 0 HA PHE A 102 27.995 14.650 1.323 1.00 33.77 H new ATOM 0 HB2 PHE A 102 28.608 15.345 4.007 1.00 33.45 H new ATOM 0 HB3 PHE A 102 29.347 14.228 3.208 1.00 33.45 H new ATOM 0 HD1 PHE A 102 30.600 15.049 1.060 1.00 31.81 H new ATOM 0 HD2 PHE A 102 29.582 17.478 4.083 1.00 33.29 H new ATOM 0 HE1 PHE A 102 32.155 16.606 0.324 1.00 34.76 H new ATOM 0 HE2 PHE A 102 31.135 19.043 3.360 1.00 34.20 H new ATOM 0 HZ PHE A 102 32.430 18.608 1.480 1.00 34.72 H new ATOM 112 N GLY A 103 25.536 14.318 3.103 1.00 33.78 N ATOM 113 CA GLY A 103 24.527 13.423 3.655 1.00 33.74 C ATOM 114 C GLY A 103 23.348 13.170 2.731 1.00 34.23 C ATOM 115 O GLY A 103 23.507 13.054 1.512 1.00 33.83 O ATOM 0 H GLY A 103 25.281 15.137 3.038 1.00 33.78 H new ATOM 0 HA2 GLY A 103 24.945 12.574 3.870 1.00 33.74 H new ATOM 0 HA3 GLY A 103 24.198 13.797 4.488 1.00 33.74 H new ATOM 116 N LEU A 104 22.163 13.094 3.331 1.00 34.32 N ATOM 117 CA LEU A 104 20.935 12.705 2.642 1.00 35.11 C ATOM 118 C LEU A 104 20.308 13.787 1.757 1.00 35.33 C ATOM 119 O LEU A 104 19.480 13.475 0.900 1.00 35.60 O ATOM 120 CB LEU A 104 19.902 12.224 3.670 1.00 35.08 C ATOM 121 CG LEU A 104 19.700 10.736 4.000 1.00 38.30 C ATOM 122 CD1 LEU A 104 20.970 9.899 3.948 1.00 39.65 C ATOM 123 CD2 LEU A 104 19.036 10.602 5.369 1.00 37.47 C ATOM 0 H LEU A 104 22.048 13.270 4.165 1.00 34.32 H new ATOM 0 HA LEU A 104 21.195 11.995 2.035 1.00 35.11 H new ATOM 0 HB2 LEU A 104 20.114 12.668 4.506 1.00 35.08 H new ATOM 0 HB3 LEU A 104 19.041 12.564 3.379 1.00 35.08 H new ATOM 0 HG LEU A 104 19.128 10.380 3.302 1.00 38.30 H new ATOM 0 HD11 LEU A 104 20.760 8.978 4.167 1.00 39.65 H new ATOM 0 HD12 LEU A 104 21.349 9.941 3.056 1.00 39.65 H new ATOM 0 HD13 LEU A 104 21.612 10.245 4.588 1.00 39.65 H new ATOM 0 HD21 LEU A 104 18.909 9.663 5.577 1.00 37.47 H new ATOM 0 HD22 LEU A 104 19.601 11.008 6.044 1.00 37.47 H new ATOM 0 HD23 LEU A 104 18.175 11.049 5.357 1.00 37.47 H new ATOM 124 N LEU A 105 20.691 15.047 1.959 1.00 35.03 N ATOM 125 CA LEU A 105 20.037 16.161 1.260 1.00 35.20 C ATOM 126 C LEU A 105 19.976 16.033 -0.277 1.00 34.53 C ATOM 127 O LEU A 105 18.902 16.202 -0.852 1.00 34.95 O ATOM 128 CB LEU A 105 20.620 17.524 1.678 1.00 35.13 C ATOM 129 CG LEU A 105 19.979 18.763 1.028 1.00 36.76 C ATOM 130 CD1 LEU A 105 18.474 18.849 1.326 1.00 37.40 C ATOM 131 CD2 LEU A 105 20.686 20.038 1.461 1.00 35.96 C ATOM 0 H LEU A 105 21.324 15.280 2.493 1.00 35.03 H new ATOM 0 HA LEU A 105 19.114 16.110 1.553 1.00 35.20 H new ATOM 0 HB2 LEU A 105 20.539 17.608 2.641 1.00 35.13 H new ATOM 0 HB3 LEU A 105 21.568 17.527 1.472 1.00 35.13 H new ATOM 0 HG LEU A 105 20.083 18.668 0.068 1.00 36.76 H new ATOM 0 HD11 LEU A 105 18.105 19.639 0.902 1.00 37.40 H new ATOM 0 HD12 LEU A 105 18.030 18.059 0.980 1.00 37.40 H new ATOM 0 HD13 LEU A 105 18.336 18.903 2.285 1.00 37.40 H new ATOM 0 HD21 LEU A 105 20.264 20.802 1.038 1.00 35.96 H new ATOM 0 HD22 LEU A 105 20.628 20.129 2.425 1.00 35.96 H new ATOM 0 HD23 LEU A 105 21.618 19.997 1.196 1.00 35.96 H new ATOM 132 N PRO A 106 21.120 15.768 -0.946 1.00 33.77 N ATOM 133 CA PRO A 106 21.051 15.651 -2.408 1.00 33.60 C ATOM 134 C PRO A 106 20.058 14.606 -2.932 1.00 33.99 C ATOM 135 O PRO A 106 19.356 14.876 -3.907 1.00 33.66 O ATOM 136 CB PRO A 106 22.490 15.299 -2.803 1.00 33.02 C ATOM 137 CG PRO A 106 23.324 15.889 -1.703 1.00 32.40 C ATOM 138 CD PRO A 106 22.508 15.620 -0.463 1.00 33.48 C ATOM 0 HA PRO A 106 20.717 16.473 -2.800 1.00 33.60 H new ATOM 0 HB2 PRO A 106 22.616 14.339 -2.868 1.00 33.02 H new ATOM 0 HB3 PRO A 106 22.723 15.675 -3.666 1.00 33.02 H new ATOM 0 HG2 PRO A 106 24.198 15.471 -1.654 1.00 32.40 H new ATOM 0 HG3 PRO A 106 23.471 16.839 -1.836 1.00 32.40 H new ATOM 0 HD2 PRO A 106 22.673 14.732 -0.109 1.00 33.48 H new ATOM 0 HD3 PRO A 106 22.712 16.250 0.246 1.00 33.48 H new ATOM 139 N ARG A 107 19.991 13.434 -2.297 1.00 34.38 N ATOM 140 CA ARG A 107 19.063 12.394 -2.749 1.00 34.63 C ATOM 141 C ARG A 107 17.610 12.773 -2.448 1.00 34.66 C ATOM 142 O ARG A 107 16.700 12.364 -3.166 1.00 34.33 O ATOM 143 CB ARG A 107 19.424 11.010 -2.184 1.00 34.59 C ATOM 144 CG ARG A 107 18.955 10.735 -0.762 1.00 34.08 C ATOM 145 CD ARG A 107 19.256 9.303 -0.359 1.00 34.71 C ATOM 146 NE ARG A 107 20.611 9.156 0.171 1.00 36.36 N ATOM 147 CZ ARG A 107 21.125 8.013 0.619 1.00 36.27 C ATOM 148 NH1 ARG A 107 20.408 6.895 0.593 1.00 34.49 N ATOM 149 NH2 ARG A 107 22.363 7.987 1.092 1.00 35.28 N ATOM 0 H ARG A 107 20.467 13.223 -1.612 1.00 34.38 H new ATOM 0 HA ARG A 107 19.152 12.331 -3.713 1.00 34.63 H new ATOM 0 HB2 ARG A 107 19.048 10.332 -2.768 1.00 34.59 H new ATOM 0 HB3 ARG A 107 20.388 10.908 -2.215 1.00 34.59 H new ATOM 0 HG2 ARG A 107 19.393 11.346 -0.149 1.00 34.08 H new ATOM 0 HG3 ARG A 107 18.002 10.900 -0.694 1.00 34.08 H new ATOM 0 HD2 ARG A 107 18.615 9.015 0.310 1.00 34.71 H new ATOM 0 HD3 ARG A 107 19.145 8.722 -1.128 1.00 34.71 H new ATOM 0 HE ARG A 107 21.110 9.856 0.195 1.00 36.36 H new ATOM 0 HH11 ARG A 107 19.605 6.906 0.285 1.00 34.49 H new ATOM 0 HH12 ARG A 107 20.747 6.160 0.884 1.00 34.49 H new ATOM 0 HH21 ARG A 107 22.832 8.708 1.109 1.00 35.28 H new ATOM 0 HH22 ARG A 107 22.697 7.250 1.382 1.00 35.28 H new ATOM 150 N ILE A 108 17.407 13.566 -1.395 1.00 35.16 N ATOM 151 CA ILE A 108 16.086 14.122 -1.096 1.00 35.83 C ATOM 152 C ILE A 108 15.672 15.086 -2.214 1.00 36.16 C ATOM 153 O ILE A 108 14.562 14.989 -2.736 1.00 36.35 O ATOM 154 CB ILE A 108 16.038 14.811 0.295 1.00 35.83 C ATOM 155 CG1 ILE A 108 16.150 13.766 1.413 1.00 35.05 C ATOM 156 CG2 ILE A 108 14.747 15.613 0.459 1.00 36.88 C ATOM 157 CD1 ILE A 108 16.660 14.318 2.745 1.00 36.04 C ATOM 0 H ILE A 108 18.023 13.795 -0.840 1.00 35.16 H new ATOM 0 HA ILE A 108 15.451 13.390 -1.056 1.00 35.83 H new ATOM 0 HB ILE A 108 16.790 15.420 0.356 1.00 35.83 H new ATOM 0 HG12 ILE A 108 15.278 13.365 1.554 1.00 35.05 H new ATOM 0 HG13 ILE A 108 16.744 13.058 1.120 1.00 35.05 H new ATOM 0 HG21 ILE A 108 14.736 16.035 1.333 1.00 36.88 H new ATOM 0 HG22 ILE A 108 14.700 16.295 -0.229 1.00 36.88 H new ATOM 0 HG23 ILE A 108 13.984 15.019 0.378 1.00 36.88 H new ATOM 0 HD11 ILE A 108 16.703 13.601 3.397 1.00 36.04 H new ATOM 0 HD12 ILE A 108 17.545 14.696 2.621 1.00 36.04 H new ATOM 0 HD13 ILE A 108 16.056 15.008 3.062 1.00 36.04 H new ATOM 158 N ILE A 109 16.576 15.992 -2.591 1.00 36.14 N ATOM 159 CA ILE A 109 16.318 16.934 -3.685 1.00 36.42 C ATOM 160 C ILE A 109 16.037 16.196 -4.996 1.00 36.47 C ATOM 161 O ILE A 109 15.116 16.561 -5.734 1.00 36.14 O ATOM 162 CB ILE A 109 17.486 17.945 -3.894 1.00 36.21 C ATOM 163 CG1 ILE A 109 17.775 18.751 -2.615 1.00 38.30 C ATOM 164 CG2 ILE A 109 17.207 18.874 -5.085 1.00 35.19 C ATOM 165 CD1 ILE A 109 16.581 19.518 -2.042 1.00 40.39 C ATOM 0 H ILE A 109 17.349 16.078 -2.224 1.00 36.14 H new ATOM 0 HA ILE A 109 15.531 17.439 -3.425 1.00 36.42 H new ATOM 0 HB ILE A 109 18.283 17.430 -4.097 1.00 36.21 H new ATOM 0 HG12 ILE A 109 18.107 18.143 -1.935 1.00 38.30 H new ATOM 0 HG13 ILE A 109 18.487 19.383 -2.802 1.00 38.30 H new ATOM 0 HG21 ILE A 109 17.947 19.492 -5.194 1.00 35.19 H new ATOM 0 HG22 ILE A 109 17.107 18.345 -5.892 1.00 35.19 H new ATOM 0 HG23 ILE A 109 16.391 19.373 -4.923 1.00 35.19 H new ATOM 0 HD11 ILE A 109 16.855 19.993 -1.242 1.00 40.39 H new ATOM 0 HD12 ILE A 109 16.258 20.153 -2.700 1.00 40.39 H new ATOM 0 HD13 ILE A 109 15.872 18.894 -1.820 1.00 40.39 H new ATOM 166 N HIS A 110 16.825 15.158 -5.275 1.00 36.33 N ATOM 167 CA HIS A 110 16.659 14.396 -6.509 1.00 36.24 C ATOM 168 C HIS A 110 15.295 13.706 -6.589 1.00 36.46 C ATOM 169 O HIS A 110 14.647 13.744 -7.632 1.00 36.58 O ATOM 170 CB HIS A 110 17.793 13.390 -6.712 1.00 35.72 C ATOM 171 CG HIS A 110 17.854 12.840 -8.103 1.00 35.58 C ATOM 172 ND1 HIS A 110 17.084 11.775 -8.517 1.00 35.21 N ATOM 173 CD2 HIS A 110 18.575 13.225 -9.183 1.00 35.91 C ATOM 174 CE1 HIS A 110 17.335 11.519 -9.788 1.00 35.17 C ATOM 175 NE2 HIS A 110 18.236 12.385 -10.217 1.00 36.97 N ATOM 0 H HIS A 110 17.459 14.881 -4.764 1.00 36.33 H new ATOM 0 HA HIS A 110 16.698 15.040 -7.234 1.00 36.24 H new ATOM 0 HB2 HIS A 110 18.638 13.818 -6.503 1.00 35.72 H new ATOM 0 HB3 HIS A 110 17.683 12.657 -6.086 1.00 35.72 H new ATOM 0 HD2 HIS A 110 19.185 13.926 -9.218 1.00 35.91 H new ATOM 0 HE1 HIS A 110 16.944 10.844 -10.295 1.00 35.17 H new ATOM 0 HE2 HIS A 110 18.558 12.418 -11.014 1.00 36.97 H new ATOM 176 N LEU A 111 14.867 13.081 -5.492 1.00 36.78 N ATOM 177 CA LEU A 111 13.560 12.419 -5.442 1.00 37.19 C ATOM 178 C LEU A 111 12.422 13.435 -5.568 1.00 37.92 C ATOM 179 O LEU A 111 11.464 13.212 -6.308 1.00 38.07 O ATOM 180 CB LEU A 111 13.411 11.575 -4.169 1.00 37.07 C ATOM 181 CG LEU A 111 12.165 10.684 -4.026 1.00 37.56 C ATOM 182 CD1 LEU A 111 12.083 9.627 -5.131 1.00 37.47 C ATOM 183 CD2 LEU A 111 12.125 10.022 -2.655 1.00 36.90 C ATOM 0 H LEU A 111 15.320 13.028 -4.763 1.00 36.78 H new ATOM 0 HA LEU A 111 13.506 11.817 -6.201 1.00 37.19 H new ATOM 0 HB2 LEU A 111 14.192 11.004 -4.099 1.00 37.07 H new ATOM 0 HB3 LEU A 111 13.432 12.178 -3.410 1.00 37.07 H new ATOM 0 HG LEU A 111 11.391 11.262 -4.117 1.00 37.56 H new ATOM 0 HD11 LEU A 111 11.286 9.088 -5.005 1.00 37.47 H new ATOM 0 HD12 LEU A 111 12.043 10.065 -5.996 1.00 37.47 H new ATOM 0 HD13 LEU A 111 12.867 9.057 -5.093 1.00 37.47 H new ATOM 0 HD21 LEU A 111 11.333 9.466 -2.587 1.00 36.90 H new ATOM 0 HD22 LEU A 111 12.916 9.473 -2.537 1.00 36.90 H new ATOM 0 HD23 LEU A 111 12.101 10.705 -1.966 1.00 36.90 H new ATOM 184 N TYR A 112 12.551 14.548 -4.847 1.00 38.62 N ATOM 185 CA TYR A 112 11.636 15.684 -4.952 1.00 39.67 C ATOM 186 C TYR A 112 11.526 16.178 -6.398 1.00 41.19 C ATOM 187 O TYR A 112 10.428 16.485 -6.875 1.00 41.28 O ATOM 188 CB TYR A 112 12.121 16.807 -4.030 1.00 39.11 C ATOM 189 CG TYR A 112 11.253 18.045 -3.980 1.00 39.06 C ATOM 190 CD1 TYR A 112 9.950 17.993 -3.481 1.00 38.41 C ATOM 191 CD2 TYR A 112 11.750 19.280 -4.396 1.00 40.21 C ATOM 192 CE1 TYR A 112 9.159 19.134 -3.422 1.00 37.61 C ATOM 193 CE2 TYR A 112 10.966 20.429 -4.337 1.00 38.44 C ATOM 194 CZ TYR A 112 9.673 20.348 -3.848 1.00 38.44 C ATOM 195 OH TYR A 112 8.893 21.480 -3.789 1.00 39.29 O ATOM 0 H TYR A 112 13.182 14.666 -4.275 1.00 38.62 H new ATOM 0 HA TYR A 112 10.750 15.400 -4.677 1.00 39.67 H new ATOM 0 HB2 TYR A 112 12.199 16.452 -3.131 1.00 39.11 H new ATOM 0 HB3 TYR A 112 13.012 17.069 -4.310 1.00 39.11 H new ATOM 0 HD1 TYR A 112 9.606 17.182 -3.183 1.00 38.41 H new ATOM 0 HD2 TYR A 112 12.620 19.337 -4.718 1.00 40.21 H new ATOM 0 HE1 TYR A 112 8.289 19.083 -3.098 1.00 37.61 H new ATOM 0 HE2 TYR A 112 11.308 21.245 -4.624 1.00 38.44 H new ATOM 0 HH TYR A 112 8.358 21.419 -3.144 1.00 39.29 H new ATOM 196 N ARG A 113 12.669 16.229 -7.082 1.00 42.49 N ATOM 197 CA ARG A 113 12.766 16.650 -8.481 1.00 44.52 C ATOM 198 C ARG A 113 11.955 15.741 -9.410 1.00 45.04 C ATOM 199 O ARG A 113 11.318 16.224 -10.352 1.00 45.38 O ATOM 200 CB ARG A 113 14.239 16.676 -8.921 1.00 44.32 C ATOM 201 CG ARG A 113 14.636 17.867 -9.781 1.00 46.61 C ATOM 202 CD ARG A 113 16.156 17.931 -9.994 1.00 46.24 C ATOM 203 NE ARG A 113 16.631 19.299 -10.224 1.00 52.39 N ATOM 204 CZ ARG A 113 17.523 19.931 -9.461 1.00 57.16 C ATOM 205 NH1 ARG A 113 18.066 19.325 -8.415 1.00 56.70 N ATOM 206 NH2 ARG A 113 17.889 21.175 -9.750 1.00 61.60 N ATOM 0 H ARG A 113 13.427 16.015 -6.738 1.00 42.49 H new ATOM 0 HA ARG A 113 12.392 17.542 -8.546 1.00 44.52 H new ATOM 0 HB2 ARG A 113 14.799 16.666 -8.129 1.00 44.32 H new ATOM 0 HB3 ARG A 113 14.429 15.862 -9.413 1.00 44.32 H new ATOM 0 HG2 ARG A 113 14.191 17.809 -10.641 1.00 46.61 H new ATOM 0 HG3 ARG A 113 14.333 18.686 -9.359 1.00 46.61 H new ATOM 0 HD2 ARG A 113 16.605 17.562 -9.217 1.00 46.24 H new ATOM 0 HD3 ARG A 113 16.398 17.376 -10.752 1.00 46.24 H new ATOM 0 HE ARG A 113 16.311 19.724 -10.900 1.00 52.39 H new ATOM 0 HH11 ARG A 113 17.844 18.517 -8.223 1.00 56.70 H new ATOM 0 HH12 ARG A 113 18.641 19.740 -7.928 1.00 56.70 H new ATOM 0 HH21 ARG A 113 17.550 21.576 -10.431 1.00 61.60 H new ATOM 0 HH22 ARG A 113 18.465 21.580 -9.256 1.00 61.60 H new ATOM 207 N AGLN A 114 11.985 14.437 -9.135 0.50 45.23 N ATOM 208 N BGLN A 114 11.976 14.436 -9.135 0.50 45.30 N ATOM 209 CA AGLN A 114 11.250 13.444 -9.923 0.50 45.46 C ATOM 210 CA BGLN A 114 11.241 13.455 -9.940 0.50 45.61 C ATOM 211 C AGLN A 114 9.737 13.565 -9.740 0.50 45.61 C ATOM 212 C BGLN A 114 9.730 13.574 -9.746 0.50 45.69 C ATOM 213 O AGLN A 114 8.972 13.318 -10.675 0.50 45.65 O ATOM 214 O BGLN A 114 8.960 13.331 -10.677 0.50 45.73 O ATOM 215 CB AGLN A 114 11.705 12.024 -9.566 0.50 45.47 C ATOM 216 CB BGLN A 114 11.694 12.020 -9.628 0.50 45.67 C ATOM 217 CG AGLN A 114 13.119 11.677 -10.021 0.50 45.18 C ATOM 218 CG BGLN A 114 13.208 11.785 -9.610 0.50 46.05 C ATOM 219 CD AGLN A 114 13.505 10.237 -9.716 0.50 45.42 C ATOM 220 CD BGLN A 114 13.932 12.374 -10.810 0.50 46.77 C ATOM 221 OE1AGLN A 114 13.151 9.690 -8.669 0.50 44.45 O ATOM 222 OE1BGLN A 114 14.768 13.267 -10.661 0.50 47.30 O ATOM 223 NE2AGLN A 114 14.243 9.620 -10.631 0.50 45.21 N ATOM 224 NE2BGLN A 114 13.614 11.881 -12.003 0.50 47.08 N ATOM 0 H AGLN A 114 12.434 14.101 -8.483 0.50 45.30 H new ATOM 0 H BGLN A 114 12.415 14.094 -8.479 0.50 45.30 H new ATOM 0 HA AGLN A 114 11.450 13.621 -10.855 0.50 45.61 H new ATOM 0 HA BGLN A 114 11.445 13.652 -10.868 0.50 45.61 H new ATOM 0 HB2AGLN A 114 11.651 11.912 -8.604 0.50 45.67 H new ATOM 0 HB2BGLN A 114 11.335 11.767 -8.763 0.50 45.67 H new ATOM 0 HB3AGLN A 114 11.086 11.390 -9.961 0.50 45.67 H new ATOM 0 HB3BGLN A 114 11.300 11.425 -10.285 0.50 45.67 H new ATOM 0 HG2AGLN A 114 13.193 11.831 -10.976 0.50 46.05 H new ATOM 0 HG2BGLN A 114 13.577 12.169 -8.799 0.50 46.05 H new ATOM 0 HG3AGLN A 114 13.749 12.274 -9.587 0.50 46.05 H new ATOM 0 HG3BGLN A 114 13.379 10.831 -9.576 0.50 46.05 H new ATOM 0 HE21AGLN A 114 14.471 10.033 -11.350 0.50 47.08 H new ATOM 0 HE21BGLN A 114 13.025 11.257 -12.068 0.50 47.08 H new ATOM 0 HE22AGLN A 114 14.493 8.807 -10.505 0.50 47.08 H new ATOM 0 HE22BGLN A 114 13.997 12.186 -12.710 0.50 47.08 H new ATOM 225 N ALA A 115 9.317 13.947 -8.535 1.00 45.80 N ATOM 226 CA ALA A 115 7.895 14.104 -8.202 1.00 46.12 C ATOM 227 C ALA A 115 7.266 15.332 -8.860 1.00 46.38 C ATOM 228 O ALA A 115 6.049 15.384 -9.048 1.00 46.51 O ATOM 229 CB ALA A 115 7.705 14.154 -6.692 1.00 46.02 C ATOM 0 H AALA A 115 9.849 14.124 -7.883 0.50 45.80 H new ATOM 0 H BALA A 115 9.851 14.117 -7.882 0.50 45.80 H new ATOM 0 HA ALA A 115 7.435 13.328 -8.558 1.00 46.12 H new ATOM 0 HB1 ALA A 115 6.762 14.258 -6.488 1.00 46.02 H new ATOM 0 HB2 ALA A 115 8.032 13.331 -6.297 1.00 46.02 H new ATOM 0 HB3 ALA A 115 8.199 14.905 -6.328 1.00 46.02 H new ATOM 230 N HIS A 116 8.098 16.316 -9.199 1.00 46.53 N ATOM 231 CA HIS A 116 7.639 17.529 -9.872 1.00 46.62 C ATOM 232 C HIS A 116 8.506 17.837 -11.099 1.00 46.90 C ATOM 233 O HIS A 116 9.386 18.697 -11.034 1.00 46.69 O ATOM 234 CB HIS A 116 7.644 18.720 -8.906 1.00 46.57 C ATOM 235 CG HIS A 116 6.989 18.440 -7.589 1.00 46.07 C ATOM 236 ND1 HIS A 116 5.627 18.535 -7.399 1.00 46.93 N ATOM 237 CD2 HIS A 116 7.511 18.069 -6.397 1.00 45.39 C ATOM 238 CE1 HIS A 116 5.339 18.232 -6.145 1.00 46.55 C ATOM 239 NE2 HIS A 116 6.465 17.947 -5.516 1.00 45.49 N ATOM 0 H HIS A 116 8.944 16.298 -9.045 1.00 46.53 H new ATOM 0 HA HIS A 116 6.729 17.377 -10.171 1.00 46.62 H new ATOM 0 HB2 HIS A 116 8.561 18.993 -8.749 1.00 46.57 H new ATOM 0 HB3 HIS A 116 7.194 19.468 -9.328 1.00 46.57 H new ATOM 0 HD1 HIS A 116 5.055 18.757 -8.002 1.00 46.93 H new ATOM 0 HD2 HIS A 116 8.410 17.924 -6.210 1.00 45.39 H new ATOM 0 HE1 HIS A 116 4.488 18.221 -5.769 1.00 46.55 H new ATOM 240 N PRO A 117 8.258 17.138 -12.226 1.00 47.39 N ATOM 241 CA PRO A 117 9.057 17.327 -13.445 1.00 47.77 C ATOM 242 C PRO A 117 8.964 18.731 -14.057 1.00 48.18 C ATOM 243 O PRO A 117 9.917 19.181 -14.695 1.00 48.45 O ATOM 244 CB PRO A 117 8.477 16.287 -14.413 1.00 47.72 C ATOM 245 CG PRO A 117 7.108 16.006 -13.904 1.00 47.56 C ATOM 246 CD PRO A 117 7.207 16.120 -12.416 1.00 47.52 C ATOM 0 HA PRO A 117 10.002 17.222 -13.252 1.00 47.77 H new ATOM 0 HB2 PRO A 117 8.451 16.629 -15.321 1.00 47.72 H new ATOM 0 HB3 PRO A 117 9.018 15.482 -14.428 1.00 47.72 H new ATOM 0 HG2 PRO A 117 6.465 16.639 -14.261 1.00 47.56 H new ATOM 0 HG3 PRO A 117 6.812 15.121 -14.168 1.00 47.56 H new ATOM 0 HD2 PRO A 117 6.365 16.396 -12.021 1.00 47.52 H new ATOM 0 HD3 PRO A 117 7.449 15.274 -12.007 1.00 47.52 H new ATOM 247 N ASN A 118 7.833 19.407 -13.862 1.00 48.29 N ATOM 248 CA ASN A 118 7.611 20.742 -14.424 1.00 48.48 C ATOM 249 C ASN A 118 8.038 21.891 -13.505 1.00 48.30 C ATOM 250 O ASN A 118 7.913 23.063 -13.868 1.00 48.45 O ATOM 251 CB ASN A 118 6.142 20.914 -14.833 1.00 48.85 C ATOM 252 CG ASN A 118 5.731 19.983 -15.962 1.00 50.43 C ATOM 253 OD1 ASN A 118 6.570 19.481 -16.714 1.00 51.63 O ATOM 254 ND2 ASN A 118 4.428 19.753 -16.089 1.00 52.26 N ATOM 0 H ASN A 118 7.172 19.106 -13.401 1.00 48.29 H new ATOM 0 HA ASN A 118 8.185 20.795 -15.204 1.00 48.48 H new ATOM 0 HB2 ASN A 118 5.575 20.751 -14.063 1.00 48.85 H new ATOM 0 HB3 ASN A 118 5.992 21.833 -15.106 1.00 48.85 H new ATOM 0 HD21 ASN A 118 4.141 19.237 -16.714 1.00 52.26 H new ATOM 0 HD22 ASN A 118 3.872 20.120 -15.546 1.00 52.26 H new ATOM 255 N LEU A 119 8.547 21.548 -12.323 1.00 47.92 N ATOM 256 CA LEU A 119 8.936 22.539 -11.323 1.00 47.47 C ATOM 257 C LEU A 119 10.394 22.968 -11.473 1.00 47.25 C ATOM 258 O LEU A 119 11.291 22.128 -11.591 1.00 47.23 O ATOM 259 CB LEU A 119 8.691 21.988 -9.911 1.00 47.40 C ATOM 260 CG LEU A 119 9.025 22.840 -8.680 1.00 47.60 C ATOM 261 CD1 LEU A 119 8.005 23.946 -8.490 1.00 48.31 C ATOM 262 CD2 LEU A 119 9.100 21.973 -7.431 1.00 47.41 C ATOM 0 H LEU A 119 8.676 20.734 -12.079 1.00 47.92 H new ATOM 0 HA LEU A 119 8.386 23.325 -11.465 1.00 47.47 H new ATOM 0 HB2 LEU A 119 7.751 21.755 -9.853 1.00 47.40 H new ATOM 0 HB3 LEU A 119 9.194 21.162 -9.834 1.00 47.40 H new ATOM 0 HG LEU A 119 9.892 23.248 -8.828 1.00 47.60 H new ATOM 0 HD11 LEU A 119 8.237 24.470 -7.707 1.00 48.31 H new ATOM 0 HD12 LEU A 119 8.000 24.520 -9.272 1.00 48.31 H new ATOM 0 HD13 LEU A 119 7.125 23.557 -8.369 1.00 48.31 H new ATOM 0 HD21 LEU A 119 9.312 22.528 -6.664 1.00 47.41 H new ATOM 0 HD22 LEU A 119 8.246 21.537 -7.288 1.00 47.41 H new ATOM 0 HD23 LEU A 119 9.791 21.301 -7.544 1.00 47.41 H new ATOM 263 N ARG A 120 10.620 24.280 -11.470 1.00 46.82 N ATOM 264 CA ARG A 120 11.973 24.820 -11.414 1.00 46.95 C ATOM 265 C ARG A 120 12.445 24.861 -9.961 1.00 46.17 C ATOM 266 O ARG A 120 11.839 25.529 -9.120 1.00 46.09 O ATOM 267 CB ARG A 120 12.045 26.216 -12.043 1.00 46.78 C ATOM 268 CG ARG A 120 13.439 26.835 -11.973 1.00 48.57 C ATOM 269 CD ARG A 120 13.513 28.214 -12.613 1.00 48.08 C ATOM 270 NE ARG A 120 14.814 28.838 -12.367 1.00 53.54 N ATOM 271 CZ ARG A 120 15.874 28.730 -13.166 1.00 56.07 C ATOM 272 NH1 ARG A 120 15.807 28.025 -14.291 1.00 56.96 N ATOM 273 NH2 ARG A 120 17.009 29.336 -12.841 1.00 56.63 N ATOM 0 H ARG A 120 10.000 24.875 -11.500 1.00 46.82 H new ATOM 0 HA ARG A 120 12.558 24.240 -11.927 1.00 46.95 H new ATOM 0 HB2 ARG A 120 11.768 26.161 -12.971 1.00 46.78 H new ATOM 0 HB3 ARG A 120 11.415 26.800 -11.593 1.00 46.78 H new ATOM 0 HG2 ARG A 120 13.712 26.900 -11.044 1.00 48.57 H new ATOM 0 HG3 ARG A 120 14.071 26.246 -12.413 1.00 48.57 H new ATOM 0 HD2 ARG A 120 13.362 28.139 -13.568 1.00 48.08 H new ATOM 0 HD3 ARG A 120 12.808 28.777 -12.257 1.00 48.08 H new ATOM 0 HE ARG A 120 14.900 29.310 -11.653 1.00 53.54 H new ATOM 0 HH11 ARG A 120 15.074 27.633 -14.510 1.00 56.96 H new ATOM 0 HH12 ARG A 120 16.497 27.961 -14.800 1.00 56.96 H new ATOM 0 HH21 ARG A 120 17.058 29.797 -12.116 1.00 56.63 H new ATOM 0 HH22 ARG A 120 17.695 29.268 -13.355 1.00 56.63 H new ATOM 274 N ILE A 121 13.520 24.132 -9.676 1.00 45.51 N ATOM 275 CA ILE A 121 14.106 24.107 -8.342 1.00 44.92 C ATOM 276 C ILE A 121 15.420 24.878 -8.343 1.00 44.41 C ATOM 277 O ILE A 121 16.333 24.571 -9.114 1.00 44.79 O ATOM 278 CB ILE A 121 14.329 22.659 -7.835 1.00 45.23 C ATOM 279 CG1 ILE A 121 12.992 21.918 -7.734 1.00 45.22 C ATOM 280 CG2 ILE A 121 15.044 22.663 -6.480 1.00 45.05 C ATOM 281 CD1 ILE A 121 13.122 20.413 -7.670 1.00 46.49 C ATOM 0 H ILE A 121 13.929 23.639 -10.250 1.00 45.51 H new ATOM 0 HA ILE A 121 13.482 24.532 -7.733 1.00 44.92 H new ATOM 0 HB ILE A 121 14.892 22.195 -8.474 1.00 45.23 H new ATOM 0 HG12 ILE A 121 12.522 22.226 -6.944 1.00 45.22 H new ATOM 0 HG13 ILE A 121 12.445 22.153 -8.499 1.00 45.22 H new ATOM 0 HG21 ILE A 121 15.174 21.750 -6.180 1.00 45.05 H new ATOM 0 HG22 ILE A 121 15.906 23.099 -6.570 1.00 45.05 H new ATOM 0 HG23 ILE A 121 14.505 23.142 -5.831 1.00 45.05 H new ATOM 0 HD11 ILE A 121 12.240 20.014 -7.608 1.00 46.49 H new ATOM 0 HD12 ILE A 121 13.566 20.092 -8.471 1.00 46.49 H new ATOM 0 HD13 ILE A 121 13.644 20.166 -6.891 1.00 46.49 H new ATOM 282 N GLU A 122 15.499 25.891 -7.486 1.00 43.10 N ATOM 283 CA GLU A 122 16.713 26.680 -7.341 1.00 42.13 C ATOM 284 C GLU A 122 17.346 26.412 -5.982 1.00 41.51 C ATOM 285 O GLU A 122 16.687 26.510 -4.945 1.00 41.35 O ATOM 286 CB GLU A 122 16.418 28.169 -7.527 1.00 42.00 C ATOM 287 CG GLU A 122 15.979 28.544 -8.942 1.00 41.24 C ATOM 288 CD GLU A 122 15.627 30.013 -9.087 1.00 41.89 C ATOM 289 OE1 GLU A 122 15.720 30.762 -8.089 1.00 39.42 O ATOM 290 OE2 GLU A 122 15.253 30.423 -10.206 1.00 41.67 O ATOM 0 H GLU A 122 14.853 26.138 -6.975 1.00 43.10 H new ATOM 0 HA GLU A 122 17.342 26.417 -8.031 1.00 42.13 H new ATOM 0 HB2 GLU A 122 15.724 28.432 -6.903 1.00 42.00 H new ATOM 0 HB3 GLU A 122 17.212 28.677 -7.299 1.00 42.00 H new ATOM 0 HG2 GLU A 122 16.690 28.325 -9.564 1.00 41.24 H new ATOM 0 HG3 GLU A 122 15.210 28.007 -9.189 1.00 41.24 H new ATOM 291 N LEU A 123 18.626 26.058 -6.005 1.00 40.83 N ATOM 292 CA LEU A 123 19.359 25.700 -4.798 1.00 40.59 C ATOM 293 C LEU A 123 20.407 26.759 -4.478 1.00 39.80 C ATOM 294 O LEU A 123 21.200 27.135 -5.343 1.00 39.64 O ATOM 295 CB LEU A 123 20.005 24.319 -4.962 1.00 40.87 C ATOM 296 CG LEU A 123 19.039 23.176 -5.313 1.00 42.32 C ATOM 297 CD1 LEU A 123 19.792 21.929 -5.756 1.00 41.85 C ATOM 298 CD2 LEU A 123 18.097 22.854 -4.151 1.00 42.23 C ATOM 0 H LEU A 123 19.095 26.019 -6.725 1.00 40.83 H new ATOM 0 HA LEU A 123 18.738 25.659 -4.054 1.00 40.59 H new ATOM 0 HB2 LEU A 123 20.681 24.375 -5.656 1.00 40.87 H new ATOM 0 HB3 LEU A 123 20.463 24.093 -4.137 1.00 40.87 H new ATOM 0 HG LEU A 123 18.497 23.481 -6.057 1.00 42.32 H new ATOM 0 HD11 LEU A 123 19.158 21.227 -5.970 1.00 41.85 H new ATOM 0 HD12 LEU A 123 20.324 22.134 -6.541 1.00 41.85 H new ATOM 0 HD13 LEU A 123 20.374 21.631 -5.040 1.00 41.85 H new ATOM 0 HD21 LEU A 123 17.503 22.131 -4.406 1.00 42.23 H new ATOM 0 HD22 LEU A 123 18.617 22.587 -3.377 1.00 42.23 H new ATOM 0 HD23 LEU A 123 17.573 23.640 -3.932 1.00 42.23 H new ATOM 299 N TYR A 124 20.393 27.242 -3.238 1.00 39.02 N ATOM 300 CA TYR A 124 21.290 28.312 -2.811 1.00 38.60 C ATOM 301 C TYR A 124 22.041 27.936 -1.543 1.00 38.15 C ATOM 302 O TYR A 124 21.425 27.610 -0.529 1.00 38.11 O ATOM 303 CB TYR A 124 20.510 29.606 -2.564 1.00 38.55 C ATOM 304 CG TYR A 124 19.822 30.159 -3.786 1.00 40.08 C ATOM 305 CD1 TYR A 124 20.523 30.925 -4.718 1.00 39.28 C ATOM 306 CD2 TYR A 124 18.466 29.920 -4.011 1.00 38.49 C ATOM 307 CE1 TYR A 124 19.891 31.436 -5.845 1.00 41.20 C ATOM 308 CE2 TYR A 124 17.826 30.427 -5.131 1.00 39.59 C ATOM 309 CZ TYR A 124 18.543 31.182 -6.043 1.00 40.29 C ATOM 310 OH TYR A 124 17.913 31.686 -7.153 1.00 41.64 O ATOM 0 H TYR A 124 19.864 26.959 -2.622 1.00 39.02 H new ATOM 0 HA TYR A 124 21.931 28.449 -3.526 1.00 38.60 H new ATOM 0 HB2 TYR A 124 19.845 29.444 -1.877 1.00 38.55 H new ATOM 0 HB3 TYR A 124 21.119 30.277 -2.217 1.00 38.55 H new ATOM 0 HD1 TYR A 124 21.427 31.096 -4.583 1.00 39.28 H new ATOM 0 HD2 TYR A 124 17.984 29.412 -3.399 1.00 38.49 H new ATOM 0 HE1 TYR A 124 20.368 31.944 -6.461 1.00 41.20 H new ATOM 0 HE2 TYR A 124 16.921 30.261 -5.269 1.00 39.59 H new ATOM 0 HH TYR A 124 17.355 31.126 -7.437 1.00 41.64 H new ATOM 311 N GLU A 125 23.369 27.989 -1.606 1.00 37.53 N ATOM 312 CA GLU A 125 24.198 27.782 -0.426 1.00 37.30 C ATOM 313 C GLU A 125 24.166 29.046 0.429 1.00 37.44 C ATOM 314 O GLU A 125 24.499 30.135 -0.044 1.00 37.28 O ATOM 315 CB GLU A 125 25.640 27.443 -0.820 1.00 37.09 C ATOM 316 CG GLU A 125 26.528 27.039 0.362 1.00 36.66 C ATOM 317 CD GLU A 125 28.020 27.154 0.077 1.00 37.34 C ATOM 318 OE1 GLU A 125 28.413 27.835 -0.896 1.00 39.20 O ATOM 319 OE2 GLU A 125 28.812 26.572 0.846 1.00 39.67 O ATOM 0 H GLU A 125 23.810 28.145 -2.328 1.00 37.53 H new ATOM 0 HA GLU A 125 23.847 27.033 0.081 1.00 37.30 H new ATOM 0 HB2 GLU A 125 25.628 26.720 -1.466 1.00 37.09 H new ATOM 0 HB3 GLU A 125 26.034 28.211 -1.262 1.00 37.09 H new ATOM 0 HG2 GLU A 125 26.309 27.596 1.125 1.00 36.66 H new ATOM 0 HG3 GLU A 125 26.324 26.124 0.611 1.00 36.66 H new ATOM 320 N MET A 126 23.750 28.894 1.683 1.00 37.80 N ATOM 321 CA MET A 126 23.695 30.015 2.626 1.00 38.69 C ATOM 322 C MET A 126 23.614 29.530 4.064 1.00 37.44 C ATOM 323 O MET A 126 23.027 28.483 4.345 1.00 37.42 O ATOM 324 CB MET A 126 22.524 30.973 2.314 1.00 38.14 C ATOM 325 CG MET A 126 21.188 30.304 2.042 1.00 40.35 C ATOM 326 SD MET A 126 19.782 31.443 1.885 1.00 41.71 S ATOM 327 CE MET A 126 20.043 32.149 0.264 1.00 41.69 C ATOM 0 H MET A 126 23.492 28.143 2.013 1.00 37.80 H new ATOM 0 HA MET A 126 24.522 30.510 2.518 1.00 38.69 H new ATOM 0 HB2 MET A 126 22.417 31.582 3.061 1.00 38.14 H new ATOM 0 HB3 MET A 126 22.762 31.510 1.542 1.00 38.14 H new ATOM 0 HG2 MET A 126 21.261 29.786 1.225 1.00 40.35 H new ATOM 0 HG3 MET A 126 21.002 29.678 2.759 1.00 40.35 H new ATOM 0 HE1 MET A 126 19.896 33.107 0.301 1.00 41.69 H new ATOM 0 HE2 MET A 126 20.953 31.973 -0.023 1.00 41.69 H new ATOM 0 HE3 MET A 126 19.422 31.751 -0.366 1.00 41.69 H new ATOM 328 N GLY A 127 24.216 30.299 4.967 1.00 36.89 N ATOM 329 CA GLY A 127 24.145 30.024 6.398 1.00 36.78 C ATOM 330 C GLY A 127 22.742 30.262 6.922 1.00 36.50 C ATOM 331 O GLY A 127 21.912 30.870 6.237 1.00 36.19 O ATOM 0 H GLY A 127 24.678 30.996 4.766 1.00 36.89 H new ATOM 0 HA2 GLY A 127 24.407 29.106 6.569 1.00 36.78 H new ATOM 0 HA3 GLY A 127 24.773 30.591 6.872 1.00 36.78 H new ATOM 332 N THR A 128 22.481 29.788 8.138 1.00 36.32 N ATOM 333 CA THR A 128 21.146 29.873 8.733 1.00 36.59 C ATOM 334 C THR A 128 20.671 31.310 8.965 1.00 36.49 C ATOM 335 O THR A 128 19.477 31.592 8.837 1.00 36.60 O ATOM 336 CB THR A 128 21.036 29.052 10.036 1.00 36.71 C ATOM 337 OG1 THR A 128 22.055 29.461 10.953 1.00 38.49 O ATOM 338 CG2 THR A 128 21.193 27.561 9.746 1.00 36.79 C ATOM 0 H THR A 128 23.068 29.410 8.640 1.00 36.32 H new ATOM 0 HA THR A 128 20.552 29.482 8.073 1.00 36.59 H new ATOM 0 HB THR A 128 20.161 29.209 10.424 1.00 36.71 H new ATOM 0 HG1 THR A 128 21.910 29.116 11.705 1.00 38.49 H new ATOM 0 HG21 THR A 128 21.121 27.061 10.574 1.00 36.79 H new ATOM 0 HG22 THR A 128 20.496 27.275 9.135 1.00 36.79 H new ATOM 0 HG23 THR A 128 22.061 27.399 9.345 1.00 36.79 H new ATOM 339 N LYS A 129 21.595 32.213 9.296 1.00 36.21 N ATOM 340 CA LYS A 129 21.249 33.630 9.439 1.00 36.40 C ATOM 341 C LYS A 129 20.741 34.185 8.108 1.00 35.95 C ATOM 342 O LYS A 129 19.686 34.818 8.060 1.00 35.91 O ATOM 343 CB LYS A 129 22.432 34.454 9.952 1.00 36.50 C ATOM 344 CG LYS A 129 22.092 35.921 10.245 1.00 36.94 C ATOM 345 CD LYS A 129 23.311 36.709 10.732 1.00 37.72 C ATOM 346 CE LYS A 129 23.717 36.319 12.156 1.00 41.68 C ATOM 347 NZ LYS A 129 24.916 37.055 12.651 1.00 42.78 N ATOM 0 H LYS A 129 22.422 32.028 9.441 1.00 36.21 H new ATOM 0 HA LYS A 129 20.542 33.698 10.100 1.00 36.40 H new ATOM 0 HB2 LYS A 129 22.773 34.043 10.762 1.00 36.50 H new ATOM 0 HB3 LYS A 129 23.145 34.422 9.295 1.00 36.50 H new ATOM 0 HG2 LYS A 129 21.739 36.336 9.442 1.00 36.94 H new ATOM 0 HG3 LYS A 129 21.393 35.962 10.916 1.00 36.94 H new ATOM 0 HD2 LYS A 129 24.056 36.554 10.131 1.00 37.72 H new ATOM 0 HD3 LYS A 129 23.114 37.658 10.701 1.00 37.72 H new ATOM 0 HE2 LYS A 129 22.973 36.486 12.755 1.00 41.68 H new ATOM 0 HE3 LYS A 129 23.896 35.366 12.185 1.00 41.68 H new ATOM 0 HZ1 LYS A 129 24.886 37.109 13.539 1.00 42.78 H new ATOM 0 HZ2 LYS A 129 25.653 36.621 12.405 1.00 42.78 H new ATOM 0 HZ3 LYS A 129 24.925 37.875 12.305 1.00 42.78 H new ATOM 348 N ALA A 130 21.485 33.926 7.033 1.00 35.44 N ATOM 349 CA ALA A 130 21.074 34.331 5.688 1.00 35.39 C ATOM 350 C ALA A 130 19.767 33.654 5.276 1.00 35.48 C ATOM 351 O ALA A 130 18.922 34.279 4.638 1.00 35.21 O ATOM 352 CB ALA A 130 22.173 34.043 4.675 1.00 34.97 C ATOM 0 H ALA A 130 22.239 33.513 7.062 1.00 35.44 H new ATOM 0 HA ALA A 130 20.918 35.288 5.705 1.00 35.39 H new ATOM 0 HB1 ALA A 130 21.880 34.319 3.792 1.00 34.97 H new ATOM 0 HB2 ALA A 130 22.974 34.534 4.917 1.00 34.97 H new ATOM 0 HB3 ALA A 130 22.367 33.093 4.669 1.00 34.97 H new ATOM 353 N GLN A 131 19.610 32.384 5.655 1.00 36.00 N ATOM 354 CA GLN A 131 18.372 31.628 5.423 1.00 36.18 C ATOM 355 C GLN A 131 17.167 32.268 6.103 1.00 35.85 C ATOM 356 O GLN A 131 16.100 32.390 5.498 1.00 35.88 O ATOM 357 CB GLN A 131 18.513 30.188 5.924 1.00 36.05 C ATOM 358 CG GLN A 131 19.314 29.271 5.021 1.00 36.14 C ATOM 359 CD GLN A 131 19.449 27.876 5.596 1.00 36.79 C ATOM 360 OE1 GLN A 131 18.565 27.399 6.315 1.00 37.35 O ATOM 361 NE2 GLN A 131 20.559 27.214 5.289 1.00 35.62 N ATOM 0 H GLN A 131 20.222 31.933 6.057 1.00 36.00 H new ATOM 0 HA GLN A 131 18.223 31.634 4.464 1.00 36.18 H new ATOM 0 HB2 GLN A 131 18.931 30.204 6.799 1.00 36.05 H new ATOM 0 HB3 GLN A 131 17.626 29.812 6.040 1.00 36.05 H new ATOM 0 HG2 GLN A 131 18.886 29.221 4.152 1.00 36.14 H new ATOM 0 HG3 GLN A 131 20.197 29.648 4.881 1.00 36.14 H new ATOM 0 HE21 GLN A 131 21.152 27.580 4.785 1.00 35.62 H new ATOM 0 HE22 GLN A 131 20.684 26.420 5.594 1.00 35.62 H new ATOM 362 N THR A 132 17.347 32.660 7.363 1.00 35.74 N ATOM 363 CA THR A 132 16.305 33.336 8.137 1.00 36.19 C ATOM 364 C THR A 132 15.815 34.602 7.425 1.00 35.98 C ATOM 365 O THR A 132 14.608 34.797 7.261 1.00 35.67 O ATOM 366 CB THR A 132 16.801 33.663 9.567 1.00 36.19 C ATOM 367 OG1 THR A 132 17.088 32.439 10.250 1.00 40.00 O ATOM 368 CG2 THR A 132 15.751 34.434 10.364 1.00 37.15 C ATOM 0 H THR A 132 18.081 32.541 7.796 1.00 35.74 H new ATOM 0 HA THR A 132 15.552 32.729 8.211 1.00 36.19 H new ATOM 0 HB THR A 132 17.595 34.215 9.492 1.00 36.19 H new ATOM 0 HG1 THR A 132 17.777 32.089 9.921 1.00 40.00 H new ATOM 0 HG21 THR A 132 16.092 34.622 11.252 1.00 37.15 H new ATOM 0 HG22 THR A 132 15.550 35.268 9.912 1.00 37.15 H new ATOM 0 HG23 THR A 132 14.943 33.902 10.435 1.00 37.15 H new ATOM 369 N GLU A 133 16.755 35.442 6.992 1.00 36.03 N ATOM 370 CA GLU A 133 16.422 36.699 6.315 1.00 36.58 C ATOM 371 C GLU A 133 15.784 36.459 4.949 1.00 36.34 C ATOM 372 O GLU A 133 14.848 37.163 4.567 1.00 36.23 O ATOM 373 CB GLU A 133 17.657 37.600 6.179 1.00 36.76 C ATOM 374 CG GLU A 133 18.295 38.014 7.508 1.00 40.29 C ATOM 375 CD GLU A 133 17.308 38.677 8.464 1.00 43.51 C ATOM 376 OE1 GLU A 133 16.669 39.676 8.073 1.00 45.92 O ATOM 377 OE2 GLU A 133 17.175 38.196 9.611 1.00 46.63 O ATOM 0 H GLU A 133 17.599 35.302 7.081 1.00 36.03 H new ATOM 0 HA GLU A 133 15.769 37.154 6.870 1.00 36.58 H new ATOM 0 HB2 GLU A 133 18.322 37.138 5.645 1.00 36.76 H new ATOM 0 HB3 GLU A 133 17.407 38.400 5.691 1.00 36.76 H new ATOM 0 HG2 GLU A 133 18.675 37.231 7.936 1.00 40.29 H new ATOM 0 HG3 GLU A 133 19.027 38.625 7.333 1.00 40.29 H new ATOM 378 N ALA A 134 16.289 35.461 4.224 1.00 36.28 N ATOM 379 CA ALA A 134 15.764 35.124 2.899 1.00 36.22 C ATOM 380 C ALA A 134 14.332 34.583 2.969 1.00 36.36 C ATOM 381 O ALA A 134 13.499 34.913 2.121 1.00 36.72 O ATOM 382 CB ALA A 134 16.683 34.144 2.187 1.00 35.54 C ATOM 0 H ALA A 134 16.941 34.963 4.483 1.00 36.28 H new ATOM 0 HA ALA A 134 15.734 35.945 2.383 1.00 36.22 H new ATOM 0 HB1 ALA A 134 16.318 33.934 1.313 1.00 35.54 H new ATOM 0 HB2 ALA A 134 17.562 34.541 2.083 1.00 35.54 H new ATOM 0 HB3 ALA A 134 16.756 33.330 2.710 1.00 35.54 H new ATOM 383 N LEU A 135 14.051 33.765 3.982 1.00 36.04 N ATOM 384 CA LEU A 135 12.708 33.216 4.189 1.00 36.22 C ATOM 385 C LEU A 135 11.670 34.309 4.435 1.00 36.84 C ATOM 386 O LEU A 135 10.603 34.313 3.810 1.00 36.83 O ATOM 387 CB LEU A 135 12.702 32.201 5.340 1.00 35.76 C ATOM 388 CG LEU A 135 13.203 30.784 5.042 1.00 34.84 C ATOM 389 CD1 LEU A 135 13.531 30.037 6.329 1.00 31.60 C ATOM 390 CD2 LEU A 135 12.183 30.005 4.211 1.00 35.68 C ATOM 0 H LEU A 135 14.629 33.513 4.567 1.00 36.04 H new ATOM 0 HA LEU A 135 12.460 32.760 3.370 1.00 36.22 H new ATOM 0 HB2 LEU A 135 13.242 32.563 6.060 1.00 35.76 H new ATOM 0 HB3 LEU A 135 11.794 32.133 5.673 1.00 35.76 H new ATOM 0 HG LEU A 135 14.019 30.862 4.523 1.00 34.84 H new ATOM 0 HD11 LEU A 135 13.845 29.145 6.114 1.00 31.60 H new ATOM 0 HD12 LEU A 135 14.222 30.515 6.814 1.00 31.60 H new ATOM 0 HD13 LEU A 135 12.735 29.975 6.879 1.00 31.60 H new ATOM 0 HD21 LEU A 135 12.522 29.113 4.035 1.00 35.68 H new ATOM 0 HD22 LEU A 135 11.347 29.943 4.699 1.00 35.68 H new ATOM 0 HD23 LEU A 135 12.032 30.464 3.370 1.00 35.68 H new ATOM 391 N LYS A 136 11.993 35.237 5.336 1.00 37.47 N ATOM 392 CA LYS A 136 11.106 36.353 5.666 1.00 38.10 C ATOM 393 C LYS A 136 10.868 37.269 4.467 1.00 38.93 C ATOM 394 O LYS A 136 9.794 37.855 4.331 1.00 39.20 O ATOM 395 CB LYS A 136 11.663 37.161 6.840 1.00 37.82 C ATOM 396 CG LYS A 136 11.656 36.419 8.177 1.00 38.51 C ATOM 397 CD LYS A 136 12.114 37.315 9.323 1.00 38.24 C ATOM 398 CE LYS A 136 13.609 37.580 9.267 1.00 41.79 C ATOM 399 NZ LYS A 136 14.045 38.467 10.378 1.00 43.77 N ATOM 0 H LYS A 136 12.733 35.237 5.773 1.00 37.47 H new ATOM 0 HA LYS A 136 10.252 35.970 5.921 1.00 38.10 H new ATOM 0 HB2 LYS A 136 12.573 37.425 6.634 1.00 37.82 H new ATOM 0 HB3 LYS A 136 11.145 37.976 6.932 1.00 37.82 H new ATOM 0 HG2 LYS A 136 10.762 36.091 8.360 1.00 38.51 H new ATOM 0 HG3 LYS A 136 12.237 35.644 8.120 1.00 38.51 H new ATOM 0 HD2 LYS A 136 11.634 38.157 9.287 1.00 38.24 H new ATOM 0 HD3 LYS A 136 11.891 36.897 10.170 1.00 38.24 H new ATOM 0 HE2 LYS A 136 14.090 36.739 9.314 1.00 41.79 H new ATOM 0 HE3 LYS A 136 13.835 37.989 8.417 1.00 41.79 H new ATOM 0 HZ1 LYS A 136 14.877 38.746 10.227 1.00 43.77 H new ATOM 0 HZ2 LYS A 136 13.501 39.170 10.428 1.00 43.77 H new ATOM 0 HZ3 LYS A 136 14.019 38.017 11.145 1.00 43.77 H new ATOM 400 N GLU A 137 11.871 37.375 3.599 1.00 39.57 N ATOM 401 CA GLU A 137 11.787 38.218 2.406 1.00 41.10 C ATOM 402 C GLU A 137 11.217 37.481 1.186 1.00 40.75 C ATOM 403 O GLU A 137 11.074 38.065 0.109 1.00 40.66 O ATOM 404 CB GLU A 137 13.161 38.820 2.092 1.00 40.97 C ATOM 405 CG GLU A 137 13.564 39.943 3.048 1.00 43.37 C ATOM 406 CD GLU A 137 15.049 40.277 3.007 1.00 43.01 C ATOM 407 OE1 GLU A 137 15.757 39.810 2.088 1.00 49.06 O ATOM 408 OE2 GLU A 137 15.509 41.016 3.904 1.00 49.23 O ATOM 0 H GLU A 137 12.620 36.961 3.684 1.00 39.57 H new ATOM 0 HA GLU A 137 11.160 38.931 2.604 1.00 41.10 H new ATOM 0 HB2 GLU A 137 13.830 38.118 2.127 1.00 40.97 H new ATOM 0 HB3 GLU A 137 13.157 39.163 1.185 1.00 40.97 H new ATOM 0 HG2 GLU A 137 13.055 40.740 2.831 1.00 43.37 H new ATOM 0 HG3 GLU A 137 13.322 39.689 3.953 1.00 43.37 H new ATOM 409 N GLY A 138 10.889 36.203 1.366 1.00 40.70 N ATOM 410 CA GLY A 138 10.355 35.370 0.289 1.00 40.43 C ATOM 411 C GLY A 138 11.380 34.945 -0.751 1.00 40.41 C ATOM 412 O GLY A 138 11.015 34.428 -1.809 1.00 40.83 O ATOM 0 H GLY A 138 10.970 35.793 2.118 1.00 40.70 H new ATOM 0 HA2 GLY A 138 9.958 34.575 0.678 1.00 40.43 H new ATOM 0 HA3 GLY A 138 9.642 35.855 -0.156 1.00 40.43 H new ATOM 413 N ARG A 139 12.661 35.153 -0.451 1.00 39.81 N ATOM 414 CA ARG A 139 13.743 34.831 -1.386 1.00 39.47 C ATOM 415 C ARG A 139 14.111 33.341 -1.429 1.00 39.08 C ATOM 416 O ARG A 139 14.652 32.865 -2.427 1.00 39.24 O ATOM 417 CB ARG A 139 14.971 35.709 -1.125 1.00 39.39 C ATOM 418 CG ARG A 139 14.770 37.162 -1.551 1.00 39.24 C ATOM 419 CD ARG A 139 16.046 37.984 -1.438 1.00 40.01 C ATOM 420 NE ARG A 139 16.444 38.202 -0.048 1.00 42.47 N ATOM 421 CZ ARG A 139 17.502 37.643 0.538 1.00 44.01 C ATOM 422 NH1 ARG A 139 18.299 36.824 -0.140 1.00 44.95 N ATOM 423 NH2 ARG A 139 17.766 37.911 1.809 1.00 42.43 N ATOM 0 H ARG A 139 12.928 35.483 0.297 1.00 39.81 H new ATOM 0 HA ARG A 139 13.399 35.032 -2.270 1.00 39.47 H new ATOM 0 HB2 ARG A 139 15.186 35.682 -0.180 1.00 39.39 H new ATOM 0 HB3 ARG A 139 15.732 35.341 -1.600 1.00 39.39 H new ATOM 0 HG2 ARG A 139 14.453 37.186 -2.467 1.00 39.24 H new ATOM 0 HG3 ARG A 139 14.080 37.565 -1.001 1.00 39.24 H new ATOM 0 HD2 ARG A 139 16.762 37.532 -1.910 1.00 40.01 H new ATOM 0 HD3 ARG A 139 15.916 38.841 -1.873 1.00 40.01 H new ATOM 0 HE ARG A 139 15.959 38.730 0.427 1.00 42.47 H new ATOM 0 HH11 ARG A 139 18.134 36.650 -0.966 1.00 44.95 H new ATOM 0 HH12 ARG A 139 18.979 36.468 0.247 1.00 44.95 H new ATOM 0 HH21 ARG A 139 17.255 38.443 2.251 1.00 42.43 H new ATOM 0 HH22 ARG A 139 18.448 37.552 2.191 1.00 42.43 H new ATOM 424 N ILE A 140 13.839 32.620 -0.343 1.00 38.44 N ATOM 425 CA ILE A 140 13.824 31.151 -0.361 1.00 37.61 C ATOM 426 C ILE A 140 12.527 30.666 0.286 1.00 37.82 C ATOM 427 O ILE A 140 11.841 31.439 0.955 1.00 37.39 O ATOM 428 CB ILE A 140 15.058 30.494 0.336 1.00 37.37 C ATOM 429 CG1 ILE A 140 15.097 30.823 1.836 1.00 36.43 C ATOM 430 CG2 ILE A 140 16.373 30.862 -0.385 1.00 35.15 C ATOM 431 CD1 ILE A 140 16.133 30.017 2.631 1.00 37.40 C ATOM 0 H ILE A 140 13.658 32.964 0.424 1.00 38.44 H new ATOM 0 HA ILE A 140 13.875 30.875 -1.290 1.00 37.61 H new ATOM 0 HB ILE A 140 14.962 29.531 0.266 1.00 37.37 H new ATOM 0 HG12 ILE A 140 15.285 31.768 1.945 1.00 36.43 H new ATOM 0 HG13 ILE A 140 14.218 30.663 2.215 1.00 36.43 H new ATOM 0 HG21 ILE A 140 17.120 30.441 0.069 1.00 35.15 H new ATOM 0 HG22 ILE A 140 16.337 30.552 -1.303 1.00 35.15 H new ATOM 0 HG23 ILE A 140 16.490 31.825 -0.374 1.00 35.15 H new ATOM 0 HD11 ILE A 140 16.099 30.278 3.565 1.00 37.40 H new ATOM 0 HD12 ILE A 140 15.936 29.070 2.553 1.00 37.40 H new ATOM 0 HD13 ILE A 140 17.020 30.193 2.279 1.00 37.40 H new ATOM 432 N ASP A 141 12.204 29.391 0.093 1.00 38.22 N ATOM 433 CA ASP A 141 10.948 28.829 0.587 1.00 38.57 C ATOM 434 C ASP A 141 11.154 27.774 1.675 1.00 38.55 C ATOM 435 O ASP A 141 10.235 27.480 2.445 1.00 38.33 O ATOM 436 CB ASP A 141 10.132 28.271 -0.582 1.00 38.55 C ATOM 437 CG ASP A 141 9.851 29.322 -1.639 1.00 39.92 C ATOM 438 OD1 ASP A 141 9.079 30.259 -1.349 1.00 43.55 O ATOM 439 OD2 ASP A 141 10.408 29.221 -2.754 1.00 40.29 O ATOM 0 H ASP A 141 12.703 28.829 -0.325 1.00 38.22 H new ATOM 0 HA ASP A 141 10.452 29.550 1.007 1.00 38.57 H new ATOM 0 HB2 ASP A 141 10.612 27.530 -0.985 1.00 38.55 H new ATOM 0 HB3 ASP A 141 9.292 27.918 -0.249 1.00 38.55 H new ATOM 440 N ALA A 142 12.364 27.218 1.730 1.00 38.31 N ATOM 441 CA ALA A 142 12.764 26.270 2.770 1.00 38.17 C ATOM 442 C ALA A 142 14.271 26.347 2.957 1.00 38.44 C ATOM 443 O ALA A 142 15.012 26.525 1.989 1.00 38.57 O ATOM 444 CB ALA A 142 12.350 24.848 2.403 1.00 38.10 C ATOM 0 H ALA A 142 12.984 27.383 1.157 1.00 38.31 H new ATOM 0 HA ALA A 142 12.317 26.503 3.599 1.00 38.17 H new ATOM 0 HB1 ALA A 142 12.625 24.239 3.106 1.00 38.10 H new ATOM 0 HB2 ALA A 142 11.386 24.808 2.300 1.00 38.10 H new ATOM 0 HB3 ALA A 142 12.775 24.592 1.569 1.00 38.10 H new ATOM 445 N GLY A 143 14.718 26.215 4.204 1.00 38.34 N ATOM 446 CA GLY A 143 16.143 26.272 4.523 1.00 38.27 C ATOM 447 C GLY A 143 16.592 25.105 5.384 1.00 38.26 C ATOM 448 O GLY A 143 15.985 24.820 6.419 1.00 37.85 O ATOM 0 H GLY A 143 14.208 26.091 4.885 1.00 38.34 H new ATOM 0 HA2 GLY A 143 16.656 26.279 3.700 1.00 38.27 H new ATOM 0 HA3 GLY A 143 16.335 27.103 4.984 1.00 38.27 H new ATOM 449 N PHE A 144 17.654 24.431 4.945 1.00 38.03 N ATOM 450 CA PHE A 144 18.242 23.315 5.685 1.00 37.99 C ATOM 451 C PHE A 144 19.525 23.767 6.372 1.00 37.92 C ATOM 452 O PHE A 144 20.420 24.314 5.728 1.00 37.59 O ATOM 453 CB PHE A 144 18.539 22.141 4.745 1.00 37.87 C ATOM 454 CG PHE A 144 17.309 21.484 4.178 1.00 38.72 C ATOM 455 CD1 PHE A 144 16.666 20.468 4.877 1.00 36.89 C ATOM 456 CD2 PHE A 144 16.799 21.877 2.940 1.00 38.06 C ATOM 457 CE1 PHE A 144 15.529 19.853 4.358 1.00 39.59 C ATOM 458 CE2 PHE A 144 15.662 21.269 2.410 1.00 37.67 C ATOM 459 CZ PHE A 144 15.026 20.253 3.120 1.00 38.84 C ATOM 0 H PHE A 144 18.056 24.609 4.206 1.00 38.03 H new ATOM 0 HA PHE A 144 17.606 23.020 6.356 1.00 37.99 H new ATOM 0 HB2 PHE A 144 19.092 22.457 4.013 1.00 37.87 H new ATOM 0 HB3 PHE A 144 19.057 21.477 5.226 1.00 37.87 H new ATOM 0 HD1 PHE A 144 16.999 20.196 5.701 1.00 36.89 H new ATOM 0 HD2 PHE A 144 17.223 22.553 2.462 1.00 38.06 H new ATOM 0 HE1 PHE A 144 15.106 19.177 4.836 1.00 39.59 H new ATOM 0 HE2 PHE A 144 15.329 21.541 1.585 1.00 37.67 H new ATOM 0 HZ PHE A 144 14.268 19.843 2.770 1.00 38.84 H new ATOM 460 N GLY A 145 19.613 23.533 7.678 1.00 38.16 N ATOM 461 CA GLY A 145 20.749 24.014 8.457 1.00 38.21 C ATOM 462 C GLY A 145 21.013 23.243 9.731 1.00 38.49 C ATOM 463 O GLY A 145 20.293 22.295 10.060 1.00 38.58 O ATOM 0 H GLY A 145 19.026 23.098 8.132 1.00 38.16 H new ATOM 0 HA2 GLY A 145 21.544 23.980 7.902 1.00 38.21 H new ATOM 0 HA3 GLY A 145 20.600 24.946 8.682 1.00 38.21 H new ATOM 464 N ARG A 146 22.048 23.668 10.453 1.00 38.47 N ATOM 465 CA ARG A 146 22.495 22.974 11.659 1.00 39.47 C ATOM 466 C ARG A 146 22.347 23.828 12.917 1.00 40.93 C ATOM 467 O ARG A 146 22.351 23.310 14.032 1.00 41.56 O ATOM 468 CB ARG A 146 23.947 22.509 11.504 1.00 38.42 C ATOM 469 CG ARG A 146 24.141 21.429 10.453 1.00 38.76 C ATOM 470 CD ARG A 146 25.536 20.835 10.523 1.00 38.15 C ATOM 471 NE ARG A 146 25.758 19.831 9.484 1.00 37.54 N ATOM 472 CZ ARG A 146 25.440 18.541 9.592 1.00 38.75 C ATOM 473 NH1 ARG A 146 24.867 18.073 10.697 1.00 34.92 N ATOM 474 NH2 ARG A 146 25.690 17.715 8.583 1.00 36.90 N ATOM 0 H ARG A 146 22.510 24.366 10.258 1.00 38.47 H new ATOM 0 HA ARG A 146 21.919 22.201 11.768 1.00 39.47 H new ATOM 0 HB2 ARG A 146 24.499 23.273 11.275 1.00 38.42 H new ATOM 0 HB3 ARG A 146 24.263 22.176 12.359 1.00 38.42 H new ATOM 0 HG2 ARG A 146 23.482 20.729 10.581 1.00 38.76 H new ATOM 0 HG3 ARG A 146 23.990 21.803 9.571 1.00 38.76 H new ATOM 0 HD2 ARG A 146 26.193 21.543 10.433 1.00 38.15 H new ATOM 0 HD3 ARG A 146 25.671 20.432 11.395 1.00 38.15 H new ATOM 0 HE ARG A 146 26.120 20.092 8.749 1.00 37.54 H new ATOM 0 HH11 ARG A 146 24.698 18.604 11.352 1.00 34.92 H new ATOM 0 HH12 ARG A 146 24.666 17.239 10.757 1.00 34.92 H new ATOM 0 HH21 ARG A 146 26.056 18.013 7.864 1.00 36.90 H new ATOM 0 HH22 ARG A 146 25.486 16.882 8.649 1.00 36.90 H new ATOM 475 N LEU A 147 22.223 25.136 12.732 1.00 41.78 N ATOM 476 CA LEU A 147 22.111 26.051 13.859 1.00 43.40 C ATOM 477 C LEU A 147 20.735 26.683 13.935 1.00 44.28 C ATOM 478 O LEU A 147 20.095 26.940 12.914 1.00 45.74 O ATOM 479 CB LEU A 147 23.182 27.135 13.777 1.00 43.63 C ATOM 480 CG LEU A 147 24.616 26.641 13.970 1.00 46.24 C ATOM 481 CD1 LEU A 147 25.517 27.444 13.088 1.00 49.93 C ATOM 482 CD2 LEU A 147 25.064 26.711 15.428 1.00 43.91 C ATOM 0 H LEU A 147 22.202 25.515 11.960 1.00 41.78 H new ATOM 0 HA LEU A 147 22.245 25.532 14.668 1.00 43.40 H new ATOM 0 HB2 LEU A 147 23.118 27.570 12.912 1.00 43.63 H new ATOM 0 HB3 LEU A 147 22.993 27.809 14.448 1.00 43.63 H new ATOM 0 HG LEU A 147 24.659 25.704 13.723 1.00 46.24 H new ATOM 0 HD11 LEU A 147 26.432 27.142 13.199 1.00 49.93 H new ATOM 0 HD12 LEU A 147 25.250 27.330 12.163 1.00 49.93 H new ATOM 0 HD13 LEU A 147 25.455 28.381 13.329 1.00 49.93 H new ATOM 0 HD21 LEU A 147 25.976 26.389 15.502 1.00 43.91 H new ATOM 0 HD22 LEU A 147 25.020 27.630 15.737 1.00 43.91 H new ATOM 0 HD23 LEU A 147 24.481 26.159 15.973 1.00 43.91 H new ATOM 483 N LYS A 148 20.282 26.922 15.156 1.00 44.12 N ATOM 484 CA LYS A 148 19.026 27.615 15.378 1.00 44.17 C ATOM 485 C LYS A 148 19.252 29.118 15.256 1.00 44.28 C ATOM 486 O LYS A 148 20.331 29.620 15.565 1.00 44.65 O ATOM 487 CB LYS A 148 18.468 27.258 16.753 1.00 44.07 C ATOM 488 CG LYS A 148 18.277 25.764 16.956 1.00 42.45 C ATOM 489 CD LYS A 148 17.873 25.425 18.376 1.00 41.10 C ATOM 490 CE LYS A 148 19.077 25.160 19.252 1.00 41.53 C ATOM 491 NZ LYS A 148 18.752 24.167 20.312 1.00 45.57 N ATOM 0 H LYS A 148 20.692 26.688 15.875 1.00 44.12 H new ATOM 0 HA LYS A 148 18.378 27.341 14.710 1.00 44.17 H new ATOM 0 HB2 LYS A 148 19.068 27.597 17.436 1.00 44.07 H new ATOM 0 HB3 LYS A 148 17.616 27.706 16.876 1.00 44.07 H new ATOM 0 HG2 LYS A 148 17.599 25.440 16.343 1.00 42.45 H new ATOM 0 HG3 LYS A 148 19.101 25.302 16.737 1.00 42.45 H new ATOM 0 HD2 LYS A 148 17.356 26.156 18.749 1.00 41.10 H new ATOM 0 HD3 LYS A 148 17.298 24.644 18.371 1.00 41.10 H new ATOM 0 HE2 LYS A 148 19.811 24.831 18.709 1.00 41.53 H new ATOM 0 HE3 LYS A 148 19.374 25.989 19.659 1.00 41.53 H new ATOM 0 HZ1 LYS A 148 19.471 24.024 20.816 1.00 45.57 H new ATOM 0 HZ2 LYS A 148 18.092 24.480 20.820 1.00 45.57 H new ATOM 0 HZ3 LYS A 148 18.498 23.402 19.935 1.00 45.57 H new ATOM 492 N ILE A 149 18.245 29.821 14.756 1.00 44.53 N ATOM 493 CA ILE A 149 18.230 31.284 14.767 1.00 44.55 C ATOM 494 C ILE A 149 16.895 31.676 15.392 1.00 43.53 C ATOM 495 O ILE A 149 15.844 31.220 14.944 1.00 44.00 O ATOM 496 CB ILE A 149 18.382 31.909 13.335 1.00 44.90 C ATOM 497 CG1 ILE A 149 19.627 31.374 12.602 1.00 45.83 C ATOM 498 CG2 ILE A 149 18.401 33.442 13.394 1.00 45.34 C ATOM 499 CD1 ILE A 149 20.974 31.905 13.107 1.00 43.97 C ATOM 0 H ILE A 149 17.548 29.466 14.399 1.00 44.53 H new ATOM 0 HA ILE A 149 18.987 31.624 15.270 1.00 44.55 H new ATOM 0 HB ILE A 149 17.604 31.636 12.824 1.00 44.90 H new ATOM 0 HG12 ILE A 149 19.632 30.407 12.672 1.00 45.83 H new ATOM 0 HG13 ILE A 149 19.545 31.590 11.660 1.00 45.83 H new ATOM 0 HG21 ILE A 149 18.496 33.799 12.497 1.00 45.34 H new ATOM 0 HG22 ILE A 149 17.572 33.761 13.783 1.00 45.34 H new ATOM 0 HG23 ILE A 149 19.148 33.736 13.939 1.00 45.34 H new ATOM 0 HD11 ILE A 149 21.692 31.513 12.586 1.00 43.97 H new ATOM 0 HD12 ILE A 149 20.997 32.870 13.013 1.00 43.97 H new ATOM 0 HD13 ILE A 149 21.086 31.668 14.041 1.00 43.97 H new ATOM 500 N SER A 150 16.942 32.488 16.444 1.00 42.02 N ATOM 501 CA SER A 150 15.729 32.901 17.152 1.00 40.11 C ATOM 502 C SER A 150 14.968 33.943 16.340 1.00 39.01 C ATOM 503 O SER A 150 15.492 35.027 16.079 1.00 38.88 O ATOM 504 CB SER A 150 16.077 33.441 18.542 1.00 39.82 C ATOM 505 OG SER A 150 14.913 33.837 19.243 1.00 37.93 O ATOM 0 H SER A 150 17.670 32.814 16.767 1.00 42.02 H new ATOM 0 HA SER A 150 15.157 32.126 17.264 1.00 40.11 H new ATOM 0 HB2 SER A 150 16.547 32.760 19.048 1.00 39.82 H new ATOM 0 HB3 SER A 150 16.679 34.197 18.457 1.00 39.82 H new ATOM 0 HG SER A 150 15.128 34.128 20.001 1.00 37.93 H new ATOM 506 N ASP A 151 13.743 33.602 15.934 1.00 38.19 N ATOM 507 CA ASP A 151 12.903 34.492 15.120 1.00 37.67 C ATOM 508 C ASP A 151 11.439 34.037 15.103 1.00 37.45 C ATOM 509 O ASP A 151 11.145 32.922 14.674 1.00 37.61 O ATOM 510 CB ASP A 151 13.439 34.576 13.683 1.00 37.37 C ATOM 511 CG ASP A 151 12.948 35.810 12.941 1.00 38.08 C ATOM 512 OD1 ASP A 151 11.717 36.009 12.837 1.00 35.38 O ATOM 513 OD2 ASP A 151 13.801 36.579 12.452 1.00 37.97 O ATOM 0 H ASP A 151 13.374 32.848 16.122 1.00 38.19 H new ATOM 0 HA ASP A 151 12.939 35.371 15.528 1.00 37.67 H new ATOM 0 HB2 ASP A 151 14.409 34.581 13.704 1.00 37.37 H new ATOM 0 HB3 ASP A 151 13.170 33.782 13.195 1.00 37.37 H new ATOM 514 N PRO A 152 10.513 34.907 15.557 1.00 37.31 N ATOM 515 CA PRO A 152 9.083 34.573 15.602 1.00 37.30 C ATOM 516 C PRO A 152 8.416 34.362 14.232 1.00 37.15 C ATOM 517 O PRO A 152 7.314 33.812 14.168 1.00 37.35 O ATOM 518 CB PRO A 152 8.459 35.780 16.316 1.00 37.44 C ATOM 519 CG PRO A 152 9.421 36.890 16.110 1.00 38.09 C ATOM 520 CD PRO A 152 10.777 36.260 16.080 1.00 37.23 C ATOM 0 HA PRO A 152 8.953 33.720 16.046 1.00 37.30 H new ATOM 0 HB2 PRO A 152 7.589 35.996 15.945 1.00 37.44 H new ATOM 0 HB3 PRO A 152 8.328 35.600 17.260 1.00 37.44 H new ATOM 0 HG2 PRO A 152 9.238 37.359 15.281 1.00 38.09 H new ATOM 0 HG3 PRO A 152 9.357 37.542 16.825 1.00 38.09 H new ATOM 0 HD2 PRO A 152 11.387 36.752 15.508 1.00 37.23 H new ATOM 0 HD3 PRO A 152 11.177 36.230 16.963 1.00 37.23 H new ATOM 521 N ALA A 153 9.071 34.790 13.156 1.00 36.64 N ATOM 522 CA ALA A 153 8.514 34.641 11.810 1.00 36.45 C ATOM 523 C ALA A 153 8.880 33.300 11.168 1.00 36.81 C ATOM 524 O ALA A 153 8.375 32.962 10.095 1.00 37.05 O ATOM 525 CB ALA A 153 8.953 35.800 10.920 1.00 35.88 C ATOM 0 H ALA A 153 9.842 35.171 13.182 1.00 36.64 H new ATOM 0 HA ALA A 153 7.548 34.656 11.899 1.00 36.45 H new ATOM 0 HB1 ALA A 153 8.577 35.688 10.033 1.00 35.88 H new ATOM 0 HB2 ALA A 153 8.641 36.636 11.300 1.00 35.88 H new ATOM 0 HB3 ALA A 153 9.921 35.814 10.861 1.00 35.88 H new ATOM 526 N ILE A 154 9.751 32.541 11.830 1.00 36.70 N ATOM 527 CA ILE A 154 10.270 31.289 11.280 1.00 36.72 C ATOM 528 C ILE A 154 9.799 30.088 12.099 1.00 37.29 C ATOM 529 O ILE A 154 9.818 30.124 13.332 1.00 37.36 O ATOM 530 CB ILE A 154 11.834 31.298 11.227 1.00 36.64 C ATOM 531 CG1 ILE A 154 12.370 32.532 10.475 1.00 36.42 C ATOM 532 CG2 ILE A 154 12.387 29.987 10.651 1.00 34.92 C ATOM 533 CD1 ILE A 154 11.988 32.622 9.000 1.00 37.53 C ATOM 0 H ILE A 154 10.058 32.737 12.609 1.00 36.70 H new ATOM 0 HA ILE A 154 9.924 31.211 10.377 1.00 36.72 H new ATOM 0 HB ILE A 154 12.155 31.363 12.140 1.00 36.64 H new ATOM 0 HG12 ILE A 154 12.050 33.329 10.925 1.00 36.42 H new ATOM 0 HG13 ILE A 154 13.338 32.537 10.543 1.00 36.42 H new ATOM 0 HG21 ILE A 154 13.356 30.025 10.632 1.00 34.92 H new ATOM 0 HG22 ILE A 154 12.104 29.244 11.207 1.00 34.92 H new ATOM 0 HG23 ILE A 154 12.051 29.862 9.750 1.00 34.92 H new ATOM 0 HD11 ILE A 154 12.369 33.427 8.615 1.00 37.53 H new ATOM 0 HD12 ILE A 154 12.330 31.846 8.529 1.00 37.53 H new ATOM 0 HD13 ILE A 154 11.022 32.650 8.917 1.00 37.53 H new ATOM 534 N LYS A 155 9.367 29.034 11.407 1.00 37.72 N ATOM 535 CA LYS A 155 9.129 27.739 12.043 1.00 38.01 C ATOM 536 C LYS A 155 10.256 26.762 11.714 1.00 37.89 C ATOM 537 O LYS A 155 10.538 26.492 10.545 1.00 38.01 O ATOM 538 CB LYS A 155 7.776 27.144 11.641 1.00 37.91 C ATOM 539 CG LYS A 155 7.567 25.731 12.180 1.00 40.67 C ATOM 540 CD LYS A 155 6.131 25.269 12.084 1.00 47.41 C ATOM 541 CE LYS A 155 6.004 23.841 12.602 1.00 50.67 C ATOM 542 NZ LYS A 155 4.596 23.348 12.580 1.00 54.21 N ATOM 0 H LYS A 155 9.205 29.049 10.563 1.00 37.72 H new ATOM 0 HA LYS A 155 9.111 27.889 13.001 1.00 38.01 H new ATOM 0 HB2 LYS A 155 7.065 27.718 11.967 1.00 37.91 H new ATOM 0 HB3 LYS A 155 7.708 27.130 10.673 1.00 37.91 H new ATOM 0 HG2 LYS A 155 8.133 25.116 11.688 1.00 40.67 H new ATOM 0 HG3 LYS A 155 7.851 25.699 13.107 1.00 40.67 H new ATOM 0 HD2 LYS A 155 5.559 25.859 12.599 1.00 47.41 H new ATOM 0 HD3 LYS A 155 5.830 25.314 11.163 1.00 47.41 H new ATOM 0 HE2 LYS A 155 6.557 23.254 12.063 1.00 50.67 H new ATOM 0 HE3 LYS A 155 6.344 23.798 13.509 1.00 50.67 H new ATOM 0 HZ1 LYS A 155 4.592 22.466 12.458 1.00 54.21 H new ATOM 0 HZ2 LYS A 155 4.201 23.542 13.354 1.00 54.21 H new ATOM 0 HZ3 LYS A 155 4.154 23.741 11.915 1.00 54.21 H new ATOM 543 N ARG A 156 10.877 26.230 12.761 1.00 37.78 N ATOM 544 CA ARG A 156 11.989 25.300 12.637 1.00 38.04 C ATOM 545 C ARG A 156 11.585 23.909 13.129 1.00 37.43 C ATOM 546 O ARG A 156 10.963 23.773 14.186 1.00 37.28 O ATOM 547 CB ARG A 156 13.183 25.833 13.434 1.00 38.36 C ATOM 548 CG ARG A 156 14.404 24.935 13.463 1.00 39.34 C ATOM 549 CD ARG A 156 15.528 25.526 14.310 1.00 39.12 C ATOM 550 NE ARG A 156 15.113 25.805 15.684 1.00 43.89 N ATOM 551 CZ ARG A 156 14.888 27.025 16.167 1.00 45.00 C ATOM 552 NH1 ARG A 156 15.042 28.091 15.391 1.00 48.31 N ATOM 553 NH2 ARG A 156 14.506 27.181 17.425 1.00 42.17 N ATOM 0 H ARG A 156 10.660 26.403 13.575 1.00 37.78 H new ATOM 0 HA ARG A 156 12.239 25.221 11.703 1.00 38.04 H new ATOM 0 HB2 ARG A 156 13.441 26.691 13.064 1.00 38.36 H new ATOM 0 HB3 ARG A 156 12.897 25.992 14.347 1.00 38.36 H new ATOM 0 HG2 ARG A 156 14.157 24.066 13.816 1.00 39.34 H new ATOM 0 HG3 ARG A 156 14.722 24.794 12.558 1.00 39.34 H new ATOM 0 HD2 ARG A 156 16.277 24.910 14.321 1.00 39.12 H new ATOM 0 HD3 ARG A 156 15.841 26.346 13.898 1.00 39.12 H new ATOM 0 HE ARG A 156 15.007 25.137 16.215 1.00 43.89 H new ATOM 0 HH11 ARG A 156 15.288 27.995 14.573 1.00 48.31 H new ATOM 0 HH12 ARG A 156 14.896 28.877 15.707 1.00 48.31 H new ATOM 0 HH21 ARG A 156 14.403 26.494 17.931 1.00 42.17 H new ATOM 0 HH22 ARG A 156 14.361 27.970 17.736 1.00 42.17 H new ATOM 554 N THR A 157 11.936 22.886 12.352 1.00 36.68 N ATOM 555 CA THR A 157 11.650 21.495 12.707 1.00 36.14 C ATOM 556 C THR A 157 12.947 20.683 12.752 1.00 35.67 C ATOM 557 O THR A 157 13.720 20.683 11.791 1.00 35.77 O ATOM 558 CB THR A 157 10.660 20.838 11.701 1.00 36.18 C ATOM 559 OG1 THR A 157 9.476 21.637 11.591 1.00 37.08 O ATOM 560 CG2 THR A 157 10.270 19.430 12.145 1.00 35.18 C ATOM 0 H THR A 157 12.348 22.978 11.603 1.00 36.68 H new ATOM 0 HA THR A 157 11.235 21.497 13.584 1.00 36.14 H new ATOM 0 HB THR A 157 11.106 20.780 10.841 1.00 36.18 H new ATOM 0 HG1 THR A 157 8.946 21.279 11.046 1.00 37.08 H new ATOM 0 HG21 THR A 157 9.654 19.046 11.501 1.00 35.18 H new ATOM 0 HG22 THR A 157 11.065 18.877 12.201 1.00 35.18 H new ATOM 0 HG23 THR A 157 9.843 19.471 13.015 1.00 35.18 H new ATOM 561 N LEU A 158 13.180 20.001 13.872 1.00 35.04 N ATOM 562 CA LEU A 158 14.311 19.089 14.003 1.00 34.67 C ATOM 563 C LEU A 158 14.054 17.828 13.182 1.00 34.30 C ATOM 564 O LEU A 158 13.036 17.158 13.364 1.00 34.14 O ATOM 565 CB LEU A 158 14.563 18.734 15.477 1.00 34.83 C ATOM 566 CG LEU A 158 15.633 17.679 15.793 1.00 34.70 C ATOM 567 CD1 LEU A 158 17.033 18.170 15.431 1.00 34.56 C ATOM 568 CD2 LEU A 158 15.573 17.270 17.258 1.00 34.37 C ATOM 0 H LEU A 158 12.687 20.055 14.575 1.00 35.04 H new ATOM 0 HA LEU A 158 15.106 19.530 13.665 1.00 34.67 H new ATOM 0 HB2 LEU A 158 14.805 19.550 15.942 1.00 34.83 H new ATOM 0 HB3 LEU A 158 13.724 18.429 15.857 1.00 34.83 H new ATOM 0 HG LEU A 158 15.443 16.901 15.246 1.00 34.70 H new ATOM 0 HD11 LEU A 158 17.682 17.481 15.643 1.00 34.56 H new ATOM 0 HD12 LEU A 158 17.071 18.369 14.482 1.00 34.56 H new ATOM 0 HD13 LEU A 158 17.236 18.972 15.938 1.00 34.56 H new ATOM 0 HD21 LEU A 158 16.256 16.604 17.437 1.00 34.37 H new ATOM 0 HD22 LEU A 158 15.726 18.047 17.818 1.00 34.37 H new ATOM 0 HD23 LEU A 158 14.699 16.897 17.455 1.00 34.37 H new ATOM 569 N LEU A 159 14.979 17.519 12.277 1.00 33.73 N ATOM 570 CA LEU A 159 14.838 16.360 11.396 1.00 33.94 C ATOM 571 C LEU A 159 15.518 15.119 11.964 1.00 34.51 C ATOM 572 O LEU A 159 14.902 14.056 12.046 1.00 34.48 O ATOM 573 CB LEU A 159 15.354 16.678 9.986 1.00 33.50 C ATOM 574 CG LEU A 159 14.628 17.803 9.235 1.00 32.80 C ATOM 575 CD1 LEU A 159 15.253 18.036 7.867 1.00 31.26 C ATOM 576 CD2 LEU A 159 13.140 17.508 9.092 1.00 30.11 C ATOM 0 H LEU A 159 15.701 17.971 12.156 1.00 33.73 H new ATOM 0 HA LEU A 159 13.891 16.160 11.335 1.00 33.94 H new ATOM 0 HB2 LEU A 159 16.293 16.912 10.051 1.00 33.50 H new ATOM 0 HB3 LEU A 159 15.299 15.870 9.452 1.00 33.50 H new ATOM 0 HG LEU A 159 14.725 18.612 9.762 1.00 32.80 H new ATOM 0 HD11 LEU A 159 14.779 18.749 7.412 1.00 31.26 H new ATOM 0 HD12 LEU A 159 16.184 18.284 7.975 1.00 31.26 H new ATOM 0 HD13 LEU A 159 15.194 17.223 7.341 1.00 31.26 H new ATOM 0 HD21 LEU A 159 12.710 18.235 8.615 1.00 30.11 H new ATOM 0 HD22 LEU A 159 13.020 16.682 8.598 1.00 30.11 H new ATOM 0 HD23 LEU A 159 12.741 17.419 9.972 1.00 30.11 H new ATOM 577 N ARG A 160 16.785 15.266 12.353 1.00 35.17 N ATOM 578 CA ARG A 160 17.551 14.188 12.985 1.00 36.20 C ATOM 579 C ARG A 160 18.745 14.744 13.761 1.00 35.84 C ATOM 580 O ARG A 160 19.209 15.858 13.500 1.00 35.48 O ATOM 581 CB ARG A 160 18.030 13.156 11.947 1.00 36.36 C ATOM 582 CG ARG A 160 19.077 13.671 10.955 1.00 36.87 C ATOM 583 CD ARG A 160 19.467 12.600 9.938 1.00 37.51 C ATOM 584 NE ARG A 160 20.391 11.621 10.504 1.00 46.33 N ATOM 585 CZ ARG A 160 21.659 11.464 10.132 1.00 46.42 C ATOM 586 NH1 ARG A 160 22.182 12.203 9.161 1.00 47.45 N ATOM 587 NH2 ARG A 160 22.404 10.544 10.726 1.00 50.49 N ATOM 0 H ARG A 160 17.227 15.997 12.257 1.00 35.17 H new ATOM 0 HA ARG A 160 16.957 13.741 13.608 1.00 36.20 H new ATOM 0 HB2 ARG A 160 18.399 12.392 12.417 1.00 36.36 H new ATOM 0 HB3 ARG A 160 17.261 12.838 11.448 1.00 36.36 H new ATOM 0 HG2 ARG A 160 18.728 14.447 10.490 1.00 36.87 H new ATOM 0 HG3 ARG A 160 19.866 13.961 11.439 1.00 36.87 H new ATOM 0 HD2 ARG A 160 18.669 12.147 9.624 1.00 37.51 H new ATOM 0 HD3 ARG A 160 19.876 13.021 9.166 1.00 37.51 H new ATOM 0 HE ARG A 160 20.093 11.107 11.125 1.00 46.33 H new ATOM 0 HH11 ARG A 160 21.700 12.793 8.763 1.00 47.45 H new ATOM 0 HH12 ARG A 160 23.003 12.091 8.930 1.00 47.45 H new ATOM 0 HH21 ARG A 160 22.068 10.053 11.347 1.00 50.49 H new ATOM 0 HH22 ARG A 160 23.224 10.437 10.491 1.00 50.49 H new ATOM 588 N ASN A 161 19.226 13.959 14.719 1.00 35.88 N ATOM 589 CA ASN A 161 20.472 14.254 15.411 1.00 35.90 C ATOM 590 C ASN A 161 21.591 13.410 14.834 1.00 35.93 C ATOM 591 O ASN A 161 21.605 12.186 14.989 1.00 36.77 O ATOM 592 CB ASN A 161 20.342 14.001 16.916 1.00 35.95 C ATOM 593 CG ASN A 161 19.449 15.014 17.605 1.00 36.90 C ATOM 594 OD1 ASN A 161 19.471 16.200 17.283 1.00 39.55 O ATOM 595 ND2 ASN A 161 18.664 14.549 18.567 1.00 36.32 N ATOM 0 H ASN A 161 18.838 13.240 14.986 1.00 35.88 H new ATOM 0 HA ASN A 161 20.678 15.193 15.283 1.00 35.90 H new ATOM 0 HB2 ASN A 161 19.986 13.110 17.061 1.00 35.95 H new ATOM 0 HB3 ASN A 161 21.223 14.024 17.321 1.00 35.95 H new ATOM 0 HD21 ASN A 161 18.143 15.084 18.993 1.00 36.32 H new ATOM 0 HD22 ASN A 161 18.676 13.712 18.765 1.00 36.32 H new ATOM 596 N GLU A 162 22.517 14.073 14.154 1.00 35.44 N ATOM 597 CA GLU A 162 23.683 13.421 13.580 1.00 35.13 C ATOM 598 C GLU A 162 24.836 13.405 14.590 1.00 34.87 C ATOM 599 O GLU A 162 25.026 14.371 15.329 1.00 34.67 O ATOM 600 CB GLU A 162 24.090 14.161 12.307 1.00 34.73 C ATOM 601 CG GLU A 162 25.233 13.531 11.546 1.00 36.98 C ATOM 602 CD GLU A 162 25.405 14.114 10.158 1.00 38.49 C ATOM 603 OE1 GLU A 162 24.983 15.266 9.914 1.00 40.67 O ATOM 604 OE2 GLU A 162 25.969 13.407 9.307 1.00 37.81 O ATOM 0 H GLU A 162 22.485 14.921 14.012 1.00 35.44 H new ATOM 0 HA GLU A 162 23.467 12.501 13.360 1.00 35.13 H new ATOM 0 HB2 GLU A 162 23.320 14.217 11.720 1.00 34.73 H new ATOM 0 HB3 GLU A 162 24.336 15.070 12.541 1.00 34.73 H new ATOM 0 HG2 GLU A 162 26.055 13.651 12.047 1.00 36.98 H new ATOM 0 HG3 GLU A 162 25.081 12.576 11.475 1.00 36.98 H new ATOM 605 N ARG A 163 25.593 12.308 14.619 1.00 34.71 N ATOM 606 CA ARG A 163 26.763 12.187 15.497 1.00 34.70 C ATOM 607 C ARG A 163 27.920 13.070 15.034 1.00 34.38 C ATOM 608 O ARG A 163 28.143 13.239 13.832 1.00 33.62 O ATOM 609 CB ARG A 163 27.264 10.734 15.566 1.00 34.72 C ATOM 610 CG ARG A 163 26.307 9.713 16.190 1.00 37.20 C ATOM 611 CD ARG A 163 25.993 9.998 17.656 1.00 37.97 C ATOM 612 NE ARG A 163 27.185 10.130 18.497 1.00 37.79 N ATOM 613 CZ ARG A 163 27.161 10.524 19.769 1.00 37.88 C ATOM 614 NH1 ARG A 163 26.008 10.821 20.360 1.00 34.64 N ATOM 615 NH2 ARG A 163 28.291 10.621 20.457 1.00 36.35 N ATOM 0 H ARG A 163 25.445 11.614 14.133 1.00 34.71 H new ATOM 0 HA ARG A 163 26.470 12.478 16.375 1.00 34.70 H new ATOM 0 HB2 ARG A 163 27.475 10.442 14.665 1.00 34.72 H new ATOM 0 HB3 ARG A 163 28.093 10.722 16.070 1.00 34.72 H new ATOM 0 HG2 ARG A 163 25.479 9.704 15.684 1.00 37.20 H new ATOM 0 HG3 ARG A 163 26.695 8.827 16.115 1.00 37.20 H new ATOM 0 HD2 ARG A 163 25.473 10.815 17.715 1.00 37.97 H new ATOM 0 HD3 ARG A 163 25.438 9.283 18.005 1.00 37.97 H new ATOM 0 HE ARG A 163 27.948 9.941 18.148 1.00 37.79 H new ATOM 0 HH11 ARG A 163 25.271 10.759 19.921 1.00 34.64 H new ATOM 0 HH12 ARG A 163 25.999 11.075 21.182 1.00 34.64 H new ATOM 0 HH21 ARG A 163 29.041 10.429 20.082 1.00 36.35 H new ATOM 0 HH22 ARG A 163 28.274 10.876 21.278 1.00 36.35 H new ATOM 616 N LEU A 164 28.651 13.622 15.998 1.00 34.57 N ATOM 617 CA LEU A 164 29.934 14.259 15.727 1.00 34.87 C ATOM 618 C LEU A 164 31.033 13.216 15.810 1.00 35.21 C ATOM 619 O LEU A 164 30.922 12.243 16.574 1.00 35.13 O ATOM 620 CB LEU A 164 30.229 15.369 16.738 1.00 34.89 C ATOM 621 CG LEU A 164 29.591 16.749 16.574 1.00 35.98 C ATOM 622 CD1 LEU A 164 29.931 17.607 17.783 1.00 36.07 C ATOM 623 CD2 LEU A 164 30.046 17.427 15.289 1.00 34.33 C ATOM 0 H LEU A 164 28.417 13.637 16.825 1.00 34.57 H new ATOM 0 HA LEU A 164 29.898 14.651 14.841 1.00 34.87 H new ATOM 0 HB2 LEU A 164 29.974 15.036 17.613 1.00 34.89 H new ATOM 0 HB3 LEU A 164 31.190 15.497 16.752 1.00 34.89 H new ATOM 0 HG LEU A 164 28.629 16.639 16.515 1.00 35.98 H new ATOM 0 HD11 LEU A 164 29.528 18.483 17.682 1.00 36.07 H new ATOM 0 HD12 LEU A 164 29.589 17.185 18.586 1.00 36.07 H new ATOM 0 HD13 LEU A 164 30.894 17.701 17.853 1.00 36.07 H new ATOM 0 HD21 LEU A 164 29.624 18.298 15.215 1.00 34.33 H new ATOM 0 HD22 LEU A 164 31.010 17.535 15.304 1.00 34.33 H new ATOM 0 HD23 LEU A 164 29.794 16.881 14.528 1.00 34.33 H new ATOM 624 N AMET A 165 32.090 13.403 15.023 0.25 35.21 N ATOM 625 N BMET A 165 32.090 13.403 15.023 0.25 35.21 N ATOM 626 N CMET A 165 32.089 13.433 15.031 0.50 35.05 N ATOM 627 CA AMET A 165 33.248 12.509 15.060 0.25 35.26 C ATOM 628 CA BMET A 165 33.248 12.509 15.060 0.25 35.26 C ATOM 629 CA CMET A 165 33.252 12.555 15.009 0.50 34.94 C ATOM 630 C AMET A 165 34.567 13.261 14.892 0.25 34.98 C ATOM 631 C BMET A 165 34.567 13.261 14.892 0.25 34.98 C ATOM 632 C CMET A 165 34.534 13.369 15.110 0.50 34.68 C ATOM 633 O AMET A 165 34.614 14.324 14.268 0.25 34.94 O ATOM 634 O BMET A 165 34.614 14.324 14.268 0.25 34.94 O ATOM 635 O CMET A 165 34.527 14.579 14.874 0.50 34.24 O ATOM 636 CB AMET A 165 33.110 11.383 14.028 0.25 35.30 C ATOM 637 CB BMET A 165 33.110 11.383 14.028 0.25 35.30 C ATOM 638 CB CMET A 165 33.271 11.735 13.720 0.50 34.64 C ATOM 639 CG AMET A 165 32.177 10.262 14.486 0.25 34.87 C ATOM 640 CG BMET A 165 32.177 10.262 14.486 0.25 34.87 C ATOM 641 CG CMET A 165 32.011 10.926 13.483 0.50 33.97 C ATOM 642 SD AMET A 165 31.911 8.937 13.305 0.25 35.88 S ATOM 643 SD BMET A 165 31.911 8.937 13.305 0.25 35.88 S ATOM 644 SD CMET A 165 32.246 9.740 12.169 0.50 35.92 S ATOM 645 CE AMET A 165 33.447 8.026 13.436 0.25 34.23 C ATOM 646 CE BMET A 165 33.447 8.026 13.436 0.25 34.23 C ATOM 647 CE CMET A 165 33.068 8.408 13.050 0.50 35.01 C ATOM 0 H AMET A 165 32.157 14.046 14.456 0.25 35.05 H new ATOM 0 H BMET A 165 32.157 14.046 14.456 0.25 35.05 H new ATOM 0 H CMET A 165 32.150 14.102 14.495 0.50 35.05 H new ATOM 0 HA AMET A 165 33.267 12.106 15.942 0.25 34.94 H new ATOM 0 HA BMET A 165 33.267 12.106 15.942 0.25 34.94 H new ATOM 0 HA CMET A 165 33.195 11.956 15.770 0.50 34.94 H new ATOM 0 HB2AMET A 165 32.778 11.753 13.195 0.25 34.64 H new ATOM 0 HB2BMET A 165 32.778 11.753 13.195 0.25 34.64 H new ATOM 0 HB2CMET A 165 33.405 12.334 12.969 0.50 34.64 H new ATOM 0 HB3AMET A 165 33.987 11.012 13.843 0.25 34.64 H new ATOM 0 HB3BMET A 165 33.987 11.012 13.843 0.25 34.64 H new ATOM 0 HB3CMET A 165 34.031 11.133 13.742 0.50 34.64 H new ATOM 0 HG2AMET A 165 32.536 9.879 15.302 0.25 33.97 H new ATOM 0 HG2BMET A 165 32.536 9.879 15.302 0.25 33.97 H new ATOM 0 HG2CMET A 165 31.761 10.464 14.299 0.50 33.97 H new ATOM 0 HG3AMET A 165 31.317 10.651 14.710 0.25 33.97 H new ATOM 0 HG3BMET A 165 31.317 10.651 14.710 0.25 33.97 H new ATOM 0 HG3CMET A 165 31.279 11.521 13.258 0.50 33.97 H new ATOM 0 HE1AMET A 165 33.688 7.671 12.566 0.25 35.01 H new ATOM 0 HE1BMET A 165 33.688 7.671 12.566 0.25 35.01 H new ATOM 0 HE1CMET A 165 33.200 7.657 12.451 0.50 35.01 H new ATOM 0 HE2AMET A 165 34.149 8.618 13.749 0.25 35.01 H new ATOM 0 HE2BMET A 165 34.149 8.618 13.749 0.25 35.01 H new ATOM 0 HE2CMET A 165 33.928 8.717 13.375 0.50 35.01 H new ATOM 0 HE3AMET A 165 33.337 7.295 14.064 0.25 35.01 H new ATOM 0 HE3BMET A 165 33.337 7.295 14.064 0.25 35.01 H new ATOM 0 HE3CMET A 165 32.520 8.130 13.801 0.50 35.01 H new ATOM 648 N VAL A 166 35.629 12.700 15.466 1.00 34.65 N ATOM 649 CA VAL A 166 36.954 13.321 15.456 1.00 34.16 C ATOM 650 C VAL A 166 37.747 12.799 14.264 1.00 33.27 C ATOM 651 O VAL A 166 37.937 11.591 14.118 1.00 33.19 O ATOM 652 CB VAL A 166 37.747 13.038 16.764 1.00 34.44 C ATOM 653 CG1 VAL A 166 38.905 14.019 16.917 1.00 33.06 C ATOM 654 CG2 VAL A 166 36.841 13.120 17.974 1.00 36.23 C ATOM 0 H AVAL A 166 35.602 11.944 15.875 0.25 34.65 H new ATOM 0 H BVAL A 166 35.602 11.944 15.875 0.25 34.65 H new ATOM 0 H CVAL A 166 35.626 11.878 15.719 0.50 34.65 H new ATOM 0 HA VAL A 166 36.828 14.280 15.390 1.00 34.16 H new ATOM 0 HB VAL A 166 38.104 12.138 16.704 1.00 34.44 H new ATOM 0 HG11 VAL A 166 39.386 13.827 17.737 1.00 33.06 H new ATOM 0 HG12 VAL A 166 39.506 13.930 16.161 1.00 33.06 H new ATOM 0 HG13 VAL A 166 38.560 14.925 16.950 1.00 33.06 H new ATOM 0 HG21 VAL A 166 37.355 12.940 18.776 1.00 36.23 H new ATOM 0 HG22 VAL A 166 36.455 14.008 18.030 1.00 36.23 H new ATOM 0 HG23 VAL A 166 36.131 12.464 17.892 1.00 36.23 H new ATOM 655 N ALA A 167 38.188 13.714 13.407 1.00 31.91 N ATOM 656 CA ALA A 167 39.079 13.376 12.308 1.00 31.09 C ATOM 657 C ALA A 167 40.516 13.503 12.795 1.00 30.91 C ATOM 658 O ALA A 167 40.917 14.556 13.302 1.00 30.71 O ATOM 659 CB ALA A 167 38.832 14.291 11.119 1.00 30.73 C ATOM 0 H ALA A 167 37.978 14.547 13.448 1.00 31.91 H new ATOM 0 HA ALA A 167 38.912 12.466 12.017 1.00 31.09 H new ATOM 0 HB1 ALA A 167 39.433 14.052 10.396 1.00 30.73 H new ATOM 0 HB2 ALA A 167 37.914 14.194 10.821 1.00 30.73 H new ATOM 0 HB3 ALA A 167 38.991 15.212 11.380 1.00 30.73 H new ATOM 660 N VAL A 168 41.275 12.417 12.663 1.00 30.52 N ATOM 661 CA VAL A 168 42.676 12.377 13.092 1.00 30.55 C ATOM 662 C VAL A 168 43.561 11.732 12.019 1.00 30.95 C ATOM 663 O VAL A 168 43.064 11.021 11.138 1.00 30.64 O ATOM 664 CB VAL A 168 42.860 11.614 14.445 1.00 30.10 C ATOM 665 CG1 VAL A 168 41.985 12.219 15.546 1.00 29.71 C ATOM 666 CG2 VAL A 168 42.569 10.124 14.290 1.00 29.79 C ATOM 0 H VAL A 168 40.993 11.680 12.321 1.00 30.52 H new ATOM 0 HA VAL A 168 42.949 13.298 13.225 1.00 30.55 H new ATOM 0 HB VAL A 168 43.789 11.713 14.706 1.00 30.10 H new ATOM 0 HG11 VAL A 168 42.118 11.728 16.372 1.00 29.71 H new ATOM 0 HG12 VAL A 168 42.229 13.148 15.680 1.00 29.71 H new ATOM 0 HG13 VAL A 168 41.052 12.165 15.285 1.00 29.71 H new ATOM 0 HG21 VAL A 168 42.691 9.680 15.144 1.00 29.79 H new ATOM 0 HG22 VAL A 168 41.654 10.002 13.991 1.00 29.79 H new ATOM 0 HG23 VAL A 168 43.176 9.742 13.637 1.00 29.79 H new ATOM 667 N HIS A 169 44.866 11.993 12.089 1.00 31.35 N ATOM 668 CA HIS A 169 45.829 11.226 11.310 1.00 32.14 C ATOM 669 C HIS A 169 45.899 9.818 11.900 1.00 32.92 C ATOM 670 O HIS A 169 45.759 9.648 13.111 1.00 33.05 O ATOM 671 CB HIS A 169 47.210 11.882 11.335 1.00 32.30 C ATOM 672 CG HIS A 169 48.176 11.288 10.356 1.00 31.63 C ATOM 673 ND1 HIS A 169 49.003 10.232 10.675 1.00 33.29 N ATOM 674 CD2 HIS A 169 48.437 11.593 9.063 1.00 30.83 C ATOM 675 CE1 HIS A 169 49.737 9.915 9.622 1.00 32.77 C ATOM 676 NE2 HIS A 169 49.412 10.727 8.630 1.00 32.86 N ATOM 0 H HIS A 169 45.211 12.609 12.581 1.00 31.35 H new ATOM 0 HA HIS A 169 45.544 11.192 10.383 1.00 32.14 H new ATOM 0 HB2 HIS A 169 47.113 12.829 11.148 1.00 32.30 H new ATOM 0 HB3 HIS A 169 47.579 11.806 12.229 1.00 32.30 H new ATOM 0 HD2 HIS A 169 48.032 12.263 8.562 1.00 30.83 H new ATOM 0 HE1 HIS A 169 50.373 9.237 9.585 1.00 32.77 H new ATOM 0 HE2 HIS A 169 49.755 10.715 7.842 1.00 32.86 H new ATOM 677 N ALA A 170 46.106 8.818 11.047 1.00 33.69 N ATOM 678 CA ALA A 170 46.134 7.414 11.479 1.00 34.68 C ATOM 679 C ALA A 170 47.190 7.107 12.554 1.00 35.62 C ATOM 680 O ALA A 170 47.012 6.186 13.354 1.00 35.73 O ATOM 681 CB ALA A 170 46.307 6.489 10.276 1.00 34.32 C ATOM 0 H ALA A 170 46.234 8.929 10.204 1.00 33.69 H new ATOM 0 HA ALA A 170 45.276 7.249 11.900 1.00 34.68 H new ATOM 0 HB1 ALA A 170 46.324 5.567 10.576 1.00 34.32 H new ATOM 0 HB2 ALA A 170 45.567 6.615 9.662 1.00 34.32 H new ATOM 0 HB3 ALA A 170 47.140 6.697 9.825 1.00 34.32 H new ATOM 682 N SER A 171 48.271 7.886 12.571 1.00 36.52 N ATOM 683 CA SER A 171 49.357 7.716 13.543 1.00 37.72 C ATOM 684 C SER A 171 49.086 8.377 14.901 1.00 38.39 C ATOM 685 O SER A 171 49.847 8.171 15.851 1.00 39.01 O ATOM 686 CB SER A 171 50.669 8.261 12.972 1.00 37.86 C ATOM 687 OG SER A 171 50.622 9.678 12.875 1.00 40.51 O ATOM 0 H SER A 171 48.398 8.532 12.017 1.00 36.52 H new ATOM 0 HA SER A 171 49.420 6.761 13.702 1.00 37.72 H new ATOM 0 HB2 SER A 171 51.410 7.995 13.539 1.00 37.86 H new ATOM 0 HB3 SER A 171 50.831 7.877 12.096 1.00 37.86 H new ATOM 0 HG SER A 171 49.994 9.903 12.364 1.00 40.51 H new ATOM 688 N HIS A 172 48.019 9.170 14.990 1.00 38.50 N ATOM 689 CA HIS A 172 47.675 9.870 16.230 1.00 39.05 C ATOM 690 C HIS A 172 47.291 8.887 17.340 1.00 39.16 C ATOM 691 O HIS A 172 46.567 7.924 17.082 1.00 38.91 O ATOM 692 CB HIS A 172 46.532 10.862 15.995 1.00 39.09 C ATOM 693 CG HIS A 172 46.461 11.954 17.017 1.00 40.94 C ATOM 694 ND1 HIS A 172 45.981 11.752 18.293 1.00 41.93 N ATOM 695 CD2 HIS A 172 46.813 13.260 16.950 1.00 41.44 C ATOM 696 CE1 HIS A 172 46.046 12.885 18.971 1.00 41.85 C ATOM 697 NE2 HIS A 172 46.542 13.817 18.177 1.00 41.39 N ATOM 0 H HIS A 172 47.477 9.317 14.339 1.00 38.50 H new ATOM 0 HA HIS A 172 48.463 10.358 16.515 1.00 39.05 H new ATOM 0 HB2 HIS A 172 46.635 11.259 15.116 1.00 39.09 H new ATOM 0 HB3 HIS A 172 45.691 10.379 15.991 1.00 39.09 H new ATOM 0 HD2 HIS A 172 47.171 13.698 16.212 1.00 41.44 H new ATOM 0 HE1 HIS A 172 45.787 13.005 19.856 1.00 41.85 H new ATOM 0 HE2 HIS A 172 46.674 14.639 18.393 1.00 41.39 H new ATOM 698 N PRO A 173 47.787 9.118 18.576 1.00 39.59 N ATOM 699 CA PRO A 173 47.409 8.299 19.736 1.00 39.91 C ATOM 700 C PRO A 173 45.895 8.092 19.895 1.00 39.56 C ATOM 701 O PRO A 173 45.472 7.025 20.345 1.00 39.75 O ATOM 702 CB PRO A 173 47.966 9.095 20.918 1.00 40.23 C ATOM 703 CG PRO A 173 49.144 9.799 20.357 1.00 41.16 C ATOM 704 CD PRO A 173 48.773 10.155 18.944 1.00 39.50 C ATOM 0 HA PRO A 173 47.757 7.397 19.653 1.00 39.91 H new ATOM 0 HB2 PRO A 173 47.311 9.721 21.265 1.00 40.23 H new ATOM 0 HB3 PRO A 173 48.217 8.512 21.651 1.00 40.23 H new ATOM 0 HG2 PRO A 173 49.353 10.594 20.873 1.00 41.16 H new ATOM 0 HG3 PRO A 173 49.931 9.232 20.378 1.00 41.16 H new ATOM 0 HD2 PRO A 173 48.393 11.046 18.888 1.00 39.50 H new ATOM 0 HD3 PRO A 173 49.545 10.139 18.357 1.00 39.50 H new ATOM 705 N LEU A 174 45.097 9.091 19.516 1.00 38.98 N ATOM 706 CA LEU A 174 43.633 8.988 19.585 1.00 38.84 C ATOM 707 C LEU A 174 43.070 7.895 18.676 1.00 38.38 C ATOM 708 O LEU A 174 42.014 7.330 18.965 1.00 37.96 O ATOM 709 CB LEU A 174 42.963 10.329 19.255 1.00 38.84 C ATOM 710 CG LEU A 174 43.043 11.478 20.267 1.00 39.57 C ATOM 711 CD1 LEU A 174 42.622 12.780 19.605 1.00 37.81 C ATOM 712 CD2 LEU A 174 42.207 11.216 21.518 1.00 38.86 C ATOM 0 H LEU A 174 45.384 9.843 19.213 1.00 38.98 H new ATOM 0 HA LEU A 174 43.428 8.743 20.501 1.00 38.84 H new ATOM 0 HB2 LEU A 174 43.344 10.648 18.422 1.00 38.84 H new ATOM 0 HB3 LEU A 174 42.024 10.152 19.088 1.00 38.84 H new ATOM 0 HG LEU A 174 43.966 11.546 20.558 1.00 39.57 H new ATOM 0 HD11 LEU A 174 42.675 13.503 20.250 1.00 37.81 H new ATOM 0 HD12 LEU A 174 43.212 12.969 18.859 1.00 37.81 H new ATOM 0 HD13 LEU A 174 41.710 12.700 19.284 1.00 37.81 H new ATOM 0 HD21 LEU A 174 42.289 11.968 22.126 1.00 38.86 H new ATOM 0 HD22 LEU A 174 41.277 11.103 21.268 1.00 38.86 H new ATOM 0 HD23 LEU A 174 42.523 10.410 21.956 1.00 38.86 H new ATOM 713 N ASN A 175 43.778 7.597 17.588 1.00 38.36 N ATOM 714 CA ASN A 175 43.340 6.570 16.643 1.00 38.66 C ATOM 715 C ASN A 175 43.450 5.137 17.175 1.00 39.39 C ATOM 716 O ASN A 175 42.874 4.210 16.600 1.00 39.44 O ATOM 717 CB ASN A 175 44.067 6.699 15.304 1.00 38.22 C ATOM 718 CG ASN A 175 43.349 5.966 14.185 1.00 38.34 C ATOM 719 OD1 ASN A 175 42.120 6.016 14.085 1.00 37.85 O ATOM 720 ND2 ASN A 175 44.109 5.276 13.341 1.00 32.14 N ATOM 0 H ASN A 175 44.519 7.980 17.378 1.00 38.36 H new ATOM 0 HA ASN A 175 42.393 6.736 16.512 1.00 38.66 H new ATOM 0 HB2 ASN A 175 44.149 7.637 15.072 1.00 38.22 H new ATOM 0 HB3 ASN A 175 44.967 6.348 15.392 1.00 38.22 H new ATOM 0 HD21 ASN A 175 43.747 4.841 12.693 1.00 32.14 H new ATOM 0 HD22 ASN A 175 44.963 5.264 13.442 1.00 32.14 H new ATOM 721 N GLN A 176 44.183 4.956 18.271 1.00 40.33 N ATOM 722 CA GLN A 176 44.222 3.664 18.957 1.00 41.89 C ATOM 723 C GLN A 176 42.876 3.362 19.621 1.00 42.48 C ATOM 724 O GLN A 176 42.597 2.219 19.990 1.00 42.43 O ATOM 725 CB GLN A 176 45.355 3.623 19.987 1.00 42.23 C ATOM 726 CG GLN A 176 46.758 3.663 19.379 1.00 45.81 C ATOM 727 CD GLN A 176 47.014 2.522 18.402 1.00 50.02 C ATOM 728 OE1 GLN A 176 46.975 1.347 18.774 1.00 50.86 O ATOM 729 NE2 GLN A 176 47.282 2.867 17.145 1.00 50.87 N ATOM 0 H GLN A 176 44.666 5.568 18.635 1.00 40.33 H new ATOM 0 HA GLN A 176 44.395 2.978 18.293 1.00 41.89 H new ATOM 0 HB2 GLN A 176 45.255 4.374 20.593 1.00 42.23 H new ATOM 0 HB3 GLN A 176 45.267 2.816 20.518 1.00 42.23 H new ATOM 0 HG2 GLN A 176 46.883 4.509 18.921 1.00 45.81 H new ATOM 0 HG3 GLN A 176 47.415 3.626 20.091 1.00 45.81 H new ATOM 0 HE21 GLN A 176 47.301 3.697 16.922 1.00 50.87 H new ATOM 0 HE22 GLN A 176 47.436 2.260 16.556 1.00 50.87 H new ATOM 730 N MET A 177 42.049 4.398 19.748 1.00 43.01 N ATOM 731 CA MET A 177 40.720 4.292 20.344 1.00 44.04 C ATOM 732 C MET A 177 39.624 4.288 19.279 1.00 44.10 C ATOM 733 O MET A 177 38.460 4.543 19.587 1.00 44.30 O ATOM 734 CB MET A 177 40.481 5.451 21.320 1.00 44.87 C ATOM 735 CG MET A 177 41.585 5.663 22.342 1.00 46.82 C ATOM 736 SD MET A 177 41.694 4.278 23.472 1.00 55.47 S ATOM 737 CE MET A 177 43.282 4.594 24.244 1.00 53.47 C ATOM 0 H MET A 177 42.248 5.193 19.487 1.00 43.01 H new ATOM 0 HA MET A 177 40.682 3.449 20.823 1.00 44.04 H new ATOM 0 HB2 MET A 177 40.369 6.268 20.810 1.00 44.87 H new ATOM 0 HB3 MET A 177 39.648 5.294 21.791 1.00 44.87 H new ATOM 0 HG2 MET A 177 42.433 5.780 21.886 1.00 46.82 H new ATOM 0 HG3 MET A 177 41.416 6.478 22.840 1.00 46.82 H new ATOM 0 HE1 MET A 177 43.469 3.900 24.895 1.00 53.47 H new ATOM 0 HE2 MET A 177 43.976 4.597 23.567 1.00 53.47 H new ATOM 0 HE3 MET A 177 43.260 5.456 24.688 1.00 53.47 H new ATOM 738 N LYS A 178 40.002 3.993 18.036 1.00 44.28 N ATOM 739 CA LYS A 178 39.084 4.043 16.892 1.00 44.98 C ATOM 740 C LYS A 178 37.809 3.219 17.091 1.00 45.16 C ATOM 741 O LYS A 178 36.716 3.670 16.747 1.00 45.31 O ATOM 742 CB LYS A 178 39.801 3.606 15.611 1.00 44.88 C ATOM 743 CG LYS A 178 39.015 3.866 14.336 1.00 45.42 C ATOM 744 CD LYS A 178 39.822 3.488 13.103 1.00 45.78 C ATOM 745 CE LYS A 178 38.995 3.622 11.828 1.00 47.99 C ATOM 746 NZ LYS A 178 38.458 4.997 11.639 1.00 48.34 N ATOM 0 H LYS A 178 40.803 3.757 17.829 1.00 44.28 H new ATOM 0 HA LYS A 178 38.803 4.968 16.813 1.00 44.98 H new ATOM 0 HB2 LYS A 178 40.651 4.069 15.555 1.00 44.88 H new ATOM 0 HB3 LYS A 178 39.998 2.658 15.670 1.00 44.88 H new ATOM 0 HG2 LYS A 178 38.189 3.357 14.353 1.00 45.42 H new ATOM 0 HG3 LYS A 178 38.770 4.803 14.290 1.00 45.42 H new ATOM 0 HD2 LYS A 178 40.606 4.056 13.042 1.00 45.78 H new ATOM 0 HD3 LYS A 178 40.139 2.575 13.190 1.00 45.78 H new ATOM 0 HE2 LYS A 178 39.543 3.384 11.064 1.00 47.99 H new ATOM 0 HE3 LYS A 178 38.259 2.991 11.856 1.00 47.99 H new ATOM 0 HZ1 LYS A 178 38.123 5.075 10.818 1.00 48.34 H new ATOM 0 HZ2 LYS A 178 37.817 5.150 12.237 1.00 48.34 H new ATOM 0 HZ3 LYS A 178 39.113 5.589 11.749 1.00 48.34 H new ATOM 747 N ASP A 179 37.959 2.017 17.640 1.00 45.30 N ATOM 748 CA ASP A 179 36.826 1.126 17.878 1.00 45.81 C ATOM 749 C ASP A 179 36.104 1.474 19.180 1.00 45.64 C ATOM 750 O ASP A 179 34.882 1.343 19.271 1.00 45.76 O ATOM 751 CB ASP A 179 37.286 -0.337 17.899 1.00 46.11 C ATOM 752 CG ASP A 179 38.086 -0.721 16.659 1.00 48.54 C ATOM 753 OD1 ASP A 179 37.777 -0.222 15.554 1.00 49.13 O ATOM 754 OD2 ASP A 179 39.030 -1.529 16.792 1.00 51.02 O ATOM 0 H ASP A 179 38.718 1.695 17.885 1.00 45.30 H new ATOM 0 HA ASP A 179 36.199 1.247 17.148 1.00 45.81 H new ATOM 0 HB2 ASP A 179 37.828 -0.490 18.689 1.00 46.11 H new ATOM 0 HB3 ASP A 179 36.510 -0.915 17.970 1.00 46.11 H new ATOM 755 N LYS A 180 36.869 1.924 20.174 1.00 45.18 N ATOM 756 CA LYS A 180 36.336 2.267 21.492 1.00 44.73 C ATOM 757 C LYS A 180 35.608 3.615 21.487 1.00 43.47 C ATOM 758 O LYS A 180 34.531 3.744 22.068 1.00 43.77 O ATOM 759 CB LYS A 180 37.466 2.271 22.532 1.00 45.43 C ATOM 760 CG LYS A 180 37.026 2.004 23.976 1.00 48.88 C ATOM 761 CD LYS A 180 36.664 3.290 24.723 1.00 51.88 C ATOM 762 CE LYS A 180 36.104 3.004 26.114 1.00 51.10 C ATOM 763 NZ LYS A 180 37.111 2.396 27.034 1.00 54.48 N ATOM 0 H LYS A 180 37.718 2.040 20.102 1.00 45.18 H new ATOM 0 HA LYS A 180 35.683 1.590 21.729 1.00 44.73 H new ATOM 0 HB2 LYS A 180 38.121 1.601 22.280 1.00 45.43 H new ATOM 0 HB3 LYS A 180 37.913 3.131 22.499 1.00 45.43 H new ATOM 0 HG2 LYS A 180 36.261 1.408 23.973 1.00 48.88 H new ATOM 0 HG3 LYS A 180 37.739 1.548 24.450 1.00 48.88 H new ATOM 0 HD2 LYS A 180 37.452 3.850 24.801 1.00 51.88 H new ATOM 0 HD3 LYS A 180 36.011 3.789 24.208 1.00 51.88 H new ATOM 0 HE2 LYS A 180 35.777 3.831 26.502 1.00 51.10 H new ATOM 0 HE3 LYS A 180 35.344 2.407 26.035 1.00 51.10 H new ATOM 0 HZ1 LYS A 180 36.737 2.249 27.828 1.00 54.48 H new ATOM 0 HZ2 LYS A 180 37.397 1.625 26.694 1.00 54.48 H new ATOM 0 HZ3 LYS A 180 37.800 2.951 27.129 1.00 54.48 H new ATOM 764 N GLY A 181 36.199 4.608 20.826 1.00 41.65 N ATOM 765 CA GLY A 181 35.705 5.981 20.876 1.00 39.93 C ATOM 766 C GLY A 181 36.440 6.796 21.927 1.00 38.52 C ATOM 767 O GLY A 181 37.155 6.242 22.767 1.00 38.49 O ATOM 0 H GLY A 181 36.898 4.504 20.336 1.00 41.65 H new ATOM 0 HA2 GLY A 181 35.814 6.398 20.007 1.00 39.93 H new ATOM 0 HA3 GLY A 181 34.755 5.978 21.072 1.00 39.93 H new ATOM 768 N VAL A 182 36.269 8.115 21.873 1.00 37.09 N ATOM 769 CA VAL A 182 36.898 9.038 22.825 1.00 35.78 C ATOM 770 C VAL A 182 35.883 10.055 23.364 1.00 35.46 C ATOM 771 O VAL A 182 34.764 10.157 22.857 1.00 34.99 O ATOM 772 CB VAL A 182 38.113 9.795 22.202 1.00 35.73 C ATOM 773 CG1 VAL A 182 39.221 8.825 21.808 1.00 33.39 C ATOM 774 CG2 VAL A 182 37.684 10.654 21.001 1.00 33.68 C ATOM 0 H VAL A 182 35.782 8.505 21.281 1.00 37.09 H new ATOM 0 HA VAL A 182 37.226 8.493 23.557 1.00 35.78 H new ATOM 0 HB VAL A 182 38.464 10.392 22.882 1.00 35.73 H new ATOM 0 HG11 VAL A 182 39.962 9.319 21.424 1.00 33.39 H new ATOM 0 HG12 VAL A 182 39.525 8.344 22.594 1.00 33.39 H new ATOM 0 HG13 VAL A 182 38.881 8.194 21.155 1.00 33.39 H new ATOM 0 HG21 VAL A 182 38.458 11.111 20.637 1.00 33.68 H new ATOM 0 HG22 VAL A 182 37.294 10.085 20.319 1.00 33.68 H new ATOM 0 HG23 VAL A 182 37.029 11.309 21.289 1.00 33.68 H new ATOM 775 N HIS A 183 36.281 10.792 24.397 1.00 34.87 N ATOM 776 CA HIS A 183 35.461 11.869 24.943 1.00 34.80 C ATOM 777 C HIS A 183 35.977 13.227 24.478 1.00 34.55 C ATOM 778 O HIS A 183 37.146 13.364 24.110 1.00 34.40 O ATOM 779 CB HIS A 183 35.446 11.814 26.472 1.00 34.31 C ATOM 780 CG HIS A 183 34.586 10.726 27.031 1.00 34.58 C ATOM 781 ND1 HIS A 183 34.967 9.402 27.033 1.00 34.61 N ATOM 782 CD2 HIS A 183 33.366 10.768 27.619 1.00 34.90 C ATOM 783 CE1 HIS A 183 34.015 8.673 27.589 1.00 34.79 C ATOM 784 NE2 HIS A 183 33.034 9.478 27.956 1.00 34.58 N ATOM 0 H HIS A 183 37.033 10.682 24.800 1.00 34.87 H new ATOM 0 HA HIS A 183 34.555 11.750 24.617 1.00 34.80 H new ATOM 0 HB2 HIS A 183 36.354 11.693 26.791 1.00 34.31 H new ATOM 0 HB3 HIS A 183 35.136 12.667 26.814 1.00 34.31 H new ATOM 0 HD2 HIS A 183 32.850 11.528 27.767 1.00 34.90 H new ATOM 0 HE1 HIS A 183 34.033 7.750 27.703 1.00 34.79 H new ATOM 0 HE2 HIS A 183 32.306 9.234 28.343 1.00 34.58 H new ATOM 785 N LEU A 184 35.098 14.227 24.502 1.00 34.44 N ATOM 786 CA LEU A 184 35.477 15.604 24.183 1.00 34.45 C ATOM 787 C LEU A 184 36.612 16.096 25.081 1.00 34.63 C ATOM 788 O LEU A 184 37.478 16.848 24.638 1.00 34.75 O ATOM 789 CB LEU A 184 34.272 16.537 24.304 1.00 33.98 C ATOM 790 CG LEU A 184 33.140 16.391 23.286 1.00 33.91 C ATOM 791 CD1 LEU A 184 31.900 17.090 23.815 1.00 30.48 C ATOM 792 CD2 LEU A 184 33.539 16.935 21.907 1.00 30.87 C ATOM 0 H LEU A 184 34.268 14.128 24.703 1.00 34.44 H new ATOM 0 HA LEU A 184 35.793 15.613 23.266 1.00 34.45 H new ATOM 0 HB2 LEU A 184 33.892 16.417 25.189 1.00 33.98 H new ATOM 0 HB3 LEU A 184 34.598 17.449 24.256 1.00 33.98 H new ATOM 0 HG LEU A 184 32.950 15.447 23.166 1.00 33.91 H new ATOM 0 HD11 LEU A 184 31.179 17.000 23.173 1.00 30.48 H new ATOM 0 HD12 LEU A 184 31.635 16.687 24.656 1.00 30.48 H new ATOM 0 HD13 LEU A 184 32.093 18.030 23.954 1.00 30.48 H new ATOM 0 HD21 LEU A 184 32.799 16.826 21.289 1.00 30.87 H new ATOM 0 HD22 LEU A 184 33.761 17.876 21.982 1.00 30.87 H new ATOM 0 HD23 LEU A 184 34.310 16.447 21.577 1.00 30.87 H new ATOM 793 N ASN A 185 36.598 15.652 26.338 1.00 34.84 N ATOM 794 CA ASN A 185 37.642 15.964 27.313 1.00 35.11 C ATOM 795 C ASN A 185 39.051 15.550 26.874 1.00 35.12 C ATOM 796 O ASN A 185 40.030 16.206 27.226 1.00 35.07 O ATOM 797 CB ASN A 185 37.310 15.312 28.657 1.00 35.38 C ATOM 798 CG ASN A 185 38.170 15.838 29.791 1.00 38.24 C ATOM 799 OD1 ASN A 185 38.225 17.045 30.038 1.00 41.46 O ATOM 800 ND2 ASN A 185 38.844 14.932 30.490 1.00 38.18 N ATOM 0 H ASN A 185 35.972 15.153 26.652 1.00 34.84 H new ATOM 0 HA ASN A 185 37.654 16.931 27.393 1.00 35.11 H new ATOM 0 HB2 ASN A 185 36.376 15.468 28.866 1.00 35.38 H new ATOM 0 HB3 ASN A 185 37.428 14.352 28.585 1.00 35.38 H new ATOM 0 HD21 ASN A 185 39.344 15.179 31.145 1.00 38.18 H new ATOM 0 HD22 ASN A 185 38.780 14.099 30.288 1.00 38.18 H new ATOM 801 N ASP A 186 39.141 14.464 26.106 1.00 35.25 N ATOM 802 CA ASP A 186 40.420 13.967 25.588 1.00 35.56 C ATOM 803 C ASP A 186 41.033 14.879 24.520 1.00 35.51 C ATOM 804 O ASP A 186 42.209 14.743 24.180 1.00 35.42 O ATOM 805 CB ASP A 186 40.250 12.553 25.019 1.00 35.65 C ATOM 806 CG ASP A 186 39.818 11.543 26.069 1.00 36.15 C ATOM 807 OD1 ASP A 186 40.331 11.597 27.208 1.00 35.86 O ATOM 808 OD2 ASP A 186 38.966 10.688 25.748 1.00 37.55 O ATOM 0 H ASP A 186 38.462 13.993 25.869 1.00 35.25 H new ATOM 0 HA ASP A 186 41.033 13.954 26.340 1.00 35.56 H new ATOM 0 HB2 ASP A 186 39.593 12.573 24.306 1.00 35.65 H new ATOM 0 HB3 ASP A 186 41.088 12.265 24.625 1.00 35.65 H new ATOM 809 N LEU A 187 40.235 15.811 24.007 1.00 35.65 N ATOM 810 CA LEU A 187 40.642 16.652 22.880 1.00 36.00 C ATOM 811 C LEU A 187 41.116 18.041 23.309 1.00 36.67 C ATOM 812 O LEU A 187 41.636 18.801 22.493 1.00 37.16 O ATOM 813 CB LEU A 187 39.481 16.789 21.881 1.00 35.32 C ATOM 814 CG LEU A 187 38.704 15.537 21.450 1.00 34.53 C ATOM 815 CD1 LEU A 187 37.570 15.915 20.506 1.00 32.41 C ATOM 816 CD2 LEU A 187 39.614 14.489 20.806 1.00 31.29 C ATOM 0 H LEU A 187 39.443 15.975 24.300 1.00 35.65 H new ATOM 0 HA LEU A 187 41.397 16.210 22.461 1.00 36.00 H new ATOM 0 HB2 LEU A 187 38.842 17.411 22.262 1.00 35.32 H new ATOM 0 HB3 LEU A 187 39.835 17.202 21.078 1.00 35.32 H new ATOM 0 HG LEU A 187 38.329 15.138 22.251 1.00 34.53 H new ATOM 0 HD11 LEU A 187 37.088 15.115 20.242 1.00 32.41 H new ATOM 0 HD12 LEU A 187 36.963 16.524 20.956 1.00 32.41 H new ATOM 0 HD13 LEU A 187 37.935 16.347 19.718 1.00 32.41 H new ATOM 0 HD21 LEU A 187 39.087 13.717 20.549 1.00 31.29 H new ATOM 0 HD22 LEU A 187 40.038 14.867 20.020 1.00 31.29 H new ATOM 0 HD23 LEU A 187 40.295 14.218 21.441 1.00 31.29 H new ATOM 817 N ILE A 188 40.945 18.357 24.591 1.00 37.33 N ATOM 818 CA ILE A 188 41.117 19.724 25.101 1.00 38.14 C ATOM 819 C ILE A 188 42.477 20.373 24.783 1.00 38.22 C ATOM 820 O ILE A 188 42.539 21.569 24.493 1.00 38.50 O ATOM 821 CB ILE A 188 40.763 19.820 26.626 1.00 38.57 C ATOM 822 CG1 ILE A 188 40.566 21.277 27.067 1.00 42.47 C ATOM 823 CG2 ILE A 188 41.794 19.097 27.503 1.00 38.01 C ATOM 824 CD1 ILE A 188 39.311 21.936 26.507 1.00 45.45 C ATOM 0 H ILE A 188 40.725 17.785 25.194 1.00 37.33 H new ATOM 0 HA ILE A 188 40.476 20.256 24.604 1.00 38.14 H new ATOM 0 HB ILE A 188 39.917 19.362 26.751 1.00 38.57 H new ATOM 0 HG12 ILE A 188 40.531 21.309 28.036 1.00 42.47 H new ATOM 0 HG13 ILE A 188 41.340 21.794 26.794 1.00 42.47 H new ATOM 0 HG21 ILE A 188 41.540 19.179 28.436 1.00 38.01 H new ATOM 0 HG22 ILE A 188 41.826 18.159 27.259 1.00 38.01 H new ATOM 0 HG23 ILE A 188 42.668 19.495 27.370 1.00 38.01 H new ATOM 0 HD11 ILE A 188 39.255 22.850 26.827 1.00 45.45 H new ATOM 0 HD12 ILE A 188 39.350 21.935 25.538 1.00 45.45 H new ATOM 0 HD13 ILE A 188 38.528 21.443 26.799 1.00 45.45 H new ATOM 825 N ASP A 189 43.547 19.583 24.813 1.00 38.04 N ATOM 826 CA ASP A 189 44.897 20.102 24.596 1.00 38.27 C ATOM 827 C ASP A 189 45.439 19.832 23.186 1.00 37.99 C ATOM 828 O ASP A 189 46.624 20.040 22.917 1.00 37.56 O ATOM 829 CB ASP A 189 45.856 19.555 25.664 1.00 38.70 C ATOM 830 CG ASP A 189 45.493 20.014 27.072 1.00 41.38 C ATOM 831 OD1 ASP A 189 45.055 21.175 27.240 1.00 42.90 O ATOM 832 OD2 ASP A 189 45.654 19.212 28.016 1.00 45.30 O ATOM 0 H ASP A 189 43.513 18.736 24.959 1.00 38.04 H new ATOM 0 HA ASP A 189 44.838 21.067 24.678 1.00 38.27 H new ATOM 0 HB2 ASP A 189 45.850 18.586 25.632 1.00 38.70 H new ATOM 0 HB3 ASP A 189 46.760 19.840 25.458 1.00 38.70 H new ATOM 833 N GLU A 190 44.564 19.378 22.291 1.00 37.83 N ATOM 834 CA GLU A 190 44.944 19.108 20.905 1.00 37.71 C ATOM 835 C GLU A 190 44.792 20.354 20.039 1.00 37.48 C ATOM 836 O GLU A 190 44.005 21.250 20.356 1.00 37.14 O ATOM 837 CB GLU A 190 44.097 17.972 20.320 1.00 37.68 C ATOM 838 CG GLU A 190 44.280 16.612 20.994 1.00 40.56 C ATOM 839 CD GLU A 190 45.637 15.978 20.719 1.00 44.48 C ATOM 840 OE1 GLU A 190 46.193 16.178 19.616 1.00 45.52 O ATOM 841 OE2 GLU A 190 46.143 15.266 21.609 1.00 46.40 O ATOM 0 H GLU A 190 43.738 19.218 22.468 1.00 37.83 H new ATOM 0 HA GLU A 190 45.877 18.841 20.907 1.00 37.71 H new ATOM 0 HB2 GLU A 190 43.162 18.222 20.377 1.00 37.68 H new ATOM 0 HB3 GLU A 190 44.309 17.881 19.378 1.00 37.68 H new ATOM 0 HG2 GLU A 190 44.167 16.715 21.952 1.00 40.56 H new ATOM 0 HG3 GLU A 190 43.582 16.011 20.689 1.00 40.56 H new ATOM 842 N LYS A 191 45.555 20.403 18.949 1.00 37.48 N ATOM 843 CA LYS A 191 45.395 21.438 17.935 1.00 37.74 C ATOM 844 C LYS A 191 44.142 21.116 17.126 1.00 37.03 C ATOM 845 O LYS A 191 44.112 20.141 16.371 1.00 37.17 O ATOM 846 CB LYS A 191 46.629 21.513 17.031 1.00 37.54 C ATOM 847 CG LYS A 191 47.908 21.925 17.756 1.00 40.21 C ATOM 848 CD LYS A 191 49.113 21.945 16.819 1.00 39.47 C ATOM 849 CE LYS A 191 50.387 22.294 17.573 1.00 45.44 C ATOM 850 NZ LYS A 191 51.566 22.415 16.664 1.00 50.77 N ATOM 0 H LYS A 191 46.179 19.837 18.778 1.00 37.48 H new ATOM 0 HA LYS A 191 45.301 22.306 18.358 1.00 37.74 H new ATOM 0 HB2 LYS A 191 46.768 20.647 16.617 1.00 37.54 H new ATOM 0 HB3 LYS A 191 46.456 22.145 16.316 1.00 37.54 H new ATOM 0 HG2 LYS A 191 47.788 22.805 18.147 1.00 40.21 H new ATOM 0 HG3 LYS A 191 48.077 21.310 18.487 1.00 40.21 H new ATOM 0 HD2 LYS A 191 49.212 21.078 16.395 1.00 39.47 H new ATOM 0 HD3 LYS A 191 48.965 22.591 16.111 1.00 39.47 H new ATOM 0 HE2 LYS A 191 50.261 23.130 18.049 1.00 45.44 H new ATOM 0 HE3 LYS A 191 50.563 21.612 18.240 1.00 45.44 H new ATOM 0 HZ1 LYS A 191 52.289 22.619 17.141 1.00 50.77 H new ATOM 0 HZ2 LYS A 191 51.697 21.642 16.243 1.00 50.77 H new ATOM 0 HZ3 LYS A 191 51.415 23.056 16.065 1.00 50.77 H new ATOM 851 N ILE A 192 43.103 21.926 17.310 1.00 36.14 N ATOM 852 CA ILE A 192 41.803 21.669 16.693 1.00 35.34 C ATOM 853 C ILE A 192 41.556 22.608 15.516 1.00 35.35 C ATOM 854 O ILE A 192 41.730 23.825 15.629 1.00 35.33 O ATOM 855 CB ILE A 192 40.648 21.753 17.728 1.00 35.22 C ATOM 856 CG1 ILE A 192 40.813 20.660 18.795 1.00 34.34 C ATOM 857 CG2 ILE A 192 39.278 21.630 17.036 1.00 34.75 C ATOM 858 CD1 ILE A 192 39.949 20.848 20.033 1.00 35.39 C ATOM 0 H ILE A 192 43.130 22.637 17.793 1.00 36.14 H new ATOM 0 HA ILE A 192 41.820 20.761 16.352 1.00 35.34 H new ATOM 0 HB ILE A 192 40.688 22.620 18.160 1.00 35.22 H new ATOM 0 HG12 ILE A 192 40.603 19.801 18.396 1.00 34.34 H new ATOM 0 HG13 ILE A 192 41.744 20.627 19.066 1.00 34.34 H new ATOM 0 HG21 ILE A 192 38.574 21.685 17.700 1.00 34.75 H new ATOM 0 HG22 ILE A 192 39.174 22.350 16.394 1.00 34.75 H new ATOM 0 HG23 ILE A 192 39.223 20.777 16.577 1.00 34.75 H new ATOM 0 HD11 ILE A 192 40.111 20.121 20.654 1.00 35.39 H new ATOM 0 HD12 ILE A 192 40.171 21.691 20.458 1.00 35.39 H new ATOM 0 HD13 ILE A 192 39.013 20.852 19.777 1.00 35.39 H new ATOM 859 N LEU A 193 41.162 22.025 14.386 1.00 34.96 N ATOM 860 CA LEU A 193 40.847 22.789 13.187 1.00 35.04 C ATOM 861 C LEU A 193 39.343 22.986 13.045 1.00 34.69 C ATOM 862 O LEU A 193 38.587 22.024 12.869 1.00 34.83 O ATOM 863 CB LEU A 193 41.446 22.129 11.934 1.00 34.88 C ATOM 864 CG LEU A 193 42.970 21.927 11.956 1.00 37.52 C ATOM 865 CD1 LEU A 193 43.420 20.995 10.844 1.00 36.95 C ATOM 866 CD2 LEU A 193 43.721 23.253 11.884 1.00 40.20 C ATOM 0 H LEU A 193 41.070 21.175 14.295 1.00 34.96 H new ATOM 0 HA LEU A 193 41.252 23.666 13.277 1.00 35.04 H new ATOM 0 HB2 LEU A 193 41.023 21.265 11.809 1.00 34.88 H new ATOM 0 HB3 LEU A 193 41.218 22.671 11.162 1.00 34.88 H new ATOM 0 HG LEU A 193 43.187 21.513 12.806 1.00 37.52 H new ATOM 0 HD11 LEU A 193 44.383 20.886 10.882 1.00 36.95 H new ATOM 0 HD12 LEU A 193 42.993 20.131 10.953 1.00 36.95 H new ATOM 0 HD13 LEU A 193 43.172 21.372 9.985 1.00 36.95 H new ATOM 0 HD21 LEU A 193 44.676 23.085 11.900 1.00 40.20 H new ATOM 0 HD22 LEU A 193 43.488 23.713 11.062 1.00 40.20 H new ATOM 0 HD23 LEU A 193 43.477 23.805 12.644 1.00 40.20 H new ATOM 867 N LEU A 194 38.925 24.245 13.145 1.00 34.24 N ATOM 868 CA LEU A 194 37.531 24.630 12.968 1.00 34.18 C ATOM 869 C LEU A 194 37.315 25.112 11.541 1.00 33.92 C ATOM 870 O LEU A 194 38.254 25.554 10.881 1.00 33.78 O ATOM 871 CB LEU A 194 37.134 25.735 13.961 1.00 34.11 C ATOM 872 CG LEU A 194 37.347 25.530 15.467 1.00 35.09 C ATOM 873 CD1 LEU A 194 37.042 26.820 16.224 1.00 32.89 C ATOM 874 CD2 LEU A 194 36.517 24.375 16.021 1.00 32.93 C ATOM 0 H LEU A 194 39.449 24.905 13.319 1.00 34.24 H new ATOM 0 HA LEU A 194 36.972 23.856 13.139 1.00 34.18 H new ATOM 0 HB2 LEU A 194 37.618 26.537 13.708 1.00 34.11 H new ATOM 0 HB3 LEU A 194 36.191 25.918 13.826 1.00 34.11 H new ATOM 0 HG LEU A 194 38.279 25.295 15.596 1.00 35.09 H new ATOM 0 HD11 LEU A 194 37.180 26.678 17.174 1.00 32.89 H new ATOM 0 HD12 LEU A 194 37.632 27.525 15.914 1.00 32.89 H new ATOM 0 HD13 LEU A 194 36.120 27.078 16.066 1.00 32.89 H new ATOM 0 HD21 LEU A 194 36.684 24.284 16.972 1.00 32.93 H new ATOM 0 HD22 LEU A 194 35.575 24.553 15.874 1.00 32.93 H new ATOM 0 HD23 LEU A 194 36.764 23.553 15.569 1.00 32.93 H new ATOM 875 N TYR A 195 36.071 25.018 11.080 1.00 33.70 N ATOM 876 CA TYR A 195 35.678 25.406 9.730 1.00 33.78 C ATOM 877 C TYR A 195 34.155 25.578 9.727 1.00 33.99 C ATOM 878 O TYR A 195 33.483 25.048 10.609 1.00 33.83 O ATOM 879 CB TYR A 195 36.082 24.317 8.722 1.00 33.33 C ATOM 880 CG TYR A 195 35.297 23.032 8.872 1.00 33.46 C ATOM 881 CD1 TYR A 195 34.081 22.850 8.202 1.00 32.88 C ATOM 882 CD2 TYR A 195 35.760 22.003 9.694 1.00 31.90 C ATOM 883 CE1 TYR A 195 33.350 21.679 8.346 1.00 33.45 C ATOM 884 CE2 TYR A 195 35.036 20.823 9.843 1.00 34.42 C ATOM 885 CZ TYR A 195 33.834 20.669 9.165 1.00 34.29 C ATOM 886 OH TYR A 195 33.114 19.510 9.306 1.00 35.68 O ATOM 0 H TYR A 195 35.418 24.720 11.554 1.00 33.70 H new ATOM 0 HA TYR A 195 36.120 26.231 9.473 1.00 33.78 H new ATOM 0 HB2 TYR A 195 35.960 24.658 7.822 1.00 33.33 H new ATOM 0 HB3 TYR A 195 37.027 24.124 8.827 1.00 33.33 H new ATOM 0 HD1 TYR A 195 33.758 23.526 7.651 1.00 32.88 H new ATOM 0 HD2 TYR A 195 36.564 22.107 10.149 1.00 31.90 H new ATOM 0 HE1 TYR A 195 32.542 21.572 7.897 1.00 33.45 H new ATOM 0 HE2 TYR A 195 35.355 20.144 10.392 1.00 34.42 H new ATOM 0 HH TYR A 195 32.735 19.505 10.056 1.00 35.68 H new ATOM 887 N PRO A 196 33.603 26.323 8.749 1.00 34.27 N ATOM 888 CA PRO A 196 34.280 27.129 7.738 1.00 35.04 C ATOM 889 C PRO A 196 34.554 28.544 8.255 1.00 36.23 C ATOM 890 O PRO A 196 34.299 28.826 9.425 1.00 36.78 O ATOM 891 CB PRO A 196 33.261 27.166 6.596 1.00 34.53 C ATOM 892 CG PRO A 196 31.934 27.125 7.286 1.00 32.87 C ATOM 893 CD PRO A 196 32.134 26.368 8.585 1.00 34.47 C ATOM 0 HA PRO A 196 35.143 26.769 7.480 1.00 35.04 H new ATOM 0 HB2 PRO A 196 33.357 27.969 6.061 1.00 34.53 H new ATOM 0 HB3 PRO A 196 33.372 26.411 5.997 1.00 34.53 H new ATOM 0 HG2 PRO A 196 31.609 28.022 7.458 1.00 32.87 H new ATOM 0 HG3 PRO A 196 31.272 26.685 6.731 1.00 32.87 H new ATOM 0 HD2 PRO A 196 31.707 26.820 9.329 1.00 34.47 H new ATOM 0 HD3 PRO A 196 31.754 25.477 8.539 1.00 34.47 H new ATOM 894 N SER A 197 35.059 29.418 7.390 1.00 37.17 N ATOM 895 CA SER A 197 35.333 30.803 7.770 1.00 38.50 C ATOM 896 C SER A 197 34.298 31.775 7.195 1.00 39.26 C ATOM 897 O SER A 197 34.562 32.974 7.060 1.00 40.92 O ATOM 898 CB SER A 197 36.749 31.203 7.346 1.00 38.42 C ATOM 899 OG SER A 197 36.880 31.156 5.940 1.00 40.92 O ATOM 0 H SER A 197 35.251 29.229 6.573 1.00 37.17 H new ATOM 0 HA SER A 197 35.268 30.858 8.736 1.00 38.50 H new ATOM 0 HB2 SER A 197 36.947 32.098 7.664 1.00 38.42 H new ATOM 0 HB3 SER A 197 37.395 30.607 7.756 1.00 38.42 H new ATOM 0 HG SER A 197 37.660 31.379 5.723 1.00 40.92 H new ATOM 900 N SER A 198 33.120 31.251 6.872 1.00 38.73 N ATOM 901 CA SER A 198 32.029 32.035 6.296 1.00 38.85 C ATOM 902 C SER A 198 31.249 32.800 7.381 1.00 38.87 C ATOM 903 O SER A 198 31.549 32.648 8.570 1.00 38.98 O ATOM 904 CB SER A 198 31.100 31.104 5.514 1.00 38.84 C ATOM 905 OG SER A 198 30.614 30.072 6.344 1.00 37.95 O ATOM 0 H SER A 198 32.928 30.420 6.982 1.00 38.73 H new ATOM 0 HA SER A 198 32.405 32.697 5.695 1.00 38.85 H new ATOM 0 HB2 SER A 198 30.357 31.611 5.152 1.00 38.84 H new ATOM 0 HB3 SER A 198 31.577 30.722 4.761 1.00 38.84 H new ATOM 0 HG SER A 198 30.470 29.385 5.882 1.00 37.95 H new ATOM 906 N PRO A 199 30.251 33.626 6.982 1.00 38.42 N ATOM 907 CA PRO A 199 29.468 34.381 7.969 1.00 38.35 C ATOM 908 C PRO A 199 28.944 33.532 9.126 1.00 38.06 C ATOM 909 O PRO A 199 28.502 32.400 8.922 1.00 38.29 O ATOM 910 CB PRO A 199 28.308 34.938 7.141 1.00 38.38 C ATOM 911 CG PRO A 199 28.892 35.109 5.783 1.00 38.47 C ATOM 912 CD PRO A 199 29.809 33.928 5.605 1.00 38.36 C ATOM 0 HA PRO A 199 30.011 35.056 8.405 1.00 38.35 H new ATOM 0 HB2 PRO A 199 27.553 34.328 7.130 1.00 38.38 H new ATOM 0 HB3 PRO A 199 27.987 35.780 7.499 1.00 38.38 H new ATOM 0 HG2 PRO A 199 28.201 35.124 5.102 1.00 38.47 H new ATOM 0 HG3 PRO A 199 29.378 35.945 5.712 1.00 38.47 H new ATOM 0 HD2 PRO A 199 29.348 33.175 5.204 1.00 38.36 H new ATOM 0 HD3 PRO A 199 30.559 34.141 5.028 1.00 38.36 H new ATOM 913 N LYS A 200 29.024 34.087 10.332 1.00 37.48 N ATOM 914 CA LYS A 200 28.594 33.407 11.546 1.00 36.78 C ATOM 915 C LYS A 200 27.101 33.644 11.775 1.00 35.56 C ATOM 916 O LYS A 200 26.566 34.652 11.316 1.00 35.74 O ATOM 917 CB LYS A 200 29.417 33.896 12.747 1.00 37.30 C ATOM 918 CG LYS A 200 30.928 33.653 12.634 1.00 40.02 C ATOM 919 CD LYS A 200 31.270 32.164 12.629 1.00 44.74 C ATOM 920 CE LYS A 200 32.780 31.924 12.668 1.00 50.15 C ATOM 921 NZ LYS A 200 33.442 32.152 11.348 1.00 51.77 N ATOM 0 H LYS A 200 29.333 34.878 10.468 1.00 37.48 H new ATOM 0 HA LYS A 200 28.741 32.453 11.446 1.00 36.78 H new ATOM 0 HB2 LYS A 200 29.263 34.847 12.863 1.00 37.30 H new ATOM 0 HB3 LYS A 200 29.090 33.456 13.547 1.00 37.30 H new ATOM 0 HG2 LYS A 200 31.261 34.063 11.820 1.00 40.02 H new ATOM 0 HG3 LYS A 200 31.381 34.085 13.375 1.00 40.02 H new ATOM 0 HD2 LYS A 200 30.855 31.735 13.394 1.00 44.74 H new ATOM 0 HD3 LYS A 200 30.898 31.750 11.835 1.00 44.74 H new ATOM 0 HE2 LYS A 200 33.179 32.511 13.330 1.00 50.15 H new ATOM 0 HE3 LYS A 200 32.950 31.014 12.957 1.00 50.15 H new ATOM 0 HZ1 LYS A 200 34.032 31.504 11.196 1.00 51.77 H new ATOM 0 HZ2 LYS A 200 32.828 32.151 10.704 1.00 51.77 H new ATOM 0 HZ3 LYS A 200 33.860 32.938 11.357 1.00 51.77 H new ATOM 922 N PRO A 201 26.417 32.709 12.466 1.00 34.50 N ATOM 923 CA PRO A 201 26.957 31.451 12.983 1.00 33.68 C ATOM 924 C PRO A 201 27.098 30.388 11.897 1.00 33.54 C ATOM 925 O PRO A 201 26.312 30.358 10.943 1.00 32.98 O ATOM 926 CB PRO A 201 25.915 31.022 14.016 1.00 33.53 C ATOM 927 CG PRO A 201 24.636 31.585 13.505 1.00 32.64 C ATOM 928 CD PRO A 201 24.985 32.867 12.796 1.00 34.18 C ATOM 0 HA PRO A 201 27.850 31.560 13.346 1.00 33.68 H new ATOM 0 HB2 PRO A 201 25.870 30.056 14.094 1.00 33.53 H new ATOM 0 HB3 PRO A 201 26.127 31.368 14.897 1.00 33.53 H new ATOM 0 HG2 PRO A 201 24.203 30.963 12.900 1.00 32.64 H new ATOM 0 HG3 PRO A 201 24.017 31.751 14.233 1.00 32.64 H new ATOM 0 HD2 PRO A 201 24.447 32.990 11.998 1.00 34.18 H new ATOM 0 HD3 PRO A 201 24.833 33.640 13.362 1.00 34.18 H new ATOM 929 N ASN A 202 28.112 29.541 12.048 1.00 33.10 N ATOM 930 CA ASN A 202 28.344 28.423 11.143 1.00 32.96 C ATOM 931 C ASN A 202 28.774 27.191 11.944 1.00 32.81 C ATOM 932 O ASN A 202 28.692 27.191 13.177 1.00 32.57 O ATOM 933 CB ASN A 202 29.369 28.793 10.060 1.00 32.70 C ATOM 934 CG ASN A 202 30.709 29.232 10.635 1.00 32.98 C ATOM 935 OD1 ASN A 202 31.112 28.802 11.713 1.00 33.57 O ATOM 936 ND2 ASN A 202 31.409 30.091 9.905 1.00 35.18 N ATOM 0 H ASN A 202 28.688 29.601 12.684 1.00 33.10 H new ATOM 0 HA ASN A 202 27.517 28.210 10.683 1.00 32.96 H new ATOM 0 HB2 ASN A 202 29.507 28.029 9.478 1.00 32.70 H new ATOM 0 HB3 ASN A 202 29.009 29.507 9.511 1.00 32.70 H new ATOM 0 HD21 ASN A 202 32.175 30.367 10.182 1.00 35.18 H new ATOM 0 HD22 ASN A 202 31.097 30.372 9.155 1.00 35.18 H new ATOM 937 N PHE A 203 29.230 26.150 11.255 1.00 32.32 N ATOM 938 CA PHE A 203 29.583 24.905 11.923 1.00 32.39 C ATOM 939 C PHE A 203 30.655 25.068 13.014 1.00 32.47 C ATOM 940 O PHE A 203 30.610 24.368 14.025 1.00 32.17 O ATOM 941 CB PHE A 203 29.978 23.820 10.913 1.00 32.39 C ATOM 942 CG PHE A 203 30.188 22.469 11.537 1.00 31.90 C ATOM 943 CD1 PHE A 203 29.121 21.780 12.111 1.00 30.66 C ATOM 944 CD2 PHE A 203 31.452 21.895 11.572 1.00 29.48 C ATOM 945 CE1 PHE A 203 29.313 20.534 12.705 1.00 30.41 C ATOM 946 CE2 PHE A 203 31.653 20.645 12.159 1.00 30.75 C ATOM 947 CZ PHE A 203 30.581 19.968 12.729 1.00 30.23 C ATOM 0 H PHE A 203 29.342 26.145 10.402 1.00 32.32 H new ATOM 0 HA PHE A 203 28.779 24.619 12.384 1.00 32.39 H new ATOM 0 HB2 PHE A 203 29.287 23.752 10.236 1.00 32.39 H new ATOM 0 HB3 PHE A 203 30.793 24.090 10.461 1.00 32.39 H new ATOM 0 HD1 PHE A 203 28.271 22.156 12.097 1.00 30.66 H new ATOM 0 HD2 PHE A 203 32.173 22.349 11.200 1.00 29.48 H new ATOM 0 HE1 PHE A 203 28.594 20.083 13.084 1.00 30.41 H new ATOM 0 HE2 PHE A 203 32.502 20.266 12.169 1.00 30.75 H new ATOM 0 HZ PHE A 203 30.713 19.137 13.126 1.00 30.23 H new ATOM 948 N SER A 204 31.594 25.998 12.823 1.00 32.51 N ATOM 949 CA SER A 204 32.615 26.264 13.847 1.00 33.32 C ATOM 950 C SER A 204 31.997 26.812 15.138 1.00 33.27 C ATOM 951 O SER A 204 32.462 26.495 16.240 1.00 33.05 O ATOM 952 CB SER A 204 33.704 27.206 13.328 1.00 33.39 C ATOM 953 OG SER A 204 33.229 28.534 13.216 1.00 39.25 O ATOM 0 H SER A 204 31.659 26.483 12.116 1.00 32.51 H new ATOM 0 HA SER A 204 33.030 25.412 14.055 1.00 33.32 H new ATOM 0 HB2 SER A 204 34.466 27.183 13.927 1.00 33.39 H new ATOM 0 HB3 SER A 204 34.015 26.898 12.462 1.00 33.39 H new ATOM 0 HG SER A 204 32.506 28.538 12.789 1.00 39.25 H new ATOM 954 N THR A 205 30.954 27.631 14.991 1.00 33.03 N ATOM 955 CA THR A 205 30.167 28.106 16.129 1.00 32.97 C ATOM 956 C THR A 205 29.564 26.915 16.874 1.00 33.50 C ATOM 957 O THR A 205 29.620 26.858 18.106 1.00 33.61 O ATOM 958 CB THR A 205 29.027 29.054 15.694 1.00 32.54 C ATOM 959 OG1 THR A 205 29.506 29.966 14.696 1.00 32.52 O ATOM 960 CG2 THR A 205 28.485 29.839 16.890 1.00 31.48 C ATOM 0 H THR A 205 30.684 27.926 14.230 1.00 33.03 H new ATOM 0 HA THR A 205 30.768 28.602 16.707 1.00 32.97 H new ATOM 0 HB THR A 205 28.308 28.517 15.326 1.00 32.54 H new ATOM 0 HG1 THR A 205 29.298 30.751 14.910 1.00 32.52 H new ATOM 0 HG21 THR A 205 27.772 30.427 16.595 1.00 31.48 H new ATOM 0 HG22 THR A 205 28.141 29.221 17.554 1.00 31.48 H new ATOM 0 HG23 THR A 205 29.198 30.368 17.280 1.00 31.48 H new ATOM 961 N HIS A 206 29.001 25.965 16.124 1.00 33.58 N ATOM 962 CA HIS A 206 28.393 24.781 16.728 1.00 33.91 C ATOM 963 C HIS A 206 29.400 23.930 17.502 1.00 33.59 C ATOM 964 O HIS A 206 29.106 23.478 18.608 1.00 34.23 O ATOM 965 CB HIS A 206 27.658 23.915 15.697 1.00 33.67 C ATOM 966 CG HIS A 206 27.015 22.704 16.299 1.00 34.47 C ATOM 967 ND1 HIS A 206 25.852 22.769 17.037 1.00 32.82 N ATOM 968 CD2 HIS A 206 27.397 21.404 16.314 1.00 33.10 C ATOM 969 CE1 HIS A 206 25.536 21.560 17.465 1.00 33.61 C ATOM 970 NE2 HIS A 206 26.458 20.714 17.042 1.00 34.33 N ATOM 0 H HIS A 206 28.962 25.989 15.265 1.00 33.58 H new ATOM 0 HA HIS A 206 27.742 25.121 17.361 1.00 33.91 H new ATOM 0 HB2 HIS A 206 26.979 24.451 15.258 1.00 33.67 H new ATOM 0 HB3 HIS A 206 28.285 23.635 15.012 1.00 33.67 H new ATOM 0 HD2 HIS A 206 28.153 21.046 15.908 1.00 33.10 H new ATOM 0 HE1 HIS A 206 24.791 21.342 17.977 1.00 33.61 H new ATOM 0 HE2 HIS A 206 26.469 19.868 17.197 1.00 34.33 H new ATOM 971 N VAL A 207 30.578 23.715 16.922 1.00 33.31 N ATOM 972 CA VAL A 207 31.608 22.885 17.555 1.00 32.92 C ATOM 973 C VAL A 207 32.067 23.480 18.886 1.00 33.15 C ATOM 974 O VAL A 207 32.190 22.763 19.880 1.00 33.92 O ATOM 975 CB VAL A 207 32.811 22.612 16.609 1.00 32.90 C ATOM 976 CG1 VAL A 207 33.990 21.991 17.370 1.00 30.25 C ATOM 977 CG2 VAL A 207 32.387 21.691 15.477 1.00 30.47 C ATOM 0 H VAL A 207 30.804 24.041 16.159 1.00 33.31 H new ATOM 0 HA VAL A 207 31.198 22.026 17.742 1.00 32.92 H new ATOM 0 HB VAL A 207 33.101 23.462 16.243 1.00 32.90 H new ATOM 0 HG11 VAL A 207 34.724 21.832 16.756 1.00 30.25 H new ATOM 0 HG12 VAL A 207 34.280 22.598 18.069 1.00 30.25 H new ATOM 0 HG13 VAL A 207 33.713 21.150 17.766 1.00 30.25 H new ATOM 0 HG21 VAL A 207 33.144 21.527 14.893 1.00 30.47 H new ATOM 0 HG22 VAL A 207 32.074 20.850 15.844 1.00 30.47 H new ATOM 0 HG23 VAL A 207 31.673 22.108 14.971 1.00 30.47 H new ATOM 978 N MET A 208 32.303 24.790 18.906 1.00 32.43 N ATOM 979 CA MET A 208 32.706 25.471 20.132 1.00 32.17 C ATOM 980 C MET A 208 31.573 25.523 21.158 1.00 32.01 C ATOM 981 O MET A 208 31.830 25.498 22.361 1.00 31.96 O ATOM 982 CB MET A 208 33.248 26.871 19.832 1.00 32.16 C ATOM 983 CG MET A 208 34.579 26.856 19.075 1.00 34.37 C ATOM 984 SD MET A 208 35.910 25.969 19.927 1.00 37.35 S ATOM 985 CE MET A 208 36.275 27.109 21.263 1.00 33.94 C ATOM 0 H MET A 208 32.235 25.302 18.219 1.00 32.43 H new ATOM 0 HA MET A 208 33.423 24.950 20.527 1.00 32.17 H new ATOM 0 HB2 MET A 208 32.592 27.360 19.311 1.00 32.16 H new ATOM 0 HB3 MET A 208 33.363 27.352 20.666 1.00 32.16 H new ATOM 0 HG2 MET A 208 34.440 26.451 18.205 1.00 34.37 H new ATOM 0 HG3 MET A 208 34.861 27.771 18.920 1.00 34.37 H new ATOM 0 HE1 MET A 208 37.127 26.876 21.664 1.00 33.94 H new ATOM 0 HE2 MET A 208 36.319 28.013 20.914 1.00 33.94 H new ATOM 0 HE3 MET A 208 35.577 27.056 21.934 1.00 33.94 H new ATOM 986 N ASN A 209 30.332 25.592 20.672 1.00 31.91 N ATOM 987 CA ASN A 209 29.142 25.456 21.515 1.00 31.92 C ATOM 988 C ASN A 209 29.099 24.105 22.223 1.00 32.12 C ATOM 989 O ASN A 209 28.799 24.039 23.413 1.00 32.25 O ATOM 990 CB ASN A 209 27.857 25.637 20.691 1.00 31.77 C ATOM 991 CG ASN A 209 27.571 27.094 20.338 1.00 33.82 C ATOM 992 OD1 ASN A 209 28.242 28.012 20.810 1.00 34.29 O ATOM 993 ND2 ASN A 209 26.561 27.307 19.497 1.00 34.17 N ATOM 0 H ASN A 209 30.156 25.720 19.840 1.00 31.91 H new ATOM 0 HA ASN A 209 29.195 26.155 22.186 1.00 31.92 H new ATOM 0 HB2 ASN A 209 27.928 25.120 19.873 1.00 31.77 H new ATOM 0 HB3 ASN A 209 27.107 25.278 21.189 1.00 31.77 H new ATOM 0 HD21 ASN A 209 26.357 28.109 19.265 1.00 34.17 H new ATOM 0 HD22 ASN A 209 26.113 26.642 19.186 1.00 34.17 H new ATOM 994 N ILE A 210 29.385 23.034 21.477 1.00 32.18 N ATOM 995 CA ILE A 210 29.401 21.674 22.020 1.00 32.36 C ATOM 996 C ILE A 210 30.455 21.553 23.124 1.00 32.86 C ATOM 997 O ILE A 210 30.167 21.039 24.207 1.00 33.22 O ATOM 998 CB ILE A 210 29.610 20.597 20.903 1.00 32.19 C ATOM 999 CG1 ILE A 210 28.372 20.488 20.000 1.00 32.63 C ATOM 1000 CG2 ILE A 210 29.946 19.221 21.495 1.00 32.70 C ATOM 1001 CD1 ILE A 210 27.092 19.990 20.700 1.00 31.75 C ATOM 0 H ILE A 210 29.576 23.077 20.639 1.00 32.18 H new ATOM 0 HA ILE A 210 28.530 21.500 22.410 1.00 32.36 H new ATOM 0 HB ILE A 210 30.364 20.889 20.368 1.00 32.19 H new ATOM 0 HG12 ILE A 210 28.194 21.359 19.613 1.00 32.63 H new ATOM 0 HG13 ILE A 210 28.577 19.888 19.266 1.00 32.63 H new ATOM 0 HG21 ILE A 210 30.068 18.581 20.777 1.00 32.70 H new ATOM 0 HG22 ILE A 210 30.762 19.283 22.015 1.00 32.70 H new ATOM 0 HG23 ILE A 210 29.220 18.929 22.068 1.00 32.70 H new ATOM 0 HD11 ILE A 210 26.366 19.952 20.058 1.00 31.75 H new ATOM 0 HD12 ILE A 210 27.246 19.105 21.065 1.00 31.75 H new ATOM 0 HD13 ILE A 210 26.858 20.599 21.418 1.00 31.75 H new ATOM 1002 N PHE A 211 31.663 22.047 22.853 1.00 32.68 N ATOM 1003 CA PHE A 211 32.706 22.110 23.873 1.00 32.93 C ATOM 1004 C PHE A 211 32.245 22.885 25.110 1.00 33.12 C ATOM 1005 O PHE A 211 32.361 22.390 26.234 1.00 33.02 O ATOM 1006 CB PHE A 211 33.996 22.711 23.307 1.00 32.57 C ATOM 1007 CG PHE A 211 34.855 21.720 22.564 1.00 34.52 C ATOM 1008 CD1 PHE A 211 35.507 20.692 23.246 1.00 34.12 C ATOM 1009 CD2 PHE A 211 35.026 21.822 21.185 1.00 32.71 C ATOM 1010 CE1 PHE A 211 36.311 19.772 22.566 1.00 33.63 C ATOM 1011 CE2 PHE A 211 35.827 20.909 20.496 1.00 31.57 C ATOM 1012 CZ PHE A 211 36.470 19.882 21.191 1.00 33.06 C ATOM 0 H PHE A 211 31.898 22.351 22.083 1.00 32.68 H new ATOM 0 HA PHE A 211 32.890 21.199 24.150 1.00 32.93 H new ATOM 0 HB2 PHE A 211 33.768 23.440 22.709 1.00 32.57 H new ATOM 0 HB3 PHE A 211 34.512 23.092 24.035 1.00 32.57 H new ATOM 0 HD1 PHE A 211 35.405 20.618 24.167 1.00 34.12 H new ATOM 0 HD2 PHE A 211 34.602 22.506 20.718 1.00 32.71 H new ATOM 0 HE1 PHE A 211 36.737 19.090 23.032 1.00 33.63 H new ATOM 0 HE2 PHE A 211 35.932 20.985 19.575 1.00 31.57 H new ATOM 0 HZ PHE A 211 37.004 19.273 20.734 1.00 33.06 H new ATOM 1013 N SER A 212 31.704 24.084 24.890 1.00 32.97 N ATOM 1014 CA SER A 212 31.225 24.943 25.975 1.00 33.41 C ATOM 1015 C SER A 212 30.064 24.328 26.760 1.00 33.82 C ATOM 1016 O SER A 212 29.947 24.547 27.965 1.00 34.07 O ATOM 1017 CB SER A 212 30.830 26.324 25.440 1.00 33.10 C ATOM 1018 OG SER A 212 30.453 27.185 26.503 1.00 32.74 O ATOM 0 H SER A 212 31.604 24.423 24.106 1.00 32.97 H new ATOM 0 HA SER A 212 31.965 25.037 26.595 1.00 33.41 H new ATOM 0 HB2 SER A 212 31.573 26.712 24.952 1.00 33.10 H new ATOM 0 HB3 SER A 212 30.095 26.235 24.813 1.00 33.10 H new ATOM 0 HG SER A 212 30.241 27.937 26.193 1.00 32.74 H new ATOM 1019 N ASP A 213 29.218 23.564 26.071 1.00 34.28 N ATOM 1020 CA ASP A 213 28.145 22.789 26.703 1.00 35.38 C ATOM 1021 C ASP A 213 28.665 21.728 27.668 1.00 34.56 C ATOM 1022 O ASP A 213 27.958 21.322 28.589 1.00 33.90 O ATOM 1023 CB ASP A 213 27.306 22.091 25.636 1.00 36.83 C ATOM 1024 CG ASP A 213 26.041 22.832 25.318 1.00 45.22 C ATOM 1025 OD1 ASP A 213 25.955 23.408 24.210 1.00 49.64 O ATOM 1026 OD2 ASP A 213 25.133 22.838 26.182 1.00 53.64 O ATOM 0 H ASP A 213 29.249 23.479 25.216 1.00 34.28 H new ATOM 0 HA ASP A 213 27.614 23.424 27.209 1.00 35.38 H new ATOM 0 HB2 ASP A 213 27.833 21.996 24.827 1.00 36.83 H new ATOM 0 HB3 ASP A 213 27.085 21.196 25.938 1.00 36.83 H new ATOM 1027 N HIS A 214 29.893 21.268 27.435 1.00 34.42 N ATOM 1028 CA HIS A 214 30.497 20.220 28.252 1.00 34.48 C ATOM 1029 C HIS A 214 31.605 20.769 29.156 1.00 35.01 C ATOM 1030 O HIS A 214 32.486 20.032 29.597 1.00 35.14 O ATOM 1031 CB HIS A 214 30.995 19.074 27.363 1.00 34.28 C ATOM 1032 CG HIS A 214 29.895 18.337 26.663 1.00 33.11 C ATOM 1033 ND1 HIS A 214 29.312 18.796 25.500 1.00 33.37 N ATOM 1034 CD2 HIS A 214 29.262 17.180 26.968 1.00 32.08 C ATOM 1035 CE1 HIS A 214 28.373 17.951 25.116 1.00 32.14 C ATOM 1036 NE2 HIS A 214 28.323 16.960 25.988 1.00 32.21 N ATOM 0 H HIS A 214 30.397 21.555 26.800 1.00 34.42 H new ATOM 0 HA HIS A 214 29.814 19.866 28.843 1.00 34.48 H new ATOM 0 HB2 HIS A 214 31.607 19.431 26.701 1.00 34.28 H new ATOM 0 HB3 HIS A 214 31.498 18.448 27.907 1.00 34.28 H new ATOM 0 HD1 HIS A 214 29.527 19.520 25.089 1.00 33.37 H new ATOM 0 HD2 HIS A 214 29.431 16.636 27.703 1.00 32.08 H new ATOM 0 HE1 HIS A 214 27.838 18.039 24.360 1.00 32.14 H new ATOM 1037 N GLY A 215 31.539 22.072 29.428 1.00 35.55 N ATOM 1038 CA GLY A 215 32.454 22.743 30.351 1.00 36.19 C ATOM 1039 C GLY A 215 33.865 22.915 29.827 1.00 36.81 C ATOM 1040 O GLY A 215 34.807 23.053 30.609 1.00 36.61 O ATOM 0 H GLY A 215 30.955 22.597 29.078 1.00 35.55 H new ATOM 0 HA2 GLY A 215 32.093 23.617 30.567 1.00 36.19 H new ATOM 0 HA3 GLY A 215 32.488 22.238 31.178 1.00 36.19 H new ATOM 1041 N LEU A 216 34.007 22.924 28.502 1.00 37.31 N ATOM 1042 CA LEU A 216 35.322 22.930 27.867 1.00 38.31 C ATOM 1043 C LEU A 216 35.537 24.131 26.953 1.00 39.45 C ATOM 1044 O LEU A 216 34.624 24.564 26.247 1.00 39.53 O ATOM 1045 CB LEU A 216 35.535 21.631 27.081 1.00 38.30 C ATOM 1046 CG LEU A 216 35.481 20.311 27.860 1.00 36.99 C ATOM 1047 CD1 LEU A 216 35.343 19.129 26.910 1.00 36.61 C ATOM 1048 CD2 LEU A 216 36.706 20.148 28.753 1.00 38.44 C ATOM 0 H LEU A 216 33.348 22.927 27.950 1.00 37.31 H new ATOM 0 HA LEU A 216 35.976 22.997 28.581 1.00 38.31 H new ATOM 0 HB2 LEU A 216 34.865 21.592 26.381 1.00 38.30 H new ATOM 0 HB3 LEU A 216 36.399 21.685 26.644 1.00 38.30 H new ATOM 0 HG LEU A 216 34.698 20.335 28.432 1.00 36.99 H new ATOM 0 HD11 LEU A 216 35.311 18.305 27.421 1.00 36.61 H new ATOM 0 HD12 LEU A 216 34.527 19.222 26.394 1.00 36.61 H new ATOM 0 HD13 LEU A 216 36.104 19.106 26.309 1.00 36.61 H new ATOM 0 HD21 LEU A 216 36.647 19.307 29.233 1.00 38.44 H new ATOM 0 HD22 LEU A 216 37.508 20.152 28.207 1.00 38.44 H new ATOM 0 HD23 LEU A 216 36.744 20.880 29.388 1.00 38.44 H new ATOM 1049 N GLU A 217 36.754 24.665 26.976 1.00 40.72 N ATOM 1050 CA GLU A 217 37.135 25.750 26.080 1.00 42.26 C ATOM 1051 C GLU A 217 38.558 25.524 25.561 1.00 42.48 C ATOM 1052 O GLU A 217 39.528 25.969 26.184 1.00 42.86 O ATOM 1053 CB GLU A 217 36.998 27.110 26.776 1.00 42.37 C ATOM 1054 CG GLU A 217 36.808 28.283 25.813 1.00 44.04 C ATOM 1055 CD GLU A 217 36.548 29.611 26.517 1.00 43.62 C ATOM 1056 OE1 GLU A 217 36.389 29.632 27.761 1.00 46.91 O ATOM 1057 OE2 GLU A 217 36.500 30.644 25.815 1.00 49.02 O ATOM 0 H GLU A 217 37.379 24.410 27.509 1.00 40.72 H new ATOM 0 HA GLU A 217 36.532 25.755 25.320 1.00 42.26 H new ATOM 0 HB2 GLU A 217 36.243 27.077 27.385 1.00 42.37 H new ATOM 0 HB3 GLU A 217 37.789 27.269 27.314 1.00 42.37 H new ATOM 0 HG2 GLU A 217 37.599 28.368 25.258 1.00 44.04 H new ATOM 0 HG3 GLU A 217 36.065 28.089 25.220 1.00 44.04 H new ATOM 1058 N PRO A 218 38.685 24.815 24.420 1.00 42.38 N ATOM 1059 CA PRO A 218 39.988 24.534 23.816 1.00 42.46 C ATOM 1060 C PRO A 218 40.691 25.818 23.381 1.00 42.75 C ATOM 1061 O PRO A 218 40.067 26.685 22.764 1.00 42.94 O ATOM 1062 CB PRO A 218 39.634 23.685 22.588 1.00 42.49 C ATOM 1063 CG PRO A 218 38.263 23.172 22.845 1.00 42.71 C ATOM 1064 CD PRO A 218 37.582 24.237 23.634 1.00 42.09 C ATOM 0 HA PRO A 218 40.594 24.094 24.433 1.00 42.46 H new ATOM 0 HB2 PRO A 218 39.662 24.215 21.776 1.00 42.49 H new ATOM 0 HB3 PRO A 218 40.264 22.957 22.473 1.00 42.49 H new ATOM 0 HG2 PRO A 218 37.793 22.998 22.014 1.00 42.71 H new ATOM 0 HG3 PRO A 218 38.289 22.336 23.336 1.00 42.71 H new ATOM 0 HD2 PRO A 218 37.163 24.898 23.061 1.00 42.09 H new ATOM 0 HD3 PRO A 218 36.886 23.874 24.203 1.00 42.09 H new ATOM 1065 N THR A 219 41.976 25.931 23.708 1.00 42.99 N ATOM 1066 CA THR A 219 42.760 27.127 23.379 1.00 43.33 C ATOM 1067 C THR A 219 43.511 27.001 22.053 1.00 42.77 C ATOM 1068 O THR A 219 43.668 27.991 21.334 1.00 42.99 O ATOM 1069 CB THR A 219 43.773 27.481 24.491 1.00 43.38 C ATOM 1070 OG1 THR A 219 44.578 26.335 24.787 1.00 46.20 O ATOM 1071 CG2 THR A 219 43.055 27.938 25.756 1.00 45.21 C ATOM 0 H THR A 219 42.419 25.322 24.124 1.00 42.99 H new ATOM 0 HA THR A 219 42.107 27.840 23.297 1.00 43.33 H new ATOM 0 HB THR A 219 44.334 28.207 24.176 1.00 43.38 H new ATOM 0 HG1 THR A 219 45.130 26.528 25.390 1.00 46.20 H new ATOM 0 HG21 THR A 219 43.709 28.155 26.439 1.00 45.21 H new ATOM 0 HG22 THR A 219 42.521 28.724 25.559 1.00 45.21 H new ATOM 0 HG23 THR A 219 42.478 27.227 26.075 1.00 45.21 H new ATOM 1072 N LYS A 220 43.974 25.791 21.737 1.00 41.88 N ATOM 1073 CA LYS A 220 44.715 25.542 20.498 1.00 41.26 C ATOM 1074 C LYS A 220 43.750 25.346 19.332 1.00 41.14 C ATOM 1075 O LYS A 220 43.608 24.243 18.792 1.00 40.97 O ATOM 1076 CB LYS A 220 45.644 24.331 20.639 1.00 41.11 C ATOM 1077 CG LYS A 220 46.708 24.460 21.722 1.00 42.35 C ATOM 1078 CD LYS A 220 47.506 23.173 21.837 1.00 44.15 C ATOM 1079 CE LYS A 220 48.367 23.163 23.083 1.00 47.07 C ATOM 1080 NZ LYS A 220 49.060 21.856 23.245 1.00 49.59 N ATOM 0 H LYS A 220 43.869 25.095 22.231 1.00 41.88 H new ATOM 0 HA LYS A 220 45.267 26.319 20.318 1.00 41.26 H new ATOM 0 HB2 LYS A 220 45.105 23.547 20.826 1.00 41.11 H new ATOM 0 HB3 LYS A 220 46.084 24.177 19.788 1.00 41.11 H new ATOM 0 HG2 LYS A 220 47.302 25.198 21.514 1.00 42.35 H new ATOM 0 HG3 LYS A 220 46.289 24.665 22.573 1.00 42.35 H new ATOM 0 HD2 LYS A 220 46.900 22.416 21.855 1.00 44.15 H new ATOM 0 HD3 LYS A 220 48.068 23.068 21.053 1.00 44.15 H new ATOM 0 HE2 LYS A 220 49.023 23.876 23.032 1.00 47.07 H new ATOM 0 HE3 LYS A 220 47.816 23.339 23.862 1.00 47.07 H new ATOM 0 HZ1 LYS A 220 49.428 21.813 24.054 1.00 49.59 H new ATOM 0 HZ2 LYS A 220 48.472 21.194 23.152 1.00 49.59 H new ATOM 0 HZ3 LYS A 220 49.695 21.778 22.626 1.00 49.59 H new ATOM 1081 N ILE A 221 43.078 26.427 18.955 1.00 40.93 N ATOM 1082 CA ILE A 221 42.113 26.380 17.866 1.00 40.96 C ATOM 1083 C ILE A 221 42.555 27.231 16.686 1.00 40.73 C ATOM 1084 O ILE A 221 43.093 28.328 16.860 1.00 40.94 O ATOM 1085 CB ILE A 221 40.672 26.777 18.314 1.00 40.86 C ATOM 1086 CG1 ILE A 221 40.672 28.105 19.084 1.00 41.77 C ATOM 1087 CG2 ILE A 221 40.042 25.658 19.140 1.00 38.96 C ATOM 1088 CD1 ILE A 221 39.319 28.811 19.122 1.00 41.54 C ATOM 0 H ILE A 221 43.167 27.201 19.319 1.00 40.93 H new ATOM 0 HA ILE A 221 42.080 25.453 17.582 1.00 40.96 H new ATOM 0 HB ILE A 221 40.133 26.906 17.518 1.00 40.86 H new ATOM 0 HG12 ILE A 221 40.964 27.939 19.994 1.00 41.77 H new ATOM 0 HG13 ILE A 221 41.324 28.700 18.681 1.00 41.77 H new ATOM 0 HG21 ILE A 221 39.148 25.919 19.411 1.00 38.96 H new ATOM 0 HG22 ILE A 221 39.994 24.849 18.607 1.00 38.96 H new ATOM 0 HG23 ILE A 221 40.583 25.494 19.928 1.00 38.96 H new ATOM 0 HD11 ILE A 221 39.399 29.638 19.623 1.00 41.54 H new ATOM 0 HD12 ILE A 221 39.031 29.009 18.217 1.00 41.54 H new ATOM 0 HD13 ILE A 221 38.666 28.236 19.550 1.00 41.54 H new ATOM 1089 N AASN A 222 42.325 26.704 15.487 0.50 40.47 N ATOM 1090 N BASN A 222 42.336 26.709 15.483 0.50 40.54 N ATOM 1091 CA AASN A 222 42.602 27.408 14.244 0.50 40.33 C ATOM 1092 CA BASN A 222 42.604 27.448 14.256 0.50 40.46 C ATOM 1093 C AASN A 222 41.415 27.243 13.304 0.50 40.07 C ATOM 1094 C BASN A 222 41.474 27.258 13.255 0.50 40.17 C ATOM 1095 O AASN A 222 41.019 26.121 12.983 0.50 40.01 O ATOM 1096 O BASN A 222 41.176 26.136 12.844 0.50 40.15 O ATOM 1097 CB AASN A 222 43.886 26.866 13.601 0.50 40.48 C ATOM 1098 CB BASN A 222 43.948 27.034 13.649 0.50 40.69 C ATOM 1099 CG AASN A 222 44.230 27.551 12.281 0.50 40.98 C ATOM 1100 CG BASN A 222 45.134 27.627 14.393 0.50 41.65 C ATOM 1101 OD1AASN A 222 44.693 26.902 11.343 0.50 41.15 O ATOM 1102 OD1BASN A 222 45.344 28.842 14.388 0.50 41.88 O ATOM 1103 ND2AASN A 222 44.016 28.862 12.209 0.50 41.71 N ATOM 1104 ND2BASN A 222 45.921 26.768 15.028 0.50 42.65 N ATOM 0 H AASN A 222 41.999 25.916 15.373 0.50 40.54 H new ATOM 0 H BASN A 222 42.028 25.916 15.356 0.50 40.54 H new ATOM 0 HA AASN A 222 42.735 28.352 14.426 0.50 40.46 H new ATOM 0 HA BASN A 222 42.655 28.391 14.478 0.50 40.46 H new ATOM 0 HB2AASN A 222 44.624 26.980 14.220 0.50 40.69 H new ATOM 0 HB2BASN A 222 44.018 26.067 13.656 0.50 40.69 H new ATOM 0 HB3AASN A 222 43.788 25.913 13.449 0.50 40.69 H new ATOM 0 HB3BASN A 222 43.980 27.314 12.721 0.50 40.69 H new ATOM 0 HD21AASN A 222 44.203 29.289 11.486 0.50 42.65 H new ATOM 0 HD21BASN A 222 46.609 27.052 15.458 0.50 42.65 H new ATOM 0 HD22AASN A 222 43.691 29.282 12.885 0.50 42.65 H new ATOM 0 HD22BASN A 222 45.743 25.927 15.009 0.50 42.65 H new ATOM 1105 N GLU A 223 40.840 28.364 12.882 1.00 39.85 N ATOM 1106 CA GLU A 223 39.731 28.339 11.942 1.00 39.52 C ATOM 1107 C GLU A 223 40.277 28.342 10.522 1.00 38.08 C ATOM 1108 O GLU A 223 41.022 29.243 10.135 1.00 38.36 O ATOM 1109 CB GLU A 223 38.784 29.521 12.175 1.00 39.96 C ATOM 1110 CG GLU A 223 37.505 29.460 11.341 1.00 45.87 C ATOM 1111 CD GLU A 223 36.418 30.375 11.874 1.00 52.04 C ATOM 1112 OE1 GLU A 223 35.757 30.001 12.869 1.00 53.99 O ATOM 1113 OE2 GLU A 223 36.221 31.463 11.294 1.00 52.89 O ATOM 0 H AGLU A 223 41.080 29.152 13.130 0.50 39.85 H new ATOM 0 H BGLU A 223 41.042 29.150 13.168 0.50 39.85 H new ATOM 0 HA GLU A 223 39.215 27.529 12.080 1.00 39.52 H new ATOM 0 HB2 GLU A 223 38.546 29.554 13.115 1.00 39.96 H new ATOM 0 HB3 GLU A 223 39.253 30.345 11.972 1.00 39.96 H new ATOM 0 HG2 GLU A 223 37.708 29.704 10.425 1.00 45.87 H new ATOM 0 HG3 GLU A 223 37.176 28.548 11.325 1.00 45.87 H new ATOM 1114 N VAL A 224 39.921 27.311 9.762 1.00 36.10 N ATOM 1115 CA VAL A 224 40.305 27.221 8.358 1.00 34.74 C ATOM 1116 C VAL A 224 39.086 27.451 7.459 1.00 34.05 C ATOM 1117 O VAL A 224 37.942 27.444 7.933 1.00 33.57 O ATOM 1118 CB VAL A 224 41.059 25.900 8.026 1.00 34.71 C ATOM 1119 CG1 VAL A 224 42.363 25.821 8.819 1.00 33.90 C ATOM 1120 CG2 VAL A 224 40.186 24.677 8.281 1.00 32.46 C ATOM 0 H VAL A 224 39.452 26.647 10.044 1.00 36.10 H new ATOM 0 HA VAL A 224 40.944 27.928 8.177 1.00 34.74 H new ATOM 0 HB VAL A 224 41.273 25.906 7.080 1.00 34.71 H new ATOM 0 HG11 VAL A 224 42.823 24.995 8.604 1.00 33.90 H new ATOM 0 HG12 VAL A 224 42.928 26.575 8.589 1.00 33.90 H new ATOM 0 HG13 VAL A 224 42.166 25.843 9.769 1.00 33.90 H new ATOM 0 HG21 VAL A 224 40.684 23.873 8.065 1.00 32.46 H new ATOM 0 HG22 VAL A 224 39.925 24.654 9.215 1.00 32.46 H new ATOM 0 HG23 VAL A 224 39.392 24.724 7.725 1.00 32.46 H new ATOM 1121 N ARG A 225 39.340 27.650 6.169 1.00 33.43 N ATOM 1122 CA ARG A 225 38.327 28.157 5.244 1.00 33.32 C ATOM 1123 C ARG A 225 37.159 27.204 4.976 1.00 33.74 C ATOM 1124 O ARG A 225 36.009 27.635 4.970 1.00 33.41 O ATOM 1125 CB ARG A 225 38.975 28.595 3.926 1.00 33.07 C ATOM 1126 CG ARG A 225 38.080 29.470 3.053 1.00 32.79 C ATOM 1127 CD ARG A 225 38.768 29.841 1.749 1.00 32.83 C ATOM 1128 NE ARG A 225 39.042 28.661 0.932 1.00 31.72 N ATOM 1129 CZ ARG A 225 38.204 28.154 0.032 1.00 33.86 C ATOM 1130 NH1 ARG A 225 37.020 28.719 -0.180 1.00 31.15 N ATOM 1131 NH2 ARG A 225 38.549 27.073 -0.653 1.00 34.29 N ATOM 0 H ARG A 225 40.103 27.495 5.804 1.00 33.43 H new ATOM 0 HA ARG A 225 37.933 28.921 5.694 1.00 33.32 H new ATOM 0 HB2 ARG A 225 39.792 29.080 4.124 1.00 33.07 H new ATOM 0 HB3 ARG A 225 39.229 27.805 3.423 1.00 33.07 H new ATOM 0 HG2 ARG A 225 37.253 29.000 2.862 1.00 32.79 H new ATOM 0 HG3 ARG A 225 37.843 30.277 3.536 1.00 32.79 H new ATOM 0 HD2 ARG A 225 38.209 30.458 1.251 1.00 32.83 H new ATOM 0 HD3 ARG A 225 39.599 30.303 1.941 1.00 32.83 H new ATOM 0 HE ARG A 225 39.798 28.266 1.041 1.00 31.72 H new ATOM 0 HH11 ARG A 225 36.791 29.418 0.266 1.00 31.15 H new ATOM 0 HH12 ARG A 225 36.483 28.386 -0.763 1.00 31.15 H new ATOM 0 HH21 ARG A 225 39.312 26.702 -0.515 1.00 34.29 H new ATOM 0 HH22 ARG A 225 38.009 26.743 -1.236 1.00 34.29 H new ATOM 1132 N GLU A 226 37.464 25.925 4.751 1.00 34.37 N ATOM 1133 CA GLU A 226 36.471 24.931 4.322 1.00 34.90 C ATOM 1134 C GLU A 226 36.774 23.547 4.906 1.00 34.39 C ATOM 1135 O GLU A 226 37.895 23.284 5.354 1.00 33.83 O ATOM 1136 CB GLU A 226 36.440 24.831 2.788 1.00 35.71 C ATOM 1137 CG GLU A 226 35.931 26.075 2.040 1.00 40.84 C ATOM 1138 CD GLU A 226 34.470 26.402 2.325 1.00 48.03 C ATOM 1139 OE1 GLU A 226 33.652 25.459 2.437 1.00 49.67 O ATOM 1140 OE2 GLU A 226 34.141 27.607 2.433 1.00 49.63 O ATOM 0 H GLU A 226 38.257 25.606 4.843 1.00 34.37 H new ATOM 0 HA GLU A 226 35.607 25.226 4.650 1.00 34.90 H new ATOM 0 HB2 GLU A 226 37.337 24.633 2.477 1.00 35.71 H new ATOM 0 HB3 GLU A 226 35.882 24.077 2.542 1.00 35.71 H new ATOM 0 HG2 GLU A 226 36.479 26.837 2.285 1.00 40.84 H new ATOM 0 HG3 GLU A 226 36.044 25.939 1.086 1.00 40.84 H new ATOM 1141 N VAL A 227 35.778 22.663 4.869 1.00 33.98 N ATOM 1142 CA VAL A 227 35.911 21.295 5.387 1.00 34.28 C ATOM 1143 C VAL A 227 37.110 20.528 4.804 1.00 34.64 C ATOM 1144 O VAL A 227 37.848 19.884 5.552 1.00 34.56 O ATOM 1145 CB VAL A 227 34.592 20.473 5.239 1.00 33.95 C ATOM 1146 CG1 VAL A 227 34.208 20.272 3.769 1.00 32.05 C ATOM 1147 CG2 VAL A 227 34.705 19.132 5.966 1.00 34.22 C ATOM 0 H VAL A 227 35.002 22.838 4.542 1.00 33.98 H new ATOM 0 HA VAL A 227 36.090 21.403 6.334 1.00 34.28 H new ATOM 0 HB VAL A 227 33.880 20.986 5.653 1.00 33.95 H new ATOM 0 HG11 VAL A 227 33.386 19.759 3.716 1.00 32.05 H new ATOM 0 HG12 VAL A 227 34.077 21.136 3.348 1.00 32.05 H new ATOM 0 HG13 VAL A 227 34.917 19.794 3.312 1.00 32.05 H new ATOM 0 HG21 VAL A 227 33.877 18.637 5.863 1.00 34.22 H new ATOM 0 HG22 VAL A 227 35.437 18.620 5.588 1.00 34.22 H new ATOM 0 HG23 VAL A 227 34.872 19.288 6.909 1.00 34.22 H new ATOM 1148 N GLN A 228 37.309 20.617 3.486 1.00 34.72 N ATOM 1149 CA GLN A 228 38.401 19.893 2.821 1.00 34.93 C ATOM 1150 C GLN A 228 39.778 20.396 3.245 1.00 34.99 C ATOM 1151 O GLN A 228 40.748 19.634 3.226 1.00 34.41 O ATOM 1152 CB GLN A 228 38.267 19.917 1.290 1.00 35.17 C ATOM 1153 CG GLN A 228 38.389 21.293 0.631 1.00 37.03 C ATOM 1154 CD GLN A 228 37.047 21.991 0.444 1.00 42.00 C ATOM 1155 OE1 GLN A 228 36.125 21.836 1.248 1.00 40.01 O ATOM 1156 NE2 GLN A 228 36.938 22.771 -0.625 1.00 45.09 N ATOM 0 H GLN A 228 36.823 21.091 2.958 1.00 34.72 H new ATOM 0 HA GLN A 228 38.322 18.971 3.113 1.00 34.93 H new ATOM 0 HB2 GLN A 228 38.946 19.336 0.914 1.00 35.17 H new ATOM 0 HB3 GLN A 228 37.406 19.538 1.052 1.00 35.17 H new ATOM 0 HG2 GLN A 228 38.966 21.854 1.172 1.00 37.03 H new ATOM 0 HG3 GLN A 228 38.819 21.194 -0.233 1.00 37.03 H new ATOM 0 HE21 GLN A 228 37.602 22.856 -1.165 1.00 45.09 H new ATOM 0 HE22 GLN A 228 36.203 23.191 -0.777 1.00 45.09 H new ATOM 1157 N ALEU A 229 39.856 21.673 3.618 0.50 35.03 N ATOM 1158 N BLEU A 229 39.857 21.678 3.607 0.50 35.06 N ATOM 1159 CA ALEU A 229 41.091 22.247 4.133 0.50 35.14 C ATOM 1160 CA BLEU A 229 41.086 22.248 4.143 0.50 35.20 C ATOM 1161 C ALEU A 229 41.386 21.683 5.522 0.50 35.10 C ATOM 1162 C BLEU A 229 41.373 21.626 5.502 0.50 35.13 C ATOM 1163 O ALEU A 229 42.522 21.321 5.812 0.50 35.17 O ATOM 1164 O BLEU A 229 42.488 21.174 5.755 0.50 35.19 O ATOM 1165 CB ALEU A 229 41.026 23.779 4.163 0.50 35.06 C ATOM 1166 CB BLEU A 229 41.003 23.774 4.277 0.50 35.15 C ATOM 1167 CG ALEU A 229 42.363 24.513 4.016 0.50 35.26 C ATOM 1168 CG BLEU A 229 40.703 24.736 3.121 0.50 35.75 C ATOM 1169 CD1ALEU A 229 42.820 24.527 2.568 0.50 36.37 C ATOM 1170 CD1BLEU A 229 41.502 25.996 3.373 0.50 35.52 C ATOM 1171 CD2ALEU A 229 42.255 25.929 4.524 0.50 36.14 C ATOM 1172 CD2BLEU A 229 41.023 24.187 1.735 0.50 37.37 C ATOM 0 H ALEU A 229 39.198 22.225 3.579 0.50 35.06 H new ATOM 0 H BLEU A 229 39.204 22.234 3.548 0.50 35.06 H new ATOM 0 HA ALEU A 229 41.815 22.002 3.536 0.50 35.20 H new ATOM 0 HA BLEU A 229 41.805 22.051 3.522 0.50 35.20 H new ATOM 0 HB2ALEU A 229 40.436 24.074 3.452 0.50 35.15 H new ATOM 0 HB2BLEU A 229 40.328 23.947 4.952 0.50 35.15 H new ATOM 0 HB3ALEU A 229 40.619 24.051 5.000 0.50 35.15 H new ATOM 0 HB3BLEU A 229 41.854 24.057 4.647 0.50 35.15 H new ATOM 0 HG ALEU A 229 43.019 24.035 4.547 0.50 35.75 H new ATOM 0 HG BLEU A 229 39.746 24.895 3.109 0.50 35.75 H new ATOM 0 HD11ALEU A 229 43.666 24.996 2.500 0.50 35.52 H new ATOM 0 HD11BLEU A 229 41.338 26.632 2.659 0.50 35.52 H new ATOM 0 HD12ALEU A 229 42.930 23.616 2.254 0.50 35.52 H new ATOM 0 HD12BLEU A 229 41.234 26.385 4.220 0.50 35.52 H new ATOM 0 HD13ALEU A 229 42.156 24.978 2.023 0.50 35.52 H new ATOM 0 HD13BLEU A 229 42.447 25.780 3.401 0.50 35.52 H new ATOM 0 HD21ALEU A 229 43.110 26.376 4.422 0.50 37.37 H new ATOM 0 HD21BLEU A 229 40.806 24.854 1.065 0.50 37.37 H new ATOM 0 HD22ALEU A 229 41.580 26.405 4.016 0.50 37.37 H new ATOM 0 HD22BLEU A 229 41.967 23.972 1.682 0.50 37.37 H new ATOM 0 HD23ALEU A 229 42.006 25.919 5.461 0.50 37.37 H new ATOM 0 HD23BLEU A 229 40.500 23.386 1.575 0.50 37.37 H new ATOM 1173 N ALA A 230 40.354 21.594 6.360 1.00 34.92 N ATOM 1174 CA ALA A 230 40.465 20.982 7.689 1.00 35.19 C ATOM 1175 C ALA A 230 40.922 19.526 7.598 1.00 35.19 C ATOM 1176 O ALA A 230 41.894 19.139 8.244 1.00 35.80 O ATOM 1177 CB ALA A 230 39.138 21.081 8.442 1.00 35.32 C ATOM 0 H AALA A 230 39.567 21.887 6.175 0.50 34.92 H new ATOM 0 H BALA A 230 39.579 21.926 6.190 0.50 34.92 H new ATOM 0 HA ALA A 230 41.139 21.474 8.183 1.00 35.19 H new ATOM 0 HB1 ALA A 230 39.231 20.672 9.317 1.00 35.32 H new ATOM 0 HB2 ALA A 230 38.894 22.014 8.546 1.00 35.32 H new ATOM 0 HB3 ALA A 230 38.447 20.620 7.942 1.00 35.32 H new ATOM 1178 N LEU A 231 40.238 18.737 6.772 1.00 34.76 N ATOM 1179 CA LEU A 231 40.565 17.313 6.611 1.00 34.17 C ATOM 1180 C LEU A 231 41.940 17.100 5.966 1.00 34.37 C ATOM 1181 O LEU A 231 42.715 16.252 6.415 1.00 34.23 O ATOM 1182 CB LEU A 231 39.467 16.585 5.826 1.00 33.58 C ATOM 1183 CG LEU A 231 38.069 16.551 6.470 1.00 33.89 C ATOM 1184 CD1 LEU A 231 37.060 15.912 5.535 1.00 31.71 C ATOM 1185 CD2 LEU A 231 38.085 15.822 7.816 1.00 30.42 C ATOM 0 H LEU A 231 39.577 19.005 6.292 1.00 34.76 H new ATOM 0 HA LEU A 231 40.610 16.929 7.501 1.00 34.17 H new ATOM 0 HB2 LEU A 231 39.389 17.003 4.954 1.00 33.58 H new ATOM 0 HB3 LEU A 231 39.755 15.671 5.678 1.00 33.58 H new ATOM 0 HG LEU A 231 37.803 17.470 6.633 1.00 33.89 H new ATOM 0 HD11 LEU A 231 36.188 15.900 5.959 1.00 31.71 H new ATOM 0 HD12 LEU A 231 37.012 16.423 4.712 1.00 31.71 H new ATOM 0 HD13 LEU A 231 37.334 15.003 5.335 1.00 31.71 H new ATOM 0 HD21 LEU A 231 37.191 15.819 8.193 1.00 30.42 H new ATOM 0 HD22 LEU A 231 38.384 14.908 7.686 1.00 30.42 H new ATOM 0 HD23 LEU A 231 38.690 16.276 8.423 1.00 30.42 H new ATOM 1186 N GLY A 232 42.237 17.885 4.928 1.00 33.74 N ATOM 1187 CA GLY A 232 43.525 17.830 4.246 1.00 33.35 C ATOM 1188 C GLY A 232 44.702 18.146 5.153 1.00 33.43 C ATOM 1189 O GLY A 232 45.746 17.497 5.067 1.00 33.90 O ATOM 0 H GLY A 232 41.693 18.465 4.601 1.00 33.74 H new ATOM 0 HA2 GLY A 232 43.645 16.945 3.868 1.00 33.35 H new ATOM 0 HA3 GLY A 232 43.518 18.457 3.506 1.00 33.35 H new ATOM 1190 N LEU A 233 44.529 19.140 6.024 1.00 32.67 N ATOM 1191 CA LEU A 233 45.564 19.529 6.982 1.00 32.77 C ATOM 1192 C LEU A 233 45.754 18.491 8.088 1.00 32.72 C ATOM 1193 O LEU A 233 46.880 18.253 8.524 1.00 32.69 O ATOM 1194 CB LEU A 233 45.275 20.914 7.578 1.00 32.45 C ATOM 1195 CG LEU A 233 45.375 22.124 6.635 1.00 33.47 C ATOM 1196 CD1 LEU A 233 44.767 23.367 7.277 1.00 33.02 C ATOM 1197 CD2 LEU A 233 46.807 22.389 6.199 1.00 32.31 C ATOM 0 H LEU A 233 43.809 19.607 6.076 1.00 32.67 H new ATOM 0 HA LEU A 233 46.398 19.575 6.488 1.00 32.77 H new ATOM 0 HB2 LEU A 233 44.380 20.899 7.952 1.00 32.45 H new ATOM 0 HB3 LEU A 233 45.889 21.057 8.316 1.00 32.45 H new ATOM 0 HG LEU A 233 44.865 21.909 5.838 1.00 33.47 H new ATOM 0 HD11 LEU A 233 44.841 24.116 6.666 1.00 33.02 H new ATOM 0 HD12 LEU A 233 43.832 23.204 7.476 1.00 33.02 H new ATOM 0 HD13 LEU A 233 45.241 23.572 8.098 1.00 33.02 H new ATOM 0 HD21 LEU A 233 46.828 23.157 5.607 1.00 32.31 H new ATOM 0 HD22 LEU A 233 47.355 22.567 6.979 1.00 32.31 H new ATOM 0 HD23 LEU A 233 47.152 21.612 5.732 1.00 32.31 H new ATOM 1198 N VAL A 234 44.657 17.876 8.534 1.00 32.50 N ATOM 1199 CA VAL A 234 44.727 16.732 9.454 1.00 32.60 C ATOM 1200 C VAL A 234 45.545 15.594 8.831 1.00 33.00 C ATOM 1201 O VAL A 234 46.450 15.050 9.469 1.00 33.47 O ATOM 1202 CB VAL A 234 43.316 16.218 9.863 1.00 33.00 C ATOM 1203 CG1 VAL A 234 43.420 14.915 10.641 1.00 32.14 C ATOM 1204 CG2 VAL A 234 42.579 17.260 10.698 1.00 31.07 C ATOM 0 H VAL A 234 43.858 18.106 8.316 1.00 32.50 H new ATOM 0 HA VAL A 234 45.168 17.040 10.261 1.00 32.60 H new ATOM 0 HB VAL A 234 42.813 16.058 9.049 1.00 33.00 H new ATOM 0 HG11 VAL A 234 42.532 14.612 10.886 1.00 32.14 H new ATOM 0 HG12 VAL A 234 43.850 14.242 10.090 1.00 32.14 H new ATOM 0 HG13 VAL A 234 43.945 15.058 11.444 1.00 32.14 H new ATOM 0 HG21 VAL A 234 41.704 16.920 10.942 1.00 31.07 H new ATOM 0 HG22 VAL A 234 43.087 17.449 11.502 1.00 31.07 H new ATOM 0 HG23 VAL A 234 42.476 18.075 10.182 1.00 31.07 H new ATOM 1205 N ALA A 235 45.236 15.260 7.578 1.00 32.80 N ATOM 1206 CA ALA A 235 45.979 14.240 6.835 1.00 32.83 C ATOM 1207 C ALA A 235 47.446 14.621 6.626 1.00 32.72 C ATOM 1208 O ALA A 235 48.300 13.746 6.465 1.00 32.94 O ATOM 1209 CB ALA A 235 45.301 13.954 5.495 1.00 32.58 C ATOM 0 H ALA A 235 44.591 15.617 7.135 1.00 32.80 H new ATOM 0 HA ALA A 235 45.971 13.433 7.373 1.00 32.83 H new ATOM 0 HB1 ALA A 235 45.804 13.277 5.015 1.00 32.58 H new ATOM 0 HB2 ALA A 235 44.398 13.635 5.650 1.00 32.58 H new ATOM 0 HB3 ALA A 235 45.270 14.768 4.968 1.00 32.58 H new ATOM 1210 N ALA A 236 47.727 15.926 6.635 1.00 32.73 N ATOM 1211 CA ALA A 236 49.089 16.442 6.491 1.00 33.12 C ATOM 1212 C ALA A 236 49.838 16.539 7.828 1.00 34.03 C ATOM 1213 O ALA A 236 51.034 16.832 7.849 1.00 34.13 O ATOM 1214 CB ALA A 236 49.079 17.796 5.779 1.00 32.83 C ATOM 0 H ALA A 236 47.130 16.538 6.725 1.00 32.73 H new ATOM 0 HA ALA A 236 49.573 15.800 5.948 1.00 33.12 H new ATOM 0 HB1 ALA A 236 49.988 18.123 5.692 1.00 32.83 H new ATOM 0 HB2 ALA A 236 48.686 17.696 4.898 1.00 32.83 H new ATOM 0 HB3 ALA A 236 48.556 18.429 6.295 1.00 32.83 H new ATOM 1215 N GLY A 237 49.133 16.289 8.930 1.00 35.11 N ATOM 1216 CA GLY A 237 49.738 16.278 10.265 1.00 36.61 C ATOM 1217 C GLY A 237 49.623 17.574 11.055 1.00 38.17 C ATOM 1218 O GLY A 237 50.391 17.795 11.993 1.00 38.42 O ATOM 0 H GLY A 237 48.290 16.121 8.926 1.00 35.11 H new ATOM 0 HA2 GLY A 237 49.328 15.567 10.782 1.00 36.61 H new ATOM 0 HA3 GLY A 237 50.678 16.057 10.174 1.00 36.61 H new ATOM 1219 N GLU A 238 48.659 18.420 10.690 1.00 39.23 N ATOM 1220 CA GLU A 238 48.514 19.755 11.290 1.00 40.76 C ATOM 1221 C GLU A 238 47.672 19.766 12.571 1.00 40.88 C ATOM 1222 O GLU A 238 47.719 20.727 13.344 1.00 42.28 O ATOM 1223 CB GLU A 238 47.933 20.741 10.269 1.00 41.67 C ATOM 1224 CG GLU A 238 47.986 22.213 10.680 1.00 48.02 C ATOM 1225 CD GLU A 238 49.275 22.896 10.265 1.00 53.84 C ATOM 1226 OE1 GLU A 238 49.554 22.952 9.049 1.00 55.19 O ATOM 1227 OE2 GLU A 238 50.004 23.389 11.155 1.00 58.84 O ATOM 0 H GLU A 238 48.070 18.240 10.089 1.00 39.23 H new ATOM 0 HA GLU A 238 49.407 20.032 11.546 1.00 40.76 H new ATOM 0 HB2 GLU A 238 48.412 20.637 9.432 1.00 41.67 H new ATOM 0 HB3 GLU A 238 47.009 20.501 10.099 1.00 41.67 H new ATOM 0 HG2 GLU A 238 47.235 22.682 10.284 1.00 48.02 H new ATOM 0 HG3 GLU A 238 47.886 22.279 11.643 1.00 48.02 H new ATOM 1228 N GLY A 239 46.902 18.707 12.796 1.00 39.62 N ATOM 1229 CA GLY A 239 46.108 18.602 14.014 1.00 38.20 C ATOM 1230 C GLY A 239 44.941 17.648 13.886 1.00 36.94 C ATOM 1231 O GLY A 239 45.039 16.619 13.215 1.00 36.81 O ATOM 0 H GLY A 239 46.825 18.041 12.258 1.00 39.62 H new ATOM 0 HA2 GLY A 239 46.679 18.309 14.741 1.00 38.20 H new ATOM 0 HA3 GLY A 239 45.775 19.481 14.252 1.00 38.20 H new ATOM 1232 N ILE A 240 43.842 17.993 14.553 1.00 35.59 N ATOM 1233 CA ILE A 240 42.611 17.201 14.522 1.00 34.76 C ATOM 1234 C ILE A 240 41.427 18.109 14.194 1.00 35.04 C ATOM 1235 O ILE A 240 41.539 19.336 14.269 1.00 35.28 O ATOM 1236 CB ILE A 240 42.354 16.453 15.870 1.00 34.81 C ATOM 1237 CG1 ILE A 240 41.974 17.436 16.991 1.00 34.05 C ATOM 1238 CG2 ILE A 240 43.567 15.588 16.254 1.00 31.80 C ATOM 1239 CD1 ILE A 240 41.326 16.787 18.214 1.00 34.83 C ATOM 0 H ILE A 240 43.788 18.699 15.041 1.00 35.59 H new ATOM 0 HA ILE A 240 42.713 16.525 13.834 1.00 34.76 H new ATOM 0 HB ILE A 240 41.598 15.858 15.746 1.00 34.81 H new ATOM 0 HG12 ILE A 240 42.772 17.908 17.275 1.00 34.05 H new ATOM 0 HG13 ILE A 240 41.365 18.099 16.631 1.00 34.05 H new ATOM 0 HG21 ILE A 240 43.388 15.133 17.092 1.00 31.80 H new ATOM 0 HG22 ILE A 240 43.730 14.932 15.558 1.00 31.80 H new ATOM 0 HG23 ILE A 240 44.349 16.153 16.354 1.00 31.80 H new ATOM 0 HD11 ILE A 240 41.118 17.470 18.871 1.00 34.83 H new ATOM 0 HD12 ILE A 240 40.510 16.336 17.947 1.00 34.83 H new ATOM 0 HD13 ILE A 240 41.939 16.143 18.601 1.00 34.83 H new ATOM 1240 N SER A 241 40.295 17.511 13.839 1.00 34.94 N ATOM 1241 CA SER A 241 39.094 18.279 13.533 1.00 35.31 C ATOM 1242 C SER A 241 37.835 17.532 13.967 1.00 35.92 C ATOM 1243 O SER A 241 37.824 16.301 14.033 1.00 37.35 O ATOM 1244 CB SER A 241 39.037 18.589 12.034 1.00 35.12 C ATOM 1245 OG SER A 241 38.051 19.565 11.756 1.00 35.04 O ATOM 0 H SER A 241 40.201 16.659 13.769 1.00 34.94 H new ATOM 0 HA SER A 241 39.133 19.112 14.029 1.00 35.31 H new ATOM 0 HB2 SER A 241 39.903 18.904 11.732 1.00 35.12 H new ATOM 0 HB3 SER A 241 38.842 17.778 11.539 1.00 35.12 H new ATOM 0 HG SER A 241 38.265 20.291 12.120 1.00 35.04 H new ATOM 1246 N LEU A 242 36.780 18.277 14.277 1.00 35.33 N ATOM 1247 CA LEU A 242 35.483 17.671 14.572 1.00 35.02 C ATOM 1248 C LEU A 242 34.564 17.865 13.373 1.00 34.32 C ATOM 1249 O LEU A 242 34.488 18.962 12.815 1.00 34.63 O ATOM 1250 CB LEU A 242 34.867 18.255 15.850 1.00 35.12 C ATOM 1251 CG LEU A 242 35.479 17.785 17.180 1.00 36.39 C ATOM 1252 CD1 LEU A 242 36.763 18.551 17.517 1.00 34.78 C ATOM 1253 CD2 LEU A 242 34.474 17.930 18.303 1.00 37.55 C ATOM 0 H LEU A 242 36.792 19.136 14.322 1.00 35.33 H new ATOM 0 HA LEU A 242 35.604 16.722 14.732 1.00 35.02 H new ATOM 0 HB2 LEU A 242 34.938 19.221 15.807 1.00 35.12 H new ATOM 0 HB3 LEU A 242 33.921 18.040 15.858 1.00 35.12 H new ATOM 0 HG LEU A 242 35.712 16.849 17.080 1.00 36.39 H new ATOM 0 HD11 LEU A 242 37.120 18.229 18.360 1.00 34.78 H new ATOM 0 HD12 LEU A 242 37.417 18.411 16.815 1.00 34.78 H new ATOM 0 HD13 LEU A 242 36.565 19.498 17.591 1.00 34.78 H new ATOM 0 HD21 LEU A 242 34.873 17.630 19.135 1.00 37.55 H new ATOM 0 HD22 LEU A 242 34.214 18.861 18.386 1.00 37.55 H new ATOM 0 HD23 LEU A 242 33.691 17.392 18.108 1.00 37.55 H new ATOM 1254 N VAL A 243 33.901 16.788 12.962 1.00 33.14 N ATOM 1255 CA VAL A 243 33.062 16.799 11.761 1.00 32.52 C ATOM 1256 C VAL A 243 31.745 16.062 12.010 1.00 32.12 C ATOM 1257 O VAL A 243 31.674 15.219 12.910 1.00 32.47 O ATOM 1258 CB VAL A 243 33.787 16.147 10.535 1.00 32.61 C ATOM 1259 CG1 VAL A 243 35.095 16.874 10.201 1.00 31.17 C ATOM 1260 CG2 VAL A 243 34.034 14.651 10.768 1.00 31.30 C ATOM 0 H VAL A 243 33.923 16.031 13.369 1.00 33.14 H new ATOM 0 HA VAL A 243 32.883 17.730 11.556 1.00 32.52 H new ATOM 0 HB VAL A 243 33.198 16.238 9.769 1.00 32.61 H new ATOM 0 HG11 VAL A 243 35.518 16.447 9.440 1.00 31.17 H new ATOM 0 HG12 VAL A 243 34.905 17.801 9.987 1.00 31.17 H new ATOM 0 HG13 VAL A 243 35.691 16.835 10.965 1.00 31.17 H new ATOM 0 HG21 VAL A 243 34.483 14.273 9.996 1.00 31.30 H new ATOM 0 HG22 VAL A 243 34.590 14.533 11.554 1.00 31.30 H new ATOM 0 HG23 VAL A 243 33.186 14.200 10.901 1.00 31.30 H new ATOM 1261 N PRO A 244 30.695 16.373 11.218 1.00 31.78 N ATOM 1262 CA PRO A 244 29.496 15.533 11.252 1.00 31.90 C ATOM 1263 C PRO A 244 29.812 14.158 10.666 1.00 32.46 C ATOM 1264 O PRO A 244 30.696 14.044 9.812 1.00 32.83 O ATOM 1265 CB PRO A 244 28.513 16.277 10.335 1.00 32.04 C ATOM 1266 CG PRO A 244 29.063 17.661 10.196 1.00 31.28 C ATOM 1267 CD PRO A 244 30.544 17.494 10.272 1.00 31.69 C ATOM 0 HA PRO A 244 29.152 15.392 12.148 1.00 31.90 H new ATOM 0 HB2 PRO A 244 28.443 15.841 9.471 1.00 32.04 H new ATOM 0 HB3 PRO A 244 27.622 16.292 10.718 1.00 32.04 H new ATOM 0 HG2 PRO A 244 28.797 18.062 9.354 1.00 31.28 H new ATOM 0 HG3 PRO A 244 28.738 18.241 10.902 1.00 31.28 H new ATOM 0 HD2 PRO A 244 30.929 17.289 9.405 1.00 31.69 H new ATOM 0 HD3 PRO A 244 30.981 18.298 10.593 1.00 31.69 H new ATOM 1268 N ALA A 245 29.101 13.126 11.116 1.00 32.32 N ATOM 1269 CA ALA A 245 29.368 11.755 10.667 1.00 32.02 C ATOM 1270 C ALA A 245 29.305 11.593 9.143 1.00 32.09 C ATOM 1271 O ALA A 245 30.102 10.852 8.570 1.00 32.39 O ATOM 1272 CB ALA A 245 28.431 10.764 11.361 1.00 31.63 C ATOM 0 H ALA A 245 28.458 13.196 11.683 1.00 32.32 H new ATOM 0 HA ALA A 245 30.282 11.557 10.923 1.00 32.02 H new ATOM 0 HB1 ALA A 245 28.623 9.865 11.051 1.00 31.63 H new ATOM 0 HB2 ALA A 245 28.564 10.810 12.321 1.00 31.63 H new ATOM 0 HB3 ALA A 245 27.511 10.988 11.152 1.00 31.63 H new ATOM 1273 N SER A 246 28.372 12.294 8.493 1.00 32.02 N ATOM 1274 CA SER A 246 28.200 12.204 7.034 1.00 31.69 C ATOM 1275 C SER A 246 29.404 12.709 6.237 1.00 31.76 C ATOM 1276 O SER A 246 29.538 12.405 5.052 1.00 31.88 O ATOM 1277 CB SER A 246 26.918 12.909 6.573 1.00 31.68 C ATOM 1278 OG SER A 246 26.855 14.243 7.047 1.00 31.38 O ATOM 0 H SER A 246 27.824 12.832 8.880 1.00 32.02 H new ATOM 0 HA SER A 246 28.124 11.256 6.845 1.00 31.69 H new ATOM 0 HB2 SER A 246 26.878 12.907 5.604 1.00 31.68 H new ATOM 0 HB3 SER A 246 26.145 12.416 6.890 1.00 31.68 H new ATOM 0 HG SER A 246 26.688 14.240 7.870 1.00 31.38 H new ATOM 1279 N THR A 247 30.275 13.476 6.893 1.00 32.12 N ATOM 1280 CA THR A 247 31.506 13.988 6.272 1.00 32.09 C ATOM 1281 C THR A 247 32.502 12.852 5.958 1.00 32.26 C ATOM 1282 O THR A 247 33.487 13.054 5.237 1.00 32.57 O ATOM 1283 CB THR A 247 32.124 15.138 7.124 1.00 32.14 C ATOM 1284 OG1 THR A 247 31.272 16.291 7.046 1.00 33.56 O ATOM 1285 CG2 THR A 247 33.510 15.532 6.636 1.00 30.77 C ATOM 0 H THR A 247 30.172 13.716 7.712 1.00 32.12 H new ATOM 0 HA THR A 247 31.276 14.377 5.414 1.00 32.09 H new ATOM 0 HB THR A 247 32.202 14.817 8.036 1.00 32.14 H new ATOM 0 HG1 THR A 247 31.715 16.980 7.233 1.00 33.56 H new ATOM 0 HG21 THR A 247 33.857 16.248 7.191 1.00 30.77 H new ATOM 0 HG22 THR A 247 34.102 14.766 6.689 1.00 30.77 H new ATOM 0 HG23 THR A 247 33.456 15.834 5.716 1.00 30.77 H new ATOM 1286 N GLN A 248 32.216 11.653 6.470 1.00 31.77 N ATOM 1287 CA GLN A 248 32.959 10.439 6.108 1.00 31.48 C ATOM 1288 C GLN A 248 32.783 10.059 4.632 1.00 31.71 C ATOM 1289 O GLN A 248 33.394 9.100 4.151 1.00 32.04 O ATOM 1290 CB GLN A 248 32.547 9.268 6.999 1.00 31.43 C ATOM 1291 CG GLN A 248 33.029 9.385 8.432 1.00 32.00 C ATOM 1292 CD GLN A 248 32.467 8.296 9.311 1.00 34.15 C ATOM 1293 OE1 GLN A 248 31.284 8.304 9.652 1.00 36.66 O ATOM 1294 NE2 GLN A 248 33.311 7.354 9.688 1.00 31.71 N ATOM 0 H GLN A 248 31.585 11.519 7.038 1.00 31.77 H new ATOM 0 HA GLN A 248 33.898 10.637 6.248 1.00 31.48 H new ATOM 0 HB2 GLN A 248 31.580 9.197 6.998 1.00 31.43 H new ATOM 0 HB3 GLN A 248 32.892 8.446 6.617 1.00 31.43 H new ATOM 0 HG2 GLN A 248 33.998 9.346 8.450 1.00 32.00 H new ATOM 0 HG3 GLN A 248 32.774 10.250 8.788 1.00 32.00 H new ATOM 0 HE21 GLN A 248 34.131 7.382 9.429 1.00 31.71 H new ATOM 0 HE22 GLN A 248 33.041 6.712 10.192 1.00 31.71 H new ATOM 1295 N SER A 249 31.942 10.811 3.924 1.00 31.73 N ATOM 1296 CA SER A 249 31.886 10.759 2.463 1.00 31.76 C ATOM 1297 C SER A 249 33.242 11.119 1.852 1.00 31.80 C ATOM 1298 O SER A 249 33.555 10.704 0.733 1.00 31.86 O ATOM 1299 CB SER A 249 30.807 11.704 1.940 1.00 31.70 C ATOM 1300 OG SER A 249 29.517 11.213 2.259 1.00 32.56 O ATOM 0 H SER A 249 31.388 11.366 4.277 1.00 31.73 H new ATOM 0 HA SER A 249 31.664 9.852 2.201 1.00 31.76 H new ATOM 0 HB2 SER A 249 30.927 12.586 2.326 1.00 31.70 H new ATOM 0 HB3 SER A 249 30.893 11.801 0.979 1.00 31.70 H new ATOM 0 HG SER A 249 28.996 11.859 2.389 1.00 32.56 H new ATOM 1301 N ILE A 250 34.036 11.890 2.597 1.00 31.67 N ATOM 1302 CA ILE A 250 35.405 12.224 2.208 1.00 32.22 C ATOM 1303 C ILE A 250 36.382 11.276 2.894 1.00 32.45 C ATOM 1304 O ILE A 250 36.507 11.279 4.124 1.00 32.87 O ATOM 1305 CB ILE A 250 35.780 13.692 2.558 1.00 32.20 C ATOM 1306 CG1 ILE A 250 34.776 14.674 1.940 1.00 32.22 C ATOM 1307 CG2 ILE A 250 37.223 14.001 2.113 1.00 32.91 C ATOM 1308 CD1 ILE A 250 35.031 16.147 2.275 1.00 31.91 C ATOM 0 H ILE A 250 33.793 12.235 3.346 1.00 31.67 H new ATOM 0 HA ILE A 250 35.461 12.128 1.244 1.00 32.22 H new ATOM 0 HB ILE A 250 35.737 13.801 3.521 1.00 32.20 H new ATOM 0 HG12 ILE A 250 34.790 14.567 0.976 1.00 32.22 H new ATOM 0 HG13 ILE A 250 33.884 14.437 2.239 1.00 32.22 H new ATOM 0 HG21 ILE A 250 37.442 14.919 2.338 1.00 32.91 H new ATOM 0 HG22 ILE A 250 37.837 13.402 2.567 1.00 32.91 H new ATOM 0 HG23 ILE A 250 37.300 13.876 1.154 1.00 32.91 H new ATOM 0 HD11 ILE A 250 34.356 16.698 1.848 1.00 31.91 H new ATOM 0 HD12 ILE A 250 34.990 16.272 3.236 1.00 31.91 H new ATOM 0 HD13 ILE A 250 35.909 16.405 1.953 1.00 31.91 H new ATOM 1309 N GLN A 251 37.062 10.459 2.096 1.00 32.29 N ATOM 1310 CA GLN A 251 38.064 9.539 2.617 1.00 32.19 C ATOM 1311 C GLN A 251 39.421 9.899 2.027 1.00 32.20 C ATOM 1312 O GLN A 251 39.560 10.009 0.810 1.00 32.47 O ATOM 1313 CB GLN A 251 37.695 8.084 2.296 1.00 32.22 C ATOM 1314 CG GLN A 251 36.439 7.573 3.011 1.00 32.37 C ATOM 1315 CD GLN A 251 36.637 7.367 4.510 1.00 34.80 C ATOM 1316 OE1 GLN A 251 37.691 6.913 4.955 1.00 34.13 O ATOM 1317 NE2 GLN A 251 35.612 7.692 5.292 1.00 33.11 N ATOM 0 H GLN A 251 36.956 10.423 1.243 1.00 32.29 H new ATOM 0 HA GLN A 251 38.102 9.620 3.583 1.00 32.19 H new ATOM 0 HB2 GLN A 251 37.565 7.999 1.338 1.00 32.22 H new ATOM 0 HB3 GLN A 251 38.443 7.513 2.533 1.00 32.22 H new ATOM 0 HG2 GLN A 251 35.716 8.204 2.871 1.00 32.37 H new ATOM 0 HG3 GLN A 251 36.165 6.734 2.609 1.00 32.37 H new ATOM 0 HE21 GLN A 251 34.890 8.007 4.946 1.00 33.11 H new ATOM 0 HE22 GLN A 251 35.671 7.587 6.144 1.00 33.11 H new ATOM 1318 N LEU A 252 40.408 10.102 2.897 1.00 31.86 N ATOM 1319 CA LEU A 252 41.761 10.468 2.472 1.00 31.61 C ATOM 1320 C LEU A 252 42.774 9.516 3.086 1.00 31.80 C ATOM 1321 O LEU A 252 42.557 8.998 4.189 1.00 31.89 O ATOM 1322 CB LEU A 252 42.098 11.908 2.889 1.00 31.69 C ATOM 1323 CG LEU A 252 41.140 13.063 2.575 1.00 31.01 C ATOM 1324 CD1 LEU A 252 41.617 14.342 3.258 1.00 29.95 C ATOM 1325 CD2 LEU A 252 40.990 13.281 1.073 1.00 28.08 C ATOM 0 H LEU A 252 40.314 10.032 3.749 1.00 31.86 H new ATOM 0 HA LEU A 252 41.799 10.407 1.505 1.00 31.61 H new ATOM 0 HB2 LEU A 252 42.232 11.902 3.850 1.00 31.69 H new ATOM 0 HB3 LEU A 252 42.952 12.129 2.485 1.00 31.69 H new ATOM 0 HG LEU A 252 40.266 12.826 2.922 1.00 31.01 H new ATOM 0 HD11 LEU A 252 41.005 15.066 3.053 1.00 29.95 H new ATOM 0 HD12 LEU A 252 41.646 14.205 4.218 1.00 29.95 H new ATOM 0 HD13 LEU A 252 42.504 14.569 2.937 1.00 29.95 H new ATOM 0 HD21 LEU A 252 40.379 14.017 0.912 1.00 28.08 H new ATOM 0 HD22 LEU A 252 41.855 13.490 0.688 1.00 28.08 H new ATOM 0 HD23 LEU A 252 40.640 12.475 0.662 1.00 28.08 H new ATOM 1326 N PHE A 253 43.880 9.295 2.378 1.00 31.36 N ATOM 1327 CA PHE A 253 44.952 8.434 2.875 1.00 31.02 C ATOM 1328 C PHE A 253 45.444 8.904 4.241 1.00 30.84 C ATOM 1329 O PHE A 253 45.733 10.089 4.436 1.00 30.38 O ATOM 1330 CB PHE A 253 46.115 8.368 1.881 1.00 30.77 C ATOM 1331 CG PHE A 253 47.222 7.439 2.305 1.00 32.02 C ATOM 1332 CD1 PHE A 253 47.106 6.062 2.116 1.00 31.90 C ATOM 1333 CD2 PHE A 253 48.380 7.938 2.894 1.00 30.03 C ATOM 1334 CE1 PHE A 253 48.126 5.198 2.508 1.00 34.66 C ATOM 1335 CE2 PHE A 253 49.408 7.084 3.290 1.00 33.15 C ATOM 1336 CZ PHE A 253 49.281 5.709 3.096 1.00 33.83 C ATOM 0 H PHE A 253 44.030 9.636 1.603 1.00 31.36 H new ATOM 0 HA PHE A 253 44.587 7.541 2.973 1.00 31.02 H new ATOM 0 HB2 PHE A 253 45.777 8.082 1.018 1.00 30.77 H new ATOM 0 HB3 PHE A 253 46.479 9.259 1.762 1.00 30.77 H new ATOM 0 HD1 PHE A 253 46.337 5.716 1.723 1.00 31.90 H new ATOM 0 HD2 PHE A 253 48.469 8.854 3.025 1.00 30.03 H new ATOM 0 HE1 PHE A 253 48.036 4.282 2.377 1.00 34.66 H new ATOM 0 HE2 PHE A 253 50.177 7.430 3.683 1.00 33.15 H new ATOM 0 HZ PHE A 253 49.965 5.135 3.358 1.00 33.83 H new ATOM 1337 N ASN A 254 45.526 7.953 5.171 1.00 30.91 N ATOM 1338 CA ASN A 254 45.925 8.194 6.565 1.00 30.96 C ATOM 1339 C ASN A 254 45.025 9.142 7.355 1.00 30.78 C ATOM 1340 O ASN A 254 45.426 9.668 8.392 1.00 30.58 O ATOM 1341 CB ASN A 254 47.409 8.585 6.675 1.00 30.79 C ATOM 1342 CG ASN A 254 48.326 7.375 6.743 1.00 32.31 C ATOM 1343 OD1 ASN A 254 47.866 6.242 6.884 1.00 32.83 O ATOM 1344 ND2 ASN A 254 49.633 7.612 6.649 1.00 30.48 N ATOM 0 H ASN A 254 45.347 7.128 5.008 1.00 30.91 H new ATOM 0 HA ASN A 254 45.800 7.336 6.999 1.00 30.96 H new ATOM 0 HB2 ASN A 254 47.654 9.130 5.911 1.00 30.79 H new ATOM 0 HB3 ASN A 254 47.539 9.130 7.467 1.00 30.79 H new ATOM 0 HD21 ASN A 254 50.192 6.960 6.686 1.00 30.48 H new ATOM 0 HD22 ASN A 254 49.918 8.417 6.551 1.00 30.48 H new ATOM 1345 N LEU A 255 43.808 9.351 6.860 1.00 31.37 N ATOM 1346 CA LEU A 255 42.789 10.081 7.603 1.00 31.61 C ATOM 1347 C LEU A 255 41.831 9.071 8.213 1.00 32.08 C ATOM 1348 O LEU A 255 41.309 8.201 7.515 1.00 32.35 O ATOM 1349 CB LEU A 255 42.032 11.068 6.701 1.00 31.86 C ATOM 1350 CG LEU A 255 40.866 11.850 7.322 1.00 32.80 C ATOM 1351 CD1 LEU A 255 41.376 12.900 8.302 1.00 33.68 C ATOM 1352 CD2 LEU A 255 39.986 12.503 6.249 1.00 31.74 C ATOM 0 H LEU A 255 43.552 9.074 6.087 1.00 31.37 H new ATOM 0 HA LEU A 255 43.214 10.605 8.300 1.00 31.61 H new ATOM 0 HB2 LEU A 255 42.673 11.710 6.357 1.00 31.86 H new ATOM 0 HB3 LEU A 255 41.689 10.574 5.940 1.00 31.86 H new ATOM 0 HG LEU A 255 40.318 11.213 7.807 1.00 32.80 H new ATOM 0 HD11 LEU A 255 40.624 13.381 8.682 1.00 33.68 H new ATOM 0 HD12 LEU A 255 41.873 12.465 9.013 1.00 33.68 H new ATOM 0 HD13 LEU A 255 41.956 13.523 7.836 1.00 33.68 H new ATOM 0 HD21 LEU A 255 39.262 12.987 6.675 1.00 31.74 H new ATOM 0 HD22 LEU A 255 40.520 13.118 5.723 1.00 31.74 H new ATOM 0 HD23 LEU A 255 39.619 11.817 5.670 1.00 31.74 H new ATOM 1353 N SER A 256 41.606 9.198 9.516 1.00 32.42 N ATOM 1354 CA SER A 256 40.766 8.267 10.248 1.00 32.98 C ATOM 1355 C SER A 256 39.719 9.019 11.070 1.00 33.46 C ATOM 1356 O SER A 256 40.000 10.088 11.621 1.00 33.55 O ATOM 1357 CB SER A 256 41.637 7.385 11.144 1.00 33.03 C ATOM 1358 OG SER A 256 40.863 6.420 11.830 1.00 34.96 O ATOM 0 H SER A 256 41.938 9.828 9.999 1.00 32.42 H new ATOM 0 HA SER A 256 40.294 7.700 9.617 1.00 32.98 H new ATOM 0 HB2 SER A 256 42.310 6.939 10.606 1.00 33.03 H new ATOM 0 HB3 SER A 256 42.109 7.939 11.786 1.00 33.03 H new ATOM 0 HG SER A 256 41.123 6.367 12.627 1.00 34.96 H new ATOM 1359 N TYR A 257 38.511 8.462 11.134 1.00 33.31 N ATOM 1360 CA TYR A 257 37.420 9.078 11.887 1.00 33.55 C ATOM 1361 C TYR A 257 37.139 8.297 13.165 1.00 33.74 C ATOM 1362 O TYR A 257 36.936 7.081 13.133 1.00 33.96 O ATOM 1363 CB TYR A 257 36.156 9.187 11.035 1.00 33.24 C ATOM 1364 CG TYR A 257 36.277 10.094 9.828 1.00 34.25 C ATOM 1365 CD1 TYR A 257 36.034 11.465 9.935 1.00 32.59 C ATOM 1366 CD2 TYR A 257 36.612 9.579 8.573 1.00 33.17 C ATOM 1367 CE1 TYR A 257 36.131 12.301 8.827 1.00 33.41 C ATOM 1368 CE2 TYR A 257 36.709 10.409 7.455 1.00 32.62 C ATOM 1369 CZ TYR A 257 36.467 11.768 7.592 1.00 33.68 C ATOM 1370 OH TYR A 257 36.557 12.598 6.498 1.00 34.69 O ATOM 0 H TYR A 257 38.302 7.723 10.746 1.00 33.31 H new ATOM 0 HA TYR A 257 37.696 9.976 12.130 1.00 33.55 H new ATOM 0 HB2 TYR A 257 35.908 8.299 10.733 1.00 33.24 H new ATOM 0 HB3 TYR A 257 35.432 9.509 11.594 1.00 33.24 H new ATOM 0 HD1 TYR A 257 35.803 11.825 10.761 1.00 32.59 H new ATOM 0 HD2 TYR A 257 36.773 8.668 8.481 1.00 33.17 H new ATOM 0 HE1 TYR A 257 35.971 13.213 8.914 1.00 33.41 H new ATOM 0 HE2 TYR A 257 36.934 10.054 6.625 1.00 32.62 H new ATOM 0 HH TYR A 257 36.537 12.139 5.795 1.00 34.69 H new ATOM 1371 N VAL A 258 37.138 9.009 14.288 1.00 33.61 N ATOM 1372 CA VAL A 258 36.983 8.401 15.607 1.00 33.34 C ATOM 1373 C VAL A 258 35.651 8.845 16.221 1.00 33.66 C ATOM 1374 O VAL A 258 35.363 10.042 16.271 1.00 33.69 O ATOM 1375 CB VAL A 258 38.174 8.771 16.536 1.00 33.33 C ATOM 1376 CG1 VAL A 258 38.001 8.178 17.928 1.00 31.79 C ATOM 1377 CG2 VAL A 258 39.495 8.311 15.925 1.00 31.60 C ATOM 0 H VAL A 258 37.228 9.864 14.307 1.00 33.61 H new ATOM 0 HA VAL A 258 36.980 7.436 15.510 1.00 33.34 H new ATOM 0 HB VAL A 258 38.189 9.737 16.623 1.00 33.33 H new ATOM 0 HG11 VAL A 258 38.758 8.426 18.482 1.00 31.79 H new ATOM 0 HG12 VAL A 258 37.184 8.518 18.326 1.00 31.79 H new ATOM 0 HG13 VAL A 258 37.951 7.211 17.864 1.00 31.79 H new ATOM 0 HG21 VAL A 258 40.226 8.549 16.517 1.00 31.60 H new ATOM 0 HG22 VAL A 258 39.478 7.349 15.804 1.00 31.60 H new ATOM 0 HG23 VAL A 258 39.622 8.742 15.065 1.00 31.60 H new ATOM 1378 N PRO A 259 34.822 7.877 16.660 1.00 33.99 N ATOM 1379 CA PRO A 259 33.544 8.194 17.296 1.00 34.40 C ATOM 1380 C PRO A 259 33.713 8.905 18.636 1.00 35.04 C ATOM 1381 O PRO A 259 34.722 8.714 19.320 1.00 34.66 O ATOM 1382 CB PRO A 259 32.894 6.821 17.499 1.00 34.34 C ATOM 1383 CG PRO A 259 34.012 5.849 17.468 1.00 34.52 C ATOM 1384 CD PRO A 259 35.041 6.422 16.556 1.00 34.06 C ATOM 0 HA PRO A 259 33.017 8.802 16.755 1.00 34.40 H new ATOM 0 HB2 PRO A 259 32.419 6.780 18.344 1.00 34.34 H new ATOM 0 HB3 PRO A 259 32.248 6.633 16.800 1.00 34.34 H new ATOM 0 HG2 PRO A 259 34.376 5.712 18.357 1.00 34.52 H new ATOM 0 HG3 PRO A 259 33.710 4.984 17.149 1.00 34.52 H new ATOM 0 HD2 PRO A 259 35.938 6.175 16.830 1.00 34.06 H new ATOM 0 HD3 PRO A 259 34.926 6.108 15.646 1.00 34.06 H new ATOM 1385 N LEU A 260 32.732 9.730 18.987 1.00 35.71 N ATOM 1386 CA LEU A 260 32.721 10.408 20.278 1.00 36.12 C ATOM 1387 C LEU A 260 31.760 9.721 21.234 1.00 36.34 C ATOM 1388 O LEU A 260 30.645 9.359 20.853 1.00 36.62 O ATOM 1389 CB LEU A 260 32.378 11.892 20.117 1.00 36.16 C ATOM 1390 CG LEU A 260 33.540 12.780 19.649 1.00 37.43 C ATOM 1391 CD1 LEU A 260 33.037 14.080 19.037 1.00 37.50 C ATOM 1392 CD2 LEU A 260 34.524 13.057 20.794 1.00 36.19 C ATOM 0 H LEU A 260 32.057 9.912 18.486 1.00 35.71 H new ATOM 0 HA LEU A 260 33.612 10.354 20.657 1.00 36.12 H new ATOM 0 HB2 LEU A 260 31.650 11.975 19.482 1.00 36.16 H new ATOM 0 HB3 LEU A 260 32.053 12.229 20.967 1.00 36.16 H new ATOM 0 HG LEU A 260 34.016 12.294 18.957 1.00 37.43 H new ATOM 0 HD11 LEU A 260 33.793 14.617 18.752 1.00 37.50 H new ATOM 0 HD12 LEU A 260 32.475 13.881 18.272 1.00 37.50 H new ATOM 0 HD13 LEU A 260 32.522 14.571 19.697 1.00 37.50 H new ATOM 0 HD21 LEU A 260 35.246 13.619 20.472 1.00 36.19 H new ATOM 0 HD22 LEU A 260 34.061 13.509 21.516 1.00 36.19 H new ATOM 0 HD23 LEU A 260 34.887 12.218 21.119 1.00 36.19 H new ATOM 1393 N LEU A 261 32.207 9.535 22.473 1.00 36.26 N ATOM 1394 CA LEU A 261 31.442 8.790 23.470 1.00 36.39 C ATOM 1395 C LEU A 261 30.418 9.638 24.227 1.00 36.31 C ATOM 1396 O LEU A 261 29.471 9.098 24.801 1.00 36.23 O ATOM 1397 CB LEU A 261 32.381 8.059 24.442 1.00 36.57 C ATOM 1398 CG LEU A 261 33.151 6.848 23.886 1.00 38.32 C ATOM 1399 CD1 LEU A 261 34.243 6.397 24.847 1.00 36.21 C ATOM 1400 CD2 LEU A 261 32.216 5.684 23.563 1.00 38.60 C ATOM 0 H LEU A 261 32.960 9.836 22.759 1.00 36.26 H new ATOM 0 HA LEU A 261 30.924 8.136 22.975 1.00 36.39 H new ATOM 0 HB2 LEU A 261 33.027 8.700 24.777 1.00 36.57 H new ATOM 0 HB3 LEU A 261 31.857 7.761 25.202 1.00 36.57 H new ATOM 0 HG LEU A 261 33.570 7.135 23.059 1.00 38.32 H new ATOM 0 HD11 LEU A 261 34.710 5.634 24.471 1.00 36.21 H new ATOM 0 HD12 LEU A 261 34.871 7.123 24.988 1.00 36.21 H new ATOM 0 HD13 LEU A 261 33.845 6.146 25.695 1.00 36.21 H new ATOM 0 HD21 LEU A 261 32.733 4.940 23.216 1.00 38.60 H new ATOM 0 HD22 LEU A 261 31.753 5.407 24.369 1.00 38.60 H new ATOM 0 HD23 LEU A 261 31.567 5.964 22.898 1.00 38.60 H new ATOM 1401 N ASP A 262 30.601 10.959 24.220 1.00 36.31 N ATOM 1402 CA ASP A 262 29.643 11.873 24.847 1.00 36.39 C ATOM 1403 C ASP A 262 28.279 11.744 24.167 1.00 36.07 C ATOM 1404 O ASP A 262 28.180 11.922 22.952 1.00 36.26 O ATOM 1405 CB ASP A 262 30.129 13.326 24.773 1.00 36.47 C ATOM 1406 CG ASP A 262 31.533 13.504 25.317 1.00 37.50 C ATOM 1407 OD1 ASP A 262 31.671 13.957 26.472 1.00 38.27 O ATOM 1408 OD2 ASP A 262 32.498 13.188 24.589 1.00 37.80 O ATOM 0 H ASP A 262 31.276 11.348 23.856 1.00 36.31 H new ATOM 0 HA ASP A 262 29.563 11.630 25.783 1.00 36.39 H new ATOM 0 HB2 ASP A 262 30.104 13.625 23.850 1.00 36.47 H new ATOM 0 HB3 ASP A 262 29.519 13.892 25.271 1.00 36.47 H new ATOM 1409 N PRO A 263 27.228 11.413 24.943 1.00 35.86 N ATOM 1410 CA PRO A 263 25.876 11.260 24.392 1.00 35.38 C ATOM 1411 C PRO A 263 25.411 12.477 23.582 1.00 35.08 C ATOM 1412 O PRO A 263 24.766 12.311 22.544 1.00 35.01 O ATOM 1413 CB PRO A 263 25.004 11.083 25.641 1.00 35.45 C ATOM 1414 CG PRO A 263 25.924 10.516 26.662 1.00 36.27 C ATOM 1415 CD PRO A 263 27.261 11.146 26.395 1.00 36.16 C ATOM 0 HA PRO A 263 25.829 10.520 23.766 1.00 35.38 H new ATOM 0 HB2 PRO A 263 24.630 11.929 25.933 1.00 35.45 H new ATOM 0 HB3 PRO A 263 24.258 10.488 25.469 1.00 35.45 H new ATOM 0 HG2 PRO A 263 25.616 10.718 27.559 1.00 36.27 H new ATOM 0 HG3 PRO A 263 25.973 9.550 26.590 1.00 36.27 H new ATOM 0 HD2 PRO A 263 27.381 11.962 26.906 1.00 36.16 H new ATOM 0 HD3 PRO A 263 27.990 10.552 26.633 1.00 36.16 H new ATOM 1416 N ASP A 264 25.757 13.677 24.046 1.00 34.72 N ATOM 1417 CA ASP A 264 25.337 14.921 23.397 1.00 34.50 C ATOM 1418 C ASP A 264 26.386 15.522 22.449 1.00 34.41 C ATOM 1419 O ASP A 264 26.295 16.697 22.077 1.00 34.54 O ATOM 1420 CB ASP A 264 24.900 15.946 24.449 1.00 34.81 C ATOM 1421 CG ASP A 264 23.792 15.419 25.357 1.00 36.26 C ATOM 1422 OD1 ASP A 264 22.929 14.655 24.877 1.00 38.25 O ATOM 1423 OD2 ASP A 264 23.786 15.767 26.554 1.00 37.85 O ATOM 0 H ASP A 264 26.242 13.794 24.746 1.00 34.72 H new ATOM 0 HA ASP A 264 24.583 14.689 22.832 1.00 34.50 H new ATOM 0 HB2 ASP A 264 25.665 16.196 24.990 1.00 34.81 H new ATOM 0 HB3 ASP A 264 24.593 16.751 24.003 1.00 34.81 H new ATOM 1424 N ALA A 265 27.375 14.721 22.056 1.00 34.00 N ATOM 1425 CA ALA A 265 28.316 15.128 21.011 1.00 33.92 C ATOM 1426 C ALA A 265 27.647 14.912 19.656 1.00 34.23 C ATOM 1427 O ALA A 265 27.977 13.978 18.911 1.00 33.94 O ATOM 1428 CB ALA A 265 29.617 14.346 21.113 1.00 33.46 C ATOM 0 H ALA A 265 27.519 13.938 22.381 1.00 34.00 H new ATOM 0 HA ALA A 265 28.543 16.065 21.118 1.00 33.92 H new ATOM 0 HB1 ALA A 265 30.223 14.633 20.412 1.00 33.46 H new ATOM 0 HB2 ALA A 265 30.025 14.507 21.978 1.00 33.46 H new ATOM 0 HB3 ALA A 265 29.434 13.399 21.014 1.00 33.46 H new ATOM 1429 N ILE A 266 26.685 15.782 19.360 1.00 34.46 N ATOM 1430 CA ILE A 266 25.839 15.650 18.179 1.00 34.73 C ATOM 1431 C ILE A 266 25.725 16.962 17.408 1.00 35.48 C ATOM 1432 O ILE A 266 26.017 18.041 17.934 1.00 35.90 O ATOM 1433 CB ILE A 266 24.407 15.159 18.539 1.00 34.77 C ATOM 1434 CG1 ILE A 266 23.771 16.067 19.604 1.00 34.81 C ATOM 1435 CG2 ILE A 266 24.427 13.681 18.969 1.00 34.44 C ATOM 1436 CD1 ILE A 266 22.259 16.044 19.621 1.00 36.83 C ATOM 0 H ILE A 266 26.504 16.470 19.843 1.00 34.46 H new ATOM 0 HA ILE A 266 26.273 14.987 17.619 1.00 34.73 H new ATOM 0 HB ILE A 266 23.851 15.217 17.746 1.00 34.77 H new ATOM 0 HG12 ILE A 266 24.098 15.801 20.478 1.00 34.81 H new ATOM 0 HG13 ILE A 266 24.068 16.978 19.456 1.00 34.81 H new ATOM 0 HG21 ILE A 266 23.526 13.395 19.189 1.00 34.44 H new ATOM 0 HG22 ILE A 266 24.770 13.137 18.243 1.00 34.44 H new ATOM 0 HG23 ILE A 266 24.997 13.578 19.747 1.00 34.44 H new ATOM 0 HD11 ILE A 266 21.934 16.638 20.315 1.00 36.83 H new ATOM 0 HD12 ILE A 266 21.921 16.338 18.760 1.00 36.83 H new ATOM 0 HD13 ILE A 266 21.951 15.141 19.798 1.00 36.83 H new ATOM 1437 N THR A 267 25.294 16.852 16.159 1.00 35.82 N ATOM 1438 CA THR A 267 24.981 18.010 15.343 1.00 36.70 C ATOM 1439 C THR A 267 23.607 17.815 14.681 1.00 36.95 C ATOM 1440 O THR A 267 23.474 17.056 13.720 1.00 37.73 O ATOM 1441 CB THR A 267 26.112 18.332 14.320 1.00 37.10 C ATOM 1442 OG1 THR A 267 25.663 19.332 13.397 1.00 39.82 O ATOM 1443 CG2 THR A 267 26.567 17.075 13.551 1.00 36.92 C ATOM 0 H THR A 267 25.175 16.099 15.761 1.00 35.82 H new ATOM 0 HA THR A 267 24.929 18.792 15.914 1.00 36.70 H new ATOM 0 HB THR A 267 26.875 18.664 14.819 1.00 37.10 H new ATOM 0 HG1 THR A 267 26.071 20.052 13.543 1.00 39.82 H new ATOM 0 HG21 THR A 267 27.269 17.314 12.926 1.00 36.92 H new ATOM 0 HG22 THR A 267 26.904 16.416 14.178 1.00 36.92 H new ATOM 0 HG23 THR A 267 25.815 16.703 13.065 1.00 36.92 H new ATOM 1444 N PRO A 268 22.570 18.469 15.231 1.00 36.66 N ATOM 1445 CA PRO A 268 21.205 18.392 14.700 1.00 36.27 C ATOM 1446 C PRO A 268 21.050 18.960 13.288 1.00 35.79 C ATOM 1447 O PRO A 268 21.819 19.830 12.871 1.00 35.63 O ATOM 1448 CB PRO A 268 20.395 19.226 15.696 1.00 36.25 C ATOM 1449 CG PRO A 268 21.389 20.111 16.355 1.00 39.47 C ATOM 1450 CD PRO A 268 22.635 19.307 16.442 1.00 36.82 C ATOM 0 HA PRO A 268 20.919 17.469 14.615 1.00 36.27 H new ATOM 0 HB2 PRO A 268 19.709 19.743 15.245 1.00 36.25 H new ATOM 0 HB3 PRO A 268 19.945 18.661 16.343 1.00 36.25 H new ATOM 0 HG2 PRO A 268 21.531 20.921 15.841 1.00 39.47 H new ATOM 0 HG3 PRO A 268 21.086 20.383 17.235 1.00 39.47 H new ATOM 0 HD2 PRO A 268 23.426 19.869 16.449 1.00 36.82 H new ATOM 0 HD3 PRO A 268 22.661 18.771 17.250 1.00 36.82 H new ATOM 1451 N ILE A 269 20.064 18.443 12.562 1.00 35.17 N ATOM 1452 CA ILE A 269 19.723 18.937 11.233 1.00 35.10 C ATOM 1453 C ILE A 269 18.291 19.460 11.283 1.00 35.27 C ATOM 1454 O ILE A 269 17.394 18.768 11.756 1.00 34.74 O ATOM 1455 CB ILE A 269 19.877 17.836 10.142 1.00 35.05 C ATOM 1456 CG1 ILE A 269 21.329 17.335 10.085 1.00 34.76 C ATOM 1457 CG2 ILE A 269 19.420 18.365 8.763 1.00 34.51 C ATOM 1458 CD1 ILE A 269 21.538 16.049 9.291 1.00 34.68 C ATOM 0 H ILE A 269 19.571 17.791 12.829 1.00 35.17 H new ATOM 0 HA ILE A 269 20.336 19.647 10.987 1.00 35.10 H new ATOM 0 HB ILE A 269 19.307 17.087 10.379 1.00 35.05 H new ATOM 0 HG12 ILE A 269 21.882 18.031 9.698 1.00 34.76 H new ATOM 0 HG13 ILE A 269 21.644 17.194 10.992 1.00 34.76 H new ATOM 0 HG21 ILE A 269 19.523 17.667 8.098 1.00 34.51 H new ATOM 0 HG22 ILE A 269 18.488 18.631 8.811 1.00 34.51 H new ATOM 0 HG23 ILE A 269 19.961 19.130 8.514 1.00 34.51 H new ATOM 0 HD11 ILE A 269 22.477 15.807 9.307 1.00 34.68 H new ATOM 0 HD12 ILE A 269 21.014 15.335 9.687 1.00 34.68 H new ATOM 0 HD13 ILE A 269 21.256 16.186 8.373 1.00 34.68 H new ATOM 1459 N TYR A 270 18.098 20.692 10.816 1.00 35.97 N ATOM 1460 CA TYR A 270 16.793 21.345 10.832 1.00 36.10 C ATOM 1461 C TYR A 270 16.328 21.735 9.438 1.00 36.29 C ATOM 1462 O TYR A 270 17.140 22.029 8.558 1.00 35.66 O ATOM 1463 CB TYR A 270 16.829 22.629 11.672 1.00 36.23 C ATOM 1464 CG TYR A 270 17.296 22.477 13.100 1.00 36.30 C ATOM 1465 CD1 TYR A 270 16.429 22.027 14.100 1.00 36.10 C ATOM 1466 CD2 TYR A 270 18.595 22.819 13.460 1.00 35.07 C ATOM 1467 CE1 TYR A 270 16.857 21.899 15.423 1.00 33.19 C ATOM 1468 CE2 TYR A 270 19.034 22.697 14.773 1.00 36.16 C ATOM 1469 CZ TYR A 270 18.160 22.239 15.748 1.00 36.08 C ATOM 1470 OH TYR A 270 18.605 22.126 17.046 1.00 38.16 O ATOM 0 H TYR A 270 18.725 21.174 10.479 1.00 35.97 H new ATOM 0 HA TYR A 270 16.180 20.698 11.214 1.00 36.10 H new ATOM 0 HB2 TYR A 270 17.408 23.268 11.228 1.00 36.23 H new ATOM 0 HB3 TYR A 270 15.938 23.013 11.681 1.00 36.23 H new ATOM 0 HD1 TYR A 270 15.552 21.809 13.880 1.00 36.10 H new ATOM 0 HD2 TYR A 270 19.181 23.135 12.810 1.00 35.07 H new ATOM 0 HE1 TYR A 270 16.274 21.589 16.078 1.00 33.19 H new ATOM 0 HE2 TYR A 270 19.908 22.921 14.997 1.00 36.16 H new ATOM 0 HH TYR A 270 19.409 22.365 17.089 1.00 38.16 H new ATOM 1471 N ILE A 271 15.011 21.740 9.252 1.00 36.40 N ATOM 1472 CA ILE A 271 14.392 22.463 8.146 1.00 36.54 C ATOM 1473 C ILE A 271 13.686 23.700 8.715 1.00 36.70 C ATOM 1474 O ILE A 271 12.989 23.618 9.731 1.00 37.33 O ATOM 1475 CB ILE A 271 13.424 21.574 7.307 1.00 36.46 C ATOM 1476 CG1 ILE A 271 12.914 22.337 6.076 1.00 36.20 C ATOM 1477 CG2 ILE A 271 12.268 21.039 8.163 1.00 36.04 C ATOM 1478 CD1 ILE A 271 12.135 21.481 5.075 1.00 36.65 C ATOM 0 H ILE A 271 14.454 21.327 9.761 1.00 36.40 H new ATOM 0 HA ILE A 271 15.084 22.736 7.524 1.00 36.54 H new ATOM 0 HB ILE A 271 13.922 20.804 6.992 1.00 36.46 H new ATOM 0 HG12 ILE A 271 12.345 23.064 6.373 1.00 36.20 H new ATOM 0 HG13 ILE A 271 13.672 22.737 5.621 1.00 36.20 H new ATOM 0 HG21 ILE A 271 11.685 20.491 7.614 1.00 36.04 H new ATOM 0 HG22 ILE A 271 12.624 20.504 8.890 1.00 36.04 H new ATOM 0 HG23 ILE A 271 11.763 21.783 8.527 1.00 36.04 H new ATOM 0 HD11 ILE A 271 11.849 22.033 4.331 1.00 36.65 H new ATOM 0 HD12 ILE A 271 12.704 20.767 4.748 1.00 36.65 H new ATOM 0 HD13 ILE A 271 11.357 21.099 5.512 1.00 36.65 H new ATOM 1479 N ALA A 272 13.896 24.844 8.073 1.00 36.36 N ATOM 1480 CA ALA A 272 13.243 26.085 8.472 1.00 36.08 C ATOM 1481 C ALA A 272 12.339 26.582 7.354 1.00 36.12 C ATOM 1482 O ALA A 272 12.735 26.595 6.183 1.00 36.12 O ATOM 1483 CB ALA A 272 14.279 27.144 8.838 1.00 35.55 C ATOM 0 H ALA A 272 14.420 24.923 7.395 1.00 36.36 H new ATOM 0 HA ALA A 272 12.700 25.912 9.257 1.00 36.08 H new ATOM 0 HB1 ALA A 272 13.828 27.961 9.100 1.00 35.55 H new ATOM 0 HB2 ALA A 272 14.822 26.824 9.575 1.00 35.55 H new ATOM 0 HB3 ALA A 272 14.846 27.320 8.071 1.00 35.55 H new ATOM 1484 N VAL A 273 11.116 26.960 7.725 1.00 36.25 N ATOM 1485 CA VAL A 273 10.148 27.560 6.805 1.00 36.43 C ATOM 1486 C VAL A 273 9.504 28.789 7.459 1.00 36.58 C ATOM 1487 O VAL A 273 9.651 29.000 8.666 1.00 36.39 O ATOM 1488 CB VAL A 273 9.035 26.551 6.374 1.00 36.49 C ATOM 1489 CG1 VAL A 273 9.636 25.336 5.662 1.00 35.76 C ATOM 1490 CG2 VAL A 273 8.176 26.121 7.568 1.00 36.06 C ATOM 0 H VAL A 273 10.821 26.874 8.528 1.00 36.25 H new ATOM 0 HA VAL A 273 10.631 27.821 6.005 1.00 36.43 H new ATOM 0 HB VAL A 273 8.455 27.008 5.745 1.00 36.49 H new ATOM 0 HG11 VAL A 273 8.926 24.727 5.406 1.00 35.76 H new ATOM 0 HG12 VAL A 273 10.113 25.628 4.869 1.00 35.76 H new ATOM 0 HG13 VAL A 273 10.251 24.882 6.259 1.00 35.76 H new ATOM 0 HG21 VAL A 273 7.496 25.497 7.270 1.00 36.06 H new ATOM 0 HG22 VAL A 273 8.737 25.693 8.233 1.00 36.06 H new ATOM 0 HG23 VAL A 273 7.750 26.900 7.958 1.00 36.06 H new ATOM 1491 N ARG A 274 8.798 29.592 6.662 1.00 36.54 N ATOM 1492 CA ARG A 274 7.975 30.676 7.195 1.00 37.04 C ATOM 1493 C ARG A 274 6.949 30.099 8.159 1.00 37.13 C ATOM 1494 O ARG A 274 6.454 28.990 7.960 1.00 36.25 O ATOM 1495 CB ARG A 274 7.248 31.423 6.075 1.00 37.30 C ATOM 1496 CG ARG A 274 8.137 32.293 5.213 1.00 39.30 C ATOM 1497 CD ARG A 274 7.408 32.753 3.955 1.00 39.66 C ATOM 1498 NE ARG A 274 8.350 32.857 2.845 1.00 49.16 N ATOM 1499 CZ ARG A 274 8.417 32.013 1.819 1.00 47.68 C ATOM 1500 NH1 ARG A 274 7.573 30.998 1.715 1.00 43.58 N ATOM 1501 NH2 ARG A 274 9.328 32.202 0.877 1.00 50.16 N ATOM 0 H ARG A 274 8.783 29.524 5.805 1.00 36.54 H new ATOM 0 HA ARG A 274 8.556 31.303 7.654 1.00 37.04 H new ATOM 0 HB2 ARG A 274 6.802 30.775 5.507 1.00 37.30 H new ATOM 0 HB3 ARG A 274 6.557 31.978 6.469 1.00 37.30 H new ATOM 0 HG2 ARG A 274 8.428 33.066 5.722 1.00 39.30 H new ATOM 0 HG3 ARG A 274 8.934 31.799 4.965 1.00 39.30 H new ATOM 0 HD2 ARG A 274 6.702 32.126 3.733 1.00 39.66 H new ATOM 0 HD3 ARG A 274 6.985 33.612 4.112 1.00 39.66 H new ATOM 0 HE ARG A 274 8.904 33.514 2.855 1.00 49.16 H new ATOM 0 HH11 ARG A 274 6.970 30.877 2.316 1.00 43.58 H new ATOM 0 HH12 ARG A 274 7.628 30.460 1.046 1.00 43.58 H new ATOM 0 HH21 ARG A 274 9.871 32.867 0.931 1.00 50.16 H new ATOM 0 HH22 ARG A 274 9.377 31.660 0.211 1.00 50.16 H new ATOM 1502 N ASN A 275 6.636 30.863 9.200 1.00 38.22 N ATOM 1503 CA ASN A 275 5.704 30.434 10.236 1.00 39.63 C ATOM 1504 C ASN A 275 4.370 29.903 9.698 1.00 40.27 C ATOM 1505 O ASN A 275 3.901 28.846 10.126 1.00 40.71 O ATOM 1506 CB ASN A 275 5.453 31.576 11.222 1.00 39.92 C ATOM 1507 CG ASN A 275 4.931 31.089 12.556 1.00 43.34 C ATOM 1508 OD1 ASN A 275 3.921 31.584 13.056 1.00 46.80 O ATOM 1509 ND2 ASN A 275 5.618 30.112 13.142 1.00 45.37 N ATOM 0 H ASN A 275 6.960 31.649 9.326 1.00 38.22 H new ATOM 0 HA ASN A 275 6.129 29.686 10.685 1.00 39.63 H new ATOM 0 HB2 ASN A 275 6.278 32.066 11.361 1.00 39.92 H new ATOM 0 HB3 ASN A 275 4.816 32.197 10.836 1.00 39.92 H new ATOM 0 HD21 ASN A 275 5.361 29.801 13.901 1.00 45.37 H new ATOM 0 HD22 ASN A 275 6.319 29.791 12.761 1.00 45.37 H new ATOM 1510 N MET A 276 3.771 30.629 8.759 1.00 40.42 N ATOM 1511 CA MET A 276 2.449 30.258 8.249 1.00 41.34 C ATOM 1512 C MET A 276 2.510 29.545 6.893 1.00 40.84 C ATOM 1513 O MET A 276 1.538 29.557 6.134 1.00 40.88 O ATOM 1514 CB MET A 276 1.529 31.484 8.187 1.00 41.86 C ATOM 1515 CG MET A 276 1.339 32.204 9.524 1.00 47.10 C ATOM 1516 SD MET A 276 0.654 31.164 10.836 1.00 56.22 S ATOM 1517 CE MET A 276 -1.063 31.050 10.330 1.00 53.51 C ATOM 0 H MET A 276 4.108 31.336 8.404 1.00 40.42 H new ATOM 0 HA MET A 276 2.076 29.619 8.876 1.00 41.34 H new ATOM 0 HB2 MET A 276 1.890 32.113 7.543 1.00 41.86 H new ATOM 0 HB3 MET A 276 0.661 31.206 7.856 1.00 41.86 H new ATOM 0 HG2 MET A 276 2.195 32.553 9.816 1.00 47.10 H new ATOM 0 HG3 MET A 276 0.753 32.965 9.389 1.00 47.10 H new ATOM 0 HE1 MET A 276 -1.552 30.505 10.966 1.00 53.51 H new ATOM 0 HE2 MET A 276 -1.451 31.938 10.300 1.00 53.51 H new ATOM 0 HE3 MET A 276 -1.115 30.645 9.450 1.00 53.51 H new ATOM 1518 N GLU A 277 3.651 28.916 6.604 1.00 39.91 N ATOM 1519 CA GLU A 277 3.849 28.194 5.347 1.00 39.48 C ATOM 1520 C GLU A 277 2.860 27.040 5.187 1.00 39.42 C ATOM 1521 O GLU A 277 2.738 26.188 6.068 1.00 39.66 O ATOM 1522 CB GLU A 277 5.285 27.671 5.242 1.00 39.42 C ATOM 1523 CG GLU A 277 5.623 27.057 3.891 1.00 40.16 C ATOM 1524 CD GLU A 277 5.374 28.015 2.743 1.00 43.05 C ATOM 1525 OE1 GLU A 277 5.925 29.134 2.762 1.00 43.44 O ATOM 1526 OE2 GLU A 277 4.617 27.651 1.823 1.00 44.91 O ATOM 0 H GLU A 277 4.330 28.896 7.131 1.00 39.91 H new ATOM 0 HA GLU A 277 3.687 28.825 4.629 1.00 39.48 H new ATOM 0 HB2 GLU A 277 5.899 28.401 5.418 1.00 39.42 H new ATOM 0 HB3 GLU A 277 5.429 27.007 5.934 1.00 39.42 H new ATOM 0 HG2 GLU A 277 6.554 26.785 3.886 1.00 40.16 H new ATOM 0 HG3 GLU A 277 5.093 26.255 3.761 1.00 40.16 H new ATOM 1527 N GLU A 278 2.154 27.023 4.061 1.00 39.19 N ATOM 1528 CA GLU A 278 1.200 25.950 3.782 1.00 39.37 C ATOM 1529 C GLU A 278 1.224 25.482 2.325 1.00 38.76 C ATOM 1530 O GLU A 278 0.297 24.810 1.872 1.00 38.63 O ATOM 1531 CB GLU A 278 -0.222 26.339 4.225 1.00 39.16 C ATOM 1532 CG GLU A 278 -0.770 27.613 3.607 1.00 40.06 C ATOM 1533 CD GLU A 278 -2.158 27.954 4.115 1.00 40.14 C ATOM 1534 OE1 GLU A 278 -2.298 28.271 5.316 1.00 44.68 O ATOM 1535 OE2 GLU A 278 -3.112 27.912 3.312 1.00 41.71 O ATOM 0 H GLU A 278 2.211 27.621 3.446 1.00 39.19 H new ATOM 0 HA GLU A 278 1.486 25.189 4.311 1.00 39.37 H new ATOM 0 HB2 GLU A 278 -0.823 25.609 4.010 1.00 39.16 H new ATOM 0 HB3 GLU A 278 -0.229 26.437 5.190 1.00 39.16 H new ATOM 0 HG2 GLU A 278 -0.168 28.348 3.801 1.00 40.06 H new ATOM 0 HG3 GLU A 278 -0.797 27.516 2.642 1.00 40.06 H new ATOM 1536 N SER A 279 2.290 25.826 1.603 1.00 37.95 N ATOM 1537 CA SER A 279 2.423 25.433 0.201 1.00 37.93 C ATOM 1538 C SER A 279 2.559 23.925 0.049 1.00 37.53 C ATOM 1539 O SER A 279 3.351 23.283 0.748 1.00 37.22 O ATOM 1540 CB SER A 279 3.614 26.129 -0.462 1.00 38.18 C ATOM 1541 OG SER A 279 3.836 25.620 -1.766 1.00 40.42 O ATOM 0 H SER A 279 2.948 26.288 1.907 1.00 37.95 H new ATOM 0 HA SER A 279 1.609 25.713 -0.245 1.00 37.93 H new ATOM 0 HB2 SER A 279 3.451 27.084 -0.507 1.00 38.18 H new ATOM 0 HB3 SER A 279 4.409 26.002 0.078 1.00 38.18 H new ATOM 0 HG SER A 279 4.491 26.015 -2.113 1.00 40.42 H new ATOM 1542 N THR A 280 1.783 23.377 -0.881 1.00 36.98 N ATOM 1543 CA THR A 280 1.817 21.954 -1.204 1.00 37.54 C ATOM 1544 C THR A 280 3.207 21.495 -1.679 1.00 37.88 C ATOM 1545 O THR A 280 3.579 20.340 -1.482 1.00 38.19 O ATOM 1546 CB THR A 280 0.704 21.581 -2.232 1.00 37.87 C ATOM 1547 OG1 THR A 280 0.599 20.156 -2.349 1.00 40.25 O ATOM 1548 CG2 THR A 280 0.979 22.196 -3.605 1.00 37.27 C ATOM 0 H THR A 280 1.216 23.825 -1.347 1.00 36.98 H new ATOM 0 HA THR A 280 1.634 21.472 -0.382 1.00 37.54 H new ATOM 0 HB THR A 280 -0.135 21.942 -1.904 1.00 37.87 H new ATOM 0 HG1 THR A 280 -0.003 19.964 -2.903 1.00 40.25 H new ATOM 0 HG21 THR A 280 0.271 21.946 -4.219 1.00 37.27 H new ATOM 0 HG22 THR A 280 1.012 23.162 -3.526 1.00 37.27 H new ATOM 0 HG23 THR A 280 1.828 21.870 -3.941 1.00 37.27 H new ATOM 1549 N TYR A 281 3.969 22.408 -2.282 1.00 37.82 N ATOM 1550 CA TYR A 281 5.329 22.112 -2.733 1.00 38.61 C ATOM 1551 C TYR A 281 6.294 21.910 -1.567 1.00 39.23 C ATOM 1552 O TYR A 281 7.238 21.125 -1.669 1.00 39.47 O ATOM 1553 CB TYR A 281 5.852 23.213 -3.660 1.00 38.27 C ATOM 1554 CG TYR A 281 5.112 23.317 -4.976 1.00 38.35 C ATOM 1555 CD1 TYR A 281 5.330 22.390 -5.997 1.00 38.24 C ATOM 1556 CD2 TYR A 281 4.201 24.346 -5.204 1.00 37.10 C ATOM 1557 CE1 TYR A 281 4.654 22.482 -7.210 1.00 38.29 C ATOM 1558 CE2 TYR A 281 3.518 24.448 -6.415 1.00 37.80 C ATOM 1559 CZ TYR A 281 3.752 23.513 -7.412 1.00 38.09 C ATOM 1560 OH TYR A 281 3.084 23.608 -8.609 1.00 39.27 O ATOM 0 H TYR A 281 3.713 23.214 -2.441 1.00 37.82 H new ATOM 0 HA TYR A 281 5.283 21.278 -3.226 1.00 38.61 H new ATOM 0 HB2 TYR A 281 5.794 24.065 -3.199 1.00 38.27 H new ATOM 0 HB3 TYR A 281 6.791 23.051 -3.840 1.00 38.27 H new ATOM 0 HD1 TYR A 281 5.938 21.699 -5.864 1.00 38.24 H new ATOM 0 HD2 TYR A 281 4.046 24.975 -4.537 1.00 37.10 H new ATOM 0 HE1 TYR A 281 4.807 21.856 -7.880 1.00 38.29 H new ATOM 0 HE2 TYR A 281 2.910 25.138 -6.553 1.00 37.80 H new ATOM 0 HH TYR A 281 2.573 24.274 -8.593 1.00 39.27 H new ATOM 1561 N ILE A 282 6.052 22.619 -0.466 1.00 39.57 N ATOM 1562 CA ILE A 282 6.865 22.478 0.742 1.00 40.20 C ATOM 1563 C ILE A 282 6.455 21.233 1.532 1.00 40.28 C ATOM 1564 O ILE A 282 7.311 20.509 2.045 1.00 40.48 O ATOM 1565 CB ILE A 282 6.832 23.761 1.629 1.00 40.31 C ATOM 1566 CG1 ILE A 282 7.356 24.978 0.851 1.00 40.29 C ATOM 1567 CG2 ILE A 282 7.637 23.568 2.923 1.00 41.44 C ATOM 1568 CD1 ILE A 282 8.772 24.824 0.276 1.00 42.75 C ATOM 0 H ILE A 282 5.415 23.193 -0.398 1.00 39.57 H new ATOM 0 HA ILE A 282 7.786 22.363 0.460 1.00 40.20 H new ATOM 0 HB ILE A 282 5.907 23.924 1.872 1.00 40.31 H new ATOM 0 HG12 ILE A 282 6.745 25.166 0.122 1.00 40.29 H new ATOM 0 HG13 ILE A 282 7.343 25.750 1.438 1.00 40.29 H new ATOM 0 HG21 ILE A 282 7.598 24.380 3.452 1.00 41.44 H new ATOM 0 HG22 ILE A 282 7.261 22.833 3.432 1.00 41.44 H new ATOM 0 HG23 ILE A 282 8.561 23.370 2.703 1.00 41.44 H new ATOM 0 HD11 ILE A 282 9.020 25.634 -0.196 1.00 42.75 H new ATOM 0 HD12 ILE A 282 9.400 24.667 0.999 1.00 42.75 H new ATOM 0 HD13 ILE A 282 8.792 24.074 -0.338 1.00 42.75 H new ATOM 1569 N TYR A 283 5.151 20.983 1.612 1.00 40.63 N ATOM 1570 CA TYR A 283 4.633 19.746 2.195 1.00 40.94 C ATOM 1571 C TYR A 283 5.173 18.521 1.456 1.00 40.52 C ATOM 1572 O TYR A 283 5.546 17.528 2.083 1.00 40.76 O ATOM 1573 CB TYR A 283 3.101 19.731 2.182 1.00 41.34 C ATOM 1574 CG TYR A 283 2.512 18.374 2.508 1.00 43.97 C ATOM 1575 CD1 TYR A 283 2.065 17.522 1.495 1.00 44.52 C ATOM 1576 CD2 TYR A 283 2.418 17.933 3.830 1.00 45.43 C ATOM 1577 CE1 TYR A 283 1.531 16.269 1.792 1.00 44.88 C ATOM 1578 CE2 TYR A 283 1.883 16.683 4.135 1.00 44.96 C ATOM 1579 CZ TYR A 283 1.446 15.859 3.113 1.00 43.31 C ATOM 1580 OH TYR A 283 0.917 14.626 3.416 1.00 45.63 O ATOM 0 H TYR A 283 4.543 21.523 1.331 1.00 40.63 H new ATOM 0 HA TYR A 283 4.936 19.710 3.116 1.00 40.94 H new ATOM 0 HB2 TYR A 283 2.772 20.382 2.822 1.00 41.34 H new ATOM 0 HB3 TYR A 283 2.789 20.011 1.307 1.00 41.34 H new ATOM 0 HD1 TYR A 283 2.125 17.795 0.608 1.00 44.52 H new ATOM 0 HD2 TYR A 283 2.717 18.483 4.518 1.00 45.43 H new ATOM 0 HE1 TYR A 283 1.234 15.712 1.109 1.00 44.88 H new ATOM 0 HE2 TYR A 283 1.820 16.404 5.020 1.00 44.96 H new ATOM 0 HH TYR A 283 0.929 14.512 4.248 1.00 45.63 H new ATOM 1581 N SER A 284 5.199 18.603 0.127 1.00 39.97 N ATOM 1582 CA SER A 284 5.768 17.557 -0.720 1.00 39.95 C ATOM 1583 C SER A 284 7.259 17.348 -0.449 1.00 39.87 C ATOM 1584 O SER A 284 7.733 16.210 -0.431 1.00 40.20 O ATOM 1585 CB SER A 284 5.554 17.886 -2.195 1.00 39.63 C ATOM 1586 OG SER A 284 6.268 16.981 -3.016 1.00 41.53 O ATOM 0 H SER A 284 4.884 19.273 -0.311 1.00 39.97 H new ATOM 0 HA SER A 284 5.306 16.732 -0.502 1.00 39.95 H new ATOM 0 HB2 SER A 284 4.608 17.845 -2.407 1.00 39.63 H new ATOM 0 HB3 SER A 284 5.846 18.793 -2.375 1.00 39.63 H new ATOM 0 HG SER A 284 6.038 17.088 -3.817 1.00 41.53 H new ATOM 1587 N LEU A 285 7.987 18.445 -0.250 1.00 39.60 N ATOM 1588 CA LEU A 285 9.409 18.385 0.104 1.00 39.65 C ATOM 1589 C LEU A 285 9.605 17.676 1.441 1.00 39.89 C ATOM 1590 O LEU A 285 10.496 16.838 1.584 1.00 40.01 O ATOM 1591 CB LEU A 285 10.028 19.790 0.150 1.00 39.20 C ATOM 1592 CG LEU A 285 11.506 19.917 0.563 1.00 40.06 C ATOM 1593 CD1 LEU A 285 12.436 19.239 -0.439 1.00 36.27 C ATOM 1594 CD2 LEU A 285 11.897 21.378 0.757 1.00 39.62 C ATOM 0 H LEU A 285 7.674 19.243 -0.316 1.00 39.60 H new ATOM 0 HA LEU A 285 9.863 17.876 -0.585 1.00 39.65 H new ATOM 0 HB2 LEU A 285 9.930 20.186 -0.730 1.00 39.20 H new ATOM 0 HB3 LEU A 285 9.501 20.327 0.763 1.00 39.20 H new ATOM 0 HG LEU A 285 11.606 19.458 1.412 1.00 40.06 H new ATOM 0 HD11 LEU A 285 13.355 19.339 -0.147 1.00 36.27 H new ATOM 0 HD12 LEU A 285 12.217 18.296 -0.497 1.00 36.27 H new ATOM 0 HD13 LEU A 285 12.328 19.650 -1.311 1.00 36.27 H new ATOM 0 HD21 LEU A 285 12.830 21.432 1.016 1.00 39.62 H new ATOM 0 HD22 LEU A 285 11.764 21.862 -0.073 1.00 39.62 H new ATOM 0 HD23 LEU A 285 11.346 21.771 1.452 1.00 39.62 H new ATOM 1595 N TYR A 286 8.758 18.017 2.409 1.00 39.84 N ATOM 1596 CA TYR A 286 8.811 17.422 3.735 1.00 39.96 C ATOM 1597 C TYR A 286 8.491 15.928 3.702 1.00 39.71 C ATOM 1598 O TYR A 286 9.114 15.143 4.416 1.00 40.10 O ATOM 1599 CB TYR A 286 7.854 18.151 4.678 1.00 40.26 C ATOM 1600 CG TYR A 286 8.084 17.842 6.136 1.00 41.78 C ATOM 1601 CD1 TYR A 286 9.048 18.534 6.872 1.00 43.19 C ATOM 1602 CD2 TYR A 286 7.341 16.857 6.785 1.00 42.54 C ATOM 1603 CE1 TYR A 286 9.264 18.253 8.216 1.00 41.50 C ATOM 1604 CE2 TYR A 286 7.548 16.570 8.128 1.00 42.71 C ATOM 1605 CZ TYR A 286 8.511 17.271 8.836 1.00 41.46 C ATOM 1606 OH TYR A 286 8.719 16.993 10.166 1.00 42.29 O ATOM 0 H TYR A 286 8.135 18.602 2.312 1.00 39.84 H new ATOM 0 HA TYR A 286 9.718 17.517 4.064 1.00 39.96 H new ATOM 0 HB2 TYR A 286 7.943 19.107 4.541 1.00 40.26 H new ATOM 0 HB3 TYR A 286 6.942 17.915 4.446 1.00 40.26 H new ATOM 0 HD1 TYR A 286 9.554 19.194 6.456 1.00 43.19 H new ATOM 0 HD2 TYR A 286 6.696 16.384 6.311 1.00 42.54 H new ATOM 0 HE1 TYR A 286 9.909 18.721 8.695 1.00 41.50 H new ATOM 0 HE2 TYR A 286 7.044 15.912 8.549 1.00 42.71 H new ATOM 0 HH TYR A 286 8.225 16.355 10.400 1.00 42.29 H new ATOM 1607 N GLU A 287 7.525 15.543 2.871 1.00 39.16 N ATOM 1608 CA GLU A 287 7.164 14.134 2.709 1.00 38.81 C ATOM 1609 C GLU A 287 8.259 13.334 2.016 1.00 37.92 C ATOM 1610 O GLU A 287 8.424 12.143 2.280 1.00 37.68 O ATOM 1611 CB GLU A 287 5.837 13.987 1.962 1.00 38.79 C ATOM 1612 CG GLU A 287 4.628 14.280 2.824 1.00 43.84 C ATOM 1613 CD GLU A 287 4.615 13.466 4.110 1.00 48.00 C ATOM 1614 OE1 GLU A 287 4.634 14.078 5.201 1.00 49.31 O ATOM 1615 OE2 GLU A 287 4.602 12.218 4.026 1.00 48.69 O ATOM 0 H GLU A 287 7.063 16.085 2.389 1.00 39.16 H new ATOM 0 HA GLU A 287 7.059 13.768 3.601 1.00 38.81 H new ATOM 0 HB2 GLU A 287 5.835 14.586 1.199 1.00 38.79 H new ATOM 0 HB3 GLU A 287 5.767 13.084 1.614 1.00 38.79 H new ATOM 0 HG2 GLU A 287 4.613 15.225 3.043 1.00 43.84 H new ATOM 0 HG3 GLU A 287 3.822 14.093 2.319 1.00 43.84 H new ATOM 1616 N THR A 288 9.003 13.999 1.134 1.00 37.50 N ATOM 1617 CA THR A 288 10.165 13.400 0.482 1.00 37.25 C ATOM 1618 C THR A 288 11.249 13.067 1.516 1.00 37.37 C ATOM 1619 O THR A 288 11.863 11.996 1.453 1.00 37.44 O ATOM 1620 CB THR A 288 10.731 14.324 -0.621 1.00 37.17 C ATOM 1621 OG1 THR A 288 9.683 14.687 -1.530 1.00 36.40 O ATOM 1622 CG2 THR A 288 11.846 13.632 -1.395 1.00 36.47 C ATOM 0 H THR A 288 8.848 14.811 0.897 1.00 37.50 H new ATOM 0 HA THR A 288 9.876 12.576 0.058 1.00 37.25 H new ATOM 0 HB THR A 288 11.093 15.117 -0.196 1.00 37.17 H new ATOM 0 HG1 THR A 288 9.134 15.189 -1.139 1.00 36.40 H new ATOM 0 HG21 THR A 288 12.184 14.230 -2.080 1.00 36.47 H new ATOM 0 HG22 THR A 288 12.565 13.397 -0.787 1.00 36.47 H new ATOM 0 HG23 THR A 288 11.500 12.827 -1.811 1.00 36.47 H new ATOM 1623 N ILE A 289 11.476 13.983 2.461 1.00 37.15 N ATOM 1624 CA ILE A 289 12.395 13.739 3.581 1.00 37.21 C ATOM 1625 C ILE A 289 11.934 12.496 4.350 1.00 38.10 C ATOM 1626 O ILE A 289 12.730 11.595 4.620 1.00 38.47 O ATOM 1627 CB ILE A 289 12.480 14.954 4.553 1.00 37.17 C ATOM 1628 CG1 ILE A 289 12.988 16.207 3.831 1.00 36.29 C ATOM 1629 CG2 ILE A 289 13.378 14.635 5.755 1.00 36.90 C ATOM 1630 CD1 ILE A 289 12.670 17.509 4.553 1.00 36.84 C ATOM 0 H ILE A 289 11.105 14.759 2.472 1.00 37.15 H new ATOM 0 HA ILE A 289 13.281 13.602 3.212 1.00 37.21 H new ATOM 0 HB ILE A 289 11.583 15.131 4.877 1.00 37.17 H new ATOM 0 HG12 ILE A 289 13.949 16.137 3.718 1.00 36.29 H new ATOM 0 HG13 ILE A 289 12.599 16.237 2.943 1.00 36.29 H new ATOM 0 HG21 ILE A 289 13.415 15.404 6.344 1.00 36.90 H new ATOM 0 HG22 ILE A 289 13.015 13.876 6.238 1.00 36.90 H new ATOM 0 HG23 ILE A 289 14.272 14.423 5.444 1.00 36.90 H new ATOM 0 HD11 ILE A 289 13.019 18.256 4.042 1.00 36.84 H new ATOM 0 HD12 ILE A 289 11.709 17.602 4.645 1.00 36.84 H new ATOM 0 HD13 ILE A 289 13.079 17.500 5.432 1.00 36.84 H new ATOM 1631 N ARG A 290 10.642 12.457 4.681 1.00 38.25 N ATOM 1632 CA ARG A 290 10.045 11.338 5.406 1.00 39.29 C ATOM 1633 C ARG A 290 10.253 10.009 4.671 1.00 39.12 C ATOM 1634 O ARG A 290 10.612 9.007 5.293 1.00 39.06 O ATOM 1635 CB ARG A 290 8.553 11.601 5.666 1.00 39.18 C ATOM 1636 CG ARG A 290 7.770 10.391 6.157 1.00 41.12 C ATOM 1637 CD ARG A 290 6.309 10.719 6.433 1.00 40.84 C ATOM 1638 NE ARG A 290 6.094 11.084 7.832 1.00 49.80 N ATOM 1639 CZ ARG A 290 6.073 12.330 8.301 1.00 51.74 C ATOM 1640 NH1 ARG A 290 6.248 13.365 7.487 1.00 52.26 N ATOM 1641 NH2 ARG A 290 5.871 12.539 9.593 1.00 53.30 N ATOM 0 H ARG A 290 10.085 13.084 4.489 1.00 38.25 H new ATOM 0 HA ARG A 290 10.497 11.264 6.261 1.00 39.29 H new ATOM 0 HB2 ARG A 290 8.472 12.311 6.322 1.00 39.18 H new ATOM 0 HB3 ARG A 290 8.146 11.923 4.847 1.00 39.18 H new ATOM 0 HG2 ARG A 290 7.821 9.685 5.494 1.00 41.12 H new ATOM 0 HG3 ARG A 290 8.181 10.050 6.967 1.00 41.12 H new ATOM 0 HD2 ARG A 290 6.027 11.449 5.860 1.00 40.84 H new ATOM 0 HD3 ARG A 290 5.757 9.953 6.209 1.00 40.84 H new ATOM 0 HE ARG A 290 5.972 10.445 8.395 1.00 49.80 H new ATOM 0 HH11 ARG A 290 6.377 13.234 6.647 1.00 52.26 H new ATOM 0 HH12 ARG A 290 6.233 14.166 7.800 1.00 52.26 H new ATOM 0 HH21 ARG A 290 5.754 11.872 10.123 1.00 53.30 H new ATOM 0 HH22 ARG A 290 5.856 13.342 9.902 1.00 53.30 H new ATOM 1642 N GLN A 291 10.036 10.016 3.356 1.00 39.22 N ATOM 1643 CA GLN A 291 10.219 8.826 2.522 1.00 39.96 C ATOM 1644 C GLN A 291 11.665 8.330 2.529 1.00 39.68 C ATOM 1645 O GLN A 291 11.910 7.129 2.657 1.00 39.90 O ATOM 1646 CB GLN A 291 9.764 9.091 1.083 1.00 39.70 C ATOM 1647 CG GLN A 291 8.254 9.113 0.900 1.00 42.22 C ATOM 1648 CD GLN A 291 7.821 9.252 -0.554 1.00 41.18 C ATOM 1649 OE1 GLN A 291 6.639 9.456 -0.836 1.00 47.35 O ATOM 1650 NE2 GLN A 291 8.771 9.136 -1.482 1.00 43.58 N ATOM 0 H GLN A 291 9.778 10.712 2.921 1.00 39.22 H new ATOM 0 HA GLN A 291 9.666 8.128 2.907 1.00 39.96 H new ATOM 0 HB2 GLN A 291 10.127 9.942 0.791 1.00 39.70 H new ATOM 0 HB3 GLN A 291 10.140 8.409 0.505 1.00 39.70 H new ATOM 0 HG2 GLN A 291 7.879 8.296 1.265 1.00 42.22 H new ATOM 0 HG3 GLN A 291 7.884 9.849 1.412 1.00 42.22 H new ATOM 0 HE21 GLN A 291 9.586 8.994 -1.248 1.00 43.58 H new ATOM 0 HE22 GLN A 291 8.569 9.204 -2.315 1.00 43.58 H new ATOM 1651 N ILE A 292 12.612 9.256 2.391 1.00 39.47 N ATOM 1652 CA ILE A 292 14.041 8.922 2.403 1.00 39.23 C ATOM 1653 C ILE A 292 14.472 8.391 3.774 1.00 39.41 C ATOM 1654 O ILE A 292 15.170 7.382 3.856 1.00 39.49 O ATOM 1655 CB ILE A 292 14.924 10.128 1.954 1.00 38.90 C ATOM 1656 CG1 ILE A 292 14.703 10.450 0.463 1.00 37.95 C ATOM 1657 CG2 ILE A 292 16.411 9.888 2.257 1.00 37.21 C ATOM 1658 CD1 ILE A 292 15.127 9.350 -0.524 1.00 36.48 C ATOM 0 H ILE A 292 12.448 10.094 2.288 1.00 39.47 H new ATOM 0 HA ILE A 292 14.178 8.214 1.754 1.00 39.23 H new ATOM 0 HB ILE A 292 14.647 10.900 2.471 1.00 38.90 H new ATOM 0 HG12 ILE A 292 13.762 10.640 0.326 1.00 37.95 H new ATOM 0 HG13 ILE A 292 15.190 11.261 0.248 1.00 37.95 H new ATOM 0 HG21 ILE A 292 16.929 10.655 1.966 1.00 37.21 H new ATOM 0 HG22 ILE A 292 16.531 9.761 3.211 1.00 37.21 H new ATOM 0 HG23 ILE A 292 16.714 9.096 1.786 1.00 37.21 H new ATOM 0 HD11 ILE A 292 14.950 9.643 -1.431 1.00 36.48 H new ATOM 0 HD12 ILE A 292 16.075 9.171 -0.422 1.00 36.48 H new ATOM 0 HD13 ILE A 292 14.624 8.541 -0.343 1.00 36.48 H new ATOM 1659 N TYR A 293 14.027 9.062 4.837 1.00 39.78 N ATOM 1660 CA TYR A 293 14.329 8.664 6.216 1.00 40.06 C ATOM 1661 C TYR A 293 13.818 7.263 6.542 1.00 40.34 C ATOM 1662 O TYR A 293 14.522 6.477 7.179 1.00 40.14 O ATOM 1663 CB TYR A 293 13.751 9.677 7.213 1.00 39.78 C ATOM 1664 CG TYR A 293 14.634 10.884 7.490 1.00 40.90 C ATOM 1665 CD1 TYR A 293 15.429 11.447 6.488 1.00 38.14 C ATOM 1666 CD2 TYR A 293 14.653 11.477 8.753 1.00 38.89 C ATOM 1667 CE1 TYR A 293 16.232 12.557 6.740 1.00 38.46 C ATOM 1668 CE2 TYR A 293 15.449 12.590 9.014 1.00 40.62 C ATOM 1669 CZ TYR A 293 16.235 13.124 8.002 1.00 40.41 C ATOM 1670 OH TYR A 293 17.027 14.222 8.255 1.00 40.45 O ATOM 0 H TYR A 293 13.537 9.767 4.779 1.00 39.78 H new ATOM 0 HA TYR A 293 15.296 8.649 6.297 1.00 40.06 H new ATOM 0 HB2 TYR A 293 12.896 9.989 6.877 1.00 39.78 H new ATOM 0 HB3 TYR A 293 13.577 9.222 8.052 1.00 39.78 H new ATOM 0 HD1 TYR A 293 15.422 11.073 5.636 1.00 38.14 H new ATOM 0 HD2 TYR A 293 14.125 11.123 9.432 1.00 38.89 H new ATOM 0 HE1 TYR A 293 16.762 12.914 6.065 1.00 38.46 H new ATOM 0 HE2 TYR A 293 15.454 12.973 9.861 1.00 40.62 H new ATOM 0 HH TYR A 293 17.517 14.373 7.590 1.00 40.45 H new ATOM 1671 N ALA A 294 12.596 6.960 6.101 1.00 40.93 N ATOM 1672 CA ALA A 294 11.982 5.651 6.331 1.00 41.84 C ATOM 1673 C ALA A 294 12.770 4.524 5.665 1.00 42.72 C ATOM 1674 O ALA A 294 12.946 3.458 6.254 1.00 43.01 O ATOM 1675 CB ALA A 294 10.531 5.645 5.859 1.00 41.65 C ATOM 0 H ALA A 294 12.100 7.507 5.660 1.00 40.93 H new ATOM 0 HA ALA A 294 11.999 5.489 7.287 1.00 41.84 H new ATOM 0 HB1 ALA A 294 10.142 4.771 6.019 1.00 41.65 H new ATOM 0 HB2 ALA A 294 10.029 6.316 6.347 1.00 41.65 H new ATOM 0 HB3 ALA A 294 10.498 5.844 4.910 1.00 41.65 H new ATOM 1676 N TYR A 295 13.246 4.769 4.445 1.00 43.63 N ATOM 1677 CA TYR A 295 14.046 3.785 3.713 1.00 44.85 C ATOM 1678 C TYR A 295 15.420 3.582 4.356 1.00 45.50 C ATOM 1679 O TYR A 295 15.989 2.493 4.285 1.00 45.10 O ATOM 1680 CB TYR A 295 14.199 4.187 2.243 1.00 45.07 C ATOM 1681 CG TYR A 295 14.667 3.060 1.346 1.00 47.16 C ATOM 1682 CD1 TYR A 295 16.021 2.889 1.056 1.00 48.32 C ATOM 1683 CD2 TYR A 295 13.756 2.160 0.788 1.00 47.42 C ATOM 1684 CE1 TYR A 295 16.457 1.850 0.235 1.00 48.22 C ATOM 1685 CE2 TYR A 295 14.182 1.119 -0.037 1.00 47.57 C ATOM 1686 CZ TYR A 295 15.533 0.972 -0.309 1.00 47.49 C ATOM 1687 OH TYR A 295 15.964 -0.051 -1.122 1.00 48.03 O ATOM 0 H TYR A 295 13.116 5.505 4.020 1.00 43.63 H new ATOM 0 HA TYR A 295 13.571 2.940 3.755 1.00 44.85 H new ATOM 0 HB2 TYR A 295 13.347 4.517 1.916 1.00 45.07 H new ATOM 0 HB3 TYR A 295 14.830 4.921 2.181 1.00 45.07 H new ATOM 0 HD1 TYR A 295 16.643 3.478 1.417 1.00 48.32 H new ATOM 0 HD2 TYR A 295 12.849 2.257 0.970 1.00 47.42 H new ATOM 0 HE1 TYR A 295 17.363 1.747 0.053 1.00 48.22 H new ATOM 0 HE2 TYR A 295 13.564 0.528 -0.402 1.00 47.57 H new ATOM 0 HH TYR A 295 15.304 -0.503 -1.378 1.00 48.03 H new ATOM 1688 N GLU A 296 15.938 4.635 4.985 1.00 46.68 N ATOM 1689 CA GLU A 296 17.231 4.578 5.669 1.00 47.90 C ATOM 1690 C GLU A 296 17.152 3.917 7.045 1.00 48.57 C ATOM 1691 O GLU A 296 18.175 3.522 7.607 1.00 48.49 O ATOM 1692 CB GLU A 296 17.836 5.980 5.795 1.00 47.93 C ATOM 1693 CG GLU A 296 18.384 6.541 4.495 1.00 50.08 C ATOM 1694 CD GLU A 296 19.442 5.651 3.874 1.00 53.27 C ATOM 1695 OE1 GLU A 296 20.566 5.587 4.420 1.00 54.99 O ATOM 1696 OE2 GLU A 296 19.149 5.018 2.837 1.00 55.67 O ATOM 0 H GLU A 296 15.551 5.402 5.028 1.00 46.68 H new ATOM 0 HA GLU A 296 17.806 4.022 5.120 1.00 47.90 H new ATOM 0 HB2 GLU A 296 17.158 6.584 6.136 1.00 47.93 H new ATOM 0 HB3 GLU A 296 18.550 5.955 6.451 1.00 47.93 H new ATOM 0 HG2 GLU A 296 17.656 6.659 3.865 1.00 50.08 H new ATOM 0 HG3 GLU A 296 18.761 7.419 4.660 1.00 50.08 H new ATOM 1697 N GLY A 297 15.940 3.803 7.581 1.00 49.49 N ATOM 1698 CA GLY A 297 15.734 3.246 8.913 1.00 50.71 C ATOM 1699 C GLY A 297 15.828 4.284 10.018 1.00 51.91 C ATOM 1700 O GLY A 297 15.828 3.936 11.200 1.00 52.02 O ATOM 0 H GLY A 297 15.217 4.046 7.184 1.00 49.49 H new ATOM 0 HA2 GLY A 297 14.862 2.823 8.949 1.00 50.71 H new ATOM 0 HA3 GLY A 297 16.393 2.552 9.072 1.00 50.71 H new ATOM 1701 N PHE A 298 15.917 5.558 9.635 1.00 53.00 N ATOM 1702 CA PHE A 298 15.910 6.661 10.594 1.00 54.21 C ATOM 1703 C PHE A 298 14.501 6.899 11.122 1.00 55.09 C ATOM 1704 O PHE A 298 13.517 6.559 10.458 1.00 55.34 O ATOM 1705 CB PHE A 298 16.442 7.954 9.960 1.00 54.39 C ATOM 1706 CG PHE A 298 17.920 7.936 9.668 1.00 55.89 C ATOM 1707 CD1 PHE A 298 18.836 7.528 10.636 1.00 57.35 C ATOM 1708 CD2 PHE A 298 18.398 8.356 8.432 1.00 56.41 C ATOM 1709 CE1 PHE A 298 20.203 7.517 10.365 1.00 57.66 C ATOM 1710 CE2 PHE A 298 19.763 8.349 8.153 1.00 56.54 C ATOM 1711 CZ PHE A 298 20.667 7.931 9.121 1.00 56.07 C ATOM 0 H PHE A 298 15.983 5.806 8.814 1.00 53.00 H new ATOM 0 HA PHE A 298 16.493 6.413 11.328 1.00 54.21 H new ATOM 0 HB2 PHE A 298 15.961 8.119 9.134 1.00 54.39 H new ATOM 0 HB3 PHE A 298 16.249 8.697 10.553 1.00 54.39 H new ATOM 0 HD1 PHE A 298 18.531 7.260 11.473 1.00 57.35 H new ATOM 0 HD2 PHE A 298 17.799 8.646 7.783 1.00 56.41 H new ATOM 0 HE1 PHE A 298 20.804 7.233 11.015 1.00 57.66 H new ATOM 0 HE2 PHE A 298 20.069 8.624 7.319 1.00 56.54 H new ATOM 0 HZ PHE A 298 21.579 7.928 8.938 1.00 56.07 H new ATOM 1712 N THR A 299 14.411 7.481 12.317 1.00 55.83 N ATOM 1713 CA THR A 299 13.131 7.895 12.882 1.00 56.66 C ATOM 1714 C THR A 299 12.529 8.983 11.995 1.00 57.59 C ATOM 1715 O THR A 299 13.193 9.973 11.675 1.00 57.59 O ATOM 1716 CB THR A 299 13.284 8.406 14.337 1.00 56.64 C ATOM 1717 OG1 THR A 299 13.925 7.403 15.135 1.00 56.31 O ATOM 1718 CG2 THR A 299 11.925 8.733 14.950 1.00 56.34 C ATOM 0 H THR A 299 15.089 7.646 12.820 1.00 55.83 H new ATOM 0 HA THR A 299 12.541 7.126 12.911 1.00 56.66 H new ATOM 0 HB THR A 299 13.821 9.214 14.318 1.00 56.64 H new ATOM 0 HG1 THR A 299 14.008 7.682 15.923 1.00 56.31 H new ATOM 0 HG21 THR A 299 12.047 9.050 15.859 1.00 56.34 H new ATOM 0 HG22 THR A 299 11.490 9.422 14.424 1.00 56.34 H new ATOM 0 HG23 THR A 299 11.373 7.935 14.958 1.00 56.34 H new ATOM 1719 N GLU A 300 11.283 8.776 11.576 1.00 58.47 N ATOM 1720 CA GLU A 300 10.578 9.739 10.737 1.00 59.30 C ATOM 1721 C GLU A 300 10.421 11.083 11.454 1.00 59.82 C ATOM 1722 O GLU A 300 10.134 11.113 12.655 1.00 59.90 O ATOM 1723 CB GLU A 300 9.207 9.195 10.322 1.00 59.34 C ATOM 1724 CG GLU A 300 9.245 8.216 9.150 1.00 59.60 C ATOM 1725 CD GLU A 300 7.858 7.783 8.690 1.00 59.47 C ATOM 1726 OE1 GLU A 300 6.877 8.513 8.948 1.00 60.04 O ATOM 1727 OE2 GLU A 300 7.749 6.708 8.062 1.00 59.93 O ATOM 0 H GLU A 300 10.824 8.075 11.770 1.00 58.47 H new ATOM 0 HA GLU A 300 11.110 9.881 9.938 1.00 59.30 H new ATOM 0 HB2 GLU A 300 8.802 8.754 11.085 1.00 59.34 H new ATOM 0 HB3 GLU A 300 8.633 9.941 10.088 1.00 59.34 H new ATOM 0 HG2 GLU A 300 9.713 8.627 8.407 1.00 59.60 H new ATOM 0 HG3 GLU A 300 9.755 7.432 9.407 1.00 59.60 H new ATOM 1728 N PRO A 301 10.626 12.198 10.723 1.00 60.28 N ATOM 1729 CA PRO A 301 10.412 13.532 11.288 1.00 60.69 C ATOM 1730 C PRO A 301 8.933 13.744 11.636 1.00 61.09 C ATOM 1731 O PRO A 301 8.071 13.132 11.000 1.00 61.01 O ATOM 1732 CB PRO A 301 10.850 14.469 10.155 1.00 60.59 C ATOM 1733 CG PRO A 301 10.725 13.659 8.916 1.00 60.79 C ATOM 1734 CD PRO A 301 11.073 12.263 9.319 1.00 60.27 C ATOM 0 HA PRO A 301 10.901 13.681 12.112 1.00 60.69 H new ATOM 0 HB2 PRO A 301 10.289 15.259 10.116 1.00 60.59 H new ATOM 0 HB3 PRO A 301 11.762 14.774 10.284 1.00 60.59 H new ATOM 0 HG2 PRO A 301 9.825 13.705 8.557 1.00 60.79 H new ATOM 0 HG3 PRO A 301 11.323 13.983 8.225 1.00 60.79 H new ATOM 0 HD2 PRO A 301 10.619 11.607 8.767 1.00 60.27 H new ATOM 0 HD3 PRO A 301 12.024 12.093 9.237 1.00 60.27 H new ATOM 1735 N PRO A 302 8.639 14.600 12.639 1.00 61.50 N ATOM 1736 CA PRO A 302 7.260 14.778 13.119 1.00 61.85 C ATOM 1737 C PRO A 302 6.279 15.153 12.008 1.00 62.13 C ATOM 1738 O PRO A 302 6.661 15.817 11.045 1.00 62.05 O ATOM 1739 CB PRO A 302 7.379 15.923 14.136 1.00 61.87 C ATOM 1740 CG PRO A 302 8.708 16.549 13.886 1.00 61.41 C ATOM 1741 CD PRO A 302 9.583 15.456 13.378 1.00 61.51 C ATOM 0 HA PRO A 302 6.906 13.954 13.489 1.00 61.85 H new ATOM 0 HB2 PRO A 302 6.663 16.567 14.020 1.00 61.87 H new ATOM 0 HB3 PRO A 302 7.316 15.590 15.045 1.00 61.87 H new ATOM 0 HG2 PRO A 302 8.638 17.268 13.238 1.00 61.41 H new ATOM 0 HG3 PRO A 302 9.070 16.934 14.699 1.00 61.41 H new ATOM 0 HD2 PRO A 302 10.287 15.796 12.803 1.00 61.51 H new ATOM 0 HD3 PRO A 302 10.015 14.975 14.101 1.00 61.51 H new ATOM 1742 N ASN A 303 5.028 14.722 12.153 1.00 62.50 N ATOM 1743 CA ASN A 303 4.002 14.927 11.129 1.00 62.98 C ATOM 1744 C ASN A 303 3.783 16.401 10.783 1.00 63.19 C ATOM 1745 O ASN A 303 3.825 17.265 11.661 1.00 63.33 O ATOM 1746 CB ASN A 303 2.683 14.277 11.559 1.00 63.16 C ATOM 1747 CG ASN A 303 1.926 13.662 10.394 1.00 64.12 C ATOM 1748 OD1 ASN A 303 0.777 14.018 10.130 1.00 65.04 O ATOM 1749 ND2 ASN A 303 2.568 12.731 9.691 1.00 64.39 N ATOM 0 H ASN A 303 4.748 14.301 12.849 1.00 62.50 H new ATOM 0 HA ASN A 303 4.327 14.499 10.321 1.00 62.98 H new ATOM 0 HB2 ASN A 303 2.865 13.591 12.220 1.00 63.16 H new ATOM 0 HB3 ASN A 303 2.123 14.943 11.988 1.00 63.16 H new ATOM 0 HD21 ASN A 303 2.180 12.353 9.023 1.00 64.39 H new ATOM 0 HD22 ASN A 303 3.371 12.508 9.905 1.00 64.39 H new ATOM 1750 N TRP A 304 3.557 16.669 9.497 1.00 63.30 N ATOM 1751 CA TRP A 304 3.387 18.029 8.980 1.00 63.33 C ATOM 1752 C TRP A 304 2.101 18.673 9.495 1.00 63.38 C ATOM 1753 O TRP A 304 2.057 19.878 9.747 1.00 63.37 O ATOM 1754 CB TRP A 304 3.376 18.010 7.450 1.00 63.27 C ATOM 1755 CG TRP A 304 3.997 19.219 6.804 1.00 63.49 C ATOM 1756 CD1 TRP A 304 5.323 19.428 6.571 1.00 63.22 C ATOM 1757 CD2 TRP A 304 3.316 20.373 6.291 1.00 63.78 C ATOM 1758 NE1 TRP A 304 5.518 20.638 5.950 1.00 62.58 N ATOM 1759 CE2 TRP A 304 4.302 21.241 5.767 1.00 63.88 C ATOM 1760 CE3 TRP A 304 1.972 20.761 6.228 1.00 62.17 C ATOM 1761 CZ2 TRP A 304 3.985 22.472 5.185 1.00 63.31 C ATOM 1762 CZ3 TRP A 304 1.661 21.986 5.654 1.00 62.80 C ATOM 1763 CH2 TRP A 304 2.663 22.825 5.138 1.00 62.65 C ATOM 0 H TRP A 304 3.497 16.060 8.893 1.00 63.30 H new ATOM 0 HA TRP A 304 4.135 18.559 9.296 1.00 63.33 H new ATOM 0 HB2 TRP A 304 3.845 17.218 7.145 1.00 63.27 H new ATOM 0 HB3 TRP A 304 2.458 17.931 7.146 1.00 63.27 H new ATOM 0 HD1 TRP A 304 6.001 18.835 6.800 1.00 63.22 H new ATOM 0 HE1 TRP A 304 6.279 20.963 5.715 1.00 62.58 H new ATOM 0 HE3 TRP A 304 1.302 20.210 6.563 1.00 62.17 H new ATOM 0 HZ2 TRP A 304 4.646 23.029 4.843 1.00 63.31 H new ATOM 0 HZ3 TRP A 304 0.772 22.257 5.610 1.00 62.80 H new ATOM 0 HH2 TRP A 304 2.423 23.638 4.756 1.00 62.65 H new TER 1764 TRP A 304 HETATM 1765 C ACT A1003 18.733 16.193 5.583 1.00 47.57 C HETATM 1766 O ACT A1003 19.795 16.642 5.105 1.00 47.13 O HETATM 1767 OXT ACT A1003 18.832 15.174 6.304 1.00 47.97 O HETATM 1768 CH3 ACT A1003 17.417 16.845 5.304 1.00 47.50 C HETATM 0 H3 ACT A1003 17.435 17.760 5.624 1.00 47.50 H new HETATM 0 H2 ACT A1003 17.250 16.840 4.349 1.00 47.50 H new HETATM 0 H1 ACT A1003 16.712 16.358 5.758 1.00 47.50 H new HETATM 1772 O1 PG4 A1001 27.928 26.424 3.367 1.00 37.25 O HETATM 1773 C1 PG4 A1001 27.498 27.317 4.402 1.00 45.37 C HETATM 1774 C2 PG4 A1001 27.142 28.673 3.804 1.00 50.61 C HETATM 1775 O2 PG4 A1001 28.298 29.249 3.193 1.00 54.92 O HETATM 1776 C3 PG4 A1001 27.974 30.392 2.403 1.00 56.04 C HETATM 1777 C4 PG4 A1001 29.107 30.682 1.426 1.00 56.73 C HETATM 1778 O3 PG4 A1001 30.278 31.072 2.142 1.00 58.93 O HETATM 1779 C5 PG4 A1001 31.109 31.935 1.368 1.00 60.64 C HETATM 1780 C6 PG4 A1001 32.283 32.414 2.212 1.00 62.87 C HETATM 1781 O4 PG4 A1001 32.238 33.834 2.323 1.00 66.56 O HETATM 1782 C7 PG4 A1001 33.338 34.343 3.076 1.00 68.86 C HETATM 1783 C8 PG4 A1001 32.934 35.644 3.760 1.00 71.05 C HETATM 1784 O5 PG4 A1001 33.079 35.508 5.180 1.00 72.92 O HETATM 0 HO5 PG4 A1001 32.857 36.226 5.555 1.00 72.92 H new HETATM 0 HO1 PG4 A1001 28.138 26.866 2.684 1.00 37.25 H new HETATM 0 H82 PG4 A1001 33.486 36.374 3.438 1.00 71.05 H new HETATM 0 H81 PG4 A1001 32.015 35.864 3.539 1.00 71.05 H new HETATM 0 H72 PG4 A1001 33.617 33.692 3.739 1.00 68.86 H new HETATM 0 H71 PG4 A1001 34.097 34.496 2.492 1.00 68.86 H new HETATM 0 H62 PG4 A1001 32.247 32.009 3.093 1.00 62.87 H new HETATM 0 H61 PG4 A1001 33.120 32.138 1.807 1.00 62.87 H new HETATM 0 H52 PG4 A1001 31.434 31.467 0.583 1.00 60.64 H new HETATM 0 H51 PG4 A1001 30.595 32.695 1.052 1.00 60.64 H new HETATM 0 H42 PG4 A1001 29.293 29.895 0.891 1.00 56.73 H new HETATM 0 H41 PG4 A1001 28.844 31.386 0.813 1.00 56.73 H new HETATM 0 H32 PG4 A1001 27.149 30.237 1.917 1.00 56.04 H new HETATM 0 H31 PG4 A1001 27.825 31.160 2.976 1.00 56.04 H new HETATM 0 H22 PG4 A1001 26.435 28.571 3.147 1.00 50.61 H new HETATM 0 H21 PG4 A1001 26.804 29.263 4.496 1.00 50.61 H new HETATM 0 H12 PG4 A1001 26.729 26.945 4.861 1.00 45.37 H new HETATM 0 H11 PG4 A1001 28.200 27.421 5.063 1.00 45.37 H new HETATM 1785 O1 PG4 A1002 11.417 37.884 -3.946 1.00 79.08 O HETATM 1786 C1 PG4 A1002 11.236 36.584 -4.522 1.00 79.70 C HETATM 1787 C2 PG4 A1002 12.101 36.447 -5.771 1.00 80.24 C HETATM 1788 O2 PG4 A1002 13.472 36.657 -5.435 1.00 81.07 O HETATM 1789 C3 PG4 A1002 14.320 35.644 -5.978 1.00 79.36 C HETATM 1790 C4 PG4 A1002 15.780 35.954 -5.657 1.00 77.74 C HETATM 1791 O3 PG4 A1002 16.180 35.264 -4.472 1.00 75.95 O HETATM 1792 C5 PG4 A1002 17.138 34.241 -4.740 1.00 74.26 C HETATM 1793 C6 PG4 A1002 17.739 33.730 -3.433 1.00 72.10 C HETATM 1794 O4 PG4 A1002 18.789 34.599 -3.013 1.00 71.61 O HETATM 1795 C7 PG4 A1002 20.055 33.943 -2.999 1.00 70.95 C HETATM 1796 C8 PG4 A1002 21.120 34.869 -2.425 1.00 71.30 C HETATM 1797 O5 PG4 A1002 21.605 35.734 -3.457 1.00 71.72 O HETATM 0 HO5 PG4 A1002 22.191 36.246 -3.141 1.00 71.72 H new HETATM 0 HO1 PG4 A1002 12.176 38.179 -4.152 1.00 79.08 H new HETATM 0 H82 PG4 A1002 20.749 35.393 -1.698 1.00 71.30 H new HETATM 0 H81 PG4 A1002 21.850 34.348 -2.056 1.00 71.30 H new HETATM 0 H72 PG4 A1002 20.001 33.133 -2.469 1.00 70.95 H new HETATM 0 H71 PG4 A1002 20.299 33.677 -3.899 1.00 70.95 H new HETATM 0 H62 PG4 A1002 17.053 33.683 -2.748 1.00 72.10 H new HETATM 0 H61 PG4 A1002 18.081 32.830 -3.554 1.00 72.10 H new HETATM 0 H52 PG4 A1002 16.716 33.510 -5.218 1.00 74.26 H new HETATM 0 H51 PG4 A1002 17.840 34.587 -5.313 1.00 74.26 H new HETATM 0 H42 PG4 A1002 16.345 35.690 -6.400 1.00 77.74 H new HETATM 0 H41 PG4 A1002 15.896 36.910 -5.538 1.00 77.74 H new HETATM 0 H32 PG4 A1002 14.078 34.779 -5.612 1.00 79.36 H new HETATM 0 H31 PG4 A1002 14.197 35.590 -6.939 1.00 79.36 H new HETATM 0 H22 PG4 A1002 11.986 35.566 -6.159 1.00 80.24 H new HETATM 0 H21 PG4 A1002 11.821 37.091 -6.441 1.00 80.24 H new HETATM 0 H12 PG4 A1002 11.474 35.899 -3.877 1.00 79.70 H new HETATM 0 H11 PG4 A1002 10.303 36.449 -4.748 1.00 79.70 H new HETATM 1798 C1 PEG A1004 2.821 15.158 -2.330 1.00102.45 C HETATM 1799 O1 PEG A1004 1.928 14.966 -1.227 1.00102.26 O HETATM 1800 C2 PEG A1004 2.329 16.309 -3.200 1.00102.38 C HETATM 1801 O2 PEG A1004 2.854 16.173 -4.522 1.00102.70 O HETATM 1802 C3 PEG A1004 1.993 16.687 -5.541 1.00102.60 C HETATM 1803 C4 PEG A1004 1.815 18.193 -5.377 1.00102.60 C HETATM 1804 O4 PEG A1004 1.588 18.795 -6.657 1.00102.57 O HETATM 0 HO4 PEG A1004 1.489 19.624 -6.563 1.00102.57 H new HETATM 0 HO1 PEG A1004 2.117 15.509 -0.615 1.00102.26 H new HETATM 0 H42 PEG A1004 1.068 18.377 -4.786 1.00102.60 H new HETATM 0 H41 PEG A1004 2.604 18.578 -4.964 1.00102.60 H new HETATM 0 H32 PEG A1004 2.365 16.493 -6.415 1.00102.60 H new HETATM 0 H31 PEG A1004 1.130 16.247 -5.496 1.00102.60 H new HETATM 0 H22 PEG A1004 1.359 16.314 -3.227 1.00102.38 H new HETATM 0 H21 PEG A1004 2.607 17.156 -2.818 1.00102.38 H new HETATM 0 H12 PEG A1004 3.715 15.347 -2.004 1.00102.45 H new HETATM 0 H11 PEG A1004 2.877 14.345 -2.856 1.00102.45 H new HETATM 1815 C1 PEG A1005 4.408 24.660 8.282 1.00 83.33 C HETATM 1816 O1 PEG A1005 3.575 25.325 9.240 1.00 83.52 O HETATM 1817 C2 PEG A1005 5.400 23.764 9.011 1.00 83.32 C HETATM 1818 O2 PEG A1005 5.787 22.654 8.200 1.00 83.58 O HETATM 1819 C3 PEG A1005 6.679 21.759 8.873 1.00 82.51 C HETATM 1820 C4 PEG A1005 5.908 20.875 9.851 1.00 81.73 C HETATM 1821 O4 PEG A1005 6.622 19.658 10.087 1.00 80.58 O HETATM 0 HO4 PEG A1005 6.976 19.397 9.371 1.00 80.58 H new HETATM 0 HO1 PEG A1005 3.124 25.919 8.854 1.00 83.52 H new HETATM 0 H42 PEG A1005 5.775 21.347 10.688 1.00 81.73 H new HETATM 0 H41 PEG A1005 5.028 20.677 9.494 1.00 81.73 H new HETATM 0 H32 PEG A1005 7.142 21.206 8.224 1.00 82.51 H new HETATM 0 H31 PEG A1005 7.356 22.265 9.349 1.00 82.51 H new HETATM 0 H22 PEG A1005 6.185 24.278 9.255 1.00 83.32 H new HETATM 0 H21 PEG A1005 5.004 23.442 9.836 1.00 83.32 H new HETATM 0 H12 PEG A1005 3.864 24.132 7.677 1.00 83.33 H new HETATM 0 H11 PEG A1005 4.882 25.312 7.742 1.00 83.33 H new HETATM 1832 O HOH A1006 21.999 13.449 6.582 1.00 21.20 O HETATM 1833 O HOH A1007 31.181 19.056 7.191 1.00 26.76 O HETATM 1834 O HOH A1008 35.291 8.358 -0.140 0.50 33.16 O HETATM 1835 O HOH A1009 24.167 25.861 9.917 1.00 31.66 O HETATM 1836 O HOH A1010 25.490 13.224 -0.314 1.00 26.65 O HETATM 1837 O HOH A1011 34.350 23.492 13.138 1.00 27.78 O HETATM 1838 O HOH A1012 8.562 29.079 3.771 1.00 33.98 O HETATM 1839 O HOH A1013 31.100 21.428 5.282 1.00 27.44 O HETATM 1840 O HOH A1014 22.296 16.108 4.399 1.00 32.44 O HETATM 1841 O HOH A1015 26.485 26.031 23.666 0.50 47.13 O HETATM 1842 O HOH A1016 11.507 32.026 -2.927 1.00 39.41 O HETATM 1843 O HOH A1017 24.599 31.966 9.462 1.00 28.38 O HETATM 1844 O HOH A1018 28.441 16.327 6.788 1.00 31.33 O HETATM 1845 O HOH A1019 27.455 29.191 -3.148 1.00 30.79 O HETATM 1846 O HOH A1020 17.541 26.044 8.911 1.00 37.94 O HETATM 1847 O HOH A1021 22.173 11.906 -0.588 1.00 33.01 O HETATM 1848 O HOH A1022 42.935 23.003 22.212 1.00 43.57 O HETATM 1849 O HOH A1023 24.928 9.882 12.675 1.00 32.06 O HETATM 1850 O HOH A1024 33.270 23.638 4.408 1.00 38.28 O HETATM 1851 O HOH A1025 26.780 24.016 9.435 1.00 32.82 O HETATM 1852 O HOH A1026 41.963 28.675 5.718 1.00 38.88 O HETATM 1853 O HOH A1027 27.192 14.550 26.622 1.00 38.46 O HETATM 1854 O HOH A1028 45.881 13.907 13.929 1.00 40.74 O HETATM 1855 O HOH A1029 30.279 9.803 17.499 1.00 32.79 O HETATM 1856 O HOH A1030 25.061 28.409 9.274 1.00 30.95 O HETATM 1857 O HOH A1031 44.015 10.628 -0.289 1.00 31.83 O HETATM 1858 O HOH A1032 24.422 15.507 6.298 1.00 36.69 O HETATM 1859 O HOH A1033 24.791 29.135 -3.908 1.00 36.87 O HETATM 1860 O HOH A1034 37.781 6.183 9.349 1.00 31.94 O HETATM 1861 O HOH A1035 35.868 21.225 13.553 1.00 28.76 O HETATM 1862 O HOH A1036 35.261 6.489 8.083 1.00 29.45 O HETATM 1863 O HOH A1037 24.506 33.438 7.172 1.00 28.10 O HETATM 1864 O HOH A1038 9.856 23.621 9.886 1.00 42.17 O HETATM 1865 O HOH A1039 39.782 8.607 5.370 1.00 42.64 O HETATM 1866 O HOH A1040 28.510 28.498 23.461 0.50 46.78 O HETATM 1867 O HOH A1041 11.407 20.159 16.127 1.00 43.73 O HETATM 1868 O HOH A1042 46.054 12.119 2.456 1.00 31.82 O HETATM 1869 O HOH A1043 48.342 11.561 4.837 1.00 30.85 O HETATM 1870 O HOH A1044 25.964 32.731 4.681 1.00 42.33 O HETATM 1871 O HOH A1045 25.155 10.862 9.433 1.00 44.61 O HETATM 1872 O HOH A1046 43.942 16.760 24.790 1.00 39.49 O HETATM 1873 O HOH A1047 50.398 10.178 5.993 1.00 30.01 O HETATM 1874 O HOH A1048 1.898 19.759 -17.959 1.00 72.72 O HETATM 1875 O HOH A1049 29.804 24.080 6.334 1.00 35.63 O HETATM 1876 O HOH A1050 23.903 10.088 1.858 1.00 41.08 O HETATM 1877 O HOH A1051 19.720 36.277 3.015 1.00 36.35 O HETATM 1878 O HOH A1052 27.090 28.216 7.532 1.00 34.49 O HETATM 1879 O HOH A1053 17.200 10.175 -4.691 1.00 33.48 O HETATM 1880 O HOH A1054 35.684 31.017 1.185 1.00 33.14 O HETATM 1881 O HOH A1055 18.025 11.521 15.352 1.00 45.73 O HETATM 1882 O HOH A1056 24.222 21.198 14.515 1.00 54.18 O HETATM 1883 O HOH A1057 34.063 26.172 23.947 1.00 41.32 O HETATM 1884 O HOH A1058 -5.769 28.696 2.859 1.00 64.64 O HETATM 1885 O HOH A1059 18.622 18.009 19.019 1.00 41.33 O HETATM 1886 O HOH A1060 28.013 30.634 6.871 1.00 40.28 O HETATM 1887 O HOH A1061 23.235 10.324 19.374 1.00 47.20 O HETATM 1888 O HOH A1062 34.518 30.008 3.483 1.00 47.40 O HETATM 1889 O HOH A1063 39.122 21.748 -2.698 1.00 42.00 O HETATM 1890 O HOH A1064 38.917 12.255 29.454 1.00 52.32 O HETATM 1891 O HOH A1065 29.789 7.636 16.064 1.00 49.31 O HETATM 1892 O HOH A1066 17.904 36.204 15.286 1.00 58.70 O HETATM 1893 O HOH A1067 16.668 29.073 12.599 1.00 49.21 O HETATM 1894 O HOH A1068 27.864 10.095 4.349 1.00 44.18 O HETATM 1895 O HOH A1069 29.613 13.486 28.074 1.00 40.85 O HETATM 1896 O HOH A1070 6.355 8.039 4.307 1.00 68.68 O HETATM 1897 O HOH A1071 43.363 1.543 15.158 1.00 58.92 O HETATM 1898 O HOH A1072 23.178 31.928 -1.612 1.00 49.84 O HETATM 1899 O HOH A1073 42.949 24.018 25.505 1.00 57.28 O HETATM 1900 O HOH A1074 16.812 6.491 1.650 1.00 55.22 O HETATM 1901 O HOH A1075 21.889 23.104 17.650 1.00 61.18 O HETATM 1902 O HOH A1076 44.199 5.412 4.736 1.00 43.58 O HETATM 1903 O HOH A1077 17.838 6.107 -0.746 1.00 48.05 O HETATM 1904 O HOH A1078 35.054 21.719 32.774 1.00 64.78 O HETATM 1905 O HOH A1079 11.848 19.555 -11.020 1.00 46.18 O HETATM 1906 O HOH A1080 38.021 6.305 25.340 1.00 49.93 O HETATM 1907 O HOH A1081 40.251 1.072 19.205 1.00 58.03 O HETATM 1908 O HOH A1082 19.927 25.471 22.969 1.00 56.44 O HETATM 1909 O HOH A1083 10.134 5.122 2.291 1.00 57.35 O HETATM 1910 O HOH A1084 4.405 31.409 3.237 1.00 51.77 O HETATM 1911 O HOH A1085 30.610 29.166 19.936 1.00 48.60 O HETATM 1912 O HOH A1086 39.855 7.736 -0.857 1.00 51.65 O HETATM 1913 O HOH A1087 47.161 15.647 12.018 1.00 45.40 O HETATM 1914 O HOH A1088 32.910 7.349 1.849 1.00 61.10 O HETATM 1915 O HOH A1089 1.958 29.657 2.445 1.00 51.26 O HETATM 1916 O HOH A1090 15.113 11.293 12.642 1.00 45.78 O HETATM 1917 O HOH A1091 25.099 25.032 18.714 1.00 42.51 O HETATM 1918 O HOH A1092 51.337 22.644 13.475 1.00 77.11 O HETATM 1919 O HOH A1093 25.301 10.089 4.348 1.00 45.26 O HETATM 1920 O HOH A1094 31.736 31.191 15.860 1.00 58.37 O HETATM 1921 O HOH A1095 30.666 24.200 1.806 1.00 45.72 O HETATM 1922 O HOH A1096 15.760 10.002 -7.014 1.00 43.26 O HETATM 1923 O HOH A1097 37.604 8.502 26.798 1.00 39.55 O HETATM 1924 O HOH A1098 34.377 27.015 30.731 1.00 58.79 O HETATM 1925 O HOH A1099 43.255 3.962 10.868 1.00 51.20 O HETATM 1926 O HOH A1100 21.228 15.361 27.987 1.00 61.58 O HETATM 1927 O HOH A1101 46.936 18.064 17.833 1.00 47.12 O HETATM 1928 O HOH A1102 23.402 24.780 25.459 1.00 49.39 O HETATM 1929 O HOH A1103 30.161 36.673 10.526 1.00 49.42 O HETATM 1930 O HOH A1104 5.509 10.073 2.701 1.00 85.84 O HETATM 1931 O HOH A1105 38.273 32.440 10.055 1.00 60.69 O HETATM 1932 O HOH A1106 41.345 6.346 4.009 1.00 52.49 O HETATM 1933 O HOH A1107 35.239 5.103 12.655 1.00 51.50 O HETATM 1934 O HOH A1108 47.192 30.138 12.020 1.00 81.36 O HETATM 1935 O HOH A1109 3.782 32.907 5.325 1.00 58.49 O HETATM 1936 O HOH A1110 27.948 9.138 1.455 1.00 48.32 O HETATM 1937 O HOH A1111 19.820 38.162 11.237 1.00 65.86 O HETATM 1938 O HOH A1112 29.028 8.307 5.827 1.00 50.38 O HETATM 1939 O HOH A1113 22.399 22.174 24.756 1.00 59.42 O HETATM 1940 O HOH A1114 4.127 30.043 -11.525 1.00 91.60 O HETATM 1941 O HOH A1115 28.186 31.711 -2.918 1.00 56.62 O HETATM 1942 O HOH A1116 14.170 32.992 -9.827 1.00 54.32 O HETATM 1943 O HOH A1117 16.833 7.584 -3.353 1.00 45.00 O HETATM 1944 O HOH A1118 18.836 37.249 -3.162 1.00 60.56 O HETATM 1945 O HOH A1119 14.632 14.734 -12.934 1.00 73.45 O HETATM 1946 O HOH A1120 42.299 15.620 28.840 1.00 51.29 O HETATM 1947 O HOH A1121 24.162 18.519 22.111 1.00 44.62 O HETATM 1948 O HOH A1122 38.423 24.033 29.101 1.00 68.36 O HETATM 1949 O HOH A1123 37.049 33.214 1.811 1.00 47.63 O HETATM 1950 O HOH A1124 14.315 24.669 18.246 1.00 68.17 O HETATM 1951 O HOH A1125 11.189 39.867 15.117 1.00 62.70 O HETATM 1952 O HOH A1126 16.537 36.988 13.072 1.00 56.93 O HETATM 1953 O HOH A1127 14.865 22.536 -11.741 1.00 49.93 O HETATM 1954 O HOH A1128 42.206 31.019 13.432 1.00 51.12 O HETATM 1955 O HOH A1129 32.551 26.195 29.070 1.00 48.70 O HETATM 1956 O HOH A1130 50.071 25.718 8.539 1.00 46.15 O HETATM 1957 O HOH A1131 4.649 33.327 7.991 1.00 63.70 O HETATM 1958 O HOH A1132 8.207 22.255 14.545 1.00 70.32 O HETATM 1959 O HOH A1133 21.717 17.634 22.957 1.00 54.97 O HETATM 1960 O HOH A1134 7.123 30.816 -8.709 1.00 56.70 O HETATM 1961 O HOH A1135 30.519 25.685 4.032 1.00 46.48 O HETATM 1962 O HOH A1136 34.083 29.882 16.407 1.00 52.01 O HETATM 1963 O HOH A1137 31.187 29.217 22.599 1.00 51.61 O HETATM 1964 O HOH A1138 29.756 6.566 11.507 1.00 54.24 O HETATM 1965 O HOH A1139 48.540 17.003 15.765 1.00 58.43 O HETATM 1966 O HOH A1140 39.333 5.741 7.260 1.00 59.18 O HETATM 1967 O HOH A1141 10.840 38.495 12.871 1.00 52.12 O HETATM 1968 O HOH A1142 52.135 5.898 5.938 1.00 57.71 O HETATM 1969 O HOH A1143 19.748 3.123 0.951 1.00 74.93 O HETATM 1970 O HOH A1144 24.746 36.288 7.219 1.00 50.94 O HETATM 1971 O HOH A1145 19.264 13.220 -12.845 1.00 57.98 O HETATM 1972 O HOH A1146 24.090 31.993 -4.073 1.00 58.29 O HETATM 1973 O HOH A1147 39.981 31.429 6.089 1.00 60.02 O HETATM 1974 O HOH A1148 43.391 5.712 7.875 1.00 58.86 O HETATM 1975 O HOH A1149 26.465 36.672 9.509 1.00 59.97 O HETATM 1976 O HOH A1150 10.411 26.927 15.845 1.00 52.16 O HETATM 1977 O HOH A1151 20.172 10.392 13.212 1.00 55.31 O HETATM 1978 O HOH A1152 33.331 2.282 24.411 1.00 62.33 O HETATM 1979 O HOH A1153 25.755 22.281 29.620 1.00 57.97 O HETATM 1980 O HOH A1154 23.760 10.375 6.227 1.00 52.86 O HETATM 1981 O HOH A1155 26.644 32.233 -0.159 1.00 57.16 O HETATM 1982 O HOH A1156 47.458 5.487 16.101 1.00 50.90 O HETATM 1983 O HOH A1157 12.142 30.725 15.901 1.00 48.85 O HETATM 1984 O HOH A1158 29.635 6.466 19.990 1.00 68.49 O HETATM 1985 O HOH A1159 23.193 19.968 19.970 1.00 58.10 O HETATM 1986 O HOH A1160 50.800 22.076 20.912 1.00 73.85 O HETATM 1987 O HOH A1161 22.731 4.706 1.615 1.00 71.79 O HETATM 1988 O HOH A1162 15.165 13.234 16.308 1.00 70.83 O HETATM 1989 O HOH A1163 20.925 35.857 0.724 1.00 53.31 O HETATM 1990 O HOH A1164 29.289 34.658 2.182 1.00 55.92 O HETATM 1991 O HOH A1165 16.729 7.297 13.904 1.00 64.01 O HETATM 1992 O HOH A1166 33.154 5.151 11.051 1.00 48.42 O HETATM 1993 O HOH A1167 27.646 7.803 13.358 1.00 59.10 O HETATM 1994 O HOH A1168 5.254 29.498 -0.361 1.00 61.19 O HETATM 1995 O HOH A1169 29.237 23.215 30.585 1.00 56.31 O HETATM 1996 O HOH A1170 22.313 37.622 6.939 1.00 52.37 O HETATM 1997 O HOH A1171 45.953 7.609 23.981 1.00 65.12 O HETATM 1998 O HOH A1172 32.164 2.367 17.658 1.00 81.06 O HETATM 1999 O HOH A1173 32.493 30.321 18.459 1.00 55.45 O HETATM 2000 O HOH A1174 34.981 3.020 14.775 1.00 57.49 O HETATM 2001 O HOH A1175 30.445 8.538 28.595 1.00 67.63 O HETATM 2002 O HOH A1176 39.610 29.365 22.433 1.00 58.08 O HETATM 2003 O HOH A1177 7.749 30.113 15.204 1.00 55.73 O HETATM 2004 O HOH A1178 25.817 36.448 4.505 1.00 55.42 O HETATM 2005 O HOH A1179 12.754 14.204 15.077 1.00 68.74 O HETATM 2006 O HOH A1180 23.311 34.366 0.344 1.00 65.56 O HETATM 2007 O HOH A1181 10.708 2.128 2.785 1.00 77.51 O HETATM 2008 O HOH A1182 6.454 31.642 -15.167 1.00 80.96 O HETATM 2009 O HOH A1183 7.985 12.197 -3.287 1.00 64.07 O HETATM 2010 O HOH A1184 9.857 6.524 12.603 1.00 64.19 O HETATM 2011 O HOH A1185 11.701 17.753 18.173 1.00 60.96 O HETATM 2012 O HOH A1186 14.643 40.190 6.480 1.00 64.76 O HETATM 2013 O HOH A1187 0.269 24.652 7.493 1.00 81.74 O HETATM 2014 O HOH A1188 15.051 31.281 12.602 1.00 51.79 O HETATM 2015 O HOH A1189 27.590 6.807 9.919 1.00 69.31 O HETATM 2016 O HOH A1190 5.937 13.937 -2.703 1.00 61.41 O HETATM 2017 O HOH A1191 8.523 30.456 -4.636 1.00 58.15 O HETATM 2018 O HOH A1192 12.180 15.896 -13.156 1.00 66.80 O HETATM 2019 O HOH A1193 27.042 8.737 8.131 1.00 56.34 O HETATM 2020 O HOH A1194 4.698 22.706 -18.871 1.00 84.15 O HETATM 2021 O HOH A1195 14.774 3.866 13.923 1.00 73.28 O HETATM 2022 O HOH A1196 45.583 23.919 25.546 1.00 66.48 O HETATM 2023 O HOH A1197 21.398 7.796 13.393 1.00 79.74 O HETATM 2024 O HOH A1198 37.201 -1.122 21.948 1.00 83.89 O HETATM 2025 O HOH A1199 47.022 25.995 17.503 1.00 63.42 O HETATM 2026 O HOH A1200 10.201 6.566 -1.943 1.00 67.51 O HETATM 2027 O HOH A1201 11.301 4.017 -0.369 1.00 78.28 O HETATM 2028 O HOH A1202 14.343 39.516 -4.521 1.00 74.69 O HETATM 2029 O HOH A1203 48.652 14.346 14.091 1.00 52.09 O HETATM 2030 O HOH A1204 18.568 3.560 -1.441 1.00 67.57 O HETATM 2031 O HOH A1205 40.407 18.494 31.464 1.00 68.49 O HETATM 2032 O HOH A1206 46.263 28.603 18.496 1.00 73.02 O HETATM 2033 O HOH A1207 12.769 6.077 -1.223 1.00 66.82 O HETATM 2034 O HOH A1208 31.433 3.789 19.869 1.00 65.58 O HETATM 2035 O HOH A1209 24.343 26.677 -5.641 1.00 61.80 O HETATM 2036 O HOH A1210 -1.107 27.683 8.142 1.00 66.20 O HETATM 2037 O HOH A1211 46.426 16.237 24.070 1.00 54.29 O HETATM 2038 O HOH A1212 11.375 24.070 17.051 1.00 64.41 O HETATM 2039 O HOH A1213 8.107 38.356 8.487 1.00 59.70 O HETATM 2040 O HOH A1214 46.595 5.407 22.556 1.00 74.58 O HETATM 2041 O HOH A1215 20.170 37.200 14.088 1.00 52.45 O HETATM 2042 O HOH A1216 13.724 25.612 -15.629 1.00 79.73 O HETATM 2043 O HOH A1217 14.188 19.996 -12.283 1.00 72.94 O HETATM 2044 O HOH A1218 7.123 34.426 8.080 1.00 57.11 O HETATM 2045 O HOH A1219 44.219 3.642 2.652 1.00 65.11 O HETATM 2046 O HOH A1220 41.471 6.758 1.092 1.00 67.45 O HETATM 2047 O HOH A1221 17.423 26.643 11.303 1.00 61.59 O HETATM 2048 O HOH A1222 45.167 24.251 15.822 1.00 69.91 O HETATM 2049 O HOH A1223 19.245 11.471 19.230 1.00 60.16 O HETATM 2050 O HOH A1224 15.846 24.673 -13.065 1.00 81.49 O HETATM 2051 O HOH A1225 22.404 10.395 16.767 1.00 55.64 O HETATM 2052 O HOH A1226 13.695 22.348 17.141 1.00 64.84 O HETATM 2053 O HOH A1227 7.666 23.963 -17.023 1.00 81.61 O HETATM 2054 O HOH A1228 5.277 35.260 18.394 1.00 67.18 O HETATM 2055 O HOH A1229 5.397 24.121 -12.740 1.00 82.19 O HETATM 2056 O HOH A1230 21.388 14.174 22.691 1.00 67.51 O HETATM 2057 O HOH A1231 17.848 20.386 18.748 1.00 46.75 O HETATM 2058 O HOH A1232 14.549 30.060 16.775 1.00 68.07 O HETATM 2059 O HOH A1233 14.580 4.009 -2.590 1.00 74.45 O HETATM 2060 O HOH A1234 45.743 11.865 22.630 1.00 56.29 O HETATM 2061 O HOH A1235 5.372 25.389 -16.760 1.00 93.69 O HETATM 2062 O HOH A1236 6.602 34.679 0.002 1.00 70.68 O HETATM 2063 O HOH A1237 0.298 23.515 -19.663 1.00 81.14 O HETATM 2064 O HOH A1238 7.017 36.836 1.575 1.00 60.04 O HETATM 2065 O HOH A1239 42.219 8.418 25.036 1.00 70.05 O HETATM 2066 O HOH A1240 5.594 19.250 -11.943 1.00 57.33 O HETATM 2067 O HOH A1241 11.052 41.688 1.480 1.00 72.07 O HETATM 2068 O HOH A1242 6.040 32.755 16.670 1.00 69.52 O HETATM 2069 O HOH A1243 21.376 37.875 4.390 1.00 54.93 O HETATM 2070 O HOH A1244 1.358 28.768 -0.061 1.00 75.80 O HETATM 2071 O HOH A1245 40.833 14.039 32.958 1.00 75.07 O HETATM 2072 O HOH A1246 19.551 40.345 -1.526 1.00 74.59 O HETATM 2073 O HOH A1247 4.594 35.675 10.576 1.00 72.58 O HETATM 2074 O HOH A1248 22.915 9.355 23.253 1.00 79.01 O HETATM 2075 O HOH A1249 43.761 5.661 0.425 1.00 68.81 O HETATM 2076 O HOH A1250 8.352 33.214 -2.040 1.00 58.67 O HETATM 2077 O HOH A1251 48.921 19.717 20.903 1.00 74.73 O HETATM 2078 O HOH A1252 52.439 7.405 9.777 1.00 54.35 O HETATM 2079 O HOH A1253 50.236 5.162 10.035 1.00 65.26 O HETATM 2080 O HOH A1254 28.777 26.025 8.275 1.00 29.97 O HETATM 2081 O HOH A1255 30.344 4.757 7.645 1.00 61.18 O HETATM 2082 O HOH A1256 31.344 28.228 3.852 1.00 38.99 O HETATM 2083 O HOH A1257 27.225 7.557 22.529 1.00 65.78 O CONECT 1765 1766 1767 1768 CONECT 1766 1765 CONECT 1767 1765 CONECT 1768 1765 1769 1770 1771 CONECT 1769 1768 CONECT 1770 1768 CONECT 1771 1768 CONECT 1772 1773 CONECT 1773 1772 1774 CONECT 1774 1773 1775 CONECT 1775 1774 1776 CONECT 1776 1775 1777 CONECT 1777 1776 1778 CONECT 1778 1777 1779 CONECT 1779 1778 1780 CONECT 1780 1779 1781 CONECT 1781 1780 1782 CONECT 1782 1781 1783 CONECT 1783 1782 1784 CONECT 1784 1783 CONECT 1785 1786 CONECT 1786 1785 1787 CONECT 1787 1786 1788 CONECT 1788 1787 1789 CONECT 1789 1788 1790 CONECT 1790 1789 1791 CONECT 1791 1790 1792 CONECT 1792 1791 1793 CONECT 1793 1792 1794 CONECT 1794 1793 1795 CONECT 1795 1794 1796 CONECT 1796 1795 1797 CONECT 1797 1796 CONECT 1798 1799 1800 1805 1806 CONECT 1799 1798 1807 CONECT 1800 1798 1801 1808 1809 CONECT 1801 1800 1802 CONECT 1802 1801 1803 1810 1811 CONECT 1803 1802 1804 1812 1813 CONECT 1804 1803 1814 CONECT 1805 1798 CONECT 1806 1798 CONECT 1807 1799 CONECT 1808 1800 CONECT 1809 1800 CONECT 1810 1802 CONECT 1811 1802 CONECT 1812 1803 CONECT 1813 1803 CONECT 1814 1804 CONECT 1815 1816 1817 1822 1823 CONECT 1816 1815 1824 CONECT 1817 1815 1818 1825 1826 CONECT 1818 1817 1819 CONECT 1819 1818 1820 1827 1828 CONECT 1820 1819 1821 1829 1830 CONECT 1821 1820 1831 CONECT 1822 1815 CONECT 1823 1815 CONECT 1824 1816 CONECT 1825 1817 CONECT 1826 1817 CONECT 1827 1819 CONECT 1828 1819 CONECT 1829 1820 CONECT 1830 1820 CONECT 1831 1821 END