USER MOD reduce.3.24.130724 H: found=0, std=0, add=3249, rem=0, adj=90 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) HEADER SIGNALING PROTEIN 17-MAY-07 2PZ1 TITLE CRYSTAL STRUCTURE OF AUTO-INHIBITED ASEF COMPND MOL_ID: 1; COMPND 2 MOLECULE: RHO GUANINE NUCLEOTIDE EXCHANGE FACTOR 4; COMPND 3 CHAIN: A; COMPND 4 SYNONYM: APC-STIMULATED GUANINE NUCLEOTIDE EXCHANGE FACTOR, ASEF; COMPND 5 ENGINEERED: YES SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN; SOURCE 4 ORGANISM_TAXID: 9606; SOURCE 5 GENE: ARHGEF4, KIAA1112; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_TAXID: 562; SOURCE 8 EXPRESSION_SYSTEM_STRAIN: BL21(DE3) ROSETTA KEYWDS HELICAL BUNDLE, BETA BARREL, BETA SANDWICH, SIGNALING PROTEIN EXPDTA X-RAY DIFFRACTION AUTHOR L.BETTS,J.SONDEK,K.L.ROSSMAN REVDAT 4 13-JUL-11 2PZ1 1 VERSN REVDAT 3 24-FEB-09 2PZ1 1 VERSN REVDAT 2 25-DEC-07 2PZ1 1 JRNL REVDAT 1 21-AUG-07 2PZ1 0 JRNL AUTH N.MITIN,L.BETTS,M.E.YOHE,C.J.DER,J.SONDEK,K.L.ROSSMAN JRNL TITL RELEASE OF AUTOINHIBITION OF ASEF BY APC LEADS TO CDC42 JRNL TITL 2 ACTIVATION AND TUMOR SUPPRESSION. JRNL REF NAT.STRUCT.MOL.BIOL. V. 14 814 2007 JRNL REFN ISSN 1545-9993 JRNL PMID 17704816 JRNL DOI 10.1038/NSMB1290 REMARK 2 REMARK 2 RESOLUTION. 2.25 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : REFMAC 5.2.0019 REMARK 3 AUTHORS : MURSHUDOV,VAGIN,DODSON REMARK 3 REMARK 3 REFINEMENT TARGET : MAXIMUM LIKELIHOOD REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.25 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 15.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.000 REMARK 3 COMPLETENESS FOR RANGE (%) : 98.9 REMARK 3 NUMBER OF REFLECTIONS : 19854 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) : 0.221 REMARK 3 R VALUE (WORKING SET) : 0.217 REMARK 3 FREE R VALUE : 0.279 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 5.100 REMARK 3 FREE R VALUE TEST SET COUNT : 1071 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) : 2.25 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.31 REMARK 3 REFLECTION IN BIN (WORKING SET) : 1366 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 93.55 REMARK 3 BIN R VALUE (WORKING SET) : 0.2680 REMARK 3 BIN FREE R VALUE SET COUNT : 85 REMARK 3 BIN FREE R VALUE : 0.3030 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 3330 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 100 REMARK 3 REMARK 3 B VALUES. REMARK 3 B VALUE TYPE : LIKELY RESIDUAL REMARK 3 FROM WILSON PLOT (A**2) : 49.60 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 51.17 REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : 1.92000 REMARK 3 B22 (A**2) : -1.35000 REMARK 3 B33 (A**2) : -0.42000 REMARK 3 B12 (A**2) : 0.00000 REMARK 3 B13 (A**2) : 0.14000 REMARK 3 B23 (A**2) : 0.00000 REMARK 3 REMARK 3 ESTIMATED OVERALL COORDINATE ERROR. REMARK 3 ESU BASED ON R VALUE (A): 0.374 REMARK 3 ESU BASED ON FREE R VALUE (A): 0.267 REMARK 3 ESU BASED ON MAXIMUM LIKELIHOOD (A): 0.208 REMARK 3 ESU FOR B VALUES BASED ON MAXIMUM LIKELIHOOD (A**2): 16.619 REMARK 3 REMARK 3 CORRELATION COEFFICIENTS. REMARK 3 CORRELATION COEFFICIENT FO-FC : 0.946 REMARK 3 CORRELATION COEFFICIENT FO-FC FREE : 0.911 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES COUNT RMS WEIGHT REMARK 3 BOND LENGTHS REFINED ATOMS (A): 3394 ; 0.008 ; 0.021 REMARK 3 BOND LENGTHS OTHERS (A): NULL ; NULL ; NULL REMARK 3 BOND ANGLES REFINED ATOMS (DEGREES): 4565 ; 1.063 ; 1.946 REMARK 3 BOND ANGLES OTHERS (DEGREES): NULL ; NULL ; NULL REMARK 3 TORSION ANGLES, PERIOD 1 (DEGREES): 406 ; 5.818 ; 5.000 REMARK 3 TORSION ANGLES, PERIOD 2 (DEGREES): 187 ;33.483 ;23.797 REMARK 3 TORSION ANGLES, PERIOD 3 (DEGREES): 622 ;17.582 ;15.000 REMARK 3 TORSION ANGLES, PERIOD 4 (DEGREES): 33 ;16.336 ;15.000 REMARK 3 CHIRAL-CENTER RESTRAINTS (A**3): 477 ; 0.076 ; 0.200 REMARK 3 GENERAL PLANES REFINED ATOMS (A): 2613 ; 0.003 ; 0.020 REMARK 3 GENERAL PLANES OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED CONTACTS REFINED ATOMS (A): 1577 ; 0.248 ; 0.300 REMARK 3 NON-BONDED CONTACTS OTHERS (A): NULL ; NULL ; NULL REMARK 3 NON-BONDED TORSION REFINED ATOMS (A): 2298 ; 0.320 ; 0.500 REMARK 3 NON-BONDED TORSION OTHERS (A): NULL ; NULL ; NULL REMARK 3 H-BOND (X...Y) REFINED ATOMS (A): 265 ; 0.227 ; 0.500 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): 50 ; 0.298 ; 0.300 REMARK 3 SYMMETRY VDW OTHERS (A): NULL ; NULL ; NULL REMARK 3 SYMMETRY H-BOND REFINED ATOMS (A): 4 ; 0.225 ; 0.500 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): 2068 ; 0.584 ; 2.000 REMARK 3 MAIN-CHAIN BOND OTHER ATOMS (A**2): NULL ; NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE REFINED ATOMS (A**2): 3224 ; 1.005 ; 3.000 REMARK 3 SIDE-CHAIN BOND REFINED ATOMS (A**2): 1493 ; 0.488 ; 2.000 REMARK 3 SIDE-CHAIN ANGLE REFINED ATOMS (A**2): 1341 ; 0.786 ; 3.000 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 : 13 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 182 A 196 REMARK 3 ORIGIN FOR THE GROUP (A): 19.0245 15.2777 40.2210 REMARK 3 T TENSOR REMARK 3 T11: 0.3235 T22: 0.3515 REMARK 3 T33: 0.0109 T12: 0.2395 REMARK 3 T13: -0.1059 T23: 0.0735 REMARK 3 L TENSOR REMARK 3 L11: 23.0201 L22: 10.0457 REMARK 3 L33: 47.0624 L12: 1.5190 REMARK 3 L13: -5.2111 L23: 9.8814 REMARK 3 S TENSOR REMARK 3 S11: -0.7146 S12: -2.5000 S13: -3.3208 REMARK 3 S21: 1.5045 S22: 0.5967 S23: -1.9194 REMARK 3 S31: -1.3423 S32: -2.1825 S33: 0.1179 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 197 A 254 REMARK 3 ORIGIN FOR THE GROUP (A): 17.6448 16.3329 23.8018 REMARK 3 T TENSOR REMARK 3 T11: -0.2392 T22: -0.2495 REMARK 3 T33: -0.1598 T12: -0.0194 REMARK 3 T13: 0.0503 T23: -0.0352 REMARK 3 L TENSOR REMARK 3 L11: 3.7626 L22: 4.2322 REMARK 3 L33: 3.1331 L12: -0.9476 REMARK 3 L13: 0.9390 L23: 0.2728 REMARK 3 S TENSOR REMARK 3 S11: 0.1084 S12: -0.1728 S13: 0.2024 REMARK 3 S21: -0.2575 S22: -0.0820 S23: -0.5459 REMARK 3 S31: -0.0837 S32: 0.2205 S33: -0.0265 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 278 A 404 REMARK 3 ORIGIN FOR THE GROUP (A): 0.7459 -0.7524 24.7500 REMARK 3 T TENSOR REMARK 3 T11: -0.1728 T22: -0.1946 REMARK 3 T33: -0.2048 T12: -0.0360 REMARK 3 T13: 0.0182 T23: 0.0465 REMARK 3 L TENSOR REMARK 3 L11: 2.4601 L22: 1.9369 REMARK 3 L33: 1.5893 L12: -0.6509 REMARK 3 L13: 0.4754 L23: -0.5224 REMARK 3 S TENSOR REMARK 3 S11: -0.0066 S12: 0.0194 S13: -0.1464 REMARK 3 S21: -0.0227 S22: -0.0290 S23: -0.0613 REMARK 3 S31: -0.0324 S32: -0.0762 S33: 0.0356 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 405 A 416 REMARK 3 ORIGIN FOR THE GROUP (A): -8.3209 10.2366 29.9004 REMARK 3 T TENSOR REMARK 3 T11: 0.0136 T22: 0.1929 REMARK 3 T33: 0.0197 T12: -0.1374 REMARK 3 T13: -0.0707 T23: -0.0533 REMARK 3 L TENSOR REMARK 3 L11: 26.7788 L22: 1.9130 REMARK 3 L33: 10.2554 L12: -1.9206 REMARK 3 L13: -14.2664 L23: 3.1942 REMARK 3 S TENSOR REMARK 3 S11: 1.2966 S12: -2.7043 S13: 1.1471 REMARK 3 S21: 0.5223 S22: -0.0803 S23: -0.8290 REMARK 3 S31: -0.1584 S32: 1.3554 S33: -1.2163 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 417 A 477 REMARK 3 ORIGIN FOR THE GROUP (A): 15.3279 -0.4037 20.7993 REMARK 3 T TENSOR REMARK 3 T11: -0.2308 T22: -0.2111 REMARK 3 T33: -0.1115 T12: 0.0126 REMARK 3 T13: 0.1073 T23: -0.0180 REMARK 3 L TENSOR REMARK 3 L11: 2.3700 L22: 3.0327 REMARK 3 L33: 2.0168 L12: 0.6771 REMARK 3 L13: -0.7302 L23: 0.0347 REMARK 3 S TENSOR REMARK 3 S11: -0.0321 S12: 0.2145 S13: -0.3830 REMARK 3 S21: -0.2029 S22: 0.0270 S23: -0.4571 REMARK 3 S31: -0.0537 S32: 0.1943 S33: 0.0051 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 478 A 506 REMARK 3 ORIGIN FOR THE GROUP (A): 14.9661 24.3354 2.0345 REMARK 3 T TENSOR REMARK 3 T11: 0.0511 T22: -0.1959 REMARK 3 T33: -0.2806 T12: -0.0591 REMARK 3 T13: 0.0367 T23: 0.0065 REMARK 3 L TENSOR REMARK 3 L11: 5.1660 L22: 7.6776 REMARK 3 L33: 6.5055 L12: 0.3278 REMARK 3 L13: 1.6553 L23: 0.3795 REMARK 3 S TENSOR REMARK 3 S11: -0.3002 S12: 0.1043 S13: 0.1749 REMARK 3 S21: 0.0646 S22: 0.1726 S23: 0.4730 REMARK 3 S31: -0.8288 S32: 0.0532 S33: 0.1276 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 507 A 518 REMARK 3 ORIGIN FOR THE GROUP (A): 31.0265 37.7192 -0.1163 REMARK 3 T TENSOR REMARK 3 T11: 0.2131 T22: 0.0907 REMARK 3 T33: 0.1336 T12: -0.1405 REMARK 3 T13: 0.1202 T23: 0.0455 REMARK 3 L TENSOR REMARK 3 L11: 10.3548 L22: 34.6147 REMARK 3 L33: 25.3340 L12: 9.1564 REMARK 3 L13: -6.9426 L23: 2.3864 REMARK 3 S TENSOR REMARK 3 S11: 0.8003 S12: -0.6184 S13: 0.8274 REMARK 3 S21: -0.7662 S22: -0.0113 S23: -2.0371 REMARK 3 S31: -1.6521 S32: 0.5894 S33: -0.7891 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 519 A 532 REMARK 3 ORIGIN FOR THE GROUP (A): 21.4687 26.1787 2.1749 REMARK 3 T TENSOR REMARK 3 T11: 0.0496 T22: -0.1104 REMARK 3 T33: -0.1780 T12: -0.0968 REMARK 3 T13: -0.0085 T23: 0.0397 REMARK 3 L TENSOR REMARK 3 L11: 5.0040 L22: 1.4597 REMARK 3 L33: 7.1826 L12: 1.4206 REMARK 3 L13: -1.7227 L23: -1.9297 REMARK 3 S TENSOR REMARK 3 S11: -0.1271 S12: 0.1243 S13: 0.1468 REMARK 3 S21: 0.5666 S22: 0.1978 S23: -0.0066 REMARK 3 S31: -0.4241 S32: 0.4106 S33: -0.0707 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 533 A 541 REMARK 3 ORIGIN FOR THE GROUP (A): 15.0519 37.2979 12.6268 REMARK 3 T TENSOR REMARK 3 T11: 0.2945 T22: 0.1671 REMARK 3 T33: 0.2695 T12: 0.0106 REMARK 3 T13: -0.0186 T23: -0.0296 REMARK 3 L TENSOR REMARK 3 L11: 18.2657 L22: 16.7273 REMARK 3 L33: 125.7785 L12: -14.1740 REMARK 3 L13: -12.5031 L23: 35.6154 REMARK 3 S TENSOR REMARK 3 S11: 0.1289 S12: -1.6888 S13: 0.7968 REMARK 3 S21: 0.9116 S22: 1.4310 S23: -0.3659 REMARK 3 S31: 1.0221 S32: 2.6420 S33: -1.5600 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 542 A 550 REMARK 3 ORIGIN FOR THE GROUP (A): 20.3326 28.2507 -2.6440 REMARK 3 T TENSOR REMARK 3 T11: 0.1272 T22: -0.1709 REMARK 3 T33: -0.2590 T12: -0.2193 REMARK 3 T13: -0.0225 T23: 0.0413 REMARK 3 L TENSOR REMARK 3 L11: 11.1628 L22: 3.6891 REMARK 3 L33: 8.6895 L12: -2.5795 REMARK 3 L13: -1.9369 L23: -0.7172 REMARK 3 S TENSOR REMARK 3 S11: -0.1047 S12: 0.5413 S13: 0.5087 REMARK 3 S21: 0.1101 S22: -0.2106 S23: -0.0302 REMARK 3 S31: -1.1264 S32: 0.2120 S33: 0.3152 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 551 A 559 REMARK 3 ORIGIN FOR THE GROUP (A): 38.1795 22.9333 -0.2285 REMARK 3 T TENSOR REMARK 3 T11: -0.1071 T22: -0.0102 REMARK 3 T33: 0.0157 T12: -0.1284 REMARK 3 T13: -0.0770 T23: 0.0125 REMARK 3 L TENSOR REMARK 3 L11: 74.2756 L22: 4.5784 REMARK 3 L33: 19.1045 L12: 4.9041 REMARK 3 L13: 3.8394 L23: -8.7152 REMARK 3 S TENSOR REMARK 3 S11: 0.3728 S12: -0.6687 S13: -0.8107 REMARK 3 S21: 0.9811 S22: -0.9627 S23: -0.4627 REMARK 3 S31: 0.6951 S32: 0.2992 S33: 0.5899 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 569 A 591 REMARK 3 ORIGIN FOR THE GROUP (A): 34.5771 27.4327 0.0220 REMARK 3 T TENSOR REMARK 3 T11: -0.0668 T22: 0.5447 REMARK 3 T33: 0.2858 T12: -0.3610 REMARK 3 T13: 0.0000 T23: 0.0844 REMARK 3 L TENSOR REMARK 3 L11: 18.0502 L22: 11.6956 REMARK 3 L33: 6.5476 L12: -1.4648 REMARK 3 L13: 8.5547 L23: -4.5844 REMARK 3 S TENSOR REMARK 3 S11: -0.8341 S12: 0.9071 S13: 0.4792 REMARK 3 S21: -0.4189 S22: -0.0442 S23: -0.6852 REMARK 3 S31: -1.4659 S32: 1.3379 S33: 0.8782 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 592 A 611 REMARK 3 ORIGIN FOR THE GROUP (A): 29.4846 15.8107 4.5444 REMARK 3 T TENSOR REMARK 3 T11: -0.0757 T22: 0.2794 REMARK 3 T33: 0.1436 T12: 0.0326 REMARK 3 T13: 0.0091 T23: -0.0003 REMARK 3 L TENSOR REMARK 3 L11: 8.5074 L22: 10.5574 REMARK 3 L33: 12.3213 L12: 2.5629 REMARK 3 L13: 4.9986 L23: -0.2098 REMARK 3 S TENSOR REMARK 3 S11: -0.2793 S12: 0.4326 S13: -1.3496 REMARK 3 S21: 0.6045 S22: 0.5255 S23: -0.4640 REMARK 3 S31: 0.6685 S32: 2.1335 S33: -0.2462 REMARK 3 REMARK 3 BULK SOLVENT MODELLING. REMARK 3 METHOD USED : MASK REMARK 3 PARAMETERS FOR MASK CALCULATION REMARK 3 VDW PROBE RADIUS : 1.20 REMARK 3 ION PROBE RADIUS : 0.80 REMARK 3 SHRINKAGE RADIUS : 0.80 REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: HYDROGENS HAVE BEEN ADDED IN THE RIDING REMARK 3 POSITIONS REMARK 4 REMARK 4 2PZ1 COMPLIES WITH FORMAT V. 3.30, 13-JUL-11 REMARK 100 REMARK 100 THIS ENTRY HAS BEEN PROCESSED BY RCSB ON 01-JUN-07. REMARK 100 THE RCSB ID CODE IS RCSB042942. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 12-FEB-05; 15-FEB-06 REMARK 200 TEMPERATURE (KELVIN) : 100; 100 REMARK 200 PH : 7 REMARK 200 NUMBER OF CRYSTALS USED : 2 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : Y; N REMARK 200 RADIATION SOURCE : APS; ROTATING ANODE REMARK 200 BEAMLINE : 22-ID; NULL REMARK 200 X-RAY GENERATOR MODEL : NULL; RIGAKU RU300 REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M; M REMARK 200 WAVELENGTH OR RANGE (A) : .97925, .97936, .97164; 1.5418 REMARK 200 MONOCHROMATOR : ROSENBAUM-ROCK DOUBLE SI(220) REMARK 200 CRYSTAL CRYOGENICALLY COOLED REMARK 200 MONOCHROMATOR; GRAPHITE REMARK 200 OPTICS : ROSENBAUM-ROCK VERTICAL FOCUSING REMARK 200 MIRROR; OSMIC CONFOCAL BLUE MULTI REMARK 200 -LAYER MIRRORS REMARK 200 REMARK 200 DETECTOR TYPE : CCD; IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : MARMOSAIC 300 MM CCD; RIGAKU REMARK 200 RAXIS IV REMARK 200 INTENSITY-INTEGRATION SOFTWARE : HKL-2000 REMARK 200 DATA SCALING SOFTWARE : HKL-2000 REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 20993 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.250 REMARK 200 RESOLUTION RANGE LOW (A) : 50.000 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 2.000 REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.1 REMARK 200 DATA REDUNDANCY : 2.800 REMARK 200 R MERGE (I) : NULL REMARK 200 R SYM (I) : 0.04100 REMARK 200 FOR THE DATA SET : 30.2000 REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.25 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.34 REMARK 200 COMPLETENESS FOR SHELL (%) : 97.9 REMARK 200 DATA REDUNDANCY IN SHELL : 2.60 REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : 0.41200 REMARK 200 FOR SHELL : 3.230 REMARK 200 REMARK 200 DIFFRACTION PROTOCOL: MAD; SINGLE WAVELENGTH REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MAD, MOLECULAR REPLACEMENT REMARK 200 SOFTWARE USED: SHELXD, MLPHARE, PHAZER REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 41.48 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 2.10 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 100 MM HEPES PH 7, 20 % PEG 3350, 200 REMARK 280 MM MAGNESIUM ACETATE, 10% GLYCEROL, VAPOR DIFFUSION, SITTING REMARK 280 DROP, TEMPERATURE 291K REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: C 1 2 1 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -X,Y,-Z REMARK 290 3555 X+1/2,Y+1/2,Z REMARK 290 4555 -X+1/2,Y+1/2,-Z REMARK 290 REMARK 290 WHERE NNN -> OPERATOR NUMBER REMARK 290 MMM -> TRANSLATION VECTOR REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 2 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 3 1.000000 0.000000 0.000000 50.20900 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 39.94150 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 50.20900 REMARK 290 SMTRY2 4 0.000000 1.000000 0.000000 39.94150 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 300 REMARK 300 BIOMOLECULE: 1 REMARK 300 SEE REMARK 350 FOR THE AUTHOR PROVIDED AND/OR PROGRAM REMARK 300 GENERATED ASSEMBLY INFORMATION FOR THE STRUCTURE IN REMARK 300 THIS ENTRY. THE REMARK MAY ALSO PROVIDE INFORMATION ON REMARK 300 BURIED SURFACE AREA. REMARK 350 REMARK 350 COORDINATES FOR A COMPLETE MULTIMER REPRESENTING THE KNOWN REMARK 350 BIOLOGICALLY SIGNIFICANT OLIGOMERIZATION STATE OF THE REMARK 350 MOLECULE CAN BE GENERATED BY APPLYING BIOMT TRANSFORMATIONS REMARK 350 GIVEN BELOW. BOTH NON-CRYSTALLOGRAPHIC AND REMARK 350 CRYSTALLOGRAPHIC OPERATIONS ARE GIVEN. REMARK 350 REMARK 350 BIOMOLECULE: 1 REMARK 350 AUTHOR DETERMINED BIOLOGICAL UNIT: MONOMERIC 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 465 REMARK 465 MISSING RESIDUES REMARK 465 THE FOLLOWING RESIDUES WERE NOT LOCATED IN THE REMARK 465 EXPERIMENT. (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 465 IDENTIFIER; SSSEQ=SEQUENCE NUMBER; I=INSERTION CODE.) REMARK 465 REMARK 465 M RES C SSSEQI REMARK 465 GLY A 167 REMARK 465 ALA A 168 REMARK 465 MET A 169 REMARK 465 SER A 170 REMARK 465 SER A 171 REMARK 465 SER A 172 REMARK 465 HIS A 173 REMARK 465 HIS A 174 REMARK 465 TYR A 175 REMARK 465 SER A 176 REMARK 465 HIS A 177 REMARK 465 PRO A 178 REMARK 465 GLY A 179 REMARK 465 GLY A 180 REMARK 465 ASP A 255 REMARK 465 GLU A 256 REMARK 465 PRO A 257 REMARK 465 ALA A 258 REMARK 465 ASP A 259 REMARK 465 ASP A 260 REMARK 465 ASP A 261 REMARK 465 ALA A 262 REMARK 465 PRO A 263 REMARK 465 LEU A 264 REMARK 465 ALA A 265 REMARK 465 GLY A 266 REMARK 465 ASN A 267 REMARK 465 SER A 268 REMARK 465 GLY A 269 REMARK 465 ALA A 270 REMARK 465 GLU A 271 REMARK 465 ASP A 272 REMARK 465 GLY A 273 REMARK 465 GLY A 274 REMARK 465 ALA A 275 REMARK 465 GLU A 276 REMARK 465 ALA A 277 REMARK 465 GLN A 612 REMARK 465 GLU A 613 REMARK 465 THR A 614 REMARK 465 GLY A 615 REMARK 465 PHE A 616 REMARK 465 SER A 617 REMARK 465 ILE A 618 REMARK 465 THR A 619 REMARK 465 GLU A 620 REMARK 465 LEU A 621 REMARK 465 GLN A 622 REMARK 465 ARG A 623 REMARK 465 LYS A 624 REMARK 465 GLN A 625 REMARK 465 ALA A 626 REMARK 465 MET A 627 REMARK 465 LEU A 628 REMARK 465 ASN A 629 REMARK 465 ALA A 630 REMARK 465 SER A 631 REMARK 465 LYS A 632 REMARK 470 REMARK 470 MISSING ATOM REMARK 470 THE FOLLOWING RESIDUES HAVE MISSING ATOMS (M=MODEL NUMBER; REMARK 470 RES=RESIDUE NAME; C=CHAIN IDENTIFIER; SSEQ=SEQUENCE NUMBER; REMARK 470 I=INSERTION CODE): REMARK 470 M RES CSSEQI ATOMS REMARK 470 LYS A 561 CB CG CD CE NZ REMARK 470 ASP A 562 CB CG OD1 OD2 REMARK 470 ARG A 563 CB CG CD NE CZ NH1 NH2 REMARK 470 ASP A 564 CB CG OD1 OD2 REMARK 470 LEU A 565 CB CG CD1 CD2 REMARK 470 HIS A 566 CB CG ND1 CD2 CE1 NE2 REMARK 470 VAL A 567 CB CG1 CG2 REMARK 470 SER A 568 CB OG REMARK 470 ILE A 569 CB CG1 CG2 CD1 REMARK 470 LYS A 570 CB CG CD CE NZ REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS IN SAME ASYMMETRIC UNIT REMARK 500 REMARK 500 THE FOLLOWING ATOMS ARE IN CLOSE CONTACT. REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI DISTANCE REMARK 500 OG1 THR A 580 OD1 ASP A 582 2.03 REMARK 500 SG CYS A 198 O HOH A 82 2.18 REMARK 500 OG1 THR A 507 OE1 GLN A 518 2.18 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: COVALENT BOND ANGLES REMARK 500 REMARK 500 THE STEREOCHEMICAL PARAMETERS OF THE FOLLOWING RESIDUES REMARK 500 HAVE VALUES WHICH DEVIATE FROM EXPECTED VALUES BY MORE REMARK 500 THAN 6*RMSD (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,3(1X,A4,2X),12X,F5.1) REMARK 500 REMARK 500 EXPECTED VALUES PROTEIN: ENGH AND HUBER, 1999 REMARK 500 EXPECTED VALUES NUCLEIC ACID: CLOWNEY ET AL 1996 REMARK 500 REMARK 500 M RES CSSEQI ATM1 ATM2 ATM3 REMARK 500 GLY A 239 N - CA - C ANGL. DEV. = -18.0 DEGREES REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: TORSION ANGLES REMARK 500 REMARK 500 TORSION ANGLES OUTSIDE THE EXPECTED RAMACHANDRAN REGIONS: REMARK 500 (M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN IDENTIFIER; REMARK 500 SSEQ=SEQUENCE NUMBER; I=INSERTION CODE). REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT:(10X,I3,1X,A3,1X,A1,I4,A1,4X,F7.2,3X,F7.2) REMARK 500 REMARK 500 EXPECTED VALUES: GJ KLEYWEGT AND TA JONES (1996). PHI/PSI- REMARK 500 CHOLOGY: RAMACHANDRAN REVISITED. STRUCTURE 4, 1395 - 1400 REMARK 500 REMARK 500 M RES CSSEQI PSI PHI REMARK 500 ASP A 238 -58.92 135.81 REMARK 500 GLU A 240 115.72 153.51 REMARK 500 SER A 279 43.72 35.95 REMARK 500 ARG A 317 66.72 -106.76 REMARK 500 GLU A 491 -176.80 117.22 REMARK 500 GLN A 513 126.80 130.87 REMARK 500 ALA A 514 70.56 -170.81 REMARK 500 HIS A 526 -15.69 83.92 REMARK 500 ASP A 562 -101.49 -64.64 REMARK 500 ARG A 563 136.14 108.24 REMARK 500 ASP A 564 66.94 69.92 REMARK 500 LEU A 565 -50.81 112.50 REMARK 500 HIS A 566 -136.32 -154.34 REMARK 500 VAL A 567 -86.68 -138.27 REMARK 500 SER A 568 102.56 -49.46 REMARK 500 LYS A 570 -105.78 -120.78 REMARK 500 ASN A 571 61.24 -61.65 REMARK 500 ARG A 577 -102.05 -63.59 REMARK 500 THR A 580 -129.84 -77.85 REMARK 500 LEU A 610 68.56 -115.78 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: NON-CIS, NON-TRANS REMARK 500 REMARK 500 THE FOLLOWING PEPTIDE BONDS DEVIATE SIGNIFICANTLY FROM BOTH REMARK 500 CIS AND TRANS CONFORMATION. CIS BONDS, IF ANY, ARE LISTED REMARK 500 ON CISPEP RECORDS. TRANS IS DEFINED AS 180 +/- 30 AND REMARK 500 CIS IS DEFINED AS 0 +/- 30 DEGREES. REMARK 500 MODEL OMEGA REMARK 500 GLY A 239 GLU A 240 -51.96 REMARK 500 REMARK 500 REMARK: NULL REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CHIRAL CENTERS REMARK 500 REMARK 500 UNEXPECTED CONFIGURATION OF THE FOLLOWING CHIRAL REMARK 500 CENTER(S) USING IMPROPER CA--C--CB--N CHIRALITY REMARK 500 FOR AMINO ACIDS AND C1'--O4'--N1(N9)--C2' FOR REMARK 500 NUCLEIC ACIDS OR EQUIVALENT ANGLE REMARK 500 M=MODEL NUMBER; RES=RESIDUE NAME; C=CHAIN REMARK 500 IDENTIFIER; SSEQ=SEQUENCE NUMBER; I=INSERTION CODE REMARK 500 REMARK 500 STANDARD TABLE: REMARK 500 FORMAT: (10X,I3,1X,A3,1X,A1,I4,A1,6X,F5.1,6X,A1,10X,A1,3X,A16) REMARK 500 REMARK 500 M RES CSSEQI IMPROPER EXPECTED FOUND DETAILS REMARK 500 GLU A 240 24.9 L L OUTSIDE RANGE REMARK 500 REMARK 500 REMARK: NULL DBREF 2PZ1 A 170 632 UNP Q9NR80 ARHG4_HUMAN 137 599 SEQADV 2PZ1 GLY A 167 UNP Q9NR80 CLONING ARTIFACT SEQADV 2PZ1 ALA A 168 UNP Q9NR80 CLONING ARTIFACT SEQADV 2PZ1 MET A 169 UNP Q9NR80 CLONING ARTIFACT SEQRES 1 A 466 GLY ALA MET SER SER SER HIS HIS TYR SER HIS PRO GLY SEQRES 2 A 466 GLY GLY GLY GLU GLN LEU ALA ILE ASN GLU LEU ILE SER SEQRES 3 A 466 ASP GLY SER VAL VAL CYS ALA GLU ALA LEU TRP ASP HIS SEQRES 4 A 466 VAL THR MET ASP ASP GLN GLU LEU GLY PHE LYS ALA GLY SEQRES 5 A 466 ASP VAL ILE GLU VAL MET ASP ALA THR ASN ARG GLU TRP SEQRES 6 A 466 TRP TRP GLY ARG VAL ALA ASP GLY GLU GLY TRP PHE PRO SEQRES 7 A 466 ALA SER PHE VAL ARG LEU ARG VAL ASN GLN ASP GLU PRO SEQRES 8 A 466 ALA ASP ASP ASP ALA PRO LEU ALA GLY ASN SER GLY ALA SEQRES 9 A 466 GLU ASP GLY GLY ALA GLU ALA GLN SER SER LYS ASP GLN SEQRES 10 A 466 MET ARG THR ASN VAL ILE ASN GLU ILE LEU SER THR GLU SEQRES 11 A 466 ARG ASP TYR ILE LYS HIS LEU ARG ASP ILE CYS GLU GLY SEQRES 12 A 466 TYR VAL ARG GLN CYS ARG LYS ARG ALA ASP MET PHE SER SEQRES 13 A 466 GLU GLU GLN LEU ARG THR ILE PHE GLY ASN ILE GLU ASP SEQRES 14 A 466 ILE TYR ARG CYS GLN LYS ALA PHE VAL LYS ALA LEU GLU SEQRES 15 A 466 GLN ARG PHE ASN ARG GLU ARG PRO HIS LEU SER GLU LEU SEQRES 16 A 466 GLY ALA CYS PHE LEU GLU HIS GLN ALA ASP PHE GLN ILE SEQRES 17 A 466 TYR SER GLU TYR CYS ASN ASN HIS PRO ASN ALA CYS VAL SEQRES 18 A 466 GLU LEU SER ARG LEU THR LYS LEU SER LYS TYR VAL TYR SEQRES 19 A 466 PHE PHE GLU ALA CYS ARG LEU LEU GLN LYS MET ILE ASP SEQRES 20 A 466 ILE SER LEU ASP GLY PHE LEU LEU THR PRO VAL GLN LYS SEQRES 21 A 466 ILE CYS LYS TYR PRO LEU GLN LEU ALA GLU LEU LEU LYS SEQRES 22 A 466 TYR THR HIS PRO GLN HIS ARG ASP PHE LYS ASP VAL GLU SEQRES 23 A 466 ALA ALA LEU HIS ALA MET LYS ASN VAL ALA GLN LEU ILE SEQRES 24 A 466 ASN GLU ARG LYS ARG ARG LEU GLU ASN ILE ASP LYS ILE SEQRES 25 A 466 ALA GLN TRP GLN SER SER ILE GLU ASP TRP GLU GLY GLU SEQRES 26 A 466 ASP LEU LEU VAL ARG SER SER GLU LEU ILE TYR SER GLY SEQRES 27 A 466 GLU LEU THR ARG VAL THR GLN PRO GLN ALA LYS SER GLN SEQRES 28 A 466 GLN ARG MET PHE PHE LEU PHE ASP HIS GLN LEU ILE TYR SEQRES 29 A 466 CYS LYS LYS ASP LEU LEU ARG ARG ASP VAL LEU TYR TYR SEQRES 30 A 466 LYS GLY ARG LEU ASP MET ASP GLY LEU GLU VAL VAL ASP SEQRES 31 A 466 LEU GLU ASP GLY LYS ASP ARG ASP LEU HIS VAL SER ILE SEQRES 32 A 466 LYS ASN ALA PHE ARG LEU HIS ARG GLY ALA THR GLY ASP SEQRES 33 A 466 SER HIS LEU LEU CYS THR ARG LYS PRO GLU GLN LYS GLN SEQRES 34 A 466 ARG TRP LEU LYS ALA PHE ALA ARG GLU ARG GLU GLN VAL SEQRES 35 A 466 GLN LEU ASP GLN GLU THR GLY PHE SER ILE THR GLU LEU SEQRES 36 A 466 GLN ARG LYS GLN ALA MET LEU ASN ALA SER LYS FORMUL 2 HOH *100(H2 O) HELIX 1 1 ALA A 186 SER A 192 1 7 HELIX 2 2 SER A 280 TYR A 310 1 31 HELIX 3 3 TYR A 310 ARG A 317 1 8 HELIX 4 4 SER A 322 GLY A 331 1 10 HELIX 5 5 ASN A 332 PHE A 351 1 20 HELIX 6 6 ARG A 355 SER A 359 5 5 HELIX 7 7 LEU A 361 HIS A 368 1 8 HELIX 8 8 HIS A 368 GLN A 373 1 6 HELIX 9 9 ILE A 374 LYS A 394 1 21 HELIX 10 10 LEU A 395 LYS A 410 1 16 HELIX 11 11 SER A 415 TYR A 440 1 26 HELIX 12 12 ASP A 447 ILE A 485 1 39 HELIX 13 13 ASP A 492 SER A 497 1 6 HELIX 14 14 LYS A 590 LEU A 610 1 21 SHEET 1 A 5 GLY A 239 PRO A 244 0 SHEET 2 A 5 TRP A 231 VAL A 236 -1 N TRP A 232 O PHE A 243 SHEET 3 A 5 VAL A 220 ASP A 225 -1 N MET A 224 O TRP A 233 SHEET 4 A 5 VAL A 197 ALA A 201 -1 N VAL A 197 O VAL A 223 SHEET 5 A 5 VAL A 248 LEU A 250 -1 O ARG A 249 N GLU A 200 SHEET 1 B 7 LEU A 541 ASP A 548 0 SHEET 2 B 7 GLN A 527 LYS A 533 -1 N LEU A 528 O LEU A 547 SHEET 3 B 7 SER A 516 PHE A 524 -1 N PHE A 524 O GLN A 527 SHEET 4 B 7 LEU A 500 VAL A 509 -1 N ILE A 501 O LEU A 523 SHEET 5 B 7 SER A 583 THR A 588 -1 O CYS A 587 N THR A 507 SHEET 6 B 7 ASN A 571 HIS A 576 -1 N PHE A 573 O LEU A 586 SHEET 7 B 7 GLU A 553 ASP A 556 -1 N GLU A 553 O HIS A 576 CISPEP 1 GLN A 513 ALA A 514 0 -7.72 CRYST1 100.418 79.883 67.407 90.00 122.99 90.00 C 1 2 1 4 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 0.009958 0.000000 0.006465 0.00000 SCALE2 0.000000 0.012518 0.000000 0.00000 SCALE3 0.000000 0.000000 0.017688 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 590 LYS NZ :NH3+ -172:sc= -0.0281 (180deg=0) USER MOD Set 1.2: A 593 GLN : amide:sc=-0.00216 K(o=-0.03,f=-4!) USER MOD Set 2.1: A 507 THR OG1 : rot -59:sc= 0.355! USER MOD Set 2.2: A 518 GLN : amide:sc= -0.277 K(o=0.078,f=-11!) USER MOD Set 3.1: A 497 SER OG : rot -64:sc= 1.77 USER MOD Set 3.2: A 527 GLN : amide:sc= 2.05 K(o=3.8,f=-0.94) USER MOD Set 4.1: A 456 HIS : no HD1:sc= -0.0819 K(o=-0.1,f=-0.78) USER MOD Set 4.2: A 460 ASN : amide:sc= -0.0229 K(o=-0.1,f=-1.2) USER MOD Set 5.1: A 439 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 5.2: A 440 TYR OH : rot 180:sc= 0 USER MOD Set 6.1: A 426 LYS NZ :NH3+ 143:sc= -0.909 (180deg=-2.29!) USER MOD Set 6.2: A 433 GLN :FLIP amide:sc= -2.24 F(o=-5.6!,f=-3.1) USER MOD Set 7.1: A 382 HIS :FLIP no HD1:sc= -0.0105 F(o=-1,f=-0.015) USER MOD Set 7.2: A 386 CYS SG : rot 180:sc=-0.00487 USER MOD Set 8.1: A 345 LYS NZ :NH3+ 150:sc= 1.04 (180deg=0) USER MOD Set 8.2: A 349 GLN : amide:sc= 0.594 K(o=1.6,f=-3) USER MOD Set 9.1: A 299 TYR OH : rot 162:sc= 1.16 USER MOD Set 9.2: A 340 GLN :FLIP amide:sc= 1.44 F(o=2,f=5.6) USER MOD Set 9.3: A 375 TYR OH : rot 6:sc= 1.67 USER MOD Set 9.4: A 430 TYR OH : rot -171:sc= 1.38 USER MOD Set10.1: A 253 ASN : amide:sc= 0.43 X(o=-2.2,f=-2.1) USER MOD Set10.2: A 283 GLN : amide:sc= 0.851 X(o=-2.2,f=-1.7) USER MOD Set10.3: A 287 ASN : amide:sc= -3.51! X(o=-2.2!,f=-1.7) USER MOD Single : A 184 GLN : amide:sc= 0 X(o=0,f=-0.0018) USER MOD Single : A 188 ASN : amide:sc= -0.0308 X(o=-0.031,f=-0.31) USER MOD Single : A 192 SER OG : rot 86:sc= 0.536 USER MOD Single : A 195 SER OG : rot 180:sc= 0 USER MOD Single : A 198 CYS SG : rot 180:sc= 0 USER MOD Single : A 205 HIS :FLIP no HE2:sc= 1.01 F(o=-3.6!,f=1) USER MOD Single : A 207 THR OG1 : rot 118:sc= 1.29 USER MOD Single : A 208 MET CE :methyl -146:sc= -0.0534 (180deg=-0.174) USER MOD Single : A 211 GLN :FLIP amide:sc= -0.709 F(o=-2!,f=-0.71) USER MOD Single : A 216 LYS NZ :NH3+ -150:sc= -0.335 (180deg=-0.851) USER MOD Single : A 224 MET CE :methyl -170:sc= -0.723 (180deg=-1.05) USER MOD Single : A 227 THR OG1 : rot 78:sc= 0.933 USER MOD Single : A 228 ASN :FLIP amide:sc= 0.0846 F(o=-1.4!,f=0.085) USER MOD Single : A 246 SER OG : rot -90:sc= 1.35 USER MOD Single : A 254 GLN :FLIP amide:sc= 0.478 F(o=-7.5!,f=0.48) USER MOD Single : A 278 GLN :FLIP amide:sc= -0.787 F(o=-3.5!,f=-0.79) USER MOD Single : A 279 SER OG : rot 180:sc= 0 USER MOD Single : A 280 SER OG : rot 180:sc= 0 USER MOD Single : A 281 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 284 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 286 THR OG1 : rot 180:sc= -0.591 USER MOD Single : A 290 ASN : amide:sc= -0.119 K(o=-0.12,f=-1.3!) USER MOD Single : A 294 SER OG : rot 180:sc= -0.0325 USER MOD Single : A 295 THR OG1 : rot 180:sc= 0 USER MOD Single : A 301 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 302 HIS : no HD1:sc= -0.033 X(o=-0.033,f=-0.13) USER MOD Single : A 307 CYS SG : rot 84:sc= 0.00199 USER MOD Single : A 310 TYR OH : rot 180:sc= 0 USER MOD Single : A 313 GLN : amide:sc= -0.0154 K(o=-0.015,f=-0.62) USER MOD Single : A 314 CYS SG : rot -79:sc= 0.21 USER MOD Single : A 316 LYS NZ :NH3+ -119:sc= 0.157 (180deg=-1.07) USER MOD Single : A 320 MET CE :methyl 153:sc= -0.0798 (180deg=-0.996) USER MOD Single : A 322 SER OG : rot 180:sc= 0.465 USER MOD Single : A 325 GLN : amide:sc= 0.354 K(o=0.35,f=-5.1!) USER MOD Single : A 328 THR OG1 : rot 75:sc= 0.443 USER MOD Single : A 332 ASN : amide:sc= -0.0791 K(o=-0.079,f=-6.4!) USER MOD Single : A 337 TYR OH : rot 180:sc= 0 USER MOD Single : A 339 CYS SG : rot 92:sc= -1.17! USER MOD Single : A 341 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 352 ASN : amide:sc= -0.304 K(o=-0.3,f=-7.2!) USER MOD Single : A 357 HIS : no HE2:sc= -4.34! C(o=-4.3!,f=-12!) USER MOD Single : A 359 SER OG : rot 84:sc= 0.641 USER MOD Single : A 364 CYS SG : rot -84:sc= 0.0219 USER MOD Single : A 368 HIS :FLIP no HE2:sc= -0.483 F(o=-1.3!,f=-0.48) USER MOD Single : A 369 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 373 GLN :FLIP amide:sc= 0.511 F(o=-0.065,f=0.51) USER MOD Single : A 376 SER OG : rot 180:sc= 0 USER MOD Single : A 378 TYR OH : rot 178:sc= 1.47 USER MOD Single : A 379 CYS SG : rot 82:sc= -0.145 USER MOD Single : A 380 ASN : amide:sc= 0 K(o=0,f=-0.96) USER MOD Single : A 381 ASN :FLIP amide:sc= 1.82 F(o=0.92,f=1.8) USER MOD Single : A 384 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 390 SER OG : rot 74:sc= 0.888 USER MOD Single : A 393 THR OG1 : rot 82:sc= 0.0629 USER MOD Single : A 394 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 396 SER OG : rot 180:sc=-0.00204 USER MOD Single : A 397 LYS NZ :NH3+ -142:sc= -0.854 (180deg=-2.05!) USER MOD Single : A 398 TYR OH : rot -178:sc= 1.41 USER MOD Single : A 400 TYR OH : rot 180:sc= 0 USER MOD Single : A 405 CYS SG : rot 108:sc= 0.0316 USER MOD Single : A 409 GLN :FLIP amide:sc= -0.0642 F(o=-1.4!,f=-0.064) USER MOD Single : A 410 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 411 MET CE :methyl -115:sc= -5.76! (180deg=-10.5!) USER MOD Single : A 415 SER OG : rot 119:sc= 0.843 USER MOD Single : A 422 THR OG1 : rot 180:sc= 0 USER MOD Single : A 425 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 428 CYS SG : rot -159:sc= 0.0785 USER MOD Single : A 429 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 441 THR OG1 : rot 66:sc= 2.29 USER MOD Single : A 442 HIS : no HD1:sc= -5.17! C(o=-5.2!,f=-5.4!) USER MOD Single : A 444 GLN : amide:sc=-0.00857 K(o=-0.0086,f=-0.98) USER MOD Single : A 445 HIS :FLIP no HD1:sc= 1.02 F(o=-6!,f=1) USER MOD Single : A 449 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 MET CE :methyl -131:sc=-0.00611 (180deg=-0.248) USER MOD Single : A 459 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 463 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 466 ASN :FLIP amide:sc= -0.305! C(o=-6.3!,f=-0.31!) USER MOD Single : A 469 LYS NZ :NH3+ -153:sc= 0.843 (180deg=0.491) USER MOD Single : A 474 ASN : amide:sc= 0.349 K(o=0.35,f=-0.29) USER MOD Single : A 477 LYS NZ :NH3+ 160:sc= 0.465 (180deg=0.315) USER MOD Single : A 480 GLN : amide:sc= -0.0277 K(o=-0.028,f=-1.5) USER MOD Single : A 482 GLN : amide:sc= 0.536 K(o=0.54,f=-2.5!) USER MOD Single : A 483 SER OG : rot -41:sc= 0.0272 USER MOD Single : A 484 SER OG : rot 180:sc= 0 USER MOD Single : A 498 SER OG : rot -140:sc= -1.03 USER MOD Single : A 502 TYR OH : rot 180:sc= 0 USER MOD Single : A 503 SER OG : rot 180:sc= 0 USER MOD Single : A 510 THR OG1 : rot 180:sc= 0 USER MOD Single : A 511 GLN :FLIP amide:sc= -0.0828 F(o=-0.87,f=-0.083) USER MOD Single : A 513 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 515 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 516 SER OG : rot 180:sc= 0 USER MOD Single : A 517 GLN :FLIP amide:sc= 0.17 F(o=-4.4!,f=0.17) USER MOD Single : A 520 MET CE :methyl -160:sc= -0.16 (180deg=-1.01) USER MOD Single : A 526 HIS : no HE2:sc= 0.447 K(o=0.45,f=-2.1!) USER MOD Single : A 530 TYR OH : rot 180:sc= 0 USER MOD Single : A 531 CYS SG : rot 180:sc= 0 USER MOD Single : A 532 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 533 LYS NZ :NH3+ 170:sc= 0.576 (180deg=0.272) USER MOD Single : A 542 TYR OH : rot 22:sc= 0.784 USER MOD Single : A 543 TYR OH : rot 180:sc= 0.674 USER MOD Single : A 544 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 549 MET CE :methyl -147:sc= -11.5! (180deg=-12.8!) USER MOD Single : A 571 ASN : amide:sc=-0.00556 X(o=-0.0056,f=-0.012) USER MOD Single : A 576 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 580 THR OG1 : rot 140:sc= -0.566! USER MOD Single : A 583 SER OG : rot 144:sc= -0.99 USER MOD Single : A 584 HIS : no HD1:sc= -0.117 X(o=-0.12,f=-0.05) USER MOD Single : A 587 CYS SG : rot 180:sc= -0.311 USER MOD Single : A 588 THR OG1 : rot 170:sc= 0 USER MOD Single : A 594 LYS NZ :NH3+ 150:sc= 1.62 (180deg=0.622) USER MOD Single : A 595 GLN : amide:sc= -1.1 K(o=-1.1,f=-3.2!) USER MOD Single : A 599 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 607 GLN : amide:sc= -0.12 X(o=-0.12,f=-0.12) USER MOD Single : A 609 GLN : amide:sc= 0 X(o=0,f=-0.19) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 181 23.898 3.663 41.031 1.00 55.46 N ATOM 2 CA GLY A 181 23.093 2.632 41.741 1.00 55.34 C ATOM 3 C GLY A 181 22.523 3.186 43.031 1.00 55.57 C ATOM 4 O GLY A 181 23.171 3.996 43.708 1.00 56.43 O ATOM 0 HA2 GLY A 181 22.372 2.328 41.168 1.00 55.34 H new ATOM 0 HA3 GLY A 181 23.647 1.859 41.933 1.00 55.34 H new ATOM 5 N GLY A 182 21.310 2.757 43.373 1.00 54.54 N ATOM 6 CA GLY A 182 20.648 3.207 44.596 1.00 53.38 C ATOM 7 C GLY A 182 19.234 3.700 44.352 1.00 52.56 C ATOM 8 O GLY A 182 18.547 3.219 43.450 1.00 52.47 O ATOM 0 H GLY A 182 20.850 2.200 42.906 1.00 54.54 H new ATOM 0 HA2 GLY A 182 20.626 2.477 45.234 1.00 53.38 H new ATOM 0 HA3 GLY A 182 21.170 3.919 44.998 1.00 53.38 H new ATOM 9 N GLU A 183 18.794 4.661 45.161 1.00 51.82 N ATOM 10 CA GLU A 183 17.459 5.236 45.007 1.00 51.14 C ATOM 11 C GLU A 183 17.517 6.597 44.306 1.00 50.87 C ATOM 12 O GLU A 183 18.282 7.480 44.695 1.00 50.79 O ATOM 13 CB GLU A 183 16.721 5.293 46.355 1.00 50.92 C ATOM 14 CG GLU A 183 17.175 6.376 47.325 1.00 50.60 C ATOM 15 CD GLU A 183 16.124 7.456 47.526 1.00 50.46 C ATOM 16 OE1 GLU A 183 15.820 7.776 48.697 1.00 50.28 O ATOM 17 OE2 GLU A 183 15.594 7.975 46.520 1.00 50.33 O ATOM 0 H GLU A 183 19.254 4.995 45.807 1.00 51.82 H new ATOM 0 HA GLU A 183 16.941 4.652 44.431 1.00 51.14 H new ATOM 0 HB2 GLU A 183 15.775 5.418 46.180 1.00 50.92 H new ATOM 0 HB3 GLU A 183 16.817 4.432 46.792 1.00 50.92 H new ATOM 0 HG2 GLU A 183 17.386 5.971 48.181 1.00 50.60 H new ATOM 0 HG3 GLU A 183 17.992 6.781 46.993 1.00 50.60 H new ATOM 18 N GLN A 184 16.703 6.743 43.264 1.00 50.66 N ATOM 19 CA GLN A 184 16.814 7.857 42.318 1.00 50.60 C ATOM 20 C GLN A 184 16.336 9.219 42.821 1.00 50.92 C ATOM 21 O GLN A 184 15.613 9.319 43.814 1.00 50.82 O ATOM 22 CB GLN A 184 16.095 7.511 41.008 1.00 50.17 C ATOM 23 CG GLN A 184 16.998 6.918 39.933 1.00 49.69 C ATOM 24 CD GLN A 184 17.651 7.978 39.060 1.00 49.34 C ATOM 25 OE1 GLN A 184 16.977 8.668 38.293 1.00 49.18 O ATOM 26 NE2 GLN A 184 18.970 8.101 39.165 1.00 49.13 N ATOM 0 H GLN A 184 16.065 6.195 43.083 1.00 50.66 H new ATOM 0 HA GLN A 184 17.769 7.962 42.184 1.00 50.60 H new ATOM 0 HB2 GLN A 184 15.382 6.882 41.199 1.00 50.17 H new ATOM 0 HB3 GLN A 184 15.678 8.314 40.658 1.00 50.17 H new ATOM 0 HG2 GLN A 184 17.688 6.383 40.355 1.00 49.69 H new ATOM 0 HG3 GLN A 184 16.478 6.320 39.374 1.00 49.69 H new ATOM 0 HE21 GLN A 184 19.406 7.601 39.712 1.00 49.13 H new ATOM 0 HE22 GLN A 184 19.387 8.681 38.686 1.00 49.13 H new ATOM 27 N LEU A 185 16.760 10.263 42.109 1.00 51.42 N ATOM 28 CA LEU A 185 16.334 11.636 42.366 1.00 52.06 C ATOM 29 C LEU A 185 15.541 12.170 41.174 1.00 52.82 C ATOM 30 O LEU A 185 15.525 11.556 40.108 1.00 52.75 O ATOM 31 CB LEU A 185 17.547 12.537 42.623 1.00 51.91 C ATOM 32 CG LEU A 185 18.179 12.561 44.020 1.00 51.81 C ATOM 33 CD1 LEU A 185 18.885 11.247 44.335 1.00 51.81 C ATOM 34 CD2 LEU A 185 19.154 13.724 44.132 1.00 51.88 C ATOM 0 H LEU A 185 17.312 10.191 41.453 1.00 51.42 H new ATOM 0 HA LEU A 185 15.770 11.639 43.155 1.00 52.06 H new ATOM 0 HB2 LEU A 185 18.239 12.281 41.994 1.00 51.91 H new ATOM 0 HB3 LEU A 185 17.287 13.446 42.405 1.00 51.91 H new ATOM 0 HG LEU A 185 17.467 12.678 44.669 1.00 51.81 H new ATOM 0 HD11 LEU A 185 19.274 11.293 45.223 1.00 51.81 H new ATOM 0 HD12 LEU A 185 18.245 10.519 44.300 1.00 51.81 H new ATOM 0 HD13 LEU A 185 19.586 11.092 43.683 1.00 51.81 H new ATOM 0 HD21 LEU A 185 19.549 13.731 45.018 1.00 51.88 H new ATOM 0 HD22 LEU A 185 19.854 13.625 43.468 1.00 51.88 H new ATOM 0 HD23 LEU A 185 18.682 14.558 43.982 1.00 51.88 H new ATOM 35 N ALA A 186 14.886 13.315 41.357 1.00 54.02 N ATOM 36 CA ALA A 186 14.140 13.960 40.277 1.00 55.17 C ATOM 37 C ALA A 186 15.076 14.795 39.404 1.00 56.20 C ATOM 38 O ALA A 186 16.072 15.328 39.893 1.00 56.36 O ATOM 39 CB ALA A 186 13.023 14.820 40.841 1.00 55.23 C ATOM 0 H ALA A 186 14.861 13.738 42.106 1.00 54.02 H new ATOM 0 HA ALA A 186 13.742 13.270 39.723 1.00 55.17 H new ATOM 0 HB1 ALA A 186 12.539 15.240 40.113 1.00 55.23 H new ATOM 0 HB2 ALA A 186 12.416 14.265 41.355 1.00 55.23 H new ATOM 0 HB3 ALA A 186 13.400 15.505 41.415 1.00 55.23 H new ATOM 40 N ILE A 187 14.749 14.912 38.119 1.00 57.38 N ATOM 41 CA ILE A 187 15.667 15.510 37.140 1.00 58.79 C ATOM 42 C ILE A 187 16.055 16.972 37.412 1.00 59.92 C ATOM 43 O ILE A 187 17.232 17.324 37.325 1.00 59.66 O ATOM 44 CB ILE A 187 15.173 15.318 35.671 1.00 58.61 C ATOM 45 CG1 ILE A 187 16.095 16.045 34.688 1.00 58.45 C ATOM 46 CG2 ILE A 187 13.735 15.781 35.510 1.00 59.00 C ATOM 47 CD1 ILE A 187 15.790 15.760 33.238 1.00 58.49 C ATOM 0 H ILE A 187 13.999 14.652 37.789 1.00 57.38 H new ATOM 0 HA ILE A 187 16.488 15.007 37.256 1.00 58.79 H new ATOM 0 HB ILE A 187 15.203 14.370 35.468 1.00 58.61 H new ATOM 0 HG12 ILE A 187 16.028 17.000 34.842 1.00 58.45 H new ATOM 0 HG13 ILE A 187 17.013 15.792 34.872 1.00 58.45 H new ATOM 0 HG21 ILE A 187 13.454 15.651 34.591 1.00 59.00 H new ATOM 0 HG22 ILE A 187 13.161 15.266 36.099 1.00 59.00 H new ATOM 0 HG23 ILE A 187 13.670 16.722 35.737 1.00 59.00 H new ATOM 0 HD11 ILE A 187 16.409 16.250 32.675 1.00 58.49 H new ATOM 0 HD12 ILE A 187 15.883 14.809 33.068 1.00 58.49 H new ATOM 0 HD13 ILE A 187 14.882 16.037 33.038 1.00 58.49 H new ATOM 48 N ASN A 188 15.096 17.772 37.791 1.00 61.69 N ATOM 49 CA ASN A 188 15.356 19.163 38.047 1.00 63.44 C ATOM 50 C ASN A 188 16.158 19.440 39.316 1.00 63.20 C ATOM 51 O ASN A 188 16.815 20.454 39.446 1.00 63.22 O ATOM 52 CB ASN A 188 14.042 19.896 38.084 1.00 65.25 C ATOM 53 CG ASN A 188 13.542 20.238 36.723 1.00 67.24 C ATOM 54 OD1 ASN A 188 14.238 20.877 35.934 1.00 68.23 O ATOM 55 ND2 ASN A 188 12.329 19.834 36.438 1.00 68.80 N ATOM 0 H ASN A 188 14.279 17.530 37.908 1.00 61.69 H new ATOM 0 HA ASN A 188 15.919 19.482 37.324 1.00 63.44 H new ATOM 0 HB2 ASN A 188 13.383 19.350 38.540 1.00 65.25 H new ATOM 0 HB3 ASN A 188 14.143 20.710 38.602 1.00 65.25 H new ATOM 0 HD21 ASN A 188 11.985 20.013 35.670 1.00 68.80 H new ATOM 0 HD22 ASN A 188 11.876 19.390 37.019 1.00 68.80 H new ATOM 56 N GLU A 189 16.126 18.503 40.232 1.00 63.02 N ATOM 57 CA GLU A 189 16.907 18.647 41.455 1.00 63.06 C ATOM 58 C GLU A 189 18.365 18.295 41.184 1.00 62.91 C ATOM 59 O GLU A 189 19.270 18.807 41.843 1.00 62.83 O ATOM 60 CB GLU A 189 16.357 17.787 42.595 1.00 63.18 C ATOM 61 CG GLU A 189 16.971 18.125 43.957 1.00 63.31 C ATOM 62 CD GLU A 189 16.744 17.046 45.001 1.00 63.41 C ATOM 63 OE1 GLU A 189 15.944 16.123 44.741 1.00 63.53 O ATOM 64 OE2 GLU A 189 17.367 17.120 46.084 1.00 63.48 O ATOM 0 H GLU A 189 15.666 17.778 40.176 1.00 63.02 H new ATOM 0 HA GLU A 189 16.843 19.573 41.737 1.00 63.06 H new ATOM 0 HB2 GLU A 189 15.395 17.901 42.643 1.00 63.18 H new ATOM 0 HB3 GLU A 189 16.522 16.852 42.396 1.00 63.18 H new ATOM 0 HG2 GLU A 189 17.925 18.267 43.849 1.00 63.31 H new ATOM 0 HG3 GLU A 189 16.595 18.960 44.276 1.00 63.31 H new ATOM 65 N LEU A 190 18.584 17.414 40.212 1.00 62.82 N ATOM 66 CA LEU A 190 19.933 17.072 39.776 1.00 62.75 C ATOM 67 C LEU A 190 20.551 18.262 39.055 1.00 62.99 C ATOM 68 O LEU A 190 21.686 18.656 39.325 1.00 62.93 O ATOM 69 CB LEU A 190 19.905 15.864 38.841 1.00 62.48 C ATOM 70 CG LEU A 190 19.497 14.508 39.422 1.00 62.31 C ATOM 71 CD1 LEU A 190 19.521 13.440 38.338 1.00 62.09 C ATOM 72 CD2 LEU A 190 20.407 14.123 40.576 1.00 62.16 C ATOM 0 H LEU A 190 17.959 17.001 39.790 1.00 62.82 H new ATOM 0 HA LEU A 190 20.465 16.849 40.555 1.00 62.75 H new ATOM 0 HB2 LEU A 190 19.299 16.068 38.112 1.00 62.48 H new ATOM 0 HB3 LEU A 190 20.790 15.767 38.456 1.00 62.48 H new ATOM 0 HG LEU A 190 18.592 14.579 39.763 1.00 62.31 H new ATOM 0 HD11 LEU A 190 19.261 12.587 38.719 1.00 62.09 H new ATOM 0 HD12 LEU A 190 18.901 13.681 37.632 1.00 62.09 H new ATOM 0 HD13 LEU A 190 20.416 13.371 37.972 1.00 62.09 H new ATOM 0 HD21 LEU A 190 20.134 13.263 40.931 1.00 62.16 H new ATOM 0 HD22 LEU A 190 21.323 14.066 40.261 1.00 62.16 H new ATOM 0 HD23 LEU A 190 20.346 14.794 41.274 1.00 62.16 H new ATOM 73 N ILE A 191 19.782 18.833 38.136 1.00 63.38 N ATOM 74 CA ILE A 191 20.219 19.986 37.359 1.00 63.75 C ATOM 75 C ILE A 191 20.346 21.224 38.246 1.00 63.66 C ATOM 76 O ILE A 191 21.047 22.174 37.897 1.00 63.68 O ATOM 77 CB ILE A 191 19.261 20.252 36.172 1.00 63.81 C ATOM 78 CG1 ILE A 191 19.387 19.131 35.138 1.00 63.73 C ATOM 79 CG2 ILE A 191 19.532 21.612 35.547 1.00 64.00 C ATOM 80 CD1 ILE A 191 18.394 19.218 33.996 1.00 63.60 C ATOM 0 H ILE A 191 18.989 18.562 37.945 1.00 63.38 H new ATOM 0 HA ILE A 191 21.096 19.786 36.995 1.00 63.75 H new ATOM 0 HB ILE A 191 18.350 20.263 36.504 1.00 63.81 H new ATOM 0 HG12 ILE A 191 20.285 19.142 34.773 1.00 63.73 H new ATOM 0 HG13 ILE A 191 19.274 18.278 35.586 1.00 63.73 H new ATOM 0 HG21 ILE A 191 18.921 21.756 34.807 1.00 64.00 H new ATOM 0 HG22 ILE A 191 19.402 22.306 36.212 1.00 64.00 H new ATOM 0 HG23 ILE A 191 20.445 21.643 35.222 1.00 64.00 H new ATOM 0 HD11 ILE A 191 18.536 18.477 33.386 1.00 63.60 H new ATOM 0 HD12 ILE A 191 17.491 19.177 34.348 1.00 63.60 H new ATOM 0 HD13 ILE A 191 18.518 20.055 33.522 1.00 63.60 H new ATOM 81 N SER A 192 19.675 21.194 39.398 1.00 63.80 N ATOM 82 CA SER A 192 19.772 22.263 40.389 1.00 63.64 C ATOM 83 C SER A 192 21.012 22.093 41.265 1.00 63.38 C ATOM 84 O SER A 192 21.424 23.022 41.970 1.00 63.32 O ATOM 85 CB SER A 192 18.526 22.286 41.283 1.00 64.31 C ATOM 86 OG SER A 192 17.421 22.936 40.619 1.00 65.05 O ATOM 0 H SER A 192 19.150 20.552 39.626 1.00 63.80 H new ATOM 0 HA SER A 192 19.840 23.101 39.905 1.00 63.64 H new ATOM 0 HB2 SER A 192 18.277 21.379 41.519 1.00 64.31 H new ATOM 0 HB3 SER A 192 18.727 22.749 42.111 1.00 64.31 H new ATOM 0 HG SER A 192 17.012 22.377 40.143 1.00 65.05 H new ATOM 87 N ASP A 193 21.585 20.893 41.236 1.00 62.79 N ATOM 88 CA ASP A 193 22.772 20.581 42.025 1.00 62.02 C ATOM 89 C ASP A 193 24.037 20.902 41.242 1.00 61.40 C ATOM 90 O ASP A 193 25.100 21.122 41.822 1.00 61.53 O ATOM 91 CB ASP A 193 22.783 19.101 42.423 1.00 62.03 C ATOM 92 CG ASP A 193 21.735 18.766 43.466 1.00 62.02 C ATOM 93 OD1 ASP A 193 21.278 19.688 44.174 1.00 61.89 O ATOM 94 OD2 ASP A 193 21.371 17.575 43.581 1.00 62.03 O ATOM 0 H ASP A 193 21.297 20.238 40.759 1.00 62.79 H new ATOM 0 HA ASP A 193 22.747 21.126 42.827 1.00 62.02 H new ATOM 0 HB2 ASP A 193 22.634 18.557 41.634 1.00 62.03 H new ATOM 0 HB3 ASP A 193 23.660 18.869 42.766 1.00 62.03 H new ATOM 95 N GLY A 194 23.910 20.930 39.921 1.00 60.53 N ATOM 96 CA GLY A 194 25.065 21.049 39.044 1.00 59.55 C ATOM 97 C GLY A 194 25.464 19.674 38.547 1.00 58.66 C ATOM 98 O GLY A 194 26.463 19.520 37.844 1.00 58.45 O ATOM 0 H GLY A 194 23.156 20.881 39.510 1.00 60.53 H new ATOM 0 HA2 GLY A 194 24.856 21.627 38.294 1.00 59.55 H new ATOM 0 HA3 GLY A 194 25.804 21.459 39.520 1.00 59.55 H new ATOM 99 N SER A 195 24.674 18.673 38.927 1.00 57.97 N ATOM 100 CA SER A 195 24.898 17.296 38.501 1.00 57.31 C ATOM 101 C SER A 195 24.686 17.134 37.000 1.00 56.83 C ATOM 102 O SER A 195 23.979 17.924 36.373 1.00 56.67 O ATOM 103 CB SER A 195 23.978 16.337 39.262 1.00 57.29 C ATOM 104 OG SER A 195 24.427 16.144 40.593 1.00 57.25 O ATOM 0 H SER A 195 23.992 18.774 39.440 1.00 57.97 H new ATOM 0 HA SER A 195 25.821 17.077 38.703 1.00 57.31 H new ATOM 0 HB2 SER A 195 23.075 16.690 39.271 1.00 57.29 H new ATOM 0 HB3 SER A 195 23.945 15.484 38.802 1.00 57.29 H new ATOM 0 HG SER A 195 23.908 15.617 40.991 1.00 57.25 H new ATOM 105 N VAL A 196 25.309 16.106 36.434 1.00 56.25 N ATOM 106 CA VAL A 196 25.203 15.830 35.008 1.00 55.91 C ATOM 107 C VAL A 196 24.143 14.765 34.752 1.00 55.73 C ATOM 108 O VAL A 196 24.211 13.665 35.305 1.00 55.61 O ATOM 109 CB VAL A 196 26.553 15.350 34.429 1.00 55.91 C ATOM 110 CG1 VAL A 196 26.383 14.867 32.991 1.00 55.82 C ATOM 111 CG2 VAL A 196 27.598 16.459 34.516 1.00 55.95 C ATOM 0 H VAL A 196 25.804 15.550 36.865 1.00 56.25 H new ATOM 0 HA VAL A 196 24.950 16.657 34.568 1.00 55.91 H new ATOM 0 HB VAL A 196 26.865 14.600 34.960 1.00 55.91 H new ATOM 0 HG11 VAL A 196 27.240 14.570 32.646 1.00 55.82 H new ATOM 0 HG12 VAL A 196 25.753 14.130 32.969 1.00 55.82 H new ATOM 0 HG13 VAL A 196 26.048 15.594 32.443 1.00 55.82 H new ATOM 0 HG21 VAL A 196 28.438 16.142 34.149 1.00 55.95 H new ATOM 0 HG22 VAL A 196 27.295 17.230 34.011 1.00 55.95 H new ATOM 0 HG23 VAL A 196 27.726 16.711 35.444 1.00 55.95 H new ATOM 112 N VAL A 197 23.157 15.097 33.924 1.00 55.41 N ATOM 113 CA VAL A 197 22.117 14.135 33.587 1.00 55.05 C ATOM 114 C VAL A 197 22.129 13.780 32.098 1.00 54.65 C ATOM 115 O VAL A 197 21.957 14.644 31.231 1.00 55.02 O ATOM 116 CB VAL A 197 20.718 14.587 34.079 1.00 55.43 C ATOM 117 CG1 VAL A 197 20.859 15.523 35.276 1.00 55.40 C ATOM 118 CG2 VAL A 197 19.923 15.244 32.970 1.00 55.73 C ATOM 0 H VAL A 197 23.073 15.867 33.550 1.00 55.41 H new ATOM 0 HA VAL A 197 22.322 13.318 34.068 1.00 55.05 H new ATOM 0 HB VAL A 197 20.227 13.798 34.356 1.00 55.43 H new ATOM 0 HG11 VAL A 197 19.979 15.800 35.576 1.00 55.40 H new ATOM 0 HG12 VAL A 197 21.315 15.061 35.997 1.00 55.40 H new ATOM 0 HG13 VAL A 197 21.373 16.304 35.017 1.00 55.40 H new ATOM 0 HG21 VAL A 197 19.056 15.514 33.310 1.00 55.73 H new ATOM 0 HG22 VAL A 197 20.401 16.024 32.647 1.00 55.73 H new ATOM 0 HG23 VAL A 197 19.803 14.615 32.241 1.00 55.73 H new ATOM 119 N CYS A 198 22.362 12.501 31.822 1.00 53.47 N ATOM 120 CA CYS A 198 22.488 11.999 30.463 1.00 52.70 C ATOM 121 C CYS A 198 21.257 11.215 30.034 1.00 52.27 C ATOM 122 O CYS A 198 20.614 10.533 30.839 1.00 52.21 O ATOM 123 CB CYS A 198 23.736 11.119 30.319 1.00 53.10 C ATOM 124 SG CYS A 198 25.317 11.991 30.574 1.00 53.99 S ATOM 0 H CYS A 198 22.452 11.896 32.426 1.00 53.47 H new ATOM 0 HA CYS A 198 22.573 12.772 29.883 1.00 52.70 H new ATOM 0 HB2 CYS A 198 23.677 10.389 30.955 1.00 53.10 H new ATOM 0 HB3 CYS A 198 23.738 10.724 29.433 1.00 53.10 H new ATOM 0 HG CYS A 198 26.226 11.219 30.442 1.00 53.99 H new ATOM 125 N ALA A 199 20.943 11.326 28.750 1.00 51.37 N ATOM 126 CA ALA A 199 19.819 10.643 28.154 1.00 51.29 C ATOM 127 C ALA A 199 20.269 10.166 26.788 1.00 51.25 C ATOM 128 O ALA A 199 21.353 10.518 26.332 1.00 51.87 O ATOM 129 CB ALA A 199 18.629 11.591 28.022 1.00 50.44 C ATOM 0 H ALA A 199 21.388 11.810 28.196 1.00 51.37 H new ATOM 0 HA ALA A 199 19.535 9.897 28.705 1.00 51.29 H new ATOM 0 HB1 ALA A 199 17.882 11.119 27.621 1.00 50.44 H new ATOM 0 HB2 ALA A 199 18.373 11.913 28.900 1.00 50.44 H new ATOM 0 HB3 ALA A 199 18.875 12.343 27.461 1.00 50.44 H new ATOM 130 N GLU A 200 19.443 9.357 26.142 1.00 51.16 N ATOM 131 CA GLU A 200 19.749 8.871 24.811 1.00 51.47 C ATOM 132 C GLU A 200 18.515 8.973 23.938 1.00 50.57 C ATOM 133 O GLU A 200 17.401 8.745 24.403 1.00 50.54 O ATOM 134 CB GLU A 200 20.280 7.435 24.869 1.00 51.78 C ATOM 135 CG GLU A 200 21.669 7.355 25.484 1.00 52.76 C ATOM 136 CD GLU A 200 21.997 5.994 26.051 1.00 53.97 C ATOM 137 OE1 GLU A 200 21.107 5.365 26.676 1.00 54.36 O ATOM 138 OE2 GLU A 200 23.155 5.555 25.878 1.00 54.25 O ATOM 0 H GLU A 200 18.695 9.077 26.461 1.00 51.16 H new ATOM 0 HA GLU A 200 20.447 9.420 24.421 1.00 51.47 H new ATOM 0 HB2 GLU A 200 19.668 6.887 25.385 1.00 51.78 H new ATOM 0 HB3 GLU A 200 20.304 7.065 23.973 1.00 51.78 H new ATOM 0 HG2 GLU A 200 22.328 7.584 24.810 1.00 52.76 H new ATOM 0 HG3 GLU A 200 21.742 8.018 26.189 1.00 52.76 H new ATOM 139 N ALA A 201 18.729 9.338 22.680 1.00 50.00 N ATOM 140 CA ALA A 201 17.652 9.468 21.710 1.00 49.35 C ATOM 141 C ALA A 201 17.081 8.103 21.338 1.00 49.22 C ATOM 142 O ALA A 201 17.822 7.164 21.055 1.00 49.07 O ATOM 143 CB ALA A 201 18.152 10.190 20.467 1.00 48.74 C ATOM 0 H ALA A 201 19.508 9.518 22.364 1.00 50.00 H new ATOM 0 HA ALA A 201 16.941 9.990 22.113 1.00 49.35 H new ATOM 0 HB1 ALA A 201 17.428 10.272 19.827 1.00 48.74 H new ATOM 0 HB2 ALA A 201 18.469 11.074 20.711 1.00 48.74 H new ATOM 0 HB3 ALA A 201 18.879 9.685 20.070 1.00 48.74 H new ATOM 144 N LEU A 202 15.758 7.989 21.358 1.00 49.43 N ATOM 145 CA LEU A 202 15.102 6.770 20.887 1.00 49.16 C ATOM 146 C LEU A 202 14.583 7.033 19.483 1.00 48.85 C ATOM 147 O LEU A 202 14.342 6.107 18.720 1.00 48.81 O ATOM 148 CB LEU A 202 13.980 6.332 21.838 1.00 49.19 C ATOM 149 CG LEU A 202 12.855 7.321 22.151 1.00 49.18 C ATOM 150 CD1 LEU A 202 11.608 6.948 21.394 1.00 48.92 C ATOM 151 CD2 LEU A 202 12.564 7.344 23.641 1.00 48.76 C ATOM 0 H LEU A 202 15.223 8.601 21.638 1.00 49.43 H new ATOM 0 HA LEU A 202 15.737 6.037 20.869 1.00 49.16 H new ATOM 0 HB2 LEU A 202 13.574 5.533 21.466 1.00 49.19 H new ATOM 0 HB3 LEU A 202 14.390 6.077 22.679 1.00 49.19 H new ATOM 0 HG LEU A 202 13.142 8.206 21.875 1.00 49.18 H new ATOM 0 HD11 LEU A 202 10.903 7.581 21.600 1.00 48.92 H new ATOM 0 HD12 LEU A 202 11.790 6.966 20.441 1.00 48.92 H new ATOM 0 HD13 LEU A 202 11.327 6.056 21.652 1.00 48.92 H new ATOM 0 HD21 LEU A 202 11.850 7.975 23.822 1.00 48.76 H new ATOM 0 HD22 LEU A 202 12.294 6.459 23.932 1.00 48.76 H new ATOM 0 HD23 LEU A 202 13.362 7.613 24.123 1.00 48.76 H new ATOM 152 N TRP A 203 14.432 8.312 19.151 1.00 48.66 N ATOM 153 CA TRP A 203 14.122 8.721 17.791 1.00 48.87 C ATOM 154 C TRP A 203 15.115 9.769 17.302 1.00 49.09 C ATOM 155 O TRP A 203 15.716 10.493 18.102 1.00 48.58 O ATOM 156 CB TRP A 203 12.731 9.344 17.699 1.00 48.02 C ATOM 157 CG TRP A 203 11.584 8.451 18.011 1.00 47.89 C ATOM 158 CD1 TRP A 203 11.466 7.118 17.736 1.00 48.01 C ATOM 159 CD2 TRP A 203 10.355 8.848 18.614 1.00 47.79 C ATOM 160 NE1 TRP A 203 10.243 6.657 18.156 1.00 47.93 N ATOM 161 CE2 TRP A 203 9.542 7.700 18.703 1.00 47.96 C ATOM 162 CE3 TRP A 203 9.870 10.063 19.109 1.00 47.68 C ATOM 163 CZ2 TRP A 203 8.265 7.733 19.262 1.00 47.66 C ATOM 164 CZ3 TRP A 203 8.609 10.098 19.661 1.00 48.00 C ATOM 165 CH2 TRP A 203 7.813 8.937 19.727 1.00 47.97 C ATOM 0 H TRP A 203 14.507 8.963 19.708 1.00 48.66 H new ATOM 0 HA TRP A 203 14.168 7.920 17.246 1.00 48.87 H new ATOM 0 HB2 TRP A 203 12.698 10.103 18.302 1.00 48.02 H new ATOM 0 HB3 TRP A 203 12.612 9.689 16.801 1.00 48.02 H new ATOM 0 HD1 TRP A 203 12.119 6.599 17.324 1.00 48.01 H new ATOM 0 HE1 TRP A 203 9.963 5.847 18.087 1.00 47.93 H new ATOM 0 HE3 TRP A 203 10.390 10.833 19.066 1.00 47.68 H new ATOM 0 HZ2 TRP A 203 7.741 6.966 19.316 1.00 47.66 H new ATOM 0 HZ3 TRP A 203 8.278 10.900 19.995 1.00 48.00 H new ATOM 0 HH2 TRP A 203 6.961 8.991 20.095 1.00 47.97 H new ATOM 166 N ASP A 204 15.265 9.859 15.985 1.00 48.76 N ATOM 167 CA ASP A 204 15.966 10.983 15.393 1.00 49.00 C ATOM 168 C ASP A 204 15.170 12.250 15.650 1.00 48.88 C ATOM 169 O ASP A 204 13.945 12.229 15.709 1.00 49.31 O ATOM 170 CB ASP A 204 16.143 10.795 13.886 1.00 48.83 C ATOM 171 CG ASP A 204 17.216 9.779 13.545 1.00 48.82 C ATOM 172 OD1 ASP A 204 17.344 8.771 14.270 1.00 48.57 O ATOM 173 OD2 ASP A 204 17.935 9.992 12.551 1.00 49.20 O ATOM 0 H ASP A 204 14.969 9.281 15.422 1.00 48.76 H new ATOM 0 HA ASP A 204 16.846 11.045 15.796 1.00 49.00 H new ATOM 0 HB2 ASP A 204 15.300 10.512 13.498 1.00 48.83 H new ATOM 0 HB3 ASP A 204 16.370 11.647 13.482 1.00 48.83 H new ATOM 174 N HIS A 205 15.870 13.356 15.831 1.00 48.76 N ATOM 175 CA HIS A 205 15.195 14.634 15.868 1.00 48.89 C ATOM 176 C HIS A 205 15.685 15.489 14.719 1.00 48.66 C ATOM 177 O HIS A 205 16.837 15.896 14.693 1.00 49.16 O ATOM 178 CB HIS A 205 15.425 15.353 17.183 1.00 47.81 C ATOM 179 CG HIS A 205 14.729 16.670 17.258 1.00 47.66 C ATOM 180 ND1 HIS A 205 15.172 17.897 17.613 1.00 48.12 N flip ATOM 181 CD2 HIS A 205 13.396 16.820 16.940 1.00 47.26 C flip ATOM 182 CE1 HIS A 205 14.107 18.757 17.509 1.00 47.46 C flip ATOM 183 NE2 HIS A 205 13.046 18.082 17.106 1.00 47.53 N flip ATOM 0 H HIS A 205 16.723 13.388 15.933 1.00 48.76 H new ATOM 0 HA HIS A 205 14.241 14.477 15.784 1.00 48.89 H new ATOM 0 HB2 HIS A 205 15.120 14.790 17.911 1.00 47.81 H new ATOM 0 HB3 HIS A 205 16.377 15.489 17.309 1.00 47.81 H new ATOM 0 HD1 HIS A 205 15.971 18.101 17.858 1.00 48.12 H new ATOM 0 HD2 HIS A 205 12.832 16.139 16.653 1.00 47.26 H new ATOM 0 HE1 HIS A 205 14.129 19.668 17.693 1.00 47.46 H new ATOM 184 N VAL A 206 14.796 15.746 13.771 1.00 48.75 N ATOM 185 CA VAL A 206 15.132 16.489 12.573 1.00 49.22 C ATOM 186 C VAL A 206 14.726 17.946 12.763 1.00 49.42 C ATOM 187 O VAL A 206 13.617 18.234 13.203 1.00 49.90 O ATOM 188 CB VAL A 206 14.417 15.883 11.350 1.00 49.16 C ATOM 189 CG1 VAL A 206 14.757 16.651 10.087 1.00 48.16 C ATOM 190 CG2 VAL A 206 14.772 14.398 11.222 1.00 49.03 C ATOM 0 H VAL A 206 13.975 15.491 13.807 1.00 48.75 H new ATOM 0 HA VAL A 206 16.088 16.440 12.416 1.00 49.22 H new ATOM 0 HB VAL A 206 13.458 15.956 11.478 1.00 49.16 H new ATOM 0 HG11 VAL A 206 14.297 16.252 9.332 1.00 48.16 H new ATOM 0 HG12 VAL A 206 14.478 17.575 10.185 1.00 48.16 H new ATOM 0 HG13 VAL A 206 15.715 16.618 9.936 1.00 48.16 H new ATOM 0 HG21 VAL A 206 14.319 14.022 10.451 1.00 49.03 H new ATOM 0 HG22 VAL A 206 15.731 14.303 11.112 1.00 49.03 H new ATOM 0 HG23 VAL A 206 14.491 13.928 12.022 1.00 49.03 H new ATOM 191 N THR A 207 15.624 18.868 12.444 1.00 49.20 N ATOM 192 CA THR A 207 15.332 20.271 12.666 1.00 49.71 C ATOM 193 C THR A 207 16.243 21.181 11.854 1.00 49.75 C ATOM 194 O THR A 207 17.416 20.873 11.645 1.00 49.62 O ATOM 195 CB THR A 207 15.406 20.625 14.189 1.00 49.72 C ATOM 196 OG1 THR A 207 14.960 21.971 14.403 1.00 49.62 O ATOM 197 CG2 THR A 207 16.826 20.456 14.726 1.00 49.73 C ATOM 0 H THR A 207 16.396 18.704 12.103 1.00 49.20 H new ATOM 0 HA THR A 207 14.425 20.425 12.359 1.00 49.71 H new ATOM 0 HB THR A 207 14.826 20.014 14.669 1.00 49.72 H new ATOM 0 HG1 THR A 207 14.279 21.966 14.895 1.00 49.62 H new ATOM 0 HG21 THR A 207 16.844 20.681 15.669 1.00 49.73 H new ATOM 0 HG22 THR A 207 17.109 19.536 14.608 1.00 49.73 H new ATOM 0 HG23 THR A 207 17.427 21.044 14.242 1.00 49.73 H new ATOM 198 N MET A 208 15.686 22.292 11.383 1.00 50.54 N ATOM 199 CA MET A 208 16.467 23.323 10.696 1.00 51.00 C ATOM 200 C MET A 208 16.618 24.561 11.577 1.00 51.66 C ATOM 201 O MET A 208 17.316 25.501 11.220 1.00 51.67 O ATOM 202 CB MET A 208 15.815 23.726 9.371 1.00 50.70 C ATOM 203 CG MET A 208 15.826 22.665 8.282 1.00 50.43 C ATOM 204 SD MET A 208 14.543 21.428 8.527 1.00 50.57 S ATOM 205 CE MET A 208 14.471 20.686 6.907 1.00 50.27 C ATOM 0 H MET A 208 14.848 22.472 11.451 1.00 50.54 H new ATOM 0 HA MET A 208 17.342 22.947 10.512 1.00 51.00 H new ATOM 0 HB2 MET A 208 14.895 23.977 9.546 1.00 50.70 H new ATOM 0 HB3 MET A 208 16.266 24.516 9.035 1.00 50.70 H new ATOM 0 HG2 MET A 208 15.704 23.089 7.418 1.00 50.43 H new ATOM 0 HG3 MET A 208 16.693 22.230 8.265 1.00 50.43 H new ATOM 0 HE1 MET A 208 13.558 20.422 6.712 1.00 50.27 H new ATOM 0 HE2 MET A 208 14.771 21.327 6.244 1.00 50.27 H new ATOM 0 HE3 MET A 208 15.045 19.905 6.883 1.00 50.27 H new ATOM 206 N ASP A 209 15.958 24.560 12.730 1.00 52.81 N ATOM 207 CA ASP A 209 16.045 25.688 13.656 1.00 53.53 C ATOM 208 C ASP A 209 17.387 25.682 14.386 1.00 54.13 C ATOM 209 O ASP A 209 17.745 24.690 15.016 1.00 54.40 O ATOM 210 CB ASP A 209 14.888 25.637 14.656 1.00 53.47 C ATOM 211 CG ASP A 209 14.922 26.778 15.652 1.00 53.27 C ATOM 212 OD1 ASP A 209 15.988 27.401 15.819 1.00 53.45 O ATOM 213 OD2 ASP A 209 13.879 27.046 16.280 1.00 53.26 O ATOM 0 H ASP A 209 15.454 23.916 12.997 1.00 52.81 H new ATOM 0 HA ASP A 209 15.981 26.512 13.149 1.00 53.53 H new ATOM 0 HB2 ASP A 209 14.047 25.660 14.173 1.00 53.47 H new ATOM 0 HB3 ASP A 209 14.917 24.794 15.135 1.00 53.47 H new ATOM 214 N ASP A 210 18.117 26.795 14.314 1.00 54.79 N ATOM 215 CA ASP A 210 19.466 26.870 14.894 1.00 55.11 C ATOM 216 C ASP A 210 19.481 26.938 16.428 1.00 54.84 C ATOM 217 O ASP A 210 20.541 26.834 17.052 1.00 55.02 O ATOM 218 CB ASP A 210 20.270 28.033 14.290 1.00 55.56 C ATOM 219 CG ASP A 210 19.891 29.387 14.875 1.00 56.32 C ATOM 220 OD1 ASP A 210 20.809 30.143 15.257 1.00 56.57 O ATOM 221 OD2 ASP A 210 18.684 29.710 14.941 1.00 56.83 O ATOM 0 H ASP A 210 17.852 27.520 13.934 1.00 54.79 H new ATOM 0 HA ASP A 210 19.896 26.033 14.658 1.00 55.11 H new ATOM 0 HB2 ASP A 210 21.216 27.876 14.437 1.00 55.56 H new ATOM 0 HB3 ASP A 210 20.131 28.051 13.330 1.00 55.56 H new ATOM 222 N GLN A 211 18.308 27.106 17.028 1.00 53.85 N ATOM 223 CA GLN A 211 18.190 27.112 18.480 1.00 53.29 C ATOM 224 C GLN A 211 17.736 25.758 19.008 1.00 52.57 C ATOM 225 O GLN A 211 17.620 25.562 20.217 1.00 51.78 O ATOM 226 CB GLN A 211 17.226 28.208 18.932 1.00 53.87 C ATOM 227 CG GLN A 211 17.768 29.611 18.754 1.00 54.40 C ATOM 228 CD GLN A 211 18.933 29.895 19.678 1.00 54.91 C ATOM 229 OE1 GLN A 211 20.094 29.331 19.366 1.00 55.50 O flip ATOM 230 NE2 GLN A 211 18.787 30.604 20.671 1.00 55.22 N flip ATOM 0 H GLN A 211 17.565 27.219 16.610 1.00 53.85 H new ATOM 0 HA GLN A 211 19.069 27.295 18.847 1.00 53.29 H new ATOM 0 HB2 GLN A 211 16.398 28.125 18.433 1.00 53.87 H new ATOM 0 HB3 GLN A 211 17.009 28.070 19.867 1.00 53.87 H new ATOM 0 HG2 GLN A 211 18.050 29.733 17.834 1.00 54.40 H new ATOM 0 HG3 GLN A 211 17.060 30.253 18.921 1.00 54.40 H new ATOM 0 HE21 GLN A 211 18.020 30.953 20.841 1.00 55.22 H new ATOM 0 HE22 GLN A 211 19.452 30.751 21.196 1.00 55.22 H new ATOM 231 N GLU A 212 17.480 24.829 18.090 1.00 52.10 N ATOM 232 CA GLU A 212 17.069 23.476 18.458 1.00 51.61 C ATOM 233 C GLU A 212 18.201 22.486 18.197 1.00 50.95 C ATOM 234 O GLU A 212 19.073 22.733 17.373 1.00 50.63 O ATOM 235 CB GLU A 212 15.820 23.053 17.683 1.00 51.70 C ATOM 236 CG GLU A 212 14.533 23.774 18.089 1.00 52.20 C ATOM 237 CD GLU A 212 13.336 23.295 17.291 1.00 52.44 C ATOM 238 OE1 GLU A 212 13.517 22.456 16.382 1.00 53.14 O ATOM 239 OE2 GLU A 212 12.212 23.747 17.567 1.00 52.98 O ATOM 0 H GLU A 212 17.539 24.963 17.243 1.00 52.10 H new ATOM 0 HA GLU A 212 16.859 23.475 19.405 1.00 51.61 H new ATOM 0 HB2 GLU A 212 15.975 23.205 16.738 1.00 51.70 H new ATOM 0 HB3 GLU A 212 15.691 22.099 17.800 1.00 51.70 H new ATOM 0 HG2 GLU A 212 14.368 23.632 19.034 1.00 52.20 H new ATOM 0 HG3 GLU A 212 14.644 24.729 17.961 1.00 52.20 H new ATOM 240 N LEU A 213 18.168 21.368 18.906 1.00 50.28 N ATOM 241 CA LEU A 213 19.198 20.351 18.818 1.00 49.94 C ATOM 242 C LEU A 213 18.687 19.169 18.010 1.00 49.57 C ATOM 243 O LEU A 213 17.718 18.513 18.384 1.00 49.18 O ATOM 244 CB LEU A 213 19.595 19.901 20.229 1.00 50.09 C ATOM 245 CG LEU A 213 20.770 18.950 20.439 1.00 50.23 C ATOM 246 CD1 LEU A 213 22.094 19.617 20.057 1.00 50.51 C ATOM 247 CD2 LEU A 213 20.792 18.468 21.884 1.00 50.20 C ATOM 0 H LEU A 213 17.537 21.177 19.459 1.00 50.28 H new ATOM 0 HA LEU A 213 19.978 20.717 18.373 1.00 49.94 H new ATOM 0 HB2 LEU A 213 19.780 20.702 20.743 1.00 50.09 H new ATOM 0 HB3 LEU A 213 18.815 19.483 20.626 1.00 50.09 H new ATOM 0 HG LEU A 213 20.657 18.182 19.858 1.00 50.23 H new ATOM 0 HD11 LEU A 213 22.823 18.994 20.199 1.00 50.51 H new ATOM 0 HD12 LEU A 213 22.068 19.876 19.123 1.00 50.51 H new ATOM 0 HD13 LEU A 213 22.230 20.404 20.607 1.00 50.51 H new ATOM 0 HD21 LEU A 213 21.540 17.864 22.013 1.00 50.20 H new ATOM 0 HD22 LEU A 213 20.886 19.229 22.478 1.00 50.20 H new ATOM 0 HD23 LEU A 213 19.964 18.003 22.083 1.00 50.20 H new ATOM 248 N GLY A 214 19.334 18.912 16.884 1.00 49.48 N ATOM 249 CA GLY A 214 18.991 17.769 16.070 1.00 49.26 C ATOM 250 C GLY A 214 19.906 16.636 16.456 1.00 49.60 C ATOM 251 O GLY A 214 21.052 16.864 16.839 1.00 50.01 O ATOM 0 H GLY A 214 19.977 19.392 16.576 1.00 49.48 H new ATOM 0 HA2 GLY A 214 18.064 17.519 16.208 1.00 49.26 H new ATOM 0 HA3 GLY A 214 19.090 17.980 15.129 1.00 49.26 H new ATOM 252 N PHE A 215 19.400 15.413 16.370 1.00 49.43 N ATOM 253 CA PHE A 215 20.197 14.242 16.690 1.00 49.02 C ATOM 254 C PHE A 215 19.638 12.989 16.012 1.00 49.00 C ATOM 255 O PHE A 215 18.557 13.030 15.425 1.00 48.61 O ATOM 256 CB PHE A 215 20.315 14.050 18.212 1.00 49.23 C ATOM 257 CG PHE A 215 19.000 14.099 18.954 1.00 49.24 C ATOM 258 CD1 PHE A 215 18.069 13.082 18.819 1.00 49.51 C ATOM 259 CD2 PHE A 215 18.711 15.153 19.805 1.00 49.58 C ATOM 260 CE1 PHE A 215 16.866 13.117 19.509 1.00 48.96 C ATOM 261 CE2 PHE A 215 17.517 15.200 20.502 1.00 49.96 C ATOM 262 CZ PHE A 215 16.589 14.174 20.351 1.00 49.74 C ATOM 0 H PHE A 215 18.593 15.241 16.127 1.00 49.43 H new ATOM 0 HA PHE A 215 21.091 14.388 16.342 1.00 49.02 H new ATOM 0 HB2 PHE A 215 20.740 13.196 18.387 1.00 49.23 H new ATOM 0 HB3 PHE A 215 20.900 14.736 18.569 1.00 49.23 H new ATOM 0 HD1 PHE A 215 18.253 12.364 18.257 1.00 49.51 H new ATOM 0 HD2 PHE A 215 19.329 15.840 19.909 1.00 49.58 H new ATOM 0 HE1 PHE A 215 16.248 12.430 19.404 1.00 48.96 H new ATOM 0 HE2 PHE A 215 17.335 15.914 21.069 1.00 49.96 H new ATOM 0 HZ PHE A 215 15.784 14.201 20.816 1.00 49.74 H new ATOM 263 N LYS A 216 20.397 11.896 16.084 1.00 48.75 N ATOM 264 CA LYS A 216 19.969 10.593 15.579 1.00 49.62 C ATOM 265 C LYS A 216 19.657 9.647 16.739 1.00 49.55 C ATOM 266 O LYS A 216 20.208 9.795 17.833 1.00 49.36 O ATOM 267 CB LYS A 216 21.074 9.970 14.718 1.00 50.45 C ATOM 268 CG LYS A 216 21.498 10.812 13.534 1.00 51.56 C ATOM 269 CD LYS A 216 23.012 10.842 13.384 1.00 53.15 C ATOM 270 CE LYS A 216 23.575 9.517 12.875 1.00 53.93 C ATOM 271 NZ LYS A 216 23.695 8.477 13.948 1.00 54.88 N ATOM 0 H LYS A 216 21.184 11.891 16.432 1.00 48.75 H new ATOM 0 HA LYS A 216 19.171 10.725 15.044 1.00 49.62 H new ATOM 0 HB2 LYS A 216 21.849 9.805 15.277 1.00 50.45 H new ATOM 0 HB3 LYS A 216 20.769 9.108 14.394 1.00 50.45 H new ATOM 0 HG2 LYS A 216 21.099 10.458 12.724 1.00 51.56 H new ATOM 0 HG3 LYS A 216 21.165 11.716 13.643 1.00 51.56 H new ATOM 0 HD2 LYS A 216 23.259 11.552 12.771 1.00 53.15 H new ATOM 0 HD3 LYS A 216 23.415 11.054 14.241 1.00 53.15 H new ATOM 0 HE2 LYS A 216 23.003 9.180 12.168 1.00 53.93 H new ATOM 0 HE3 LYS A 216 24.449 9.672 12.484 1.00 53.93 H new ATOM 0 HZ1 LYS A 216 24.374 7.933 13.760 1.00 54.88 H new ATOM 0 HZ2 LYS A 216 23.841 8.874 14.731 1.00 54.88 H new ATOM 0 HZ3 LYS A 216 22.941 8.006 13.991 1.00 54.88 H new ATOM 272 N ALA A 217 18.784 8.671 16.498 1.00 49.27 N ATOM 273 CA ALA A 217 18.491 7.660 17.503 1.00 49.48 C ATOM 274 C ALA A 217 19.794 7.029 17.981 1.00 49.72 C ATOM 275 O ALA A 217 20.660 6.671 17.179 1.00 49.64 O ATOM 276 CB ALA A 217 17.552 6.592 16.938 1.00 49.41 C ATOM 0 H ALA A 217 18.353 8.579 15.760 1.00 49.27 H new ATOM 0 HA ALA A 217 18.045 8.080 18.255 1.00 49.48 H new ATOM 0 HB1 ALA A 217 17.369 5.928 17.621 1.00 49.41 H new ATOM 0 HB2 ALA A 217 16.721 7.007 16.659 1.00 49.41 H new ATOM 0 HB3 ALA A 217 17.971 6.163 16.175 1.00 49.41 H new ATOM 277 N GLY A 218 19.939 6.906 19.294 1.00 50.12 N ATOM 278 CA GLY A 218 21.132 6.304 19.863 1.00 49.89 C ATOM 279 C GLY A 218 22.123 7.314 20.400 1.00 49.73 C ATOM 280 O GLY A 218 23.007 6.957 21.176 1.00 50.54 O ATOM 0 H GLY A 218 19.357 7.165 19.872 1.00 50.12 H new ATOM 0 HA2 GLY A 218 20.872 5.704 20.580 1.00 49.89 H new ATOM 0 HA3 GLY A 218 21.567 5.764 19.185 1.00 49.89 H new ATOM 281 N ASP A 219 21.990 8.574 19.989 1.00 49.03 N ATOM 282 CA ASP A 219 22.923 9.614 20.432 1.00 48.49 C ATOM 283 C ASP A 219 22.767 9.899 21.916 1.00 48.34 C ATOM 284 O ASP A 219 21.661 9.836 22.453 1.00 48.81 O ATOM 285 CB ASP A 219 22.724 10.914 19.650 1.00 47.78 C ATOM 286 CG ASP A 219 23.272 10.840 18.239 1.00 47.33 C ATOM 287 OD1 ASP A 219 23.836 9.793 17.865 1.00 46.71 O ATOM 288 OD2 ASP A 219 23.133 11.841 17.504 1.00 47.56 O ATOM 0 H ASP A 219 21.372 8.848 19.458 1.00 49.03 H new ATOM 0 HA ASP A 219 23.817 9.277 20.264 1.00 48.49 H new ATOM 0 HB2 ASP A 219 21.778 11.124 19.614 1.00 47.78 H new ATOM 0 HB3 ASP A 219 23.158 11.641 20.123 1.00 47.78 H new ATOM 289 N VAL A 220 23.886 10.203 22.567 1.00 48.33 N ATOM 290 CA VAL A 220 23.896 10.603 23.965 1.00 48.38 C ATOM 291 C VAL A 220 23.727 12.121 24.047 1.00 48.87 C ATOM 292 O VAL A 220 24.372 12.877 23.311 1.00 48.86 O ATOM 293 CB VAL A 220 25.205 10.174 24.669 1.00 48.79 C ATOM 294 CG1 VAL A 220 25.215 10.621 26.121 1.00 48.67 C ATOM 295 CG2 VAL A 220 25.400 8.654 24.582 1.00 48.42 C ATOM 0 H VAL A 220 24.666 10.182 22.205 1.00 48.33 H new ATOM 0 HA VAL A 220 23.163 10.160 24.420 1.00 48.38 H new ATOM 0 HB VAL A 220 25.942 10.607 24.210 1.00 48.79 H new ATOM 0 HG11 VAL A 220 26.044 10.341 26.540 1.00 48.67 H new ATOM 0 HG12 VAL A 220 25.142 11.587 26.163 1.00 48.67 H new ATOM 0 HG13 VAL A 220 24.465 10.220 26.588 1.00 48.67 H new ATOM 0 HG21 VAL A 220 26.225 8.407 25.029 1.00 48.42 H new ATOM 0 HG22 VAL A 220 24.654 8.207 25.011 1.00 48.42 H new ATOM 0 HG23 VAL A 220 25.445 8.386 23.651 1.00 48.42 H new ATOM 296 N ILE A 221 22.845 12.555 24.939 1.00 48.72 N ATOM 297 CA ILE A 221 22.524 13.961 25.109 1.00 48.84 C ATOM 298 C ILE A 221 22.665 14.311 26.582 1.00 49.09 C ATOM 299 O ILE A 221 22.135 13.612 27.442 1.00 50.13 O ATOM 300 CB ILE A 221 21.060 14.214 24.681 1.00 49.17 C ATOM 301 CG1 ILE A 221 20.849 13.772 23.231 1.00 48.74 C ATOM 302 CG2 ILE A 221 20.638 15.675 24.904 1.00 48.99 C ATOM 303 CD1 ILE A 221 19.440 13.368 22.952 1.00 49.69 C ATOM 0 H ILE A 221 22.412 12.033 25.468 1.00 48.72 H new ATOM 0 HA ILE A 221 23.120 14.502 24.568 1.00 48.84 H new ATOM 0 HB ILE A 221 20.484 13.677 25.247 1.00 49.17 H new ATOM 0 HG12 ILE A 221 21.098 14.497 22.636 1.00 48.74 H new ATOM 0 HG13 ILE A 221 21.440 13.028 23.034 1.00 48.74 H new ATOM 0 HG21 ILE A 221 19.717 15.792 24.624 1.00 48.99 H new ATOM 0 HG22 ILE A 221 20.720 15.896 25.845 1.00 48.99 H new ATOM 0 HG23 ILE A 221 21.210 16.260 24.384 1.00 48.99 H new ATOM 0 HD11 ILE A 221 19.358 13.098 22.024 1.00 49.69 H new ATOM 0 HD12 ILE A 221 19.196 12.626 23.527 1.00 49.69 H new ATOM 0 HD13 ILE A 221 18.848 14.117 23.123 1.00 49.69 H new ATOM 304 N GLU A 222 23.390 15.374 26.890 1.00 49.81 N ATOM 305 CA GLU A 222 23.362 15.900 28.251 1.00 50.63 C ATOM 306 C GLU A 222 22.212 16.898 28.387 1.00 50.35 C ATOM 307 O GLU A 222 22.110 17.841 27.607 1.00 50.24 O ATOM 308 CB GLU A 222 24.684 16.565 28.632 1.00 50.77 C ATOM 309 CG GLU A 222 24.706 16.997 30.098 1.00 51.69 C ATOM 310 CD GLU A 222 25.972 17.722 30.495 1.00 52.22 C ATOM 311 OE1 GLU A 222 27.009 17.526 29.823 1.00 52.23 O ATOM 312 OE2 GLU A 222 25.922 18.486 31.486 1.00 52.33 O ATOM 0 H GLU A 222 23.896 15.801 26.341 1.00 49.81 H new ATOM 0 HA GLU A 222 23.227 15.156 28.859 1.00 50.63 H new ATOM 0 HB2 GLU A 222 25.415 15.949 28.466 1.00 50.77 H new ATOM 0 HB3 GLU A 222 24.831 17.338 28.065 1.00 50.77 H new ATOM 0 HG2 GLU A 222 23.945 17.573 30.269 1.00 51.69 H new ATOM 0 HG3 GLU A 222 24.601 16.214 30.660 1.00 51.69 H new ATOM 313 N VAL A 223 21.343 16.676 29.364 1.00 50.38 N ATOM 314 CA VAL A 223 20.207 17.566 29.591 1.00 50.49 C ATOM 315 C VAL A 223 20.593 18.651 30.588 1.00 50.64 C ATOM 316 O VAL A 223 21.004 18.353 31.711 1.00 51.30 O ATOM 317 CB VAL A 223 18.971 16.800 30.116 1.00 49.93 C ATOM 318 CG1 VAL A 223 17.748 17.717 30.169 1.00 49.69 C ATOM 319 CG2 VAL A 223 18.701 15.585 29.256 1.00 49.87 C ATOM 0 H VAL A 223 21.392 16.013 29.910 1.00 50.38 H new ATOM 0 HA VAL A 223 19.972 17.965 28.739 1.00 50.49 H new ATOM 0 HB VAL A 223 19.156 16.498 31.019 1.00 49.93 H new ATOM 0 HG11 VAL A 223 16.984 17.219 30.500 1.00 49.69 H new ATOM 0 HG12 VAL A 223 17.928 18.464 30.761 1.00 49.69 H new ATOM 0 HG13 VAL A 223 17.555 18.051 29.279 1.00 49.69 H new ATOM 0 HG21 VAL A 223 17.924 15.114 29.596 1.00 49.87 H new ATOM 0 HG22 VAL A 223 18.535 15.865 28.342 1.00 49.87 H new ATOM 0 HG23 VAL A 223 19.471 14.995 29.278 1.00 49.87 H new ATOM 320 N MET A 224 20.458 19.905 30.172 1.00 50.91 N ATOM 321 CA MET A 224 20.893 21.042 30.978 1.00 51.63 C ATOM 322 C MET A 224 19.704 21.708 31.648 1.00 51.34 C ATOM 323 O MET A 224 19.803 22.189 32.768 1.00 51.41 O ATOM 324 CB MET A 224 21.608 22.083 30.110 1.00 52.46 C ATOM 325 CG MET A 224 22.506 21.508 29.034 1.00 54.17 C ATOM 326 SD MET A 224 23.981 20.780 29.738 1.00 56.43 S ATOM 327 CE MET A 224 24.762 22.246 30.413 1.00 55.81 C ATOM 0 H MET A 224 20.112 20.122 29.415 1.00 50.91 H new ATOM 0 HA MET A 224 21.504 20.705 31.652 1.00 51.63 H new ATOM 0 HB2 MET A 224 20.941 22.647 29.689 1.00 52.46 H new ATOM 0 HB3 MET A 224 22.140 22.655 30.686 1.00 52.46 H new ATOM 0 HG2 MET A 224 22.021 20.837 28.530 1.00 54.17 H new ATOM 0 HG3 MET A 224 22.754 22.207 28.409 1.00 54.17 H new ATOM 0 HE1 MET A 224 25.664 22.031 30.697 1.00 55.81 H new ATOM 0 HE2 MET A 224 24.794 22.938 29.734 1.00 55.81 H new ATOM 0 HE3 MET A 224 24.251 22.564 31.174 1.00 55.81 H new ATOM 328 N ASP A 225 18.577 21.748 30.953 1.00 50.83 N ATOM 329 CA ASP A 225 17.428 22.454 31.473 1.00 51.08 C ATOM 330 C ASP A 225 16.158 21.683 31.179 1.00 50.93 C ATOM 331 O ASP A 225 15.828 21.436 30.020 1.00 51.11 O ATOM 332 CB ASP A 225 17.359 23.873 30.888 1.00 51.10 C ATOM 333 CG ASP A 225 16.295 24.738 31.555 1.00 50.89 C ATOM 334 OD1 ASP A 225 16.643 25.816 32.054 1.00 51.17 O ATOM 335 OD2 ASP A 225 15.109 24.354 31.578 1.00 51.67 O ATOM 0 H ASP A 225 18.461 21.376 30.186 1.00 50.83 H new ATOM 0 HA ASP A 225 17.519 22.530 32.436 1.00 51.08 H new ATOM 0 HB2 ASP A 225 18.224 24.300 30.985 1.00 51.10 H new ATOM 0 HB3 ASP A 225 17.175 23.817 29.937 1.00 51.10 H new ATOM 336 N ALA A 226 15.457 21.302 32.239 1.00 50.83 N ATOM 337 CA ALA A 226 14.189 20.598 32.116 1.00 51.33 C ATOM 338 C ALA A 226 13.033 21.392 32.738 1.00 51.91 C ATOM 339 O ALA A 226 12.087 20.810 33.262 1.00 52.41 O ATOM 340 CB ALA A 226 14.291 19.204 32.733 1.00 50.76 C ATOM 0 H ALA A 226 15.703 21.445 33.050 1.00 50.83 H new ATOM 0 HA ALA A 226 13.994 20.504 31.170 1.00 51.33 H new ATOM 0 HB1 ALA A 226 13.440 18.747 32.644 1.00 50.76 H new ATOM 0 HB2 ALA A 226 14.979 18.697 32.275 1.00 50.76 H new ATOM 0 HB3 ALA A 226 14.519 19.282 33.673 1.00 50.76 H new ATOM 341 N THR A 227 13.111 22.720 32.668 1.00 52.63 N ATOM 342 CA THR A 227 12.054 23.590 33.196 1.00 53.40 C ATOM 343 C THR A 227 10.725 23.302 32.499 1.00 53.29 C ATOM 344 O THR A 227 9.670 23.285 33.132 1.00 52.71 O ATOM 345 CB THR A 227 12.401 25.096 33.014 1.00 53.92 C ATOM 346 OG1 THR A 227 13.658 25.387 33.633 1.00 54.26 O ATOM 347 CG2 THR A 227 11.331 25.991 33.631 1.00 54.36 C ATOM 0 H THR A 227 13.773 23.142 32.316 1.00 52.63 H new ATOM 0 HA THR A 227 11.979 23.401 34.144 1.00 53.40 H new ATOM 0 HB THR A 227 12.447 25.273 32.061 1.00 53.92 H new ATOM 0 HG1 THR A 227 14.282 25.119 33.139 1.00 54.26 H new ATOM 0 HG21 THR A 227 11.574 26.921 33.503 1.00 54.36 H new ATOM 0 HG22 THR A 227 10.478 25.818 33.203 1.00 54.36 H new ATOM 0 HG23 THR A 227 11.260 25.804 34.580 1.00 54.36 H new ATOM 348 N ASN A 228 10.794 23.085 31.187 1.00 53.19 N ATOM 349 CA ASN A 228 9.623 22.808 30.380 1.00 52.71 C ATOM 350 C ASN A 228 9.199 21.356 30.497 1.00 53.13 C ATOM 351 O ASN A 228 10.024 20.461 30.733 1.00 53.24 O ATOM 352 CB ASN A 228 9.893 23.123 28.906 1.00 52.89 C ATOM 353 CG ASN A 228 9.999 24.618 28.625 1.00 53.28 C ATOM 354 OD1 ASN A 228 9.380 25.426 29.469 1.00 53.71 O flip ATOM 355 ND2 ASN A 228 10.622 25.034 27.646 1.00 52.93 N flip ATOM 0 H ASN A 228 11.530 23.096 30.742 1.00 53.19 H new ATOM 0 HA ASN A 228 8.910 23.375 30.712 1.00 52.71 H new ATOM 0 HB2 ASN A 228 10.716 22.689 28.633 1.00 52.89 H new ATOM 0 HB3 ASN A 228 9.181 22.747 28.365 1.00 52.89 H new ATOM 0 HD21 ASN A 228 11.013 24.479 27.118 1.00 52.93 H new ATOM 0 HD22 ASN A 228 10.666 25.879 27.491 1.00 52.93 H new ATOM 356 N ARG A 229 7.903 21.138 30.318 1.00 53.27 N ATOM 357 CA ARG A 229 7.324 19.816 30.256 1.00 54.04 C ATOM 358 C ARG A 229 7.981 19.020 29.147 1.00 53.32 C ATOM 359 O ARG A 229 8.394 17.890 29.353 1.00 53.78 O ATOM 360 CB ARG A 229 5.823 19.922 29.974 1.00 54.66 C ATOM 361 CG ARG A 229 5.181 18.637 29.452 1.00 55.25 C ATOM 362 CD ARG A 229 3.753 18.892 28.957 1.00 55.82 C ATOM 363 NE ARG A 229 3.599 18.756 27.504 1.00 57.26 N ATOM 364 CZ ARG A 229 3.599 19.772 26.643 1.00 57.82 C ATOM 365 NH1 ARG A 229 3.768 21.020 27.072 1.00 58.21 N ATOM 366 NH2 ARG A 229 3.435 19.540 25.347 1.00 58.02 N ATOM 0 H ARG A 229 7.328 21.771 30.228 1.00 53.27 H new ATOM 0 HA ARG A 229 7.466 19.370 31.105 1.00 54.04 H new ATOM 0 HB2 ARG A 229 5.371 20.187 30.790 1.00 54.66 H new ATOM 0 HB3 ARG A 229 5.677 20.629 29.326 1.00 54.66 H new ATOM 0 HG2 ARG A 229 5.717 18.275 28.729 1.00 55.25 H new ATOM 0 HG3 ARG A 229 5.168 17.970 30.156 1.00 55.25 H new ATOM 0 HD2 ARG A 229 3.151 18.272 29.397 1.00 55.82 H new ATOM 0 HD3 ARG A 229 3.483 19.785 29.221 1.00 55.82 H new ATOM 0 HE ARG A 229 3.502 17.963 27.186 1.00 57.26 H new ATOM 0 HH11 ARG A 229 3.878 21.175 27.911 1.00 58.21 H new ATOM 0 HH12 ARG A 229 3.767 21.672 26.511 1.00 58.21 H new ATOM 0 HH21 ARG A 229 3.329 18.735 25.064 1.00 58.02 H new ATOM 0 HH22 ARG A 229 3.435 20.195 24.790 1.00 58.02 H new ATOM 367 N GLU A 230 8.081 19.629 27.972 1.00 52.59 N ATOM 368 CA GLU A 230 8.516 18.914 26.789 1.00 52.06 C ATOM 369 C GLU A 230 9.828 19.433 26.190 1.00 51.25 C ATOM 370 O GLU A 230 10.716 18.648 25.867 1.00 50.89 O ATOM 371 CB GLU A 230 7.400 18.921 25.741 1.00 52.87 C ATOM 372 CG GLU A 230 7.781 18.304 24.399 1.00 53.97 C ATOM 373 CD GLU A 230 7.940 16.797 24.461 1.00 54.74 C ATOM 374 OE1 GLU A 230 8.040 16.238 25.570 1.00 55.71 O ATOM 375 OE2 GLU A 230 7.972 16.162 23.394 1.00 56.01 O ATOM 0 H GLU A 230 7.900 20.460 27.842 1.00 52.59 H new ATOM 0 HA GLU A 230 8.704 18.005 27.070 1.00 52.06 H new ATOM 0 HB2 GLU A 230 6.635 18.442 26.098 1.00 52.87 H new ATOM 0 HB3 GLU A 230 7.118 19.837 25.593 1.00 52.87 H new ATOM 0 HG2 GLU A 230 7.102 18.525 23.743 1.00 53.97 H new ATOM 0 HG3 GLU A 230 8.612 18.699 24.092 1.00 53.97 H new ATOM 376 N TRP A 231 9.950 20.748 26.035 1.00 50.33 N ATOM 377 CA TRP A 231 11.095 21.303 25.322 1.00 49.85 C ATOM 378 C TRP A 231 12.266 21.612 26.231 1.00 50.08 C ATOM 379 O TRP A 231 12.300 22.638 26.903 1.00 50.23 O ATOM 380 CB TRP A 231 10.678 22.491 24.451 1.00 49.56 C ATOM 381 CG TRP A 231 9.900 21.994 23.295 1.00 49.53 C ATOM 382 CD1 TRP A 231 8.551 21.781 23.244 1.00 49.35 C ATOM 383 CD2 TRP A 231 10.427 21.549 22.041 1.00 49.34 C ATOM 384 NE1 TRP A 231 8.202 21.264 22.021 1.00 49.57 N ATOM 385 CE2 TRP A 231 9.335 21.113 21.263 1.00 49.41 C ATOM 386 CE3 TRP A 231 11.713 21.507 21.489 1.00 48.81 C ATOM 387 CZ2 TRP A 231 9.490 20.636 19.960 1.00 49.55 C ATOM 388 CZ3 TRP A 231 11.867 21.033 20.201 1.00 49.16 C ATOM 389 CH2 TRP A 231 10.762 20.605 19.448 1.00 49.50 C ATOM 0 H TRP A 231 9.389 21.329 26.331 1.00 50.33 H new ATOM 0 HA TRP A 231 11.422 20.613 24.723 1.00 49.85 H new ATOM 0 HB2 TRP A 231 10.146 23.115 24.969 1.00 49.56 H new ATOM 0 HB3 TRP A 231 11.462 22.973 24.144 1.00 49.56 H new ATOM 0 HD1 TRP A 231 7.956 21.960 23.936 1.00 49.35 H new ATOM 0 HE1 TRP A 231 7.403 21.067 21.771 1.00 49.57 H new ATOM 0 HE3 TRP A 231 12.449 21.793 21.980 1.00 48.81 H new ATOM 0 HZ2 TRP A 231 8.760 20.351 19.459 1.00 49.55 H new ATOM 0 HZ3 TRP A 231 12.717 20.997 19.826 1.00 49.16 H new ATOM 0 HH2 TRP A 231 10.896 20.293 18.582 1.00 49.50 H new ATOM 390 N TRP A 232 13.223 20.691 26.252 1.00 50.04 N ATOM 391 CA TRP A 232 14.347 20.787 27.161 1.00 50.10 C ATOM 392 C TRP A 232 15.526 21.365 26.422 1.00 50.33 C ATOM 393 O TRP A 232 15.554 21.368 25.190 1.00 51.04 O ATOM 394 CB TRP A 232 14.712 19.406 27.718 1.00 50.14 C ATOM 395 CG TRP A 232 13.695 18.851 28.668 1.00 50.13 C ATOM 396 CD1 TRP A 232 12.625 19.514 29.207 1.00 49.89 C ATOM 397 CD2 TRP A 232 13.675 17.533 29.229 1.00 49.73 C ATOM 398 NE1 TRP A 232 11.927 18.679 30.046 1.00 49.71 N ATOM 399 CE2 TRP A 232 12.556 17.461 30.085 1.00 49.69 C ATOM 400 CE3 TRP A 232 14.489 16.403 29.083 1.00 49.94 C ATOM 401 CZ2 TRP A 232 12.225 16.298 30.792 1.00 49.81 C ATOM 402 CZ3 TRP A 232 14.157 15.245 29.783 1.00 50.00 C ATOM 403 CH2 TRP A 232 13.033 15.205 30.627 1.00 49.89 C ATOM 0 H TRP A 232 13.236 19.999 25.742 1.00 50.04 H new ATOM 0 HA TRP A 232 14.106 21.362 27.904 1.00 50.10 H new ATOM 0 HB2 TRP A 232 14.824 18.788 26.979 1.00 50.14 H new ATOM 0 HB3 TRP A 232 15.568 19.465 28.171 1.00 50.14 H new ATOM 0 HD1 TRP A 232 12.403 20.400 29.031 1.00 49.89 H new ATOM 0 HE1 TRP A 232 11.212 18.886 30.477 1.00 49.71 H new ATOM 0 HE3 TRP A 232 15.236 16.425 28.530 1.00 49.94 H new ATOM 0 HZ2 TRP A 232 11.484 16.269 31.353 1.00 49.81 H new ATOM 0 HZ3 TRP A 232 14.687 14.487 29.691 1.00 50.00 H new ATOM 0 HH2 TRP A 232 12.834 14.419 31.083 1.00 49.89 H new ATOM 404 N TRP A 233 16.492 21.869 27.174 1.00 50.04 N ATOM 405 CA TRP A 233 17.725 22.331 26.586 1.00 49.89 C ATOM 406 C TRP A 233 18.764 21.252 26.819 1.00 50.47 C ATOM 407 O TRP A 233 18.933 20.757 27.936 1.00 50.52 O ATOM 408 CB TRP A 233 18.165 23.662 27.197 1.00 49.18 C ATOM 409 CG TRP A 233 19.363 24.260 26.519 1.00 48.76 C ATOM 410 CD1 TRP A 233 20.678 24.033 26.824 1.00 48.84 C ATOM 411 CD2 TRP A 233 19.360 25.170 25.409 1.00 48.65 C ATOM 412 NE1 TRP A 233 21.492 24.752 25.973 1.00 48.96 N ATOM 413 CE2 TRP A 233 20.706 25.460 25.100 1.00 48.86 C ATOM 414 CE3 TRP A 233 18.351 25.770 24.650 1.00 48.56 C ATOM 415 CZ2 TRP A 233 21.066 26.328 24.066 1.00 49.08 C ATOM 416 CZ3 TRP A 233 18.710 26.635 23.623 1.00 48.68 C ATOM 417 CH2 TRP A 233 20.056 26.904 23.342 1.00 48.98 C ATOM 0 H TRP A 233 16.448 21.950 28.029 1.00 50.04 H new ATOM 0 HA TRP A 233 17.608 22.491 25.636 1.00 49.89 H new ATOM 0 HB2 TRP A 233 17.428 24.291 27.151 1.00 49.18 H new ATOM 0 HB3 TRP A 233 18.366 23.529 28.136 1.00 49.18 H new ATOM 0 HD1 TRP A 233 20.979 23.476 27.505 1.00 48.84 H new ATOM 0 HE1 TRP A 233 22.352 24.756 25.988 1.00 48.96 H new ATOM 0 HE3 TRP A 233 17.456 25.594 24.829 1.00 48.56 H new ATOM 0 HZ2 TRP A 233 21.958 26.508 23.876 1.00 49.08 H new ATOM 0 HZ3 TRP A 233 18.046 27.042 23.114 1.00 48.68 H new ATOM 0 HH2 TRP A 233 20.268 27.486 22.649 1.00 48.98 H new ATOM 418 N GLY A 234 19.452 20.873 25.757 1.00 51.03 N ATOM 419 CA GLY A 234 20.412 19.798 25.849 1.00 52.20 C ATOM 420 C GLY A 234 21.714 20.129 25.167 1.00 53.31 C ATOM 421 O GLY A 234 21.820 21.128 24.453 1.00 52.92 O ATOM 0 H GLY A 234 19.377 21.226 24.976 1.00 51.03 H new ATOM 0 HA2 GLY A 234 20.581 19.598 26.783 1.00 52.20 H new ATOM 0 HA3 GLY A 234 20.036 18.997 25.451 1.00 52.20 H new ATOM 422 N ARG A 235 22.706 19.276 25.388 1.00 54.56 N ATOM 423 CA ARG A 235 24.023 19.474 24.816 1.00 56.62 C ATOM 424 C ARG A 235 24.550 18.202 24.162 1.00 57.36 C ATOM 425 O ARG A 235 24.407 17.093 24.688 1.00 56.71 O ATOM 426 CB ARG A 235 24.995 19.962 25.893 1.00 57.63 C ATOM 427 CG ARG A 235 26.459 19.928 25.489 1.00 59.33 C ATOM 428 CD ARG A 235 27.357 19.931 26.717 1.00 60.28 C ATOM 429 NE ARG A 235 27.308 21.204 27.430 1.00 61.30 N ATOM 430 CZ ARG A 235 27.841 21.405 28.633 1.00 62.12 C ATOM 431 NH1 ARG A 235 28.456 20.411 29.264 1.00 62.42 N ATOM 432 NH2 ARG A 235 27.760 22.599 29.208 1.00 62.27 N ATOM 0 H ARG A 235 22.632 18.569 25.873 1.00 54.56 H new ATOM 0 HA ARG A 235 23.948 20.149 24.123 1.00 56.62 H new ATOM 0 HB2 ARG A 235 24.760 20.871 26.135 1.00 57.63 H new ATOM 0 HB3 ARG A 235 24.879 19.418 26.687 1.00 57.63 H new ATOM 0 HG2 ARG A 235 26.634 19.136 24.957 1.00 59.33 H new ATOM 0 HG3 ARG A 235 26.663 20.695 24.932 1.00 59.33 H new ATOM 0 HD2 ARG A 235 27.088 19.216 27.315 1.00 60.28 H new ATOM 0 HD3 ARG A 235 28.271 19.747 26.448 1.00 60.28 H new ATOM 0 HE ARG A 235 26.910 21.865 27.049 1.00 61.30 H new ATOM 0 HH11 ARG A 235 28.510 19.636 28.895 1.00 62.42 H new ATOM 0 HH12 ARG A 235 28.800 20.543 30.041 1.00 62.42 H new ATOM 0 HH21 ARG A 235 27.362 23.245 28.803 1.00 62.27 H new ATOM 0 HH22 ARG A 235 28.105 22.726 29.985 1.00 62.27 H new ATOM 433 N VAL A 236 25.143 18.377 22.992 1.00 58.75 N ATOM 434 CA VAL A 236 25.925 17.326 22.362 1.00 60.15 C ATOM 435 C VAL A 236 27.359 17.852 22.256 1.00 60.63 C ATOM 436 O VAL A 236 27.599 19.037 22.495 1.00 61.01 O ATOM 437 CB VAL A 236 25.324 16.959 20.983 1.00 60.34 C ATOM 438 CG1 VAL A 236 26.373 16.411 20.044 1.00 60.91 C ATOM 439 CG2 VAL A 236 24.170 15.977 21.157 1.00 60.03 C ATOM 0 H VAL A 236 25.104 19.108 22.540 1.00 58.75 H new ATOM 0 HA VAL A 236 25.915 16.507 22.882 1.00 60.15 H new ATOM 0 HB VAL A 236 24.980 17.771 20.579 1.00 60.34 H new ATOM 0 HG11 VAL A 236 25.963 16.192 19.193 1.00 60.91 H new ATOM 0 HG12 VAL A 236 27.065 17.077 19.908 1.00 60.91 H new ATOM 0 HG13 VAL A 236 26.765 15.611 20.428 1.00 60.91 H new ATOM 0 HG21 VAL A 236 23.801 15.754 20.288 1.00 60.03 H new ATOM 0 HG22 VAL A 236 24.494 15.170 21.587 1.00 60.03 H new ATOM 0 HG23 VAL A 236 23.481 16.382 21.706 1.00 60.03 H new ATOM 440 N ALA A 237 28.324 16.987 21.959 1.00 61.28 N ATOM 441 CA ALA A 237 29.645 17.482 21.598 1.00 62.12 C ATOM 442 C ALA A 237 29.460 18.106 20.228 1.00 62.58 C ATOM 443 O ALA A 237 29.184 17.395 19.264 1.00 63.40 O ATOM 444 CB ALA A 237 30.654 16.351 21.547 1.00 62.35 C ATOM 0 H ALA A 237 28.238 16.131 21.960 1.00 61.28 H new ATOM 0 HA ALA A 237 29.987 18.117 22.247 1.00 62.12 H new ATOM 0 HB1 ALA A 237 31.524 16.704 21.305 1.00 62.35 H new ATOM 0 HB2 ALA A 237 30.708 15.926 22.417 1.00 62.35 H new ATOM 0 HB3 ALA A 237 30.375 15.698 20.886 1.00 62.35 H new ATOM 445 N ASP A 238 29.596 19.429 20.153 1.00 62.72 N ATOM 446 CA ASP A 238 29.134 20.227 19.008 1.00 62.91 C ATOM 447 C ASP A 238 28.418 21.484 19.519 1.00 62.42 C ATOM 448 O ASP A 238 28.813 22.617 19.224 1.00 62.71 O ATOM 449 CB ASP A 238 28.145 19.433 18.144 1.00 63.61 C ATOM 450 CG ASP A 238 28.805 18.747 16.955 1.00 64.40 C ATOM 451 OD1 ASP A 238 30.049 18.600 16.946 1.00 64.46 O ATOM 452 OD2 ASP A 238 28.068 18.338 16.029 1.00 64.96 O ATOM 0 H ASP A 238 29.964 19.898 20.773 1.00 62.72 H new ATOM 0 HA ASP A 238 29.909 20.461 18.474 1.00 62.91 H new ATOM 0 HB2 ASP A 238 27.708 18.764 18.694 1.00 63.61 H new ATOM 0 HB3 ASP A 238 27.453 20.031 17.822 1.00 63.61 H new ATOM 453 N GLY A 239 27.364 21.238 20.298 1.00 61.01 N ATOM 454 CA GLY A 239 26.415 22.229 20.838 1.00 60.11 C ATOM 455 C GLY A 239 25.266 21.255 20.974 1.00 58.60 C ATOM 456 O GLY A 239 25.546 20.069 21.089 1.00 59.48 O ATOM 0 H GLY A 239 27.167 20.438 20.544 1.00 61.01 H new ATOM 0 HA2 GLY A 239 26.697 22.619 21.680 1.00 60.11 H new ATOM 0 HA3 GLY A 239 26.233 22.964 20.232 1.00 60.11 H new ATOM 457 N GLU A 240 23.997 21.648 21.061 1.00 57.30 N ATOM 458 CA GLU A 240 23.404 22.631 21.974 1.00 55.45 C ATOM 459 C GLU A 240 22.136 23.314 21.440 1.00 53.61 C ATOM 460 O GLU A 240 22.166 24.007 20.424 1.00 53.65 O ATOM 461 CB GLU A 240 24.394 23.572 22.655 1.00 55.79 C ATOM 462 CG GLU A 240 24.092 23.634 24.149 1.00 56.28 C ATOM 463 CD GLU A 240 24.955 24.610 24.911 1.00 56.68 C ATOM 464 OE1 GLU A 240 24.391 25.430 25.667 1.00 56.78 O ATOM 465 OE2 GLU A 240 26.191 24.553 24.762 1.00 57.08 O ATOM 0 H GLU A 240 23.402 21.315 20.537 1.00 57.30 H new ATOM 0 HA GLU A 240 23.085 22.083 22.708 1.00 55.45 H new ATOM 0 HB2 GLU A 240 25.302 23.261 22.511 1.00 55.79 H new ATOM 0 HB3 GLU A 240 24.333 24.458 22.266 1.00 55.79 H new ATOM 0 HG2 GLU A 240 23.161 23.876 24.271 1.00 56.28 H new ATOM 0 HG3 GLU A 240 24.207 22.749 24.530 1.00 56.28 H new ATOM 466 N GLY A 241 21.019 23.068 22.126 1.00 51.65 N ATOM 467 CA GLY A 241 19.722 23.624 21.737 1.00 50.11 C ATOM 468 C GLY A 241 18.505 22.925 22.332 1.00 49.30 C ATOM 469 O GLY A 241 18.633 21.944 23.065 1.00 49.08 O ATOM 0 H GLY A 241 20.992 22.574 22.830 1.00 51.65 H new ATOM 0 HA2 GLY A 241 19.697 24.559 21.995 1.00 50.11 H new ATOM 0 HA3 GLY A 241 19.652 23.595 20.770 1.00 50.11 H new ATOM 470 N TRP A 242 17.320 23.437 22.005 1.00 48.65 N ATOM 471 CA TRP A 242 16.048 22.869 22.458 1.00 48.19 C ATOM 472 C TRP A 242 15.700 21.553 21.749 1.00 48.76 C ATOM 473 O TRP A 242 15.851 21.443 20.535 1.00 49.65 O ATOM 474 CB TRP A 242 14.907 23.865 22.219 1.00 46.85 C ATOM 475 CG TRP A 242 15.049 25.210 22.897 1.00 46.52 C ATOM 476 CD1 TRP A 242 15.263 26.422 22.288 1.00 46.56 C ATOM 477 CD2 TRP A 242 14.948 25.482 24.301 1.00 46.35 C ATOM 478 NE1 TRP A 242 15.313 27.426 23.233 1.00 46.53 N ATOM 479 CE2 TRP A 242 15.122 26.874 24.474 1.00 46.54 C ATOM 480 CE3 TRP A 242 14.730 24.684 25.431 1.00 46.89 C ATOM 481 CZ2 TRP A 242 15.087 27.479 25.731 1.00 46.61 C ATOM 482 CZ3 TRP A 242 14.698 25.290 26.679 1.00 46.46 C ATOM 483 CH2 TRP A 242 14.878 26.671 26.816 1.00 46.51 C ATOM 0 H TRP A 242 17.230 24.133 21.508 1.00 48.65 H new ATOM 0 HA TRP A 242 16.153 22.685 23.405 1.00 48.19 H new ATOM 0 HB2 TRP A 242 14.824 24.011 21.264 1.00 46.85 H new ATOM 0 HB3 TRP A 242 14.078 23.458 22.517 1.00 46.85 H new ATOM 0 HD1 TRP A 242 15.360 26.548 21.372 1.00 46.56 H new ATOM 0 HE1 TRP A 242 15.443 28.261 23.071 1.00 46.53 H new ATOM 0 HE3 TRP A 242 14.609 23.766 25.347 1.00 46.89 H new ATOM 0 HZ2 TRP A 242 15.201 28.397 25.828 1.00 46.61 H new ATOM 0 HZ3 TRP A 242 14.555 24.770 27.437 1.00 46.46 H new ATOM 0 HH2 TRP A 242 14.855 27.049 27.665 1.00 46.51 H new ATOM 484 N PHE A 243 15.199 20.574 22.501 1.00 48.88 N ATOM 485 CA PHE A 243 14.793 19.280 21.936 1.00 49.31 C ATOM 486 C PHE A 243 13.596 18.706 22.704 1.00 49.42 C ATOM 487 O PHE A 243 13.393 19.048 23.856 1.00 49.48 O ATOM 488 CB PHE A 243 15.973 18.285 21.961 1.00 48.87 C ATOM 489 CG PHE A 243 16.360 17.831 23.349 1.00 48.86 C ATOM 490 CD1 PHE A 243 15.889 16.625 23.861 1.00 48.98 C ATOM 491 CD2 PHE A 243 17.190 18.603 24.140 1.00 48.55 C ATOM 492 CE1 PHE A 243 16.234 16.207 25.140 1.00 48.69 C ATOM 493 CE2 PHE A 243 17.540 18.190 25.424 1.00 48.89 C ATOM 494 CZ PHE A 243 17.060 16.992 25.923 1.00 49.00 C ATOM 0 H PHE A 243 15.084 20.638 23.351 1.00 48.88 H new ATOM 0 HA PHE A 243 14.527 19.421 21.014 1.00 49.31 H new ATOM 0 HB2 PHE A 243 15.741 17.508 21.429 1.00 48.87 H new ATOM 0 HB3 PHE A 243 16.742 18.698 21.539 1.00 48.87 H new ATOM 0 HD1 PHE A 243 15.335 16.091 23.339 1.00 48.98 H new ATOM 0 HD2 PHE A 243 17.519 19.408 23.811 1.00 48.55 H new ATOM 0 HE1 PHE A 243 15.910 15.400 25.469 1.00 48.69 H new ATOM 0 HE2 PHE A 243 18.097 18.721 25.946 1.00 48.89 H new ATOM 0 HZ PHE A 243 17.292 16.716 26.780 1.00 49.00 H new ATOM 495 N PRO A 244 12.812 17.806 22.077 1.00 50.36 N ATOM 496 CA PRO A 244 11.655 17.258 22.798 1.00 49.94 C ATOM 497 C PRO A 244 12.046 16.126 23.745 1.00 50.37 C ATOM 498 O PRO A 244 12.690 15.162 23.323 1.00 50.35 O ATOM 499 CB PRO A 244 10.756 16.709 21.679 1.00 50.03 C ATOM 500 CG PRO A 244 11.523 16.868 20.381 1.00 49.88 C ATOM 501 CD PRO A 244 12.942 17.229 20.726 1.00 50.00 C ATOM 0 HA PRO A 244 11.230 17.931 23.353 1.00 49.94 H new ATOM 0 HB2 PRO A 244 10.539 15.777 21.838 1.00 50.03 H new ATOM 0 HB3 PRO A 244 9.916 17.193 21.644 1.00 50.03 H new ATOM 0 HG2 PRO A 244 11.497 16.045 19.868 1.00 49.88 H new ATOM 0 HG3 PRO A 244 11.121 17.558 19.831 1.00 49.88 H new ATOM 0 HD2 PRO A 244 13.523 16.452 20.721 1.00 50.00 H new ATOM 0 HD3 PRO A 244 13.315 17.866 20.097 1.00 50.00 H new ATOM 502 N ALA A 245 11.658 16.249 25.012 1.00 49.96 N ATOM 503 CA ALA A 245 11.949 15.238 26.025 1.00 50.25 C ATOM 504 C ALA A 245 11.434 13.849 25.648 1.00 50.87 C ATOM 505 O ALA A 245 12.056 12.839 25.984 1.00 51.15 O ATOM 506 CB ALA A 245 11.368 15.659 27.357 1.00 50.51 C ATOM 0 H ALA A 245 11.217 16.924 25.309 1.00 49.96 H new ATOM 0 HA ALA A 245 12.915 15.173 26.088 1.00 50.25 H new ATOM 0 HB1 ALA A 245 11.565 14.983 28.024 1.00 50.51 H new ATOM 0 HB2 ALA A 245 11.759 16.504 27.628 1.00 50.51 H new ATOM 0 HB3 ALA A 245 10.407 15.760 27.274 1.00 50.51 H new ATOM 507 N SER A 246 10.300 13.809 24.945 1.00 50.86 N ATOM 508 CA SER A 246 9.637 12.561 24.562 1.00 49.70 C ATOM 509 C SER A 246 10.393 11.759 23.494 1.00 49.24 C ATOM 510 O SER A 246 10.025 10.625 23.202 1.00 48.77 O ATOM 511 CB SER A 246 8.223 12.849 24.066 1.00 49.50 C ATOM 512 OG SER A 246 8.262 13.604 22.865 1.00 49.43 O ATOM 0 H SER A 246 9.890 14.515 24.674 1.00 50.86 H new ATOM 0 HA SER A 246 9.617 12.014 25.363 1.00 49.70 H new ATOM 0 HB2 SER A 246 7.751 12.015 23.915 1.00 49.50 H new ATOM 0 HB3 SER A 246 7.729 13.336 24.744 1.00 49.50 H new ATOM 0 HG SER A 246 8.264 14.424 23.049 1.00 49.43 H new ATOM 513 N PHE A 247 11.444 12.351 22.927 1.00 48.63 N ATOM 514 CA PHE A 247 12.288 11.689 21.918 1.00 48.48 C ATOM 515 C PHE A 247 13.454 10.948 22.561 1.00 49.03 C ATOM 516 O PHE A 247 14.330 10.408 21.866 1.00 49.53 O ATOM 517 CB PHE A 247 12.866 12.732 20.946 1.00 47.24 C ATOM 518 CG PHE A 247 11.941 13.105 19.833 1.00 46.32 C ATOM 519 CD1 PHE A 247 10.621 13.432 20.091 1.00 45.98 C ATOM 520 CD2 PHE A 247 12.398 13.141 18.523 1.00 46.46 C ATOM 521 CE1 PHE A 247 9.761 13.776 19.057 1.00 46.51 C ATOM 522 CE2 PHE A 247 11.552 13.478 17.483 1.00 45.73 C ATOM 523 CZ PHE A 247 10.228 13.803 17.748 1.00 46.45 C ATOM 0 H PHE A 247 11.692 13.153 23.115 1.00 48.63 H new ATOM 0 HA PHE A 247 11.726 11.054 21.447 1.00 48.48 H new ATOM 0 HB2 PHE A 247 13.097 13.532 21.444 1.00 47.24 H new ATOM 0 HB3 PHE A 247 13.689 12.386 20.568 1.00 47.24 H new ATOM 0 HD1 PHE A 247 10.307 13.421 20.966 1.00 45.98 H new ATOM 0 HD2 PHE A 247 13.287 12.935 18.342 1.00 46.46 H new ATOM 0 HE1 PHE A 247 8.874 13.988 19.240 1.00 46.51 H new ATOM 0 HE2 PHE A 247 11.868 13.487 16.609 1.00 45.73 H new ATOM 0 HZ PHE A 247 9.656 14.038 17.053 1.00 46.45 H new ATOM 524 N VAL A 248 13.455 10.922 23.888 1.00 49.17 N ATOM 525 CA VAL A 248 14.656 10.642 24.656 1.00 49.40 C ATOM 526 C VAL A 248 14.343 9.809 25.904 1.00 48.85 C ATOM 527 O VAL A 248 13.271 9.951 26.490 1.00 49.56 O ATOM 528 CB VAL A 248 15.290 11.992 25.052 1.00 50.54 C ATOM 529 CG1 VAL A 248 15.594 12.079 26.548 1.00 50.86 C ATOM 530 CG2 VAL A 248 16.475 12.315 24.174 1.00 50.47 C ATOM 0 H VAL A 248 12.756 11.067 24.368 1.00 49.17 H new ATOM 0 HA VAL A 248 15.272 10.121 24.117 1.00 49.40 H new ATOM 0 HB VAL A 248 14.632 12.686 24.891 1.00 50.54 H new ATOM 0 HG11 VAL A 248 15.990 12.942 26.748 1.00 50.86 H new ATOM 0 HG12 VAL A 248 14.772 11.976 27.052 1.00 50.86 H new ATOM 0 HG13 VAL A 248 16.214 11.375 26.794 1.00 50.86 H new ATOM 0 HG21 VAL A 248 16.855 13.166 24.443 1.00 50.47 H new ATOM 0 HG22 VAL A 248 17.145 11.619 24.265 1.00 50.47 H new ATOM 0 HG23 VAL A 248 16.188 12.367 23.249 1.00 50.47 H new ATOM 531 N ARG A 249 15.258 8.919 26.285 1.00 47.29 N ATOM 532 CA ARG A 249 15.129 8.156 27.531 1.00 45.97 C ATOM 533 C ARG A 249 16.303 8.502 28.438 1.00 46.45 C ATOM 534 O ARG A 249 17.455 8.478 28.002 1.00 46.73 O ATOM 535 CB ARG A 249 15.133 6.645 27.267 1.00 45.27 C ATOM 536 CG ARG A 249 15.286 5.782 28.532 1.00 44.84 C ATOM 537 CD ARG A 249 15.665 4.346 28.182 1.00 44.42 C ATOM 538 NE ARG A 249 15.905 3.483 29.337 1.00 43.37 N ATOM 539 CZ ARG A 249 17.115 3.124 29.770 1.00 43.49 C ATOM 540 NH1 ARG A 249 18.205 3.572 29.160 1.00 43.53 N ATOM 541 NH2 ARG A 249 17.242 2.317 30.816 1.00 42.62 N ATOM 0 H ARG A 249 15.967 8.740 25.833 1.00 47.29 H new ATOM 0 HA ARG A 249 14.285 8.389 27.949 1.00 45.97 H new ATOM 0 HB2 ARG A 249 14.306 6.403 26.821 1.00 45.27 H new ATOM 0 HB3 ARG A 249 15.857 6.436 26.656 1.00 45.27 H new ATOM 0 HG2 ARG A 249 15.965 6.167 29.108 1.00 44.84 H new ATOM 0 HG3 ARG A 249 14.455 5.787 29.032 1.00 44.84 H new ATOM 0 HD2 ARG A 249 14.956 3.958 27.645 1.00 44.42 H new ATOM 0 HD3 ARG A 249 16.463 4.359 27.631 1.00 44.42 H new ATOM 0 HE ARG A 249 15.221 3.187 29.766 1.00 43.37 H new ATOM 0 HH11 ARG A 249 18.134 4.096 28.482 1.00 43.53 H new ATOM 0 HH12 ARG A 249 18.983 3.338 29.443 1.00 43.53 H new ATOM 0 HH21 ARG A 249 16.542 2.022 31.219 1.00 42.62 H new ATOM 0 HH22 ARG A 249 18.024 2.089 31.091 1.00 42.62 H new ATOM 542 N LEU A 250 16.017 8.819 29.693 1.00 46.15 N ATOM 543 CA LEU A 250 17.072 9.071 30.654 1.00 47.29 C ATOM 544 C LEU A 250 17.751 7.765 31.017 1.00 47.26 C ATOM 545 O LEU A 250 17.089 6.768 31.278 1.00 47.53 O ATOM 546 CB LEU A 250 16.515 9.718 31.918 1.00 48.02 C ATOM 547 CG LEU A 250 16.035 11.157 31.785 1.00 49.18 C ATOM 548 CD1 LEU A 250 15.187 11.548 33.008 1.00 49.65 C ATOM 549 CD2 LEU A 250 17.236 12.080 31.600 1.00 49.05 C ATOM 0 H LEU A 250 15.219 8.893 30.005 1.00 46.15 H new ATOM 0 HA LEU A 250 17.713 9.678 30.252 1.00 47.29 H new ATOM 0 HB2 LEU A 250 15.774 9.178 32.235 1.00 48.02 H new ATOM 0 HB3 LEU A 250 17.201 9.688 32.603 1.00 48.02 H new ATOM 0 HG LEU A 250 15.468 11.245 31.003 1.00 49.18 H new ATOM 0 HD11 LEU A 250 14.886 12.465 32.914 1.00 49.65 H new ATOM 0 HD12 LEU A 250 14.417 10.961 33.070 1.00 49.65 H new ATOM 0 HD13 LEU A 250 15.722 11.465 33.813 1.00 49.65 H new ATOM 0 HD21 LEU A 250 16.930 12.997 31.515 1.00 49.05 H new ATOM 0 HD22 LEU A 250 17.823 12.005 32.368 1.00 49.05 H new ATOM 0 HD23 LEU A 250 17.719 11.826 30.798 1.00 49.05 H new ATOM 550 N ARG A 251 19.076 7.775 31.020 1.00 47.07 N ATOM 551 CA ARG A 251 19.823 6.658 31.550 1.00 47.09 C ATOM 552 C ARG A 251 19.345 6.402 32.964 1.00 46.53 C ATOM 553 O ARG A 251 19.121 7.341 33.725 1.00 46.28 O ATOM 554 CB ARG A 251 21.310 6.985 31.578 1.00 48.03 C ATOM 555 CG ARG A 251 22.000 6.809 30.253 1.00 49.57 C ATOM 556 CD ARG A 251 23.475 7.147 30.368 1.00 50.18 C ATOM 557 NE ARG A 251 24.165 6.933 29.101 1.00 51.30 N ATOM 558 CZ ARG A 251 25.397 7.357 28.839 1.00 51.47 C ATOM 559 NH1 ARG A 251 26.079 8.028 29.757 1.00 51.79 N ATOM 560 NH2 ARG A 251 25.943 7.110 27.657 1.00 51.90 N ATOM 0 H ARG A 251 19.557 8.421 30.719 1.00 47.07 H new ATOM 0 HA ARG A 251 19.686 5.877 30.992 1.00 47.09 H new ATOM 0 HB2 ARG A 251 21.425 7.902 31.873 1.00 48.03 H new ATOM 0 HB3 ARG A 251 21.744 6.419 32.236 1.00 48.03 H new ATOM 0 HG2 ARG A 251 21.896 5.894 29.948 1.00 49.57 H new ATOM 0 HG3 ARG A 251 21.584 7.379 29.588 1.00 49.57 H new ATOM 0 HD2 ARG A 251 23.577 8.072 30.643 1.00 50.18 H new ATOM 0 HD3 ARG A 251 23.882 6.600 31.058 1.00 50.18 H new ATOM 0 HE ARG A 251 23.747 6.505 28.483 1.00 51.30 H new ATOM 0 HH11 ARG A 251 25.724 8.190 30.524 1.00 51.79 H new ATOM 0 HH12 ARG A 251 26.876 8.302 29.586 1.00 51.79 H new ATOM 0 HH21 ARG A 251 25.500 6.676 27.061 1.00 51.90 H new ATOM 0 HH22 ARG A 251 26.740 7.384 27.486 1.00 51.90 H new ATOM 561 N VAL A 252 19.194 5.129 33.313 1.00 45.98 N ATOM 562 CA VAL A 252 18.791 4.744 34.660 1.00 45.72 C ATOM 563 C VAL A 252 19.885 5.060 35.669 1.00 45.90 C ATOM 564 O VAL A 252 19.630 5.666 36.706 1.00 46.13 O ATOM 565 CB VAL A 252 18.457 3.245 34.736 1.00 45.19 C ATOM 566 CG1 VAL A 252 18.344 2.794 36.190 1.00 45.19 C ATOM 567 CG2 VAL A 252 17.180 2.962 33.986 1.00 44.64 C ATOM 0 H VAL A 252 19.322 4.467 32.779 1.00 45.98 H new ATOM 0 HA VAL A 252 17.997 5.257 34.876 1.00 45.72 H new ATOM 0 HB VAL A 252 19.176 2.743 34.322 1.00 45.19 H new ATOM 0 HG11 VAL A 252 18.133 1.848 36.220 1.00 45.19 H new ATOM 0 HG12 VAL A 252 19.186 2.952 36.644 1.00 45.19 H new ATOM 0 HG13 VAL A 252 17.640 3.296 36.631 1.00 45.19 H new ATOM 0 HG21 VAL A 252 16.977 2.015 34.039 1.00 44.64 H new ATOM 0 HG22 VAL A 252 16.454 3.471 34.380 1.00 44.64 H new ATOM 0 HG23 VAL A 252 17.287 3.218 33.057 1.00 44.64 H new ATOM 568 N ASN A 253 21.103 4.638 35.354 1.00 46.08 N ATOM 569 CA ASN A 253 22.246 4.853 36.229 1.00 46.12 C ATOM 570 C ASN A 253 23.045 6.049 35.715 1.00 46.48 C ATOM 571 O ASN A 253 23.605 6.001 34.619 1.00 46.23 O ATOM 572 CB ASN A 253 23.122 3.599 36.278 1.00 45.15 C ATOM 573 CG ASN A 253 22.368 2.373 36.764 1.00 45.06 C ATOM 574 OD1 ASN A 253 21.919 2.316 37.910 1.00 44.78 O ATOM 575 ND2 ASN A 253 22.244 1.371 35.898 1.00 45.06 N ATOM 0 H ASN A 253 21.290 4.219 34.627 1.00 46.08 H new ATOM 0 HA ASN A 253 21.937 5.036 37.130 1.00 46.12 H new ATOM 0 HB2 ASN A 253 23.479 3.424 35.393 1.00 45.15 H new ATOM 0 HB3 ASN A 253 23.879 3.761 36.863 1.00 45.15 H new ATOM 0 HD21 ASN A 253 21.838 0.649 36.131 1.00 45.06 H new ATOM 0 HD22 ASN A 253 22.570 1.445 35.105 1.00 45.06 H new ATOM 576 N GLN A 254 23.076 7.120 36.503 1.00 47.07 N ATOM 577 CA GLN A 254 23.695 8.374 36.085 1.00 47.76 C ATOM 578 C GLN A 254 25.143 8.475 36.553 1.00 47.72 C ATOM 579 O GLN A 254 25.600 7.671 37.365 1.00 47.89 O ATOM 580 CB GLN A 254 22.885 9.568 36.600 1.00 48.21 C ATOM 581 CG GLN A 254 21.472 9.673 36.024 1.00 49.02 C ATOM 582 CD GLN A 254 21.441 10.175 34.584 1.00 49.61 C ATOM 583 OE1 GLN A 254 22.480 10.899 34.177 1.00 50.52 O flip ATOM 584 NE2 GLN A 254 20.483 9.921 33.853 1.00 49.46 N flip ATOM 0 H GLN A 254 22.739 7.140 37.294 1.00 47.07 H new ATOM 0 HA GLN A 254 23.699 8.388 35.115 1.00 47.76 H new ATOM 0 HB2 GLN A 254 22.824 9.510 37.566 1.00 48.21 H new ATOM 0 HB3 GLN A 254 23.367 10.384 36.394 1.00 48.21 H new ATOM 0 HG2 GLN A 254 21.048 8.802 36.065 1.00 49.02 H new ATOM 0 HG3 GLN A 254 20.947 10.271 36.579 1.00 49.02 H new ATOM 0 HE21 GLN A 254 19.828 9.449 34.151 1.00 49.46 H new ATOM 0 HE22 GLN A 254 20.469 10.215 33.045 1.00 49.46 H new ATOM 585 N GLN A 278 32.563 -2.238 44.098 1.00 63.45 N ATOM 586 CA GLN A 278 32.542 -3.649 44.456 1.00 63.67 C ATOM 587 C GLN A 278 31.111 -4.182 44.528 1.00 63.62 C ATOM 588 O GLN A 278 30.316 -3.735 45.357 1.00 63.83 O ATOM 589 CB GLN A 278 33.248 -3.868 45.798 1.00 63.88 C ATOM 590 CG GLN A 278 33.899 -5.241 45.963 1.00 64.12 C ATOM 591 CD GLN A 278 32.896 -6.360 46.199 1.00 64.30 C ATOM 592 OE1 GLN A 278 31.702 -6.002 46.663 1.00 64.16 O flip ATOM 593 NE2 GLN A 278 33.195 -7.534 45.973 1.00 64.39 N flip ATOM 0 HA GLN A 278 33.013 -4.138 43.763 1.00 63.67 H new ATOM 0 HB2 GLN A 278 33.929 -3.186 45.906 1.00 63.88 H new ATOM 0 HB3 GLN A 278 32.604 -3.741 46.512 1.00 63.88 H new ATOM 0 HG2 GLN A 278 34.418 -5.443 45.169 1.00 64.12 H new ATOM 0 HG3 GLN A 278 34.520 -5.210 46.708 1.00 64.12 H new ATOM 0 HE21 GLN A 278 33.977 -7.728 45.673 1.00 64.39 H new ATOM 0 HE22 GLN A 278 32.621 -8.159 46.115 1.00 64.39 H new ATOM 594 N SER A 279 30.795 -5.138 43.656 1.00 63.25 N ATOM 595 CA SER A 279 29.505 -5.833 43.676 1.00 62.68 C ATOM 596 C SER A 279 28.346 -4.910 44.073 1.00 62.08 C ATOM 597 O SER A 279 27.497 -5.275 44.892 1.00 62.16 O ATOM 598 CB SER A 279 29.573 -7.051 44.609 1.00 62.81 C ATOM 599 OG SER A 279 28.756 -8.115 44.143 1.00 62.76 O ATOM 0 H SER A 279 31.324 -5.404 43.033 1.00 63.25 H new ATOM 0 HA SER A 279 29.326 -6.133 42.771 1.00 62.68 H new ATOM 0 HB2 SER A 279 30.492 -7.355 44.679 1.00 62.81 H new ATOM 0 HB3 SER A 279 29.291 -6.792 45.500 1.00 62.81 H new ATOM 0 HG SER A 279 28.814 -8.765 44.671 1.00 62.76 H new ATOM 600 N SER A 280 28.350 -3.705 43.503 1.00 61.12 N ATOM 601 CA SER A 280 27.237 -2.762 43.593 1.00 59.81 C ATOM 602 C SER A 280 26.854 -2.490 42.154 1.00 58.91 C ATOM 603 O SER A 280 25.892 -1.771 41.858 1.00 58.85 O ATOM 604 CB SER A 280 27.664 -1.463 44.270 1.00 60.13 C ATOM 605 OG SER A 280 28.278 -0.586 43.340 1.00 60.06 O ATOM 0 H SER A 280 29.014 -3.408 43.044 1.00 61.12 H new ATOM 0 HA SER A 280 26.506 -3.120 44.120 1.00 59.81 H new ATOM 0 HB2 SER A 280 26.891 -1.031 44.666 1.00 60.13 H new ATOM 0 HB3 SER A 280 28.281 -1.658 44.992 1.00 60.13 H new ATOM 0 HG SER A 280 28.504 0.123 43.730 1.00 60.06 H new ATOM 606 N LYS A 281 27.651 -3.068 41.260 1.00 57.56 N ATOM 607 CA LYS A 281 27.299 -3.190 39.857 1.00 56.21 C ATOM 608 C LYS A 281 26.070 -4.084 39.771 1.00 54.77 C ATOM 609 O LYS A 281 25.363 -4.082 38.765 1.00 54.57 O ATOM 610 CB LYS A 281 28.457 -3.816 39.074 1.00 56.72 C ATOM 611 CG LYS A 281 29.769 -3.045 39.164 1.00 57.12 C ATOM 612 CD LYS A 281 30.961 -3.909 38.756 1.00 57.41 C ATOM 613 CE LYS A 281 32.259 -3.113 38.798 1.00 57.61 C ATOM 614 NZ LYS A 281 33.472 -3.981 38.695 1.00 57.76 N ATOM 0 H LYS A 281 28.418 -3.403 41.457 1.00 57.56 H new ATOM 0 HA LYS A 281 27.116 -2.317 39.475 1.00 56.21 H new ATOM 0 HB2 LYS A 281 28.602 -4.718 39.399 1.00 56.72 H new ATOM 0 HB3 LYS A 281 28.200 -3.888 38.141 1.00 56.72 H new ATOM 0 HG2 LYS A 281 29.725 -2.263 38.592 1.00 57.12 H new ATOM 0 HG3 LYS A 281 29.896 -2.726 40.071 1.00 57.12 H new ATOM 0 HD2 LYS A 281 31.028 -4.673 39.350 1.00 57.41 H new ATOM 0 HD3 LYS A 281 30.821 -4.256 37.861 1.00 57.41 H new ATOM 0 HE2 LYS A 281 32.263 -2.470 38.072 1.00 57.61 H new ATOM 0 HE3 LYS A 281 32.297 -2.607 39.625 1.00 57.61 H new ATOM 0 HZ1 LYS A 281 34.203 -3.474 38.724 1.00 57.76 H new ATOM 0 HZ2 LYS A 281 33.484 -4.557 39.373 1.00 57.76 H new ATOM 0 HZ3 LYS A 281 33.452 -4.429 37.926 1.00 57.76 H new ATOM 615 N ASP A 282 25.833 -4.850 40.837 1.00 53.14 N ATOM 616 CA ASP A 282 24.606 -5.629 40.997 1.00 51.65 C ATOM 617 C ASP A 282 23.422 -4.699 41.214 1.00 50.38 C ATOM 618 O ASP A 282 22.389 -4.832 40.560 1.00 50.23 O ATOM 619 CB ASP A 282 24.723 -6.592 42.183 1.00 51.78 C ATOM 620 CG ASP A 282 25.578 -7.799 41.868 1.00 52.13 C ATOM 621 OD1 ASP A 282 25.872 -8.583 42.794 1.00 52.17 O ATOM 622 OD2 ASP A 282 25.953 -7.964 40.688 1.00 52.27 O ATOM 0 H ASP A 282 26.384 -4.932 41.492 1.00 53.14 H new ATOM 0 HA ASP A 282 24.469 -6.146 40.188 1.00 51.65 H new ATOM 0 HB2 ASP A 282 25.101 -6.121 42.942 1.00 51.78 H new ATOM 0 HB3 ASP A 282 23.837 -6.887 42.445 1.00 51.78 H new ATOM 623 N GLN A 283 23.581 -3.757 42.142 1.00 49.29 N ATOM 624 CA GLN A 283 22.561 -2.746 42.382 1.00 48.61 C ATOM 625 C GLN A 283 22.224 -2.001 41.088 1.00 47.81 C ATOM 626 O GLN A 283 21.058 -1.744 40.806 1.00 48.06 O ATOM 627 CB GLN A 283 22.999 -1.763 43.471 1.00 48.60 C ATOM 628 CG GLN A 283 21.988 -0.643 43.732 1.00 48.92 C ATOM 629 CD GLN A 283 20.688 -1.152 44.321 1.00 48.99 C ATOM 630 OE1 GLN A 283 20.677 -1.748 45.398 1.00 49.34 O ATOM 631 NE2 GLN A 283 19.582 -0.917 43.620 1.00 48.94 N ATOM 0 H GLN A 283 24.276 -3.688 42.644 1.00 49.29 H new ATOM 0 HA GLN A 283 21.762 -3.199 42.694 1.00 48.61 H new ATOM 0 HB2 GLN A 283 23.148 -2.252 44.296 1.00 48.60 H new ATOM 0 HB3 GLN A 283 23.848 -1.369 43.217 1.00 48.60 H new ATOM 0 HG2 GLN A 283 22.380 0.007 44.337 1.00 48.92 H new ATOM 0 HG3 GLN A 283 21.802 -0.180 42.900 1.00 48.92 H new ATOM 0 HE21 GLN A 283 19.629 -0.497 42.871 1.00 48.94 H new ATOM 0 HE22 GLN A 283 18.820 -1.185 43.916 1.00 48.94 H new ATOM 632 N MET A 284 23.245 -1.675 40.299 1.00 46.99 N ATOM 633 CA MET A 284 23.039 -1.003 39.014 1.00 46.63 C ATOM 634 C MET A 284 22.273 -1.882 38.022 1.00 46.18 C ATOM 635 O MET A 284 21.440 -1.386 37.266 1.00 46.06 O ATOM 636 CB MET A 284 24.369 -0.534 38.407 1.00 46.53 C ATOM 637 CG MET A 284 25.035 0.598 39.170 1.00 46.64 C ATOM 638 SD MET A 284 26.330 1.435 38.227 1.00 47.32 S ATOM 639 CE MET A 284 27.330 2.122 39.550 1.00 46.75 C ATOM 0 H MET A 284 24.069 -1.834 40.489 1.00 46.99 H new ATOM 0 HA MET A 284 22.494 -0.221 39.193 1.00 46.63 H new ATOM 0 HB2 MET A 284 24.979 -1.287 38.368 1.00 46.53 H new ATOM 0 HB3 MET A 284 24.213 -0.247 37.493 1.00 46.53 H new ATOM 0 HG2 MET A 284 24.361 1.246 39.427 1.00 46.64 H new ATOM 0 HG3 MET A 284 25.417 0.246 39.989 1.00 46.64 H new ATOM 0 HE1 MET A 284 28.078 2.609 39.171 1.00 46.75 H new ATOM 0 HE2 MET A 284 26.790 2.725 40.084 1.00 46.75 H new ATOM 0 HE3 MET A 284 27.663 1.404 40.111 1.00 46.75 H new ATOM 640 N ARG A 285 22.541 -3.185 38.028 1.00 45.65 N ATOM 641 CA ARG A 285 21.770 -4.086 37.178 1.00 45.74 C ATOM 642 C ARG A 285 20.300 -4.136 37.618 1.00 45.75 C ATOM 643 O ARG A 285 19.399 -4.141 36.792 1.00 45.33 O ATOM 644 CB ARG A 285 22.368 -5.494 37.129 1.00 45.41 C ATOM 645 CG ARG A 285 21.769 -6.320 35.993 1.00 45.39 C ATOM 646 CD ARG A 285 22.378 -7.705 35.839 1.00 44.98 C ATOM 647 NE ARG A 285 22.021 -8.253 34.531 1.00 44.67 N ATOM 648 CZ ARG A 285 20.920 -8.959 34.279 1.00 44.45 C ATOM 649 NH1 ARG A 285 20.057 -9.232 35.252 1.00 43.88 N ATOM 650 NH2 ARG A 285 20.686 -9.399 33.049 1.00 44.17 N ATOM 0 H ARG A 285 23.150 -3.560 38.505 1.00 45.65 H new ATOM 0 HA ARG A 285 21.811 -3.726 36.278 1.00 45.74 H new ATOM 0 HB2 ARG A 285 23.329 -5.434 37.014 1.00 45.41 H new ATOM 0 HB3 ARG A 285 22.210 -5.943 37.974 1.00 45.41 H new ATOM 0 HG2 ARG A 285 20.815 -6.412 36.142 1.00 45.39 H new ATOM 0 HG3 ARG A 285 21.880 -5.835 35.161 1.00 45.39 H new ATOM 0 HD2 ARG A 285 23.343 -7.656 35.927 1.00 44.98 H new ATOM 0 HD3 ARG A 285 22.058 -8.290 36.544 1.00 44.98 H new ATOM 0 HE ARG A 285 22.561 -8.109 33.877 1.00 44.67 H new ATOM 0 HH11 ARG A 285 20.207 -8.952 36.051 1.00 43.88 H new ATOM 0 HH12 ARG A 285 19.348 -9.688 35.082 1.00 43.88 H new ATOM 0 HH21 ARG A 285 21.244 -9.228 32.418 1.00 44.17 H new ATOM 0 HH22 ARG A 285 19.976 -9.855 32.883 1.00 44.17 H new ATOM 651 N THR A 286 20.081 -4.166 38.926 1.00 46.37 N ATOM 652 CA THR A 286 18.743 -4.194 39.507 1.00 46.23 C ATOM 653 C THR A 286 17.932 -2.954 39.127 1.00 45.81 C ATOM 654 O THR A 286 16.756 -3.054 38.777 1.00 46.50 O ATOM 655 CB THR A 286 18.839 -4.340 41.041 1.00 47.06 C ATOM 656 OG1 THR A 286 19.294 -5.661 41.364 1.00 46.92 O ATOM 657 CG2 THR A 286 17.496 -4.079 41.717 1.00 47.24 C ATOM 0 H THR A 286 20.712 -4.171 39.510 1.00 46.37 H new ATOM 0 HA THR A 286 18.274 -4.962 39.145 1.00 46.23 H new ATOM 0 HB THR A 286 19.469 -3.679 41.369 1.00 47.06 H new ATOM 0 HG1 THR A 286 19.349 -5.743 42.198 1.00 46.92 H new ATOM 0 HG21 THR A 286 17.592 -4.179 42.677 1.00 47.24 H new ATOM 0 HG22 THR A 286 17.201 -3.178 41.514 1.00 47.24 H new ATOM 0 HG23 THR A 286 16.840 -4.715 41.390 1.00 47.24 H new ATOM 658 N ASN A 287 18.567 -1.788 39.178 1.00 45.06 N ATOM 659 CA ASN A 287 17.914 -0.541 38.792 1.00 44.18 C ATOM 660 C ASN A 287 17.346 -0.586 37.368 1.00 44.43 C ATOM 661 O ASN A 287 16.259 -0.052 37.102 1.00 43.52 O ATOM 662 CB ASN A 287 18.888 0.632 38.898 1.00 43.63 C ATOM 663 CG ASN A 287 19.362 0.889 40.321 1.00 43.52 C ATOM 664 OD1 ASN A 287 18.840 0.329 41.290 1.00 43.55 O ATOM 665 ND2 ASN A 287 20.356 1.750 40.449 1.00 43.02 N ATOM 0 H ASN A 287 19.383 -1.697 39.435 1.00 45.06 H new ATOM 0 HA ASN A 287 17.174 -0.421 39.408 1.00 44.18 H new ATOM 0 HB2 ASN A 287 19.657 0.458 38.333 1.00 43.63 H new ATOM 0 HB3 ASN A 287 18.460 1.432 38.556 1.00 43.63 H new ATOM 0 HD21 ASN A 287 20.663 1.939 41.230 1.00 43.02 H new ATOM 0 HD22 ASN A 287 20.696 2.121 39.752 1.00 43.02 H new ATOM 666 N VAL A 288 18.091 -1.202 36.450 1.00 44.15 N ATOM 667 CA VAL A 288 17.653 -1.274 35.060 1.00 44.38 C ATOM 668 C VAL A 288 16.531 -2.294 34.915 1.00 44.63 C ATOM 669 O VAL A 288 15.577 -2.067 34.169 1.00 44.83 O ATOM 670 CB VAL A 288 18.807 -1.606 34.089 1.00 44.31 C ATOM 671 CG1 VAL A 288 18.295 -1.654 32.648 1.00 43.76 C ATOM 672 CG2 VAL A 288 19.934 -0.584 34.229 1.00 43.94 C ATOM 0 H VAL A 288 18.846 -1.581 36.611 1.00 44.15 H new ATOM 0 HA VAL A 288 17.325 -0.393 34.819 1.00 44.38 H new ATOM 0 HB VAL A 288 19.160 -2.480 34.316 1.00 44.31 H new ATOM 0 HG11 VAL A 288 19.030 -1.863 32.050 1.00 43.76 H new ATOM 0 HG12 VAL A 288 17.611 -2.337 32.570 1.00 43.76 H new ATOM 0 HG13 VAL A 288 17.920 -0.792 32.409 1.00 43.76 H new ATOM 0 HG21 VAL A 288 20.650 -0.806 33.614 1.00 43.94 H new ATOM 0 HG22 VAL A 288 19.595 0.302 34.025 1.00 43.94 H new ATOM 0 HG23 VAL A 288 20.273 -0.598 35.138 1.00 43.94 H new ATOM 673 N ILE A 289 16.646 -3.410 35.633 1.00 44.68 N ATOM 674 CA ILE A 289 15.592 -4.428 35.644 1.00 45.14 C ATOM 675 C ILE A 289 14.289 -3.829 36.171 1.00 45.04 C ATOM 676 O ILE A 289 13.217 -4.050 35.607 1.00 45.26 O ATOM 677 CB ILE A 289 16.001 -5.660 36.501 1.00 45.24 C ATOM 678 CG1 ILE A 289 16.960 -6.553 35.713 1.00 45.33 C ATOM 679 CG2 ILE A 289 14.790 -6.462 36.923 1.00 44.41 C ATOM 680 CD1 ILE A 289 17.867 -7.339 36.578 1.00 45.57 C ATOM 0 H ILE A 289 17.328 -3.599 36.122 1.00 44.68 H new ATOM 0 HA ILE A 289 15.459 -4.731 34.732 1.00 45.14 H new ATOM 0 HB ILE A 289 16.444 -5.333 37.300 1.00 45.24 H new ATOM 0 HG12 ILE A 289 16.446 -7.160 35.158 1.00 45.33 H new ATOM 0 HG13 ILE A 289 17.489 -6.002 35.116 1.00 45.33 H new ATOM 0 HG21 ILE A 289 15.074 -7.222 37.455 1.00 44.41 H new ATOM 0 HG22 ILE A 289 14.199 -5.902 37.450 1.00 44.41 H new ATOM 0 HG23 ILE A 289 14.320 -6.777 36.135 1.00 44.41 H new ATOM 0 HD11 ILE A 289 18.449 -7.884 36.026 1.00 45.57 H new ATOM 0 HD12 ILE A 289 18.404 -6.737 37.117 1.00 45.57 H new ATOM 0 HD13 ILE A 289 17.344 -7.913 37.159 1.00 45.57 H new ATOM 681 N ASN A 290 14.397 -3.064 37.252 1.00 45.09 N ATOM 682 CA ASN A 290 13.247 -2.383 37.841 1.00 45.39 C ATOM 683 C ASN A 290 12.616 -1.351 36.901 1.00 44.88 C ATOM 684 O ASN A 290 11.394 -1.241 36.833 1.00 45.94 O ATOM 685 CB ASN A 290 13.632 -1.736 39.176 1.00 45.94 C ATOM 686 CG ASN A 290 13.709 -2.741 40.311 1.00 46.79 C ATOM 687 OD1 ASN A 290 13.043 -3.772 40.285 1.00 47.63 O ATOM 688 ND2 ASN A 290 14.519 -2.441 41.316 1.00 46.88 N ATOM 0 H ASN A 290 15.138 -2.924 37.665 1.00 45.09 H new ATOM 0 HA ASN A 290 12.572 -3.061 37.998 1.00 45.39 H new ATOM 0 HB2 ASN A 290 14.490 -1.294 39.082 1.00 45.94 H new ATOM 0 HB3 ASN A 290 12.983 -1.051 39.399 1.00 45.94 H new ATOM 0 HD21 ASN A 290 14.593 -2.978 41.984 1.00 46.88 H new ATOM 0 HD22 ASN A 290 14.971 -1.709 41.301 1.00 46.88 H new ATOM 689 N GLU A 291 13.444 -0.603 36.175 1.00 44.18 N ATOM 690 CA GLU A 291 12.948 0.352 35.169 1.00 43.82 C ATOM 691 C GLU A 291 12.230 -0.336 34.010 1.00 43.69 C ATOM 692 O GLU A 291 11.189 0.137 33.549 1.00 44.12 O ATOM 693 CB GLU A 291 14.077 1.241 34.630 1.00 43.61 C ATOM 694 CG GLU A 291 13.607 2.359 33.680 1.00 43.50 C ATOM 695 CD GLU A 291 14.045 2.161 32.236 1.00 43.78 C ATOM 696 OE1 GLU A 291 14.747 1.170 31.941 1.00 43.61 O ATOM 697 OE2 GLU A 291 13.693 3.009 31.384 1.00 44.28 O ATOM 0 H GLU A 291 14.301 -0.630 36.246 1.00 44.18 H new ATOM 0 HA GLU A 291 12.301 0.910 35.628 1.00 43.82 H new ATOM 0 HB2 GLU A 291 14.543 1.643 35.380 1.00 43.61 H new ATOM 0 HB3 GLU A 291 14.719 0.683 34.163 1.00 43.61 H new ATOM 0 HG2 GLU A 291 12.639 2.413 33.711 1.00 43.50 H new ATOM 0 HG3 GLU A 291 13.949 3.209 33.999 1.00 43.50 H new ATOM 698 N ILE A 292 12.786 -1.446 33.533 1.00 43.39 N ATOM 699 CA ILE A 292 12.134 -2.206 32.480 1.00 43.71 C ATOM 700 C ILE A 292 10.767 -2.694 32.961 1.00 44.03 C ATOM 701 O ILE A 292 9.769 -2.626 32.232 1.00 43.49 O ATOM 702 CB ILE A 292 12.973 -3.429 32.053 1.00 43.65 C ATOM 703 CG1 ILE A 292 14.164 -2.986 31.195 1.00 44.26 C ATOM 704 CG2 ILE A 292 12.107 -4.416 31.297 1.00 42.99 C ATOM 705 CD1 ILE A 292 15.349 -3.944 31.256 1.00 44.58 C ATOM 0 H ILE A 292 13.534 -1.772 33.805 1.00 43.39 H new ATOM 0 HA ILE A 292 12.035 -1.616 31.716 1.00 43.71 H new ATOM 0 HB ILE A 292 13.317 -3.866 32.848 1.00 43.65 H new ATOM 0 HG12 ILE A 292 13.875 -2.899 30.273 1.00 44.26 H new ATOM 0 HG13 ILE A 292 14.453 -2.107 31.485 1.00 44.26 H new ATOM 0 HG21 ILE A 292 12.642 -5.181 31.033 1.00 42.99 H new ATOM 0 HG22 ILE A 292 11.380 -4.712 31.867 1.00 42.99 H new ATOM 0 HG23 ILE A 292 11.743 -3.988 30.506 1.00 42.99 H new ATOM 0 HD11 ILE A 292 16.066 -3.609 30.695 1.00 44.58 H new ATOM 0 HD12 ILE A 292 15.662 -4.014 32.172 1.00 44.58 H new ATOM 0 HD13 ILE A 292 15.074 -4.819 30.941 1.00 44.58 H new ATOM 706 N LEU A 293 10.727 -3.185 34.193 1.00 43.92 N ATOM 707 CA LEU A 293 9.494 -3.732 34.732 1.00 45.03 C ATOM 708 C LEU A 293 8.427 -2.672 34.936 1.00 44.93 C ATOM 709 O LEU A 293 7.279 -2.891 34.585 1.00 45.16 O ATOM 710 CB LEU A 293 9.752 -4.521 36.018 1.00 45.61 C ATOM 711 CG LEU A 293 10.383 -5.886 35.715 1.00 46.70 C ATOM 712 CD1 LEU A 293 10.988 -6.486 36.960 1.00 47.09 C ATOM 713 CD2 LEU A 293 9.361 -6.838 35.102 1.00 47.74 C ATOM 0 H LEU A 293 11.399 -3.210 34.729 1.00 43.92 H new ATOM 0 HA LEU A 293 9.148 -4.348 34.067 1.00 45.03 H new ATOM 0 HB2 LEU A 293 10.339 -4.013 36.600 1.00 45.61 H new ATOM 0 HB3 LEU A 293 8.917 -4.647 36.496 1.00 45.61 H new ATOM 0 HG LEU A 293 11.092 -5.748 35.068 1.00 46.70 H new ATOM 0 HD11 LEU A 293 11.381 -7.347 36.747 1.00 47.09 H new ATOM 0 HD12 LEU A 293 11.675 -5.894 37.304 1.00 47.09 H new ATOM 0 HD13 LEU A 293 10.298 -6.603 37.631 1.00 47.09 H new ATOM 0 HD21 LEU A 293 9.783 -7.692 34.920 1.00 47.74 H new ATOM 0 HD22 LEU A 293 8.626 -6.967 35.722 1.00 47.74 H new ATOM 0 HD23 LEU A 293 9.023 -6.461 34.274 1.00 47.74 H new ATOM 714 N SER A 294 8.802 -1.518 35.474 1.00 45.42 N ATOM 715 CA SER A 294 7.807 -0.485 35.759 1.00 46.68 C ATOM 716 C SER A 294 7.367 0.227 34.475 1.00 46.84 C ATOM 717 O SER A 294 6.195 0.573 34.301 1.00 47.42 O ATOM 718 CB SER A 294 8.348 0.519 36.776 1.00 47.27 C ATOM 719 OG SER A 294 8.994 1.581 36.113 1.00 48.27 O ATOM 0 H SER A 294 9.611 -1.313 35.679 1.00 45.42 H new ATOM 0 HA SER A 294 7.028 -0.918 36.142 1.00 46.68 H new ATOM 0 HB2 SER A 294 7.622 0.862 37.320 1.00 47.27 H new ATOM 0 HB3 SER A 294 8.969 0.078 37.377 1.00 47.27 H new ATOM 0 HG SER A 294 9.287 2.128 36.679 1.00 48.27 H new ATOM 720 N THR A 295 8.321 0.434 33.578 1.00 46.08 N ATOM 721 CA THR A 295 8.034 0.889 32.230 1.00 46.41 C ATOM 722 C THR A 295 6.971 0.014 31.527 1.00 46.08 C ATOM 723 O THR A 295 6.084 0.537 30.856 1.00 45.31 O ATOM 724 CB THR A 295 9.359 0.962 31.425 1.00 47.29 C ATOM 725 OG1 THR A 295 9.823 2.321 31.384 1.00 48.41 O ATOM 726 CG2 THR A 295 9.191 0.443 30.044 1.00 46.90 C ATOM 0 H THR A 295 9.158 0.313 33.737 1.00 46.08 H new ATOM 0 HA THR A 295 7.646 1.777 32.278 1.00 46.41 H new ATOM 0 HB THR A 295 10.014 0.403 31.872 1.00 47.29 H new ATOM 0 HG1 THR A 295 10.541 2.359 30.949 1.00 48.41 H new ATOM 0 HG21 THR A 295 10.035 0.503 29.571 1.00 46.90 H new ATOM 0 HG22 THR A 295 8.906 -0.483 30.079 1.00 46.90 H new ATOM 0 HG23 THR A 295 8.522 0.970 29.579 1.00 46.90 H new ATOM 727 N GLU A 296 7.055 -1.307 31.696 1.00 46.16 N ATOM 728 CA GLU A 296 6.053 -2.229 31.147 1.00 47.38 C ATOM 729 C GLU A 296 4.703 -2.075 31.824 1.00 48.11 C ATOM 730 O GLU A 296 3.670 -2.102 31.169 1.00 47.42 O ATOM 731 CB GLU A 296 6.497 -3.691 31.288 1.00 47.56 C ATOM 732 CG GLU A 296 7.555 -4.108 30.308 1.00 48.00 C ATOM 733 CD GLU A 296 7.151 -3.816 28.883 1.00 49.03 C ATOM 734 OE1 GLU A 296 8.003 -3.300 28.139 1.00 48.47 O ATOM 735 OE2 GLU A 296 5.978 -4.091 28.517 1.00 49.86 O ATOM 0 H GLU A 296 7.690 -1.693 32.129 1.00 46.16 H new ATOM 0 HA GLU A 296 5.968 -1.999 30.208 1.00 47.38 H new ATOM 0 HB2 GLU A 296 6.830 -3.832 32.188 1.00 47.56 H new ATOM 0 HB3 GLU A 296 5.723 -4.266 31.178 1.00 47.56 H new ATOM 0 HG2 GLU A 296 8.383 -3.645 30.510 1.00 48.00 H new ATOM 0 HG3 GLU A 296 7.730 -5.057 30.406 1.00 48.00 H new ATOM 736 N ARG A 297 4.725 -1.933 33.147 1.00 49.21 N ATOM 737 CA ARG A 297 3.506 -1.746 33.917 1.00 50.52 C ATOM 738 C ARG A 297 2.775 -0.459 33.530 1.00 50.34 C ATOM 739 O ARG A 297 1.561 -0.468 33.363 1.00 50.47 O ATOM 740 CB ARG A 297 3.814 -1.778 35.419 1.00 51.86 C ATOM 741 CG ARG A 297 4.262 -3.147 35.905 1.00 53.56 C ATOM 742 CD ARG A 297 4.238 -3.240 37.426 1.00 55.66 C ATOM 743 NE ARG A 297 5.576 -3.242 38.018 1.00 56.94 N ATOM 744 CZ ARG A 297 6.232 -4.349 38.361 1.00 57.86 C ATOM 745 NH1 ARG A 297 5.676 -5.537 38.165 1.00 57.89 N ATOM 746 NH2 ARG A 297 7.445 -4.274 38.904 1.00 58.43 N ATOM 0 H ARG A 297 5.444 -1.943 33.618 1.00 49.21 H new ATOM 0 HA ARG A 297 2.909 -2.481 33.708 1.00 50.52 H new ATOM 0 HB2 ARG A 297 4.507 -1.128 35.616 1.00 51.86 H new ATOM 0 HB3 ARG A 297 3.023 -1.508 35.912 1.00 51.86 H new ATOM 0 HG2 ARG A 297 3.684 -3.829 35.530 1.00 53.56 H new ATOM 0 HG3 ARG A 297 5.159 -3.327 35.584 1.00 53.56 H new ATOM 0 HD2 ARG A 297 3.733 -2.493 37.783 1.00 55.66 H new ATOM 0 HD3 ARG A 297 3.772 -4.049 37.689 1.00 55.66 H new ATOM 0 HE ARG A 297 5.961 -2.485 38.152 1.00 56.94 H new ATOM 0 HH11 ARG A 297 4.892 -5.592 37.816 1.00 57.89 H new ATOM 0 HH12 ARG A 297 6.100 -6.252 38.387 1.00 57.89 H new ATOM 0 HH21 ARG A 297 7.811 -3.507 39.036 1.00 58.43 H new ATOM 0 HH22 ARG A 297 7.863 -4.993 39.123 1.00 58.43 H new ATOM 747 N ASP A 298 3.516 0.636 33.378 1.00 50.34 N ATOM 748 CA ASP A 298 2.939 1.916 32.950 1.00 50.57 C ATOM 749 C ASP A 298 2.337 1.809 31.549 1.00 49.56 C ATOM 750 O ASP A 298 1.203 2.223 31.302 1.00 50.31 O ATOM 751 CB ASP A 298 4.005 3.014 32.953 1.00 51.80 C ATOM 752 CG ASP A 298 4.478 3.382 34.352 1.00 53.38 C ATOM 753 OD1 ASP A 298 3.794 3.050 35.349 1.00 53.59 O ATOM 754 OD2 ASP A 298 5.540 4.031 34.452 1.00 54.37 O ATOM 0 H ASP A 298 4.364 0.661 33.519 1.00 50.34 H new ATOM 0 HA ASP A 298 2.236 2.143 33.579 1.00 50.57 H new ATOM 0 HB2 ASP A 298 4.765 2.721 32.427 1.00 51.80 H new ATOM 0 HB3 ASP A 298 3.648 3.805 32.519 1.00 51.80 H new ATOM 755 N TYR A 299 3.120 1.248 30.640 1.00 48.04 N ATOM 756 CA TYR A 299 2.731 1.064 29.251 1.00 46.73 C ATOM 757 C TYR A 299 1.467 0.212 29.104 1.00 46.82 C ATOM 758 O TYR A 299 0.600 0.517 28.300 1.00 46.47 O ATOM 759 CB TYR A 299 3.899 0.443 28.488 1.00 44.49 C ATOM 760 CG TYR A 299 3.610 0.149 27.039 1.00 44.13 C ATOM 761 CD1 TYR A 299 3.081 1.124 26.206 1.00 43.71 C ATOM 762 CD2 TYR A 299 3.888 -1.097 26.495 1.00 43.52 C ATOM 763 CE1 TYR A 299 2.819 0.865 24.875 1.00 43.67 C ATOM 764 CE2 TYR A 299 3.638 -1.360 25.161 1.00 43.78 C ATOM 765 CZ TYR A 299 3.100 -0.375 24.360 1.00 43.59 C ATOM 766 OH TYR A 299 2.842 -0.628 23.038 1.00 43.96 O ATOM 0 H TYR A 299 3.910 0.957 30.817 1.00 48.04 H new ATOM 0 HA TYR A 299 2.516 1.933 28.877 1.00 46.73 H new ATOM 0 HB2 TYR A 299 4.660 1.042 28.540 1.00 44.49 H new ATOM 0 HB3 TYR A 299 4.157 -0.382 28.929 1.00 44.49 H new ATOM 0 HD1 TYR A 299 2.899 1.968 26.551 1.00 43.71 H new ATOM 0 HD2 TYR A 299 4.247 -1.764 27.035 1.00 43.52 H new ATOM 0 HE1 TYR A 299 2.455 1.526 24.332 1.00 43.67 H new ATOM 0 HE2 TYR A 299 3.832 -2.197 24.806 1.00 43.78 H new ATOM 0 HH TYR A 299 3.272 -1.307 22.793 1.00 43.96 H new ATOM 767 N ILE A 300 1.368 -0.850 29.892 1.00 47.71 N ATOM 768 CA ILE A 300 0.161 -1.677 29.932 1.00 49.38 C ATOM 769 C ILE A 300 -1.086 -0.873 30.327 1.00 49.86 C ATOM 770 O ILE A 300 -2.164 -1.077 29.772 1.00 49.66 O ATOM 771 CB ILE A 300 0.342 -2.885 30.887 1.00 50.08 C ATOM 772 CG1 ILE A 300 1.246 -3.936 30.242 1.00 50.90 C ATOM 773 CG2 ILE A 300 -0.997 -3.533 31.222 1.00 50.24 C ATOM 774 CD1 ILE A 300 0.538 -4.762 29.181 1.00 51.13 C ATOM 0 H ILE A 300 1.994 -1.114 30.419 1.00 47.71 H new ATOM 0 HA ILE A 300 0.023 -2.007 29.030 1.00 49.38 H new ATOM 0 HB ILE A 300 0.745 -2.552 31.704 1.00 50.08 H new ATOM 0 HG12 ILE A 300 2.012 -3.495 29.843 1.00 50.90 H new ATOM 0 HG13 ILE A 300 1.587 -4.528 30.931 1.00 50.90 H new ATOM 0 HG21 ILE A 300 -0.853 -4.284 31.819 1.00 50.24 H new ATOM 0 HG22 ILE A 300 -1.573 -2.882 31.654 1.00 50.24 H new ATOM 0 HG23 ILE A 300 -1.418 -3.846 30.406 1.00 50.24 H new ATOM 0 HD11 ILE A 300 1.157 -5.409 28.808 1.00 51.13 H new ATOM 0 HD12 ILE A 300 -0.214 -5.227 29.581 1.00 51.13 H new ATOM 0 HD13 ILE A 300 0.218 -4.178 28.476 1.00 51.13 H new ATOM 775 N LYS A 301 -0.937 0.036 31.288 1.00 50.90 N ATOM 776 CA LYS A 301 -2.036 0.920 31.672 1.00 51.84 C ATOM 777 C LYS A 301 -2.424 1.871 30.539 1.00 51.24 C ATOM 778 O LYS A 301 -3.599 2.139 30.333 1.00 51.28 O ATOM 779 CB LYS A 301 -1.711 1.688 32.956 1.00 52.17 C ATOM 780 CG LYS A 301 -1.719 0.800 34.194 1.00 53.55 C ATOM 781 CD LYS A 301 -1.522 1.581 35.489 1.00 54.03 C ATOM 782 CE LYS A 301 -0.094 2.113 35.610 1.00 55.38 C ATOM 783 NZ LYS A 301 0.326 2.230 37.045 1.00 56.11 N ATOM 0 H LYS A 301 -0.209 0.157 31.730 1.00 50.90 H new ATOM 0 HA LYS A 301 -2.806 0.358 31.851 1.00 51.84 H new ATOM 0 HB2 LYS A 301 -0.839 2.104 32.867 1.00 52.17 H new ATOM 0 HB3 LYS A 301 -2.356 2.403 33.072 1.00 52.17 H new ATOM 0 HG2 LYS A 301 -2.561 0.320 34.236 1.00 53.55 H new ATOM 0 HG3 LYS A 301 -1.017 0.135 34.113 1.00 53.55 H new ATOM 0 HD2 LYS A 301 -2.148 2.321 35.520 1.00 54.03 H new ATOM 0 HD3 LYS A 301 -1.721 1.009 36.247 1.00 54.03 H new ATOM 0 HE2 LYS A 301 0.514 1.521 35.140 1.00 55.38 H new ATOM 0 HE3 LYS A 301 -0.033 2.981 35.181 1.00 55.38 H new ATOM 0 HZ1 LYS A 301 1.159 2.541 37.086 1.00 56.11 H new ATOM 0 HZ2 LYS A 301 -0.221 2.789 37.470 1.00 56.11 H new ATOM 0 HZ3 LYS A 301 0.289 1.429 37.432 1.00 56.11 H new ATOM 784 N HIS A 302 -1.443 2.370 29.794 1.00 51.04 N ATOM 785 CA HIS A 302 -1.746 3.173 28.605 1.00 50.57 C ATOM 786 C HIS A 302 -2.557 2.382 27.575 1.00 49.85 C ATOM 787 O HIS A 302 -3.590 2.855 27.098 1.00 48.92 O ATOM 788 CB HIS A 302 -0.474 3.731 27.966 1.00 51.64 C ATOM 789 CG HIS A 302 0.277 4.680 28.847 1.00 52.91 C ATOM 790 ND1 HIS A 302 -0.336 5.713 29.520 1.00 53.87 N ATOM 791 CD2 HIS A 302 1.590 4.753 29.163 1.00 53.58 C ATOM 792 CE1 HIS A 302 0.569 6.385 30.211 1.00 54.16 C ATOM 793 NE2 HIS A 302 1.746 5.819 30.016 1.00 53.78 N ATOM 0 H HIS A 302 -0.605 2.260 29.953 1.00 51.04 H new ATOM 0 HA HIS A 302 -2.289 3.919 28.904 1.00 50.57 H new ATOM 0 HB2 HIS A 302 0.109 2.993 27.728 1.00 51.64 H new ATOM 0 HB3 HIS A 302 -0.708 4.185 27.141 1.00 51.64 H new ATOM 0 HD2 HIS A 302 2.262 4.187 28.859 1.00 53.58 H new ATOM 0 HE1 HIS A 302 0.405 7.129 30.744 1.00 54.16 H new ATOM 0 HE2 HIS A 302 2.489 6.076 30.366 1.00 53.78 H new ATOM 794 N LEU A 303 -2.090 1.180 27.244 1.00 49.17 N ATOM 795 CA LEU A 303 -2.784 0.316 26.288 1.00 49.26 C ATOM 796 C LEU A 303 -4.195 -0.030 26.750 1.00 49.81 C ATOM 797 O LEU A 303 -5.102 -0.151 25.929 1.00 49.79 O ATOM 798 CB LEU A 303 -2.005 -0.983 26.041 1.00 48.43 C ATOM 799 CG LEU A 303 -0.611 -0.928 25.413 1.00 48.19 C ATOM 800 CD1 LEU A 303 0.022 -2.315 25.436 1.00 47.54 C ATOM 801 CD2 LEU A 303 -0.665 -0.386 23.978 1.00 48.20 C ATOM 0 H LEU A 303 -1.367 0.843 27.564 1.00 49.17 H new ATOM 0 HA LEU A 303 -2.843 0.819 25.460 1.00 49.26 H new ATOM 0 HB2 LEU A 303 -1.920 -1.436 26.895 1.00 48.43 H new ATOM 0 HB3 LEU A 303 -2.555 -1.547 25.475 1.00 48.43 H new ATOM 0 HG LEU A 303 -0.066 -0.320 25.936 1.00 48.19 H new ATOM 0 HD11 LEU A 303 0.905 -2.275 25.037 1.00 47.54 H new ATOM 0 HD12 LEU A 303 0.096 -2.622 26.353 1.00 47.54 H new ATOM 0 HD13 LEU A 303 -0.532 -2.932 24.933 1.00 47.54 H new ATOM 0 HD21 LEU A 303 0.231 -0.363 23.607 1.00 48.20 H new ATOM 0 HD22 LEU A 303 -1.225 -0.963 23.435 1.00 48.20 H new ATOM 0 HD23 LEU A 303 -1.035 0.511 23.984 1.00 48.20 H new ATOM 802 N ARG A 304 -4.361 -0.214 28.059 1.00 50.64 N ATOM 803 CA ARG A 304 -5.665 -0.493 28.654 1.00 51.79 C ATOM 804 C ARG A 304 -6.610 0.685 28.496 1.00 51.37 C ATOM 805 O ARG A 304 -7.772 0.515 28.138 1.00 51.77 O ATOM 806 CB ARG A 304 -5.535 -0.858 30.144 1.00 52.21 C ATOM 807 CG ARG A 304 -6.892 -0.940 30.877 1.00 53.49 C ATOM 808 CD ARG A 304 -6.798 -1.518 32.295 1.00 54.33 C ATOM 809 NE ARG A 304 -6.198 -0.615 33.288 1.00 56.25 N ATOM 810 CZ ARG A 304 -6.262 0.718 33.259 1.00 57.03 C ATOM 811 NH1 ARG A 304 -6.921 1.345 32.289 1.00 56.96 N ATOM 812 NH2 ARG A 304 -5.667 1.432 34.213 1.00 57.15 N ATOM 0 H ARG A 304 -3.717 -0.180 28.628 1.00 50.64 H new ATOM 0 HA ARG A 304 -6.035 -1.253 28.179 1.00 51.79 H new ATOM 0 HB2 ARG A 304 -5.081 -1.711 30.222 1.00 52.21 H new ATOM 0 HB3 ARG A 304 -4.977 -0.198 30.584 1.00 52.21 H new ATOM 0 HG2 ARG A 304 -7.278 -0.052 30.924 1.00 53.49 H new ATOM 0 HG3 ARG A 304 -7.500 -1.486 30.354 1.00 53.49 H new ATOM 0 HD2 ARG A 304 -7.689 -1.760 32.592 1.00 54.33 H new ATOM 0 HD3 ARG A 304 -6.278 -2.336 32.264 1.00 54.33 H new ATOM 0 HE ARG A 304 -5.771 -0.975 33.941 1.00 56.25 H new ATOM 0 HH11 ARG A 304 -7.312 0.891 31.672 1.00 56.96 H new ATOM 0 HH12 ARG A 304 -6.957 2.204 32.279 1.00 56.96 H new ATOM 0 HH21 ARG A 304 -5.242 1.034 34.846 1.00 57.15 H new ATOM 0 HH22 ARG A 304 -5.707 2.291 34.196 1.00 57.15 H new ATOM 813 N ASP A 305 -6.107 1.880 28.774 1.00 51.31 N ATOM 814 CA ASP A 305 -6.901 3.090 28.657 1.00 51.66 C ATOM 815 C ASP A 305 -7.350 3.336 27.212 1.00 51.38 C ATOM 816 O ASP A 305 -8.492 3.718 26.969 1.00 51.26 O ATOM 817 CB ASP A 305 -6.125 4.285 29.221 1.00 52.21 C ATOM 818 CG ASP A 305 -6.016 4.238 30.739 1.00 52.80 C ATOM 819 OD1 ASP A 305 -6.553 3.292 31.346 1.00 53.31 O ATOM 820 OD2 ASP A 305 -5.390 5.136 31.332 1.00 53.59 O ATOM 0 H ASP A 305 -5.298 2.011 29.035 1.00 51.31 H new ATOM 0 HA ASP A 305 -7.709 2.976 29.182 1.00 51.66 H new ATOM 0 HB2 ASP A 305 -5.235 4.301 28.835 1.00 52.21 H new ATOM 0 HB3 ASP A 305 -6.565 5.108 28.956 1.00 52.21 H new ATOM 821 N ILE A 306 -6.455 3.089 26.260 1.00 50.73 N ATOM 822 CA ILE A 306 -6.790 3.199 24.841 1.00 50.18 C ATOM 823 C ILE A 306 -7.894 2.228 24.449 1.00 50.04 C ATOM 824 O ILE A 306 -8.913 2.626 23.880 1.00 49.75 O ATOM 825 CB ILE A 306 -5.571 2.926 23.949 1.00 49.67 C ATOM 826 CG1 ILE A 306 -4.544 4.051 24.092 1.00 49.82 C ATOM 827 CG2 ILE A 306 -5.994 2.766 22.494 1.00 49.26 C ATOM 828 CD1 ILE A 306 -3.171 3.703 23.512 1.00 49.13 C ATOM 0 H ILE A 306 -5.642 2.855 26.415 1.00 50.73 H new ATOM 0 HA ILE A 306 -7.094 4.110 24.706 1.00 50.18 H new ATOM 0 HB ILE A 306 -5.160 2.096 24.237 1.00 49.67 H new ATOM 0 HG12 ILE A 306 -4.882 4.846 23.650 1.00 49.82 H new ATOM 0 HG13 ILE A 306 -4.444 4.270 25.032 1.00 49.82 H new ATOM 0 HG21 ILE A 306 -5.212 2.594 21.946 1.00 49.26 H new ATOM 0 HG22 ILE A 306 -6.612 2.022 22.416 1.00 49.26 H new ATOM 0 HG23 ILE A 306 -6.428 3.579 22.192 1.00 49.26 H new ATOM 0 HD11 ILE A 306 -2.569 4.453 23.634 1.00 49.13 H new ATOM 0 HD12 ILE A 306 -2.814 2.925 23.969 1.00 49.13 H new ATOM 0 HD13 ILE A 306 -3.259 3.510 22.566 1.00 49.13 H new ATOM 829 N CYS A 307 -7.684 0.955 24.767 1.00 49.99 N ATOM 830 CA CYS A 307 -8.582 -0.108 24.330 1.00 50.14 C ATOM 831 C CYS A 307 -9.930 -0.100 25.050 1.00 50.26 C ATOM 832 O CYS A 307 -10.954 -0.312 24.420 1.00 50.22 O ATOM 833 CB CYS A 307 -7.902 -1.472 24.462 1.00 49.84 C ATOM 834 SG CYS A 307 -6.518 -1.701 23.320 1.00 49.77 S ATOM 0 H CYS A 307 -7.019 0.684 25.241 1.00 49.99 H new ATOM 0 HA CYS A 307 -8.776 0.064 23.395 1.00 50.14 H new ATOM 0 HB2 CYS A 307 -7.583 -1.580 25.372 1.00 49.84 H new ATOM 0 HB3 CYS A 307 -8.559 -2.169 24.307 1.00 49.84 H new ATOM 0 HG CYS A 307 -5.527 -1.211 23.788 1.00 49.77 H new ATOM 835 N GLU A 308 -9.919 0.139 26.361 1.00 51.14 N ATOM 836 CA GLU A 308 -11.147 0.183 27.163 1.00 52.08 C ATOM 837 C GLU A 308 -11.814 1.545 27.070 1.00 51.49 C ATOM 838 O GLU A 308 -13.032 1.638 26.969 1.00 52.19 O ATOM 839 CB GLU A 308 -10.854 -0.092 28.645 1.00 52.46 C ATOM 840 CG GLU A 308 -10.506 -1.525 29.005 1.00 53.77 C ATOM 841 CD GLU A 308 -10.304 -1.717 30.514 1.00 54.35 C ATOM 842 OE1 GLU A 308 -10.329 -0.708 31.263 1.00 55.28 O ATOM 843 OE2 GLU A 308 -10.117 -2.877 30.951 1.00 55.12 O ATOM 0 H GLU A 308 -9.201 0.280 26.812 1.00 51.14 H new ATOM 0 HA GLU A 308 -11.734 -0.502 26.807 1.00 52.08 H new ATOM 0 HB2 GLU A 308 -10.120 0.479 28.922 1.00 52.46 H new ATOM 0 HB3 GLU A 308 -11.630 0.173 29.163 1.00 52.46 H new ATOM 0 HG2 GLU A 308 -11.213 -2.114 28.699 1.00 53.77 H new ATOM 0 HG3 GLU A 308 -9.697 -1.786 28.537 1.00 53.77 H new ATOM 844 N GLY A 309 -11.007 2.600 27.133 1.00 50.84 N ATOM 845 CA GLY A 309 -11.510 3.963 27.213 1.00 50.27 C ATOM 846 C GLY A 309 -11.867 4.600 25.883 1.00 50.30 C ATOM 847 O GLY A 309 -12.782 5.421 25.811 1.00 49.49 O ATOM 0 H GLY A 309 -10.149 2.543 27.130 1.00 50.84 H new ATOM 0 HA2 GLY A 309 -12.297 3.969 27.780 1.00 50.27 H new ATOM 0 HA3 GLY A 309 -10.842 4.514 27.650 1.00 50.27 H new ATOM 848 N TYR A 310 -11.153 4.231 24.827 1.00 50.46 N ATOM 849 CA TYR A 310 -11.382 4.852 23.523 1.00 51.33 C ATOM 850 C TYR A 310 -11.989 3.907 22.503 1.00 51.14 C ATOM 851 O TYR A 310 -13.073 4.172 21.995 1.00 51.29 O ATOM 852 CB TYR A 310 -10.105 5.486 22.960 1.00 51.84 C ATOM 853 CG TYR A 310 -9.737 6.817 23.576 1.00 52.08 C ATOM 854 CD1 TYR A 310 -8.652 6.926 24.430 1.00 52.52 C ATOM 855 CD2 TYR A 310 -10.466 7.969 23.290 1.00 52.14 C ATOM 856 CE1 TYR A 310 -8.300 8.145 24.994 1.00 52.70 C ATOM 857 CE2 TYR A 310 -10.125 9.191 23.850 1.00 52.02 C ATOM 858 CZ TYR A 310 -9.041 9.272 24.703 1.00 52.50 C ATOM 859 OH TYR A 310 -8.681 10.477 25.268 1.00 52.35 O ATOM 0 H TYR A 310 -10.538 3.630 24.840 1.00 50.46 H new ATOM 0 HA TYR A 310 -12.033 5.552 23.686 1.00 51.33 H new ATOM 0 HB2 TYR A 310 -9.368 4.869 23.089 1.00 51.84 H new ATOM 0 HB3 TYR A 310 -10.212 5.605 22.003 1.00 51.84 H new ATOM 0 HD1 TYR A 310 -8.150 6.169 24.629 1.00 52.52 H new ATOM 0 HD2 TYR A 310 -11.194 7.918 22.714 1.00 52.14 H new ATOM 0 HE1 TYR A 310 -7.568 8.202 25.565 1.00 52.70 H new ATOM 0 HE2 TYR A 310 -10.623 9.951 23.653 1.00 52.02 H new ATOM 0 HH TYR A 310 -9.209 11.077 25.010 1.00 52.35 H new ATOM 860 N VAL A 311 -11.300 2.810 22.200 1.00 51.17 N ATOM 861 CA VAL A 311 -11.763 1.891 21.151 1.00 51.57 C ATOM 862 C VAL A 311 -13.162 1.352 21.419 1.00 52.05 C ATOM 863 O VAL A 311 -14.019 1.365 20.540 1.00 52.75 O ATOM 864 CB VAL A 311 -10.804 0.701 20.940 1.00 51.30 C ATOM 865 CG1 VAL A 311 -11.350 -0.228 19.847 1.00 51.47 C ATOM 866 CG2 VAL A 311 -9.427 1.192 20.571 1.00 50.87 C ATOM 0 H VAL A 311 -10.567 2.577 22.584 1.00 51.17 H new ATOM 0 HA VAL A 311 -11.782 2.427 20.343 1.00 51.57 H new ATOM 0 HB VAL A 311 -10.739 0.203 21.770 1.00 51.30 H new ATOM 0 HG11 VAL A 311 -10.741 -0.973 19.721 1.00 51.47 H new ATOM 0 HG12 VAL A 311 -12.220 -0.564 20.113 1.00 51.47 H new ATOM 0 HG13 VAL A 311 -11.434 0.265 19.016 1.00 51.47 H new ATOM 0 HG21 VAL A 311 -8.837 0.433 20.442 1.00 50.87 H new ATOM 0 HG22 VAL A 311 -9.476 1.707 19.750 1.00 50.87 H new ATOM 0 HG23 VAL A 311 -9.081 1.753 21.283 1.00 50.87 H new ATOM 867 N ARG A 312 -13.379 0.872 22.637 1.00 52.72 N ATOM 868 CA ARG A 312 -14.667 0.325 23.038 1.00 53.33 C ATOM 869 C ARG A 312 -15.821 1.291 22.790 1.00 52.58 C ATOM 870 O ARG A 312 -16.867 0.893 22.288 1.00 52.49 O ATOM 871 CB ARG A 312 -14.631 -0.069 24.515 1.00 54.49 C ATOM 872 CG ARG A 312 -15.974 -0.479 25.094 1.00 56.15 C ATOM 873 CD ARG A 312 -15.751 -1.404 26.273 1.00 57.61 C ATOM 874 NE ARG A 312 -14.492 -2.119 26.078 1.00 59.21 N ATOM 875 CZ ARG A 312 -14.141 -3.237 26.702 1.00 59.88 C ATOM 876 NH1 ARG A 312 -14.961 -3.808 27.582 1.00 59.95 N ATOM 877 NH2 ARG A 312 -12.963 -3.789 26.434 1.00 60.09 N ATOM 0 H ARG A 312 -12.782 0.854 23.256 1.00 52.72 H new ATOM 0 HA ARG A 312 -14.825 -0.458 22.488 1.00 53.33 H new ATOM 0 HB2 ARG A 312 -14.007 -0.803 24.626 1.00 54.49 H new ATOM 0 HB3 ARG A 312 -14.285 0.678 25.028 1.00 54.49 H new ATOM 0 HG2 ARG A 312 -16.470 0.306 25.375 1.00 56.15 H new ATOM 0 HG3 ARG A 312 -16.507 -0.924 24.417 1.00 56.15 H new ATOM 0 HD2 ARG A 312 -15.724 -0.896 27.099 1.00 57.61 H new ATOM 0 HD3 ARG A 312 -16.486 -2.032 26.351 1.00 57.61 H new ATOM 0 HE ARG A 312 -13.933 -1.789 25.514 1.00 59.21 H new ATOM 0 HH11 ARG A 312 -15.726 -3.453 27.751 1.00 59.95 H new ATOM 0 HH12 ARG A 312 -14.726 -4.532 27.982 1.00 59.95 H new ATOM 0 HH21 ARG A 312 -12.437 -3.422 25.861 1.00 60.09 H new ATOM 0 HH22 ARG A 312 -12.727 -4.513 26.833 1.00 60.09 H new ATOM 878 N GLN A 313 -15.633 2.557 23.144 1.00 51.78 N ATOM 879 CA GLN A 313 -16.698 3.545 22.996 1.00 51.00 C ATOM 880 C GLN A 313 -16.888 3.944 21.539 1.00 50.68 C ATOM 881 O GLN A 313 -18.020 4.124 21.082 1.00 50.12 O ATOM 882 CB GLN A 313 -16.425 4.779 23.856 1.00 50.88 C ATOM 883 CG GLN A 313 -16.182 4.475 25.327 1.00 51.14 C ATOM 884 CD GLN A 313 -17.457 4.271 26.141 1.00 52.18 C ATOM 885 OE1 GLN A 313 -18.585 4.311 25.621 1.00 52.42 O ATOM 886 NE2 GLN A 313 -17.278 4.061 27.441 1.00 52.41 N ATOM 0 H GLN A 313 -14.900 2.865 23.471 1.00 51.78 H new ATOM 0 HA GLN A 313 -17.520 3.133 23.304 1.00 51.00 H new ATOM 0 HB2 GLN A 313 -15.651 5.244 23.500 1.00 50.88 H new ATOM 0 HB3 GLN A 313 -17.179 5.385 23.782 1.00 50.88 H new ATOM 0 HG2 GLN A 313 -15.635 3.677 25.396 1.00 51.14 H new ATOM 0 HG3 GLN A 313 -15.673 5.203 25.718 1.00 51.14 H new ATOM 0 HE21 GLN A 313 -16.483 4.039 27.768 1.00 52.41 H new ATOM 0 HE22 GLN A 313 -17.957 3.947 27.956 1.00 52.41 H new ATOM 887 N CYS A 314 -15.778 4.080 20.814 1.00 50.36 N ATOM 888 CA CYS A 314 -15.818 4.412 19.394 1.00 50.34 C ATOM 889 C CYS A 314 -16.590 3.354 18.615 1.00 51.35 C ATOM 890 O CYS A 314 -17.380 3.677 17.726 1.00 52.09 O ATOM 891 CB CYS A 314 -14.404 4.551 18.822 1.00 49.28 C ATOM 892 SG CYS A 314 -13.509 6.016 19.383 1.00 48.01 S ATOM 0 H CYS A 314 -14.985 3.983 21.132 1.00 50.36 H new ATOM 0 HA CYS A 314 -16.273 5.264 19.303 1.00 50.34 H new ATOM 0 HB2 CYS A 314 -13.892 3.762 19.060 1.00 49.28 H new ATOM 0 HB3 CYS A 314 -14.460 4.571 17.854 1.00 49.28 H new ATOM 0 HG CYS A 314 -13.889 6.976 18.772 1.00 48.01 H new ATOM 893 N ARG A 315 -16.372 2.091 18.970 1.00 52.40 N ATOM 894 CA ARG A 315 -16.940 0.969 18.228 1.00 53.01 C ATOM 895 C ARG A 315 -18.426 0.815 18.509 1.00 53.19 C ATOM 896 O ARG A 315 -19.167 0.245 17.708 1.00 53.16 O ATOM 897 CB ARG A 315 -16.196 -0.323 18.557 1.00 53.52 C ATOM 898 CG ARG A 315 -16.553 -1.488 17.656 1.00 54.35 C ATOM 899 CD ARG A 315 -15.620 -2.656 17.904 1.00 54.63 C ATOM 900 NE ARG A 315 -14.361 -2.518 17.176 1.00 55.15 N ATOM 901 CZ ARG A 315 -13.171 -2.826 17.683 1.00 55.10 C ATOM 902 NH1 ARG A 315 -13.069 -3.259 18.932 1.00 54.86 N ATOM 903 NH2 ARG A 315 -12.079 -2.680 16.946 1.00 55.32 N ATOM 0 H ARG A 315 -15.892 1.861 19.646 1.00 52.40 H new ATOM 0 HA ARG A 315 -16.835 1.156 17.282 1.00 53.01 H new ATOM 0 HB2 ARG A 315 -15.242 -0.160 18.496 1.00 53.52 H new ATOM 0 HB3 ARG A 315 -16.384 -0.568 19.477 1.00 53.52 H new ATOM 0 HG2 ARG A 315 -17.470 -1.760 17.817 1.00 54.35 H new ATOM 0 HG3 ARG A 315 -16.498 -1.214 16.727 1.00 54.35 H new ATOM 0 HD2 ARG A 315 -15.437 -2.726 18.854 1.00 54.63 H new ATOM 0 HD3 ARG A 315 -16.057 -3.480 17.638 1.00 54.63 H new ATOM 0 HE ARG A 315 -14.391 -2.219 16.370 1.00 55.15 H new ATOM 0 HH11 ARG A 315 -13.774 -3.342 19.417 1.00 54.86 H new ATOM 0 HH12 ARG A 315 -12.298 -3.457 19.257 1.00 54.86 H new ATOM 0 HH21 ARG A 315 -12.140 -2.386 16.140 1.00 55.32 H new ATOM 0 HH22 ARG A 315 -11.309 -2.879 17.274 1.00 55.32 H new ATOM 904 N LYS A 316 -18.867 1.333 19.647 1.00 53.26 N ATOM 905 CA LYS A 316 -20.288 1.343 19.939 1.00 53.22 C ATOM 906 C LYS A 316 -20.988 2.420 19.125 1.00 52.82 C ATOM 907 O LYS A 316 -22.204 2.385 18.968 1.00 53.10 O ATOM 908 CB LYS A 316 -20.549 1.536 21.435 1.00 53.70 C ATOM 909 CG LYS A 316 -20.509 0.232 22.228 1.00 54.05 C ATOM 910 CD LYS A 316 -19.081 -0.221 22.420 1.00 54.35 C ATOM 911 CE LYS A 316 -18.926 -1.727 22.296 1.00 54.45 C ATOM 912 NZ LYS A 316 -17.490 -2.076 22.099 1.00 54.20 N ATOM 0 H LYS A 316 -18.366 1.679 20.255 1.00 53.26 H new ATOM 0 HA LYS A 316 -20.652 0.480 19.688 1.00 53.22 H new ATOM 0 HB2 LYS A 316 -19.888 2.147 21.796 1.00 53.70 H new ATOM 0 HB3 LYS A 316 -21.416 1.953 21.554 1.00 53.70 H new ATOM 0 HG2 LYS A 316 -20.934 0.358 23.091 1.00 54.05 H new ATOM 0 HG3 LYS A 316 -21.012 -0.453 21.761 1.00 54.05 H new ATOM 0 HD2 LYS A 316 -18.516 0.214 21.763 1.00 54.35 H new ATOM 0 HD3 LYS A 316 -18.770 0.062 23.294 1.00 54.35 H new ATOM 0 HE2 LYS A 316 -19.266 -2.162 23.094 1.00 54.45 H new ATOM 0 HE3 LYS A 316 -19.452 -2.054 21.549 1.00 54.45 H new ATOM 0 HZ1 LYS A 316 -17.389 -2.489 21.317 1.00 54.20 H new ATOM 0 HZ2 LYS A 316 -17.000 -1.333 22.107 1.00 54.20 H new ATOM 0 HZ3 LYS A 316 -17.222 -2.614 22.755 1.00 54.20 H new ATOM 913 N ARG A 317 -20.213 3.359 18.589 1.00 52.15 N ATOM 914 CA ARG A 317 -20.779 4.504 17.874 1.00 51.43 C ATOM 915 C ARG A 317 -20.588 4.414 16.358 1.00 51.49 C ATOM 916 O ARG A 317 -19.870 5.213 15.751 1.00 50.97 O ATOM 917 CB ARG A 317 -20.210 5.810 18.434 1.00 50.65 C ATOM 918 CG ARG A 317 -20.585 6.046 19.888 1.00 49.70 C ATOM 919 CD ARG A 317 -22.101 6.100 20.057 1.00 49.64 C ATOM 920 NE ARG A 317 -22.677 7.138 19.213 1.00 48.95 N ATOM 921 CZ ARG A 317 -22.867 8.393 19.598 1.00 48.79 C ATOM 922 NH1 ARG A 317 -22.554 8.765 20.833 1.00 49.08 N ATOM 923 NH2 ARG A 317 -23.376 9.274 18.754 1.00 48.24 N ATOM 0 H ARG A 317 -19.354 3.353 18.628 1.00 52.15 H new ATOM 0 HA ARG A 317 -21.738 4.491 18.022 1.00 51.43 H new ATOM 0 HB2 ARG A 317 -19.244 5.797 18.352 1.00 50.65 H new ATOM 0 HB3 ARG A 317 -20.530 6.552 17.898 1.00 50.65 H new ATOM 0 HG2 ARG A 317 -20.219 5.337 20.440 1.00 49.70 H new ATOM 0 HG3 ARG A 317 -20.191 6.877 20.197 1.00 49.70 H new ATOM 0 HD2 ARG A 317 -22.487 5.240 19.829 1.00 49.64 H new ATOM 0 HD3 ARG A 317 -22.322 6.273 20.986 1.00 49.64 H new ATOM 0 HE ARG A 317 -22.909 6.923 18.413 1.00 48.95 H new ATOM 0 HH11 ARG A 317 -22.227 8.192 21.385 1.00 49.08 H new ATOM 0 HH12 ARG A 317 -22.678 9.579 21.081 1.00 49.08 H new ATOM 0 HH21 ARG A 317 -23.584 9.034 17.955 1.00 48.24 H new ATOM 0 HH22 ARG A 317 -23.499 10.088 19.004 1.00 48.24 H new ATOM 924 N ALA A 318 -21.254 3.435 15.756 1.00 51.90 N ATOM 925 CA ALA A 318 -21.165 3.200 14.318 1.00 52.12 C ATOM 926 C ALA A 318 -21.553 4.438 13.524 1.00 52.19 C ATOM 927 O ALA A 318 -21.116 4.609 12.387 1.00 52.57 O ATOM 928 CB ALA A 318 -22.038 2.016 13.917 1.00 52.11 C ATOM 0 H ALA A 318 -21.771 2.887 16.170 1.00 51.90 H new ATOM 0 HA ALA A 318 -20.240 2.994 14.110 1.00 52.12 H new ATOM 0 HB1 ALA A 318 -21.969 1.872 12.960 1.00 52.11 H new ATOM 0 HB2 ALA A 318 -21.740 1.221 14.386 1.00 52.11 H new ATOM 0 HB3 ALA A 318 -22.961 2.201 14.150 1.00 52.11 H new ATOM 929 N ASP A 319 -22.372 5.299 14.123 1.00 51.97 N ATOM 930 CA ASP A 319 -22.794 6.536 13.469 1.00 51.86 C ATOM 931 C ASP A 319 -21.649 7.543 13.338 1.00 51.88 C ATOM 932 O ASP A 319 -21.638 8.365 12.427 1.00 51.90 O ATOM 933 CB ASP A 319 -23.978 7.171 14.206 1.00 51.70 C ATOM 934 CG ASP A 319 -23.644 7.547 15.641 1.00 51.70 C ATOM 935 OD1 ASP A 319 -23.117 6.696 16.382 1.00 51.43 O ATOM 936 OD2 ASP A 319 -23.917 8.698 16.029 1.00 51.84 O ATOM 0 H ASP A 319 -22.696 5.185 14.911 1.00 51.97 H new ATOM 0 HA ASP A 319 -23.075 6.296 12.572 1.00 51.86 H new ATOM 0 HB2 ASP A 319 -24.265 7.964 13.726 1.00 51.70 H new ATOM 0 HB3 ASP A 319 -24.725 6.552 14.203 1.00 51.70 H new ATOM 937 N MET A 320 -20.684 7.476 14.244 1.00 52.03 N ATOM 938 CA MET A 320 -19.560 8.405 14.202 1.00 52.37 C ATOM 939 C MET A 320 -18.285 7.774 13.650 1.00 51.88 C ATOM 940 O MET A 320 -17.454 8.460 13.054 1.00 51.43 O ATOM 941 CB MET A 320 -19.308 9.003 15.586 1.00 52.55 C ATOM 942 CG MET A 320 -20.255 10.138 15.922 1.00 53.16 C ATOM 943 SD MET A 320 -19.970 10.818 17.552 1.00 53.66 S ATOM 944 CE MET A 320 -18.348 11.545 17.342 1.00 54.01 C ATOM 0 H MET A 320 -20.659 6.906 14.887 1.00 52.03 H new ATOM 0 HA MET A 320 -19.807 9.113 13.587 1.00 52.37 H new ATOM 0 HB2 MET A 320 -19.396 8.306 16.255 1.00 52.55 H new ATOM 0 HB3 MET A 320 -18.395 9.326 15.632 1.00 52.55 H new ATOM 0 HG2 MET A 320 -20.158 10.841 15.261 1.00 53.16 H new ATOM 0 HG3 MET A 320 -21.169 9.819 15.864 1.00 53.16 H new ATOM 0 HE1 MET A 320 -18.242 12.284 17.961 1.00 54.01 H new ATOM 0 HE2 MET A 320 -17.668 10.876 17.519 1.00 54.01 H new ATOM 0 HE3 MET A 320 -18.254 11.869 16.433 1.00 54.01 H new ATOM 945 N PHE A 321 -18.141 6.467 13.845 1.00 51.78 N ATOM 946 CA PHE A 321 -16.922 5.769 13.469 1.00 52.19 C ATOM 947 C PHE A 321 -17.194 4.553 12.590 1.00 52.76 C ATOM 948 O PHE A 321 -17.831 3.594 13.021 1.00 52.45 O ATOM 949 CB PHE A 321 -16.133 5.358 14.721 1.00 52.13 C ATOM 950 CG PHE A 321 -15.607 6.524 15.515 1.00 52.04 C ATOM 951 CD1 PHE A 321 -16.307 7.008 16.604 1.00 51.99 C ATOM 952 CD2 PHE A 321 -14.419 7.146 15.157 1.00 51.94 C ATOM 953 CE1 PHE A 321 -15.829 8.085 17.330 1.00 52.24 C ATOM 954 CE2 PHE A 321 -13.938 8.228 15.875 1.00 51.83 C ATOM 955 CZ PHE A 321 -14.641 8.697 16.962 1.00 51.88 C ATOM 0 H PHE A 321 -18.744 5.965 14.197 1.00 51.78 H new ATOM 0 HA PHE A 321 -16.390 6.387 12.943 1.00 52.19 H new ATOM 0 HB2 PHE A 321 -16.704 4.820 15.291 1.00 52.13 H new ATOM 0 HB3 PHE A 321 -15.388 4.796 14.454 1.00 52.13 H new ATOM 0 HD1 PHE A 321 -17.108 6.606 16.852 1.00 51.99 H new ATOM 0 HD2 PHE A 321 -13.939 6.832 14.425 1.00 51.94 H new ATOM 0 HE1 PHE A 321 -16.305 8.398 18.065 1.00 52.24 H new ATOM 0 HE2 PHE A 321 -13.142 8.637 15.623 1.00 51.83 H new ATOM 0 HZ PHE A 321 -14.320 9.422 17.448 1.00 51.88 H new ATOM 956 N SER A 322 -16.709 4.604 11.353 1.00 53.81 N ATOM 957 CA SER A 322 -16.749 3.446 10.473 1.00 54.74 C ATOM 958 C SER A 322 -15.675 2.469 10.909 1.00 55.56 C ATOM 959 O SER A 322 -14.776 2.826 11.669 1.00 55.91 O ATOM 960 CB SER A 322 -16.508 3.855 9.017 1.00 54.62 C ATOM 961 OG SER A 322 -15.144 4.170 8.784 1.00 54.51 O ATOM 0 H SER A 322 -16.351 5.304 11.005 1.00 53.81 H new ATOM 0 HA SER A 322 -17.626 3.035 10.530 1.00 54.74 H new ATOM 0 HB2 SER A 322 -16.780 3.134 8.428 1.00 54.62 H new ATOM 0 HB3 SER A 322 -17.060 4.622 8.800 1.00 54.62 H new ATOM 0 HG SER A 322 -15.040 4.389 7.980 1.00 54.51 H new ATOM 962 N GLU A 323 -15.774 1.235 10.429 1.00 56.50 N ATOM 963 CA GLU A 323 -14.762 0.226 10.699 1.00 57.39 C ATOM 964 C GLU A 323 -13.421 0.666 10.102 1.00 57.37 C ATOM 965 O GLU A 323 -12.368 0.513 10.726 1.00 58.09 O ATOM 966 CB GLU A 323 -15.205 -1.120 10.119 1.00 58.29 C ATOM 967 CG GLU A 323 -14.422 -2.315 10.635 1.00 59.04 C ATOM 968 CD GLU A 323 -14.398 -2.390 12.147 1.00 59.37 C ATOM 969 OE1 GLU A 323 -15.475 -2.266 12.771 1.00 59.54 O ATOM 970 OE2 GLU A 323 -13.296 -2.576 12.711 1.00 59.74 O ATOM 0 H GLU A 323 -16.427 0.961 9.940 1.00 56.50 H new ATOM 0 HA GLU A 323 -14.651 0.124 11.657 1.00 57.39 H new ATOM 0 HB2 GLU A 323 -16.145 -1.252 10.319 1.00 58.29 H new ATOM 0 HB3 GLU A 323 -15.123 -1.086 9.153 1.00 58.29 H new ATOM 0 HG2 GLU A 323 -14.812 -3.130 10.281 1.00 59.04 H new ATOM 0 HG3 GLU A 323 -13.512 -2.268 10.303 1.00 59.04 H new ATOM 971 N GLU A 324 -13.485 1.229 8.898 1.00 57.19 N ATOM 972 CA GLU A 324 -12.332 1.788 8.192 1.00 56.76 C ATOM 973 C GLU A 324 -11.615 2.834 9.047 1.00 55.66 C ATOM 974 O GLU A 324 -10.391 2.799 9.192 1.00 54.97 O ATOM 975 CB GLU A 324 -12.799 2.387 6.853 1.00 57.22 C ATOM 976 CG GLU A 324 -11.901 3.465 6.250 1.00 57.97 C ATOM 977 CD GLU A 324 -12.565 4.215 5.089 1.00 58.43 C ATOM 978 OE1 GLU A 324 -13.750 3.940 4.771 1.00 58.99 O ATOM 979 OE2 GLU A 324 -11.896 5.088 4.488 1.00 58.94 O ATOM 0 H GLU A 324 -14.220 1.299 8.456 1.00 57.19 H new ATOM 0 HA GLU A 324 -11.693 1.079 8.016 1.00 56.76 H new ATOM 0 HB2 GLU A 324 -12.885 1.666 6.210 1.00 57.22 H new ATOM 0 HB3 GLU A 324 -13.685 2.762 6.979 1.00 57.22 H new ATOM 0 HG2 GLU A 324 -11.657 4.100 6.941 1.00 57.97 H new ATOM 0 HG3 GLU A 324 -11.079 3.056 5.937 1.00 57.97 H new ATOM 980 N GLN A 325 -12.392 3.747 9.623 1.00 54.78 N ATOM 981 CA GLN A 325 -11.868 4.765 10.522 1.00 54.32 C ATOM 982 C GLN A 325 -11.192 4.153 11.748 1.00 53.60 C ATOM 983 O GLN A 325 -10.116 4.590 12.154 1.00 52.62 O ATOM 984 CB GLN A 325 -12.985 5.704 10.976 1.00 54.91 C ATOM 985 CG GLN A 325 -13.325 6.797 9.985 1.00 55.77 C ATOM 986 CD GLN A 325 -14.400 7.718 10.508 1.00 56.06 C ATOM 987 OE1 GLN A 325 -15.446 7.265 10.972 1.00 56.41 O ATOM 988 NE2 GLN A 325 -14.149 9.020 10.442 1.00 56.40 N ATOM 0 H GLN A 325 -13.242 3.792 9.501 1.00 54.78 H new ATOM 0 HA GLN A 325 -11.201 5.265 10.026 1.00 54.32 H new ATOM 0 HB2 GLN A 325 -13.783 5.180 11.149 1.00 54.91 H new ATOM 0 HB3 GLN A 325 -12.727 6.114 11.817 1.00 54.91 H new ATOM 0 HG2 GLN A 325 -12.527 7.312 9.786 1.00 55.77 H new ATOM 0 HG3 GLN A 325 -13.620 6.397 9.152 1.00 55.77 H new ATOM 0 HE21 GLN A 325 -13.406 9.298 10.111 1.00 56.40 H new ATOM 0 HE22 GLN A 325 -14.730 9.585 10.731 1.00 56.40 H new ATOM 989 N LEU A 326 -11.834 3.148 12.337 1.00 53.17 N ATOM 990 CA LEU A 326 -11.282 2.475 13.513 1.00 52.87 C ATOM 991 C LEU A 326 -9.928 1.837 13.215 1.00 52.59 C ATOM 992 O LEU A 326 -9.010 1.935 14.024 1.00 53.36 O ATOM 993 CB LEU A 326 -12.256 1.428 14.054 1.00 52.56 C ATOM 994 CG LEU A 326 -13.547 1.944 14.688 1.00 52.46 C ATOM 995 CD1 LEU A 326 -14.556 0.813 14.879 1.00 51.84 C ATOM 996 CD2 LEU A 326 -13.248 2.636 15.999 1.00 52.10 C ATOM 0 H LEU A 326 -12.592 2.839 12.072 1.00 53.17 H new ATOM 0 HA LEU A 326 -11.148 3.153 14.194 1.00 52.87 H new ATOM 0 HB2 LEU A 326 -12.494 0.833 13.326 1.00 52.56 H new ATOM 0 HB3 LEU A 326 -11.788 0.894 14.715 1.00 52.56 H new ATOM 0 HG LEU A 326 -13.946 2.592 14.086 1.00 52.46 H new ATOM 0 HD11 LEU A 326 -15.365 1.165 15.282 1.00 51.84 H new ATOM 0 HD12 LEU A 326 -14.769 0.420 14.018 1.00 51.84 H new ATOM 0 HD13 LEU A 326 -14.176 0.134 15.458 1.00 51.84 H new ATOM 0 HD21 LEU A 326 -14.075 2.959 16.391 1.00 52.10 H new ATOM 0 HD22 LEU A 326 -12.825 2.009 16.607 1.00 52.10 H new ATOM 0 HD23 LEU A 326 -12.652 3.385 15.841 1.00 52.10 H new ATOM 997 N ARG A 327 -9.808 1.184 12.061 1.00 52.33 N ATOM 998 CA ARG A 327 -8.535 0.596 11.641 1.00 52.25 C ATOM 999 C ARG A 327 -7.474 1.678 11.425 1.00 51.55 C ATOM 1000 O ARG A 327 -6.326 1.517 11.836 1.00 51.82 O ATOM 1001 CB ARG A 327 -8.706 -0.236 10.365 1.00 53.54 C ATOM 1002 CG ARG A 327 -9.780 -1.325 10.445 1.00 55.08 C ATOM 1003 CD ARG A 327 -10.213 -1.780 9.052 1.00 56.04 C ATOM 1004 NE ARG A 327 -11.392 -2.647 9.076 1.00 57.16 N ATOM 1005 CZ ARG A 327 -11.351 -3.974 9.185 1.00 57.94 C ATOM 1006 NH1 ARG A 327 -10.184 -4.603 9.289 1.00 58.32 N ATOM 1007 NH2 ARG A 327 -12.478 -4.676 9.193 1.00 58.15 N ATOM 0 H ARG A 327 -10.453 1.069 11.504 1.00 52.33 H new ATOM 0 HA ARG A 327 -8.236 0.009 12.353 1.00 52.25 H new ATOM 0 HB2 ARG A 327 -8.923 0.361 9.632 1.00 53.54 H new ATOM 0 HB3 ARG A 327 -7.857 -0.653 10.150 1.00 53.54 H new ATOM 0 HG2 ARG A 327 -9.438 -2.084 10.944 1.00 55.08 H new ATOM 0 HG3 ARG A 327 -10.549 -0.989 10.931 1.00 55.08 H new ATOM 0 HD2 ARG A 327 -10.402 -1.000 8.506 1.00 56.04 H new ATOM 0 HD3 ARG A 327 -9.479 -2.252 8.628 1.00 56.04 H new ATOM 0 HE ARG A 327 -12.165 -2.274 9.016 1.00 57.16 H new ATOM 0 HH11 ARG A 327 -9.451 -4.153 9.286 1.00 58.32 H new ATOM 0 HH12 ARG A 327 -10.162 -5.460 9.359 1.00 58.32 H new ATOM 0 HH21 ARG A 327 -13.235 -4.274 9.128 1.00 58.15 H new ATOM 0 HH22 ARG A 327 -12.450 -5.533 9.263 1.00 58.15 H new ATOM 1008 N THR A 328 -7.870 2.784 10.800 1.00 50.54 N ATOM 1009 CA THR A 328 -6.964 3.910 10.534 1.00 50.08 C ATOM 1010 C THR A 328 -6.447 4.570 11.817 1.00 49.94 C ATOM 1011 O THR A 328 -5.244 4.789 11.979 1.00 50.40 O ATOM 1012 CB THR A 328 -7.646 4.974 9.641 1.00 50.08 C ATOM 1013 OG1 THR A 328 -8.047 4.367 8.407 1.00 49.76 O ATOM 1014 CG2 THR A 328 -6.704 6.134 9.344 1.00 49.79 C ATOM 0 H THR A 328 -8.672 2.907 10.516 1.00 50.54 H new ATOM 0 HA THR A 328 -6.201 3.537 10.066 1.00 50.08 H new ATOM 0 HB THR A 328 -8.418 5.321 10.116 1.00 50.08 H new ATOM 0 HG1 THR A 328 -8.725 3.888 8.537 1.00 49.76 H new ATOM 0 HG21 THR A 328 -7.157 6.784 8.784 1.00 49.79 H new ATOM 0 HG22 THR A 328 -6.437 6.555 10.176 1.00 49.79 H new ATOM 0 HG23 THR A 328 -5.918 5.803 8.883 1.00 49.79 H new ATOM 1015 N ILE A 329 -7.357 4.866 12.735 1.00 49.10 N ATOM 1016 CA ILE A 329 -6.999 5.561 13.961 1.00 48.43 C ATOM 1017 C ILE A 329 -6.218 4.690 14.945 1.00 48.39 C ATOM 1018 O ILE A 329 -5.169 5.091 15.434 1.00 48.08 O ATOM 1019 CB ILE A 329 -8.247 6.112 14.665 1.00 47.92 C ATOM 1020 CG1 ILE A 329 -8.951 7.135 13.769 1.00 47.60 C ATOM 1021 CG2 ILE A 329 -7.878 6.735 16.016 1.00 47.55 C ATOM 1022 CD1 ILE A 329 -10.353 7.471 14.226 1.00 47.60 C ATOM 0 H ILE A 329 -8.192 4.672 12.666 1.00 49.10 H new ATOM 0 HA ILE A 329 -6.420 6.289 13.687 1.00 48.43 H new ATOM 0 HB ILE A 329 -8.857 5.377 14.832 1.00 47.92 H new ATOM 0 HG12 ILE A 329 -8.423 7.948 13.742 1.00 47.60 H new ATOM 0 HG13 ILE A 329 -8.987 6.790 12.863 1.00 47.60 H new ATOM 0 HG21 ILE A 329 -8.678 7.077 16.444 1.00 47.55 H new ATOM 0 HG22 ILE A 329 -7.471 6.061 16.583 1.00 47.55 H new ATOM 0 HG23 ILE A 329 -7.251 7.462 15.877 1.00 47.55 H new ATOM 0 HD11 ILE A 329 -10.744 8.121 13.621 1.00 47.60 H new ATOM 0 HD12 ILE A 329 -10.894 6.666 14.229 1.00 47.60 H new ATOM 0 HD13 ILE A 329 -10.321 7.842 15.122 1.00 47.60 H new ATOM 1023 N PHE A 330 -6.737 3.499 15.224 1.00 48.33 N ATOM 1024 CA PHE A 330 -6.213 2.669 16.301 1.00 48.27 C ATOM 1025 C PHE A 330 -5.322 1.538 15.816 1.00 48.37 C ATOM 1026 O PHE A 330 -4.606 0.930 16.608 1.00 49.34 O ATOM 1027 CB PHE A 330 -7.363 2.108 17.136 1.00 48.17 C ATOM 1028 CG PHE A 330 -8.186 3.166 17.811 1.00 48.03 C ATOM 1029 CD1 PHE A 330 -9.457 3.485 17.340 1.00 47.87 C ATOM 1030 CD2 PHE A 330 -7.692 3.842 18.917 1.00 47.85 C ATOM 1031 CE1 PHE A 330 -10.216 4.454 17.964 1.00 47.89 C ATOM 1032 CE2 PHE A 330 -8.444 4.814 19.547 1.00 47.97 C ATOM 1033 CZ PHE A 330 -9.712 5.120 19.074 1.00 48.26 C ATOM 0 H PHE A 330 -7.398 3.152 14.797 1.00 48.33 H new ATOM 0 HA PHE A 330 -5.654 3.245 16.845 1.00 48.27 H new ATOM 0 HB2 PHE A 330 -7.939 1.577 16.564 1.00 48.17 H new ATOM 0 HB3 PHE A 330 -7.002 1.510 17.810 1.00 48.17 H new ATOM 0 HD1 PHE A 330 -9.798 3.041 16.598 1.00 47.87 H new ATOM 0 HD2 PHE A 330 -6.843 3.638 19.238 1.00 47.85 H new ATOM 0 HE1 PHE A 330 -11.064 4.661 17.642 1.00 47.89 H new ATOM 0 HE2 PHE A 330 -8.101 5.262 20.286 1.00 47.97 H new ATOM 0 HZ PHE A 330 -10.224 5.770 19.499 1.00 48.26 H new ATOM 1034 N GLY A 331 -5.359 1.262 14.519 1.00 47.95 N ATOM 1035 CA GLY A 331 -4.510 0.233 13.939 1.00 48.10 C ATOM 1036 C GLY A 331 -4.732 -1.126 14.572 1.00 47.92 C ATOM 1037 O GLY A 331 -5.870 -1.510 14.857 1.00 47.91 O ATOM 0 H GLY A 331 -5.871 1.662 13.956 1.00 47.95 H new ATOM 0 HA2 GLY A 331 -4.682 0.175 12.986 1.00 48.10 H new ATOM 0 HA3 GLY A 331 -3.580 0.488 14.044 1.00 48.10 H new ATOM 1038 N ASN A 332 -3.639 -1.852 14.793 1.00 47.53 N ATOM 1039 CA ASN A 332 -3.697 -3.156 15.436 1.00 47.97 C ATOM 1040 C ASN A 332 -3.457 -3.073 16.947 1.00 48.02 C ATOM 1041 O ASN A 332 -3.000 -4.036 17.559 1.00 48.61 O ATOM 1042 CB ASN A 332 -2.714 -4.139 14.767 1.00 47.98 C ATOM 1043 CG ASN A 332 -1.245 -3.749 14.970 1.00 48.08 C ATOM 1044 OD1 ASN A 332 -0.929 -2.604 15.276 1.00 47.74 O ATOM 1045 ND2 ASN A 332 -0.346 -4.712 14.793 1.00 48.28 N ATOM 0 H ASN A 332 -2.846 -1.601 14.574 1.00 47.53 H new ATOM 0 HA ASN A 332 -4.598 -3.495 15.316 1.00 47.97 H new ATOM 0 HB2 ASN A 332 -2.860 -5.028 15.126 1.00 47.98 H new ATOM 0 HB3 ASN A 332 -2.904 -4.182 13.817 1.00 47.98 H new ATOM 0 HD21 ASN A 332 0.491 -4.542 14.893 1.00 48.28 H new ATOM 0 HD22 ASN A 332 -0.602 -5.505 14.579 1.00 48.28 H new ATOM 1046 N ILE A 333 -3.788 -1.925 17.542 1.00 47.79 N ATOM 1047 CA ILE A 333 -3.508 -1.646 18.958 1.00 47.26 C ATOM 1048 C ILE A 333 -4.091 -2.676 19.926 1.00 47.67 C ATOM 1049 O ILE A 333 -3.511 -2.953 20.977 1.00 46.48 O ATOM 1050 CB ILE A 333 -4.008 -0.232 19.369 1.00 47.07 C ATOM 1051 CG1 ILE A 333 -3.303 0.251 20.638 1.00 46.98 C ATOM 1052 CG2 ILE A 333 -5.526 -0.217 19.557 1.00 46.19 C ATOM 1053 CD1 ILE A 333 -1.789 0.305 20.529 1.00 46.63 C ATOM 0 H ILE A 333 -4.184 -1.280 17.134 1.00 47.79 H new ATOM 0 HA ILE A 333 -2.542 -1.696 19.029 1.00 47.26 H new ATOM 0 HB ILE A 333 -3.788 0.379 18.649 1.00 47.07 H new ATOM 0 HG12 ILE A 333 -3.633 1.135 20.862 1.00 46.98 H new ATOM 0 HG13 ILE A 333 -3.543 -0.336 21.372 1.00 46.98 H new ATOM 0 HG21 ILE A 333 -5.812 0.674 19.812 1.00 46.19 H new ATOM 0 HG22 ILE A 333 -5.958 -0.469 18.726 1.00 46.19 H new ATOM 0 HG23 ILE A 333 -5.772 -0.847 20.252 1.00 46.19 H new ATOM 0 HD11 ILE A 333 -1.415 0.619 21.367 1.00 46.63 H new ATOM 0 HD12 ILE A 333 -1.447 -0.581 20.334 1.00 46.63 H new ATOM 0 HD13 ILE A 333 -1.537 0.912 19.816 1.00 46.63 H new ATOM 1054 N GLU A 334 -5.244 -3.232 19.578 1.00 48.51 N ATOM 1055 CA GLU A 334 -5.858 -4.264 20.405 1.00 49.95 C ATOM 1056 C GLU A 334 -5.043 -5.563 20.412 1.00 50.11 C ATOM 1057 O GLU A 334 -5.022 -6.261 21.417 1.00 49.95 O ATOM 1058 CB GLU A 334 -7.310 -4.523 19.970 1.00 50.77 C ATOM 1059 CG GLU A 334 -8.277 -3.390 20.313 1.00 50.97 C ATOM 1060 CD GLU A 334 -9.680 -3.610 19.766 1.00 51.09 C ATOM 1061 OE1 GLU A 334 -9.848 -3.733 18.535 1.00 51.19 O ATOM 1062 OE2 GLU A 334 -10.629 -3.642 20.574 1.00 52.40 O ATOM 0 H GLU A 334 -5.687 -3.028 18.870 1.00 48.51 H new ATOM 0 HA GLU A 334 -5.867 -3.932 21.316 1.00 49.95 H new ATOM 0 HB2 GLU A 334 -7.328 -4.672 19.012 1.00 50.77 H new ATOM 0 HB3 GLU A 334 -7.622 -5.340 20.390 1.00 50.77 H new ATOM 0 HG2 GLU A 334 -8.324 -3.294 21.277 1.00 50.97 H new ATOM 0 HG3 GLU A 334 -7.927 -2.557 19.962 1.00 50.97 H new ATOM 1063 N ASP A 335 -4.369 -5.884 19.302 1.00 50.47 N ATOM 1064 CA ASP A 335 -3.511 -7.079 19.244 1.00 50.84 C ATOM 1065 C ASP A 335 -2.250 -6.867 20.078 1.00 50.36 C ATOM 1066 O ASP A 335 -1.768 -7.775 20.759 1.00 50.63 O ATOM 1067 CB ASP A 335 -3.092 -7.401 17.804 1.00 52.01 C ATOM 1068 CG ASP A 335 -4.250 -7.845 16.925 1.00 53.42 C ATOM 1069 OD1 ASP A 335 -5.250 -8.387 17.443 1.00 53.94 O ATOM 1070 OD2 ASP A 335 -4.152 -7.662 15.693 1.00 54.39 O ATOM 0 H ASP A 335 -4.394 -5.427 18.574 1.00 50.47 H new ATOM 0 HA ASP A 335 -4.028 -7.820 19.597 1.00 50.84 H new ATOM 0 HB2 ASP A 335 -2.678 -6.616 17.411 1.00 52.01 H new ATOM 0 HB3 ASP A 335 -2.419 -8.099 17.818 1.00 52.01 H new ATOM 1071 N ILE A 336 -1.715 -5.656 19.990 1.00 49.27 N ATOM 1072 CA ILE A 336 -0.549 -5.242 20.751 1.00 48.86 C ATOM 1073 C ILE A 336 -0.820 -5.285 22.250 1.00 48.63 C ATOM 1074 O ILE A 336 0.041 -5.673 23.028 1.00 49.27 O ATOM 1075 CB ILE A 336 -0.129 -3.813 20.353 1.00 48.50 C ATOM 1076 CG1 ILE A 336 0.566 -3.836 18.992 1.00 48.38 C ATOM 1077 CG2 ILE A 336 0.754 -3.188 21.426 1.00 48.27 C ATOM 1078 CD1 ILE A 336 0.787 -2.461 18.398 1.00 48.74 C ATOM 0 H ILE A 336 -2.027 -5.041 19.476 1.00 49.27 H new ATOM 0 HA ILE A 336 0.168 -5.863 20.547 1.00 48.86 H new ATOM 0 HB ILE A 336 -0.922 -3.259 20.278 1.00 48.50 H new ATOM 0 HG12 ILE A 336 1.423 -4.282 19.083 1.00 48.38 H new ATOM 0 HG13 ILE A 336 0.035 -4.364 18.376 1.00 48.38 H new ATOM 0 HG21 ILE A 336 1.006 -2.291 21.156 1.00 48.27 H new ATOM 0 HG22 ILE A 336 0.266 -3.148 22.264 1.00 48.27 H new ATOM 0 HG23 ILE A 336 1.552 -3.727 21.543 1.00 48.27 H new ATOM 0 HD11 ILE A 336 1.230 -2.547 17.539 1.00 48.74 H new ATOM 0 HD12 ILE A 336 -0.068 -2.019 18.278 1.00 48.74 H new ATOM 0 HD13 ILE A 336 1.341 -1.935 18.996 1.00 48.74 H new ATOM 1079 N TYR A 337 -2.015 -4.864 22.643 1.00 48.12 N ATOM 1080 CA TYR A 337 -2.443 -4.922 24.031 1.00 48.25 C ATOM 1081 C TYR A 337 -2.492 -6.383 24.502 1.00 48.90 C ATOM 1082 O TYR A 337 -2.052 -6.707 25.603 1.00 48.17 O ATOM 1083 CB TYR A 337 -3.813 -4.249 24.172 1.00 47.37 C ATOM 1084 CG TYR A 337 -4.381 -4.237 25.576 1.00 46.94 C ATOM 1085 CD1 TYR A 337 -5.742 -4.406 25.798 1.00 46.73 C ATOM 1086 CD2 TYR A 337 -3.556 -4.047 26.673 1.00 46.75 C ATOM 1087 CE1 TYR A 337 -6.266 -4.395 27.089 1.00 47.07 C ATOM 1088 CE2 TYR A 337 -4.061 -4.026 27.956 1.00 46.87 C ATOM 1089 CZ TYR A 337 -5.409 -4.201 28.161 1.00 47.10 C ATOM 1090 OH TYR A 337 -5.883 -4.180 29.447 1.00 47.45 O ATOM 0 H TYR A 337 -2.603 -4.535 22.108 1.00 48.12 H new ATOM 0 HA TYR A 337 -1.808 -4.447 24.590 1.00 48.25 H new ATOM 0 HB2 TYR A 337 -3.742 -3.334 23.859 1.00 47.37 H new ATOM 0 HB3 TYR A 337 -4.442 -4.701 23.588 1.00 47.37 H new ATOM 0 HD1 TYR A 337 -6.312 -4.528 25.074 1.00 46.73 H new ATOM 0 HD2 TYR A 337 -2.643 -3.931 26.541 1.00 46.75 H new ATOM 0 HE1 TYR A 337 -7.177 -4.516 27.229 1.00 47.07 H new ATOM 0 HE2 TYR A 337 -3.492 -3.894 28.680 1.00 46.87 H new ATOM 0 HH TYR A 337 -5.245 -4.055 29.979 1.00 47.45 H new ATOM 1091 N ARG A 338 -3.014 -7.260 23.651 1.00 49.52 N ATOM 1092 CA ARG A 338 -3.077 -8.682 23.970 1.00 51.10 C ATOM 1093 C ARG A 338 -1.693 -9.325 24.144 1.00 51.06 C ATOM 1094 O ARG A 338 -1.454 -10.000 25.135 1.00 51.12 O ATOM 1095 CB ARG A 338 -3.892 -9.438 22.922 1.00 52.14 C ATOM 1096 CG ARG A 338 -3.720 -10.935 22.985 1.00 54.27 C ATOM 1097 CD ARG A 338 -4.248 -11.595 21.725 1.00 56.34 C ATOM 1098 NE ARG A 338 -3.314 -12.601 21.223 1.00 57.92 N ATOM 1099 CZ ARG A 338 -2.272 -12.324 20.444 1.00 58.79 C ATOM 1100 NH1 ARG A 338 -2.029 -11.066 20.080 1.00 59.21 N ATOM 1101 NH2 ARG A 338 -1.472 -13.302 20.028 1.00 59.03 N ATOM 0 H ARG A 338 -3.338 -7.052 22.882 1.00 49.52 H new ATOM 0 HA ARG A 338 -3.523 -8.749 24.829 1.00 51.10 H new ATOM 0 HB2 ARG A 338 -4.831 -9.223 23.037 1.00 52.14 H new ATOM 0 HB3 ARG A 338 -3.636 -9.128 22.039 1.00 52.14 H new ATOM 0 HG2 ARG A 338 -2.781 -11.152 23.099 1.00 54.27 H new ATOM 0 HG3 ARG A 338 -4.188 -11.286 23.759 1.00 54.27 H new ATOM 0 HD2 ARG A 338 -5.105 -12.010 21.909 1.00 56.34 H new ATOM 0 HD3 ARG A 338 -4.399 -10.922 21.043 1.00 56.34 H new ATOM 0 HE ARG A 338 -3.446 -13.421 21.445 1.00 57.92 H new ATOM 0 HH11 ARG A 338 -2.546 -10.433 20.349 1.00 59.21 H new ATOM 0 HH12 ARG A 338 -1.355 -10.887 19.576 1.00 59.21 H new ATOM 0 HH21 ARG A 338 -1.628 -14.114 20.263 1.00 59.03 H new ATOM 0 HH22 ARG A 338 -0.799 -13.122 19.524 1.00 59.03 H new ATOM 1102 N CYS A 339 -0.789 -9.121 23.188 1.00 50.89 N ATOM 1103 CA CYS A 339 0.563 -9.678 23.294 1.00 50.96 C ATOM 1104 C CYS A 339 1.312 -9.075 24.464 1.00 49.95 C ATOM 1105 O CYS A 339 2.079 -9.757 25.130 1.00 49.79 O ATOM 1106 CB CYS A 339 1.373 -9.420 22.022 1.00 51.66 C ATOM 1107 SG CYS A 339 0.701 -10.188 20.571 1.00 54.21 S ATOM 0 H CYS A 339 -0.935 -8.666 22.473 1.00 50.89 H new ATOM 0 HA CYS A 339 0.460 -10.633 23.426 1.00 50.96 H new ATOM 0 HB2 CYS A 339 1.429 -8.463 21.874 1.00 51.66 H new ATOM 0 HB3 CYS A 339 2.279 -9.740 22.156 1.00 51.66 H new ATOM 0 HG CYS A 339 -0.039 -9.422 20.018 1.00 54.21 H new ATOM 1108 N GLN A 340 1.096 -7.786 24.700 1.00 49.27 N ATOM 1109 CA GLN A 340 1.800 -7.082 25.765 1.00 48.67 C ATOM 1110 C GLN A 340 1.346 -7.537 27.156 1.00 48.04 C ATOM 1111 O GLN A 340 2.152 -7.604 28.078 1.00 47.83 O ATOM 1112 CB GLN A 340 1.641 -5.568 25.604 1.00 49.57 C ATOM 1113 CG GLN A 340 2.780 -4.744 26.189 1.00 50.90 C ATOM 1114 CD GLN A 340 4.069 -4.850 25.385 1.00 51.98 C ATOM 1115 OE1 GLN A 340 3.949 -5.082 24.078 1.00 52.65 O flip ATOM 1116 NE2 GLN A 340 5.160 -4.715 25.935 1.00 52.27 N flip ATOM 0 H GLN A 340 0.545 -7.300 24.254 1.00 49.27 H new ATOM 0 HA GLN A 340 2.741 -7.305 25.688 1.00 48.67 H new ATOM 0 HB2 GLN A 340 1.561 -5.362 24.660 1.00 49.57 H new ATOM 0 HB3 GLN A 340 0.811 -5.295 26.025 1.00 49.57 H new ATOM 0 HG2 GLN A 340 2.509 -3.814 26.234 1.00 50.90 H new ATOM 0 HG3 GLN A 340 2.948 -5.035 27.099 1.00 50.90 H new ATOM 0 HE21 GLN A 340 5.200 -4.566 26.781 1.00 52.27 H new ATOM 0 HE22 GLN A 340 5.884 -4.769 25.474 1.00 52.27 H new ATOM 1117 N LYS A 341 0.062 -7.847 27.316 1.00 47.21 N ATOM 1118 CA LYS A 341 -0.402 -8.431 28.573 1.00 47.49 C ATOM 1119 C LYS A 341 0.351 -9.733 28.891 1.00 47.14 C ATOM 1120 O LYS A 341 0.800 -9.950 30.021 1.00 46.82 O ATOM 1121 CB LYS A 341 -1.918 -8.667 28.551 1.00 47.87 C ATOM 1122 CG LYS A 341 -2.735 -7.446 28.985 1.00 48.16 C ATOM 1123 CD LYS A 341 -4.209 -7.773 29.103 1.00 48.53 C ATOM 1124 CE LYS A 341 -4.866 -7.950 27.744 1.00 48.60 C ATOM 1125 NZ LYS A 341 -6.315 -8.232 27.923 1.00 49.31 N ATOM 0 H LYS A 341 -0.548 -7.730 26.721 1.00 47.21 H new ATOM 0 HA LYS A 341 -0.211 -7.795 29.280 1.00 47.49 H new ATOM 0 HB2 LYS A 341 -2.185 -8.923 27.654 1.00 47.87 H new ATOM 0 HB3 LYS A 341 -2.130 -9.413 29.134 1.00 47.87 H new ATOM 0 HG2 LYS A 341 -2.406 -7.122 29.838 1.00 48.16 H new ATOM 0 HG3 LYS A 341 -2.612 -6.729 28.343 1.00 48.16 H new ATOM 0 HD2 LYS A 341 -4.318 -8.585 29.622 1.00 48.53 H new ATOM 0 HD3 LYS A 341 -4.659 -7.064 29.588 1.00 48.53 H new ATOM 0 HE2 LYS A 341 -4.747 -7.149 27.210 1.00 48.60 H new ATOM 0 HE3 LYS A 341 -4.443 -8.678 27.262 1.00 48.60 H new ATOM 0 HZ1 LYS A 341 -6.698 -8.335 27.126 1.00 49.31 H new ATOM 0 HZ2 LYS A 341 -6.416 -8.977 28.399 1.00 49.31 H new ATOM 0 HZ3 LYS A 341 -6.699 -7.553 28.351 1.00 49.31 H new ATOM 1126 N ALA A 342 0.502 -10.582 27.881 1.00 46.84 N ATOM 1127 CA ALA A 342 1.222 -11.843 28.024 1.00 46.51 C ATOM 1128 C ALA A 342 2.700 -11.608 28.329 1.00 46.80 C ATOM 1129 O ALA A 342 3.255 -12.204 29.255 1.00 47.08 O ATOM 1130 CB ALA A 342 1.064 -12.676 26.765 1.00 46.02 C ATOM 0 H ALA A 342 0.190 -10.443 27.092 1.00 46.84 H new ATOM 0 HA ALA A 342 0.841 -12.326 28.774 1.00 46.51 H new ATOM 0 HB1 ALA A 342 1.545 -13.512 26.867 1.00 46.02 H new ATOM 0 HB2 ALA A 342 0.124 -12.861 26.615 1.00 46.02 H new ATOM 0 HB3 ALA A 342 1.422 -12.188 26.007 1.00 46.02 H new ATOM 1131 N PHE A 343 3.321 -10.727 27.550 1.00 46.34 N ATOM 1132 CA PHE A 343 4.730 -10.394 27.692 1.00 46.65 C ATOM 1133 C PHE A 343 5.100 -9.927 29.100 1.00 47.27 C ATOM 1134 O PHE A 343 6.097 -10.372 29.670 1.00 47.02 O ATOM 1135 CB PHE A 343 5.126 -9.313 26.676 1.00 46.25 C ATOM 1136 CG PHE A 343 6.578 -8.912 26.755 1.00 46.48 C ATOM 1137 CD1 PHE A 343 7.584 -9.862 26.612 1.00 46.07 C ATOM 1138 CD2 PHE A 343 6.941 -7.587 26.975 1.00 46.23 C ATOM 1139 CE1 PHE A 343 8.926 -9.496 26.693 1.00 45.99 C ATOM 1140 CE2 PHE A 343 8.277 -7.218 27.050 1.00 45.94 C ATOM 1141 CZ PHE A 343 9.268 -8.169 26.913 1.00 45.93 C ATOM 0 H PHE A 343 2.927 -10.301 26.915 1.00 46.34 H new ATOM 0 HA PHE A 343 5.222 -11.213 27.522 1.00 46.65 H new ATOM 0 HB2 PHE A 343 4.936 -9.636 25.781 1.00 46.25 H new ATOM 0 HB3 PHE A 343 4.574 -8.528 26.818 1.00 46.25 H new ATOM 0 HD1 PHE A 343 7.358 -10.751 26.461 1.00 46.07 H new ATOM 0 HD2 PHE A 343 6.280 -6.940 27.073 1.00 46.23 H new ATOM 0 HE1 PHE A 343 9.591 -10.139 26.600 1.00 45.99 H new ATOM 0 HE2 PHE A 343 8.505 -6.328 27.193 1.00 45.94 H new ATOM 0 HZ PHE A 343 10.163 -7.921 26.968 1.00 45.93 H new ATOM 1142 N VAL A 344 4.305 -9.017 29.656 1.00 47.39 N ATOM 1143 CA VAL A 344 4.589 -8.496 30.990 1.00 46.93 C ATOM 1144 C VAL A 344 4.498 -9.604 32.037 1.00 46.44 C ATOM 1145 O VAL A 344 5.331 -9.677 32.941 1.00 46.31 O ATOM 1146 CB VAL A 344 3.666 -7.312 31.348 1.00 47.03 C ATOM 1147 CG1 VAL A 344 3.943 -6.816 32.752 1.00 46.93 C ATOM 1148 CG2 VAL A 344 3.865 -6.182 30.349 1.00 47.15 C ATOM 0 H VAL A 344 3.603 -8.691 29.282 1.00 47.39 H new ATOM 0 HA VAL A 344 5.499 -8.159 30.986 1.00 46.93 H new ATOM 0 HB VAL A 344 2.746 -7.618 31.309 1.00 47.03 H new ATOM 0 HG11 VAL A 344 3.353 -6.073 32.955 1.00 46.93 H new ATOM 0 HG12 VAL A 344 3.788 -7.534 33.385 1.00 46.93 H new ATOM 0 HG13 VAL A 344 4.865 -6.522 32.816 1.00 46.93 H new ATOM 0 HG21 VAL A 344 3.283 -5.441 30.578 1.00 47.15 H new ATOM 0 HG22 VAL A 344 4.789 -5.887 30.374 1.00 47.15 H new ATOM 0 HG23 VAL A 344 3.650 -6.497 29.457 1.00 47.15 H new ATOM 1149 N LYS A 345 3.499 -10.475 31.895 1.00 45.69 N ATOM 1150 CA LYS A 345 3.357 -11.641 32.763 1.00 44.95 C ATOM 1151 C LYS A 345 4.602 -12.525 32.716 1.00 45.60 C ATOM 1152 O LYS A 345 5.124 -12.950 33.757 1.00 46.56 O ATOM 1153 CB LYS A 345 2.123 -12.460 32.366 1.00 43.93 C ATOM 1154 CG LYS A 345 1.889 -13.694 33.216 1.00 43.48 C ATOM 1155 CD LYS A 345 1.823 -13.342 34.702 1.00 43.17 C ATOM 1156 CE LYS A 345 1.651 -14.578 35.556 1.00 42.43 C ATOM 1157 NZ LYS A 345 1.714 -14.252 37.001 1.00 42.52 N ATOM 0 H LYS A 345 2.887 -10.406 31.295 1.00 45.69 H new ATOM 0 HA LYS A 345 3.247 -11.318 33.671 1.00 44.95 H new ATOM 0 HB2 LYS A 345 1.340 -11.891 32.420 1.00 43.93 H new ATOM 0 HB3 LYS A 345 2.213 -12.732 31.439 1.00 43.93 H new ATOM 0 HG2 LYS A 345 1.062 -14.123 32.946 1.00 43.48 H new ATOM 0 HG3 LYS A 345 2.602 -14.333 33.065 1.00 43.48 H new ATOM 0 HD2 LYS A 345 2.634 -12.878 34.962 1.00 43.17 H new ATOM 0 HD3 LYS A 345 1.084 -12.733 34.859 1.00 43.17 H new ATOM 0 HE2 LYS A 345 0.799 -14.996 35.354 1.00 42.43 H new ATOM 0 HE3 LYS A 345 2.342 -15.222 35.338 1.00 42.43 H new ATOM 0 HZ1 LYS A 345 1.211 -14.827 37.457 1.00 42.52 H new ATOM 0 HZ2 LYS A 345 2.557 -14.308 37.282 1.00 42.52 H new ATOM 0 HZ3 LYS A 345 1.412 -13.425 37.132 1.00 42.52 H new ATOM 1158 N ALA A 346 5.070 -12.814 31.507 1.00 45.03 N ATOM 1159 CA ALA A 346 6.241 -13.656 31.333 1.00 45.28 C ATOM 1160 C ALA A 346 7.458 -12.973 31.950 1.00 45.66 C ATOM 1161 O ALA A 346 8.341 -13.617 32.511 1.00 45.13 O ATOM 1162 CB ALA A 346 6.469 -13.923 29.859 1.00 45.31 C ATOM 0 H ALA A 346 4.721 -12.530 30.774 1.00 45.03 H new ATOM 0 HA ALA A 346 6.099 -14.505 31.781 1.00 45.28 H new ATOM 0 HB1 ALA A 346 7.252 -14.485 29.749 1.00 45.31 H new ATOM 0 HB2 ALA A 346 5.694 -14.372 29.488 1.00 45.31 H new ATOM 0 HB3 ALA A 346 6.608 -13.082 29.395 1.00 45.31 H new ATOM 1163 N LEU A 347 7.476 -11.650 31.840 1.00 46.43 N ATOM 1164 CA LEU A 347 8.559 -10.819 32.332 1.00 47.33 C ATOM 1165 C LEU A 347 8.629 -10.855 33.852 1.00 47.99 C ATOM 1166 O LEU A 347 9.698 -11.044 34.427 1.00 47.65 O ATOM 1167 CB LEU A 347 8.318 -9.390 31.860 1.00 47.50 C ATOM 1168 CG LEU A 347 9.441 -8.493 31.372 1.00 47.77 C ATOM 1169 CD1 LEU A 347 10.488 -9.240 30.562 1.00 47.94 C ATOM 1170 CD2 LEU A 347 8.804 -7.387 30.561 1.00 48.34 C ATOM 0 H LEU A 347 6.843 -11.203 31.468 1.00 46.43 H new ATOM 0 HA LEU A 347 9.402 -11.154 31.988 1.00 47.33 H new ATOM 0 HB2 LEU A 347 7.670 -9.441 31.140 1.00 47.50 H new ATOM 0 HB3 LEU A 347 7.889 -8.924 32.594 1.00 47.50 H new ATOM 0 HG LEU A 347 9.922 -8.135 32.134 1.00 47.77 H new ATOM 0 HD11 LEU A 347 11.179 -8.622 30.277 1.00 47.94 H new ATOM 0 HD12 LEU A 347 10.884 -9.937 31.109 1.00 47.94 H new ATOM 0 HD13 LEU A 347 10.070 -9.639 29.783 1.00 47.94 H new ATOM 0 HD21 LEU A 347 9.493 -6.790 30.230 1.00 48.34 H new ATOM 0 HD22 LEU A 347 8.323 -7.771 29.812 1.00 48.34 H new ATOM 0 HD23 LEU A 347 8.187 -6.890 31.120 1.00 48.34 H new ATOM 1171 N GLU A 348 7.479 -10.678 34.496 1.00 48.92 N ATOM 1172 CA GLU A 348 7.404 -10.636 35.949 1.00 50.45 C ATOM 1173 C GLU A 348 7.723 -11.973 36.604 1.00 50.87 C ATOM 1174 O GLU A 348 8.192 -12.010 37.737 1.00 50.76 O ATOM 1175 CB GLU A 348 6.021 -10.170 36.398 1.00 51.62 C ATOM 1176 CG GLU A 348 5.734 -8.713 36.086 1.00 52.93 C ATOM 1177 CD GLU A 348 4.297 -8.345 36.379 1.00 54.19 C ATOM 1178 OE1 GLU A 348 4.001 -7.133 36.480 1.00 55.36 O ATOM 1179 OE2 GLU A 348 3.460 -9.268 36.504 1.00 53.93 O ATOM 0 H GLU A 348 6.721 -10.579 34.101 1.00 48.92 H new ATOM 0 HA GLU A 348 8.081 -10.004 36.237 1.00 50.45 H new ATOM 0 HB2 GLU A 348 5.348 -10.722 35.970 1.00 51.62 H new ATOM 0 HB3 GLU A 348 5.936 -10.310 37.354 1.00 51.62 H new ATOM 0 HG2 GLU A 348 6.325 -8.148 36.609 1.00 52.93 H new ATOM 0 HG3 GLU A 348 5.928 -8.539 35.152 1.00 52.93 H new ATOM 1180 N GLN A 349 7.456 -13.067 35.896 1.00 51.10 N ATOM 1181 CA GLN A 349 7.719 -14.399 36.430 1.00 51.44 C ATOM 1182 C GLN A 349 9.206 -14.691 36.444 1.00 51.98 C ATOM 1183 O GLN A 349 9.662 -15.600 37.134 1.00 51.70 O ATOM 1184 CB GLN A 349 6.981 -15.468 35.624 1.00 51.06 C ATOM 1185 CG GLN A 349 5.486 -15.408 35.781 1.00 50.74 C ATOM 1186 CD GLN A 349 5.063 -15.411 37.230 1.00 51.03 C ATOM 1187 OE1 GLN A 349 4.401 -14.486 37.694 1.00 51.39 O ATOM 1188 NE2 GLN A 349 5.450 -16.454 37.961 1.00 50.97 N ATOM 0 H GLN A 349 7.122 -13.059 35.104 1.00 51.10 H new ATOM 0 HA GLN A 349 7.391 -14.421 37.342 1.00 51.44 H new ATOM 0 HB2 GLN A 349 7.205 -15.368 34.686 1.00 51.06 H new ATOM 0 HB3 GLN A 349 7.294 -16.344 35.899 1.00 51.06 H new ATOM 0 HG2 GLN A 349 5.149 -14.607 35.349 1.00 50.74 H new ATOM 0 HG3 GLN A 349 5.084 -16.165 35.327 1.00 50.74 H new ATOM 0 HE21 GLN A 349 5.913 -17.083 37.601 1.00 50.97 H new ATOM 0 HE22 GLN A 349 5.237 -16.499 38.793 1.00 50.97 H new ATOM 1189 N ARG A 350 9.955 -13.911 35.677 1.00 52.97 N ATOM 1190 CA ARG A 350 11.400 -14.065 35.608 1.00 54.11 C ATOM 1191 C ARG A 350 12.114 -13.187 36.634 1.00 54.24 C ATOM 1192 O ARG A 350 13.301 -13.376 36.898 1.00 54.00 O ATOM 1193 CB ARG A 350 11.895 -13.779 34.189 1.00 54.82 C ATOM 1194 CG ARG A 350 11.509 -14.875 33.205 1.00 56.08 C ATOM 1195 CD ARG A 350 12.202 -14.711 31.874 1.00 57.01 C ATOM 1196 NE ARG A 350 12.928 -15.927 31.504 1.00 58.00 N ATOM 1197 CZ ARG A 350 12.547 -16.771 30.552 1.00 58.45 C ATOM 1198 NH1 ARG A 350 11.445 -16.533 29.854 1.00 58.87 N ATOM 1199 NH2 ARG A 350 13.272 -17.852 30.295 1.00 58.85 N ATOM 0 H ARG A 350 9.642 -13.280 35.184 1.00 52.97 H new ATOM 0 HA ARG A 350 11.614 -14.985 35.829 1.00 54.11 H new ATOM 0 HB2 ARG A 350 11.529 -12.933 33.886 1.00 54.82 H new ATOM 0 HB3 ARG A 350 12.860 -13.683 34.199 1.00 54.82 H new ATOM 0 HG2 ARG A 350 11.734 -15.740 33.581 1.00 56.08 H new ATOM 0 HG3 ARG A 350 10.548 -14.865 33.072 1.00 56.08 H new ATOM 0 HD2 ARG A 350 11.548 -14.500 31.189 1.00 57.01 H new ATOM 0 HD3 ARG A 350 12.818 -13.963 31.917 1.00 57.01 H new ATOM 0 HE ARG A 350 13.651 -16.107 31.933 1.00 58.00 H new ATOM 0 HH11 ARG A 350 10.976 -15.831 30.017 1.00 58.87 H new ATOM 0 HH12 ARG A 350 11.200 -17.080 29.238 1.00 58.87 H new ATOM 0 HH21 ARG A 350 13.989 -18.006 30.745 1.00 58.85 H new ATOM 0 HH22 ARG A 350 13.025 -18.399 29.679 1.00 58.85 H new ATOM 1200 N PHE A 351 11.374 -12.248 37.218 1.00 54.58 N ATOM 1201 CA PHE A 351 11.910 -11.330 38.217 1.00 55.56 C ATOM 1202 C PHE A 351 12.274 -12.046 39.520 1.00 56.43 C ATOM 1203 O PHE A 351 11.436 -12.699 40.138 1.00 56.11 O ATOM 1204 CB PHE A 351 10.909 -10.205 38.493 1.00 55.73 C ATOM 1205 CG PHE A 351 11.361 -9.230 39.546 1.00 56.02 C ATOM 1206 CD1 PHE A 351 12.350 -8.296 39.269 1.00 56.08 C ATOM 1207 CD2 PHE A 351 10.794 -9.242 40.813 1.00 56.04 C ATOM 1208 CE1 PHE A 351 12.767 -7.396 40.231 1.00 56.15 C ATOM 1209 CE2 PHE A 351 11.210 -8.344 41.784 1.00 56.19 C ATOM 1210 CZ PHE A 351 12.199 -7.421 41.491 1.00 56.17 C ATOM 0 H PHE A 351 10.541 -12.126 37.044 1.00 54.58 H new ATOM 0 HA PHE A 351 12.727 -10.952 37.855 1.00 55.56 H new ATOM 0 HB2 PHE A 351 10.743 -9.722 37.668 1.00 55.73 H new ATOM 0 HB3 PHE A 351 10.065 -10.596 38.768 1.00 55.73 H new ATOM 0 HD1 PHE A 351 12.737 -8.276 38.424 1.00 56.08 H new ATOM 0 HD2 PHE A 351 10.128 -9.859 41.013 1.00 56.04 H new ATOM 0 HE1 PHE A 351 13.429 -6.774 40.031 1.00 56.15 H new ATOM 0 HE2 PHE A 351 10.825 -8.362 42.631 1.00 56.19 H new ATOM 0 HZ PHE A 351 12.481 -6.819 42.141 1.00 56.17 H new ATOM 1211 N ASN A 352 13.531 -11.919 39.933 1.00 57.73 N ATOM 1212 CA ASN A 352 13.993 -12.559 41.165 1.00 59.22 C ATOM 1213 C ASN A 352 13.830 -11.626 42.363 1.00 60.39 C ATOM 1214 O ASN A 352 14.705 -10.809 42.635 1.00 60.40 O ATOM 1215 CB ASN A 352 15.451 -13.005 41.018 1.00 58.63 C ATOM 1216 CG ASN A 352 15.889 -13.947 42.123 1.00 58.38 C ATOM 1217 OD1 ASN A 352 15.679 -13.677 43.304 1.00 58.23 O ATOM 1218 ND2 ASN A 352 16.508 -15.057 41.741 1.00 57.80 N ATOM 0 H ASN A 352 14.133 -11.468 39.516 1.00 57.73 H new ATOM 0 HA ASN A 352 13.445 -13.343 41.324 1.00 59.22 H new ATOM 0 HB2 ASN A 352 15.566 -13.443 40.160 1.00 58.63 H new ATOM 0 HB3 ASN A 352 16.026 -12.224 41.017 1.00 58.63 H new ATOM 0 HD21 ASN A 352 16.780 -15.622 42.330 1.00 57.80 H new ATOM 0 HD22 ASN A 352 16.637 -15.211 40.905 1.00 57.80 H new ATOM 1219 N ARG A 353 12.704 -11.746 43.064 1.00 62.08 N ATOM 1220 CA ARG A 353 12.411 -10.890 44.216 1.00 63.64 C ATOM 1221 C ARG A 353 13.593 -10.849 45.178 1.00 64.09 C ATOM 1222 O ARG A 353 14.029 -9.775 45.603 1.00 64.42 O ATOM 1223 CB ARG A 353 11.163 -11.375 44.972 1.00 64.06 C ATOM 1224 CG ARG A 353 9.886 -11.494 44.140 1.00 64.48 C ATOM 1225 CD ARG A 353 8.639 -11.602 45.024 1.00 64.47 C ATOM 1226 NE ARG A 353 8.881 -12.373 46.246 1.00 65.28 N ATOM 1227 CZ ARG A 353 7.926 -12.921 46.998 1.00 65.22 C ATOM 1228 NH1 ARG A 353 6.650 -12.806 46.652 1.00 65.19 N ATOM 1229 NH2 ARG A 353 8.250 -13.599 48.092 1.00 65.17 N ATOM 0 H ARG A 353 12.091 -12.322 42.888 1.00 62.08 H new ATOM 0 HA ARG A 353 12.244 -9.998 43.873 1.00 63.64 H new ATOM 0 HB2 ARG A 353 11.358 -12.242 45.361 1.00 64.06 H new ATOM 0 HB3 ARG A 353 10.994 -10.766 45.708 1.00 64.06 H new ATOM 0 HG2 ARG A 353 9.805 -10.721 43.559 1.00 64.48 H new ATOM 0 HG3 ARG A 353 9.945 -12.274 43.567 1.00 64.48 H new ATOM 0 HD2 ARG A 353 8.337 -10.711 45.262 1.00 64.47 H new ATOM 0 HD3 ARG A 353 7.923 -12.019 44.519 1.00 64.47 H new ATOM 0 HE ARG A 353 9.697 -12.480 46.496 1.00 65.28 H new ATOM 0 HH11 ARG A 353 6.435 -12.376 45.939 1.00 65.19 H new ATOM 0 HH12 ARG A 353 6.038 -13.162 47.141 1.00 65.19 H new ATOM 0 HH21 ARG A 353 9.076 -13.685 48.316 1.00 65.17 H new ATOM 0 HH22 ARG A 353 7.634 -13.952 48.577 1.00 65.17 H new ATOM 1230 N GLU A 354 14.110 -12.028 45.512 1.00 64.42 N ATOM 1231 CA GLU A 354 15.186 -12.148 46.484 1.00 64.81 C ATOM 1232 C GLU A 354 16.420 -11.362 46.047 1.00 64.71 C ATOM 1233 O GLU A 354 16.986 -10.592 46.827 1.00 65.05 O ATOM 1234 CB GLU A 354 15.556 -13.621 46.721 1.00 65.32 C ATOM 1235 CG GLU A 354 14.422 -14.626 46.503 1.00 65.78 C ATOM 1236 CD GLU A 354 14.631 -15.488 45.264 1.00 66.11 C ATOM 1237 OE1 GLU A 354 15.746 -16.041 45.106 1.00 66.24 O ATOM 1238 OE2 GLU A 354 13.685 -15.618 44.452 1.00 65.94 O ATOM 0 H GLU A 354 13.847 -12.777 45.182 1.00 64.42 H new ATOM 0 HA GLU A 354 14.864 -11.772 47.318 1.00 64.81 H new ATOM 0 HB2 GLU A 354 16.291 -13.853 46.132 1.00 65.32 H new ATOM 0 HB3 GLU A 354 15.881 -13.715 47.630 1.00 65.32 H new ATOM 0 HG2 GLU A 354 14.348 -15.199 47.282 1.00 65.78 H new ATOM 0 HG3 GLU A 354 13.582 -14.148 46.422 1.00 65.78 H new ATOM 1239 N ARG A 355 16.830 -11.561 44.797 1.00 63.96 N ATOM 1240 CA ARG A 355 18.027 -10.926 44.261 1.00 63.19 C ATOM 1241 C ARG A 355 17.772 -10.462 42.828 1.00 61.73 C ATOM 1242 O ARG A 355 18.046 -11.195 41.876 1.00 61.91 O ATOM 1243 CB ARG A 355 19.200 -11.911 44.288 1.00 64.28 C ATOM 1244 CG ARG A 355 19.417 -12.638 45.618 1.00 65.69 C ATOM 1245 CD ARG A 355 20.479 -11.965 46.496 1.00 66.87 C ATOM 1246 NE ARG A 355 19.936 -10.896 47.338 1.00 67.85 N ATOM 1247 CZ ARG A 355 19.983 -9.598 47.040 1.00 68.16 C ATOM 1248 NH1 ARG A 355 20.546 -9.189 45.912 1.00 68.16 N ATOM 1249 NH2 ARG A 355 19.463 -8.703 47.872 1.00 68.31 N ATOM 0 H ARG A 355 16.421 -12.069 44.237 1.00 63.96 H new ATOM 0 HA ARG A 355 18.248 -10.157 44.809 1.00 63.19 H new ATOM 0 HB2 ARG A 355 19.062 -12.574 43.593 1.00 64.28 H new ATOM 0 HB3 ARG A 355 20.012 -11.430 44.064 1.00 64.28 H new ATOM 0 HG2 ARG A 355 18.578 -12.674 46.103 1.00 65.69 H new ATOM 0 HG3 ARG A 355 19.682 -13.554 45.442 1.00 65.69 H new ATOM 0 HD2 ARG A 355 20.895 -12.635 47.061 1.00 66.87 H new ATOM 0 HD3 ARG A 355 21.176 -11.600 45.929 1.00 66.87 H new ATOM 0 HE ARG A 355 19.560 -11.122 48.078 1.00 67.85 H new ATOM 0 HH11 ARG A 355 20.884 -9.763 45.367 1.00 68.16 H new ATOM 0 HH12 ARG A 355 20.574 -8.350 45.725 1.00 68.16 H new ATOM 0 HH21 ARG A 355 19.095 -8.961 48.605 1.00 68.31 H new ATOM 0 HH22 ARG A 355 19.495 -7.866 47.678 1.00 68.31 H new ATOM 1250 N PRO A 356 17.242 -9.239 42.669 1.00 60.07 N ATOM 1251 CA PRO A 356 16.803 -8.724 41.364 1.00 58.71 C ATOM 1252 C PRO A 356 17.865 -8.796 40.258 1.00 57.15 C ATOM 1253 O PRO A 356 17.540 -9.128 39.119 1.00 56.86 O ATOM 1254 CB PRO A 356 16.420 -7.272 41.670 1.00 58.92 C ATOM 1255 CG PRO A 356 16.060 -7.287 43.128 1.00 59.46 C ATOM 1256 CD PRO A 356 17.010 -8.268 43.753 1.00 59.65 C ATOM 0 HA PRO A 356 16.079 -9.262 41.006 1.00 58.71 H new ATOM 0 HB2 PRO A 356 17.156 -6.666 41.493 1.00 58.92 H new ATOM 0 HB3 PRO A 356 15.674 -6.979 41.123 1.00 58.92 H new ATOM 0 HG2 PRO A 356 16.155 -6.406 43.522 1.00 59.46 H new ATOM 0 HG3 PRO A 356 15.138 -7.558 43.259 1.00 59.46 H new ATOM 0 HD2 PRO A 356 17.834 -7.841 44.035 1.00 59.65 H new ATOM 0 HD3 PRO A 356 16.626 -8.690 44.538 1.00 59.65 H new ATOM 1257 N HIS A 357 19.114 -8.493 40.598 1.00 55.12 N ATOM 1258 CA HIS A 357 20.229 -8.519 39.646 1.00 53.25 C ATOM 1259 C HIS A 357 20.381 -9.868 38.939 1.00 52.08 C ATOM 1260 O HIS A 357 20.969 -9.951 37.862 1.00 51.15 O ATOM 1261 CB HIS A 357 21.525 -8.181 40.375 1.00 52.84 C ATOM 1262 CG HIS A 357 21.692 -8.932 41.656 1.00 52.66 C ATOM 1263 ND1 HIS A 357 22.512 -10.033 41.775 1.00 52.58 N ATOM 1264 CD2 HIS A 357 21.113 -8.760 42.868 1.00 52.49 C ATOM 1265 CE1 HIS A 357 22.446 -10.496 43.010 1.00 52.67 C ATOM 1266 NE2 HIS A 357 21.600 -9.744 43.692 1.00 52.61 N ATOM 0 H HIS A 357 19.344 -8.264 41.395 1.00 55.12 H new ATOM 0 HA HIS A 357 20.035 -7.859 38.962 1.00 53.25 H new ATOM 0 HB2 HIS A 357 22.277 -8.374 39.793 1.00 52.84 H new ATOM 0 HB3 HIS A 357 21.547 -7.229 40.560 1.00 52.84 H new ATOM 0 HD1 HIS A 357 22.992 -10.366 41.144 1.00 52.58 H new ATOM 0 HD2 HIS A 357 20.500 -8.099 43.099 1.00 52.49 H new ATOM 0 HE1 HIS A 357 22.915 -11.227 43.343 1.00 52.67 H new ATOM 1267 N LEU A 358 19.846 -10.921 39.545 1.00 51.36 N ATOM 1268 CA LEU A 358 19.940 -12.255 38.958 1.00 51.02 C ATOM 1269 C LEU A 358 18.837 -12.548 37.935 1.00 50.42 C ATOM 1270 O LEU A 358 18.936 -13.518 37.189 1.00 50.56 O ATOM 1271 CB LEU A 358 19.958 -13.331 40.050 1.00 50.70 C ATOM 1272 CG LEU A 358 21.171 -13.359 40.988 1.00 50.87 C ATOM 1273 CD1 LEU A 358 20.946 -14.350 42.125 1.00 50.92 C ATOM 1274 CD2 LEU A 358 22.453 -13.696 40.236 1.00 50.73 C ATOM 0 H LEU A 358 19.425 -10.887 40.294 1.00 51.36 H new ATOM 0 HA LEU A 358 20.779 -12.277 38.472 1.00 51.02 H new ATOM 0 HB2 LEU A 358 19.161 -13.222 40.592 1.00 50.70 H new ATOM 0 HB3 LEU A 358 19.891 -14.197 39.619 1.00 50.70 H new ATOM 0 HG LEU A 358 21.272 -12.470 41.363 1.00 50.87 H new ATOM 0 HD11 LEU A 358 21.721 -14.355 42.708 1.00 50.92 H new ATOM 0 HD12 LEU A 358 20.162 -14.088 42.633 1.00 50.92 H new ATOM 0 HD13 LEU A 358 20.811 -15.238 41.759 1.00 50.92 H new ATOM 0 HD21 LEU A 358 23.199 -13.706 40.856 1.00 50.73 H new ATOM 0 HD22 LEU A 358 22.366 -14.569 39.822 1.00 50.73 H new ATOM 0 HD23 LEU A 358 22.611 -13.028 39.551 1.00 50.73 H new ATOM 1275 N SER A 359 17.792 -11.720 37.909 1.00 50.10 N ATOM 1276 CA SER A 359 16.686 -11.880 36.947 1.00 49.51 C ATOM 1277 C SER A 359 17.183 -12.078 35.518 1.00 49.38 C ATOM 1278 O SER A 359 18.099 -11.384 35.062 1.00 48.89 O ATOM 1279 CB SER A 359 15.751 -10.667 36.976 1.00 49.19 C ATOM 1280 OG SER A 359 15.068 -10.564 38.208 1.00 49.47 O ATOM 0 H SER A 359 17.700 -11.052 38.443 1.00 50.10 H new ATOM 0 HA SER A 359 16.205 -12.676 37.221 1.00 49.51 H new ATOM 0 HB2 SER A 359 16.264 -9.859 36.822 1.00 49.19 H new ATOM 0 HB3 SER A 359 15.107 -10.737 36.254 1.00 49.19 H new ATOM 0 HG SER A 359 15.556 -10.170 38.767 1.00 49.47 H new ATOM 1281 N GLU A 360 16.558 -13.018 34.816 1.00 49.18 N ATOM 1282 CA GLU A 360 16.928 -13.344 33.442 1.00 48.96 C ATOM 1283 C GLU A 360 15.855 -12.886 32.458 1.00 48.55 C ATOM 1284 O GLU A 360 14.835 -13.549 32.269 1.00 48.02 O ATOM 1285 CB GLU A 360 17.189 -14.845 33.315 1.00 49.54 C ATOM 1286 CG GLU A 360 18.343 -15.312 34.189 1.00 49.91 C ATOM 1287 CD GLU A 360 18.666 -16.782 34.020 1.00 50.14 C ATOM 1288 OE1 GLU A 360 18.106 -17.424 33.107 1.00 50.06 O ATOM 1289 OE2 GLU A 360 19.486 -17.295 34.808 1.00 50.32 O ATOM 0 H GLU A 360 15.906 -13.486 35.124 1.00 49.18 H new ATOM 0 HA GLU A 360 17.744 -12.868 33.220 1.00 48.96 H new ATOM 0 HB2 GLU A 360 16.386 -15.332 33.558 1.00 49.54 H new ATOM 0 HB3 GLU A 360 17.381 -15.060 32.389 1.00 49.54 H new ATOM 0 HG2 GLU A 360 19.132 -14.788 33.979 1.00 49.91 H new ATOM 0 HG3 GLU A 360 18.127 -15.140 35.119 1.00 49.91 H new ATOM 1290 N LEU A 361 16.104 -11.742 31.833 1.00 47.95 N ATOM 1291 CA LEU A 361 15.108 -11.062 31.023 1.00 47.53 C ATOM 1292 C LEU A 361 15.291 -11.302 29.530 1.00 47.08 C ATOM 1293 O LEU A 361 14.326 -11.274 28.773 1.00 46.37 O ATOM 1294 CB LEU A 361 15.124 -9.557 31.326 1.00 47.83 C ATOM 1295 CG LEU A 361 14.097 -9.017 32.332 1.00 47.92 C ATOM 1296 CD1 LEU A 361 13.805 -9.993 33.469 1.00 47.48 C ATOM 1297 CD2 LEU A 361 14.514 -7.663 32.867 1.00 47.54 C ATOM 0 H LEU A 361 16.862 -11.337 31.868 1.00 47.95 H new ATOM 0 HA LEU A 361 14.246 -11.437 31.261 1.00 47.53 H new ATOM 0 HB2 LEU A 361 16.009 -9.328 31.652 1.00 47.83 H new ATOM 0 HB3 LEU A 361 14.998 -9.083 30.489 1.00 47.83 H new ATOM 0 HG LEU A 361 13.266 -8.910 31.843 1.00 47.92 H new ATOM 0 HD11 LEU A 361 13.153 -9.602 34.072 1.00 47.48 H new ATOM 0 HD12 LEU A 361 13.453 -10.820 33.104 1.00 47.48 H new ATOM 0 HD13 LEU A 361 14.624 -10.178 33.955 1.00 47.48 H new ATOM 0 HD21 LEU A 361 13.850 -7.346 33.499 1.00 47.54 H new ATOM 0 HD22 LEU A 361 15.372 -7.741 33.313 1.00 47.54 H new ATOM 0 HD23 LEU A 361 14.588 -7.034 32.133 1.00 47.54 H new ATOM 1298 N GLY A 362 16.531 -11.545 29.117 1.00 47.02 N ATOM 1299 CA GLY A 362 16.864 -11.692 27.703 1.00 47.00 C ATOM 1300 C GLY A 362 16.050 -12.716 26.936 1.00 47.27 C ATOM 1301 O GLY A 362 15.478 -12.404 25.890 1.00 46.74 O ATOM 0 H GLY A 362 17.203 -11.629 29.648 1.00 47.02 H new ATOM 0 HA2 GLY A 362 16.757 -10.830 27.272 1.00 47.00 H new ATOM 0 HA3 GLY A 362 17.802 -11.930 27.632 1.00 47.00 H new ATOM 1302 N ALA A 363 16.005 -13.947 27.446 1.00 47.44 N ATOM 1303 CA ALA A 363 15.322 -15.039 26.752 1.00 47.35 C ATOM 1304 C ALA A 363 13.833 -14.750 26.605 1.00 47.58 C ATOM 1305 O ALA A 363 13.173 -15.261 25.697 1.00 47.59 O ATOM 1306 CB ALA A 363 15.540 -16.360 27.479 1.00 47.33 C ATOM 0 H ALA A 363 16.365 -14.171 28.194 1.00 47.44 H new ATOM 0 HA ALA A 363 15.704 -15.111 25.863 1.00 47.35 H new ATOM 0 HB1 ALA A 363 15.080 -17.070 27.005 1.00 47.33 H new ATOM 0 HB2 ALA A 363 16.489 -16.557 27.515 1.00 47.33 H new ATOM 0 HB3 ALA A 363 15.189 -16.295 28.381 1.00 47.33 H new ATOM 1307 N CYS A 364 13.310 -13.930 27.509 1.00 47.44 N ATOM 1308 CA CYS A 364 11.917 -13.527 27.452 1.00 47.66 C ATOM 1309 C CYS A 364 11.629 -12.674 26.218 1.00 47.27 C ATOM 1310 O CYS A 364 10.601 -12.844 25.553 1.00 47.14 O ATOM 1311 CB CYS A 364 11.533 -12.765 28.714 1.00 47.99 C ATOM 1312 SG CYS A 364 9.776 -12.625 28.884 1.00 47.88 S ATOM 0 H CYS A 364 13.751 -13.595 28.167 1.00 47.44 H new ATOM 0 HA CYS A 364 11.381 -14.333 27.390 1.00 47.66 H new ATOM 0 HB2 CYS A 364 11.899 -13.218 29.490 1.00 47.99 H new ATOM 0 HB3 CYS A 364 11.928 -11.879 28.691 1.00 47.99 H new ATOM 0 HG CYS A 364 9.386 -11.685 28.249 1.00 47.88 H new ATOM 1313 N PHE A 365 12.543 -11.759 25.922 1.00 47.04 N ATOM 1314 CA PHE A 365 12.481 -10.968 24.704 1.00 47.17 C ATOM 1315 C PHE A 365 12.604 -11.875 23.484 1.00 47.29 C ATOM 1316 O PHE A 365 11.812 -11.772 22.550 1.00 47.14 O ATOM 1317 CB PHE A 365 13.578 -9.889 24.696 1.00 47.17 C ATOM 1318 CG PHE A 365 13.244 -8.672 25.525 1.00 47.33 C ATOM 1319 CD1 PHE A 365 13.511 -8.647 26.889 1.00 47.36 C ATOM 1320 CD2 PHE A 365 12.656 -7.557 24.938 1.00 47.33 C ATOM 1321 CE1 PHE A 365 13.204 -7.527 27.656 1.00 47.43 C ATOM 1322 CE2 PHE A 365 12.337 -6.436 25.695 1.00 47.47 C ATOM 1323 CZ PHE A 365 12.615 -6.420 27.057 1.00 47.64 C ATOM 0 H PHE A 365 13.218 -11.580 26.424 1.00 47.04 H new ATOM 0 HA PHE A 365 11.622 -10.519 24.670 1.00 47.17 H new ATOM 0 HB2 PHE A 365 14.404 -10.277 25.025 1.00 47.17 H new ATOM 0 HB3 PHE A 365 13.740 -9.612 23.781 1.00 47.17 H new ATOM 0 HD1 PHE A 365 13.900 -9.388 27.294 1.00 47.36 H new ATOM 0 HD2 PHE A 365 12.474 -7.561 24.026 1.00 47.33 H new ATOM 0 HE1 PHE A 365 13.392 -7.519 28.567 1.00 47.43 H new ATOM 0 HE2 PHE A 365 11.939 -5.699 25.292 1.00 47.47 H new ATOM 0 HZ PHE A 365 12.407 -5.670 27.566 1.00 47.64 H new ATOM 1324 N LEU A 366 13.591 -12.770 23.508 1.00 47.33 N ATOM 1325 CA LEU A 366 13.796 -13.727 22.421 1.00 47.34 C ATOM 1326 C LEU A 366 12.531 -14.520 22.103 1.00 48.23 C ATOM 1327 O LEU A 366 12.184 -14.704 20.931 1.00 48.78 O ATOM 1328 CB LEU A 366 14.960 -14.676 22.743 1.00 46.73 C ATOM 1329 CG LEU A 366 16.352 -14.035 22.710 1.00 46.24 C ATOM 1330 CD1 LEU A 366 17.448 -15.045 23.037 1.00 46.09 C ATOM 1331 CD2 LEU A 366 16.604 -13.385 21.360 1.00 45.47 C ATOM 0 H LEU A 366 14.158 -12.839 24.151 1.00 47.33 H new ATOM 0 HA LEU A 366 14.020 -13.213 21.629 1.00 47.34 H new ATOM 0 HB2 LEU A 366 14.815 -15.055 23.624 1.00 46.73 H new ATOM 0 HB3 LEU A 366 14.943 -15.412 22.111 1.00 46.73 H new ATOM 0 HG LEU A 366 16.377 -13.350 23.396 1.00 46.24 H new ATOM 0 HD11 LEU A 366 18.312 -14.606 23.007 1.00 46.09 H new ATOM 0 HD12 LEU A 366 17.300 -15.407 23.925 1.00 46.09 H new ATOM 0 HD13 LEU A 366 17.429 -15.765 22.387 1.00 46.09 H new ATOM 0 HD21 LEU A 366 17.487 -12.984 21.354 1.00 45.47 H new ATOM 0 HD22 LEU A 366 16.549 -14.056 20.662 1.00 45.47 H new ATOM 0 HD23 LEU A 366 15.937 -12.699 21.201 1.00 45.47 H new ATOM 1332 N GLU A 367 11.845 -14.984 23.148 1.00 48.59 N ATOM 1333 CA GLU A 367 10.614 -15.768 22.996 1.00 49.08 C ATOM 1334 C GLU A 367 9.481 -14.994 22.314 1.00 49.30 C ATOM 1335 O GLU A 367 8.579 -15.596 21.732 1.00 49.37 O ATOM 1336 CB GLU A 367 10.135 -16.283 24.364 1.00 48.97 C ATOM 1337 CG GLU A 367 11.007 -17.392 24.954 1.00 49.19 C ATOM 1338 CD GLU A 367 10.847 -17.546 26.462 1.00 49.28 C ATOM 1339 OE1 GLU A 367 9.882 -16.986 27.029 1.00 49.09 O ATOM 1340 OE2 GLU A 367 11.694 -18.233 27.082 1.00 49.58 O ATOM 0 H GLU A 367 12.079 -14.854 23.965 1.00 48.59 H new ATOM 0 HA GLU A 367 10.838 -16.513 22.417 1.00 49.08 H new ATOM 0 HB2 GLU A 367 10.108 -15.540 24.987 1.00 48.97 H new ATOM 0 HB3 GLU A 367 9.227 -16.612 24.275 1.00 48.97 H new ATOM 0 HG2 GLU A 367 10.785 -18.233 24.524 1.00 49.19 H new ATOM 0 HG3 GLU A 367 11.937 -17.206 24.751 1.00 49.19 H new ATOM 1341 N HIS A 368 9.532 -13.667 22.389 1.00 49.77 N ATOM 1342 CA HIS A 368 8.447 -12.820 21.885 1.00 50.69 C ATOM 1343 C HIS A 368 8.830 -12.015 20.650 1.00 51.18 C ATOM 1344 O HIS A 368 8.142 -11.069 20.287 1.00 50.42 O ATOM 1345 CB HIS A 368 7.934 -11.896 22.991 1.00 50.44 C ATOM 1346 CG HIS A 368 7.313 -12.634 24.134 1.00 51.25 C ATOM 1347 ND1 HIS A 368 7.871 -13.255 25.201 1.00 51.09 N flip ATOM 1348 CD2 HIS A 368 5.953 -12.835 24.240 1.00 50.92 C flip ATOM 1349 CE1 HIS A 368 6.846 -13.804 25.933 1.00 51.15 C flip ATOM 1350 NE2 HIS A 368 5.699 -13.535 25.332 1.00 50.84 N flip ATOM 0 H HIS A 368 10.191 -13.232 22.731 1.00 49.77 H new ATOM 0 HA HIS A 368 7.737 -13.420 21.608 1.00 50.69 H new ATOM 0 HB2 HIS A 368 8.670 -11.358 23.323 1.00 50.44 H new ATOM 0 HB3 HIS A 368 7.282 -11.284 22.616 1.00 50.44 H new ATOM 0 HD1 HIS A 368 8.710 -13.298 25.386 1.00 51.09 H new ATOM 0 HD2 HIS A 368 5.315 -12.527 23.638 1.00 50.92 H new ATOM 0 HE1 HIS A 368 6.943 -14.286 26.722 1.00 51.15 H new ATOM 1351 N GLN A 369 9.918 -12.417 20.004 1.00 52.78 N ATOM 1352 CA GLN A 369 10.426 -11.742 18.811 1.00 54.92 C ATOM 1353 C GLN A 369 9.333 -11.484 17.774 1.00 55.93 C ATOM 1354 O GLN A 369 9.090 -10.341 17.394 1.00 56.12 O ATOM 1355 CB GLN A 369 11.544 -12.576 18.190 1.00 55.62 C ATOM 1356 CG GLN A 369 12.294 -11.899 17.063 1.00 56.66 C ATOM 1357 CD GLN A 369 12.913 -12.905 16.119 1.00 57.42 C ATOM 1358 OE1 GLN A 369 14.116 -13.182 16.188 1.00 57.79 O ATOM 1359 NE2 GLN A 369 12.087 -13.486 15.247 1.00 57.28 N ATOM 0 H GLN A 369 10.388 -13.095 20.246 1.00 52.78 H new ATOM 0 HA GLN A 369 10.766 -10.877 19.088 1.00 54.92 H new ATOM 0 HB2 GLN A 369 12.177 -12.813 18.886 1.00 55.62 H new ATOM 0 HB3 GLN A 369 11.165 -13.404 17.857 1.00 55.62 H new ATOM 0 HG2 GLN A 369 11.688 -11.323 16.571 1.00 56.66 H new ATOM 0 HG3 GLN A 369 12.988 -11.331 17.432 1.00 56.66 H new ATOM 0 HE21 GLN A 369 11.256 -13.266 15.230 1.00 57.28 H new ATOM 0 HE22 GLN A 369 12.386 -14.080 14.702 1.00 57.28 H new ATOM 1360 N ALA A 370 8.670 -12.550 17.331 1.00 57.08 N ATOM 1361 CA ALA A 370 7.653 -12.457 16.284 1.00 58.05 C ATOM 1362 C ALA A 370 6.493 -11.555 16.688 1.00 58.79 C ATOM 1363 O ALA A 370 5.866 -10.907 15.848 1.00 59.33 O ATOM 1364 CB ALA A 370 7.142 -13.846 15.913 1.00 58.30 C ATOM 0 H ALA A 370 8.796 -13.347 17.628 1.00 57.08 H new ATOM 0 HA ALA A 370 8.074 -12.055 15.508 1.00 58.05 H new ATOM 0 HB1 ALA A 370 6.469 -13.769 15.219 1.00 58.30 H new ATOM 0 HB2 ALA A 370 7.880 -14.387 15.589 1.00 58.30 H new ATOM 0 HB3 ALA A 370 6.752 -14.267 16.695 1.00 58.30 H new ATOM 1365 N ASP A 371 6.212 -11.519 17.984 1.00 59.11 N ATOM 1366 CA ASP A 371 5.124 -10.719 18.504 1.00 58.86 C ATOM 1367 C ASP A 371 5.465 -9.230 18.423 1.00 58.29 C ATOM 1368 O ASP A 371 4.583 -8.385 18.240 1.00 58.87 O ATOM 1369 CB ASP A 371 4.812 -11.164 19.936 1.00 60.11 C ATOM 1370 CG ASP A 371 4.580 -12.674 20.036 1.00 60.99 C ATOM 1371 OD1 ASP A 371 3.622 -13.175 19.403 1.00 61.36 O ATOM 1372 OD2 ASP A 371 5.357 -13.366 20.735 1.00 61.36 O ATOM 0 H ASP A 371 6.648 -11.958 18.582 1.00 59.11 H new ATOM 0 HA ASP A 371 4.329 -10.853 17.965 1.00 58.86 H new ATOM 0 HB2 ASP A 371 5.546 -10.912 20.518 1.00 60.11 H new ATOM 0 HB3 ASP A 371 4.024 -10.696 20.254 1.00 60.11 H new ATOM 1373 N PHE A 372 6.752 -8.912 18.533 1.00 56.78 N ATOM 1374 CA PHE A 372 7.211 -7.538 18.363 1.00 55.27 C ATOM 1375 C PHE A 372 7.176 -7.101 16.897 1.00 54.85 C ATOM 1376 O PHE A 372 7.227 -5.909 16.602 1.00 54.48 O ATOM 1377 CB PHE A 372 8.616 -7.355 18.943 1.00 54.97 C ATOM 1378 CG PHE A 372 8.664 -7.413 20.452 1.00 54.58 C ATOM 1379 CD1 PHE A 372 7.827 -6.607 21.218 1.00 54.02 C ATOM 1380 CD2 PHE A 372 9.553 -8.266 21.102 1.00 54.25 C ATOM 1381 CE1 PHE A 372 7.872 -6.654 22.604 1.00 54.03 C ATOM 1382 CE2 PHE A 372 9.605 -8.318 22.488 1.00 54.01 C ATOM 1383 CZ PHE A 372 8.765 -7.512 23.241 1.00 54.20 C ATOM 0 H PHE A 372 7.376 -9.478 18.706 1.00 56.78 H new ATOM 0 HA PHE A 372 6.597 -6.969 18.853 1.00 55.27 H new ATOM 0 HB2 PHE A 372 9.198 -8.042 18.582 1.00 54.97 H new ATOM 0 HB3 PHE A 372 8.970 -6.501 18.649 1.00 54.97 H new ATOM 0 HD1 PHE A 372 7.231 -6.031 20.796 1.00 54.02 H new ATOM 0 HD2 PHE A 372 10.119 -8.808 20.601 1.00 54.25 H new ATOM 0 HE1 PHE A 372 7.307 -6.113 23.107 1.00 54.03 H new ATOM 0 HE2 PHE A 372 10.202 -8.892 22.911 1.00 54.01 H new ATOM 0 HZ PHE A 372 8.798 -7.544 24.170 1.00 54.20 H new ATOM 1384 N GLN A 373 7.078 -8.068 15.986 1.00 54.47 N ATOM 1385 CA GLN A 373 6.977 -7.773 14.555 1.00 54.57 C ATOM 1386 C GLN A 373 5.677 -7.048 14.202 1.00 53.44 C ATOM 1387 O GLN A 373 5.635 -6.277 13.254 1.00 53.09 O ATOM 1388 CB GLN A 373 7.105 -9.048 13.711 1.00 55.33 C ATOM 1389 CG GLN A 373 8.313 -9.910 14.045 1.00 56.78 C ATOM 1390 CD GLN A 373 9.604 -9.118 14.097 1.00 57.64 C ATOM 1391 OE1 GLN A 373 9.957 -8.491 12.981 1.00 58.21 O flip ATOM 1392 NE2 GLN A 373 10.273 -9.062 15.136 1.00 57.79 N flip ATOM 0 H GLN A 373 7.068 -8.907 16.176 1.00 54.47 H new ATOM 0 HA GLN A 373 7.717 -7.181 14.347 1.00 54.57 H new ATOM 0 HB2 GLN A 373 6.302 -9.579 13.825 1.00 55.33 H new ATOM 0 HB3 GLN A 373 7.149 -8.799 12.775 1.00 55.33 H new ATOM 0 HG2 GLN A 373 8.169 -10.343 14.901 1.00 56.78 H new ATOM 0 HG3 GLN A 373 8.396 -10.613 13.382 1.00 56.78 H new ATOM 0 HE21 GLN A 373 10.011 -9.482 15.839 1.00 57.79 H new ATOM 0 HE22 GLN A 373 11.000 -8.603 15.155 1.00 57.79 H new ATOM 1393 N ILE A 374 4.620 -7.300 14.967 1.00 52.94 N ATOM 1394 CA ILE A 374 3.341 -6.632 14.746 1.00 52.67 C ATOM 1395 C ILE A 374 3.390 -5.125 15.047 1.00 52.43 C ATOM 1396 O ILE A 374 2.499 -4.385 14.633 1.00 52.39 O ATOM 1397 CB ILE A 374 2.194 -7.294 15.553 1.00 52.92 C ATOM 1398 CG1 ILE A 374 2.130 -6.736 16.975 1.00 52.83 C ATOM 1399 CG2 ILE A 374 2.345 -8.815 15.557 1.00 53.19 C ATOM 1400 CD1 ILE A 374 0.968 -7.259 17.782 1.00 53.00 C ATOM 0 H ILE A 374 4.622 -7.857 15.622 1.00 52.94 H new ATOM 0 HA ILE A 374 3.157 -6.736 13.799 1.00 52.67 H new ATOM 0 HB ILE A 374 1.354 -7.080 15.118 1.00 52.92 H new ATOM 0 HG12 ILE A 374 2.956 -6.952 17.436 1.00 52.83 H new ATOM 0 HG13 ILE A 374 2.074 -5.769 16.932 1.00 52.83 H new ATOM 0 HG21 ILE A 374 1.620 -9.211 16.066 1.00 53.19 H new ATOM 0 HG22 ILE A 374 2.318 -9.145 14.645 1.00 53.19 H new ATOM 0 HG23 ILE A 374 3.193 -9.055 15.963 1.00 53.19 H new ATOM 0 HD11 ILE A 374 0.987 -6.867 18.669 1.00 53.00 H new ATOM 0 HD12 ILE A 374 0.136 -7.023 17.342 1.00 53.00 H new ATOM 0 HD13 ILE A 374 1.032 -8.224 17.854 1.00 53.00 H new ATOM 1401 N TYR A 375 4.414 -4.677 15.772 1.00 52.01 N ATOM 1402 CA TYR A 375 4.636 -3.239 15.964 1.00 52.21 C ATOM 1403 C TYR A 375 4.932 -2.568 14.625 1.00 52.12 C ATOM 1404 O TYR A 375 4.650 -1.386 14.435 1.00 52.36 O ATOM 1405 CB TYR A 375 5.786 -2.970 16.946 1.00 52.06 C ATOM 1406 CG TYR A 375 5.383 -2.944 18.410 1.00 52.05 C ATOM 1407 CD1 TYR A 375 5.129 -4.119 19.107 1.00 51.77 C ATOM 1408 CD2 TYR A 375 5.266 -1.738 19.094 1.00 52.16 C ATOM 1409 CE1 TYR A 375 4.759 -4.093 20.452 1.00 52.09 C ATOM 1410 CE2 TYR A 375 4.909 -1.702 20.433 1.00 52.16 C ATOM 1411 CZ TYR A 375 4.658 -2.877 21.107 1.00 52.08 C ATOM 1412 OH TYR A 375 4.293 -2.826 22.434 1.00 52.15 O ATOM 0 H TYR A 375 4.990 -5.184 16.160 1.00 52.01 H new ATOM 0 HA TYR A 375 3.825 -2.865 16.342 1.00 52.21 H new ATOM 0 HB2 TYR A 375 6.465 -3.651 16.823 1.00 52.06 H new ATOM 0 HB3 TYR A 375 6.194 -2.119 16.721 1.00 52.06 H new ATOM 0 HD1 TYR A 375 5.207 -4.936 18.670 1.00 51.77 H new ATOM 0 HD2 TYR A 375 5.430 -0.941 18.644 1.00 52.16 H new ATOM 0 HE1 TYR A 375 4.582 -4.886 20.905 1.00 52.09 H new ATOM 0 HE2 TYR A 375 4.839 -0.887 20.875 1.00 52.16 H new ATOM 0 HH TYR A 375 4.245 -3.606 22.742 1.00 52.15 H new ATOM 1413 N SER A 376 5.500 -3.330 13.697 1.00 51.94 N ATOM 1414 CA SER A 376 5.803 -2.807 12.368 1.00 52.33 C ATOM 1415 C SER A 376 4.558 -2.254 11.676 1.00 52.16 C ATOM 1416 O SER A 376 4.588 -1.155 11.136 1.00 51.89 O ATOM 1417 CB SER A 376 6.454 -3.885 11.504 1.00 52.44 C ATOM 1418 OG SER A 376 6.601 -3.434 10.174 1.00 53.09 O ATOM 0 H SER A 376 5.718 -4.153 13.816 1.00 51.94 H new ATOM 0 HA SER A 376 6.426 -2.073 12.481 1.00 52.33 H new ATOM 0 HB2 SER A 376 7.322 -4.119 11.869 1.00 52.44 H new ATOM 0 HB3 SER A 376 5.913 -4.690 11.520 1.00 52.44 H new ATOM 0 HG SER A 376 6.961 -4.036 9.712 1.00 53.09 H new ATOM 1419 N GLU A 377 3.469 -3.021 11.704 1.00 52.38 N ATOM 1420 CA GLU A 377 2.212 -2.609 11.084 1.00 52.88 C ATOM 1421 C GLU A 377 1.615 -1.404 11.787 1.00 52.17 C ATOM 1422 O GLU A 377 1.058 -0.516 11.149 1.00 52.19 O ATOM 1423 CB GLU A 377 1.187 -3.745 11.102 1.00 53.99 C ATOM 1424 CG GLU A 377 -0.209 -3.282 10.710 1.00 55.33 C ATOM 1425 CD GLU A 377 -1.286 -4.321 10.962 1.00 56.27 C ATOM 1426 OE1 GLU A 377 -0.958 -5.526 11.048 1.00 56.92 O ATOM 1427 OE2 GLU A 377 -2.469 -3.925 11.067 1.00 56.81 O ATOM 0 H GLU A 377 3.439 -3.793 12.082 1.00 52.38 H new ATOM 0 HA GLU A 377 2.419 -2.374 10.166 1.00 52.88 H new ATOM 0 HB2 GLU A 377 1.474 -4.445 10.495 1.00 53.99 H new ATOM 0 HB3 GLU A 377 1.157 -4.135 11.990 1.00 53.99 H new ATOM 0 HG2 GLU A 377 -0.425 -2.476 11.205 1.00 55.33 H new ATOM 0 HG3 GLU A 377 -0.211 -3.046 9.769 1.00 55.33 H new ATOM 1428 N TYR A 378 1.715 -1.388 13.109 1.00 51.48 N ATOM 1429 CA TYR A 378 1.186 -0.279 13.881 1.00 50.84 C ATOM 1430 C TYR A 378 1.850 1.030 13.484 1.00 50.52 C ATOM 1431 O TYR A 378 1.186 2.037 13.253 1.00 49.80 O ATOM 1432 CB TYR A 378 1.381 -0.495 15.384 1.00 50.50 C ATOM 1433 CG TYR A 378 0.726 0.614 16.158 1.00 50.52 C ATOM 1434 CD1 TYR A 378 -0.641 0.591 16.395 1.00 50.47 C ATOM 1435 CD2 TYR A 378 1.453 1.720 16.591 1.00 50.29 C ATOM 1436 CE1 TYR A 378 -1.264 1.616 17.076 1.00 50.59 C ATOM 1437 CE2 TYR A 378 0.831 2.758 17.275 1.00 50.55 C ATOM 1438 CZ TYR A 378 -0.528 2.695 17.509 1.00 50.30 C ATOM 1439 OH TYR A 378 -1.170 3.707 18.177 1.00 50.46 O ATOM 0 H TYR A 378 2.085 -2.009 13.576 1.00 51.48 H new ATOM 0 HA TYR A 378 0.236 -0.234 13.688 1.00 50.84 H new ATOM 0 HB2 TYR A 378 1.003 -1.349 15.646 1.00 50.50 H new ATOM 0 HB3 TYR A 378 2.328 -0.528 15.592 1.00 50.50 H new ATOM 0 HD1 TYR A 378 -1.146 -0.128 16.089 1.00 50.47 H new ATOM 0 HD2 TYR A 378 2.366 1.765 16.420 1.00 50.29 H new ATOM 0 HE1 TYR A 378 -2.178 1.578 17.242 1.00 50.59 H new ATOM 0 HE2 TYR A 378 1.325 3.488 17.572 1.00 50.55 H new ATOM 0 HH TYR A 378 -0.610 4.288 18.411 1.00 50.46 H new ATOM 1440 N CYS A 379 3.174 1.003 13.421 1.00 51.12 N ATOM 1441 CA CYS A 379 3.960 2.197 13.161 1.00 51.22 C ATOM 1442 C CYS A 379 3.858 2.633 11.701 1.00 51.97 C ATOM 1443 O CYS A 379 3.932 3.827 11.396 1.00 52.40 O ATOM 1444 CB CYS A 379 5.411 1.965 13.593 1.00 50.96 C ATOM 1445 SG CYS A 379 5.592 1.689 15.395 1.00 51.19 S ATOM 0 H CYS A 379 3.642 0.290 13.528 1.00 51.12 H new ATOM 0 HA CYS A 379 3.599 2.928 13.687 1.00 51.22 H new ATOM 0 HB2 CYS A 379 5.765 1.198 13.117 1.00 50.96 H new ATOM 0 HB3 CYS A 379 5.946 2.731 13.334 1.00 50.96 H new ATOM 0 HG CYS A 379 5.346 0.543 15.651 1.00 51.19 H new ATOM 1446 N ASN A 380 3.677 1.668 10.803 1.00 52.55 N ATOM 1447 CA ASN A 380 3.404 1.968 9.399 1.00 53.37 C ATOM 1448 C ASN A 380 2.078 2.700 9.227 1.00 52.98 C ATOM 1449 O ASN A 380 1.958 3.605 8.406 1.00 52.49 O ATOM 1450 CB ASN A 380 3.388 0.687 8.562 1.00 54.56 C ATOM 1451 CG ASN A 380 4.776 0.157 8.291 1.00 56.00 C ATOM 1452 OD1 ASN A 380 5.751 0.600 8.903 1.00 56.86 O ATOM 1453 ND2 ASN A 380 4.881 -0.795 7.368 1.00 56.59 N ATOM 0 H ASN A 380 3.708 0.829 10.987 1.00 52.55 H new ATOM 0 HA ASN A 380 4.118 2.547 9.089 1.00 53.37 H new ATOM 0 HB2 ASN A 380 2.870 0.009 9.024 1.00 54.56 H new ATOM 0 HB3 ASN A 380 2.941 0.860 7.719 1.00 54.56 H new ATOM 0 HD21 ASN A 380 5.651 -1.126 7.178 1.00 56.59 H new ATOM 0 HD22 ASN A 380 4.178 -1.079 6.962 1.00 56.59 H new ATOM 1454 N ASN A 381 1.078 2.297 10.004 1.00 52.71 N ATOM 1455 CA ASN A 381 -0.236 2.918 9.921 1.00 52.56 C ATOM 1456 C ASN A 381 -0.313 4.236 10.683 1.00 52.72 C ATOM 1457 O ASN A 381 -1.164 5.073 10.400 1.00 52.47 O ATOM 1458 CB ASN A 381 -1.315 1.958 10.421 1.00 52.15 C ATOM 1459 CG ASN A 381 -2.669 2.622 10.543 1.00 51.85 C ATOM 1460 OD1 ASN A 381 -3.311 2.882 9.411 1.00 52.54 O flip ATOM 1461 ND2 ASN A 381 -3.129 2.908 11.651 1.00 50.75 N flip ATOM 0 H ASN A 381 1.141 1.666 10.585 1.00 52.71 H new ATOM 0 HA ASN A 381 -0.391 3.119 8.985 1.00 52.56 H new ATOM 0 HB2 ASN A 381 -1.381 1.205 9.813 1.00 52.15 H new ATOM 0 HB3 ASN A 381 -1.053 1.603 11.285 1.00 52.15 H new ATOM 0 HD21 ASN A 381 -2.683 2.723 12.363 1.00 50.75 H new ATOM 0 HD22 ASN A 381 -3.896 3.292 11.712 1.00 50.75 H new ATOM 1462 N HIS A 382 0.587 4.426 11.644 1.00 53.45 N ATOM 1463 CA HIS A 382 0.519 5.591 12.526 1.00 53.77 C ATOM 1464 C HIS A 382 0.418 6.954 11.827 1.00 53.92 C ATOM 1465 O HIS A 382 -0.331 7.821 12.283 1.00 54.49 O ATOM 1466 CB HIS A 382 1.659 5.586 13.546 1.00 54.18 C ATOM 1467 CG HIS A 382 1.552 6.676 14.566 1.00 54.35 C ATOM 1468 ND1 HIS A 382 0.722 6.829 15.625 1.00 54.59 N flip ATOM 1469 CD2 HIS A 382 2.351 7.798 14.541 1.00 54.63 C flip ATOM 1470 CE1 HIS A 382 1.046 8.022 16.225 1.00 54.51 C flip ATOM 1471 NE2 HIS A 382 2.031 8.587 15.551 1.00 54.73 N flip ATOM 0 H HIS A 382 1.244 3.894 11.803 1.00 53.45 H new ATOM 0 HA HIS A 382 -0.330 5.488 12.984 1.00 53.77 H new ATOM 0 HB2 HIS A 382 1.674 4.729 14.000 1.00 54.18 H new ATOM 0 HB3 HIS A 382 2.504 5.673 13.077 1.00 54.18 H new ATOM 0 HD2 HIS A 382 3.013 7.973 13.911 1.00 54.63 H new ATOM 0 HE1 HIS A 382 0.638 8.374 16.983 1.00 54.51 H new ATOM 0 HE2 HIS A 382 2.401 9.340 15.738 1.00 54.73 H new ATOM 1472 N PRO A 383 1.186 7.171 10.746 1.00 53.84 N ATOM 1473 CA PRO A 383 1.038 8.438 10.024 1.00 53.99 C ATOM 1474 C PRO A 383 -0.392 8.718 9.550 1.00 53.93 C ATOM 1475 O PRO A 383 -0.836 9.867 9.577 1.00 53.81 O ATOM 1476 CB PRO A 383 1.991 8.275 8.833 1.00 53.67 C ATOM 1477 CG PRO A 383 3.022 7.316 9.327 1.00 53.78 C ATOM 1478 CD PRO A 383 2.255 6.337 10.167 1.00 53.99 C ATOM 0 HA PRO A 383 1.241 9.196 10.594 1.00 53.99 H new ATOM 0 HB2 PRO A 383 1.529 7.930 8.053 1.00 53.67 H new ATOM 0 HB3 PRO A 383 2.387 9.122 8.576 1.00 53.67 H new ATOM 0 HG2 PRO A 383 3.473 6.873 8.591 1.00 53.78 H new ATOM 0 HG3 PRO A 383 3.705 7.768 9.847 1.00 53.78 H new ATOM 0 HD2 PRO A 383 1.896 5.610 9.635 1.00 53.99 H new ATOM 0 HD3 PRO A 383 2.812 5.938 10.854 1.00 53.99 H new ATOM 1479 N ASN A 384 -1.105 7.677 9.133 1.00 54.20 N ATOM 1480 CA ASN A 384 -2.499 7.813 8.715 1.00 54.51 C ATOM 1481 C ASN A 384 -3.454 8.061 9.880 1.00 54.58 C ATOM 1482 O ASN A 384 -4.474 8.736 9.722 1.00 54.47 O ATOM 1483 CB ASN A 384 -2.942 6.569 7.954 1.00 54.93 C ATOM 1484 CG ASN A 384 -2.025 6.242 6.802 1.00 55.46 C ATOM 1485 OD1 ASN A 384 -1.827 7.057 5.894 1.00 55.52 O ATOM 1486 ND2 ASN A 384 -1.453 5.044 6.829 1.00 55.53 N ATOM 0 H ASN A 384 -0.798 6.875 9.084 1.00 54.20 H new ATOM 0 HA ASN A 384 -2.538 8.594 8.140 1.00 54.51 H new ATOM 0 HB2 ASN A 384 -2.974 5.815 8.563 1.00 54.93 H new ATOM 0 HB3 ASN A 384 -3.843 6.701 7.619 1.00 54.93 H new ATOM 0 HD21 ASN A 384 -0.920 4.808 6.197 1.00 55.53 H new ATOM 0 HD22 ASN A 384 -1.616 4.504 7.478 1.00 55.53 H new ATOM 1487 N ALA A 385 -3.131 7.492 11.040 1.00 54.20 N ATOM 1488 CA ALA A 385 -3.917 7.716 12.246 1.00 54.39 C ATOM 1489 C ALA A 385 -3.875 9.188 12.590 1.00 54.57 C ATOM 1490 O ALA A 385 -4.904 9.798 12.867 1.00 54.26 O ATOM 1491 CB ALA A 385 -3.368 6.899 13.404 1.00 54.36 C ATOM 0 H ALA A 385 -2.456 6.970 11.148 1.00 54.20 H new ATOM 0 HA ALA A 385 -4.833 7.438 12.087 1.00 54.39 H new ATOM 0 HB1 ALA A 385 -3.903 7.061 14.197 1.00 54.36 H new ATOM 0 HB2 ALA A 385 -3.401 5.956 13.179 1.00 54.36 H new ATOM 0 HB3 ALA A 385 -2.449 7.158 13.576 1.00 54.36 H new ATOM 1492 N CYS A 386 -2.664 9.742 12.564 1.00 55.25 N ATOM 1493 CA CYS A 386 -2.429 11.150 12.851 1.00 55.90 C ATOM 1494 C CYS A 386 -3.216 12.061 11.931 1.00 55.52 C ATOM 1495 O CYS A 386 -3.804 13.038 12.384 1.00 55.38 O ATOM 1496 CB CYS A 386 -0.944 11.473 12.732 1.00 56.83 C ATOM 1497 SG CYS A 386 0.021 10.795 14.076 1.00 58.86 S ATOM 0 H CYS A 386 -1.949 9.303 12.377 1.00 55.25 H new ATOM 0 HA CYS A 386 -2.731 11.308 13.759 1.00 55.90 H new ATOM 0 HB2 CYS A 386 -0.608 11.126 11.891 1.00 56.83 H new ATOM 0 HB3 CYS A 386 -0.827 12.436 12.709 1.00 56.83 H new ATOM 0 HG CYS A 386 1.176 11.081 13.924 1.00 58.86 H new ATOM 1498 N VAL A 387 -3.211 11.741 10.640 1.00 55.21 N ATOM 1499 CA VAL A 387 -3.945 12.523 9.657 1.00 55.17 C ATOM 1500 C VAL A 387 -5.442 12.530 9.966 1.00 55.09 C ATOM 1501 O VAL A 387 -6.076 13.585 9.984 1.00 54.88 O ATOM 1502 CB VAL A 387 -3.669 12.035 8.214 1.00 55.23 C ATOM 1503 CG1 VAL A 387 -4.733 12.546 7.254 1.00 55.05 C ATOM 1504 CG2 VAL A 387 -2.280 12.484 7.765 1.00 54.89 C ATOM 0 H VAL A 387 -2.785 11.069 10.313 1.00 55.21 H new ATOM 0 HA VAL A 387 -3.625 13.437 9.716 1.00 55.17 H new ATOM 0 HB VAL A 387 -3.702 11.066 8.207 1.00 55.23 H new ATOM 0 HG11 VAL A 387 -4.540 12.229 6.358 1.00 55.05 H new ATOM 0 HG12 VAL A 387 -5.603 12.220 7.532 1.00 55.05 H new ATOM 0 HG13 VAL A 387 -4.735 13.516 7.259 1.00 55.05 H new ATOM 0 HG21 VAL A 387 -2.116 12.174 6.861 1.00 54.89 H new ATOM 0 HG22 VAL A 387 -2.229 13.452 7.789 1.00 54.89 H new ATOM 0 HG23 VAL A 387 -1.611 12.111 8.360 1.00 54.89 H new ATOM 1505 N GLU A 388 -5.999 11.355 10.238 1.00 55.34 N ATOM 1506 CA GLU A 388 -7.412 11.258 10.596 1.00 55.58 C ATOM 1507 C GLU A 388 -7.701 11.974 11.915 1.00 55.09 C ATOM 1508 O GLU A 388 -8.738 12.619 12.059 1.00 54.85 O ATOM 1509 CB GLU A 388 -7.859 9.794 10.665 1.00 56.20 C ATOM 1510 CG GLU A 388 -9.317 9.595 11.077 1.00 56.43 C ATOM 1511 CD GLU A 388 -10.300 10.039 10.011 1.00 56.69 C ATOM 1512 OE1 GLU A 388 -9.859 10.484 8.933 1.00 57.03 O ATOM 1513 OE2 GLU A 388 -11.520 9.938 10.249 1.00 56.68 O ATOM 0 H GLU A 388 -5.580 10.604 10.221 1.00 55.34 H new ATOM 0 HA GLU A 388 -7.923 11.700 9.900 1.00 55.58 H new ATOM 0 HB2 GLU A 388 -7.721 9.384 9.797 1.00 56.20 H new ATOM 0 HB3 GLU A 388 -7.290 9.323 11.294 1.00 56.20 H new ATOM 0 HG2 GLU A 388 -9.466 8.658 11.277 1.00 56.43 H new ATOM 0 HG3 GLU A 388 -9.488 10.090 11.894 1.00 56.43 H new ATOM 1514 N LEU A 389 -6.782 11.863 12.870 1.00 54.89 N ATOM 1515 CA LEU A 389 -6.930 12.544 14.159 1.00 54.92 C ATOM 1516 C LEU A 389 -6.942 14.072 14.028 1.00 54.52 C ATOM 1517 O LEU A 389 -7.742 14.747 14.679 1.00 54.42 O ATOM 1518 CB LEU A 389 -5.840 12.108 15.144 1.00 55.49 C ATOM 1519 CG LEU A 389 -6.114 11.008 16.179 1.00 56.13 C ATOM 1520 CD1 LEU A 389 -7.438 11.232 16.906 1.00 56.32 C ATOM 1521 CD2 LEU A 389 -6.087 9.643 15.541 1.00 56.58 C ATOM 0 H LEU A 389 -6.063 11.398 12.794 1.00 54.89 H new ATOM 0 HA LEU A 389 -7.796 12.278 14.506 1.00 54.92 H new ATOM 0 HB2 LEU A 389 -5.078 11.821 14.617 1.00 55.49 H new ATOM 0 HB3 LEU A 389 -5.565 12.899 15.634 1.00 55.49 H new ATOM 0 HG LEU A 389 -5.403 11.053 16.838 1.00 56.13 H new ATOM 0 HD11 LEU A 389 -7.578 10.520 17.550 1.00 56.32 H new ATOM 0 HD12 LEU A 389 -7.414 12.085 17.367 1.00 56.32 H new ATOM 0 HD13 LEU A 389 -8.164 11.233 16.263 1.00 56.32 H new ATOM 0 HD21 LEU A 389 -6.262 8.967 16.214 1.00 56.58 H new ATOM 0 HD22 LEU A 389 -6.767 9.595 14.850 1.00 56.58 H new ATOM 0 HD23 LEU A 389 -5.215 9.487 15.147 1.00 56.58 H new ATOM 1522 N SER A 390 -6.050 14.614 13.203 1.00 53.78 N ATOM 1523 CA SER A 390 -6.033 16.050 12.926 1.00 53.86 C ATOM 1524 C SER A 390 -7.372 16.493 12.354 1.00 53.07 C ATOM 1525 O SER A 390 -7.961 17.473 12.813 1.00 53.31 O ATOM 1526 CB SER A 390 -4.921 16.403 11.932 1.00 54.34 C ATOM 1527 OG SER A 390 -3.720 15.722 12.254 1.00 55.29 O ATOM 0 H SER A 390 -5.443 14.166 12.791 1.00 53.78 H new ATOM 0 HA SER A 390 -5.867 16.511 13.763 1.00 53.86 H new ATOM 0 HB2 SER A 390 -5.199 16.168 11.033 1.00 54.34 H new ATOM 0 HB3 SER A 390 -4.767 17.361 11.940 1.00 54.34 H new ATOM 0 HG SER A 390 -3.793 14.912 12.045 1.00 55.29 H new ATOM 1528 N ARG A 391 -7.843 15.763 11.345 1.00 51.99 N ATOM 1529 CA ARG A 391 -9.131 16.042 10.720 1.00 50.69 C ATOM 1530 C ARG A 391 -10.254 16.064 11.757 1.00 50.89 C ATOM 1531 O ARG A 391 -10.995 17.042 11.849 1.00 50.28 O ATOM 1532 CB ARG A 391 -9.436 15.016 9.622 1.00 50.27 C ATOM 1533 CG ARG A 391 -10.554 15.433 8.676 1.00 49.98 C ATOM 1534 CD ARG A 391 -10.848 14.363 7.631 1.00 49.74 C ATOM 1535 NE ARG A 391 -11.438 13.163 8.224 1.00 49.25 N ATOM 1536 CZ ARG A 391 -12.733 13.007 8.486 1.00 48.83 C ATOM 1537 NH1 ARG A 391 -13.595 13.980 8.215 1.00 48.49 N ATOM 1538 NH2 ARG A 391 -13.168 11.875 9.024 1.00 48.59 N ATOM 0 H ARG A 391 -7.424 15.093 11.005 1.00 51.99 H new ATOM 0 HA ARG A 391 -9.079 16.921 10.314 1.00 50.69 H new ATOM 0 HB2 ARG A 391 -8.630 14.860 9.106 1.00 50.27 H new ATOM 0 HB3 ARG A 391 -9.675 14.173 10.038 1.00 50.27 H new ATOM 0 HG2 ARG A 391 -11.358 15.614 9.187 1.00 49.98 H new ATOM 0 HG3 ARG A 391 -10.309 16.259 8.231 1.00 49.98 H new ATOM 0 HD2 ARG A 391 -11.452 14.723 6.963 1.00 49.74 H new ATOM 0 HD3 ARG A 391 -10.027 14.126 7.173 1.00 49.74 H new ATOM 0 HE ARG A 391 -10.910 12.512 8.417 1.00 49.25 H new ATOM 0 HH11 ARG A 391 -13.317 14.716 7.868 1.00 48.49 H new ATOM 0 HH12 ARG A 391 -14.431 13.874 8.386 1.00 48.49 H new ATOM 0 HH21 ARG A 391 -12.613 11.243 9.203 1.00 48.59 H new ATOM 0 HH22 ARG A 391 -14.005 11.773 9.194 1.00 48.59 H new ATOM 1539 N LEU A 392 -10.376 14.991 12.537 1.00 51.29 N ATOM 1540 CA LEU A 392 -11.441 14.907 13.538 1.00 52.29 C ATOM 1541 C LEU A 392 -11.272 15.977 14.617 1.00 52.69 C ATOM 1542 O LEU A 392 -12.256 16.533 15.107 1.00 52.87 O ATOM 1543 CB LEU A 392 -11.508 13.510 14.165 1.00 52.33 C ATOM 1544 CG LEU A 392 -11.723 12.333 13.213 1.00 52.43 C ATOM 1545 CD1 LEU A 392 -11.975 11.058 14.005 1.00 52.17 C ATOM 1546 CD2 LEU A 392 -12.870 12.602 12.247 1.00 52.35 C ATOM 0 H LEU A 392 -9.857 14.306 12.504 1.00 51.29 H new ATOM 0 HA LEU A 392 -12.281 15.070 13.082 1.00 52.29 H new ATOM 0 HB2 LEU A 392 -10.683 13.358 14.651 1.00 52.33 H new ATOM 0 HB3 LEU A 392 -12.226 13.506 14.817 1.00 52.33 H new ATOM 0 HG LEU A 392 -10.917 12.220 12.685 1.00 52.43 H new ATOM 0 HD11 LEU A 392 -12.110 10.318 13.393 1.00 52.17 H new ATOM 0 HD12 LEU A 392 -11.210 10.873 14.572 1.00 52.17 H new ATOM 0 HD13 LEU A 392 -12.766 11.170 14.556 1.00 52.17 H new ATOM 0 HD21 LEU A 392 -12.982 11.840 11.657 1.00 52.35 H new ATOM 0 HD22 LEU A 392 -13.688 12.746 12.748 1.00 52.35 H new ATOM 0 HD23 LEU A 392 -12.671 13.392 11.720 1.00 52.35 H new ATOM 1547 N THR A 393 -10.017 16.264 14.960 1.00 53.28 N ATOM 1548 CA THR A 393 -9.653 17.336 15.892 1.00 53.50 C ATOM 1549 C THR A 393 -10.358 18.641 15.586 1.00 53.56 C ATOM 1550 O THR A 393 -10.599 19.442 16.492 1.00 54.08 O ATOM 1551 CB THR A 393 -8.127 17.605 15.868 1.00 54.07 C ATOM 1552 OG1 THR A 393 -7.474 16.809 16.866 1.00 54.49 O ATOM 1553 CG2 THR A 393 -7.823 19.079 16.128 1.00 54.30 C ATOM 0 H THR A 393 -9.339 15.834 14.652 1.00 53.28 H new ATOM 0 HA THR A 393 -9.931 17.024 16.767 1.00 53.50 H new ATOM 0 HB THR A 393 -7.797 17.369 14.987 1.00 54.07 H new ATOM 0 HG1 THR A 393 -7.346 16.034 16.567 1.00 54.49 H new ATOM 0 HG21 THR A 393 -6.864 19.220 16.108 1.00 54.30 H new ATOM 0 HG22 THR A 393 -8.244 19.622 15.443 1.00 54.30 H new ATOM 0 HG23 THR A 393 -8.168 19.332 16.998 1.00 54.30 H new ATOM 1554 N LYS A 394 -10.673 18.855 14.306 1.00 53.11 N ATOM 1555 CA LYS A 394 -11.289 20.098 13.836 1.00 52.20 C ATOM 1556 C LYS A 394 -12.809 20.026 13.847 1.00 51.55 C ATOM 1557 O LYS A 394 -13.483 20.973 13.448 1.00 51.42 O ATOM 1558 CB LYS A 394 -10.819 20.423 12.413 1.00 52.31 C ATOM 1559 CG LYS A 394 -9.333 20.696 12.287 1.00 52.47 C ATOM 1560 CD LYS A 394 -8.862 20.444 10.862 1.00 52.57 C ATOM 1561 CE LYS A 394 -7.362 20.676 10.733 1.00 52.63 C ATOM 1562 NZ LYS A 394 -6.864 20.195 9.410 1.00 52.74 N ATOM 0 H LYS A 394 -10.534 18.279 13.683 1.00 53.11 H new ATOM 0 HA LYS A 394 -11.011 20.797 14.449 1.00 52.20 H new ATOM 0 HB2 LYS A 394 -11.050 19.682 11.831 1.00 52.31 H new ATOM 0 HB3 LYS A 394 -11.307 21.198 12.093 1.00 52.31 H new ATOM 0 HG2 LYS A 394 -9.145 21.614 12.538 1.00 52.47 H new ATOM 0 HG3 LYS A 394 -8.841 20.128 12.901 1.00 52.47 H new ATOM 0 HD2 LYS A 394 -9.075 19.534 10.604 1.00 52.57 H new ATOM 0 HD3 LYS A 394 -9.337 21.030 10.252 1.00 52.57 H new ATOM 0 HE2 LYS A 394 -7.167 21.621 10.833 1.00 52.63 H new ATOM 0 HE3 LYS A 394 -6.896 20.213 11.447 1.00 52.63 H new ATOM 0 HZ1 LYS A 394 -5.988 20.338 9.353 1.00 52.74 H new ATOM 0 HZ2 LYS A 394 -7.028 19.324 9.330 1.00 52.74 H new ATOM 0 HZ3 LYS A 394 -7.280 20.636 8.758 1.00 52.74 H new ATOM 1563 N LEU A 395 -13.347 18.897 14.295 1.00 51.02 N ATOM 1564 CA LEU A 395 -14.790 18.694 14.298 1.00 50.16 C ATOM 1565 C LEU A 395 -15.301 18.611 15.728 1.00 50.22 C ATOM 1566 O LEU A 395 -14.957 17.689 16.467 1.00 49.96 O ATOM 1567 CB LEU A 395 -15.163 17.438 13.508 1.00 49.51 C ATOM 1568 CG LEU A 395 -14.761 17.422 12.024 1.00 49.22 C ATOM 1569 CD1 LEU A 395 -15.298 16.174 11.344 1.00 48.88 C ATOM 1570 CD2 LEU A 395 -15.244 18.674 11.294 1.00 49.10 C ATOM 0 H LEU A 395 -12.892 18.235 14.602 1.00 51.02 H new ATOM 0 HA LEU A 395 -15.212 19.452 13.864 1.00 50.16 H new ATOM 0 HB2 LEU A 395 -14.755 16.673 13.942 1.00 49.51 H new ATOM 0 HB3 LEU A 395 -16.124 17.317 13.564 1.00 49.51 H new ATOM 0 HG LEU A 395 -13.792 17.413 11.983 1.00 49.22 H new ATOM 0 HD11 LEU A 395 -15.037 16.177 10.410 1.00 48.88 H new ATOM 0 HD12 LEU A 395 -14.934 15.387 11.778 1.00 48.88 H new ATOM 0 HD13 LEU A 395 -16.266 16.161 11.409 1.00 48.88 H new ATOM 0 HD21 LEU A 395 -14.974 18.631 10.363 1.00 49.10 H new ATOM 0 HD22 LEU A 395 -16.211 18.727 11.347 1.00 49.10 H new ATOM 0 HD23 LEU A 395 -14.854 19.460 11.707 1.00 49.10 H new ATOM 1571 N SER A 396 -16.128 19.584 16.102 1.00 50.08 N ATOM 1572 CA SER A 396 -16.571 19.759 17.487 1.00 49.98 C ATOM 1573 C SER A 396 -17.230 18.526 18.100 1.00 49.78 C ATOM 1574 O SER A 396 -16.964 18.192 19.253 1.00 50.23 O ATOM 1575 CB SER A 396 -17.500 20.972 17.605 1.00 49.87 C ATOM 1576 OG SER A 396 -18.811 20.656 17.173 1.00 49.86 O ATOM 0 H SER A 396 -16.451 20.166 15.557 1.00 50.08 H new ATOM 0 HA SER A 396 -15.762 19.908 18.001 1.00 49.98 H new ATOM 0 HB2 SER A 396 -17.524 21.276 18.526 1.00 49.87 H new ATOM 0 HB3 SER A 396 -17.149 21.704 17.074 1.00 49.87 H new ATOM 0 HG SER A 396 -19.302 21.334 17.248 1.00 49.86 H new ATOM 1577 N LYS A 397 -18.080 17.843 17.336 1.00 49.57 N ATOM 1578 CA LYS A 397 -18.761 16.652 17.848 1.00 49.11 C ATOM 1579 C LYS A 397 -17.778 15.540 18.206 1.00 48.55 C ATOM 1580 O LYS A 397 -18.036 14.743 19.115 1.00 47.75 O ATOM 1581 CB LYS A 397 -19.831 16.152 16.870 1.00 49.85 C ATOM 1582 CG LYS A 397 -19.337 15.871 15.458 1.00 50.39 C ATOM 1583 CD LYS A 397 -20.449 16.062 14.425 1.00 50.84 C ATOM 1584 CE LYS A 397 -20.803 17.539 14.218 1.00 51.10 C ATOM 1585 NZ LYS A 397 -21.841 18.066 15.157 1.00 51.21 N ATOM 0 H LYS A 397 -18.276 18.049 16.524 1.00 49.57 H new ATOM 0 HA LYS A 397 -19.209 16.914 18.668 1.00 49.11 H new ATOM 0 HB2 LYS A 397 -20.222 15.340 17.228 1.00 49.85 H new ATOM 0 HB3 LYS A 397 -20.540 16.812 16.824 1.00 49.85 H new ATOM 0 HG2 LYS A 397 -18.596 16.461 15.250 1.00 50.39 H new ATOM 0 HG3 LYS A 397 -18.999 14.963 15.407 1.00 50.39 H new ATOM 0 HD2 LYS A 397 -20.172 15.676 13.579 1.00 50.84 H new ATOM 0 HD3 LYS A 397 -21.240 15.579 14.711 1.00 50.84 H new ATOM 0 HE2 LYS A 397 -19.997 18.070 14.315 1.00 51.10 H new ATOM 0 HE3 LYS A 397 -21.115 17.660 13.308 1.00 51.10 H new ATOM 0 HZ1 LYS A 397 -22.376 18.629 14.723 1.00 51.21 H new ATOM 0 HZ2 LYS A 397 -22.321 17.389 15.479 1.00 51.21 H new ATOM 0 HZ3 LYS A 397 -21.444 18.494 15.829 1.00 51.21 H new ATOM 1586 N TYR A 398 -16.647 15.502 17.503 1.00 47.91 N ATOM 1587 CA TYR A 398 -15.591 14.541 17.819 1.00 47.35 C ATOM 1588 C TYR A 398 -14.750 14.992 19.000 1.00 47.55 C ATOM 1589 O TYR A 398 -14.317 14.168 19.802 1.00 47.22 O ATOM 1590 CB TYR A 398 -14.697 14.263 16.610 1.00 46.46 C ATOM 1591 CG TYR A 398 -15.359 13.387 15.581 1.00 46.56 C ATOM 1592 CD1 TYR A 398 -16.046 13.947 14.516 1.00 46.11 C ATOM 1593 CD2 TYR A 398 -15.311 11.998 15.678 1.00 46.35 C ATOM 1594 CE1 TYR A 398 -16.663 13.159 13.566 1.00 46.52 C ATOM 1595 CE2 TYR A 398 -15.934 11.194 14.730 1.00 46.47 C ATOM 1596 CZ TYR A 398 -16.609 11.787 13.672 1.00 46.53 C ATOM 1597 OH TYR A 398 -17.233 11.021 12.709 1.00 46.30 O ATOM 0 H TYR A 398 -16.472 16.022 16.841 1.00 47.91 H new ATOM 0 HA TYR A 398 -16.036 13.715 18.064 1.00 47.35 H new ATOM 0 HB2 TYR A 398 -14.447 15.105 16.198 1.00 46.46 H new ATOM 0 HB3 TYR A 398 -13.878 13.839 16.910 1.00 46.46 H new ATOM 0 HD1 TYR A 398 -16.092 14.873 14.440 1.00 46.11 H new ATOM 0 HD2 TYR A 398 -14.856 11.603 16.387 1.00 46.35 H new ATOM 0 HE1 TYR A 398 -17.115 13.554 12.855 1.00 46.52 H new ATOM 0 HE2 TYR A 398 -15.899 10.268 14.804 1.00 46.47 H new ATOM 0 HH TYR A 398 -17.150 10.207 12.901 1.00 46.30 H new ATOM 1598 N VAL A 399 -14.513 16.298 19.093 1.00 47.83 N ATOM 1599 CA VAL A 399 -13.794 16.865 20.229 1.00 48.30 C ATOM 1600 C VAL A 399 -14.531 16.561 21.532 1.00 48.45 C ATOM 1601 O VAL A 399 -13.911 16.190 22.524 1.00 48.54 O ATOM 1602 CB VAL A 399 -13.607 18.398 20.089 1.00 48.71 C ATOM 1603 CG1 VAL A 399 -12.781 18.946 21.251 1.00 48.43 C ATOM 1604 CG2 VAL A 399 -12.948 18.740 18.758 1.00 48.57 C ATOM 0 H VAL A 399 -14.762 16.875 18.506 1.00 47.83 H new ATOM 0 HA VAL A 399 -12.916 16.453 20.245 1.00 48.30 H new ATOM 0 HB VAL A 399 -14.483 18.814 20.112 1.00 48.71 H new ATOM 0 HG11 VAL A 399 -12.674 19.905 21.148 1.00 48.43 H new ATOM 0 HG12 VAL A 399 -13.235 18.760 22.087 1.00 48.43 H new ATOM 0 HG13 VAL A 399 -11.909 18.522 21.256 1.00 48.43 H new ATOM 0 HG21 VAL A 399 -12.839 19.701 18.688 1.00 48.57 H new ATOM 0 HG22 VAL A 399 -12.079 18.312 18.708 1.00 48.57 H new ATOM 0 HG23 VAL A 399 -13.506 18.424 18.030 1.00 48.57 H new ATOM 1605 N TYR A 400 -15.853 16.715 21.525 1.00 49.02 N ATOM 1606 CA TYR A 400 -16.658 16.425 22.715 1.00 49.39 C ATOM 1607 C TYR A 400 -16.713 14.930 23.007 1.00 49.14 C ATOM 1608 O TYR A 400 -16.642 14.509 24.169 1.00 49.28 O ATOM 1609 CB TYR A 400 -18.073 16.984 22.578 1.00 50.89 C ATOM 1610 CG TYR A 400 -18.124 18.424 22.114 1.00 51.53 C ATOM 1611 CD1 TYR A 400 -19.282 18.954 21.561 1.00 51.73 C ATOM 1612 CD2 TYR A 400 -17.008 19.252 22.220 1.00 51.73 C ATOM 1613 CE1 TYR A 400 -19.332 20.270 21.135 1.00 51.91 C ATOM 1614 CE2 TYR A 400 -17.045 20.566 21.792 1.00 51.74 C ATOM 1615 CZ TYR A 400 -18.208 21.068 21.251 1.00 51.70 C ATOM 1616 OH TYR A 400 -18.252 22.375 20.828 1.00 51.80 O ATOM 0 H TYR A 400 -16.304 16.985 20.845 1.00 49.02 H new ATOM 0 HA TYR A 400 -16.223 16.864 23.463 1.00 49.39 H new ATOM 0 HB2 TYR A 400 -18.569 16.434 21.951 1.00 50.89 H new ATOM 0 HB3 TYR A 400 -18.523 16.914 23.434 1.00 50.89 H new ATOM 0 HD1 TYR A 400 -20.036 18.416 21.475 1.00 51.73 H new ATOM 0 HD2 TYR A 400 -16.223 18.914 22.586 1.00 51.73 H new ATOM 0 HE1 TYR A 400 -20.116 20.615 20.773 1.00 51.91 H new ATOM 0 HE2 TYR A 400 -16.292 21.106 21.869 1.00 51.74 H new ATOM 0 HH TYR A 400 -17.505 22.737 20.959 1.00 51.80 H new ATOM 1617 N PHE A 401 -16.838 14.127 21.955 1.00 47.98 N ATOM 1618 CA PHE A 401 -16.846 12.683 22.115 1.00 46.95 C ATOM 1619 C PHE A 401 -15.579 12.207 22.820 1.00 46.89 C ATOM 1620 O PHE A 401 -15.645 11.480 23.810 1.00 46.75 O ATOM 1621 CB PHE A 401 -16.978 11.980 20.769 1.00 46.29 C ATOM 1622 CG PHE A 401 -17.007 10.486 20.881 1.00 46.23 C ATOM 1623 CD1 PHE A 401 -18.205 9.820 21.078 1.00 46.21 C ATOM 1624 CD2 PHE A 401 -15.839 9.749 20.815 1.00 46.21 C ATOM 1625 CE1 PHE A 401 -18.238 8.447 21.190 1.00 46.34 C ATOM 1626 CE2 PHE A 401 -15.867 8.374 20.933 1.00 46.61 C ATOM 1627 CZ PHE A 401 -17.073 7.722 21.122 1.00 46.22 C ATOM 0 H PHE A 401 -16.919 14.400 21.143 1.00 47.98 H new ATOM 0 HA PHE A 401 -17.615 12.456 22.661 1.00 46.95 H new ATOM 0 HB2 PHE A 401 -17.790 12.281 20.332 1.00 46.29 H new ATOM 0 HB3 PHE A 401 -16.237 12.241 20.201 1.00 46.29 H new ATOM 0 HD1 PHE A 401 -18.996 10.305 21.135 1.00 46.21 H new ATOM 0 HD2 PHE A 401 -15.027 10.184 20.690 1.00 46.21 H new ATOM 0 HE1 PHE A 401 -19.050 8.010 21.312 1.00 46.34 H new ATOM 0 HE2 PHE A 401 -15.076 7.886 20.886 1.00 46.61 H new ATOM 0 HZ PHE A 401 -17.095 6.796 21.203 1.00 46.22 H new ATOM 1628 N PHE A 402 -14.425 12.608 22.295 1.00 46.92 N ATOM 1629 CA PHE A 402 -13.150 12.239 22.897 1.00 47.24 C ATOM 1630 C PHE A 402 -12.991 12.831 24.308 1.00 48.22 C ATOM 1631 O PHE A 402 -12.309 12.262 25.158 1.00 48.46 O ATOM 1632 CB PHE A 402 -11.985 12.630 21.979 1.00 45.97 C ATOM 1633 CG PHE A 402 -11.901 11.806 20.721 1.00 45.23 C ATOM 1634 CD1 PHE A 402 -11.687 12.409 19.486 1.00 45.30 C ATOM 1635 CD2 PHE A 402 -12.040 10.427 20.771 1.00 44.98 C ATOM 1636 CE1 PHE A 402 -11.611 11.649 18.322 1.00 44.53 C ATOM 1637 CE2 PHE A 402 -11.971 9.660 19.616 1.00 44.60 C ATOM 1638 CZ PHE A 402 -11.754 10.276 18.387 1.00 44.98 C ATOM 0 H PHE A 402 -14.360 13.095 21.589 1.00 46.92 H new ATOM 0 HA PHE A 402 -13.137 11.274 22.999 1.00 47.24 H new ATOM 0 HB2 PHE A 402 -12.074 13.565 21.738 1.00 45.97 H new ATOM 0 HB3 PHE A 402 -11.153 12.541 22.470 1.00 45.97 H new ATOM 0 HD1 PHE A 402 -11.593 13.333 19.437 1.00 45.30 H new ATOM 0 HD2 PHE A 402 -12.181 10.010 21.590 1.00 44.98 H new ATOM 0 HE1 PHE A 402 -11.464 12.064 17.503 1.00 44.53 H new ATOM 0 HE2 PHE A 402 -12.070 8.736 19.663 1.00 44.60 H new ATOM 0 HZ PHE A 402 -11.705 9.765 17.612 1.00 44.98 H new ATOM 1639 N GLU A 403 -13.644 13.961 24.557 1.00 49.55 N ATOM 1640 CA GLU A 403 -13.631 14.567 25.880 1.00 51.03 C ATOM 1641 C GLU A 403 -14.462 13.741 26.867 1.00 51.09 C ATOM 1642 O GLU A 403 -14.075 13.565 28.030 1.00 51.95 O ATOM 1643 CB GLU A 403 -14.119 16.018 25.820 1.00 52.28 C ATOM 1644 CG GLU A 403 -14.117 16.735 27.161 1.00 54.42 C ATOM 1645 CD GLU A 403 -12.837 16.506 27.946 1.00 55.93 C ATOM 1646 OE1 GLU A 403 -11.753 16.444 27.318 1.00 56.97 O ATOM 1647 OE2 GLU A 403 -12.911 16.386 29.194 1.00 56.98 O ATOM 0 H GLU A 403 -14.102 14.393 23.971 1.00 49.55 H new ATOM 0 HA GLU A 403 -12.715 14.576 26.200 1.00 51.03 H new ATOM 0 HB2 GLU A 403 -13.559 16.511 25.201 1.00 52.28 H new ATOM 0 HB3 GLU A 403 -15.020 16.031 25.460 1.00 52.28 H new ATOM 0 HG2 GLU A 403 -14.237 17.686 27.015 1.00 54.42 H new ATOM 0 HG3 GLU A 403 -14.873 16.431 27.687 1.00 54.42 H new ATOM 1648 N ALA A 404 -15.594 13.223 26.399 1.00 49.92 N ATOM 1649 CA ALA A 404 -16.413 12.342 27.215 1.00 49.06 C ATOM 1650 C ALA A 404 -15.677 11.037 27.523 1.00 49.07 C ATOM 1651 O ALA A 404 -15.722 10.552 28.654 1.00 49.06 O ATOM 1652 CB ALA A 404 -17.748 12.071 26.538 1.00 48.71 C ATOM 0 H ALA A 404 -15.903 13.371 25.610 1.00 49.92 H new ATOM 0 HA ALA A 404 -16.588 12.788 28.059 1.00 49.06 H new ATOM 0 HB1 ALA A 404 -18.280 11.482 27.096 1.00 48.71 H new ATOM 0 HB2 ALA A 404 -18.221 12.908 26.408 1.00 48.71 H new ATOM 0 HB3 ALA A 404 -17.595 11.650 25.678 1.00 48.71 H new ATOM 1653 N CYS A 405 -14.992 10.480 26.524 1.00 48.49 N ATOM 1654 CA CYS A 405 -14.202 9.255 26.707 1.00 48.58 C ATOM 1655 C CYS A 405 -13.208 9.410 27.851 1.00 49.26 C ATOM 1656 O CYS A 405 -13.173 8.604 28.784 1.00 49.36 O ATOM 1657 CB CYS A 405 -13.429 8.911 25.425 1.00 47.73 C ATOM 1658 SG CYS A 405 -14.403 8.142 24.111 1.00 46.57 S ATOM 0 H CYS A 405 -14.970 10.797 25.725 1.00 48.49 H new ATOM 0 HA CYS A 405 -14.823 8.540 26.916 1.00 48.58 H new ATOM 0 HB2 CYS A 405 -13.032 9.725 25.078 1.00 47.73 H new ATOM 0 HB3 CYS A 405 -12.699 8.315 25.656 1.00 47.73 H new ATOM 0 HG CYS A 405 -14.558 8.926 23.216 1.00 46.57 H new ATOM 1659 N ARG A 406 -12.391 10.452 27.735 1.00 50.36 N ATOM 1660 CA ARG A 406 -11.381 10.829 28.711 1.00 51.30 C ATOM 1661 C ARG A 406 -11.975 10.798 30.111 1.00 51.32 C ATOM 1662 O ARG A 406 -11.498 10.087 30.994 1.00 51.99 O ATOM 1663 CB ARG A 406 -10.905 12.252 28.395 1.00 51.62 C ATOM 1664 CG ARG A 406 -9.394 12.483 28.407 1.00 51.84 C ATOM 1665 CD ARG A 406 -9.085 13.974 28.213 1.00 51.91 C ATOM 1666 NE ARG A 406 -7.690 14.234 27.851 1.00 52.73 N ATOM 1667 CZ ARG A 406 -7.163 15.453 27.709 1.00 52.81 C ATOM 1668 NH1 ARG A 406 -7.908 16.536 27.904 1.00 53.06 N ATOM 1669 NH2 ARG A 406 -5.886 15.592 27.379 1.00 52.60 N ATOM 0 H ARG A 406 -12.413 10.979 27.056 1.00 50.36 H new ATOM 0 HA ARG A 406 -10.638 10.207 28.670 1.00 51.30 H new ATOM 0 HB2 ARG A 406 -11.243 12.498 27.520 1.00 51.62 H new ATOM 0 HB3 ARG A 406 -11.310 12.857 29.036 1.00 51.62 H new ATOM 0 HG2 ARG A 406 -9.019 12.175 29.247 1.00 51.84 H new ATOM 0 HG3 ARG A 406 -8.975 11.965 27.702 1.00 51.84 H new ATOM 0 HD2 ARG A 406 -9.664 14.331 27.521 1.00 51.91 H new ATOM 0 HD3 ARG A 406 -9.294 14.450 29.032 1.00 51.91 H new ATOM 0 HE ARG A 406 -7.176 13.557 27.721 1.00 52.73 H new ATOM 0 HH11 ARG A 406 -8.736 16.455 28.123 1.00 53.06 H new ATOM 0 HH12 ARG A 406 -7.563 17.318 27.811 1.00 53.06 H new ATOM 0 HH21 ARG A 406 -5.395 14.896 27.256 1.00 52.60 H new ATOM 0 HH22 ARG A 406 -5.548 16.378 27.288 1.00 52.60 H new ATOM 1670 N LEU A 407 -13.038 11.571 30.289 1.00 51.20 N ATOM 1671 CA LEU A 407 -13.667 11.782 31.583 1.00 51.08 C ATOM 1672 C LEU A 407 -14.316 10.537 32.204 1.00 51.41 C ATOM 1673 O LEU A 407 -14.383 10.417 33.428 1.00 51.39 O ATOM 1674 CB LEU A 407 -14.700 12.903 31.457 1.00 51.07 C ATOM 1675 CG LEU A 407 -15.203 13.564 32.738 1.00 51.24 C ATOM 1676 CD1 LEU A 407 -15.353 15.063 32.542 1.00 50.94 C ATOM 1677 CD2 LEU A 407 -16.516 12.938 33.162 1.00 51.54 C ATOM 0 H LEU A 407 -13.421 11.996 29.647 1.00 51.20 H new ATOM 0 HA LEU A 407 -12.952 12.022 32.193 1.00 51.08 H new ATOM 0 HB2 LEU A 407 -14.319 13.596 30.895 1.00 51.07 H new ATOM 0 HB3 LEU A 407 -15.469 12.546 30.985 1.00 51.07 H new ATOM 0 HG LEU A 407 -14.552 13.420 33.443 1.00 51.24 H new ATOM 0 HD11 LEU A 407 -15.673 15.467 33.364 1.00 50.94 H new ATOM 0 HD12 LEU A 407 -14.494 15.446 32.307 1.00 50.94 H new ATOM 0 HD13 LEU A 407 -15.989 15.234 31.830 1.00 50.94 H new ATOM 0 HD21 LEU A 407 -16.829 13.363 33.976 1.00 51.54 H new ATOM 0 HD22 LEU A 407 -17.174 13.060 32.460 1.00 51.54 H new ATOM 0 HD23 LEU A 407 -16.386 11.990 33.322 1.00 51.54 H new ATOM 1678 N LEU A 408 -14.802 9.617 31.374 1.00 51.02 N ATOM 1679 CA LEU A 408 -15.448 8.415 31.891 1.00 50.77 C ATOM 1680 C LEU A 408 -14.440 7.344 32.307 1.00 50.76 C ATOM 1681 O LEU A 408 -14.704 6.544 33.209 1.00 50.57 O ATOM 1682 CB LEU A 408 -16.456 7.860 30.885 1.00 50.68 C ATOM 1683 CG LEU A 408 -17.705 8.730 30.704 1.00 50.89 C ATOM 1684 CD1 LEU A 408 -18.750 8.021 29.865 1.00 50.73 C ATOM 1685 CD2 LEU A 408 -18.292 9.113 32.052 1.00 50.80 C ATOM 0 H LEU A 408 -14.768 9.669 30.516 1.00 51.02 H new ATOM 0 HA LEU A 408 -15.928 8.675 32.693 1.00 50.77 H new ATOM 0 HB2 LEU A 408 -16.018 7.758 30.026 1.00 50.68 H new ATOM 0 HB3 LEU A 408 -16.729 6.974 31.171 1.00 50.68 H new ATOM 0 HG LEU A 408 -17.436 9.537 30.238 1.00 50.89 H new ATOM 0 HD11 LEU A 408 -19.528 8.592 29.766 1.00 50.73 H new ATOM 0 HD12 LEU A 408 -18.382 7.822 28.990 1.00 50.73 H new ATOM 0 HD13 LEU A 408 -19.009 7.195 30.301 1.00 50.73 H new ATOM 0 HD21 LEU A 408 -19.080 9.662 31.918 1.00 50.80 H new ATOM 0 HD22 LEU A 408 -18.537 8.310 32.538 1.00 50.80 H new ATOM 0 HD23 LEU A 408 -17.634 9.611 32.562 1.00 50.80 H new ATOM 1686 N GLN A 409 -13.281 7.347 31.655 1.00 50.67 N ATOM 1687 CA GLN A 409 -12.240 6.365 31.923 1.00 50.52 C ATOM 1688 C GLN A 409 -11.216 6.922 32.914 1.00 50.87 C ATOM 1689 O GLN A 409 -10.414 6.174 33.476 1.00 50.75 O ATOM 1690 CB GLN A 409 -11.574 5.924 30.608 1.00 50.18 C ATOM 1691 CG GLN A 409 -10.415 4.932 30.744 1.00 49.85 C ATOM 1692 CD GLN A 409 -10.853 3.513 31.069 1.00 49.51 C ATOM 1693 OE1 GLN A 409 -12.132 3.221 30.871 1.00 49.47 O flip ATOM 1694 NE2 GLN A 409 -10.041 2.689 31.490 1.00 49.12 N flip ATOM 0 H GLN A 409 -13.078 7.919 31.046 1.00 50.67 H new ATOM 0 HA GLN A 409 -12.643 5.582 32.330 1.00 50.52 H new ATOM 0 HB2 GLN A 409 -12.252 5.526 30.040 1.00 50.18 H new ATOM 0 HB3 GLN A 409 -11.248 6.714 30.150 1.00 50.18 H new ATOM 0 HG2 GLN A 409 -9.910 4.923 29.916 1.00 49.85 H new ATOM 0 HG3 GLN A 409 -9.815 5.243 31.440 1.00 49.85 H new ATOM 0 HE21 GLN A 409 -9.219 2.915 31.606 1.00 49.12 H new ATOM 0 HE22 GLN A 409 -10.295 1.887 31.668 1.00 49.12 H new ATOM 1695 N LYS A 410 -11.267 8.232 33.147 1.00 51.18 N ATOM 1696 CA LYS A 410 -10.361 8.880 34.099 1.00 51.52 C ATOM 1697 C LYS A 410 -8.922 8.506 33.776 1.00 51.79 C ATOM 1698 O LYS A 410 -8.247 7.841 34.558 1.00 51.63 O ATOM 1699 CB LYS A 410 -10.694 8.472 35.538 1.00 51.53 C ATOM 1700 CG LYS A 410 -9.877 9.197 36.600 1.00 51.25 C ATOM 1701 CD LYS A 410 -10.083 8.584 37.973 1.00 51.40 C ATOM 1702 CE LYS A 410 -9.441 9.436 39.059 1.00 51.37 C ATOM 1703 NZ LYS A 410 -9.800 8.969 40.425 1.00 51.38 N ATOM 0 H LYS A 410 -11.821 8.767 32.763 1.00 51.18 H new ATOM 0 HA LYS A 410 -10.472 9.841 34.021 1.00 51.52 H new ATOM 0 HB2 LYS A 410 -11.636 8.638 35.700 1.00 51.53 H new ATOM 0 HB3 LYS A 410 -10.554 7.517 35.633 1.00 51.53 H new ATOM 0 HG2 LYS A 410 -8.936 9.162 36.366 1.00 51.25 H new ATOM 0 HG3 LYS A 410 -10.129 10.133 36.621 1.00 51.25 H new ATOM 0 HD2 LYS A 410 -11.032 8.492 38.150 1.00 51.40 H new ATOM 0 HD3 LYS A 410 -9.703 7.692 37.992 1.00 51.40 H new ATOM 0 HE2 LYS A 410 -8.477 9.417 38.955 1.00 51.37 H new ATOM 0 HE3 LYS A 410 -9.719 10.359 38.951 1.00 51.37 H new ATOM 0 HZ1 LYS A 410 -9.407 9.490 41.030 1.00 51.38 H new ATOM 0 HZ2 LYS A 410 -10.683 9.007 40.530 1.00 51.38 H new ATOM 0 HZ3 LYS A 410 -9.525 8.130 40.534 1.00 51.38 H new ATOM 1704 N MET A 411 -8.459 8.935 32.610 1.00 52.11 N ATOM 1705 CA MET A 411 -7.177 8.482 32.104 1.00 52.29 C ATOM 1706 C MET A 411 -6.024 9.395 32.489 1.00 52.35 C ATOM 1707 O MET A 411 -6.235 10.519 32.942 1.00 52.43 O ATOM 1708 CB MET A 411 -7.258 8.301 30.591 1.00 52.02 C ATOM 1709 CG MET A 411 -7.993 7.040 30.217 1.00 52.18 C ATOM 1710 SD MET A 411 -8.506 6.939 28.503 1.00 52.46 S ATOM 1711 CE MET A 411 -9.903 8.053 28.507 1.00 52.81 C ATOM 0 H MET A 411 -8.873 9.488 32.098 1.00 52.11 H new ATOM 0 HA MET A 411 -6.985 7.628 32.523 1.00 52.29 H new ATOM 0 HB2 MET A 411 -7.706 9.066 30.197 1.00 52.02 H new ATOM 0 HB3 MET A 411 -6.362 8.275 30.220 1.00 52.02 H new ATOM 0 HG2 MET A 411 -7.424 6.280 30.415 1.00 52.18 H new ATOM 0 HG3 MET A 411 -8.779 6.961 30.780 1.00 52.18 H new ATOM 0 HE1 MET A 411 -10.714 7.556 28.319 1.00 52.81 H new ATOM 0 HE2 MET A 411 -9.978 8.476 29.377 1.00 52.81 H new ATOM 0 HE3 MET A 411 -9.777 8.733 27.827 1.00 52.81 H new ATOM 1712 N ILE A 412 -4.805 8.890 32.317 1.00 52.47 N ATOM 1713 CA ILE A 412 -3.592 9.660 32.579 1.00 52.38 C ATOM 1714 C ILE A 412 -3.669 11.010 31.864 1.00 52.47 C ATOM 1715 O ILE A 412 -4.313 11.123 30.815 1.00 52.38 O ATOM 1716 CB ILE A 412 -2.326 8.908 32.088 1.00 52.38 C ATOM 1717 CG1 ILE A 412 -2.512 7.386 32.184 1.00 52.32 C ATOM 1718 CG2 ILE A 412 -1.085 9.374 32.859 1.00 52.38 C ATOM 1719 CD1 ILE A 412 -2.336 6.815 33.583 1.00 52.23 C ATOM 0 H ILE A 412 -4.658 8.088 32.044 1.00 52.47 H new ATOM 0 HA ILE A 412 -3.527 9.789 33.538 1.00 52.38 H new ATOM 0 HB ILE A 412 -2.191 9.123 31.152 1.00 52.38 H new ATOM 0 HG12 ILE A 412 -3.399 7.159 31.864 1.00 52.32 H new ATOM 0 HG13 ILE A 412 -1.877 6.956 31.589 1.00 52.32 H new ATOM 0 HG21 ILE A 412 -0.306 8.894 32.539 1.00 52.38 H new ATOM 0 HG22 ILE A 412 -0.957 10.326 32.722 1.00 52.38 H new ATOM 0 HG23 ILE A 412 -1.207 9.198 33.805 1.00 52.38 H new ATOM 0 HD11 ILE A 412 -2.469 5.854 33.560 1.00 52.23 H new ATOM 0 HD12 ILE A 412 -1.441 7.010 33.902 1.00 52.23 H new ATOM 0 HD13 ILE A 412 -2.986 7.216 34.181 1.00 52.23 H new ATOM 1720 N ASP A 413 -3.019 12.030 32.426 1.00 52.55 N ATOM 1721 CA ASP A 413 -3.023 13.359 31.809 1.00 52.43 C ATOM 1722 C ASP A 413 -2.176 13.410 30.531 1.00 51.98 C ATOM 1723 O ASP A 413 -1.055 13.922 30.518 1.00 52.43 O ATOM 1724 CB ASP A 413 -2.640 14.465 32.810 1.00 52.77 C ATOM 1725 CG ASP A 413 -1.278 14.244 33.459 1.00 53.15 C ATOM 1726 OD1 ASP A 413 -1.017 14.871 34.511 1.00 53.29 O ATOM 1727 OD2 ASP A 413 -0.464 13.455 32.926 1.00 53.32 O ATOM 0 H ASP A 413 -2.573 11.975 33.159 1.00 52.55 H new ATOM 0 HA ASP A 413 -3.937 13.536 31.538 1.00 52.43 H new ATOM 0 HB2 ASP A 413 -2.639 15.320 32.353 1.00 52.77 H new ATOM 0 HB3 ASP A 413 -3.317 14.515 33.503 1.00 52.77 H new ATOM 1728 N ILE A 414 -2.747 12.867 29.461 1.00 51.49 N ATOM 1729 CA ILE A 414 -2.104 12.761 28.158 1.00 51.03 C ATOM 1730 C ILE A 414 -3.222 12.771 27.114 1.00 50.45 C ATOM 1731 O ILE A 414 -4.284 12.193 27.335 1.00 49.74 O ATOM 1732 CB ILE A 414 -1.308 11.431 28.039 1.00 51.16 C ATOM 1733 CG1 ILE A 414 -0.022 11.472 28.873 1.00 51.33 C ATOM 1734 CG2 ILE A 414 -0.968 11.122 26.594 1.00 51.15 C ATOM 1735 CD1 ILE A 414 1.167 12.127 28.171 1.00 51.64 C ATOM 0 H ILE A 414 -3.543 12.541 29.474 1.00 51.49 H new ATOM 0 HA ILE A 414 -1.481 13.493 28.030 1.00 51.03 H new ATOM 0 HB ILE A 414 -1.879 10.727 28.384 1.00 51.16 H new ATOM 0 HG12 ILE A 414 -0.200 11.950 29.698 1.00 51.33 H new ATOM 0 HG13 ILE A 414 0.221 10.565 29.118 1.00 51.33 H new ATOM 0 HG21 ILE A 414 -0.473 10.289 26.549 1.00 51.15 H new ATOM 0 HG22 ILE A 414 -1.786 11.040 26.079 1.00 51.15 H new ATOM 0 HG23 ILE A 414 -0.427 11.839 26.228 1.00 51.15 H new ATOM 0 HD11 ILE A 414 1.938 12.114 28.760 1.00 51.64 H new ATOM 0 HD12 ILE A 414 1.373 11.638 27.359 1.00 51.64 H new ATOM 0 HD13 ILE A 414 0.946 13.045 27.948 1.00 51.64 H new ATOM 1736 N SER A 415 -2.995 13.452 25.994 1.00 50.13 N ATOM 1737 CA SER A 415 -3.978 13.513 24.912 1.00 49.92 C ATOM 1738 C SER A 415 -4.059 12.181 24.168 1.00 49.76 C ATOM 1739 O SER A 415 -3.180 11.328 24.322 1.00 49.21 O ATOM 1740 CB SER A 415 -3.615 14.624 23.929 1.00 50.09 C ATOM 1741 OG SER A 415 -2.332 14.401 23.360 1.00 50.52 O ATOM 0 H SER A 415 -2.271 13.890 25.839 1.00 50.13 H new ATOM 0 HA SER A 415 -4.844 13.701 25.307 1.00 49.92 H new ATOM 0 HB2 SER A 415 -4.281 14.668 23.225 1.00 50.09 H new ATOM 0 HB3 SER A 415 -3.626 15.480 24.385 1.00 50.09 H new ATOM 0 HG SER A 415 -2.405 14.318 22.527 1.00 50.52 H new ATOM 1742 N LEU A 416 -5.107 12.007 23.362 1.00 49.57 N ATOM 1743 CA LEU A 416 -5.265 10.786 22.572 1.00 49.63 C ATOM 1744 C LEU A 416 -4.116 10.552 21.589 1.00 50.24 C ATOM 1745 O LEU A 416 -3.657 9.426 21.438 1.00 49.85 O ATOM 1746 CB LEU A 416 -6.603 10.755 21.829 1.00 49.00 C ATOM 1747 CG LEU A 416 -6.825 9.556 20.892 1.00 48.50 C ATOM 1748 CD1 LEU A 416 -6.622 8.225 21.599 1.00 48.46 C ATOM 1749 CD2 LEU A 416 -8.209 9.616 20.253 1.00 49.20 C ATOM 0 H LEU A 416 -5.737 12.583 23.259 1.00 49.57 H new ATOM 0 HA LEU A 416 -5.248 10.061 23.216 1.00 49.63 H new ATOM 0 HB2 LEU A 416 -7.317 10.767 22.485 1.00 49.00 H new ATOM 0 HB3 LEU A 416 -6.683 11.569 21.308 1.00 49.00 H new ATOM 0 HG LEU A 416 -6.154 9.616 20.194 1.00 48.50 H new ATOM 0 HD11 LEU A 416 -6.772 7.500 20.973 1.00 48.46 H new ATOM 0 HD12 LEU A 416 -5.716 8.175 21.941 1.00 48.46 H new ATOM 0 HD13 LEU A 416 -7.249 8.150 22.335 1.00 48.46 H new ATOM 0 HD21 LEU A 416 -8.328 8.852 19.667 1.00 49.20 H new ATOM 0 HD22 LEU A 416 -8.887 9.600 20.947 1.00 49.20 H new ATOM 0 HD23 LEU A 416 -8.293 10.434 19.739 1.00 49.20 H new ATOM 1750 N ASP A 417 -3.650 11.598 20.912 1.00 51.39 N ATOM 1751 CA ASP A 417 -2.518 11.397 20.009 1.00 52.51 C ATOM 1752 C ASP A 417 -1.228 11.113 20.777 1.00 51.69 C ATOM 1753 O ASP A 417 -0.305 10.515 20.241 1.00 51.86 O ATOM 1754 CB ASP A 417 -2.356 12.527 18.985 1.00 54.01 C ATOM 1755 CG ASP A 417 -2.986 13.813 19.430 1.00 55.85 C ATOM 1756 OD1 ASP A 417 -2.840 14.166 20.621 1.00 56.84 O ATOM 1757 OD2 ASP A 417 -3.629 14.479 18.585 1.00 56.95 O ATOM 0 H ASP A 417 -3.958 12.400 20.956 1.00 51.39 H new ATOM 0 HA ASP A 417 -2.720 10.604 19.488 1.00 52.51 H new ATOM 0 HB2 ASP A 417 -1.412 12.675 18.820 1.00 54.01 H new ATOM 0 HB3 ASP A 417 -2.751 12.253 18.143 1.00 54.01 H new ATOM 1758 N GLY A 418 -1.180 11.532 22.036 1.00 51.24 N ATOM 1759 CA GLY A 418 -0.069 11.186 22.910 1.00 50.68 C ATOM 1760 C GLY A 418 -0.131 9.713 23.281 1.00 50.22 C ATOM 1761 O GLY A 418 0.878 9.011 23.261 1.00 50.10 O ATOM 0 H GLY A 418 -1.785 12.020 22.404 1.00 51.24 H new ATOM 0 HA2 GLY A 418 0.772 11.380 22.467 1.00 50.68 H new ATOM 0 HA3 GLY A 418 -0.099 11.730 23.713 1.00 50.68 H new ATOM 1762 N PHE A 419 -1.331 9.258 23.630 1.00 49.54 N ATOM 1763 CA PHE A 419 -1.603 7.850 23.868 1.00 48.89 C ATOM 1764 C PHE A 419 -1.191 7.005 22.654 1.00 48.04 C ATOM 1765 O PHE A 419 -0.577 5.953 22.799 1.00 47.79 O ATOM 1766 CB PHE A 419 -3.100 7.640 24.153 1.00 49.07 C ATOM 1767 CG PHE A 419 -3.488 7.762 25.611 1.00 49.37 C ATOM 1768 CD1 PHE A 419 -4.406 8.720 26.021 1.00 50.24 C ATOM 1769 CD2 PHE A 419 -2.968 6.898 26.560 1.00 49.47 C ATOM 1770 CE1 PHE A 419 -4.786 8.831 27.365 1.00 50.28 C ATOM 1771 CE2 PHE A 419 -3.336 6.998 27.900 1.00 49.53 C ATOM 1772 CZ PHE A 419 -4.248 7.967 28.304 1.00 49.74 C ATOM 0 H PHE A 419 -2.016 9.767 23.736 1.00 49.54 H new ATOM 0 HA PHE A 419 -1.085 7.568 24.638 1.00 48.89 H new ATOM 0 HB2 PHE A 419 -3.609 8.287 23.640 1.00 49.07 H new ATOM 0 HB3 PHE A 419 -3.357 6.761 23.835 1.00 49.07 H new ATOM 0 HD1 PHE A 419 -4.775 9.298 25.393 1.00 50.24 H new ATOM 0 HD2 PHE A 419 -2.364 6.241 26.299 1.00 49.47 H new ATOM 0 HE1 PHE A 419 -5.397 9.482 27.625 1.00 50.28 H new ATOM 0 HE2 PHE A 419 -2.971 6.415 28.526 1.00 49.53 H new ATOM 0 HZ PHE A 419 -4.495 8.034 29.198 1.00 49.74 H new ATOM 1773 N LEU A 420 -1.542 7.467 21.460 1.00 47.03 N ATOM 1774 CA LEU A 420 -1.356 6.671 20.251 1.00 46.99 C ATOM 1775 C LEU A 420 0.095 6.600 19.765 1.00 47.30 C ATOM 1776 O LEU A 420 0.453 5.714 19.000 1.00 47.04 O ATOM 1777 CB LEU A 420 -2.306 7.135 19.140 1.00 46.27 C ATOM 1778 CG LEU A 420 -3.782 6.814 19.416 1.00 45.89 C ATOM 1779 CD1 LEU A 420 -4.681 7.445 18.374 1.00 45.62 C ATOM 1780 CD2 LEU A 420 -4.029 5.299 19.496 1.00 45.18 C ATOM 0 H LEU A 420 -1.891 8.242 21.327 1.00 47.03 H new ATOM 0 HA LEU A 420 -1.584 5.760 20.493 1.00 46.99 H new ATOM 0 HB2 LEU A 420 -2.208 8.093 19.021 1.00 46.27 H new ATOM 0 HB3 LEU A 420 -2.043 6.717 18.305 1.00 46.27 H new ATOM 0 HG LEU A 420 -4.001 7.195 20.281 1.00 45.89 H new ATOM 0 HD11 LEU A 420 -5.606 7.228 18.570 1.00 45.62 H new ATOM 0 HD12 LEU A 420 -4.565 8.408 18.387 1.00 45.62 H new ATOM 0 HD13 LEU A 420 -4.448 7.104 17.496 1.00 45.62 H new ATOM 0 HD21 LEU A 420 -4.969 5.133 19.671 1.00 45.18 H new ATOM 0 HD22 LEU A 420 -3.779 4.885 18.655 1.00 45.18 H new ATOM 0 HD23 LEU A 420 -3.496 4.921 20.213 1.00 45.18 H new ATOM 1781 N LEU A 421 0.921 7.535 20.224 1.00 48.17 N ATOM 1782 CA LEU A 421 2.360 7.515 19.962 1.00 49.18 C ATOM 1783 C LEU A 421 3.055 6.510 20.889 1.00 48.93 C ATOM 1784 O LEU A 421 4.186 6.102 20.667 1.00 48.08 O ATOM 1785 CB LEU A 421 2.923 8.914 20.198 1.00 49.89 C ATOM 1786 CG LEU A 421 4.261 9.351 19.586 1.00 50.67 C ATOM 1787 CD1 LEU A 421 4.409 8.949 18.121 1.00 50.18 C ATOM 1788 CD2 LEU A 421 4.395 10.867 19.731 1.00 50.48 C ATOM 0 H LEU A 421 0.662 8.204 20.699 1.00 48.17 H new ATOM 0 HA LEU A 421 2.518 7.246 19.044 1.00 49.18 H new ATOM 0 HB2 LEU A 421 2.253 9.544 19.890 1.00 49.89 H new ATOM 0 HB3 LEU A 421 3.001 9.029 21.158 1.00 49.89 H new ATOM 0 HG LEU A 421 4.969 8.894 20.066 1.00 50.67 H new ATOM 0 HD11 LEU A 421 5.269 9.249 17.788 1.00 50.18 H new ATOM 0 HD12 LEU A 421 4.352 7.984 18.043 1.00 50.18 H new ATOM 0 HD13 LEU A 421 3.700 9.358 17.600 1.00 50.18 H new ATOM 0 HD21 LEU A 421 5.238 11.156 19.347 1.00 50.48 H new ATOM 0 HD22 LEU A 421 3.663 11.303 19.267 1.00 50.48 H new ATOM 0 HD23 LEU A 421 4.369 11.106 20.671 1.00 50.48 H new ATOM 1789 N THR A 422 2.345 6.105 21.930 1.00 49.14 N ATOM 1790 CA THR A 422 2.923 5.315 23.009 1.00 49.13 C ATOM 1791 C THR A 422 3.563 3.982 22.523 1.00 48.82 C ATOM 1792 O THR A 422 4.683 3.639 22.920 1.00 48.23 O ATOM 1793 CB THR A 422 1.865 5.183 24.151 1.00 49.65 C ATOM 1794 OG1 THR A 422 2.328 5.850 25.336 1.00 51.11 O ATOM 1795 CG2 THR A 422 1.449 3.766 24.425 1.00 48.88 C ATOM 0 H THR A 422 1.509 6.281 22.033 1.00 49.14 H new ATOM 0 HA THR A 422 3.690 5.777 23.382 1.00 49.13 H new ATOM 0 HB THR A 422 1.058 5.624 23.842 1.00 49.65 H new ATOM 0 HG1 THR A 422 1.752 5.775 25.943 1.00 51.11 H new ATOM 0 HG21 THR A 422 0.794 3.753 25.141 1.00 48.88 H new ATOM 0 HG22 THR A 422 1.059 3.382 23.624 1.00 48.88 H new ATOM 0 HG23 THR A 422 2.224 3.246 24.688 1.00 48.88 H new ATOM 1796 N PRO A 423 2.875 3.234 21.641 1.00 48.21 N ATOM 1797 CA PRO A 423 3.571 2.051 21.112 1.00 48.23 C ATOM 1798 C PRO A 423 4.812 2.369 20.278 1.00 48.28 C ATOM 1799 O PRO A 423 5.748 1.566 20.245 1.00 48.79 O ATOM 1800 CB PRO A 423 2.497 1.366 20.252 1.00 47.95 C ATOM 1801 CG PRO A 423 1.193 1.915 20.778 1.00 47.02 C ATOM 1802 CD PRO A 423 1.502 3.331 21.119 1.00 47.21 C ATOM 0 HA PRO A 423 3.919 1.503 21.833 1.00 48.23 H new ATOM 0 HB2 PRO A 423 2.613 1.570 19.311 1.00 47.95 H new ATOM 0 HB3 PRO A 423 2.536 0.401 20.339 1.00 47.95 H new ATOM 0 HG2 PRO A 423 0.490 1.856 20.112 1.00 47.02 H new ATOM 0 HG3 PRO A 423 0.889 1.422 21.556 1.00 47.02 H new ATOM 0 HD2 PRO A 423 1.450 3.910 20.343 1.00 47.21 H new ATOM 0 HD3 PRO A 423 0.888 3.687 21.780 1.00 47.21 H new ATOM 1803 N VAL A 424 4.837 3.520 19.614 1.00 47.93 N ATOM 1804 CA VAL A 424 6.013 3.889 18.831 1.00 47.67 C ATOM 1805 C VAL A 424 7.203 4.252 19.726 1.00 48.69 C ATOM 1806 O VAL A 424 8.349 3.925 19.405 1.00 47.36 O ATOM 1807 CB VAL A 424 5.731 5.043 17.866 1.00 47.44 C ATOM 1808 CG1 VAL A 424 6.777 5.047 16.747 1.00 47.06 C ATOM 1809 CG2 VAL A 424 4.325 4.924 17.295 1.00 46.68 C ATOM 0 H VAL A 424 4.196 4.093 19.602 1.00 47.93 H new ATOM 0 HA VAL A 424 6.240 3.103 18.310 1.00 47.67 H new ATOM 0 HB VAL A 424 5.788 5.883 18.347 1.00 47.44 H new ATOM 0 HG11 VAL A 424 6.596 5.779 16.137 1.00 47.06 H new ATOM 0 HG12 VAL A 424 7.661 5.157 17.131 1.00 47.06 H new ATOM 0 HG13 VAL A 424 6.737 4.207 16.264 1.00 47.06 H new ATOM 0 HG21 VAL A 424 4.159 5.661 16.686 1.00 46.68 H new ATOM 0 HG22 VAL A 424 4.240 4.084 16.817 1.00 46.68 H new ATOM 0 HG23 VAL A 424 3.679 4.951 18.018 1.00 46.68 H new ATOM 1810 N GLN A 425 6.938 4.929 20.843 1.00 49.57 N ATOM 1811 CA GLN A 425 8.010 5.232 21.790 1.00 51.26 C ATOM 1812 C GLN A 425 8.577 3.949 22.373 1.00 50.87 C ATOM 1813 O GLN A 425 9.786 3.796 22.474 1.00 51.08 O ATOM 1814 CB GLN A 425 7.530 6.130 22.931 1.00 51.91 C ATOM 1815 CG GLN A 425 6.707 7.322 22.508 1.00 52.91 C ATOM 1816 CD GLN A 425 6.307 8.185 23.690 1.00 53.35 C ATOM 1817 OE1 GLN A 425 5.195 8.069 24.212 1.00 54.55 O ATOM 1818 NE2 GLN A 425 7.221 9.051 24.130 1.00 54.11 N ATOM 0 H GLN A 425 6.160 5.217 21.068 1.00 49.57 H new ATOM 0 HA GLN A 425 8.698 5.706 21.298 1.00 51.26 H new ATOM 0 HB2 GLN A 425 7.005 5.594 23.546 1.00 51.91 H new ATOM 0 HB3 GLN A 425 8.304 6.447 23.421 1.00 51.91 H new ATOM 0 HG2 GLN A 425 7.213 7.856 21.876 1.00 52.91 H new ATOM 0 HG3 GLN A 425 5.910 7.017 22.047 1.00 52.91 H new ATOM 0 HE21 GLN A 425 7.986 9.104 23.741 1.00 54.11 H new ATOM 0 HE22 GLN A 425 7.045 9.557 24.803 1.00 54.11 H new ATOM 1819 N LYS A 426 7.689 3.033 22.754 1.00 50.64 N ATOM 1820 CA LYS A 426 8.076 1.830 23.471 1.00 50.44 C ATOM 1821 C LYS A 426 8.973 0.912 22.643 1.00 49.65 C ATOM 1822 O LYS A 426 10.005 0.459 23.114 1.00 49.64 O ATOM 1823 CB LYS A 426 6.841 1.066 23.939 1.00 51.40 C ATOM 1824 CG LYS A 426 7.134 -0.039 24.961 1.00 53.07 C ATOM 1825 CD LYS A 426 7.386 0.535 26.365 1.00 54.49 C ATOM 1826 CE LYS A 426 8.827 0.287 26.863 1.00 55.58 C ATOM 1827 NZ LYS A 426 9.867 0.180 25.770 1.00 55.53 N ATOM 0 H LYS A 426 6.845 3.095 22.602 1.00 50.64 H new ATOM 0 HA LYS A 426 8.592 2.119 24.240 1.00 50.44 H new ATOM 0 HB2 LYS A 426 6.213 1.694 24.328 1.00 51.40 H new ATOM 0 HB3 LYS A 426 6.406 0.671 23.167 1.00 51.40 H new ATOM 0 HG2 LYS A 426 6.387 -0.656 24.993 1.00 53.07 H new ATOM 0 HG3 LYS A 426 7.909 -0.547 24.675 1.00 53.07 H new ATOM 0 HD2 LYS A 426 7.211 1.489 26.356 1.00 54.49 H new ATOM 0 HD3 LYS A 426 6.759 0.137 26.990 1.00 54.49 H new ATOM 0 HE2 LYS A 426 9.078 1.009 27.461 1.00 55.58 H new ATOM 0 HE3 LYS A 426 8.839 -0.531 27.385 1.00 55.58 H new ATOM 0 HZ1 LYS A 426 10.624 0.561 26.042 1.00 55.53 H new ATOM 0 HZ2 LYS A 426 10.016 -0.678 25.585 1.00 55.53 H new ATOM 0 HZ3 LYS A 426 9.573 0.594 25.039 1.00 55.53 H new ATOM 1828 N ILE A 427 8.568 0.631 21.413 1.00 48.95 N ATOM 1829 CA ILE A 427 9.350 -0.234 20.554 1.00 48.17 C ATOM 1830 C ILE A 427 10.739 0.376 20.300 1.00 48.21 C ATOM 1831 O ILE A 427 11.736 -0.331 20.279 1.00 48.60 O ATOM 1832 CB ILE A 427 8.592 -0.571 19.239 1.00 47.68 C ATOM 1833 CG1 ILE A 427 9.249 -1.758 18.519 1.00 47.19 C ATOM 1834 CG2 ILE A 427 8.441 0.657 18.338 1.00 46.86 C ATOM 1835 CD1 ILE A 427 8.994 -3.085 19.201 1.00 46.32 C ATOM 0 H ILE A 427 7.844 0.932 21.059 1.00 48.95 H new ATOM 0 HA ILE A 427 9.485 -1.080 21.009 1.00 48.17 H new ATOM 0 HB ILE A 427 7.691 -0.843 19.473 1.00 47.68 H new ATOM 0 HG12 ILE A 427 8.917 -1.800 17.608 1.00 47.19 H new ATOM 0 HG13 ILE A 427 10.206 -1.607 18.466 1.00 47.19 H new ATOM 0 HG21 ILE A 427 7.965 0.409 17.530 1.00 46.86 H new ATOM 0 HG22 ILE A 427 7.943 1.344 18.808 1.00 46.86 H new ATOM 0 HG23 ILE A 427 9.319 0.997 18.104 1.00 46.86 H new ATOM 0 HD11 ILE A 427 9.431 -3.794 18.704 1.00 46.32 H new ATOM 0 HD12 ILE A 427 9.348 -3.058 20.104 1.00 46.32 H new ATOM 0 HD13 ILE A 427 8.039 -3.254 19.233 1.00 46.32 H new ATOM 1836 N CYS A 428 10.804 1.695 20.164 1.00 47.84 N ATOM 1837 CA CYS A 428 12.070 2.361 19.881 1.00 48.39 C ATOM 1838 C CYS A 428 12.916 2.535 21.141 1.00 48.38 C ATOM 1839 O CYS A 428 14.109 2.827 21.069 1.00 47.86 O ATOM 1840 CB CYS A 428 11.831 3.706 19.181 1.00 48.18 C ATOM 1841 SG CYS A 428 11.308 3.542 17.439 1.00 48.42 S ATOM 0 H CYS A 428 10.128 2.222 20.232 1.00 47.84 H new ATOM 0 HA CYS A 428 12.573 1.790 19.279 1.00 48.39 H new ATOM 0 HB2 CYS A 428 11.154 4.200 19.669 1.00 48.18 H new ATOM 0 HB3 CYS A 428 12.646 4.230 19.218 1.00 48.18 H new ATOM 0 HG CYS A 428 11.532 4.566 16.855 1.00 48.42 H new ATOM 1842 N LYS A 429 12.294 2.333 22.296 1.00 48.49 N ATOM 1843 CA LYS A 429 12.967 2.507 23.575 1.00 48.72 C ATOM 1844 C LYS A 429 13.670 1.234 24.033 1.00 48.45 C ATOM 1845 O LYS A 429 14.728 1.301 24.656 1.00 48.66 O ATOM 1846 CB LYS A 429 11.961 2.987 24.627 1.00 49.85 C ATOM 1847 CG LYS A 429 12.548 3.335 25.971 1.00 50.73 C ATOM 1848 CD LYS A 429 11.509 4.058 26.813 1.00 51.44 C ATOM 1849 CE LYS A 429 11.891 4.091 28.277 1.00 52.13 C ATOM 1850 NZ LYS A 429 10.967 5.021 29.015 1.00 53.88 N ATOM 0 H LYS A 429 11.471 2.092 22.360 1.00 48.49 H new ATOM 0 HA LYS A 429 13.657 3.180 23.462 1.00 48.72 H new ATOM 0 HB2 LYS A 429 11.501 3.767 24.280 1.00 49.85 H new ATOM 0 HB3 LYS A 429 11.292 2.296 24.752 1.00 49.85 H new ATOM 0 HG2 LYS A 429 12.840 2.529 26.424 1.00 50.73 H new ATOM 0 HG3 LYS A 429 13.331 3.896 25.856 1.00 50.73 H new ATOM 0 HD2 LYS A 429 11.403 4.965 26.486 1.00 51.44 H new ATOM 0 HD3 LYS A 429 10.650 3.619 26.713 1.00 51.44 H new ATOM 0 HE2 LYS A 429 11.838 3.199 28.655 1.00 52.13 H new ATOM 0 HE3 LYS A 429 12.810 4.387 28.375 1.00 52.13 H new ATOM 0 HZ1 LYS A 429 11.191 5.041 29.876 1.00 53.88 H new ATOM 0 HZ2 LYS A 429 11.034 5.840 28.672 1.00 53.88 H new ATOM 0 HZ3 LYS A 429 10.129 4.733 28.934 1.00 53.88 H new ATOM 1851 N TYR A 430 13.096 0.075 23.715 1.00 48.27 N ATOM 1852 CA TYR A 430 13.707 -1.213 24.089 1.00 48.33 C ATOM 1853 C TYR A 430 15.208 -1.339 23.831 1.00 48.64 C ATOM 1854 O TYR A 430 15.947 -1.770 24.713 1.00 49.24 O ATOM 1855 CB TYR A 430 12.992 -2.401 23.440 1.00 47.82 C ATOM 1856 CG TYR A 430 11.639 -2.728 24.017 1.00 47.29 C ATOM 1857 CD1 TYR A 430 10.530 -2.812 23.195 1.00 47.04 C ATOM 1858 CD2 TYR A 430 11.467 -2.958 25.379 1.00 47.86 C ATOM 1859 CE1 TYR A 430 9.287 -3.113 23.693 1.00 47.24 C ATOM 1860 CE2 TYR A 430 10.198 -3.263 25.900 1.00 47.36 C ATOM 1861 CZ TYR A 430 9.119 -3.340 25.039 1.00 47.24 C ATOM 1862 OH TYR A 430 7.854 -3.647 25.489 1.00 47.62 O ATOM 0 H TYR A 430 12.355 0.007 23.284 1.00 48.27 H new ATOM 0 HA TYR A 430 13.593 -1.231 25.052 1.00 48.33 H new ATOM 0 HB2 TYR A 430 12.889 -2.220 22.493 1.00 47.82 H new ATOM 0 HB3 TYR A 430 13.559 -3.184 23.519 1.00 47.82 H new ATOM 0 HD1 TYR A 430 10.629 -2.661 22.283 1.00 47.04 H new ATOM 0 HD2 TYR A 430 12.199 -2.909 25.950 1.00 47.86 H new ATOM 0 HE1 TYR A 430 8.557 -3.164 23.119 1.00 47.24 H new ATOM 0 HE2 TYR A 430 10.086 -3.411 26.811 1.00 47.36 H new ATOM 0 HH TYR A 430 7.846 -3.640 26.329 1.00 47.62 H new ATOM 1863 N PRO A 431 15.675 -0.996 22.620 1.00 48.91 N ATOM 1864 CA PRO A 431 17.113 -1.182 22.444 1.00 48.54 C ATOM 1865 C PRO A 431 17.942 -0.403 23.472 1.00 48.43 C ATOM 1866 O PRO A 431 19.014 -0.853 23.861 1.00 48.07 O ATOM 1867 CB PRO A 431 17.371 -0.665 21.021 1.00 48.78 C ATOM 1868 CG PRO A 431 16.046 -0.762 20.331 1.00 48.72 C ATOM 1869 CD PRO A 431 15.024 -0.481 21.401 1.00 48.88 C ATOM 0 HA PRO A 431 17.375 -2.107 22.573 1.00 48.54 H new ATOM 0 HB2 PRO A 431 17.696 0.249 21.032 1.00 48.78 H new ATOM 0 HB3 PRO A 431 18.043 -1.199 20.569 1.00 48.78 H new ATOM 0 HG2 PRO A 431 15.980 -0.121 19.606 1.00 48.72 H new ATOM 0 HG3 PRO A 431 15.916 -1.642 19.944 1.00 48.72 H new ATOM 0 HD2 PRO A 431 14.828 0.466 21.471 1.00 48.88 H new ATOM 0 HD3 PRO A 431 14.184 -0.933 21.224 1.00 48.88 H new ATOM 1870 N LEU A 432 17.444 0.752 23.904 1.00 48.36 N ATOM 1871 CA LEU A 432 18.137 1.569 24.894 1.00 48.31 C ATOM 1872 C LEU A 432 18.143 0.911 26.271 1.00 48.16 C ATOM 1873 O LEU A 432 19.143 0.952 26.982 1.00 48.20 O ATOM 1874 CB LEU A 432 17.495 2.954 24.993 1.00 48.72 C ATOM 1875 CG LEU A 432 17.599 3.876 23.772 1.00 49.14 C ATOM 1876 CD1 LEU A 432 16.966 5.223 24.085 1.00 49.29 C ATOM 1877 CD2 LEU A 432 19.039 4.061 23.366 1.00 48.93 C ATOM 0 H LEU A 432 16.698 1.083 23.633 1.00 48.36 H new ATOM 0 HA LEU A 432 19.056 1.658 24.597 1.00 48.31 H new ATOM 0 HB2 LEU A 432 16.554 2.833 25.197 1.00 48.72 H new ATOM 0 HB3 LEU A 432 17.892 3.414 25.749 1.00 48.72 H new ATOM 0 HG LEU A 432 17.124 3.465 23.033 1.00 49.14 H new ATOM 0 HD11 LEU A 432 17.035 5.801 23.309 1.00 49.29 H new ATOM 0 HD12 LEU A 432 16.031 5.097 24.312 1.00 49.29 H new ATOM 0 HD13 LEU A 432 17.427 5.631 24.834 1.00 49.29 H new ATOM 0 HD21 LEU A 432 19.085 4.646 22.594 1.00 48.93 H new ATOM 0 HD22 LEU A 432 19.534 4.456 24.100 1.00 48.93 H new ATOM 0 HD23 LEU A 432 19.426 3.200 23.142 1.00 48.93 H new ATOM 1878 N GLN A 433 17.012 0.322 26.644 1.00 48.03 N ATOM 1879 CA GLN A 433 16.892 -0.427 27.891 1.00 48.05 C ATOM 1880 C GLN A 433 17.769 -1.678 27.901 1.00 48.00 C ATOM 1881 O GLN A 433 18.395 -1.996 28.914 1.00 48.07 O ATOM 1882 CB GLN A 433 15.434 -0.815 28.140 1.00 47.75 C ATOM 1883 CG GLN A 433 14.545 0.368 28.533 1.00 48.69 C ATOM 1884 CD GLN A 433 13.068 0.052 28.447 1.00 48.51 C ATOM 1885 OE1 GLN A 433 12.342 0.385 29.485 1.00 50.27 O flip ATOM 1886 NE2 GLN A 433 12.589 -0.484 27.454 1.00 48.73 N flip ATOM 0 H GLN A 433 16.289 0.345 26.179 1.00 48.03 H new ATOM 0 HA GLN A 433 17.201 0.155 28.603 1.00 48.05 H new ATOM 0 HB2 GLN A 433 15.075 -1.228 27.339 1.00 47.75 H new ATOM 0 HB3 GLN A 433 15.400 -1.483 28.842 1.00 47.75 H new ATOM 0 HG2 GLN A 433 14.760 0.641 29.439 1.00 48.69 H new ATOM 0 HG3 GLN A 433 14.744 1.121 27.955 1.00 48.69 H new ATOM 0 HE21 GLN A 433 13.095 -0.689 26.790 1.00 48.73 H new ATOM 0 HE22 GLN A 433 11.747 -0.655 27.422 1.00 48.73 H new ATOM 1887 N LEU A 434 17.817 -2.381 26.773 1.00 47.41 N ATOM 1888 CA LEU A 434 18.552 -3.641 26.692 1.00 47.07 C ATOM 1889 C LEU A 434 20.059 -3.401 26.623 1.00 47.06 C ATOM 1890 O LEU A 434 20.851 -4.230 27.077 1.00 46.80 O ATOM 1891 CB LEU A 434 18.065 -4.489 25.508 1.00 46.78 C ATOM 1892 CG LEU A 434 16.666 -5.104 25.657 1.00 46.95 C ATOM 1893 CD1 LEU A 434 16.206 -5.775 24.366 1.00 46.37 C ATOM 1894 CD2 LEU A 434 16.635 -6.102 26.813 1.00 46.97 C ATOM 0 H LEU A 434 17.430 -2.146 26.042 1.00 47.41 H new ATOM 0 HA LEU A 434 18.374 -4.140 27.505 1.00 47.07 H new ATOM 0 HB2 LEU A 434 18.074 -3.936 24.711 1.00 46.78 H new ATOM 0 HB3 LEU A 434 18.701 -5.206 25.362 1.00 46.78 H new ATOM 0 HG LEU A 434 16.050 -4.380 25.852 1.00 46.95 H new ATOM 0 HD11 LEU A 434 15.321 -6.152 24.494 1.00 46.37 H new ATOM 0 HD12 LEU A 434 16.177 -5.119 23.652 1.00 46.37 H new ATOM 0 HD13 LEU A 434 16.827 -6.482 24.129 1.00 46.37 H new ATOM 0 HD21 LEU A 434 15.745 -6.479 26.891 1.00 46.97 H new ATOM 0 HD22 LEU A 434 17.273 -6.813 26.644 1.00 46.97 H new ATOM 0 HD23 LEU A 434 16.867 -5.649 27.638 1.00 46.97 H new ATOM 1895 N ALA A 435 20.453 -2.253 26.081 1.00 46.47 N ATOM 1896 CA ALA A 435 21.863 -1.904 26.038 1.00 46.50 C ATOM 1897 C ALA A 435 22.378 -1.549 27.433 1.00 46.36 C ATOM 1898 O ALA A 435 23.477 -1.963 27.817 1.00 46.11 O ATOM 1899 CB ALA A 435 22.108 -0.766 25.057 1.00 46.28 C ATOM 0 H ALA A 435 19.924 -1.669 25.737 1.00 46.47 H new ATOM 0 HA ALA A 435 22.358 -2.678 25.726 1.00 46.50 H new ATOM 0 HB1 ALA A 435 23.053 -0.548 25.043 1.00 46.28 H new ATOM 0 HB2 ALA A 435 21.826 -1.037 24.169 1.00 46.28 H new ATOM 0 HB3 ALA A 435 21.601 0.014 25.333 1.00 46.28 H new ATOM 1900 N GLU A 436 21.582 -0.798 28.193 1.00 46.29 N ATOM 1901 CA GLU A 436 21.980 -0.434 29.557 1.00 46.15 C ATOM 1902 C GLU A 436 21.929 -1.628 30.504 1.00 45.88 C ATOM 1903 O GLU A 436 22.725 -1.716 31.438 1.00 46.29 O ATOM 1904 CB GLU A 436 21.158 0.735 30.116 1.00 46.07 C ATOM 1905 CG GLU A 436 21.778 1.327 31.391 1.00 46.37 C ATOM 1906 CD GLU A 436 21.021 2.522 31.948 1.00 46.32 C ATOM 1907 OE1 GLU A 436 19.877 2.778 31.513 1.00 46.23 O ATOM 1908 OE2 GLU A 436 21.580 3.209 32.832 1.00 46.30 O ATOM 0 H GLU A 436 20.818 -0.492 27.944 1.00 46.29 H new ATOM 0 HA GLU A 436 22.902 -0.138 29.496 1.00 46.15 H new ATOM 0 HB2 GLU A 436 21.086 1.429 29.442 1.00 46.07 H new ATOM 0 HB3 GLU A 436 20.257 0.431 30.308 1.00 46.07 H new ATOM 0 HG2 GLU A 436 21.819 0.636 32.071 1.00 46.37 H new ATOM 0 HG3 GLU A 436 22.691 1.594 31.202 1.00 46.37 H new ATOM 1909 N LEU A 437 20.996 -2.548 30.264 1.00 45.76 N ATOM 1910 CA LEU A 437 20.969 -3.804 31.009 1.00 45.23 C ATOM 1911 C LEU A 437 22.235 -4.615 30.729 1.00 45.58 C ATOM 1912 O LEU A 437 22.894 -5.089 31.650 1.00 45.27 O ATOM 1913 CB LEU A 437 19.737 -4.636 30.651 1.00 44.55 C ATOM 1914 CG LEU A 437 19.658 -6.003 31.343 1.00 44.61 C ATOM 1915 CD1 LEU A 437 19.701 -5.822 32.845 1.00 44.38 C ATOM 1916 CD2 LEU A 437 18.406 -6.785 30.934 1.00 44.72 C ATOM 0 H LEU A 437 20.373 -2.465 29.677 1.00 45.76 H new ATOM 0 HA LEU A 437 20.928 -3.586 31.953 1.00 45.23 H new ATOM 0 HB2 LEU A 437 18.943 -4.127 30.877 1.00 44.55 H new ATOM 0 HB3 LEU A 437 19.723 -4.773 29.691 1.00 44.55 H new ATOM 0 HG LEU A 437 20.425 -6.523 31.058 1.00 44.61 H new ATOM 0 HD11 LEU A 437 19.651 -6.689 33.277 1.00 44.38 H new ATOM 0 HD12 LEU A 437 20.530 -5.384 33.095 1.00 44.38 H new ATOM 0 HD13 LEU A 437 18.950 -5.277 33.127 1.00 44.38 H new ATOM 0 HD21 LEU A 437 18.394 -7.640 31.392 1.00 44.72 H new ATOM 0 HD22 LEU A 437 17.615 -6.279 31.175 1.00 44.72 H new ATOM 0 HD23 LEU A 437 18.415 -6.932 29.975 1.00 44.72 H new ATOM 1917 N LEU A 438 22.560 -4.778 29.451 1.00 46.17 N ATOM 1918 CA LEU A 438 23.751 -5.525 29.055 1.00 47.09 C ATOM 1919 C LEU A 438 24.991 -4.885 29.669 1.00 47.75 C ATOM 1920 O LEU A 438 25.908 -5.578 30.096 1.00 48.42 O ATOM 1921 CB LEU A 438 23.881 -5.571 27.528 1.00 46.87 C ATOM 1922 CG LEU A 438 24.963 -6.476 26.928 1.00 46.65 C ATOM 1923 CD1 LEU A 438 24.605 -7.940 27.128 1.00 46.34 C ATOM 1924 CD2 LEU A 438 25.158 -6.169 25.450 1.00 46.58 C ATOM 0 H LEU A 438 22.103 -4.463 28.794 1.00 46.17 H new ATOM 0 HA LEU A 438 23.667 -6.435 29.380 1.00 47.09 H new ATOM 0 HB2 LEU A 438 23.026 -5.849 27.165 1.00 46.87 H new ATOM 0 HB3 LEU A 438 24.042 -4.667 27.216 1.00 46.87 H new ATOM 0 HG LEU A 438 25.799 -6.300 27.388 1.00 46.65 H new ATOM 0 HD11 LEU A 438 25.299 -8.498 26.743 1.00 46.34 H new ATOM 0 HD12 LEU A 438 24.528 -8.128 28.077 1.00 46.34 H new ATOM 0 HD13 LEU A 438 23.759 -8.129 26.692 1.00 46.34 H new ATOM 0 HD21 LEU A 438 25.845 -6.750 25.087 1.00 46.58 H new ATOM 0 HD22 LEU A 438 24.325 -6.318 24.976 1.00 46.58 H new ATOM 0 HD23 LEU A 438 25.428 -5.243 25.344 1.00 46.58 H new ATOM 1925 N LYS A 439 24.998 -3.556 29.721 1.00 48.81 N ATOM 1926 CA LYS A 439 26.135 -2.793 30.246 1.00 49.16 C ATOM 1927 C LYS A 439 26.454 -3.169 31.691 1.00 48.97 C ATOM 1928 O LYS A 439 27.608 -3.127 32.105 1.00 49.63 O ATOM 1929 CB LYS A 439 25.850 -1.289 30.140 1.00 49.12 C ATOM 1930 CG LYS A 439 26.955 -0.387 30.667 1.00 49.57 C ATOM 1931 CD LYS A 439 26.506 1.073 30.670 1.00 49.56 C ATOM 1932 CE LYS A 439 27.637 2.004 31.069 1.00 50.64 C ATOM 1933 NZ LYS A 439 27.205 3.445 31.069 1.00 51.20 N ATOM 0 H LYS A 439 24.343 -3.067 29.453 1.00 48.81 H new ATOM 0 HA LYS A 439 26.912 -3.014 29.709 1.00 49.16 H new ATOM 0 HB2 LYS A 439 25.688 -1.069 29.209 1.00 49.12 H new ATOM 0 HB3 LYS A 439 25.033 -1.093 30.624 1.00 49.12 H new ATOM 0 HG2 LYS A 439 27.198 -0.657 31.566 1.00 49.57 H new ATOM 0 HG3 LYS A 439 27.748 -0.485 30.117 1.00 49.57 H new ATOM 0 HD2 LYS A 439 26.183 1.315 29.788 1.00 49.56 H new ATOM 0 HD3 LYS A 439 25.763 1.183 31.284 1.00 49.56 H new ATOM 0 HE2 LYS A 439 27.957 1.763 31.952 1.00 50.64 H new ATOM 0 HE3 LYS A 439 28.381 1.890 30.457 1.00 50.64 H new ATOM 0 HZ1 LYS A 439 27.890 3.961 31.307 1.00 51.20 H new ATOM 0 HZ2 LYS A 439 26.931 3.673 30.253 1.00 51.20 H new ATOM 0 HZ3 LYS A 439 26.537 3.555 31.647 1.00 51.20 H new ATOM 1934 N TYR A 440 25.431 -3.540 32.453 1.00 48.61 N ATOM 1935 CA TYR A 440 25.620 -3.911 33.853 1.00 48.08 C ATOM 1936 C TYR A 440 25.400 -5.405 34.069 1.00 47.64 C ATOM 1937 O TYR A 440 24.992 -5.838 35.150 1.00 47.39 O ATOM 1938 CB TYR A 440 24.721 -3.066 34.762 1.00 48.72 C ATOM 1939 CG TYR A 440 25.014 -1.589 34.648 1.00 48.70 C ATOM 1940 CD1 TYR A 440 24.243 -0.764 33.835 1.00 48.83 C ATOM 1941 CD2 TYR A 440 26.082 -1.025 35.326 1.00 48.72 C ATOM 1942 CE1 TYR A 440 24.528 0.589 33.713 1.00 48.95 C ATOM 1943 CE2 TYR A 440 26.375 0.322 35.213 1.00 48.95 C ATOM 1944 CZ TYR A 440 25.594 1.125 34.409 1.00 49.02 C ATOM 1945 OH TYR A 440 25.894 2.464 34.302 1.00 48.99 O ATOM 0 H TYR A 440 24.617 -3.584 32.179 1.00 48.61 H new ATOM 0 HA TYR A 440 26.541 -3.725 34.093 1.00 48.08 H new ATOM 0 HB2 TYR A 440 23.792 -3.227 34.535 1.00 48.72 H new ATOM 0 HB3 TYR A 440 24.841 -3.347 35.683 1.00 48.72 H new ATOM 0 HD1 TYR A 440 23.525 -1.125 33.366 1.00 48.83 H new ATOM 0 HD2 TYR A 440 26.613 -1.563 35.868 1.00 48.72 H new ATOM 0 HE1 TYR A 440 24.005 1.131 33.167 1.00 48.95 H new ATOM 0 HE2 TYR A 440 27.095 0.684 35.677 1.00 48.95 H new ATOM 0 HH TYR A 440 26.562 2.641 34.780 1.00 48.99 H new ATOM 1946 N THR A 441 25.684 -6.183 33.025 1.00 47.05 N ATOM 1947 CA THR A 441 25.623 -7.642 33.074 1.00 46.61 C ATOM 1948 C THR A 441 26.993 -8.229 32.709 1.00 46.81 C ATOM 1949 O THR A 441 27.513 -7.954 31.628 1.00 46.88 O ATOM 1950 CB THR A 441 24.564 -8.195 32.082 1.00 46.23 C ATOM 1951 OG1 THR A 441 23.284 -7.584 32.324 1.00 45.67 O ATOM 1952 CG2 THR A 441 24.435 -9.700 32.222 1.00 45.45 C ATOM 0 H THR A 441 25.921 -5.873 32.258 1.00 47.05 H new ATOM 0 HA THR A 441 25.373 -7.899 33.975 1.00 46.61 H new ATOM 0 HB THR A 441 24.857 -7.983 31.182 1.00 46.23 H new ATOM 0 HG1 THR A 441 23.324 -6.766 32.138 1.00 45.67 H new ATOM 0 HG21 THR A 441 23.770 -10.028 31.596 1.00 45.45 H new ATOM 0 HG22 THR A 441 25.290 -10.117 32.033 1.00 45.45 H new ATOM 0 HG23 THR A 441 24.162 -9.919 33.127 1.00 45.45 H new ATOM 1953 N HIS A 442 27.577 -9.031 33.598 1.00 47.20 N ATOM 1954 CA HIS A 442 28.895 -9.633 33.326 1.00 47.52 C ATOM 1955 C HIS A 442 28.764 -10.829 32.377 1.00 47.68 C ATOM 1956 O HIS A 442 27.808 -11.592 32.475 1.00 47.61 O ATOM 1957 CB HIS A 442 29.603 -10.046 34.626 1.00 47.36 C ATOM 1958 CG HIS A 442 31.058 -10.383 34.450 1.00 47.57 C ATOM 1959 ND1 HIS A 442 31.517 -11.680 34.356 1.00 47.42 N ATOM 1960 CD2 HIS A 442 32.154 -9.591 34.354 1.00 47.33 C ATOM 1961 CE1 HIS A 442 32.831 -11.673 34.210 1.00 47.44 C ATOM 1962 NE2 HIS A 442 33.242 -10.417 34.204 1.00 47.47 N ATOM 0 H HIS A 442 27.236 -9.241 34.359 1.00 47.20 H new ATOM 0 HA HIS A 442 29.441 -8.958 32.893 1.00 47.52 H new ATOM 0 HB2 HIS A 442 29.523 -9.325 35.270 1.00 47.36 H new ATOM 0 HB3 HIS A 442 29.146 -10.814 35.002 1.00 47.36 H new ATOM 0 HD2 HIS A 442 32.167 -8.662 34.384 1.00 47.33 H new ATOM 0 HE1 HIS A 442 33.373 -12.424 34.126 1.00 47.44 H new ATOM 0 HE2 HIS A 442 34.058 -10.159 34.120 1.00 47.47 H new ATOM 1963 N PRO A 443 29.724 -10.983 31.443 1.00 47.92 N ATOM 1964 CA PRO A 443 29.728 -12.044 30.430 1.00 47.76 C ATOM 1965 C PRO A 443 29.374 -13.436 30.947 1.00 47.58 C ATOM 1966 O PRO A 443 28.925 -14.284 30.173 1.00 47.06 O ATOM 1967 CB PRO A 443 31.167 -12.021 29.927 1.00 47.70 C ATOM 1968 CG PRO A 443 31.548 -10.586 30.037 1.00 47.95 C ATOM 1969 CD PRO A 443 30.884 -10.085 31.288 1.00 47.85 C ATOM 0 HA PRO A 443 29.048 -11.878 29.759 1.00 47.76 H new ATOM 0 HB2 PRO A 443 31.743 -12.586 30.465 1.00 47.70 H new ATOM 0 HB3 PRO A 443 31.231 -12.339 29.013 1.00 47.70 H new ATOM 0 HG2 PRO A 443 32.511 -10.484 30.089 1.00 47.95 H new ATOM 0 HG3 PRO A 443 31.251 -10.086 29.261 1.00 47.95 H new ATOM 0 HD2 PRO A 443 31.479 -10.134 32.053 1.00 47.85 H new ATOM 0 HD3 PRO A 443 30.610 -9.159 31.201 1.00 47.85 H new ATOM 1970 N GLN A 444 29.564 -13.663 32.242 1.00 47.90 N ATOM 1971 CA GLN A 444 29.359 -14.988 32.819 1.00 48.41 C ATOM 1972 C GLN A 444 28.022 -15.071 33.546 1.00 47.98 C ATOM 1973 O GLN A 444 27.691 -16.105 34.137 1.00 47.84 O ATOM 1974 CB GLN A 444 30.509 -15.360 33.765 1.00 49.22 C ATOM 1975 CG GLN A 444 31.862 -14.726 33.419 1.00 50.33 C ATOM 1976 CD GLN A 444 32.558 -15.380 32.236 1.00 51.24 C ATOM 1977 OE1 GLN A 444 32.099 -16.398 31.715 1.00 51.83 O ATOM 1978 NE2 GLN A 444 33.683 -14.801 31.814 1.00 51.51 N ATOM 0 H GLN A 444 29.812 -13.062 32.805 1.00 47.90 H new ATOM 0 HA GLN A 444 29.346 -15.627 32.089 1.00 48.41 H new ATOM 0 HB2 GLN A 444 30.266 -15.099 34.667 1.00 49.22 H new ATOM 0 HB3 GLN A 444 30.610 -16.325 33.766 1.00 49.22 H new ATOM 0 HG2 GLN A 444 31.729 -13.785 33.226 1.00 50.33 H new ATOM 0 HG3 GLN A 444 32.442 -14.778 34.195 1.00 50.33 H new ATOM 0 HE21 GLN A 444 33.973 -14.091 32.203 1.00 51.51 H new ATOM 0 HE22 GLN A 444 34.118 -15.138 31.153 1.00 51.51 H new ATOM 1979 N HIS A 445 27.271 -13.971 33.511 1.00 47.10 N ATOM 1980 CA HIS A 445 25.894 -13.950 33.992 1.00 46.64 C ATOM 1981 C HIS A 445 25.078 -14.842 33.066 1.00 46.82 C ATOM 1982 O HIS A 445 25.297 -14.847 31.855 1.00 47.06 O ATOM 1983 CB HIS A 445 25.329 -12.515 33.968 1.00 45.55 C ATOM 1984 CG HIS A 445 24.044 -12.346 34.728 1.00 44.46 C ATOM 1985 ND1 HIS A 445 22.808 -12.858 34.517 1.00 43.94 N flip ATOM 1986 CD2 HIS A 445 23.946 -11.569 35.862 1.00 44.40 C flip ATOM 1987 CE1 HIS A 445 21.995 -12.385 35.519 1.00 43.98 C flip ATOM 1988 NE2 HIS A 445 22.706 -11.611 36.317 1.00 43.85 N flip ATOM 0 H HIS A 445 27.548 -13.216 33.207 1.00 47.10 H new ATOM 0 HA HIS A 445 25.854 -14.267 34.908 1.00 46.64 H new ATOM 0 HB2 HIS A 445 25.993 -11.911 34.336 1.00 45.55 H new ATOM 0 HB3 HIS A 445 25.185 -12.250 33.046 1.00 45.55 H new ATOM 0 HD2 HIS A 445 24.644 -11.090 36.247 1.00 44.40 H new ATOM 0 HE1 HIS A 445 21.091 -12.579 35.618 1.00 43.98 H new ATOM 0 HE2 HIS A 445 22.412 -11.203 37.015 1.00 43.85 H new ATOM 1989 N ARG A 446 24.143 -15.594 33.633 1.00 47.01 N ATOM 1990 CA ARG A 446 23.267 -16.459 32.844 1.00 47.30 C ATOM 1991 C ARG A 446 22.477 -15.705 31.764 1.00 46.92 C ATOM 1992 O ARG A 446 22.118 -16.271 30.731 1.00 46.54 O ATOM 1993 CB ARG A 446 22.297 -17.199 33.766 1.00 47.99 C ATOM 1994 CG ARG A 446 22.642 -18.668 34.011 1.00 48.85 C ATOM 1995 CD ARG A 446 22.405 -19.501 32.748 1.00 49.58 C ATOM 1996 NE ARG A 446 21.317 -18.953 31.931 1.00 49.98 N ATOM 1997 CZ ARG A 446 20.568 -19.668 31.095 1.00 50.33 C ATOM 1998 NH1 ARG A 446 20.771 -20.977 30.961 1.00 50.13 N ATOM 1999 NH2 ARG A 446 19.606 -19.073 30.398 1.00 50.20 N ATOM 0 H ARG A 446 23.997 -15.619 34.480 1.00 47.01 H new ATOM 0 HA ARG A 446 23.844 -17.088 32.383 1.00 47.30 H new ATOM 0 HB2 ARG A 446 22.268 -16.740 34.620 1.00 47.99 H new ATOM 0 HB3 ARG A 446 21.406 -17.148 33.386 1.00 47.99 H new ATOM 0 HG2 ARG A 446 23.569 -18.745 34.285 1.00 48.85 H new ATOM 0 HG3 ARG A 446 22.101 -19.015 34.738 1.00 48.85 H new ATOM 0 HD2 ARG A 446 23.220 -19.532 32.223 1.00 49.58 H new ATOM 0 HD3 ARG A 446 22.194 -20.414 32.998 1.00 49.58 H new ATOM 0 HE ARG A 446 21.152 -18.112 31.997 1.00 49.98 H new ATOM 0 HH11 ARG A 446 21.389 -21.365 31.416 1.00 50.13 H new ATOM 0 HH12 ARG A 446 20.284 -21.434 30.419 1.00 50.13 H new ATOM 0 HH21 ARG A 446 19.469 -18.229 30.488 1.00 50.20 H new ATOM 0 HH22 ARG A 446 19.120 -19.532 29.857 1.00 50.20 H new ATOM 2000 N ASP A 447 22.219 -14.425 32.006 1.00 46.48 N ATOM 2001 CA ASP A 447 21.363 -13.636 31.126 1.00 46.52 C ATOM 2002 C ASP A 447 22.121 -12.927 30.004 1.00 46.18 C ATOM 2003 O ASP A 447 21.503 -12.364 29.107 1.00 46.71 O ATOM 2004 CB ASP A 447 20.581 -12.611 31.950 1.00 46.47 C ATOM 2005 CG ASP A 447 19.330 -12.125 31.248 1.00 46.38 C ATOM 2006 OD1 ASP A 447 18.843 -12.818 30.334 1.00 46.78 O ATOM 2007 OD2 ASP A 447 18.826 -11.049 31.618 1.00 46.55 O ATOM 0 H ASP A 447 22.532 -13.991 32.679 1.00 46.48 H new ATOM 0 HA ASP A 447 20.760 -14.262 30.696 1.00 46.52 H new ATOM 0 HB2 ASP A 447 20.336 -13.006 32.802 1.00 46.47 H new ATOM 0 HB3 ASP A 447 21.154 -11.852 32.143 1.00 46.47 H new ATOM 2008 N PHE A 448 23.449 -12.974 30.042 1.00 45.94 N ATOM 2009 CA PHE A 448 24.281 -12.142 29.159 1.00 45.77 C ATOM 2010 C PHE A 448 24.098 -12.352 27.652 1.00 45.67 C ATOM 2011 O PHE A 448 23.970 -11.388 26.900 1.00 45.43 O ATOM 2012 CB PHE A 448 25.770 -12.297 29.499 1.00 45.24 C ATOM 2013 CG PHE A 448 26.663 -11.433 28.660 1.00 44.99 C ATOM 2014 CD1 PHE A 448 26.924 -10.121 29.030 1.00 44.81 C ATOM 2015 CD2 PHE A 448 27.228 -11.921 27.489 1.00 45.16 C ATOM 2016 CE1 PHE A 448 27.737 -9.313 28.252 1.00 44.64 C ATOM 2017 CE2 PHE A 448 28.042 -11.116 26.706 1.00 44.92 C ATOM 2018 CZ PHE A 448 28.294 -9.809 27.090 1.00 44.94 C ATOM 0 H PHE A 448 23.895 -13.482 30.573 1.00 45.94 H new ATOM 0 HA PHE A 448 23.962 -11.244 29.340 1.00 45.77 H new ATOM 0 HB2 PHE A 448 25.906 -12.080 30.434 1.00 45.24 H new ATOM 0 HB3 PHE A 448 26.027 -13.225 29.383 1.00 45.24 H new ATOM 0 HD1 PHE A 448 26.549 -9.780 29.810 1.00 44.81 H new ATOM 0 HD2 PHE A 448 27.059 -12.797 27.227 1.00 45.16 H new ATOM 0 HE1 PHE A 448 27.908 -8.437 28.512 1.00 44.64 H new ATOM 0 HE2 PHE A 448 28.418 -11.453 25.925 1.00 44.92 H new ATOM 0 HZ PHE A 448 28.838 -9.266 26.566 1.00 44.94 H new ATOM 2019 N LYS A 449 24.134 -13.610 27.218 1.00 46.02 N ATOM 2020 CA LYS A 449 24.089 -13.948 25.796 1.00 46.01 C ATOM 2021 C LYS A 449 22.714 -13.659 25.221 1.00 46.03 C ATOM 2022 O LYS A 449 22.577 -13.290 24.050 1.00 46.12 O ATOM 2023 CB LYS A 449 24.391 -15.431 25.593 1.00 46.14 C ATOM 2024 CG LYS A 449 25.433 -16.011 26.533 1.00 46.43 C ATOM 2025 CD LYS A 449 26.730 -16.354 25.809 1.00 46.57 C ATOM 2026 CE LYS A 449 27.456 -17.492 26.525 1.00 46.42 C ATOM 2027 NZ LYS A 449 28.679 -17.945 25.807 1.00 46.53 N ATOM 0 H LYS A 449 24.185 -14.292 27.739 1.00 46.02 H new ATOM 0 HA LYS A 449 24.755 -13.407 25.343 1.00 46.01 H new ATOM 0 HB2 LYS A 449 23.567 -15.932 25.698 1.00 46.14 H new ATOM 0 HB3 LYS A 449 24.690 -15.564 24.680 1.00 46.14 H new ATOM 0 HG2 LYS A 449 25.618 -15.375 27.241 1.00 46.43 H new ATOM 0 HG3 LYS A 449 25.078 -16.809 26.954 1.00 46.43 H new ATOM 0 HD2 LYS A 449 26.538 -16.611 24.894 1.00 46.57 H new ATOM 0 HD3 LYS A 449 27.302 -15.572 25.770 1.00 46.57 H new ATOM 0 HE2 LYS A 449 27.700 -17.202 27.418 1.00 46.42 H new ATOM 0 HE3 LYS A 449 26.850 -18.242 26.626 1.00 46.42 H new ATOM 0 HZ1 LYS A 449 29.063 -18.606 26.263 1.00 46.53 H new ATOM 0 HZ2 LYS A 449 28.457 -18.235 24.995 1.00 46.53 H new ATOM 0 HZ3 LYS A 449 29.249 -17.265 25.733 1.00 46.53 H new ATOM 2028 N ASP A 450 21.698 -13.842 26.060 1.00 45.72 N ATOM 2029 CA ASP A 450 20.319 -13.676 25.657 1.00 45.04 C ATOM 2030 C ASP A 450 19.991 -12.200 25.556 1.00 45.90 C ATOM 2031 O ASP A 450 19.259 -11.789 24.668 1.00 46.33 O ATOM 2032 CB ASP A 450 19.389 -14.346 26.664 1.00 44.03 C ATOM 2033 CG ASP A 450 19.345 -15.854 26.517 1.00 43.39 C ATOM 2034 OD1 ASP A 450 19.826 -16.382 25.491 1.00 42.98 O ATOM 2035 OD2 ASP A 450 18.812 -16.513 27.435 1.00 42.54 O ATOM 0 H ASP A 450 21.797 -14.068 26.884 1.00 45.72 H new ATOM 0 HA ASP A 450 20.192 -14.093 24.791 1.00 45.04 H new ATOM 0 HB2 ASP A 450 19.678 -14.122 27.562 1.00 44.03 H new ATOM 0 HB3 ASP A 450 18.493 -13.989 26.557 1.00 44.03 H new ATOM 2036 N VAL A 451 20.523 -11.402 26.475 1.00 47.02 N ATOM 2037 CA VAL A 451 20.325 -9.955 26.414 1.00 48.21 C ATOM 2038 C VAL A 451 21.010 -9.404 25.172 1.00 48.80 C ATOM 2039 O VAL A 451 20.501 -8.500 24.522 1.00 49.74 O ATOM 2040 CB VAL A 451 20.839 -9.237 27.690 1.00 48.12 C ATOM 2041 CG1 VAL A 451 20.877 -7.721 27.493 1.00 47.78 C ATOM 2042 CG2 VAL A 451 19.959 -9.596 28.883 1.00 48.18 C ATOM 0 H VAL A 451 20.999 -11.674 27.138 1.00 47.02 H new ATOM 0 HA VAL A 451 19.372 -9.783 26.364 1.00 48.21 H new ATOM 0 HB VAL A 451 21.745 -9.538 27.863 1.00 48.12 H new ATOM 0 HG11 VAL A 451 21.201 -7.297 28.303 1.00 47.78 H new ATOM 0 HG12 VAL A 451 21.470 -7.505 26.756 1.00 47.78 H new ATOM 0 HG13 VAL A 451 19.984 -7.398 27.294 1.00 47.78 H new ATOM 0 HG21 VAL A 451 20.287 -9.143 29.675 1.00 48.18 H new ATOM 0 HG22 VAL A 451 19.046 -9.318 28.707 1.00 48.18 H new ATOM 0 HG23 VAL A 451 19.983 -10.555 29.026 1.00 48.18 H new ATOM 2043 N GLU A 452 22.161 -9.972 24.841 1.00 49.81 N ATOM 2044 CA GLU A 452 22.924 -9.540 23.684 1.00 50.55 C ATOM 2045 C GLU A 452 22.192 -9.901 22.395 1.00 50.91 C ATOM 2046 O GLU A 452 22.024 -9.064 21.509 1.00 50.77 O ATOM 2047 CB GLU A 452 24.303 -10.184 23.711 1.00 50.86 C ATOM 2048 CG GLU A 452 25.342 -9.483 22.871 1.00 51.12 C ATOM 2049 CD GLU A 452 26.679 -10.189 22.927 1.00 51.36 C ATOM 2050 OE1 GLU A 452 27.710 -9.496 23.061 1.00 52.00 O ATOM 2051 OE2 GLU A 452 26.699 -11.437 22.856 1.00 51.06 O ATOM 0 H GLU A 452 22.520 -10.618 25.281 1.00 49.81 H new ATOM 0 HA GLU A 452 23.024 -8.576 23.714 1.00 50.55 H new ATOM 0 HB2 GLU A 452 24.614 -10.215 24.629 1.00 50.86 H new ATOM 0 HB3 GLU A 452 24.224 -11.102 23.407 1.00 50.86 H new ATOM 0 HG2 GLU A 452 25.038 -9.438 21.951 1.00 51.12 H new ATOM 0 HG3 GLU A 452 25.445 -8.569 23.180 1.00 51.12 H new ATOM 2052 N ALA A 453 21.754 -11.151 22.294 1.00 51.44 N ATOM 2053 CA ALA A 453 20.949 -11.574 21.157 1.00 51.91 C ATOM 2054 C ALA A 453 19.644 -10.780 21.089 1.00 52.11 C ATOM 2055 O ALA A 453 19.205 -10.404 20.005 1.00 53.09 O ATOM 2056 CB ALA A 453 20.668 -13.063 21.225 1.00 52.02 C ATOM 0 H ALA A 453 21.912 -11.768 22.872 1.00 51.44 H new ATOM 0 HA ALA A 453 21.452 -11.396 20.347 1.00 51.91 H new ATOM 0 HB1 ALA A 453 20.132 -13.326 20.461 1.00 52.02 H new ATOM 0 HB2 ALA A 453 21.506 -13.551 21.215 1.00 52.02 H new ATOM 0 HB3 ALA A 453 20.186 -13.265 22.043 1.00 52.02 H new ATOM 2057 N ALA A 454 19.033 -10.521 22.242 1.00 51.54 N ATOM 2058 CA ALA A 454 17.774 -9.766 22.291 1.00 51.44 C ATOM 2059 C ALA A 454 17.985 -8.298 21.902 1.00 51.14 C ATOM 2060 O ALA A 454 17.184 -7.717 21.174 1.00 51.15 O ATOM 2061 CB ALA A 454 17.130 -9.873 23.668 1.00 51.13 C ATOM 0 H ALA A 454 19.328 -10.772 23.010 1.00 51.54 H new ATOM 0 HA ALA A 454 17.171 -10.159 21.641 1.00 51.44 H new ATOM 0 HB1 ALA A 454 16.302 -9.368 23.678 1.00 51.13 H new ATOM 0 HB2 ALA A 454 16.943 -10.804 23.867 1.00 51.13 H new ATOM 0 HB3 ALA A 454 17.734 -9.515 24.337 1.00 51.13 H new ATOM 2062 N LEU A 455 19.071 -7.704 22.378 1.00 50.79 N ATOM 2063 CA LEU A 455 19.434 -6.362 21.955 1.00 50.97 C ATOM 2064 C LEU A 455 19.522 -6.255 20.423 1.00 51.41 C ATOM 2065 O LEU A 455 18.987 -5.318 19.829 1.00 50.70 O ATOM 2066 CB LEU A 455 20.754 -5.938 22.594 1.00 50.79 C ATOM 2067 CG LEU A 455 21.300 -4.602 22.097 1.00 50.63 C ATOM 2068 CD1 LEU A 455 20.318 -3.474 22.425 1.00 50.58 C ATOM 2069 CD2 LEU A 455 22.688 -4.329 22.673 1.00 50.42 C ATOM 0 H LEU A 455 19.610 -8.061 22.946 1.00 50.79 H new ATOM 0 HA LEU A 455 18.733 -5.761 22.253 1.00 50.97 H new ATOM 0 HB2 LEU A 455 20.633 -5.887 23.555 1.00 50.79 H new ATOM 0 HB3 LEU A 455 21.416 -6.627 22.428 1.00 50.79 H new ATOM 0 HG LEU A 455 21.395 -4.644 21.133 1.00 50.63 H new ATOM 0 HD11 LEU A 455 20.675 -2.631 22.105 1.00 50.58 H new ATOM 0 HD12 LEU A 455 19.467 -3.649 21.993 1.00 50.58 H new ATOM 0 HD13 LEU A 455 20.189 -3.426 23.385 1.00 50.58 H new ATOM 0 HD21 LEU A 455 23.013 -3.477 22.344 1.00 50.42 H new ATOM 0 HD22 LEU A 455 22.637 -4.303 23.641 1.00 50.42 H new ATOM 0 HD23 LEU A 455 23.296 -5.034 22.400 1.00 50.42 H new ATOM 2070 N HIS A 456 20.196 -7.215 19.794 1.00 51.73 N ATOM 2071 CA HIS A 456 20.316 -7.245 18.337 1.00 52.70 C ATOM 2072 C HIS A 456 18.948 -7.371 17.676 1.00 53.41 C ATOM 2073 O HIS A 456 18.623 -6.624 16.754 1.00 53.45 O ATOM 2074 CB HIS A 456 21.221 -8.400 17.895 1.00 53.09 C ATOM 2075 CG HIS A 456 21.281 -8.591 16.410 1.00 53.34 C ATOM 2076 ND1 HIS A 456 22.233 -7.984 15.617 1.00 53.35 N ATOM 2077 CD2 HIS A 456 20.510 -9.327 15.574 1.00 53.20 C ATOM 2078 CE1 HIS A 456 22.041 -8.333 14.357 1.00 53.21 C ATOM 2079 NE2 HIS A 456 21.003 -9.148 14.304 1.00 53.24 N ATOM 0 H HIS A 456 20.594 -7.863 20.196 1.00 51.73 H new ATOM 0 HA HIS A 456 20.715 -6.407 18.055 1.00 52.70 H new ATOM 0 HB2 HIS A 456 22.118 -8.242 18.228 1.00 53.09 H new ATOM 0 HB3 HIS A 456 20.906 -9.221 18.305 1.00 53.09 H new ATOM 0 HD2 HIS A 456 19.783 -9.855 15.815 1.00 53.20 H new ATOM 0 HE1 HIS A 456 22.550 -8.052 13.631 1.00 53.21 H new ATOM 0 HE2 HIS A 456 20.687 -9.508 13.590 1.00 53.24 H new ATOM 2080 N ALA A 457 18.146 -8.318 18.157 1.00 53.97 N ATOM 2081 CA ALA A 457 16.813 -8.534 17.616 1.00 54.33 C ATOM 2082 C ALA A 457 15.957 -7.274 17.741 1.00 54.86 C ATOM 2083 O ALA A 457 15.272 -6.892 16.794 1.00 54.87 O ATOM 2084 CB ALA A 457 16.138 -9.720 18.303 1.00 54.18 C ATOM 0 H ALA A 457 18.359 -8.847 18.800 1.00 53.97 H new ATOM 0 HA ALA A 457 16.902 -8.739 16.672 1.00 54.33 H new ATOM 0 HB1 ALA A 457 15.252 -9.849 17.930 1.00 54.18 H new ATOM 0 HB2 ALA A 457 16.667 -10.520 18.161 1.00 54.18 H new ATOM 0 HB3 ALA A 457 16.066 -9.545 19.254 1.00 54.18 H new ATOM 2085 N MET A 458 16.004 -6.626 18.904 1.00 55.13 N ATOM 2086 CA MET A 458 15.193 -5.426 19.134 1.00 56.08 C ATOM 2087 C MET A 458 15.730 -4.200 18.388 1.00 56.49 C ATOM 2088 O MET A 458 14.956 -3.323 18.003 1.00 56.49 O ATOM 2089 CB MET A 458 15.041 -5.126 20.632 1.00 56.10 C ATOM 2090 CG MET A 458 14.522 -6.302 21.473 1.00 56.51 C ATOM 2091 SD MET A 458 12.900 -6.939 20.994 1.00 57.40 S ATOM 2092 CE MET A 458 11.848 -5.539 21.384 1.00 55.82 C ATOM 0 H MET A 458 16.495 -6.861 19.570 1.00 55.13 H new ATOM 0 HA MET A 458 14.314 -5.620 18.771 1.00 56.08 H new ATOM 0 HB2 MET A 458 15.902 -4.849 20.983 1.00 56.10 H new ATOM 0 HB3 MET A 458 14.436 -4.376 20.739 1.00 56.10 H new ATOM 0 HG2 MET A 458 15.165 -7.026 21.421 1.00 56.51 H new ATOM 0 HG3 MET A 458 14.482 -6.024 22.401 1.00 56.51 H new ATOM 0 HE1 MET A 458 11.087 -5.841 21.905 1.00 55.82 H new ATOM 0 HE2 MET A 458 12.352 -4.888 21.897 1.00 55.82 H new ATOM 0 HE3 MET A 458 11.535 -5.130 20.562 1.00 55.82 H new ATOM 2093 N LYS A 459 17.048 -4.136 18.202 1.00 56.81 N ATOM 2094 CA LYS A 459 17.660 -3.101 17.373 1.00 57.74 C ATOM 2095 C LYS A 459 17.078 -3.198 15.971 1.00 58.00 C ATOM 2096 O LYS A 459 16.613 -2.208 15.413 1.00 58.48 O ATOM 2097 CB LYS A 459 19.173 -3.302 17.270 1.00 58.15 C ATOM 2098 CG LYS A 459 20.036 -2.573 18.290 1.00 58.65 C ATOM 2099 CD LYS A 459 21.483 -2.510 17.767 1.00 59.14 C ATOM 2100 CE LYS A 459 22.518 -2.350 18.881 1.00 59.47 C ATOM 2101 NZ LYS A 459 22.495 -1.002 19.526 1.00 59.34 N ATOM 0 H LYS A 459 17.608 -4.688 18.551 1.00 56.81 H new ATOM 0 HA LYS A 459 17.481 -2.237 17.776 1.00 57.74 H new ATOM 0 HB2 LYS A 459 19.357 -4.252 17.343 1.00 58.15 H new ATOM 0 HB3 LYS A 459 19.455 -3.026 16.384 1.00 58.15 H new ATOM 0 HG2 LYS A 459 19.694 -1.678 18.439 1.00 58.65 H new ATOM 0 HG3 LYS A 459 20.008 -3.033 19.143 1.00 58.65 H new ATOM 0 HD2 LYS A 459 21.676 -3.319 17.268 1.00 59.14 H new ATOM 0 HD3 LYS A 459 21.565 -1.768 17.148 1.00 59.14 H new ATOM 0 HE2 LYS A 459 22.362 -3.027 19.558 1.00 59.47 H new ATOM 0 HE3 LYS A 459 23.402 -2.511 18.517 1.00 59.47 H new ATOM 0 HZ1 LYS A 459 23.115 -0.967 20.163 1.00 59.34 H new ATOM 0 HZ2 LYS A 459 22.663 -0.377 18.915 1.00 59.34 H new ATOM 0 HZ3 LYS A 459 21.693 -0.858 19.885 1.00 59.34 H new ATOM 2102 N ASN A 460 17.131 -4.402 15.406 1.00 57.92 N ATOM 2103 CA ASN A 460 16.606 -4.680 14.075 1.00 57.63 C ATOM 2104 C ASN A 460 15.211 -4.109 13.853 1.00 57.40 C ATOM 2105 O ASN A 460 14.965 -3.448 12.847 1.00 57.33 O ATOM 2106 CB ASN A 460 16.577 -6.190 13.805 1.00 57.49 C ATOM 2107 CG ASN A 460 17.947 -6.761 13.455 1.00 57.68 C ATOM 2108 OD1 ASN A 460 18.906 -6.027 13.204 1.00 57.30 O ATOM 2109 ND2 ASN A 460 18.038 -8.088 13.433 1.00 57.68 N ATOM 0 H ASN A 460 17.478 -5.088 15.791 1.00 57.92 H new ATOM 0 HA ASN A 460 17.208 -4.241 13.455 1.00 57.63 H new ATOM 0 HB2 ASN A 460 16.233 -6.647 14.588 1.00 57.49 H new ATOM 0 HB3 ASN A 460 15.961 -6.371 13.078 1.00 57.49 H new ATOM 0 HD21 ASN A 460 18.786 -8.465 13.238 1.00 57.68 H new ATOM 0 HD22 ASN A 460 17.349 -8.569 13.613 1.00 57.68 H new ATOM 2110 N VAL A 461 14.294 -4.374 14.783 1.00 57.06 N ATOM 2111 CA VAL A 461 12.917 -3.924 14.612 1.00 56.32 C ATOM 2112 C VAL A 461 12.789 -2.408 14.765 1.00 55.74 C ATOM 2113 O VAL A 461 12.106 -1.767 13.972 1.00 55.60 O ATOM 2114 CB VAL A 461 11.903 -4.664 15.545 1.00 56.89 C ATOM 2115 CG1 VAL A 461 12.026 -6.168 15.388 1.00 56.75 C ATOM 2116 CG2 VAL A 461 12.085 -4.271 16.996 1.00 57.00 C ATOM 0 H VAL A 461 14.447 -4.807 15.510 1.00 57.06 H new ATOM 0 HA VAL A 461 12.680 -4.159 13.701 1.00 56.32 H new ATOM 0 HB VAL A 461 11.012 -4.393 15.274 1.00 56.89 H new ATOM 0 HG11 VAL A 461 11.390 -6.608 15.974 1.00 56.75 H new ATOM 0 HG12 VAL A 461 11.841 -6.414 14.468 1.00 56.75 H new ATOM 0 HG13 VAL A 461 12.926 -6.445 15.622 1.00 56.75 H new ATOM 0 HG21 VAL A 461 11.442 -4.748 17.544 1.00 57.00 H new ATOM 0 HG22 VAL A 461 12.984 -4.497 17.283 1.00 57.00 H new ATOM 0 HG23 VAL A 461 11.946 -3.316 17.093 1.00 57.00 H new ATOM 2117 N ALA A 462 13.450 -1.839 15.773 1.00 54.83 N ATOM 2118 CA ALA A 462 13.346 -0.405 16.040 1.00 54.31 C ATOM 2119 C ALA A 462 14.029 0.448 14.967 1.00 53.97 C ATOM 2120 O ALA A 462 13.645 1.595 14.745 1.00 53.67 O ATOM 2121 CB ALA A 462 13.904 -0.072 17.416 1.00 54.15 C ATOM 0 H ALA A 462 13.964 -2.266 16.314 1.00 54.83 H new ATOM 0 HA ALA A 462 12.401 -0.186 16.018 1.00 54.31 H new ATOM 0 HB1 ALA A 462 13.826 0.882 17.575 1.00 54.15 H new ATOM 0 HB2 ALA A 462 13.404 -0.554 18.093 1.00 54.15 H new ATOM 0 HB3 ALA A 462 14.838 -0.331 17.458 1.00 54.15 H new ATOM 2122 N GLN A 463 15.033 -0.112 14.301 1.00 53.65 N ATOM 2123 CA GLN A 463 15.780 0.633 13.288 1.00 54.07 C ATOM 2124 C GLN A 463 14.946 0.863 12.037 1.00 53.23 C ATOM 2125 O GLN A 463 15.040 1.908 11.396 1.00 52.93 O ATOM 2126 CB GLN A 463 17.090 -0.079 12.935 1.00 54.89 C ATOM 2127 CG GLN A 463 18.159 0.100 13.994 1.00 56.15 C ATOM 2128 CD GLN A 463 19.478 -0.557 13.636 1.00 56.98 C ATOM 2129 OE1 GLN A 463 19.576 -1.319 12.663 1.00 57.29 O ATOM 2130 NE2 GLN A 463 20.510 -0.263 14.426 1.00 57.26 N ATOM 0 H GLN A 463 15.299 -0.921 14.419 1.00 53.65 H new ATOM 0 HA GLN A 463 15.995 1.499 13.667 1.00 54.07 H new ATOM 0 HB2 GLN A 463 16.916 -1.026 12.813 1.00 54.89 H new ATOM 0 HB3 GLN A 463 17.420 0.260 12.088 1.00 54.89 H new ATOM 0 HG2 GLN A 463 18.306 1.048 14.138 1.00 56.15 H new ATOM 0 HG3 GLN A 463 17.839 -0.268 14.832 1.00 56.15 H new ATOM 0 HE21 GLN A 463 20.403 0.270 15.092 1.00 57.26 H new ATOM 0 HE22 GLN A 463 21.283 -0.607 14.270 1.00 57.26 H new ATOM 2131 N LEU A 464 14.130 -0.127 11.699 1.00 52.62 N ATOM 2132 CA LEU A 464 13.210 -0.012 10.579 1.00 51.96 C ATOM 2133 C LEU A 464 12.149 1.038 10.889 1.00 50.98 C ATOM 2134 O LEU A 464 11.858 1.902 10.068 1.00 49.97 O ATOM 2135 CB LEU A 464 12.561 -1.369 10.283 1.00 52.23 C ATOM 2136 CG LEU A 464 13.363 -2.354 9.419 1.00 52.58 C ATOM 2137 CD1 LEU A 464 14.822 -2.428 9.843 1.00 52.93 C ATOM 2138 CD2 LEU A 464 12.734 -3.741 9.449 1.00 52.44 C ATOM 0 H LEU A 464 14.095 -0.881 12.111 1.00 52.62 H new ATOM 0 HA LEU A 464 13.702 0.266 9.790 1.00 51.96 H new ATOM 0 HB2 LEU A 464 12.366 -1.801 11.130 1.00 52.23 H new ATOM 0 HB3 LEU A 464 11.711 -1.207 9.845 1.00 52.23 H new ATOM 0 HG LEU A 464 13.337 -2.018 8.509 1.00 52.58 H new ATOM 0 HD11 LEU A 464 15.293 -3.058 9.275 1.00 52.93 H new ATOM 0 HD12 LEU A 464 15.229 -1.551 9.759 1.00 52.93 H new ATOM 0 HD13 LEU A 464 14.876 -2.722 10.766 1.00 52.93 H new ATOM 0 HD21 LEU A 464 13.256 -4.345 8.898 1.00 52.44 H new ATOM 0 HD22 LEU A 464 12.717 -4.069 10.362 1.00 52.44 H new ATOM 0 HD23 LEU A 464 11.828 -3.693 9.107 1.00 52.44 H new ATOM 2139 N ILE A 465 11.585 0.963 12.089 1.00 49.90 N ATOM 2140 CA ILE A 465 10.563 1.907 12.505 1.00 49.69 C ATOM 2141 C ILE A 465 11.114 3.340 12.588 1.00 49.76 C ATOM 2142 O ILE A 465 10.515 4.273 12.062 1.00 49.00 O ATOM 2143 CB ILE A 465 9.900 1.462 13.841 1.00 49.30 C ATOM 2144 CG1 ILE A 465 9.084 0.185 13.612 1.00 48.72 C ATOM 2145 CG2 ILE A 465 9.033 2.577 14.403 1.00 48.82 C ATOM 2146 CD1 ILE A 465 8.885 -0.676 14.833 1.00 48.28 C ATOM 0 H ILE A 465 11.783 0.369 12.678 1.00 49.90 H new ATOM 0 HA ILE A 465 9.872 1.911 11.825 1.00 49.69 H new ATOM 0 HB ILE A 465 10.592 1.272 14.493 1.00 49.30 H new ATOM 0 HG12 ILE A 465 8.214 0.433 13.263 1.00 48.72 H new ATOM 0 HG13 ILE A 465 9.524 -0.345 12.928 1.00 48.72 H new ATOM 0 HG21 ILE A 465 8.628 2.284 15.234 1.00 48.82 H new ATOM 0 HG22 ILE A 465 9.580 3.360 14.569 1.00 48.82 H new ATOM 0 HG23 ILE A 465 8.337 2.799 13.765 1.00 48.82 H new ATOM 0 HD11 ILE A 465 8.361 -1.457 14.596 1.00 48.28 H new ATOM 0 HD12 ILE A 465 9.748 -0.957 15.175 1.00 48.28 H new ATOM 0 HD13 ILE A 465 8.418 -0.168 15.515 1.00 48.28 H new ATOM 2147 N ASN A 466 12.267 3.511 13.225 1.00 50.54 N ATOM 2148 CA ASN A 466 12.839 4.847 13.357 1.00 50.94 C ATOM 2149 C ASN A 466 13.181 5.470 12.008 1.00 51.13 C ATOM 2150 O ASN A 466 13.007 6.671 11.815 1.00 51.33 O ATOM 2151 CB ASN A 466 14.074 4.840 14.256 1.00 51.37 C ATOM 2152 CG ASN A 466 14.711 6.216 14.367 1.00 52.27 C ATOM 2153 OD1 ASN A 466 14.139 7.060 15.218 1.00 51.89 O flip ATOM 2154 ND2 ASN A 466 15.691 6.529 13.666 1.00 51.71 N flip ATOM 0 H ASN A 466 12.728 2.879 13.583 1.00 50.54 H new ATOM 0 HA ASN A 466 12.153 5.394 13.771 1.00 50.94 H new ATOM 0 HB2 ASN A 466 13.827 4.528 15.140 1.00 51.37 H new ATOM 0 HB3 ASN A 466 14.724 4.212 13.905 1.00 51.37 H new ATOM 0 HD21 ASN A 466 16.034 5.955 13.126 1.00 51.71 H new ATOM 0 HD22 ASN A 466 16.025 7.320 13.722 1.00 51.71 H new ATOM 2155 N GLU A 467 13.656 4.652 11.071 1.00 51.19 N ATOM 2156 CA GLU A 467 14.053 5.149 9.751 1.00 51.31 C ATOM 2157 C GLU A 467 12.877 5.664 8.926 1.00 51.30 C ATOM 2158 O GLU A 467 12.947 6.730 8.309 1.00 50.41 O ATOM 2159 CB GLU A 467 14.785 4.062 8.963 1.00 51.35 C ATOM 2160 CG GLU A 467 15.095 4.459 7.529 1.00 51.67 C ATOM 2161 CD GLU A 467 16.222 5.469 7.414 1.00 51.79 C ATOM 2162 OE1 GLU A 467 16.811 5.842 8.448 1.00 51.95 O ATOM 2163 OE2 GLU A 467 16.527 5.882 6.278 1.00 52.10 O ATOM 0 H GLU A 467 13.757 3.805 11.178 1.00 51.19 H new ATOM 0 HA GLU A 467 14.646 5.899 9.914 1.00 51.31 H new ATOM 0 HB2 GLU A 467 15.614 3.845 9.418 1.00 51.35 H new ATOM 0 HB3 GLU A 467 14.245 3.256 8.959 1.00 51.35 H new ATOM 0 HG2 GLU A 467 15.329 3.665 7.024 1.00 51.67 H new ATOM 0 HG3 GLU A 467 14.296 4.829 7.123 1.00 51.67 H new ATOM 2164 N ARG A 468 11.806 4.883 8.893 1.00 51.83 N ATOM 2165 CA ARG A 468 10.607 5.277 8.175 1.00 52.95 C ATOM 2166 C ARG A 468 10.039 6.570 8.758 1.00 52.62 C ATOM 2167 O ARG A 468 9.628 7.464 8.020 1.00 52.46 O ATOM 2168 CB ARG A 468 9.573 4.162 8.251 1.00 54.51 C ATOM 2169 CG ARG A 468 8.242 4.511 7.631 1.00 56.39 C ATOM 2170 CD ARG A 468 7.223 3.421 7.909 1.00 57.88 C ATOM 2171 NE ARG A 468 6.041 3.562 7.067 1.00 58.99 N ATOM 2172 CZ ARG A 468 5.932 3.035 5.853 1.00 59.51 C ATOM 2173 NH1 ARG A 468 6.934 2.328 5.344 1.00 59.73 N ATOM 2174 NH2 ARG A 468 4.819 3.211 5.150 1.00 59.82 N ATOM 0 H ARG A 468 11.755 4.118 9.282 1.00 51.83 H new ATOM 0 HA ARG A 468 10.833 5.435 7.245 1.00 52.95 H new ATOM 0 HB2 ARG A 468 9.928 3.375 7.809 1.00 54.51 H new ATOM 0 HB3 ARG A 468 9.433 3.927 9.182 1.00 54.51 H new ATOM 0 HG2 ARG A 468 7.925 5.356 7.987 1.00 56.39 H new ATOM 0 HG3 ARG A 468 8.346 4.628 6.674 1.00 56.39 H new ATOM 0 HD2 ARG A 468 7.628 2.553 7.757 1.00 57.88 H new ATOM 0 HD3 ARG A 468 6.961 3.452 8.843 1.00 57.88 H new ATOM 0 HE ARG A 468 5.376 4.012 7.374 1.00 58.99 H new ATOM 0 HH11 ARG A 468 7.653 2.211 5.801 1.00 59.73 H new ATOM 0 HH12 ARG A 468 6.864 1.987 4.558 1.00 59.73 H new ATOM 0 HH21 ARG A 468 4.169 3.666 5.481 1.00 59.82 H new ATOM 0 HH22 ARG A 468 4.749 2.870 4.364 1.00 59.82 H new ATOM 2175 N LYS A 469 10.029 6.661 10.086 1.00 52.00 N ATOM 2176 CA LYS A 469 9.597 7.871 10.787 1.00 51.66 C ATOM 2177 C LYS A 469 10.492 9.062 10.422 1.00 51.80 C ATOM 2178 O LYS A 469 10.009 10.169 10.179 1.00 51.32 O ATOM 2179 CB LYS A 469 9.609 7.628 12.302 1.00 51.33 C ATOM 2180 CG LYS A 469 9.036 8.758 13.151 1.00 51.21 C ATOM 2181 CD LYS A 469 9.033 8.373 14.640 1.00 51.22 C ATOM 2182 CE LYS A 469 8.160 9.314 15.484 1.00 51.02 C ATOM 2183 NZ LYS A 469 8.781 10.653 15.745 1.00 50.50 N ATOM 0 H LYS A 469 10.273 6.022 10.608 1.00 52.00 H new ATOM 0 HA LYS A 469 8.692 8.084 10.511 1.00 51.66 H new ATOM 0 HB2 LYS A 469 9.108 6.818 12.488 1.00 51.33 H new ATOM 0 HB3 LYS A 469 10.524 7.466 12.581 1.00 51.33 H new ATOM 0 HG2 LYS A 469 9.561 9.564 13.022 1.00 51.21 H new ATOM 0 HG3 LYS A 469 8.132 8.959 12.862 1.00 51.21 H new ATOM 0 HD2 LYS A 469 8.711 7.463 14.736 1.00 51.22 H new ATOM 0 HD3 LYS A 469 9.942 8.389 14.978 1.00 51.22 H new ATOM 0 HE2 LYS A 469 7.311 9.444 15.033 1.00 51.02 H new ATOM 0 HE3 LYS A 469 7.967 8.886 16.333 1.00 51.02 H new ATOM 0 HZ1 LYS A 469 8.461 10.986 16.506 1.00 50.50 H new ATOM 0 HZ2 LYS A 469 9.664 10.563 15.809 1.00 50.50 H new ATOM 0 HZ3 LYS A 469 8.587 11.206 15.075 1.00 50.50 H new ATOM 2184 N ARG A 470 11.797 8.815 10.384 1.00 52.01 N ATOM 2185 CA ARG A 470 12.776 9.819 9.997 1.00 53.05 C ATOM 2186 C ARG A 470 12.551 10.340 8.573 1.00 53.31 C ATOM 2187 O ARG A 470 12.496 11.549 8.357 1.00 53.25 O ATOM 2188 CB ARG A 470 14.191 9.249 10.118 1.00 53.18 C ATOM 2189 CG ARG A 470 15.288 10.291 10.054 1.00 53.47 C ATOM 2190 CD ARG A 470 16.654 9.623 9.922 1.00 53.76 C ATOM 2191 NE ARG A 470 16.753 8.818 8.711 1.00 53.94 N ATOM 2192 CZ ARG A 470 16.956 9.327 7.501 1.00 54.50 C ATOM 2193 NH1 ARG A 470 17.077 10.640 7.348 1.00 55.01 N ATOM 2194 NH2 ARG A 470 17.038 8.530 6.444 1.00 54.85 N ATOM 0 H ARG A 470 12.140 8.052 10.584 1.00 52.01 H new ATOM 0 HA ARG A 470 12.667 10.569 10.603 1.00 53.05 H new ATOM 0 HB2 ARG A 470 14.264 8.768 10.957 1.00 53.18 H new ATOM 0 HB3 ARG A 470 14.330 8.603 9.408 1.00 53.18 H new ATOM 0 HG2 ARG A 470 15.137 10.882 9.300 1.00 53.47 H new ATOM 0 HG3 ARG A 470 15.267 10.840 10.853 1.00 53.47 H new ATOM 0 HD2 ARG A 470 17.346 10.303 9.915 1.00 53.76 H new ATOM 0 HD3 ARG A 470 16.815 9.062 10.697 1.00 53.76 H new ATOM 0 HE ARG A 470 16.676 7.965 8.784 1.00 53.94 H new ATOM 0 HH11 ARG A 470 17.024 11.159 8.031 1.00 55.01 H new ATOM 0 HH12 ARG A 470 17.208 10.971 6.565 1.00 55.01 H new ATOM 0 HH21 ARG A 470 16.960 7.679 6.540 1.00 54.85 H new ATOM 0 HH22 ARG A 470 17.170 8.864 5.663 1.00 54.85 H new ATOM 2195 N ARG A 471 12.432 9.432 7.605 1.00 53.53 N ATOM 2196 CA ARG A 471 12.191 9.837 6.220 1.00 53.96 C ATOM 2197 C ARG A 471 10.892 10.628 6.095 1.00 54.01 C ATOM 2198 O ARG A 471 10.838 11.656 5.420 1.00 53.55 O ATOM 2199 CB ARG A 471 12.141 8.627 5.282 1.00 54.22 C ATOM 2200 CG ARG A 471 13.423 7.830 5.208 1.00 55.04 C ATOM 2201 CD ARG A 471 13.877 7.670 3.766 1.00 56.14 C ATOM 2202 NE ARG A 471 14.691 8.809 3.341 1.00 56.72 N ATOM 2203 CZ ARG A 471 15.139 8.995 2.106 1.00 56.89 C ATOM 2204 NH1 ARG A 471 14.847 8.122 1.152 1.00 57.26 N ATOM 2205 NH2 ARG A 471 15.878 10.061 1.825 1.00 57.10 N ATOM 0 H ARG A 471 12.487 8.583 7.727 1.00 53.53 H new ATOM 0 HA ARG A 471 12.934 10.404 5.959 1.00 53.96 H new ATOM 0 HB2 ARG A 471 11.426 8.039 5.571 1.00 54.22 H new ATOM 0 HB3 ARG A 471 11.914 8.934 4.390 1.00 54.22 H new ATOM 0 HG2 ARG A 471 14.115 8.275 5.722 1.00 55.04 H new ATOM 0 HG3 ARG A 471 13.289 6.957 5.608 1.00 55.04 H new ATOM 0 HD2 ARG A 471 14.388 6.851 3.674 1.00 56.14 H new ATOM 0 HD3 ARG A 471 13.103 7.588 3.187 1.00 56.14 H new ATOM 0 HE ARG A 471 14.893 9.399 3.933 1.00 56.72 H new ATOM 0 HH11 ARG A 471 14.366 7.433 1.333 1.00 57.26 H new ATOM 0 HH12 ARG A 471 15.139 8.245 0.352 1.00 57.26 H new ATOM 0 HH21 ARG A 471 16.065 10.629 2.443 1.00 57.10 H new ATOM 0 HH22 ARG A 471 16.169 10.183 1.025 1.00 57.10 H new ATOM 2206 N LEU A 472 9.851 10.131 6.756 1.00 54.44 N ATOM 2207 CA LEU A 472 8.526 10.731 6.708 1.00 54.82 C ATOM 2208 C LEU A 472 8.546 12.137 7.298 1.00 54.88 C ATOM 2209 O LEU A 472 7.910 13.051 6.777 1.00 54.98 O ATOM 2210 CB LEU A 472 7.542 9.846 7.474 1.00 55.56 C ATOM 2211 CG LEU A 472 6.130 9.622 6.931 1.00 56.08 C ATOM 2212 CD1 LEU A 472 5.227 10.831 7.205 1.00 56.57 C ATOM 2213 CD2 LEU A 472 6.154 9.258 5.441 1.00 56.21 C ATOM 0 H LEU A 472 9.897 9.428 7.250 1.00 54.44 H new ATOM 0 HA LEU A 472 8.244 10.800 5.782 1.00 54.82 H new ATOM 0 HB2 LEU A 472 7.955 8.974 7.572 1.00 55.56 H new ATOM 0 HB3 LEU A 472 7.452 10.219 8.365 1.00 55.56 H new ATOM 0 HG LEU A 472 5.750 8.866 7.405 1.00 56.08 H new ATOM 0 HD11 LEU A 472 4.341 10.660 6.850 1.00 56.57 H new ATOM 0 HD12 LEU A 472 5.169 10.981 8.162 1.00 56.57 H new ATOM 0 HD13 LEU A 472 5.600 11.617 6.777 1.00 56.57 H new ATOM 0 HD21 LEU A 472 5.247 9.122 5.126 1.00 56.21 H new ATOM 0 HD22 LEU A 472 6.566 9.978 4.938 1.00 56.21 H new ATOM 0 HD23 LEU A 472 6.665 8.443 5.315 1.00 56.21 H new ATOM 2214 N GLU A 473 9.295 12.310 8.381 1.00 55.10 N ATOM 2215 CA GLU A 473 9.408 13.613 9.030 1.00 55.19 C ATOM 2216 C GLU A 473 10.321 14.586 8.275 1.00 54.64 C ATOM 2217 O GLU A 473 10.041 15.782 8.214 1.00 54.48 O ATOM 2218 CB GLU A 473 9.845 13.450 10.486 1.00 55.50 C ATOM 2219 CG GLU A 473 8.728 12.905 11.368 1.00 56.45 C ATOM 2220 CD GLU A 473 9.128 12.771 12.822 1.00 56.80 C ATOM 2221 OE1 GLU A 473 8.236 12.498 13.649 1.00 56.41 O ATOM 2222 OE2 GLU A 473 10.330 12.937 13.133 1.00 57.40 O ATOM 0 H GLU A 473 9.748 11.684 8.758 1.00 55.10 H new ATOM 0 HA GLU A 473 8.525 14.013 9.013 1.00 55.19 H new ATOM 0 HB2 GLU A 473 10.608 12.852 10.527 1.00 55.50 H new ATOM 0 HB3 GLU A 473 10.138 14.308 10.832 1.00 55.50 H new ATOM 0 HG2 GLU A 473 7.958 13.491 11.303 1.00 56.45 H new ATOM 0 HG3 GLU A 473 8.453 12.037 11.033 1.00 56.45 H new ATOM 2223 N ASN A 474 11.406 14.075 7.700 1.00 53.93 N ATOM 2224 CA ASN A 474 12.261 14.895 6.853 1.00 53.68 C ATOM 2225 C ASN A 474 11.445 15.579 5.755 1.00 53.50 C ATOM 2226 O ASN A 474 11.564 16.784 5.545 1.00 53.61 O ATOM 2227 CB ASN A 474 13.403 14.067 6.256 1.00 53.62 C ATOM 2228 CG ASN A 474 14.669 14.129 7.092 1.00 53.46 C ATOM 2229 OD1 ASN A 474 15.487 15.030 6.932 1.00 53.53 O ATOM 2230 ND2 ASN A 474 14.838 13.161 7.982 1.00 54.04 N ATOM 0 H ASN A 474 11.663 13.259 7.788 1.00 53.93 H new ATOM 0 HA ASN A 474 12.656 15.586 7.407 1.00 53.68 H new ATOM 0 HB2 ASN A 474 13.119 13.143 6.173 1.00 53.62 H new ATOM 0 HB3 ASN A 474 13.595 14.386 5.360 1.00 53.62 H new ATOM 0 HD21 ASN A 474 15.543 13.148 8.475 1.00 54.04 H new ATOM 0 HD22 ASN A 474 14.243 12.546 8.066 1.00 54.04 H new ATOM 2231 N ILE A 475 10.597 14.812 5.077 1.00 53.28 N ATOM 2232 CA ILE A 475 9.734 15.363 4.033 1.00 53.22 C ATOM 2233 C ILE A 475 8.837 16.487 4.550 1.00 53.12 C ATOM 2234 O ILE A 475 8.640 17.495 3.872 1.00 52.78 O ATOM 2235 CB ILE A 475 8.882 14.267 3.354 1.00 53.38 C ATOM 2236 CG1 ILE A 475 9.724 13.520 2.313 1.00 53.60 C ATOM 2237 CG2 ILE A 475 7.644 14.869 2.697 1.00 53.29 C ATOM 2238 CD1 ILE A 475 8.912 12.697 1.328 1.00 53.70 C ATOM 0 H ILE A 475 10.505 13.967 5.206 1.00 53.28 H new ATOM 0 HA ILE A 475 10.329 15.743 3.368 1.00 53.22 H new ATOM 0 HB ILE A 475 8.589 13.641 4.034 1.00 53.38 H new ATOM 0 HG12 ILE A 475 10.256 14.164 1.820 1.00 53.60 H new ATOM 0 HG13 ILE A 475 10.344 12.934 2.774 1.00 53.60 H new ATOM 0 HG21 ILE A 475 7.125 14.165 2.278 1.00 53.29 H new ATOM 0 HG22 ILE A 475 7.103 15.312 3.370 1.00 53.29 H new ATOM 0 HG23 ILE A 475 7.915 15.514 2.025 1.00 53.29 H new ATOM 0 HD11 ILE A 475 9.510 12.256 0.704 1.00 53.70 H new ATOM 0 HD12 ILE A 475 8.398 12.030 1.810 1.00 53.70 H new ATOM 0 HD13 ILE A 475 8.308 13.279 0.840 1.00 53.70 H new ATOM 2239 N ASP A 476 8.308 16.315 5.756 1.00 53.43 N ATOM 2240 CA ASP A 476 7.420 17.312 6.348 1.00 53.54 C ATOM 2241 C ASP A 476 8.144 18.565 6.852 1.00 53.17 C ATOM 2242 O ASP A 476 7.704 19.678 6.579 1.00 53.10 O ATOM 2243 CB ASP A 476 6.561 16.684 7.454 1.00 54.15 C ATOM 2244 CG ASP A 476 5.453 15.802 6.896 1.00 54.45 C ATOM 2245 OD1 ASP A 476 4.946 16.101 5.791 1.00 54.55 O ATOM 2246 OD2 ASP A 476 5.093 14.809 7.561 1.00 54.66 O ATOM 0 H ASP A 476 8.451 15.626 6.250 1.00 53.43 H new ATOM 0 HA ASP A 476 6.841 17.617 5.632 1.00 53.54 H new ATOM 0 HB2 ASP A 476 7.127 16.157 8.040 1.00 54.15 H new ATOM 0 HB3 ASP A 476 6.170 17.387 7.995 1.00 54.15 H new ATOM 2247 N LYS A 477 9.244 18.386 7.583 1.00 52.91 N ATOM 2248 CA LYS A 477 10.047 19.516 8.055 1.00 52.58 C ATOM 2249 C LYS A 477 10.470 20.384 6.878 1.00 52.42 C ATOM 2250 O LYS A 477 10.389 21.612 6.930 1.00 52.32 O ATOM 2251 CB LYS A 477 11.293 19.031 8.804 1.00 52.98 C ATOM 2252 CG LYS A 477 11.013 18.176 10.035 1.00 53.29 C ATOM 2253 CD LYS A 477 10.752 19.024 11.269 1.00 53.70 C ATOM 2254 CE LYS A 477 10.498 18.138 12.482 1.00 54.09 C ATOM 2255 NZ LYS A 477 10.846 18.838 13.747 1.00 54.07 N ATOM 0 H LYS A 477 9.544 17.615 7.818 1.00 52.91 H new ATOM 0 HA LYS A 477 9.502 20.037 8.665 1.00 52.58 H new ATOM 0 HB2 LYS A 477 11.844 18.520 8.191 1.00 52.98 H new ATOM 0 HB3 LYS A 477 11.812 19.804 9.075 1.00 52.98 H new ATOM 0 HG2 LYS A 477 10.245 17.608 9.866 1.00 53.29 H new ATOM 0 HG3 LYS A 477 11.768 17.590 10.200 1.00 53.29 H new ATOM 0 HD2 LYS A 477 11.513 19.602 11.438 1.00 53.70 H new ATOM 0 HD3 LYS A 477 9.986 19.600 11.116 1.00 53.70 H new ATOM 0 HE2 LYS A 477 9.565 17.874 12.502 1.00 54.09 H new ATOM 0 HE3 LYS A 477 11.021 17.325 12.406 1.00 54.09 H new ATOM 0 HZ1 LYS A 477 10.434 18.441 14.429 1.00 54.07 H new ATOM 0 HZ2 LYS A 477 11.726 18.805 13.873 1.00 54.07 H new ATOM 0 HZ3 LYS A 477 10.586 19.688 13.698 1.00 54.07 H new ATOM 2256 N ILE A 478 10.919 19.731 5.812 1.00 52.16 N ATOM 2257 CA ILE A 478 11.380 20.421 4.607 1.00 51.85 C ATOM 2258 C ILE A 478 10.288 21.296 3.987 1.00 51.33 C ATOM 2259 O ILE A 478 10.497 22.488 3.756 1.00 51.23 O ATOM 2260 CB ILE A 478 11.936 19.411 3.573 1.00 52.27 C ATOM 2261 CG1 ILE A 478 13.271 18.843 4.064 1.00 52.60 C ATOM 2262 CG2 ILE A 478 12.095 20.061 2.205 1.00 52.15 C ATOM 2263 CD1 ILE A 478 13.745 17.623 3.298 1.00 53.42 C ATOM 0 H ILE A 478 10.966 18.874 5.765 1.00 52.16 H new ATOM 0 HA ILE A 478 12.099 21.014 4.875 1.00 51.85 H new ATOM 0 HB ILE A 478 11.302 18.683 3.481 1.00 52.27 H new ATOM 0 HG12 ILE A 478 13.948 19.535 4.002 1.00 52.60 H new ATOM 0 HG13 ILE A 478 13.187 18.611 5.002 1.00 52.60 H new ATOM 0 HG21 ILE A 478 12.444 19.410 1.576 1.00 52.15 H new ATOM 0 HG22 ILE A 478 11.233 20.379 1.896 1.00 52.15 H new ATOM 0 HG23 ILE A 478 12.710 20.808 2.271 1.00 52.15 H new ATOM 0 HD11 ILE A 478 14.591 17.321 3.663 1.00 53.42 H new ATOM 0 HD12 ILE A 478 13.087 16.915 3.378 1.00 53.42 H new ATOM 0 HD13 ILE A 478 13.860 17.852 2.363 1.00 53.42 H new ATOM 2264 N ALA A 479 9.124 20.705 3.735 1.00 51.22 N ATOM 2265 CA ALA A 479 7.993 21.440 3.178 1.00 51.61 C ATOM 2266 C ALA A 479 7.582 22.574 4.108 1.00 51.84 C ATOM 2267 O ALA A 479 7.297 23.682 3.655 1.00 51.93 O ATOM 2268 CB ALA A 479 6.818 20.509 2.928 1.00 51.62 C ATOM 0 H ALA A 479 8.968 19.872 3.881 1.00 51.22 H new ATOM 0 HA ALA A 479 8.268 21.821 2.329 1.00 51.61 H new ATOM 0 HB1 ALA A 479 6.077 21.015 2.559 1.00 51.62 H new ATOM 0 HB2 ALA A 479 7.081 19.817 2.301 1.00 51.62 H new ATOM 0 HB3 ALA A 479 6.545 20.101 3.764 1.00 51.62 H new ATOM 2269 N GLN A 480 7.565 22.280 5.408 1.00 51.83 N ATOM 2270 CA GLN A 480 7.221 23.253 6.443 1.00 52.03 C ATOM 2271 C GLN A 480 8.268 24.358 6.561 1.00 51.77 C ATOM 2272 O GLN A 480 7.926 25.538 6.661 1.00 52.14 O ATOM 2273 CB GLN A 480 7.056 22.556 7.801 1.00 52.23 C ATOM 2274 CG GLN A 480 5.821 21.672 7.921 1.00 52.61 C ATOM 2275 CD GLN A 480 5.859 20.754 9.149 1.00 52.91 C ATOM 2276 OE1 GLN A 480 6.920 20.266 9.548 1.00 53.28 O ATOM 2277 NE2 GLN A 480 4.694 20.513 9.742 1.00 52.73 N ATOM 0 H GLN A 480 7.755 21.500 5.717 1.00 51.83 H new ATOM 0 HA GLN A 480 6.381 23.662 6.181 1.00 52.03 H new ATOM 0 HB2 GLN A 480 7.843 22.015 7.970 1.00 52.23 H new ATOM 0 HB3 GLN A 480 7.022 23.232 8.495 1.00 52.23 H new ATOM 0 HG2 GLN A 480 5.031 22.233 7.967 1.00 52.61 H new ATOM 0 HG3 GLN A 480 5.738 21.130 7.121 1.00 52.61 H new ATOM 0 HE21 GLN A 480 3.974 20.870 9.436 1.00 52.73 H new ATOM 0 HE22 GLN A 480 4.660 20.000 10.431 1.00 52.73 H new ATOM 2278 N TRP A 481 9.542 23.970 6.572 1.00 51.24 N ATOM 2279 CA TRP A 481 10.635 24.935 6.633 1.00 50.44 C ATOM 2280 C TRP A 481 10.564 25.876 5.443 1.00 50.65 C ATOM 2281 O TRP A 481 10.583 27.093 5.602 1.00 50.07 O ATOM 2282 CB TRP A 481 11.993 24.226 6.665 1.00 49.34 C ATOM 2283 CG TRP A 481 13.157 25.168 6.788 1.00 49.17 C ATOM 2284 CD1 TRP A 481 13.547 25.852 7.908 1.00 49.09 C ATOM 2285 CD2 TRP A 481 14.089 25.527 5.756 1.00 48.90 C ATOM 2286 NE1 TRP A 481 14.660 26.615 7.633 1.00 48.97 N ATOM 2287 CE2 TRP A 481 15.011 26.434 6.320 1.00 48.95 C ATOM 2288 CE3 TRP A 481 14.230 25.171 4.410 1.00 49.27 C ATOM 2289 CZ2 TRP A 481 16.056 26.992 5.586 1.00 48.94 C ATOM 2290 CZ3 TRP A 481 15.272 25.733 3.676 1.00 49.12 C ATOM 2291 CH2 TRP A 481 16.173 26.628 4.270 1.00 49.12 C ATOM 0 H TRP A 481 9.794 23.148 6.545 1.00 51.24 H new ATOM 0 HA TRP A 481 10.543 25.448 7.451 1.00 50.44 H new ATOM 0 HB2 TRP A 481 12.008 23.605 7.410 1.00 49.34 H new ATOM 0 HB3 TRP A 481 12.095 23.701 5.856 1.00 49.34 H new ATOM 0 HD1 TRP A 481 13.122 25.808 8.734 1.00 49.09 H new ATOM 0 HE1 TRP A 481 15.069 27.123 8.194 1.00 48.97 H new ATOM 0 HE3 TRP A 481 13.640 24.571 4.014 1.00 49.27 H new ATOM 0 HZ2 TRP A 481 16.653 27.590 5.975 1.00 48.94 H new ATOM 0 HZ3 TRP A 481 15.372 25.511 2.778 1.00 49.12 H new ATOM 0 HH2 TRP A 481 16.865 26.982 3.760 1.00 49.12 H new ATOM 2292 N GLN A 482 10.482 25.304 4.244 1.00 51.15 N ATOM 2293 CA GLN A 482 10.448 26.108 3.031 1.00 51.02 C ATOM 2294 C GLN A 482 9.348 27.174 3.068 1.00 51.37 C ATOM 2295 O GLN A 482 9.608 28.346 2.806 1.00 51.27 O ATOM 2296 CB GLN A 482 10.290 25.230 1.789 1.00 50.63 C ATOM 2297 CG GLN A 482 10.294 26.048 0.507 1.00 50.63 C ATOM 2298 CD GLN A 482 10.177 25.207 -0.734 1.00 50.46 C ATOM 2299 OE1 GLN A 482 10.570 24.042 -0.753 1.00 50.79 O ATOM 2300 NE2 GLN A 482 9.641 25.799 -1.791 1.00 50.69 N ATOM 0 H GLN A 482 10.445 24.455 4.114 1.00 51.15 H new ATOM 0 HA GLN A 482 11.300 26.568 2.983 1.00 51.02 H new ATOM 0 HB2 GLN A 482 11.010 24.581 1.759 1.00 50.63 H new ATOM 0 HB3 GLN A 482 9.461 24.731 1.850 1.00 50.63 H new ATOM 0 HG2 GLN A 482 9.559 26.681 0.532 1.00 50.63 H new ATOM 0 HG3 GLN A 482 11.113 26.566 0.463 1.00 50.63 H new ATOM 0 HE21 GLN A 482 9.378 26.616 -1.739 1.00 50.69 H new ATOM 0 HE22 GLN A 482 9.556 25.366 -2.529 1.00 50.69 H new ATOM 2301 N SER A 483 8.126 26.765 3.397 1.00 51.78 N ATOM 2302 CA SER A 483 6.991 27.685 3.406 1.00 52.14 C ATOM 2303 C SER A 483 7.134 28.749 4.493 1.00 52.27 C ATOM 2304 O SER A 483 6.399 29.740 4.508 1.00 52.09 O ATOM 2305 CB SER A 483 5.675 26.921 3.583 1.00 52.61 C ATOM 2306 OG SER A 483 5.455 26.588 4.945 1.00 53.30 O ATOM 0 H SER A 483 7.932 25.957 3.619 1.00 51.78 H new ATOM 0 HA SER A 483 6.979 28.137 2.548 1.00 52.14 H new ATOM 0 HB2 SER A 483 4.938 27.461 3.256 1.00 52.61 H new ATOM 0 HB3 SER A 483 5.693 26.112 3.048 1.00 52.61 H new ATOM 0 HG SER A 483 6.178 26.338 5.293 1.00 53.30 H new ATOM 2307 N SER A 484 8.084 28.536 5.399 1.00 52.46 N ATOM 2308 CA SER A 484 8.327 29.460 6.499 1.00 52.74 C ATOM 2309 C SER A 484 9.350 30.534 6.124 1.00 53.07 C ATOM 2310 O SER A 484 9.449 31.573 6.787 1.00 52.87 O ATOM 2311 CB SER A 484 8.809 28.697 7.728 1.00 52.77 C ATOM 2312 OG SER A 484 8.540 29.429 8.911 1.00 53.32 O ATOM 0 H SER A 484 8.605 27.852 5.392 1.00 52.46 H new ATOM 0 HA SER A 484 7.488 29.904 6.698 1.00 52.74 H new ATOM 0 HB2 SER A 484 8.370 27.833 7.770 1.00 52.77 H new ATOM 0 HB3 SER A 484 9.762 28.528 7.656 1.00 52.77 H new ATOM 0 HG SER A 484 8.810 28.994 9.577 1.00 53.32 H new ATOM 2313 N ILE A 485 10.102 30.277 5.057 1.00 53.23 N ATOM 2314 CA ILE A 485 11.177 31.164 4.626 1.00 53.39 C ATOM 2315 C ILE A 485 10.636 32.339 3.813 1.00 53.72 C ATOM 2316 O ILE A 485 9.700 32.179 3.030 1.00 53.50 O ATOM 2317 CB ILE A 485 12.239 30.392 3.799 1.00 53.22 C ATOM 2318 CG1 ILE A 485 12.865 29.263 4.634 1.00 53.29 C ATOM 2319 CG2 ILE A 485 13.307 31.336 3.263 1.00 53.13 C ATOM 2320 CD1 ILE A 485 13.363 29.695 6.030 1.00 53.09 C ATOM 0 H ILE A 485 10.002 29.581 4.562 1.00 53.23 H new ATOM 0 HA ILE A 485 11.600 31.514 5.426 1.00 53.39 H new ATOM 0 HB ILE A 485 11.793 29.989 3.038 1.00 53.22 H new ATOM 0 HG12 ILE A 485 12.210 28.556 4.742 1.00 53.29 H new ATOM 0 HG13 ILE A 485 13.610 28.887 4.140 1.00 53.29 H new ATOM 0 HG21 ILE A 485 13.958 30.831 2.751 1.00 53.13 H new ATOM 0 HG22 ILE A 485 12.893 32.002 2.692 1.00 53.13 H new ATOM 0 HG23 ILE A 485 13.751 31.777 4.004 1.00 53.13 H new ATOM 0 HD11 ILE A 485 13.742 28.929 6.490 1.00 53.09 H new ATOM 0 HD12 ILE A 485 14.041 30.382 5.934 1.00 53.09 H new ATOM 0 HD13 ILE A 485 12.619 30.046 6.545 1.00 53.09 H new ATOM 2321 N GLU A 486 11.223 33.518 4.009 1.00 54.16 N ATOM 2322 CA GLU A 486 10.798 34.713 3.288 1.00 54.75 C ATOM 2323 C GLU A 486 11.433 34.792 1.906 1.00 54.78 C ATOM 2324 O GLU A 486 12.557 34.332 1.702 1.00 54.72 O ATOM 2325 CB GLU A 486 11.133 35.982 4.077 1.00 55.10 C ATOM 2326 CG GLU A 486 10.316 36.180 5.342 1.00 55.60 C ATOM 2327 CD GLU A 486 8.824 36.201 5.075 1.00 55.88 C ATOM 2328 OE1 GLU A 486 8.414 36.659 3.989 1.00 56.17 O ATOM 2329 OE2 GLU A 486 8.058 35.759 5.955 1.00 56.08 O ATOM 0 H GLU A 486 11.872 33.646 4.558 1.00 54.16 H new ATOM 0 HA GLU A 486 9.836 34.649 3.182 1.00 54.75 H new ATOM 0 HB2 GLU A 486 12.073 35.961 4.314 1.00 55.10 H new ATOM 0 HB3 GLU A 486 11.003 36.750 3.500 1.00 55.10 H new ATOM 0 HG2 GLU A 486 10.519 35.468 5.969 1.00 55.60 H new ATOM 0 HG3 GLU A 486 10.577 37.013 5.765 1.00 55.60 H new ATOM 2330 N ASP A 487 10.698 35.377 0.964 1.00 54.88 N ATOM 2331 CA ASP A 487 11.205 35.642 -0.381 1.00 55.17 C ATOM 2332 C ASP A 487 11.785 34.408 -1.071 1.00 55.11 C ATOM 2333 O ASP A 487 12.837 34.491 -1.710 1.00 55.02 O ATOM 2334 CB ASP A 487 12.254 36.760 -0.344 1.00 55.40 C ATOM 2335 CG ASP A 487 11.698 38.065 0.193 1.00 55.79 C ATOM 2336 OD1 ASP A 487 12.496 38.989 0.469 1.00 55.93 O ATOM 2337 OD2 ASP A 487 10.461 38.172 0.340 1.00 55.99 O ATOM 0 H ASP A 487 9.886 35.633 1.087 1.00 54.88 H new ATOM 0 HA ASP A 487 10.439 35.920 -0.908 1.00 55.17 H new ATOM 0 HB2 ASP A 487 13.001 36.480 0.207 1.00 55.40 H new ATOM 0 HB3 ASP A 487 12.600 36.904 -1.239 1.00 55.40 H new ATOM 2338 N TRP A 488 11.107 33.269 -0.945 1.00 55.04 N ATOM 2339 CA TRP A 488 11.568 32.061 -1.616 1.00 54.93 C ATOM 2340 C TRP A 488 11.605 32.267 -3.124 1.00 54.61 C ATOM 2341 O TRP A 488 10.689 32.843 -3.709 1.00 54.44 O ATOM 2342 CB TRP A 488 10.701 30.843 -1.277 1.00 55.08 C ATOM 2343 CG TRP A 488 11.339 29.545 -1.712 1.00 55.05 C ATOM 2344 CD1 TRP A 488 11.173 28.903 -2.909 1.00 55.20 C ATOM 2345 CD2 TRP A 488 12.262 28.750 -0.958 1.00 55.20 C ATOM 2346 NE1 TRP A 488 11.929 27.754 -2.941 1.00 55.17 N ATOM 2347 CE2 TRP A 488 12.606 27.638 -1.756 1.00 55.17 C ATOM 2348 CE3 TRP A 488 12.823 28.864 0.321 1.00 55.24 C ATOM 2349 CZ2 TRP A 488 13.486 26.649 -1.317 1.00 55.27 C ATOM 2350 CZ3 TRP A 488 13.698 27.885 0.752 1.00 55.09 C ATOM 2351 CH2 TRP A 488 14.021 26.791 -0.064 1.00 55.15 C ATOM 0 H TRP A 488 10.388 33.177 -0.482 1.00 55.04 H new ATOM 0 HA TRP A 488 12.465 31.883 -1.293 1.00 54.93 H new ATOM 0 HB2 TRP A 488 10.542 30.818 -0.320 1.00 55.08 H new ATOM 0 HB3 TRP A 488 9.836 30.935 -1.706 1.00 55.08 H new ATOM 0 HD1 TRP A 488 10.628 29.201 -3.601 1.00 55.20 H new ATOM 0 HE1 TRP A 488 11.970 27.200 -3.597 1.00 55.17 H new ATOM 0 HE3 TRP A 488 12.611 29.585 0.869 1.00 55.24 H new ATOM 0 HZ2 TRP A 488 13.701 25.921 -1.854 1.00 55.27 H new ATOM 0 HZ3 TRP A 488 14.079 27.953 1.598 1.00 55.09 H new ATOM 0 HH2 TRP A 488 14.612 26.147 0.253 1.00 55.15 H new ATOM 2352 N GLU A 489 12.687 31.806 -3.738 1.00 54.54 N ATOM 2353 CA GLU A 489 12.812 31.785 -5.183 1.00 54.65 C ATOM 2354 C GLU A 489 13.422 30.460 -5.601 1.00 54.13 C ATOM 2355 O GLU A 489 14.128 29.820 -4.816 1.00 54.12 O ATOM 2356 CB GLU A 489 13.733 32.907 -5.658 1.00 55.53 C ATOM 2357 CG GLU A 489 13.213 34.314 -5.455 1.00 56.51 C ATOM 2358 CD GLU A 489 14.278 35.342 -5.764 1.00 57.24 C ATOM 2359 OE1 GLU A 489 15.389 34.926 -6.160 1.00 57.56 O ATOM 2360 OE2 GLU A 489 14.011 36.557 -5.611 1.00 57.76 O ATOM 0 H GLU A 489 13.373 31.495 -3.323 1.00 54.54 H new ATOM 0 HA GLU A 489 11.933 31.904 -5.575 1.00 54.65 H new ATOM 0 HB2 GLU A 489 14.582 32.824 -5.196 1.00 55.53 H new ATOM 0 HB3 GLU A 489 13.911 32.779 -6.603 1.00 55.53 H new ATOM 0 HG2 GLU A 489 12.442 34.462 -6.025 1.00 56.51 H new ATOM 0 HG3 GLU A 489 12.913 34.421 -4.539 1.00 56.51 H new ATOM 2361 N GLY A 490 13.131 30.040 -6.828 1.00 53.45 N ATOM 2362 CA GLY A 490 13.915 29.007 -7.488 1.00 53.03 C ATOM 2363 C GLY A 490 13.473 27.556 -7.434 1.00 53.25 C ATOM 2364 O GLY A 490 14.263 26.670 -7.771 1.00 53.71 O ATOM 0 H GLY A 490 12.478 30.344 -7.297 1.00 53.45 H new ATOM 0 HA2 GLY A 490 13.982 29.252 -8.424 1.00 53.03 H new ATOM 0 HA3 GLY A 490 14.811 29.048 -7.119 1.00 53.03 H new ATOM 2365 N GLU A 491 12.237 27.283 -7.022 1.00 52.60 N ATOM 2366 CA GLU A 491 11.756 25.899 -7.061 1.00 52.56 C ATOM 2367 C GLU A 491 11.424 25.360 -5.657 1.00 52.69 C ATOM 2368 O GLU A 491 11.490 26.095 -4.667 1.00 54.00 O ATOM 2369 CB GLU A 491 12.798 25.018 -7.783 1.00 51.63 C ATOM 2370 CG GLU A 491 12.411 23.568 -8.039 1.00 51.12 C ATOM 2371 CD GLU A 491 11.136 23.429 -8.851 1.00 50.62 C ATOM 2372 OE1 GLU A 491 10.067 23.226 -8.231 1.00 50.37 O ATOM 2373 OE2 GLU A 491 11.204 23.528 -10.097 1.00 49.96 O ATOM 0 H GLU A 491 11.675 27.862 -6.725 1.00 52.60 H new ATOM 0 HA GLU A 491 10.924 25.874 -7.558 1.00 52.56 H new ATOM 0 HB2 GLU A 491 13.004 25.431 -8.636 1.00 51.63 H new ATOM 0 HB3 GLU A 491 13.615 25.025 -7.260 1.00 51.63 H new ATOM 0 HG2 GLU A 491 13.136 23.123 -8.505 1.00 51.12 H new ATOM 0 HG3 GLU A 491 12.299 23.114 -7.189 1.00 51.12 H new ATOM 2374 N ASP A 492 11.041 24.091 -5.573 1.00 52.03 N ATOM 2375 CA ASP A 492 10.767 23.462 -4.279 1.00 51.36 C ATOM 2376 C ASP A 492 11.870 22.475 -3.910 1.00 51.01 C ATOM 2377 O ASP A 492 12.329 21.694 -4.749 1.00 50.75 O ATOM 2378 CB ASP A 492 9.403 22.768 -4.280 1.00 51.13 C ATOM 2379 CG ASP A 492 8.247 23.752 -4.413 1.00 51.03 C ATOM 2380 OD1 ASP A 492 8.417 24.937 -4.054 1.00 50.43 O ATOM 2381 OD2 ASP A 492 7.167 23.337 -4.877 1.00 50.98 O ATOM 0 H ASP A 492 10.933 23.574 -6.252 1.00 52.03 H new ATOM 0 HA ASP A 492 10.747 24.163 -3.608 1.00 51.36 H new ATOM 0 HB2 ASP A 492 9.368 22.132 -5.011 1.00 51.13 H new ATOM 0 HB3 ASP A 492 9.300 22.262 -3.459 1.00 51.13 H new ATOM 2382 N LEU A 493 12.301 22.531 -2.654 1.00 50.53 N ATOM 2383 CA LEU A 493 13.355 21.653 -2.157 1.00 50.31 C ATOM 2384 C LEU A 493 13.076 20.204 -2.523 1.00 49.82 C ATOM 2385 O LEU A 493 13.971 19.474 -2.942 1.00 48.94 O ATOM 2386 CB LEU A 493 13.482 21.785 -0.631 1.00 50.03 C ATOM 2387 CG LEU A 493 13.998 23.138 -0.144 1.00 50.17 C ATOM 2388 CD1 LEU A 493 13.948 23.241 1.374 1.00 50.04 C ATOM 2389 CD2 LEU A 493 15.413 23.391 -0.667 1.00 50.07 C ATOM 0 H LEU A 493 11.991 23.078 -2.067 1.00 50.53 H new ATOM 0 HA LEU A 493 14.189 21.922 -2.574 1.00 50.31 H new ATOM 0 HB2 LEU A 493 12.613 21.622 -0.232 1.00 50.03 H new ATOM 0 HB3 LEU A 493 14.077 21.091 -0.308 1.00 50.03 H new ATOM 0 HG LEU A 493 13.413 23.826 -0.499 1.00 50.17 H new ATOM 0 HD11 LEU A 493 14.281 24.109 1.651 1.00 50.04 H new ATOM 0 HD12 LEU A 493 13.032 23.135 1.676 1.00 50.04 H new ATOM 0 HD13 LEU A 493 14.499 22.544 1.764 1.00 50.04 H new ATOM 0 HD21 LEU A 493 15.726 24.252 -0.350 1.00 50.07 H new ATOM 0 HD22 LEU A 493 16.006 22.694 -0.346 1.00 50.07 H new ATOM 0 HD23 LEU A 493 15.405 23.387 -1.637 1.00 50.07 H new ATOM 2390 N LEU A 494 11.813 19.816 -2.370 1.00 50.01 N ATOM 2391 CA LEU A 494 11.375 18.432 -2.502 1.00 49.94 C ATOM 2392 C LEU A 494 11.391 17.884 -3.929 1.00 49.71 C ATOM 2393 O LEU A 494 11.223 16.683 -4.140 1.00 49.78 O ATOM 2394 CB LEU A 494 9.990 18.263 -1.869 1.00 50.55 C ATOM 2395 CG LEU A 494 10.016 18.352 -0.338 1.00 50.78 C ATOM 2396 CD1 LEU A 494 8.611 18.292 0.264 1.00 50.81 C ATOM 2397 CD2 LEU A 494 10.894 17.226 0.228 1.00 50.76 C ATOM 0 H LEU A 494 11.175 20.362 -2.183 1.00 50.01 H new ATOM 0 HA LEU A 494 12.032 17.900 -2.026 1.00 49.94 H new ATOM 0 HB2 LEU A 494 9.395 18.945 -2.218 1.00 50.55 H new ATOM 0 HB3 LEU A 494 9.622 17.405 -2.132 1.00 50.55 H new ATOM 0 HG LEU A 494 10.393 19.212 -0.093 1.00 50.78 H new ATOM 0 HD11 LEU A 494 8.670 18.351 1.230 1.00 50.81 H new ATOM 0 HD12 LEU A 494 8.082 19.032 -0.073 1.00 50.81 H new ATOM 0 HD13 LEU A 494 8.188 17.455 0.017 1.00 50.81 H new ATOM 0 HD21 LEU A 494 10.910 17.283 1.196 1.00 50.76 H new ATOM 0 HD22 LEU A 494 10.531 16.367 -0.039 1.00 50.76 H new ATOM 0 HD23 LEU A 494 11.797 17.316 -0.115 1.00 50.76 H new ATOM 2398 N VAL A 495 11.597 18.755 -4.908 1.00 49.23 N ATOM 2399 CA VAL A 495 11.817 18.290 -6.271 1.00 48.68 C ATOM 2400 C VAL A 495 13.105 17.474 -6.323 1.00 48.57 C ATOM 2401 O VAL A 495 13.157 16.410 -6.931 1.00 48.10 O ATOM 2402 CB VAL A 495 11.886 19.461 -7.269 1.00 48.54 C ATOM 2403 CG1 VAL A 495 12.327 18.972 -8.645 1.00 48.67 C ATOM 2404 CG2 VAL A 495 10.536 20.164 -7.351 1.00 48.13 C ATOM 0 H VAL A 495 11.613 19.609 -4.807 1.00 49.23 H new ATOM 0 HA VAL A 495 11.065 17.735 -6.529 1.00 48.68 H new ATOM 0 HB VAL A 495 12.545 20.098 -6.953 1.00 48.54 H new ATOM 0 HG11 VAL A 495 12.364 19.722 -9.259 1.00 48.67 H new ATOM 0 HG12 VAL A 495 13.205 18.565 -8.578 1.00 48.67 H new ATOM 0 HG13 VAL A 495 11.692 18.317 -8.975 1.00 48.67 H new ATOM 0 HG21 VAL A 495 10.591 20.899 -7.982 1.00 48.13 H new ATOM 0 HG22 VAL A 495 9.860 19.534 -7.647 1.00 48.13 H new ATOM 0 HG23 VAL A 495 10.296 20.507 -6.476 1.00 48.13 H new ATOM 2405 N ARG A 496 14.140 17.957 -5.648 1.00 48.97 N ATOM 2406 CA ARG A 496 15.443 17.312 -5.729 1.00 49.11 C ATOM 2407 C ARG A 496 15.907 16.683 -4.416 1.00 49.37 C ATOM 2408 O ARG A 496 16.774 15.813 -4.424 1.00 49.62 O ATOM 2409 CB ARG A 496 16.488 18.301 -6.264 1.00 48.78 C ATOM 2410 CG ARG A 496 16.186 18.762 -7.694 1.00 49.00 C ATOM 2411 CD ARG A 496 17.312 19.583 -8.308 1.00 48.52 C ATOM 2412 NE ARG A 496 18.503 18.776 -8.566 1.00 48.20 N ATOM 2413 CZ ARG A 496 19.722 19.075 -8.119 1.00 47.85 C ATOM 2414 NH1 ARG A 496 19.917 20.179 -7.410 1.00 46.94 N ATOM 2415 NH2 ARG A 496 20.750 18.278 -8.403 1.00 47.37 N ATOM 0 H ARG A 496 14.110 18.651 -5.141 1.00 48.97 H new ATOM 0 HA ARG A 496 15.345 16.572 -6.349 1.00 49.11 H new ATOM 0 HB2 ARG A 496 16.525 19.074 -5.680 1.00 48.78 H new ATOM 0 HB3 ARG A 496 17.364 17.885 -6.240 1.00 48.78 H new ATOM 0 HG2 ARG A 496 16.019 17.985 -8.250 1.00 49.00 H new ATOM 0 HG3 ARG A 496 15.372 19.290 -7.693 1.00 49.00 H new ATOM 0 HD2 ARG A 496 17.006 19.980 -9.138 1.00 48.52 H new ATOM 0 HD3 ARG A 496 17.540 20.313 -7.712 1.00 48.52 H new ATOM 0 HE ARG A 496 18.411 18.062 -9.037 1.00 48.20 H new ATOM 0 HH11 ARG A 496 19.256 20.702 -7.239 1.00 46.94 H new ATOM 0 HH12 ARG A 496 20.704 20.371 -7.122 1.00 46.94 H new ATOM 0 HH21 ARG A 496 20.627 17.570 -8.875 1.00 47.37 H new ATOM 0 HH22 ARG A 496 21.537 18.471 -8.114 1.00 47.37 H new ATOM 2416 N SER A 497 15.320 17.109 -3.299 1.00 49.69 N ATOM 2417 CA SER A 497 15.823 16.724 -1.977 1.00 49.76 C ATOM 2418 C SER A 497 14.816 15.943 -1.142 1.00 50.17 C ATOM 2419 O SER A 497 13.607 16.068 -1.328 1.00 49.75 O ATOM 2420 CB SER A 497 16.271 17.962 -1.199 1.00 49.61 C ATOM 2421 OG SER A 497 17.360 18.596 -1.837 1.00 49.72 O ATOM 0 H SER A 497 14.630 17.621 -3.283 1.00 49.69 H new ATOM 0 HA SER A 497 16.574 16.133 -2.141 1.00 49.76 H new ATOM 0 HB2 SER A 497 15.531 18.584 -1.121 1.00 49.61 H new ATOM 0 HB3 SER A 497 16.524 17.708 -0.298 1.00 49.61 H new ATOM 0 HG SER A 497 18.024 18.081 -1.836 1.00 49.72 H new ATOM 2422 N SER A 498 15.329 15.148 -0.205 1.00 50.53 N ATOM 2423 CA SER A 498 14.477 14.369 0.685 1.00 50.66 C ATOM 2424 C SER A 498 14.968 14.405 2.133 1.00 50.92 C ATOM 2425 O SER A 498 14.271 13.947 3.040 1.00 51.10 O ATOM 2426 CB SER A 498 14.338 12.924 0.190 1.00 50.57 C ATOM 2427 OG SER A 498 15.543 12.200 0.361 1.00 50.45 O ATOM 0 H SER A 498 16.172 15.047 -0.069 1.00 50.53 H new ATOM 0 HA SER A 498 13.600 14.783 0.670 1.00 50.66 H new ATOM 0 HB2 SER A 498 13.622 12.482 0.673 1.00 50.57 H new ATOM 0 HB3 SER A 498 14.089 12.924 -0.748 1.00 50.57 H new ATOM 0 HG SER A 498 15.671 11.708 -0.307 1.00 50.45 H new ATOM 2428 N GLU A 499 16.153 14.966 2.358 1.00 51.26 N ATOM 2429 CA GLU A 499 16.623 15.145 3.726 1.00 51.83 C ATOM 2430 C GLU A 499 17.652 16.245 3.962 1.00 51.21 C ATOM 2431 O GLU A 499 18.419 16.608 3.074 1.00 50.81 O ATOM 2432 CB GLU A 499 17.125 13.824 4.311 1.00 52.95 C ATOM 2433 CG GLU A 499 18.412 13.303 3.733 1.00 54.41 C ATOM 2434 CD GLU A 499 18.964 12.166 4.565 1.00 55.48 C ATOM 2435 OE1 GLU A 499 18.885 11.011 4.102 1.00 56.31 O ATOM 2436 OE2 GLU A 499 19.449 12.422 5.693 1.00 55.85 O ATOM 0 H GLU A 499 16.689 15.244 1.746 1.00 51.26 H new ATOM 0 HA GLU A 499 15.831 15.453 4.193 1.00 51.83 H new ATOM 0 HB2 GLU A 499 17.241 13.936 5.268 1.00 52.95 H new ATOM 0 HB3 GLU A 499 16.437 13.151 4.185 1.00 52.95 H new ATOM 0 HG2 GLU A 499 18.262 12.999 2.824 1.00 54.41 H new ATOM 0 HG3 GLU A 499 19.063 14.020 3.688 1.00 54.41 H new ATOM 2437 N LEU A 500 17.642 16.773 5.184 1.00 50.31 N ATOM 2438 CA LEU A 500 18.626 17.752 5.615 1.00 49.82 C ATOM 2439 C LEU A 500 19.863 17.015 6.107 1.00 49.33 C ATOM 2440 O LEU A 500 19.784 16.187 7.011 1.00 49.15 O ATOM 2441 CB LEU A 500 18.063 18.642 6.736 1.00 49.24 C ATOM 2442 CG LEU A 500 19.000 19.732 7.281 1.00 49.29 C ATOM 2443 CD1 LEU A 500 19.083 20.936 6.346 1.00 48.57 C ATOM 2444 CD2 LEU A 500 18.585 20.182 8.678 1.00 49.69 C ATOM 0 H LEU A 500 17.061 16.571 5.785 1.00 50.31 H new ATOM 0 HA LEU A 500 18.854 18.326 4.867 1.00 49.82 H new ATOM 0 HB2 LEU A 500 17.257 19.071 6.408 1.00 49.24 H new ATOM 0 HB3 LEU A 500 17.800 18.071 7.474 1.00 49.24 H new ATOM 0 HG LEU A 500 19.882 19.332 7.335 1.00 49.29 H new ATOM 0 HD11 LEU A 500 19.682 21.599 6.724 1.00 48.57 H new ATOM 0 HD12 LEU A 500 19.420 20.652 5.482 1.00 48.57 H new ATOM 0 HD13 LEU A 500 18.200 21.323 6.237 1.00 48.57 H new ATOM 0 HD21 LEU A 500 19.195 20.868 8.992 1.00 49.69 H new ATOM 0 HD22 LEU A 500 17.684 20.540 8.649 1.00 49.69 H new ATOM 0 HD23 LEU A 500 18.612 19.425 9.283 1.00 49.69 H new ATOM 2445 N ILE A 501 21.010 17.323 5.516 1.00 49.41 N ATOM 2446 CA ILE A 501 22.245 16.667 5.903 1.00 49.52 C ATOM 2447 C ILE A 501 22.865 17.386 7.085 1.00 49.58 C ATOM 2448 O ILE A 501 23.325 16.760 8.037 1.00 49.16 O ATOM 2449 CB ILE A 501 23.267 16.658 4.757 1.00 49.32 C ATOM 2450 CG1 ILE A 501 22.642 16.097 3.478 1.00 49.31 C ATOM 2451 CG2 ILE A 501 24.518 15.872 5.165 1.00 49.14 C ATOM 2452 CD1 ILE A 501 22.420 14.594 3.496 1.00 50.14 C ATOM 0 H ILE A 501 21.092 17.908 4.891 1.00 49.41 H new ATOM 0 HA ILE A 501 22.023 15.752 6.135 1.00 49.52 H new ATOM 0 HB ILE A 501 23.537 17.571 4.572 1.00 49.32 H new ATOM 0 HG12 ILE A 501 21.791 16.537 3.327 1.00 49.31 H new ATOM 0 HG13 ILE A 501 23.214 16.320 2.727 1.00 49.31 H new ATOM 0 HG21 ILE A 501 25.155 15.874 4.433 1.00 49.14 H new ATOM 0 HG22 ILE A 501 24.921 16.286 5.944 1.00 49.14 H new ATOM 0 HG23 ILE A 501 24.272 14.958 5.376 1.00 49.14 H new ATOM 0 HD11 ILE A 501 22.023 14.315 2.656 1.00 50.14 H new ATOM 0 HD12 ILE A 501 23.270 14.143 3.617 1.00 50.14 H new ATOM 0 HD13 ILE A 501 21.825 14.363 4.226 1.00 50.14 H new ATOM 2453 N TYR A 502 22.870 18.711 7.007 1.00 50.18 N ATOM 2454 CA TYR A 502 23.525 19.547 8.000 1.00 50.18 C ATOM 2455 C TYR A 502 23.117 20.996 7.791 1.00 50.57 C ATOM 2456 O TYR A 502 22.727 21.389 6.697 1.00 51.65 O ATOM 2457 CB TYR A 502 25.044 19.420 7.867 1.00 49.58 C ATOM 2458 CG TYR A 502 25.818 19.920 9.064 1.00 49.48 C ATOM 2459 CD1 TYR A 502 25.747 19.259 10.282 1.00 49.46 C ATOM 2460 CD2 TYR A 502 26.633 21.040 8.973 1.00 49.48 C ATOM 2461 CE1 TYR A 502 26.451 19.701 11.379 1.00 49.55 C ATOM 2462 CE2 TYR A 502 27.350 21.493 10.073 1.00 49.61 C ATOM 2463 CZ TYR A 502 27.253 20.820 11.272 1.00 49.59 C ATOM 2464 OH TYR A 502 27.956 21.259 12.373 1.00 49.45 O ATOM 0 H TYR A 502 22.491 19.151 6.373 1.00 50.18 H new ATOM 0 HA TYR A 502 23.257 19.258 8.887 1.00 50.18 H new ATOM 0 HB2 TYR A 502 25.268 18.488 7.717 1.00 49.58 H new ATOM 0 HB3 TYR A 502 25.331 19.911 7.081 1.00 49.58 H new ATOM 0 HD1 TYR A 502 25.213 18.502 10.359 1.00 49.46 H new ATOM 0 HD2 TYR A 502 26.700 21.494 8.164 1.00 49.48 H new ATOM 0 HE1 TYR A 502 26.387 19.248 12.189 1.00 49.55 H new ATOM 0 HE2 TYR A 502 27.892 22.245 10.001 1.00 49.61 H new ATOM 0 HH TYR A 502 28.400 21.942 12.168 1.00 49.45 H new ATOM 2465 N SER A 503 23.212 21.789 8.846 1.00 51.16 N ATOM 2466 CA SER A 503 22.933 23.210 8.760 1.00 51.32 C ATOM 2467 C SER A 503 23.798 23.927 9.784 1.00 51.41 C ATOM 2468 O SER A 503 24.369 23.294 10.671 1.00 51.05 O ATOM 2469 CB SER A 503 21.450 23.494 9.018 1.00 51.34 C ATOM 2470 OG SER A 503 21.104 23.207 10.361 1.00 51.34 O ATOM 0 H SER A 503 23.440 21.519 9.630 1.00 51.16 H new ATOM 0 HA SER A 503 23.138 23.529 7.867 1.00 51.32 H new ATOM 0 HB2 SER A 503 21.257 24.424 8.822 1.00 51.34 H new ATOM 0 HB3 SER A 503 20.906 22.959 8.419 1.00 51.34 H new ATOM 0 HG SER A 503 20.289 23.371 10.482 1.00 51.34 H new ATOM 2471 N GLY A 504 23.896 25.245 9.653 1.00 51.50 N ATOM 2472 CA GLY A 504 24.749 26.042 10.522 1.00 51.57 C ATOM 2473 C GLY A 504 25.142 27.323 9.820 1.00 51.76 C ATOM 2474 O GLY A 504 24.964 27.455 8.607 1.00 51.71 O ATOM 0 H GLY A 504 23.471 25.700 9.060 1.00 51.50 H new ATOM 0 HA2 GLY A 504 24.283 26.246 11.348 1.00 51.57 H new ATOM 0 HA3 GLY A 504 25.542 25.538 10.761 1.00 51.57 H new ATOM 2475 N GLU A 505 25.674 28.270 10.583 1.00 51.92 N ATOM 2476 CA GLU A 505 26.072 29.557 10.033 1.00 52.16 C ATOM 2477 C GLU A 505 27.385 29.427 9.274 1.00 52.00 C ATOM 2478 O GLU A 505 28.299 28.720 9.695 1.00 52.17 O ATOM 2479 CB GLU A 505 26.198 30.611 11.143 1.00 52.26 C ATOM 2480 CG GLU A 505 26.452 32.027 10.628 1.00 52.62 C ATOM 2481 CD GLU A 505 26.650 33.040 11.737 1.00 52.79 C ATOM 2482 OE1 GLU A 505 27.119 34.161 11.440 1.00 53.20 O ATOM 2483 OE2 GLU A 505 26.345 32.721 12.908 1.00 53.21 O ATOM 0 H GLU A 505 25.813 28.185 11.427 1.00 51.92 H new ATOM 0 HA GLU A 505 25.383 29.848 9.415 1.00 52.16 H new ATOM 0 HB2 GLU A 505 25.385 30.610 11.671 1.00 52.26 H new ATOM 0 HB3 GLU A 505 26.922 30.358 11.736 1.00 52.26 H new ATOM 0 HG2 GLU A 505 27.238 32.022 10.059 1.00 52.62 H new ATOM 0 HG3 GLU A 505 25.704 32.303 10.076 1.00 52.62 H new ATOM 2484 N LEU A 506 27.464 30.111 8.142 1.00 52.16 N ATOM 2485 CA LEU A 506 28.675 30.148 7.344 1.00 51.99 C ATOM 2486 C LEU A 506 28.818 31.533 6.758 1.00 52.28 C ATOM 2487 O LEU A 506 27.827 32.155 6.374 1.00 52.62 O ATOM 2488 CB LEU A 506 28.609 29.131 6.203 1.00 51.55 C ATOM 2489 CG LEU A 506 29.298 27.775 6.343 1.00 51.43 C ATOM 2490 CD1 LEU A 506 28.936 26.890 5.162 1.00 51.40 C ATOM 2491 CD2 LEU A 506 30.797 27.950 6.422 1.00 51.48 C ATOM 0 H LEU A 506 26.813 30.568 7.815 1.00 52.16 H new ATOM 0 HA LEU A 506 29.433 29.929 7.909 1.00 51.99 H new ATOM 0 HB2 LEU A 506 27.671 28.960 6.024 1.00 51.55 H new ATOM 0 HB3 LEU A 506 28.975 29.560 5.414 1.00 51.55 H new ATOM 0 HG LEU A 506 28.995 27.353 7.162 1.00 51.43 H new ATOM 0 HD11 LEU A 506 29.376 26.030 5.255 1.00 51.40 H new ATOM 0 HD12 LEU A 506 27.975 26.760 5.137 1.00 51.40 H new ATOM 0 HD13 LEU A 506 29.226 27.314 4.339 1.00 51.40 H new ATOM 0 HD21 LEU A 506 31.220 27.082 6.511 1.00 51.48 H new ATOM 0 HD22 LEU A 506 31.115 28.384 5.615 1.00 51.48 H new ATOM 0 HD23 LEU A 506 31.019 28.497 7.191 1.00 51.48 H new ATOM 2492 N THR A 507 30.054 32.014 6.695 1.00 52.32 N ATOM 2493 CA THR A 507 30.352 33.228 5.963 1.00 52.66 C ATOM 2494 C THR A 507 30.581 32.870 4.505 1.00 52.88 C ATOM 2495 O THR A 507 31.435 32.042 4.184 1.00 52.90 O ATOM 2496 CB THR A 507 31.624 33.917 6.486 1.00 52.60 C ATOM 2497 OG1 THR A 507 31.522 34.114 7.901 1.00 52.61 O ATOM 2498 CG2 THR A 507 31.823 35.264 5.800 1.00 52.59 C ATOM 0 H THR A 507 30.734 31.648 7.072 1.00 52.32 H new ATOM 0 HA THR A 507 29.603 33.835 6.074 1.00 52.66 H new ATOM 0 HB THR A 507 32.385 33.349 6.290 1.00 52.60 H new ATOM 0 HG1 THR A 507 30.851 34.591 8.070 1.00 52.61 H new ATOM 0 HG21 THR A 507 32.628 35.685 6.140 1.00 52.59 H new ATOM 0 HG22 THR A 507 31.908 35.131 4.843 1.00 52.59 H new ATOM 0 HG23 THR A 507 31.060 35.835 5.980 1.00 52.59 H new ATOM 2499 N ARG A 508 29.802 33.483 3.624 1.00 53.15 N ATOM 2500 CA ARG A 508 30.075 33.402 2.201 1.00 53.26 C ATOM 2501 C ARG A 508 30.663 34.742 1.789 1.00 53.61 C ATOM 2502 O ARG A 508 30.311 35.782 2.355 1.00 53.82 O ATOM 2503 CB ARG A 508 28.793 33.121 1.416 1.00 52.92 C ATOM 2504 CG ARG A 508 27.742 34.223 1.510 1.00 52.67 C ATOM 2505 CD ARG A 508 26.548 33.907 0.631 1.00 51.98 C ATOM 2506 NE ARG A 508 26.963 33.532 -0.716 1.00 51.54 N ATOM 2507 CZ ARG A 508 26.813 34.298 -1.793 1.00 51.33 C ATOM 2508 NH1 ARG A 508 26.247 35.494 -1.695 1.00 50.89 N ATOM 2509 NH2 ARG A 508 27.225 33.859 -2.971 1.00 51.02 N ATOM 0 H ARG A 508 29.111 33.951 3.831 1.00 53.15 H new ATOM 0 HA ARG A 508 30.691 32.677 2.012 1.00 53.26 H new ATOM 0 HB2 ARG A 508 29.021 32.986 0.483 1.00 52.92 H new ATOM 0 HB3 ARG A 508 28.406 32.292 1.737 1.00 52.92 H new ATOM 0 HG2 ARG A 508 27.453 34.322 2.431 1.00 52.67 H new ATOM 0 HG3 ARG A 508 28.131 35.070 1.242 1.00 52.67 H new ATOM 0 HD2 ARG A 508 26.035 33.184 1.026 1.00 51.98 H new ATOM 0 HD3 ARG A 508 25.963 34.679 0.588 1.00 51.98 H new ATOM 0 HE ARG A 508 27.330 32.762 -0.821 1.00 51.54 H new ATOM 0 HH11 ARG A 508 25.974 35.779 -0.931 1.00 50.89 H new ATOM 0 HH12 ARG A 508 26.153 35.984 -2.395 1.00 50.89 H new ATOM 0 HH21 ARG A 508 27.588 33.082 -3.038 1.00 51.02 H new ATOM 0 HH22 ARG A 508 27.130 34.351 -3.670 1.00 51.02 H new ATOM 2510 N VAL A 509 31.578 34.725 0.828 1.00 53.66 N ATOM 2511 CA VAL A 509 32.065 35.979 0.269 1.00 53.83 C ATOM 2512 C VAL A 509 31.674 36.133 -1.200 1.00 53.85 C ATOM 2513 O VAL A 509 31.769 35.189 -1.990 1.00 53.67 O ATOM 2514 CB VAL A 509 33.582 36.210 0.527 1.00 53.69 C ATOM 2515 CG1 VAL A 509 34.223 34.970 1.130 1.00 53.73 C ATOM 2516 CG2 VAL A 509 34.298 36.669 -0.739 1.00 53.77 C ATOM 0 H VAL A 509 31.924 34.014 0.491 1.00 53.66 H new ATOM 0 HA VAL A 509 31.616 36.692 0.749 1.00 53.83 H new ATOM 0 HB VAL A 509 33.673 36.926 1.175 1.00 53.69 H new ATOM 0 HG11 VAL A 509 35.167 35.135 1.283 1.00 53.73 H new ATOM 0 HG12 VAL A 509 33.791 34.760 1.973 1.00 53.73 H new ATOM 0 HG13 VAL A 509 34.120 34.223 0.520 1.00 53.73 H new ATOM 0 HG21 VAL A 509 35.239 36.804 -0.548 1.00 53.77 H new ATOM 0 HG22 VAL A 509 34.203 35.993 -1.428 1.00 53.77 H new ATOM 0 HG23 VAL A 509 33.908 37.502 -1.048 1.00 53.77 H new ATOM 2517 N THR A 510 31.201 37.332 -1.533 1.00 54.03 N ATOM 2518 CA THR A 510 30.713 37.664 -2.867 1.00 54.20 C ATOM 2519 C THR A 510 31.823 37.576 -3.910 1.00 54.03 C ATOM 2520 O THR A 510 32.985 37.842 -3.615 1.00 53.64 O ATOM 2521 CB THR A 510 30.054 39.067 -2.875 1.00 54.46 C ATOM 2522 OG1 THR A 510 28.830 39.017 -2.132 1.00 55.01 O ATOM 2523 CG2 THR A 510 29.751 39.533 -4.288 1.00 54.73 C ATOM 0 H THR A 510 31.154 37.987 -0.978 1.00 54.03 H new ATOM 0 HA THR A 510 30.039 37.008 -3.106 1.00 54.20 H new ATOM 0 HB THR A 510 30.676 39.693 -2.473 1.00 54.46 H new ATOM 0 HG1 THR A 510 28.470 39.776 -2.133 1.00 55.01 H new ATOM 0 HG21 THR A 510 29.340 40.411 -4.258 1.00 54.73 H new ATOM 0 HG22 THR A 510 30.575 39.579 -4.798 1.00 54.73 H new ATOM 0 HG23 THR A 510 29.144 38.907 -4.712 1.00 54.73 H new ATOM 2524 N GLN A 511 31.455 37.177 -5.124 1.00 54.35 N ATOM 2525 CA GLN A 511 32.420 36.991 -6.203 1.00 54.36 C ATOM 2526 C GLN A 511 32.416 38.146 -7.196 1.00 54.40 C ATOM 2527 O GLN A 511 33.482 38.653 -7.548 1.00 54.58 O ATOM 2528 CB GLN A 511 32.192 35.658 -6.917 1.00 54.56 C ATOM 2529 CG GLN A 511 32.794 34.461 -6.197 1.00 54.76 C ATOM 2530 CD GLN A 511 34.247 34.231 -6.567 1.00 54.72 C ATOM 2531 OE1 GLN A 511 35.111 34.156 -5.561 1.00 54.65 O flip ATOM 2532 NE2 GLN A 511 34.587 34.111 -7.746 1.00 54.73 N flip ATOM 0 H GLN A 511 30.641 37.007 -5.345 1.00 54.35 H new ATOM 0 HA GLN A 511 33.299 36.976 -5.793 1.00 54.36 H new ATOM 0 HB2 GLN A 511 31.238 35.516 -7.020 1.00 54.56 H new ATOM 0 HB3 GLN A 511 32.569 35.711 -7.809 1.00 54.56 H new ATOM 0 HG2 GLN A 511 32.725 34.595 -5.239 1.00 54.76 H new ATOM 0 HG3 GLN A 511 32.279 33.667 -6.410 1.00 54.76 H new ATOM 0 HE21 GLN A 511 33.999 34.166 -8.371 1.00 54.73 H new ATOM 0 HE22 GLN A 511 35.413 33.973 -7.944 1.00 54.73 H new ATOM 2533 N PRO A 512 31.224 38.566 -7.664 1.00 54.32 N ATOM 2534 CA PRO A 512 31.242 39.808 -8.426 1.00 54.23 C ATOM 2535 C PRO A 512 32.251 40.724 -7.751 1.00 54.05 C ATOM 2536 O PRO A 512 33.108 41.302 -8.418 1.00 54.03 O ATOM 2537 CB PRO A 512 29.821 40.339 -8.250 1.00 54.38 C ATOM 2538 CG PRO A 512 28.976 39.098 -8.084 1.00 54.36 C ATOM 2539 CD PRO A 512 29.869 37.997 -7.555 1.00 54.17 C ATOM 0 HA PRO A 512 31.484 39.723 -9.362 1.00 54.23 H new ATOM 0 HB2 PRO A 512 29.753 40.919 -7.476 1.00 54.38 H new ATOM 0 HB3 PRO A 512 29.540 40.859 -9.019 1.00 54.38 H new ATOM 0 HG2 PRO A 512 28.243 39.265 -7.471 1.00 54.36 H new ATOM 0 HG3 PRO A 512 28.583 38.839 -8.932 1.00 54.36 H new ATOM 0 HD2 PRO A 512 29.650 37.770 -6.638 1.00 54.17 H new ATOM 0 HD3 PRO A 512 29.780 37.184 -8.077 1.00 54.17 H new ATOM 2540 N GLN A 513 32.128 40.836 -6.428 1.00 53.93 N ATOM 2541 CA GLN A 513 33.228 41.251 -5.555 1.00 53.78 C ATOM 2542 C GLN A 513 32.862 42.361 -4.565 1.00 53.68 C ATOM 2543 O GLN A 513 32.327 43.398 -4.955 1.00 53.61 O ATOM 2544 CB GLN A 513 34.466 41.629 -6.373 1.00 53.85 C ATOM 2545 CG GLN A 513 35.748 40.980 -5.875 1.00 53.92 C ATOM 2546 CD GLN A 513 36.977 41.410 -6.650 1.00 53.95 C ATOM 2547 OE1 GLN A 513 37.578 40.613 -7.370 1.00 54.12 O ATOM 2548 NE2 GLN A 513 37.361 42.673 -6.503 1.00 53.95 N ATOM 0 H GLN A 513 31.396 40.671 -6.008 1.00 53.93 H new ATOM 0 HA GLN A 513 33.433 40.475 -5.009 1.00 53.78 H new ATOM 0 HB2 GLN A 513 34.323 41.375 -7.298 1.00 53.85 H new ATOM 0 HB3 GLN A 513 34.573 42.593 -6.356 1.00 53.85 H new ATOM 0 HG2 GLN A 513 35.871 41.199 -4.938 1.00 53.92 H new ATOM 0 HG3 GLN A 513 35.658 40.016 -5.932 1.00 53.92 H new ATOM 0 HE21 GLN A 513 36.916 43.201 -5.991 1.00 53.95 H new ATOM 0 HE22 GLN A 513 38.055 42.963 -6.920 1.00 53.95 H new ATOM 2549 N ALA A 514 33.122 42.130 -3.278 1.00 53.66 N ATOM 2550 CA ALA A 514 33.576 40.832 -2.758 1.00 53.66 C ATOM 2551 C ALA A 514 33.559 40.849 -1.236 1.00 53.67 C ATOM 2552 O ALA A 514 34.615 40.848 -0.603 1.00 53.74 O ATOM 2553 CB ALA A 514 34.976 40.505 -3.246 1.00 53.64 C ATOM 0 H ALA A 514 33.039 42.732 -2.669 1.00 53.66 H new ATOM 0 HA ALA A 514 32.970 40.149 -3.085 1.00 53.66 H new ATOM 0 HB1 ALA A 514 35.251 39.646 -2.889 1.00 53.64 H new ATOM 0 HB2 ALA A 514 34.981 40.469 -4.215 1.00 53.64 H new ATOM 0 HB3 ALA A 514 35.592 41.191 -2.946 1.00 53.64 H new ATOM 2554 N LYS A 515 32.370 40.856 -0.643 1.00 53.58 N ATOM 2555 CA LYS A 515 32.287 41.042 0.801 1.00 53.52 C ATOM 2556 C LYS A 515 31.699 39.869 1.571 1.00 53.11 C ATOM 2557 O LYS A 515 31.061 38.978 0.999 1.00 53.22 O ATOM 2558 CB LYS A 515 31.531 42.332 1.143 1.00 53.77 C ATOM 2559 CG LYS A 515 31.767 42.847 2.567 1.00 53.93 C ATOM 2560 CD LYS A 515 33.223 43.267 2.800 1.00 53.96 C ATOM 2561 CE LYS A 515 33.979 42.267 3.670 1.00 53.93 C ATOM 2562 NZ LYS A 515 33.576 42.348 5.104 1.00 53.77 N ATOM 0 H LYS A 515 31.617 40.757 -1.046 1.00 53.58 H new ATOM 0 HA LYS A 515 33.209 41.107 1.094 1.00 53.52 H new ATOM 0 HB2 LYS A 515 31.792 43.023 0.514 1.00 53.77 H new ATOM 0 HB3 LYS A 515 30.581 42.179 1.019 1.00 53.77 H new ATOM 0 HG2 LYS A 515 31.183 43.603 2.736 1.00 53.93 H new ATOM 0 HG3 LYS A 515 31.526 42.155 3.203 1.00 53.93 H new ATOM 0 HD2 LYS A 515 33.673 43.355 1.945 1.00 53.96 H new ATOM 0 HD3 LYS A 515 33.243 44.140 3.222 1.00 53.96 H new ATOM 0 HE2 LYS A 515 33.818 41.369 3.341 1.00 53.93 H new ATOM 0 HE3 LYS A 515 34.932 42.431 3.594 1.00 53.93 H new ATOM 0 HZ1 LYS A 515 34.038 41.751 5.576 1.00 53.77 H new ATOM 0 HZ2 LYS A 515 33.744 43.165 5.414 1.00 53.77 H new ATOM 0 HZ3 LYS A 515 32.706 42.176 5.178 1.00 53.77 H new ATOM 2563 N SER A 516 31.942 39.885 2.879 1.00 52.39 N ATOM 2564 CA SER A 516 31.518 38.827 3.775 1.00 51.85 C ATOM 2565 C SER A 516 30.052 38.970 4.147 1.00 51.58 C ATOM 2566 O SER A 516 29.609 40.024 4.609 1.00 51.71 O ATOM 2567 CB SER A 516 32.373 38.828 5.045 1.00 51.79 C ATOM 2568 OG SER A 516 33.732 38.558 4.751 1.00 51.69 O ATOM 0 H SER A 516 32.365 40.523 3.272 1.00 52.39 H new ATOM 0 HA SER A 516 31.635 37.984 3.309 1.00 51.85 H new ATOM 0 HB2 SER A 516 32.300 39.689 5.486 1.00 51.79 H new ATOM 0 HB3 SER A 516 32.036 38.163 5.665 1.00 51.79 H new ATOM 0 HG SER A 516 34.180 38.565 5.462 1.00 51.69 H new ATOM 2569 N GLN A 517 29.301 37.900 3.930 1.00 51.04 N ATOM 2570 CA GLN A 517 27.934 37.819 4.402 1.00 50.48 C ATOM 2571 C GLN A 517 27.834 36.614 5.321 1.00 50.12 C ATOM 2572 O GLN A 517 28.133 35.490 4.915 1.00 49.99 O ATOM 2573 CB GLN A 517 26.963 37.664 3.230 1.00 50.38 C ATOM 2574 CG GLN A 517 27.044 38.770 2.187 1.00 50.18 C ATOM 2575 CD GLN A 517 26.180 38.486 0.970 1.00 50.23 C ATOM 2576 OE1 GLN A 517 25.991 37.208 0.662 1.00 50.28 O flip ATOM 2577 NE2 GLN A 517 25.689 39.405 0.316 1.00 49.97 N flip ATOM 0 H GLN A 517 29.571 37.203 3.505 1.00 51.04 H new ATOM 0 HA GLN A 517 27.698 38.633 4.874 1.00 50.48 H new ATOM 0 HB2 GLN A 517 27.132 36.813 2.796 1.00 50.38 H new ATOM 0 HB3 GLN A 517 26.058 37.630 3.578 1.00 50.38 H new ATOM 0 HG2 GLN A 517 26.768 39.609 2.588 1.00 50.18 H new ATOM 0 HG3 GLN A 517 27.966 38.880 1.907 1.00 50.18 H new ATOM 0 HE21 GLN A 517 25.833 40.221 0.546 1.00 49.97 H new ATOM 0 HE22 GLN A 517 25.201 39.231 -0.371 1.00 49.97 H new ATOM 2578 N GLN A 518 27.444 36.852 6.567 1.00 49.74 N ATOM 2579 CA GLN A 518 27.174 35.758 7.476 1.00 49.69 C ATOM 2580 C GLN A 518 25.781 35.253 7.136 1.00 49.61 C ATOM 2581 O GLN A 518 24.798 35.980 7.268 1.00 49.50 O ATOM 2582 CB GLN A 518 27.254 36.217 8.939 1.00 49.78 C ATOM 2583 CG GLN A 518 28.446 37.129 9.273 1.00 49.91 C ATOM 2584 CD GLN A 518 29.801 36.502 8.966 1.00 49.97 C ATOM 2585 OE1 GLN A 518 29.895 35.526 8.225 1.00 50.11 O ATOM 2586 NE2 GLN A 518 30.857 37.073 9.531 1.00 49.92 N ATOM 0 H GLN A 518 27.331 37.637 6.901 1.00 49.74 H new ATOM 0 HA GLN A 518 27.834 35.054 7.377 1.00 49.69 H new ATOM 0 HB2 GLN A 518 26.434 36.685 9.162 1.00 49.78 H new ATOM 0 HB3 GLN A 518 27.296 35.432 9.508 1.00 49.78 H new ATOM 0 HG2 GLN A 518 28.360 37.956 8.773 1.00 49.91 H new ATOM 0 HG3 GLN A 518 28.412 37.361 10.214 1.00 49.91 H new ATOM 0 HE21 GLN A 518 30.754 37.755 10.044 1.00 49.92 H new ATOM 0 HE22 GLN A 518 31.645 36.761 9.384 1.00 49.92 H new ATOM 2587 N ARG A 519 25.703 34.016 6.661 1.00 49.77 N ATOM 2588 CA ARG A 519 24.431 33.440 6.247 1.00 49.59 C ATOM 2589 C ARG A 519 24.192 32.101 6.918 1.00 49.92 C ATOM 2590 O ARG A 519 25.136 31.376 7.241 1.00 50.15 O ATOM 2591 CB ARG A 519 24.390 33.259 4.726 1.00 49.08 C ATOM 2592 CG ARG A 519 24.444 34.554 3.931 1.00 48.71 C ATOM 2593 CD ARG A 519 23.081 35.226 3.870 1.00 48.37 C ATOM 2594 NE ARG A 519 23.138 36.480 3.126 1.00 48.20 N ATOM 2595 CZ ARG A 519 23.261 37.680 3.684 1.00 47.88 C ATOM 2596 NH1 ARG A 519 23.333 37.794 5.003 1.00 47.51 N ATOM 2597 NH2 ARG A 519 23.311 38.765 2.920 1.00 47.68 N ATOM 0 H ARG A 519 26.378 33.492 6.570 1.00 49.77 H new ATOM 0 HA ARG A 519 23.731 34.055 6.517 1.00 49.59 H new ATOM 0 HB2 ARG A 519 25.135 32.698 4.459 1.00 49.08 H new ATOM 0 HB3 ARG A 519 23.578 32.783 4.491 1.00 49.08 H new ATOM 0 HG2 ARG A 519 25.086 35.158 4.336 1.00 48.71 H new ATOM 0 HG3 ARG A 519 24.756 34.370 3.031 1.00 48.71 H new ATOM 0 HD2 ARG A 519 22.442 34.628 3.451 1.00 48.37 H new ATOM 0 HD3 ARG A 519 22.762 35.396 4.770 1.00 48.37 H new ATOM 0 HE ARG A 519 23.089 36.440 2.268 1.00 48.20 H new ATOM 0 HH11 ARG A 519 23.300 37.091 5.498 1.00 47.51 H new ATOM 0 HH12 ARG A 519 23.413 38.571 5.364 1.00 47.51 H new ATOM 0 HH21 ARG A 519 23.264 38.691 2.064 1.00 47.68 H new ATOM 0 HH22 ARG A 519 23.391 39.542 3.281 1.00 47.68 H new ATOM 2598 N MET A 520 22.919 31.785 7.128 1.00 49.97 N ATOM 2599 CA MET A 520 22.522 30.468 7.578 1.00 49.70 C ATOM 2600 C MET A 520 22.491 29.547 6.364 1.00 49.60 C ATOM 2601 O MET A 520 21.804 29.824 5.378 1.00 49.21 O ATOM 2602 CB MET A 520 21.147 30.529 8.242 1.00 50.22 C ATOM 2603 CG MET A 520 21.077 31.449 9.451 1.00 50.74 C ATOM 2604 SD MET A 520 22.241 30.981 10.748 1.00 51.60 S ATOM 2605 CE MET A 520 21.924 29.217 10.874 1.00 51.00 C ATOM 0 H MET A 520 22.265 32.331 7.012 1.00 49.97 H new ATOM 0 HA MET A 520 23.152 30.131 8.234 1.00 49.70 H new ATOM 0 HB2 MET A 520 20.496 30.823 7.586 1.00 50.22 H new ATOM 0 HB3 MET A 520 20.891 29.634 8.514 1.00 50.22 H new ATOM 0 HG2 MET A 520 21.259 32.360 9.171 1.00 50.74 H new ATOM 0 HG3 MET A 520 20.176 31.437 9.810 1.00 50.74 H new ATOM 0 HE1 MET A 520 22.242 28.891 11.731 1.00 51.00 H new ATOM 0 HE2 MET A 520 20.971 29.053 10.800 1.00 51.00 H new ATOM 0 HE3 MET A 520 22.388 28.753 10.160 1.00 51.00 H new ATOM 2606 N PHE A 521 23.256 28.463 6.436 1.00 49.31 N ATOM 2607 CA PHE A 521 23.388 27.529 5.324 1.00 48.33 C ATOM 2608 C PHE A 521 22.703 26.204 5.639 1.00 48.02 C ATOM 2609 O PHE A 521 22.745 25.724 6.768 1.00 47.56 O ATOM 2610 CB PHE A 521 24.864 27.298 4.988 1.00 48.08 C ATOM 2611 CG PHE A 521 25.412 28.260 3.972 1.00 48.21 C ATOM 2612 CD1 PHE A 521 25.788 29.542 4.339 1.00 48.07 C ATOM 2613 CD2 PHE A 521 25.552 27.881 2.644 1.00 48.20 C ATOM 2614 CE1 PHE A 521 26.296 30.427 3.400 1.00 47.84 C ATOM 2615 CE2 PHE A 521 26.064 28.767 1.698 1.00 48.09 C ATOM 2616 CZ PHE A 521 26.432 30.035 2.078 1.00 48.01 C ATOM 0 H PHE A 521 23.714 28.248 7.132 1.00 49.31 H new ATOM 0 HA PHE A 521 22.951 27.920 4.551 1.00 48.33 H new ATOM 0 HB2 PHE A 521 25.387 27.367 5.802 1.00 48.08 H new ATOM 0 HB3 PHE A 521 24.974 26.393 4.657 1.00 48.08 H new ATOM 0 HD1 PHE A 521 25.699 29.812 5.224 1.00 48.07 H new ATOM 0 HD2 PHE A 521 25.301 27.025 2.382 1.00 48.20 H new ATOM 0 HE1 PHE A 521 26.546 31.285 3.658 1.00 47.84 H new ATOM 0 HE2 PHE A 521 26.156 28.501 0.812 1.00 48.09 H new ATOM 0 HZ PHE A 521 26.772 30.629 1.449 1.00 48.01 H new ATOM 2617 N PHE A 522 22.074 25.623 4.625 1.00 47.60 N ATOM 2618 CA PHE A 522 21.286 24.412 4.793 1.00 47.14 C ATOM 2619 C PHE A 522 21.611 23.416 3.694 1.00 46.33 C ATOM 2620 O PHE A 522 21.230 23.603 2.538 1.00 46.51 O ATOM 2621 CB PHE A 522 19.795 24.751 4.790 1.00 47.81 C ATOM 2622 CG PHE A 522 19.409 25.734 5.854 1.00 48.45 C ATOM 2623 CD1 PHE A 522 19.439 27.102 5.603 1.00 48.70 C ATOM 2624 CD2 PHE A 522 19.040 25.294 7.114 1.00 48.47 C ATOM 2625 CE1 PHE A 522 19.099 28.009 6.592 1.00 48.62 C ATOM 2626 CE2 PHE A 522 18.695 26.197 8.106 1.00 48.42 C ATOM 2627 CZ PHE A 522 18.729 27.553 7.845 1.00 48.37 C ATOM 0 H PHE A 522 22.093 25.921 3.819 1.00 47.60 H new ATOM 0 HA PHE A 522 21.508 24.008 5.646 1.00 47.14 H new ATOM 0 HB2 PHE A 522 19.553 25.111 3.922 1.00 47.81 H new ATOM 0 HB3 PHE A 522 19.284 23.935 4.911 1.00 47.81 H new ATOM 0 HD1 PHE A 522 19.690 27.410 4.762 1.00 48.70 H new ATOM 0 HD2 PHE A 522 19.024 24.382 7.296 1.00 48.47 H new ATOM 0 HE1 PHE A 522 19.119 28.922 6.415 1.00 48.62 H new ATOM 0 HE2 PHE A 522 18.441 25.891 8.947 1.00 48.42 H new ATOM 0 HZ PHE A 522 18.503 28.160 8.512 1.00 48.37 H new ATOM 2628 N LEU A 523 22.322 22.362 4.072 1.00 45.28 N ATOM 2629 CA LEU A 523 22.765 21.348 3.139 1.00 44.67 C ATOM 2630 C LEU A 523 21.765 20.198 3.071 1.00 44.36 C ATOM 2631 O LEU A 523 21.514 19.515 4.061 1.00 44.48 O ATOM 2632 CB LEU A 523 24.150 20.827 3.540 1.00 44.41 C ATOM 2633 CG LEU A 523 24.755 19.683 2.716 1.00 44.30 C ATOM 2634 CD1 LEU A 523 24.986 20.117 1.281 1.00 43.67 C ATOM 2635 CD2 LEU A 523 26.058 19.220 3.343 1.00 44.22 C ATOM 0 H LEU A 523 22.561 22.217 4.885 1.00 45.28 H new ATOM 0 HA LEU A 523 22.825 21.750 2.258 1.00 44.67 H new ATOM 0 HB2 LEU A 523 24.768 21.574 3.511 1.00 44.41 H new ATOM 0 HB3 LEU A 523 24.102 20.535 4.464 1.00 44.41 H new ATOM 0 HG LEU A 523 24.128 18.943 2.712 1.00 44.30 H new ATOM 0 HD11 LEU A 523 25.368 19.381 0.778 1.00 43.67 H new ATOM 0 HD12 LEU A 523 24.141 20.377 0.881 1.00 43.67 H new ATOM 0 HD13 LEU A 523 25.597 20.871 1.265 1.00 43.67 H new ATOM 0 HD21 LEU A 523 26.432 18.497 2.815 1.00 44.22 H new ATOM 0 HD22 LEU A 523 26.685 19.959 3.369 1.00 44.22 H new ATOM 0 HD23 LEU A 523 25.890 18.907 4.246 1.00 44.22 H new ATOM 2636 N PHE A 524 21.188 19.997 1.896 1.00 44.26 N ATOM 2637 CA PHE A 524 20.295 18.872 1.679 1.00 43.68 C ATOM 2638 C PHE A 524 21.009 17.897 0.757 1.00 43.41 C ATOM 2639 O PHE A 524 22.089 18.208 0.249 1.00 43.38 O ATOM 2640 CB PHE A 524 18.983 19.359 1.064 1.00 43.85 C ATOM 2641 CG PHE A 524 18.249 20.353 1.920 1.00 44.24 C ATOM 2642 CD1 PHE A 524 18.543 21.706 1.846 1.00 44.54 C ATOM 2643 CD2 PHE A 524 17.271 19.936 2.805 1.00 44.35 C ATOM 2644 CE1 PHE A 524 17.874 22.629 2.638 1.00 44.09 C ATOM 2645 CE2 PHE A 524 16.603 20.853 3.602 1.00 44.62 C ATOM 2646 CZ PHE A 524 16.907 22.204 3.511 1.00 44.37 C ATOM 0 H PHE A 524 21.301 20.502 1.209 1.00 44.26 H new ATOM 0 HA PHE A 524 20.075 18.433 2.515 1.00 43.68 H new ATOM 0 HB2 PHE A 524 19.169 19.762 0.201 1.00 43.85 H new ATOM 0 HB3 PHE A 524 18.407 18.595 0.903 1.00 43.85 H new ATOM 0 HD1 PHE A 524 19.199 22.000 1.256 1.00 44.54 H new ATOM 0 HD2 PHE A 524 17.060 19.032 2.866 1.00 44.35 H new ATOM 0 HE1 PHE A 524 18.081 23.533 2.576 1.00 44.09 H new ATOM 0 HE2 PHE A 524 15.951 20.563 4.198 1.00 44.62 H new ATOM 0 HZ PHE A 524 16.455 22.820 4.042 1.00 44.37 H new ATOM 2647 N ASP A 525 20.451 16.709 0.550 1.00 43.16 N ATOM 2648 CA ASP A 525 20.956 15.907 -0.554 1.00 42.68 C ATOM 2649 C ASP A 525 20.763 16.735 -1.825 1.00 42.63 C ATOM 2650 O ASP A 525 19.668 17.254 -2.079 1.00 42.40 O ATOM 2651 CB ASP A 525 20.290 14.519 -0.645 1.00 42.37 C ATOM 2652 CG ASP A 525 18.773 14.577 -0.622 1.00 42.22 C ATOM 2653 OD1 ASP A 525 18.151 13.859 -1.424 1.00 42.95 O ATOM 2654 OD2 ASP A 525 18.196 15.326 0.193 1.00 42.06 O ATOM 0 H ASP A 525 19.812 16.364 1.011 1.00 43.16 H new ATOM 0 HA ASP A 525 21.895 15.707 -0.418 1.00 42.68 H new ATOM 0 HB2 ASP A 525 20.578 14.082 -1.462 1.00 42.37 H new ATOM 0 HB3 ASP A 525 20.598 13.971 0.094 1.00 42.37 H new ATOM 2655 N HIS A 526 21.852 16.914 -2.573 1.00 42.60 N ATOM 2656 CA HIS A 526 21.830 17.566 -3.896 1.00 42.49 C ATOM 2657 C HIS A 526 21.884 19.102 -3.925 1.00 42.80 C ATOM 2658 O HIS A 526 22.151 19.680 -4.976 1.00 43.15 O ATOM 2659 CB HIS A 526 20.643 17.078 -4.740 1.00 41.62 C ATOM 2660 CG HIS A 526 20.624 15.598 -4.974 1.00 41.04 C ATOM 2661 ND1 HIS A 526 21.501 14.966 -5.831 1.00 40.43 N ATOM 2662 CD2 HIS A 526 19.820 14.628 -4.476 1.00 40.54 C ATOM 2663 CE1 HIS A 526 21.244 13.670 -5.840 1.00 40.15 C ATOM 2664 NE2 HIS A 526 20.230 13.439 -5.026 1.00 39.77 N ATOM 0 H HIS A 526 22.636 16.659 -2.328 1.00 42.60 H new ATOM 0 HA HIS A 526 22.675 17.286 -4.280 1.00 42.49 H new ATOM 0 HB2 HIS A 526 19.818 17.336 -4.300 1.00 41.62 H new ATOM 0 HB3 HIS A 526 20.661 17.531 -5.598 1.00 41.62 H new ATOM 0 HD1 HIS A 526 22.118 15.354 -6.287 1.00 40.43 H new ATOM 0 HD2 HIS A 526 19.121 14.746 -3.874 1.00 40.54 H new ATOM 0 HE1 HIS A 526 21.700 13.029 -6.336 1.00 40.15 H new ATOM 2665 N GLN A 527 21.631 19.772 -2.806 1.00 43.52 N ATOM 2666 CA GLN A 527 21.622 21.247 -2.822 1.00 44.34 C ATOM 2667 C GLN A 527 21.893 21.926 -1.478 1.00 45.40 C ATOM 2668 O GLN A 527 21.579 21.397 -0.404 1.00 45.03 O ATOM 2669 CB GLN A 527 20.334 21.813 -3.455 1.00 43.91 C ATOM 2670 CG GLN A 527 19.044 21.531 -2.675 1.00 44.03 C ATOM 2671 CD GLN A 527 17.785 21.830 -3.480 1.00 44.46 C ATOM 2672 OE1 GLN A 527 17.708 22.832 -4.200 1.00 44.79 O ATOM 2673 NE2 GLN A 527 16.792 20.958 -3.363 1.00 43.91 N ATOM 0 H GLN A 527 21.465 19.411 -2.043 1.00 43.52 H new ATOM 0 HA GLN A 527 22.383 21.468 -3.381 1.00 44.34 H new ATOM 0 HB2 GLN A 527 20.433 22.773 -3.552 1.00 43.91 H new ATOM 0 HB3 GLN A 527 20.242 21.446 -4.348 1.00 43.91 H new ATOM 0 HG2 GLN A 527 19.034 20.600 -2.402 1.00 44.03 H new ATOM 0 HG3 GLN A 527 19.038 22.065 -1.865 1.00 44.03 H new ATOM 0 HE21 GLN A 527 16.880 20.272 -2.853 1.00 43.91 H new ATOM 0 HE22 GLN A 527 16.060 21.079 -3.798 1.00 43.91 H new ATOM 2674 N LEU A 528 22.471 23.119 -1.577 1.00 46.19 N ATOM 2675 CA LEU A 528 22.869 23.913 -0.435 1.00 46.84 C ATOM 2676 C LEU A 528 22.217 25.286 -0.507 1.00 47.38 C ATOM 2677 O LEU A 528 22.562 26.093 -1.365 1.00 47.99 O ATOM 2678 CB LEU A 528 24.383 24.093 -0.446 1.00 46.57 C ATOM 2679 CG LEU A 528 24.967 24.977 0.658 1.00 46.65 C ATOM 2680 CD1 LEU A 528 24.886 24.277 2.003 1.00 45.82 C ATOM 2681 CD2 LEU A 528 26.402 25.341 0.315 1.00 46.79 C ATOM 0 H LEU A 528 22.644 23.493 -2.332 1.00 46.19 H new ATOM 0 HA LEU A 528 22.591 23.460 0.376 1.00 46.84 H new ATOM 0 HB2 LEU A 528 24.795 23.217 -0.384 1.00 46.57 H new ATOM 0 HB3 LEU A 528 24.639 24.467 -1.303 1.00 46.57 H new ATOM 0 HG LEU A 528 24.447 25.793 0.721 1.00 46.65 H new ATOM 0 HD11 LEU A 528 25.260 24.851 2.690 1.00 45.82 H new ATOM 0 HD12 LEU A 528 23.959 24.085 2.213 1.00 45.82 H new ATOM 0 HD13 LEU A 528 25.388 23.448 1.967 1.00 45.82 H new ATOM 0 HD21 LEU A 528 26.770 25.901 1.016 1.00 46.79 H new ATOM 0 HD22 LEU A 528 26.931 24.532 0.237 1.00 46.79 H new ATOM 0 HD23 LEU A 528 26.422 25.822 -0.527 1.00 46.79 H new ATOM 2682 N ILE A 529 21.286 25.547 0.402 1.00 48.00 N ATOM 2683 CA ILE A 529 20.587 26.823 0.449 1.00 48.86 C ATOM 2684 C ILE A 529 21.247 27.758 1.459 1.00 49.24 C ATOM 2685 O ILE A 529 21.738 27.310 2.497 1.00 49.25 O ATOM 2686 CB ILE A 529 19.119 26.635 0.883 1.00 48.94 C ATOM 2687 CG1 ILE A 529 18.503 25.398 0.220 1.00 48.90 C ATOM 2688 CG2 ILE A 529 18.305 27.889 0.595 1.00 49.40 C ATOM 2689 CD1 ILE A 529 18.565 25.393 -1.284 1.00 48.23 C ATOM 0 H ILE A 529 21.042 24.989 1.009 1.00 48.00 H new ATOM 0 HA ILE A 529 20.625 27.201 -0.443 1.00 48.86 H new ATOM 0 HB ILE A 529 19.103 26.488 1.842 1.00 48.94 H new ATOM 0 HG12 ILE A 529 18.957 24.608 0.553 1.00 48.90 H new ATOM 0 HG13 ILE A 529 17.575 25.328 0.493 1.00 48.90 H new ATOM 0 HG21 ILE A 529 17.387 27.750 0.875 1.00 49.40 H new ATOM 0 HG22 ILE A 529 18.681 28.638 1.083 1.00 49.40 H new ATOM 0 HG23 ILE A 529 18.328 28.078 -0.356 1.00 49.40 H new ATOM 0 HD11 ILE A 529 18.156 24.581 -1.622 1.00 48.23 H new ATOM 0 HD12 ILE A 529 18.088 26.163 -1.630 1.00 48.23 H new ATOM 0 HD13 ILE A 529 19.491 25.432 -1.570 1.00 48.23 H new ATOM 2690 N TYR A 530 21.262 29.054 1.159 1.00 49.38 N ATOM 2691 CA TYR A 530 21.649 30.044 2.160 1.00 49.61 C ATOM 2692 C TYR A 530 20.567 31.105 2.374 1.00 49.47 C ATOM 2693 O TYR A 530 19.893 31.525 1.428 1.00 49.55 O ATOM 2694 CB TYR A 530 23.021 30.670 1.861 1.00 50.10 C ATOM 2695 CG TYR A 530 23.205 31.172 0.452 1.00 50.46 C ATOM 2696 CD1 TYR A 530 22.929 32.499 0.123 1.00 50.51 C ATOM 2697 CD2 TYR A 530 23.673 30.331 -0.554 1.00 50.69 C ATOM 2698 CE1 TYR A 530 23.100 32.969 -1.170 1.00 50.38 C ATOM 2699 CE2 TYR A 530 23.848 30.794 -1.857 1.00 50.38 C ATOM 2700 CZ TYR A 530 23.558 32.111 -2.154 1.00 50.42 C ATOM 2701 OH TYR A 530 23.724 32.580 -3.437 1.00 50.52 O ATOM 0 H TYR A 530 21.054 29.378 0.390 1.00 49.38 H new ATOM 0 HA TYR A 530 21.739 29.565 2.999 1.00 49.61 H new ATOM 0 HB2 TYR A 530 23.164 31.409 2.473 1.00 50.10 H new ATOM 0 HB3 TYR A 530 23.708 30.011 2.046 1.00 50.10 H new ATOM 0 HD1 TYR A 530 22.625 33.079 0.783 1.00 50.51 H new ATOM 0 HD2 TYR A 530 23.872 29.445 -0.353 1.00 50.69 H new ATOM 0 HE1 TYR A 530 22.908 33.856 -1.375 1.00 50.38 H new ATOM 0 HE2 TYR A 530 24.157 30.221 -2.521 1.00 50.38 H new ATOM 0 HH TYR A 530 24.006 31.960 -3.928 1.00 50.52 H new ATOM 2702 N CYS A 531 20.413 31.520 3.630 1.00 49.05 N ATOM 2703 CA CYS A 531 19.382 32.473 4.046 1.00 48.47 C ATOM 2704 C CYS A 531 19.963 33.525 4.992 1.00 48.12 C ATOM 2705 O CYS A 531 20.979 33.288 5.641 1.00 47.91 O ATOM 2706 CB CYS A 531 18.241 31.741 4.764 1.00 48.48 C ATOM 2707 SG CYS A 531 17.251 30.628 3.741 1.00 48.27 S ATOM 0 H CYS A 531 20.913 31.252 4.276 1.00 49.05 H new ATOM 0 HA CYS A 531 19.044 32.910 3.249 1.00 48.47 H new ATOM 0 HB2 CYS A 531 18.618 31.229 5.496 1.00 48.48 H new ATOM 0 HB3 CYS A 531 17.651 32.404 5.156 1.00 48.48 H new ATOM 0 HG CYS A 531 16.398 30.118 4.414 1.00 48.27 H new ATOM 2708 N LYS A 532 19.306 34.680 5.078 1.00 47.92 N ATOM 2709 CA LYS A 532 19.717 35.738 6.003 1.00 48.08 C ATOM 2710 C LYS A 532 18.699 35.928 7.137 1.00 48.01 C ATOM 2711 O LYS A 532 17.493 35.898 6.906 1.00 47.89 O ATOM 2712 CB LYS A 532 19.915 37.054 5.248 1.00 47.96 C ATOM 2713 CG LYS A 532 20.210 38.251 6.147 1.00 48.14 C ATOM 2714 CD LYS A 532 20.101 39.557 5.379 1.00 48.33 C ATOM 2715 CE LYS A 532 20.336 40.755 6.282 1.00 48.46 C ATOM 2716 NZ LYS A 532 20.102 42.030 5.551 1.00 48.51 N ATOM 0 H LYS A 532 18.614 34.873 4.606 1.00 47.92 H new ATOM 0 HA LYS A 532 20.559 35.468 6.403 1.00 48.08 H new ATOM 0 HB2 LYS A 532 20.645 36.947 4.618 1.00 47.96 H new ATOM 0 HB3 LYS A 532 19.117 37.241 4.729 1.00 47.96 H new ATOM 0 HG2 LYS A 532 19.590 38.259 6.893 1.00 48.14 H new ATOM 0 HG3 LYS A 532 21.101 38.166 6.520 1.00 48.14 H new ATOM 0 HD2 LYS A 532 20.748 39.563 4.656 1.00 48.33 H new ATOM 0 HD3 LYS A 532 19.222 39.623 4.974 1.00 48.33 H new ATOM 0 HE2 LYS A 532 19.745 40.706 7.050 1.00 48.46 H new ATOM 0 HE3 LYS A 532 21.245 40.735 6.621 1.00 48.46 H new ATOM 0 HZ1 LYS A 532 20.245 42.717 6.098 1.00 48.51 H new ATOM 0 HZ2 LYS A 532 20.659 42.082 4.859 1.00 48.51 H new ATOM 0 HZ3 LYS A 532 19.262 42.055 5.258 1.00 48.51 H new ATOM 2717 N LYS A 533 19.181 36.128 8.358 1.00 48.46 N ATOM 2718 CA LYS A 533 18.281 36.348 9.495 1.00 48.91 C ATOM 2719 C LYS A 533 17.787 37.797 9.600 1.00 49.04 C ATOM 2720 O LYS A 533 18.561 38.744 9.435 1.00 49.12 O ATOM 2721 CB LYS A 533 18.940 35.901 10.805 1.00 49.06 C ATOM 2722 CG LYS A 533 18.699 34.433 11.152 1.00 49.27 C ATOM 2723 CD LYS A 533 19.714 33.932 12.174 1.00 49.48 C ATOM 2724 CE LYS A 533 19.379 32.523 12.651 1.00 49.57 C ATOM 2725 NZ LYS A 533 18.373 32.530 13.766 1.00 49.76 N ATOM 0 H LYS A 533 20.018 36.141 8.553 1.00 48.46 H new ATOM 0 HA LYS A 533 17.496 35.801 9.334 1.00 48.91 H new ATOM 0 HB2 LYS A 533 19.896 36.057 10.745 1.00 49.06 H new ATOM 0 HB3 LYS A 533 18.607 36.454 11.529 1.00 49.06 H new ATOM 0 HG2 LYS A 533 17.802 34.325 11.504 1.00 49.27 H new ATOM 0 HG3 LYS A 533 18.755 33.895 10.347 1.00 49.27 H new ATOM 0 HD2 LYS A 533 20.601 33.939 11.781 1.00 49.48 H new ATOM 0 HD3 LYS A 533 19.735 34.535 12.933 1.00 49.48 H new ATOM 0 HE2 LYS A 533 19.033 32.005 11.908 1.00 49.57 H new ATOM 0 HE3 LYS A 533 20.190 32.083 12.951 1.00 49.57 H new ATOM 0 HZ1 LYS A 533 18.094 31.699 13.920 1.00 49.76 H new ATOM 0 HZ2 LYS A 533 18.749 32.858 14.503 1.00 49.76 H new ATOM 0 HZ3 LYS A 533 17.679 33.038 13.537 1.00 49.76 H new ATOM 2726 N ASP A 534 16.493 37.952 9.881 1.00 49.17 N ATOM 2727 CA ASP A 534 15.850 39.267 10.008 1.00 49.29 C ATOM 2728 C ASP A 534 16.490 40.151 11.082 1.00 49.23 C ATOM 2729 O ASP A 534 17.044 39.649 12.064 1.00 49.33 O ATOM 2730 CB ASP A 534 14.351 39.103 10.302 1.00 49.38 C ATOM 2731 CG ASP A 534 13.614 40.434 10.367 1.00 49.59 C ATOM 2732 OD1 ASP A 534 13.546 41.134 9.332 1.00 49.66 O ATOM 2733 OD2 ASP A 534 13.097 40.779 11.452 1.00 49.48 O ATOM 0 H ASP A 534 15.956 37.292 10.005 1.00 49.17 H new ATOM 0 HA ASP A 534 15.977 39.715 9.157 1.00 49.29 H new ATOM 0 HB2 ASP A 534 13.949 38.549 9.615 1.00 49.38 H new ATOM 0 HB3 ASP A 534 14.240 38.635 11.144 1.00 49.38 H new ATOM 2734 N LEU A 535 16.391 41.465 10.886 1.00 48.95 N ATOM 2735 CA LEU A 535 16.966 42.460 11.794 1.00 48.71 C ATOM 2736 C LEU A 535 16.824 42.081 13.269 1.00 48.50 C ATOM 2737 O LEU A 535 17.822 41.821 13.942 1.00 48.50 O ATOM 2738 CB LEU A 535 16.341 43.837 11.534 1.00 48.78 C ATOM 2739 CG LEU A 535 17.158 45.087 11.880 1.00 48.86 C ATOM 2740 CD1 LEU A 535 16.745 46.257 10.996 1.00 48.90 C ATOM 2741 CD2 LEU A 535 17.038 45.458 13.356 1.00 48.87 C ATOM 0 H LEU A 535 15.982 41.809 10.212 1.00 48.95 H new ATOM 0 HA LEU A 535 17.917 42.492 11.608 1.00 48.71 H new ATOM 0 HB2 LEU A 535 16.113 43.885 10.592 1.00 48.78 H new ATOM 0 HB3 LEU A 535 15.509 43.882 12.030 1.00 48.78 H new ATOM 0 HG LEU A 535 18.090 44.880 11.710 1.00 48.86 H new ATOM 0 HD11 LEU A 535 17.270 47.039 11.227 1.00 48.90 H new ATOM 0 HD12 LEU A 535 16.897 46.029 10.065 1.00 48.90 H new ATOM 0 HD13 LEU A 535 15.804 46.449 11.132 1.00 48.90 H new ATOM 0 HD21 LEU A 535 17.567 46.251 13.535 1.00 48.87 H new ATOM 0 HD22 LEU A 535 16.109 45.635 13.571 1.00 48.87 H new ATOM 0 HD23 LEU A 535 17.362 44.724 13.902 1.00 48.87 H new ATOM 2742 N LEU A 536 15.590 42.055 13.767 1.00 48.17 N ATOM 2743 CA LEU A 536 15.337 41.696 15.166 1.00 47.92 C ATOM 2744 C LEU A 536 14.230 40.655 15.339 1.00 47.65 C ATOM 2745 O LEU A 536 13.472 40.687 16.307 1.00 47.67 O ATOM 2746 CB LEU A 536 15.056 42.945 16.013 1.00 48.09 C ATOM 2747 CG LEU A 536 14.074 44.003 15.497 1.00 48.21 C ATOM 2748 CD1 LEU A 536 12.625 43.629 15.800 1.00 48.23 C ATOM 2749 CD2 LEU A 536 14.413 45.366 16.085 1.00 48.12 C ATOM 0 H LEU A 536 14.884 42.242 13.313 1.00 48.17 H new ATOM 0 HA LEU A 536 16.151 41.277 15.487 1.00 47.92 H new ATOM 0 HB2 LEU A 536 14.731 42.644 16.876 1.00 48.09 H new ATOM 0 HB3 LEU A 536 15.905 43.388 16.168 1.00 48.09 H new ATOM 0 HG LEU A 536 14.164 44.045 14.532 1.00 48.21 H new ATOM 0 HD11 LEU A 536 12.035 44.319 15.460 1.00 48.23 H new ATOM 0 HD12 LEU A 536 12.413 42.784 15.374 1.00 48.23 H new ATOM 0 HD13 LEU A 536 12.506 43.546 16.759 1.00 48.23 H new ATOM 0 HD21 LEU A 536 13.786 46.027 15.752 1.00 48.12 H new ATOM 0 HD22 LEU A 536 14.356 45.325 17.052 1.00 48.12 H new ATOM 0 HD23 LEU A 536 15.314 45.616 15.825 1.00 48.12 H new ATOM 2750 N ARG A 537 14.149 39.737 14.384 1.00 47.27 N ATOM 2751 CA ARG A 537 13.350 38.531 14.518 1.00 46.99 C ATOM 2752 C ARG A 537 14.269 37.371 14.171 1.00 47.15 C ATOM 2753 O ARG A 537 14.260 36.876 13.043 1.00 47.13 O ATOM 2754 CB ARG A 537 12.158 38.560 13.564 1.00 46.65 C ATOM 2755 CG ARG A 537 10.883 39.135 14.147 1.00 46.27 C ATOM 2756 CD ARG A 537 10.318 38.232 15.227 1.00 45.85 C ATOM 2757 NE ARG A 537 8.868 38.095 15.112 1.00 45.50 N ATOM 2758 CZ ARG A 537 8.251 36.978 14.737 1.00 45.24 C ATOM 2759 NH1 ARG A 537 8.954 35.891 14.453 1.00 45.09 N ATOM 2760 NH2 ARG A 537 6.928 36.945 14.658 1.00 45.28 N ATOM 0 H ARG A 537 14.562 39.799 13.632 1.00 47.27 H new ATOM 0 HA ARG A 537 12.994 38.449 15.417 1.00 46.99 H new ATOM 0 HB2 ARG A 537 12.401 39.077 12.780 1.00 46.65 H new ATOM 0 HB3 ARG A 537 11.980 37.655 13.263 1.00 46.65 H new ATOM 0 HG2 ARG A 537 11.061 40.014 14.517 1.00 46.27 H new ATOM 0 HG3 ARG A 537 10.226 39.252 13.443 1.00 46.27 H new ATOM 0 HD2 ARG A 537 10.732 37.357 15.167 1.00 45.85 H new ATOM 0 HD3 ARG A 537 10.541 38.592 16.100 1.00 45.85 H new ATOM 0 HE ARG A 537 8.383 38.780 15.299 1.00 45.50 H new ATOM 0 HH11 ARG A 537 9.812 35.906 14.511 1.00 45.09 H new ATOM 0 HH12 ARG A 537 8.552 35.170 14.211 1.00 45.09 H new ATOM 0 HH21 ARG A 537 6.468 37.646 14.849 1.00 45.28 H new ATOM 0 HH22 ARG A 537 6.530 36.222 14.415 1.00 45.28 H new ATOM 2761 N ARG A 538 15.074 36.951 15.142 1.00 47.28 N ATOM 2762 CA ARG A 538 16.134 35.980 14.893 1.00 47.39 C ATOM 2763 C ARG A 538 15.606 34.641 14.373 1.00 47.53 C ATOM 2764 O ARG A 538 16.388 33.777 13.973 1.00 47.72 O ATOM 2765 CB ARG A 538 16.988 35.770 16.151 1.00 47.32 C ATOM 2766 CG ARG A 538 18.474 35.565 15.859 1.00 47.19 C ATOM 2767 CD ARG A 538 19.177 34.812 16.981 1.00 47.09 C ATOM 2768 NE ARG A 538 20.603 34.641 16.707 1.00 47.06 N ATOM 2769 CZ ARG A 538 21.576 35.195 17.427 1.00 47.07 C ATOM 2770 NH1 ARG A 538 21.285 35.954 18.481 1.00 47.00 N ATOM 2771 NH2 ARG A 538 22.844 34.982 17.099 1.00 46.97 N ATOM 0 H ARG A 538 15.022 37.218 15.958 1.00 47.28 H new ATOM 0 HA ARG A 538 16.690 36.353 14.191 1.00 47.39 H new ATOM 0 HB2 ARG A 538 16.884 36.538 16.734 1.00 47.32 H new ATOM 0 HB3 ARG A 538 16.652 34.999 16.635 1.00 47.32 H new ATOM 0 HG2 ARG A 538 18.575 35.074 15.028 1.00 47.19 H new ATOM 0 HG3 ARG A 538 18.900 36.427 15.733 1.00 47.19 H new ATOM 0 HD2 ARG A 538 19.063 35.294 17.815 1.00 47.09 H new ATOM 0 HD3 ARG A 538 18.763 33.942 17.097 1.00 47.09 H new ATOM 0 HE ARG A 538 20.828 34.151 16.037 1.00 47.06 H new ATOM 0 HH11 ARG A 538 20.464 36.089 18.700 1.00 47.00 H new ATOM 0 HH12 ARG A 538 21.918 36.309 18.943 1.00 47.00 H new ATOM 0 HH21 ARG A 538 23.036 34.487 16.422 1.00 46.97 H new ATOM 0 HH22 ARG A 538 23.474 35.339 17.563 1.00 46.97 H new ATOM 2772 N ASP A 539 14.286 34.470 14.371 1.00 47.56 N ATOM 2773 CA ASP A 539 13.695 33.223 13.884 1.00 47.60 C ATOM 2774 C ASP A 539 13.109 33.328 12.472 1.00 47.36 C ATOM 2775 O ASP A 539 12.659 32.330 11.912 1.00 47.36 O ATOM 2776 CB ASP A 539 12.655 32.670 14.871 1.00 47.75 C ATOM 2777 CG ASP A 539 11.280 33.290 14.689 1.00 47.87 C ATOM 2778 OD1 ASP A 539 11.164 34.532 14.783 1.00 47.87 O ATOM 2779 OD2 ASP A 539 10.313 32.528 14.466 1.00 47.86 O ATOM 0 H ASP A 539 13.719 35.056 14.644 1.00 47.56 H new ATOM 0 HA ASP A 539 14.431 32.594 13.824 1.00 47.60 H new ATOM 0 HB2 ASP A 539 12.589 31.709 14.759 1.00 47.75 H new ATOM 0 HB3 ASP A 539 12.959 32.830 15.778 1.00 47.75 H new ATOM 2780 N VAL A 540 13.113 34.529 11.898 1.00 47.22 N ATOM 2781 CA VAL A 540 12.728 34.683 10.490 1.00 47.03 C ATOM 2782 C VAL A 540 13.947 34.832 9.576 1.00 46.85 C ATOM 2783 O VAL A 540 14.856 35.626 9.848 1.00 46.62 O ATOM 2784 CB VAL A 540 11.658 35.798 10.254 1.00 47.01 C ATOM 2785 CG1 VAL A 540 11.582 36.744 11.431 1.00 47.00 C ATOM 2786 CG2 VAL A 540 11.906 36.547 8.940 1.00 47.00 C ATOM 0 H VAL A 540 13.331 35.259 12.296 1.00 47.22 H new ATOM 0 HA VAL A 540 12.289 33.854 10.242 1.00 47.03 H new ATOM 0 HB VAL A 540 10.795 35.363 10.176 1.00 47.01 H new ATOM 0 HG11 VAL A 540 10.912 37.424 11.257 1.00 47.00 H new ATOM 0 HG12 VAL A 540 11.340 36.249 12.229 1.00 47.00 H new ATOM 0 HG13 VAL A 540 12.445 37.167 11.562 1.00 47.00 H new ATOM 0 HG21 VAL A 540 11.227 37.230 8.823 1.00 47.00 H new ATOM 0 HG22 VAL A 540 12.782 36.963 8.965 1.00 47.00 H new ATOM 0 HG23 VAL A 540 11.866 35.922 8.199 1.00 47.00 H new ATOM 2787 N LEU A 541 13.959 34.042 8.505 1.00 46.69 N ATOM 2788 CA LEU A 541 15.047 34.041 7.538 1.00 46.45 C ATOM 2789 C LEU A 541 14.513 34.408 6.165 1.00 46.62 C ATOM 2790 O LEU A 541 13.338 34.183 5.870 1.00 46.17 O ATOM 2791 CB LEU A 541 15.699 32.659 7.451 1.00 46.53 C ATOM 2792 CG LEU A 541 16.242 31.962 8.697 1.00 46.26 C ATOM 2793 CD1 LEU A 541 15.112 31.539 9.615 1.00 46.45 C ATOM 2794 CD2 LEU A 541 17.063 30.756 8.285 1.00 46.35 C ATOM 0 H LEU A 541 13.329 33.487 8.320 1.00 46.69 H new ATOM 0 HA LEU A 541 15.707 34.689 7.829 1.00 46.45 H new ATOM 0 HB2 LEU A 541 15.046 32.062 7.054 1.00 46.53 H new ATOM 0 HB3 LEU A 541 16.435 32.732 6.823 1.00 46.53 H new ATOM 0 HG LEU A 541 16.805 32.585 9.183 1.00 46.26 H new ATOM 0 HD11 LEU A 541 15.478 31.099 10.398 1.00 46.45 H new ATOM 0 HD12 LEU A 541 14.608 32.321 9.890 1.00 46.45 H new ATOM 0 HD13 LEU A 541 14.526 30.926 9.145 1.00 46.45 H new ATOM 0 HD21 LEU A 541 17.408 30.313 9.076 1.00 46.35 H new ATOM 0 HD22 LEU A 541 16.504 30.139 7.787 1.00 46.35 H new ATOM 0 HD23 LEU A 541 17.803 31.043 7.727 1.00 46.35 H new ATOM 2795 N TYR A 542 15.391 34.961 5.330 1.00 46.85 N ATOM 2796 CA TYR A 542 15.048 35.337 3.965 1.00 47.58 C ATOM 2797 C TYR A 542 15.916 34.563 2.987 1.00 48.03 C ATOM 2798 O TYR A 542 17.141 34.578 3.099 1.00 48.51 O ATOM 2799 CB TYR A 542 15.260 36.838 3.743 1.00 47.50 C ATOM 2800 CG TYR A 542 14.426 37.729 4.632 1.00 47.44 C ATOM 2801 CD1 TYR A 542 14.778 37.948 5.957 1.00 47.57 C ATOM 2802 CD2 TYR A 542 13.293 38.367 4.142 1.00 47.62 C ATOM 2803 CE1 TYR A 542 14.017 38.774 6.778 1.00 47.65 C ATOM 2804 CE2 TYR A 542 12.524 39.195 4.955 1.00 47.65 C ATOM 2805 CZ TYR A 542 12.892 39.393 6.271 1.00 47.54 C ATOM 2806 OH TYR A 542 12.135 40.211 7.080 1.00 47.57 O ATOM 0 H TYR A 542 16.207 35.129 5.543 1.00 46.85 H new ATOM 0 HA TYR A 542 14.113 35.127 3.818 1.00 47.58 H new ATOM 0 HB2 TYR A 542 16.197 37.045 3.885 1.00 47.50 H new ATOM 0 HB3 TYR A 542 15.061 37.047 2.817 1.00 47.50 H new ATOM 0 HD1 TYR A 542 15.536 37.535 6.302 1.00 47.57 H new ATOM 0 HD2 TYR A 542 13.044 38.239 3.255 1.00 47.62 H new ATOM 0 HE1 TYR A 542 14.265 38.909 7.664 1.00 47.65 H new ATOM 0 HE2 TYR A 542 11.766 39.613 4.614 1.00 47.65 H new ATOM 0 HH TYR A 542 12.604 40.482 7.722 1.00 47.57 H new ATOM 2807 N TYR A 543 15.275 33.890 2.035 1.00 48.08 N ATOM 2808 CA TYR A 543 15.978 33.169 0.982 1.00 48.46 C ATOM 2809 C TYR A 543 16.952 34.094 0.268 1.00 48.48 C ATOM 2810 O TYR A 543 16.583 35.192 -0.142 1.00 48.61 O ATOM 2811 CB TYR A 543 14.977 32.598 -0.025 1.00 49.01 C ATOM 2812 CG TYR A 543 15.609 31.813 -1.158 1.00 49.23 C ATOM 2813 CD1 TYR A 543 15.972 30.483 -0.981 1.00 48.94 C ATOM 2814 CD2 TYR A 543 15.834 32.397 -2.410 1.00 49.15 C ATOM 2815 CE1 TYR A 543 16.547 29.755 -2.000 1.00 49.08 C ATOM 2816 CE2 TYR A 543 16.413 31.666 -3.448 1.00 48.89 C ATOM 2817 CZ TYR A 543 16.766 30.342 -3.225 1.00 49.19 C ATOM 2818 OH TYR A 543 17.335 29.581 -4.218 1.00 49.63 O ATOM 0 H TYR A 543 14.418 33.840 1.983 1.00 48.08 H new ATOM 0 HA TYR A 543 16.474 32.440 1.386 1.00 48.46 H new ATOM 0 HB2 TYR A 543 14.354 32.022 0.445 1.00 49.01 H new ATOM 0 HB3 TYR A 543 14.460 33.328 -0.400 1.00 49.01 H new ATOM 0 HD1 TYR A 543 15.824 30.076 -0.158 1.00 48.94 H new ATOM 0 HD2 TYR A 543 15.594 33.284 -2.552 1.00 49.15 H new ATOM 0 HE1 TYR A 543 16.787 28.867 -1.860 1.00 49.08 H new ATOM 0 HE2 TYR A 543 16.560 32.060 -4.277 1.00 48.89 H new ATOM 0 HH TYR A 543 17.417 30.044 -4.914 1.00 49.63 H new ATOM 2819 N LYS A 544 18.195 33.650 0.114 1.00 48.49 N ATOM 2820 CA LYS A 544 19.196 34.450 -0.591 1.00 48.14 C ATOM 2821 C LYS A 544 19.726 33.758 -1.847 1.00 48.54 C ATOM 2822 O LYS A 544 20.160 34.411 -2.790 1.00 48.96 O ATOM 2823 CB LYS A 544 20.342 34.829 0.350 1.00 47.44 C ATOM 2824 CG LYS A 544 19.942 35.844 1.413 1.00 47.01 C ATOM 2825 CD LYS A 544 19.555 37.181 0.786 1.00 46.45 C ATOM 2826 CE LYS A 544 18.805 38.056 1.777 1.00 46.48 C ATOM 2827 NZ LYS A 544 18.573 39.435 1.263 1.00 46.02 N ATOM 0 H LYS A 544 18.480 32.893 0.407 1.00 48.49 H new ATOM 0 HA LYS A 544 18.753 35.260 -0.888 1.00 48.14 H new ATOM 0 HB2 LYS A 544 20.672 34.028 0.786 1.00 47.44 H new ATOM 0 HB3 LYS A 544 21.075 35.190 -0.173 1.00 47.44 H new ATOM 0 HG2 LYS A 544 19.197 35.499 1.929 1.00 47.01 H new ATOM 0 HG3 LYS A 544 20.678 35.975 2.031 1.00 47.01 H new ATOM 0 HD2 LYS A 544 20.353 37.642 0.483 1.00 46.45 H new ATOM 0 HD3 LYS A 544 19.002 37.027 0.004 1.00 46.45 H new ATOM 0 HE2 LYS A 544 17.952 37.644 1.985 1.00 46.48 H new ATOM 0 HE3 LYS A 544 19.307 38.104 2.606 1.00 46.48 H new ATOM 0 HZ1 LYS A 544 18.133 39.910 1.874 1.00 46.02 H new ATOM 0 HZ2 LYS A 544 19.355 39.824 1.093 1.00 46.02 H new ATOM 0 HZ3 LYS A 544 18.092 39.396 0.515 1.00 46.02 H new ATOM 2828 N GLY A 545 19.686 32.435 -1.861 1.00 48.95 N ATOM 2829 CA GLY A 545 20.145 31.678 -3.024 1.00 50.13 C ATOM 2830 C GLY A 545 20.378 30.226 -2.660 1.00 50.37 C ATOM 2831 O GLY A 545 20.089 29.816 -1.541 1.00 50.30 O ATOM 0 H GLY A 545 19.398 31.953 -1.210 1.00 48.95 H new ATOM 0 HA2 GLY A 545 19.487 31.737 -3.734 1.00 50.13 H new ATOM 0 HA3 GLY A 545 20.966 32.066 -3.365 1.00 50.13 H new ATOM 2832 N ARG A 546 20.904 29.454 -3.607 1.00 50.75 N ATOM 2833 CA ARG A 546 21.230 28.049 -3.375 1.00 51.25 C ATOM 2834 C ARG A 546 22.316 27.593 -4.338 1.00 51.83 C ATOM 2835 O ARG A 546 22.587 28.261 -5.339 1.00 52.14 O ATOM 2836 CB ARG A 546 19.994 27.170 -3.583 1.00 50.94 C ATOM 2837 CG ARG A 546 19.639 26.920 -5.058 1.00 51.01 C ATOM 2838 CD ARG A 546 18.370 26.070 -5.195 1.00 50.73 C ATOM 2839 NE ARG A 546 17.178 26.800 -4.761 1.00 50.43 N ATOM 2840 CZ ARG A 546 15.955 26.277 -4.680 1.00 50.74 C ATOM 2841 NH1 ARG A 546 15.738 25.001 -4.994 1.00 50.26 N ATOM 2842 NH2 ARG A 546 14.939 27.036 -4.281 1.00 50.75 N ATOM 0 H ARG A 546 21.082 29.730 -4.402 1.00 50.75 H new ATOM 0 HA ARG A 546 21.542 27.962 -2.461 1.00 51.25 H new ATOM 0 HB2 ARG A 546 20.140 26.316 -3.147 1.00 50.94 H new ATOM 0 HB3 ARG A 546 19.236 27.587 -3.144 1.00 50.94 H new ATOM 0 HG2 ARG A 546 19.511 27.769 -5.510 1.00 51.01 H new ATOM 0 HG3 ARG A 546 20.378 26.473 -5.499 1.00 51.01 H new ATOM 0 HD2 ARG A 546 18.263 25.795 -6.119 1.00 50.73 H new ATOM 0 HD3 ARG A 546 18.464 25.261 -4.668 1.00 50.73 H new ATOM 0 HE ARG A 546 17.274 27.626 -4.542 1.00 50.43 H new ATOM 0 HH11 ARG A 546 16.391 24.505 -5.252 1.00 50.26 H new ATOM 0 HH12 ARG A 546 14.945 24.673 -4.938 1.00 50.26 H new ATOM 0 HH21 ARG A 546 15.073 27.861 -4.077 1.00 50.75 H new ATOM 0 HH22 ARG A 546 14.148 26.702 -4.227 1.00 50.75 H new ATOM 2843 N LEU A 547 22.924 26.446 -4.048 1.00 51.91 N ATOM 2844 CA LEU A 547 23.856 25.832 -4.991 1.00 52.08 C ATOM 2845 C LEU A 547 23.525 24.361 -5.217 1.00 52.18 C ATOM 2846 O LEU A 547 23.012 23.687 -4.329 1.00 51.88 O ATOM 2847 CB LEU A 547 25.300 25.977 -4.514 1.00 52.19 C ATOM 2848 CG LEU A 547 25.810 27.404 -4.356 1.00 52.11 C ATOM 2849 CD1 LEU A 547 27.081 27.412 -3.533 1.00 52.09 C ATOM 2850 CD2 LEU A 547 26.023 28.050 -5.726 1.00 52.45 C ATOM 0 H LEU A 547 22.812 26.009 -3.316 1.00 51.91 H new ATOM 0 HA LEU A 547 23.762 26.301 -5.835 1.00 52.08 H new ATOM 0 HB2 LEU A 547 25.387 25.525 -3.660 1.00 52.19 H new ATOM 0 HB3 LEU A 547 25.877 25.513 -5.141 1.00 52.19 H new ATOM 0 HG LEU A 547 25.145 27.930 -3.885 1.00 52.11 H new ATOM 0 HD11 LEU A 547 27.399 28.323 -3.437 1.00 52.09 H new ATOM 0 HD12 LEU A 547 26.901 27.039 -2.656 1.00 52.09 H new ATOM 0 HD13 LEU A 547 27.758 26.879 -3.978 1.00 52.09 H new ATOM 0 HD21 LEU A 547 26.347 28.957 -5.610 1.00 52.45 H new ATOM 0 HD22 LEU A 547 26.674 27.536 -6.229 1.00 52.45 H new ATOM 0 HD23 LEU A 547 25.183 28.067 -6.210 1.00 52.45 H new ATOM 2851 N ASP A 548 23.846 23.879 -6.412 1.00 51.90 N ATOM 2852 CA ASP A 548 23.587 22.510 -6.816 1.00 52.18 C ATOM 2853 C ASP A 548 24.813 21.667 -6.485 1.00 52.07 C ATOM 2854 O ASP A 548 25.867 21.852 -7.076 1.00 52.05 O ATOM 2855 CB ASP A 548 23.314 22.489 -8.323 1.00 52.30 C ATOM 2856 CG ASP A 548 22.815 21.155 -8.818 1.00 52.26 C ATOM 2857 OD1 ASP A 548 23.037 20.129 -8.144 1.00 52.28 O ATOM 2858 OD2 ASP A 548 22.200 21.137 -9.904 1.00 52.56 O ATOM 0 H ASP A 548 24.228 24.351 -7.021 1.00 51.90 H new ATOM 0 HA ASP A 548 22.817 22.149 -6.349 1.00 52.18 H new ATOM 0 HB2 ASP A 548 22.659 23.172 -8.537 1.00 52.30 H new ATOM 0 HB3 ASP A 548 24.129 22.719 -8.797 1.00 52.30 H new ATOM 2859 N MET A 549 24.674 20.740 -5.542 1.00 52.31 N ATOM 2860 CA MET A 549 25.823 19.970 -5.065 1.00 52.20 C ATOM 2861 C MET A 549 26.345 18.985 -6.097 1.00 51.70 C ATOM 2862 O MET A 549 27.489 18.550 -6.023 1.00 50.80 O ATOM 2863 CB MET A 549 25.491 19.239 -3.766 1.00 52.58 C ATOM 2864 CG MET A 549 25.460 20.157 -2.553 1.00 53.27 C ATOM 2865 SD MET A 549 26.925 21.210 -2.453 1.00 53.97 S ATOM 2866 CE MET A 549 26.242 22.591 -1.572 1.00 53.72 C ATOM 0 H MET A 549 23.927 20.541 -5.166 1.00 52.31 H new ATOM 0 HA MET A 549 26.529 20.614 -4.899 1.00 52.20 H new ATOM 0 HB2 MET A 549 24.629 18.804 -3.858 1.00 52.58 H new ATOM 0 HB3 MET A 549 26.147 18.540 -3.618 1.00 52.58 H new ATOM 0 HG2 MET A 549 24.666 20.713 -2.591 1.00 53.27 H new ATOM 0 HG3 MET A 549 25.393 19.622 -1.747 1.00 53.27 H new ATOM 0 HE1 MET A 549 26.674 23.408 -1.866 1.00 53.72 H new ATOM 0 HE2 MET A 549 25.290 22.648 -1.748 1.00 53.72 H new ATOM 0 HE3 MET A 549 26.388 22.472 -0.620 1.00 53.72 H new ATOM 2867 N ASP A 550 25.498 18.632 -7.055 1.00 51.81 N ATOM 2868 CA ASP A 550 25.871 17.656 -8.067 1.00 52.27 C ATOM 2869 C ASP A 550 27.085 18.094 -8.901 1.00 52.38 C ATOM 2870 O ASP A 550 27.977 17.295 -9.168 1.00 52.52 O ATOM 2871 CB ASP A 550 24.664 17.291 -8.935 1.00 52.13 C ATOM 2872 CG ASP A 550 23.645 16.443 -8.183 1.00 52.05 C ATOM 2873 OD1 ASP A 550 23.812 16.254 -6.959 1.00 51.62 O ATOM 2874 OD2 ASP A 550 22.681 15.962 -8.813 1.00 52.14 O ATOM 0 H ASP A 550 24.702 18.947 -7.136 1.00 51.81 H new ATOM 0 HA ASP A 550 26.156 16.853 -7.604 1.00 52.27 H new ATOM 0 HB2 ASP A 550 24.237 18.103 -9.249 1.00 52.13 H new ATOM 0 HB3 ASP A 550 24.967 16.808 -9.720 1.00 52.13 H new ATOM 2875 N GLY A 551 27.143 19.364 -9.278 1.00 52.59 N ATOM 2876 CA GLY A 551 28.326 19.865 -9.969 1.00 53.20 C ATOM 2877 C GLY A 551 29.519 20.077 -9.046 1.00 53.50 C ATOM 2878 O GLY A 551 30.660 20.141 -9.503 1.00 53.27 O ATOM 0 H GLY A 551 26.522 19.944 -9.147 1.00 52.59 H new ATOM 0 HA2 GLY A 551 28.573 19.240 -10.668 1.00 53.20 H new ATOM 0 HA3 GLY A 551 28.108 20.705 -10.403 1.00 53.20 H new ATOM 2879 N LEU A 552 29.255 20.152 -7.743 1.00 54.21 N ATOM 2880 CA LEU A 552 30.222 20.677 -6.772 1.00 54.91 C ATOM 2881 C LEU A 552 31.116 19.658 -6.063 1.00 55.84 C ATOM 2882 O LEU A 552 30.773 18.483 -5.946 1.00 55.81 O ATOM 2883 CB LEU A 552 29.495 21.532 -5.732 1.00 54.53 C ATOM 2884 CG LEU A 552 28.904 22.832 -6.276 1.00 54.41 C ATOM 2885 CD1 LEU A 552 28.235 23.635 -5.169 1.00 54.05 C ATOM 2886 CD2 LEU A 552 29.997 23.652 -6.964 1.00 54.37 C ATOM 0 H LEU A 552 28.510 19.900 -7.394 1.00 54.21 H new ATOM 0 HA LEU A 552 30.838 21.198 -7.311 1.00 54.91 H new ATOM 0 HB2 LEU A 552 28.781 21.005 -5.340 1.00 54.53 H new ATOM 0 HB3 LEU A 552 30.115 21.747 -5.017 1.00 54.53 H new ATOM 0 HG LEU A 552 28.221 22.613 -6.929 1.00 54.41 H new ATOM 0 HD11 LEU A 552 27.869 24.454 -5.539 1.00 54.05 H new ATOM 0 HD12 LEU A 552 27.520 23.110 -4.775 1.00 54.05 H new ATOM 0 HD13 LEU A 552 28.889 23.853 -4.487 1.00 54.05 H new ATOM 0 HD21 LEU A 552 29.616 24.476 -7.307 1.00 54.37 H new ATOM 0 HD22 LEU A 552 30.696 23.861 -6.325 1.00 54.37 H new ATOM 0 HD23 LEU A 552 30.373 23.140 -7.697 1.00 54.37 H new ATOM 2887 N GLU A 553 32.264 20.136 -5.585 1.00 57.25 N ATOM 2888 CA GLU A 553 33.220 19.314 -4.844 1.00 58.78 C ATOM 2889 C GLU A 553 34.031 20.171 -3.864 1.00 59.89 C ATOM 2890 O GLU A 553 34.312 21.340 -4.136 1.00 60.02 O ATOM 2891 CB GLU A 553 34.149 18.569 -5.806 1.00 58.87 C ATOM 2892 CG GLU A 553 34.833 17.356 -5.194 1.00 59.09 C ATOM 2893 CD GLU A 553 33.843 16.305 -4.724 1.00 59.21 C ATOM 2894 OE1 GLU A 553 32.987 15.882 -5.532 1.00 59.22 O ATOM 2895 OE2 GLU A 553 33.924 15.899 -3.545 1.00 59.34 O ATOM 0 H GLU A 553 32.512 20.954 -5.683 1.00 57.25 H new ATOM 0 HA GLU A 553 32.722 18.658 -4.331 1.00 58.78 H new ATOM 0 HB2 GLU A 553 33.637 18.284 -6.579 1.00 58.87 H new ATOM 0 HB3 GLU A 553 34.828 19.184 -6.126 1.00 58.87 H new ATOM 0 HG2 GLU A 553 35.432 16.962 -5.848 1.00 59.09 H new ATOM 0 HG3 GLU A 553 35.379 17.640 -4.444 1.00 59.09 H new ATOM 2896 N VAL A 554 34.410 19.586 -2.731 1.00 61.18 N ATOM 2897 CA VAL A 554 35.035 20.342 -1.640 1.00 62.45 C ATOM 2898 C VAL A 554 36.547 20.521 -1.782 1.00 63.29 C ATOM 2899 O VAL A 554 37.274 19.573 -2.084 1.00 63.30 O ATOM 2900 CB VAL A 554 34.708 19.714 -0.261 1.00 62.51 C ATOM 2901 CG1 VAL A 554 35.745 20.101 0.784 1.00 62.60 C ATOM 2902 CG2 VAL A 554 33.326 20.132 0.185 1.00 62.57 C ATOM 0 H VAL A 554 34.315 18.747 -2.570 1.00 61.18 H new ATOM 0 HA VAL A 554 34.647 21.229 -1.699 1.00 62.45 H new ATOM 0 HB VAL A 554 34.731 18.749 -0.356 1.00 62.51 H new ATOM 0 HG11 VAL A 554 35.515 19.695 1.634 1.00 62.60 H new ATOM 0 HG12 VAL A 554 36.620 19.789 0.503 1.00 62.60 H new ATOM 0 HG13 VAL A 554 35.762 21.066 0.881 1.00 62.60 H new ATOM 0 HG21 VAL A 554 33.130 19.735 1.048 1.00 62.57 H new ATOM 0 HG22 VAL A 554 33.288 21.098 0.258 1.00 62.57 H new ATOM 0 HG23 VAL A 554 32.671 19.832 -0.465 1.00 62.57 H new ATOM 2903 N VAL A 555 37.005 21.752 -1.557 1.00 64.37 N ATOM 2904 CA VAL A 555 38.430 22.060 -1.547 1.00 65.22 C ATOM 2905 C VAL A 555 38.861 22.593 -0.179 1.00 65.77 C ATOM 2906 O VAL A 555 38.567 23.736 0.176 1.00 66.08 O ATOM 2907 CB VAL A 555 38.811 23.079 -2.643 1.00 65.37 C ATOM 2908 CG1 VAL A 555 40.317 23.291 -2.665 1.00 65.45 C ATOM 2909 CG2 VAL A 555 38.324 22.609 -4.006 1.00 65.40 C ATOM 0 H VAL A 555 36.497 22.430 -1.406 1.00 64.37 H new ATOM 0 HA VAL A 555 38.897 21.230 -1.732 1.00 65.22 H new ATOM 0 HB VAL A 555 38.380 23.924 -2.439 1.00 65.37 H new ATOM 0 HG11 VAL A 555 40.544 23.932 -3.357 1.00 65.45 H new ATOM 0 HG12 VAL A 555 40.609 23.628 -1.804 1.00 65.45 H new ATOM 0 HG13 VAL A 555 40.760 22.448 -2.849 1.00 65.45 H new ATOM 0 HG21 VAL A 555 38.572 23.260 -4.681 1.00 65.40 H new ATOM 0 HG22 VAL A 555 38.730 21.754 -4.218 1.00 65.40 H new ATOM 0 HG23 VAL A 555 37.359 22.513 -3.989 1.00 65.40 H new ATOM 2910 N ASP A 556 39.552 21.743 0.577 1.00 66.36 N ATOM 2911 CA ASP A 556 40.080 22.089 1.897 1.00 66.97 C ATOM 2912 C ASP A 556 41.193 23.137 1.787 1.00 67.34 C ATOM 2913 O ASP A 556 42.297 22.830 1.342 1.00 67.28 O ATOM 2914 CB ASP A 556 40.616 20.823 2.577 1.00 66.81 C ATOM 2915 CG ASP A 556 40.810 20.993 4.074 1.00 66.76 C ATOM 2916 OD1 ASP A 556 40.893 22.146 4.545 1.00 66.66 O ATOM 2917 OD2 ASP A 556 40.884 19.965 4.782 1.00 66.66 O ATOM 0 H ASP A 556 39.730 20.937 0.335 1.00 66.36 H new ATOM 0 HA ASP A 556 39.363 22.468 2.429 1.00 66.97 H new ATOM 0 HB2 ASP A 556 40.001 20.090 2.416 1.00 66.81 H new ATOM 0 HB3 ASP A 556 41.462 20.577 2.172 1.00 66.81 H new ATOM 2918 N LEU A 557 40.898 24.369 2.196 1.00 67.97 N ATOM 2919 CA LEU A 557 41.851 25.471 2.065 1.00 68.52 C ATOM 2920 C LEU A 557 42.500 25.856 3.392 1.00 68.94 C ATOM 2921 O LEU A 557 41.856 26.440 4.268 1.00 68.86 O ATOM 2922 CB LEU A 557 41.184 26.697 1.430 1.00 68.58 C ATOM 2923 CG LEU A 557 40.579 26.508 0.036 1.00 68.65 C ATOM 2924 CD1 LEU A 557 39.995 27.817 -0.479 1.00 68.52 C ATOM 2925 CD2 LEU A 557 41.628 25.970 -0.928 1.00 68.82 C ATOM 0 H LEU A 557 40.148 24.589 2.554 1.00 67.97 H new ATOM 0 HA LEU A 557 42.558 25.152 1.483 1.00 68.52 H new ATOM 0 HB2 LEU A 557 40.482 27.002 2.026 1.00 68.58 H new ATOM 0 HB3 LEU A 557 41.842 27.408 1.380 1.00 68.58 H new ATOM 0 HG LEU A 557 39.859 25.861 0.099 1.00 68.65 H new ATOM 0 HD11 LEU A 557 39.617 27.678 -1.361 1.00 68.52 H new ATOM 0 HD12 LEU A 557 39.300 28.122 0.125 1.00 68.52 H new ATOM 0 HD13 LEU A 557 40.695 28.486 -0.529 1.00 68.52 H new ATOM 0 HD21 LEU A 557 41.232 25.855 -1.806 1.00 68.82 H new ATOM 0 HD22 LEU A 557 42.366 26.597 -0.986 1.00 68.82 H new ATOM 0 HD23 LEU A 557 41.955 25.115 -0.607 1.00 68.82 H new ATOM 2926 N GLU A 558 43.784 25.527 3.521 1.00 69.58 N ATOM 2927 CA GLU A 558 44.573 25.905 4.688 1.00 70.07 C ATOM 2928 C GLU A 558 44.709 27.429 4.761 1.00 70.88 C ATOM 2929 O GLU A 558 44.518 28.125 3.762 1.00 70.81 O ATOM 2930 CB GLU A 558 45.955 25.251 4.623 1.00 69.51 C ATOM 2931 CG GLU A 558 46.483 24.761 5.962 1.00 69.00 C ATOM 2932 CD GLU A 558 45.860 23.445 6.395 1.00 68.65 C ATOM 2933 OE1 GLU A 558 45.194 22.793 5.564 1.00 68.41 O ATOM 2934 OE2 GLU A 558 46.042 23.059 7.568 1.00 68.46 O ATOM 0 H GLU A 558 44.221 25.078 2.932 1.00 69.58 H new ATOM 0 HA GLU A 558 44.120 25.595 5.487 1.00 70.07 H new ATOM 0 HB2 GLU A 558 45.917 24.501 4.009 1.00 69.51 H new ATOM 0 HB3 GLU A 558 46.585 25.889 4.253 1.00 69.51 H new ATOM 0 HG2 GLU A 558 47.446 24.655 5.906 1.00 69.00 H new ATOM 0 HG3 GLU A 558 46.310 25.434 6.639 1.00 69.00 H new ATOM 2935 N ASP A 559 45.047 27.938 5.942 1.00 72.00 N ATOM 2936 CA ASP A 559 45.075 29.383 6.186 1.00 73.23 C ATOM 2937 C ASP A 559 46.161 30.167 5.448 1.00 74.16 C ATOM 2938 O ASP A 559 47.151 29.604 4.978 1.00 74.19 O ATOM 2939 CB ASP A 559 45.156 29.676 7.686 1.00 73.16 C ATOM 2940 CG ASP A 559 43.822 30.087 8.266 1.00 73.17 C ATOM 2941 OD1 ASP A 559 43.021 30.686 7.521 1.00 73.18 O ATOM 2942 OD2 ASP A 559 43.578 29.819 9.461 1.00 73.12 O ATOM 0 H ASP A 559 45.266 27.461 6.623 1.00 72.00 H new ATOM 0 HA ASP A 559 44.237 29.700 5.813 1.00 73.23 H new ATOM 0 HB2 ASP A 559 45.478 28.888 8.150 1.00 73.16 H new ATOM 0 HB3 ASP A 559 45.804 30.381 7.841 1.00 73.16 H new ATOM 2943 N GLY A 560 45.952 31.478 5.367 1.00 75.33 N ATOM 2944 CA GLY A 560 46.873 32.392 4.701 1.00 76.76 C ATOM 2945 C GLY A 560 46.122 33.593 4.157 1.00 77.82 C ATOM 2946 O GLY A 560 45.015 33.900 4.606 1.00 77.83 O ATOM 0 H GLY A 560 45.262 31.866 5.702 1.00 75.33 H new ATOM 0 HA2 GLY A 560 47.555 32.685 5.325 1.00 76.76 H new ATOM 0 HA3 GLY A 560 47.328 31.933 3.978 1.00 76.76 H new ATOM 2947 N LYS A 561 46.727 34.285 3.197 1.00 78.83 N ATOM 2948 CA LYS A 561 46.021 35.323 2.459 1.00 79.92 C ATOM 2949 C LYS A 561 44.958 34.645 1.620 1.00 80.67 C ATOM 2950 O LYS A 561 44.960 33.421 1.482 1.00 80.71 O ATOM 0 H LYS A 561 47.545 34.168 2.959 1.00 78.83 H new ATOM 2951 N ASP A 562 44.046 35.428 1.060 1.00 81.41 N ATOM 2952 CA ASP A 562 42.955 34.871 0.271 1.00 82.18 C ATOM 2953 C ASP A 562 43.415 34.174 -0.992 1.00 82.67 C ATOM 2954 O ASP A 562 43.895 33.039 -0.953 1.00 82.67 O ATOM 0 H ASP A 562 44.040 36.286 1.124 1.00 81.41 H new ATOM 2955 N ARG A 563 43.277 34.862 -2.118 1.00 83.02 N ATOM 2956 CA ARG A 563 43.508 34.244 -3.414 1.00 83.44 C ATOM 2957 C ARG A 563 42.170 34.069 -4.099 1.00 83.69 C ATOM 2958 O ARG A 563 41.192 33.646 -3.476 1.00 83.78 O ATOM 0 H ARG A 563 43.049 35.691 -2.152 1.00 83.02 H new ATOM 2959 N ASP A 564 42.124 34.397 -5.384 1.00 83.69 N ATOM 2960 CA ASP A 564 40.859 34.456 -6.095 1.00 83.55 C ATOM 2961 C ASP A 564 40.057 35.642 -5.595 1.00 83.38 C ATOM 2962 O ASP A 564 39.020 35.478 -4.948 1.00 83.62 O ATOM 0 H ASP A 564 42.814 34.588 -5.860 1.00 83.69 H new ATOM 2963 N LEU A 565 40.555 36.844 -5.874 1.00 82.93 N ATOM 2964 CA LEU A 565 39.827 38.062 -5.543 1.00 82.42 C ATOM 2965 C LEU A 565 40.443 38.935 -4.464 1.00 81.84 C ATOM 2966 O LEU A 565 40.607 40.141 -4.657 1.00 81.82 O ATOM 0 H LEU A 565 41.315 36.974 -6.256 1.00 82.93 H new ATOM 2967 N HIS A 566 40.779 38.336 -3.323 1.00 81.19 N ATOM 2968 CA HIS A 566 41.243 39.114 -2.176 1.00 80.36 C ATOM 2969 C HIS A 566 42.141 38.391 -1.186 1.00 79.63 C ATOM 2970 O HIS A 566 43.053 37.659 -1.580 1.00 79.60 O ATOM 0 H HIS A 566 40.746 37.487 -3.193 1.00 81.19 H new ATOM 2971 N VAL A 567 41.873 38.596 0.106 1.00 78.69 N ATOM 2972 CA VAL A 567 42.798 38.175 1.162 1.00 77.30 C ATOM 2973 C VAL A 567 42.236 37.532 2.422 1.00 76.14 C ATOM 2974 O VAL A 567 42.161 36.307 2.519 1.00 75.98 O ATOM 0 H VAL A 567 41.158 38.979 0.393 1.00 78.69 H new ATOM 2975 N SER A 568 41.862 38.359 3.396 1.00 75.06 N ATOM 2976 CA SER A 568 41.510 37.889 4.745 1.00 73.60 C ATOM 2977 C SER A 568 40.521 36.737 4.839 1.00 72.29 C ATOM 2978 O SER A 568 39.313 36.933 4.689 1.00 72.38 O ATOM 0 H SER A 568 41.804 39.211 3.297 1.00 75.06 H new ATOM 2979 N ILE A 569 41.037 35.536 5.100 1.00 70.69 N ATOM 2980 CA ILE A 569 40.206 34.337 5.241 1.00 68.75 C ATOM 2981 C ILE A 569 40.840 33.285 6.137 1.00 67.22 C ATOM 2982 O ILE A 569 42.053 33.078 6.096 1.00 67.23 O ATOM 0 H ILE A 569 41.879 35.392 5.201 1.00 70.69 H new ATOM 2983 N LYS A 570 40.019 32.615 6.944 1.00 65.67 N ATOM 2984 CA LYS A 570 40.518 31.652 7.928 1.00 63.63 C ATOM 2985 C LYS A 570 40.001 30.230 7.778 1.00 62.19 C ATOM 2986 O LYS A 570 40.427 29.495 6.884 1.00 62.16 O ATOM 0 H LYS A 570 39.164 32.704 6.938 1.00 65.67 H new ATOM 2987 N ASN A 571 39.093 29.836 8.668 1.00 60.55 N ATOM 2988 CA ASN A 571 38.503 28.499 8.640 1.00 58.85 C ATOM 2989 C ASN A 571 37.740 28.269 7.334 1.00 57.83 C ATOM 2990 O ASN A 571 36.532 28.018 7.335 1.00 57.44 O ATOM 2991 CB ASN A 571 37.588 28.301 9.854 1.00 58.57 C ATOM 2992 CG ASN A 571 38.323 28.479 11.178 1.00 58.31 C ATOM 2993 OD1 ASN A 571 39.370 27.872 11.408 1.00 57.91 O ATOM 2994 ND2 ASN A 571 37.771 29.309 12.055 1.00 58.15 N ATOM 0 H ASN A 571 38.802 30.336 9.305 1.00 60.55 H new ATOM 0 HA ASN A 571 39.217 27.844 8.684 1.00 58.85 H new ATOM 0 HB2 ASN A 571 36.854 28.933 9.808 1.00 58.57 H new ATOM 0 HB3 ASN A 571 37.200 27.413 9.821 1.00 58.57 H new ATOM 0 HD21 ASN A 571 38.146 29.440 12.818 1.00 58.15 H new ATOM 0 HD22 ASN A 571 37.039 29.716 11.860 1.00 58.15 H new ATOM 2995 N ALA A 572 38.471 28.338 6.223 1.00 56.55 N ATOM 2996 CA ALA A 572 37.869 28.447 4.897 1.00 55.28 C ATOM 2997 C ALA A 572 38.025 27.215 4.001 1.00 54.29 C ATOM 2998 O ALA A 572 38.895 26.367 4.216 1.00 54.24 O ATOM 2999 CB ALA A 572 38.404 29.687 4.184 1.00 55.22 C ATOM 0 H ALA A 572 39.331 28.323 6.218 1.00 56.55 H new ATOM 0 HA ALA A 572 36.915 28.521 5.056 1.00 55.28 H new ATOM 0 HB1 ALA A 572 38.001 29.754 3.304 1.00 55.22 H new ATOM 0 HB2 ALA A 572 38.184 30.478 4.701 1.00 55.22 H new ATOM 0 HB3 ALA A 572 39.367 29.618 4.093 1.00 55.22 H new ATOM 3000 N PHE A 573 37.167 27.148 2.987 1.00 52.77 N ATOM 3001 CA PHE A 573 37.196 26.100 1.977 1.00 51.28 C ATOM 3002 C PHE A 573 36.374 26.574 0.779 1.00 50.00 C ATOM 3003 O PHE A 573 35.551 27.484 0.910 1.00 50.00 O ATOM 3004 CB PHE A 573 36.626 24.788 2.535 1.00 51.56 C ATOM 3005 CG PHE A 573 35.228 24.914 3.085 1.00 51.52 C ATOM 3006 CD1 PHE A 573 35.019 25.230 4.419 1.00 51.59 C ATOM 3007 CD2 PHE A 573 34.127 24.712 2.271 1.00 51.48 C ATOM 3008 CE1 PHE A 573 33.742 25.349 4.928 1.00 51.70 C ATOM 3009 CE2 PHE A 573 32.845 24.833 2.774 1.00 51.71 C ATOM 3010 CZ PHE A 573 32.651 25.150 4.105 1.00 51.77 C ATOM 0 H PHE A 573 36.539 27.723 2.866 1.00 52.77 H new ATOM 0 HA PHE A 573 38.112 25.927 1.708 1.00 51.28 H new ATOM 0 HB2 PHE A 573 36.628 24.120 1.832 1.00 51.56 H new ATOM 0 HB3 PHE A 573 37.212 24.464 3.237 1.00 51.56 H new ATOM 0 HD1 PHE A 573 35.750 25.364 4.978 1.00 51.59 H new ATOM 0 HD2 PHE A 573 34.251 24.492 1.376 1.00 51.48 H new ATOM 0 HE1 PHE A 573 33.616 25.563 5.824 1.00 51.70 H new ATOM 0 HE2 PHE A 573 32.113 24.701 2.216 1.00 51.71 H new ATOM 0 HZ PHE A 573 31.789 25.229 4.445 1.00 51.77 H new ATOM 3011 N ARG A 574 36.594 25.970 -0.385 1.00 48.08 N ATOM 3012 CA ARG A 574 35.828 26.338 -1.575 1.00 45.86 C ATOM 3013 C ARG A 574 35.024 25.175 -2.144 1.00 44.45 C ATOM 3014 O ARG A 574 35.499 24.038 -2.188 1.00 44.04 O ATOM 3015 CB ARG A 574 36.744 26.912 -2.657 1.00 46.06 C ATOM 3016 CG ARG A 574 37.044 28.397 -2.515 1.00 46.21 C ATOM 3017 CD ARG A 574 37.957 28.863 -3.644 1.00 46.50 C ATOM 3018 NE ARG A 574 38.117 30.315 -3.693 1.00 46.60 N ATOM 3019 CZ ARG A 574 37.263 31.148 -4.281 1.00 46.60 C ATOM 3020 NH1 ARG A 574 36.168 30.683 -4.869 1.00 46.50 N ATOM 3021 NH2 ARG A 574 37.502 32.453 -4.279 1.00 46.67 N ATOM 0 H ARG A 574 37.177 25.350 -0.508 1.00 48.08 H new ATOM 0 HA ARG A 574 35.196 27.017 -1.291 1.00 45.86 H new ATOM 0 HB2 ARG A 574 37.582 26.423 -2.647 1.00 46.06 H new ATOM 0 HB3 ARG A 574 36.336 26.758 -3.524 1.00 46.06 H new ATOM 0 HG2 ARG A 574 36.217 28.903 -2.530 1.00 46.21 H new ATOM 0 HG3 ARG A 574 37.466 28.568 -1.658 1.00 46.21 H new ATOM 0 HD2 ARG A 574 38.829 28.451 -3.538 1.00 46.50 H new ATOM 0 HD3 ARG A 574 37.598 28.554 -4.491 1.00 46.50 H new ATOM 0 HE ARG A 574 38.811 30.654 -3.316 1.00 46.60 H new ATOM 0 HH11 ARG A 574 36.007 29.838 -4.871 1.00 46.50 H new ATOM 0 HH12 ARG A 574 35.619 31.226 -5.248 1.00 46.50 H new ATOM 0 HH21 ARG A 574 38.209 32.760 -3.898 1.00 46.67 H new ATOM 0 HH22 ARG A 574 36.950 32.992 -4.659 1.00 46.67 H new ATOM 3022 N LEU A 575 33.796 25.467 -2.567 1.00 42.43 N ATOM 3023 CA LEU A 575 33.007 24.511 -3.324 1.00 40.86 C ATOM 3024 C LEU A 575 33.346 24.700 -4.795 1.00 39.92 C ATOM 3025 O LEU A 575 32.819 25.595 -5.460 1.00 39.87 O ATOM 3026 CB LEU A 575 31.501 24.705 -3.083 1.00 40.54 C ATOM 3027 CG LEU A 575 30.978 24.426 -1.670 1.00 40.30 C ATOM 3028 CD1 LEU A 575 29.472 24.650 -1.581 1.00 40.13 C ATOM 3029 CD2 LEU A 575 31.340 23.019 -1.215 1.00 40.02 C ATOM 0 H LEU A 575 33.403 26.218 -2.423 1.00 42.43 H new ATOM 0 HA LEU A 575 33.219 23.609 -3.037 1.00 40.86 H new ATOM 0 HB2 LEU A 575 31.275 25.620 -3.312 1.00 40.54 H new ATOM 0 HB3 LEU A 575 31.021 24.131 -3.700 1.00 40.54 H new ATOM 0 HG LEU A 575 31.410 25.056 -1.072 1.00 40.30 H new ATOM 0 HD11 LEU A 575 29.170 24.466 -0.678 1.00 40.13 H new ATOM 0 HD12 LEU A 575 29.268 25.570 -1.809 1.00 40.13 H new ATOM 0 HD13 LEU A 575 29.019 24.056 -2.200 1.00 40.13 H new ATOM 0 HD21 LEU A 575 30.997 22.870 -0.320 1.00 40.02 H new ATOM 0 HD22 LEU A 575 30.949 22.372 -1.822 1.00 40.02 H new ATOM 0 HD23 LEU A 575 32.305 22.918 -1.213 1.00 40.02 H new ATOM 3030 N HIS A 576 34.250 23.864 -5.293 1.00 38.77 N ATOM 3031 CA HIS A 576 34.696 23.960 -6.673 1.00 37.60 C ATOM 3032 C HIS A 576 33.820 23.123 -7.589 1.00 36.88 C ATOM 3033 O HIS A 576 33.489 21.984 -7.266 1.00 37.21 O ATOM 3034 CB HIS A 576 36.154 23.510 -6.792 1.00 37.38 C ATOM 3035 CG HIS A 576 36.681 23.535 -8.192 1.00 37.04 C ATOM 3036 ND1 HIS A 576 37.036 24.704 -8.830 1.00 37.12 N ATOM 3037 CD2 HIS A 576 36.913 22.537 -9.077 1.00 36.96 C ATOM 3038 CE1 HIS A 576 37.466 24.425 -10.047 1.00 37.00 C ATOM 3039 NE2 HIS A 576 37.400 23.118 -10.223 1.00 37.02 N ATOM 0 H HIS A 576 34.619 23.231 -4.843 1.00 38.77 H new ATOM 0 HA HIS A 576 34.626 24.888 -6.947 1.00 37.60 H new ATOM 0 HB2 HIS A 576 36.707 24.082 -6.237 1.00 37.38 H new ATOM 0 HB3 HIS A 576 36.236 22.610 -6.441 1.00 37.38 H new ATOM 0 HD2 HIS A 576 36.770 21.629 -8.936 1.00 36.96 H new ATOM 0 HE1 HIS A 576 37.765 25.044 -10.674 1.00 37.00 H new ATOM 0 HE2 HIS A 576 37.625 22.698 -10.939 1.00 37.02 H new ATOM 3040 N ARG A 577 33.443 23.696 -8.728 1.00 36.04 N ATOM 3041 CA ARG A 577 32.699 22.967 -9.751 1.00 35.32 C ATOM 3042 C ARG A 577 33.514 21.809 -10.329 1.00 34.98 C ATOM 3043 O ARG A 577 33.641 20.752 -9.706 1.00 35.04 O ATOM 3044 CB ARG A 577 32.261 23.913 -10.873 1.00 35.09 C ATOM 3045 CG ARG A 577 30.798 24.313 -10.812 1.00 34.57 C ATOM 3046 CD ARG A 577 29.942 23.386 -11.665 1.00 34.19 C ATOM 3047 NE ARG A 577 28.625 23.129 -11.082 1.00 34.13 N ATOM 3048 CZ ARG A 577 28.066 23.847 -10.111 1.00 33.98 C ATOM 3049 NH1 ARG A 577 28.694 24.902 -9.604 1.00 34.11 N ATOM 3050 NH2 ARG A 577 26.869 23.514 -9.648 1.00 33.59 N ATOM 0 H ARG A 577 33.610 24.515 -8.929 1.00 36.04 H new ATOM 0 HA ARG A 577 31.912 22.593 -9.325 1.00 35.32 H new ATOM 0 HB2 ARG A 577 32.807 24.714 -10.839 1.00 35.09 H new ATOM 0 HB3 ARG A 577 32.435 23.488 -11.727 1.00 35.09 H new ATOM 0 HG2 ARG A 577 30.490 24.288 -9.892 1.00 34.57 H new ATOM 0 HG3 ARG A 577 30.696 25.227 -11.120 1.00 34.57 H new ATOM 0 HD2 ARG A 577 29.830 23.776 -12.546 1.00 34.19 H new ATOM 0 HD3 ARG A 577 30.407 22.543 -11.785 1.00 34.19 H new ATOM 0 HE ARG A 577 28.178 22.463 -11.391 1.00 34.13 H new ATOM 0 HH11 ARG A 577 29.469 25.126 -9.903 1.00 34.11 H new ATOM 0 HH12 ARG A 577 28.326 25.361 -8.977 1.00 34.11 H new ATOM 0 HH21 ARG A 577 26.455 22.835 -9.975 1.00 33.59 H new ATOM 0 HH22 ARG A 577 26.507 23.977 -9.020 1.00 33.59 H new ATOM 3051 N GLY A 578 34.067 22.016 -11.520 1.00 34.32 N ATOM 3052 CA GLY A 578 34.815 20.970 -12.203 1.00 33.82 C ATOM 3053 C GLY A 578 34.393 20.865 -13.654 1.00 33.53 C ATOM 3054 O GLY A 578 35.232 20.894 -14.555 1.00 33.58 O ATOM 0 H GLY A 578 34.019 22.759 -11.950 1.00 34.32 H new ATOM 0 HA2 GLY A 578 35.765 21.160 -12.151 1.00 33.82 H new ATOM 0 HA3 GLY A 578 34.671 20.120 -11.758 1.00 33.82 H new ATOM 3055 N ALA A 579 33.088 20.738 -13.879 1.00 33.13 N ATOM 3056 CA ALA A 579 32.542 20.765 -15.229 1.00 32.84 C ATOM 3057 C ALA A 579 32.778 22.149 -15.817 1.00 32.65 C ATOM 3058 O ALA A 579 33.529 22.301 -16.782 1.00 32.70 O ATOM 3059 CB ALA A 579 31.060 20.431 -15.219 1.00 32.81 C ATOM 0 H ALA A 579 32.501 20.635 -13.259 1.00 33.13 H new ATOM 0 HA ALA A 579 32.986 20.097 -15.774 1.00 32.84 H new ATOM 0 HB1 ALA A 579 30.717 20.454 -16.126 1.00 32.81 H new ATOM 0 HB2 ALA A 579 30.930 19.544 -14.847 1.00 32.81 H new ATOM 0 HB3 ALA A 579 30.585 21.081 -14.677 1.00 32.81 H new ATOM 3060 N THR A 580 32.142 23.157 -15.225 1.00 32.42 N ATOM 3061 CA THR A 580 32.434 24.537 -15.578 1.00 32.21 C ATOM 3062 C THR A 580 33.740 24.924 -14.889 1.00 32.27 C ATOM 3063 O THR A 580 34.732 24.198 -14.980 1.00 32.34 O ATOM 3064 CB THR A 580 31.309 25.490 -15.138 1.00 32.08 C ATOM 3065 OG1 THR A 580 31.269 25.555 -13.708 1.00 31.88 O ATOM 3066 CG2 THR A 580 29.960 25.011 -15.664 1.00 32.06 C ATOM 0 H THR A 580 31.540 23.061 -14.618 1.00 32.42 H new ATOM 0 HA THR A 580 32.509 24.612 -16.542 1.00 32.21 H new ATOM 0 HB THR A 580 31.489 26.371 -15.503 1.00 32.08 H new ATOM 0 HG1 THR A 580 31.124 26.347 -13.467 1.00 31.88 H new ATOM 0 HG21 THR A 580 29.265 25.623 -15.377 1.00 32.06 H new ATOM 0 HG22 THR A 580 29.983 24.980 -16.633 1.00 32.06 H new ATOM 0 HG23 THR A 580 29.773 24.125 -15.317 1.00 32.06 H new ATOM 3067 N GLY A 581 33.742 26.057 -14.192 1.00 32.35 N ATOM 3068 CA GLY A 581 34.927 26.483 -13.454 1.00 32.26 C ATOM 3069 C GLY A 581 34.607 27.355 -12.258 1.00 32.27 C ATOM 3070 O GLY A 581 35.506 27.942 -11.652 1.00 32.04 O ATOM 0 H GLY A 581 33.071 26.591 -14.134 1.00 32.35 H new ATOM 0 HA2 GLY A 581 35.413 25.699 -13.154 1.00 32.26 H new ATOM 0 HA3 GLY A 581 35.516 26.969 -14.052 1.00 32.26 H new ATOM 3071 N ASP A 582 33.323 27.436 -11.914 1.00 32.41 N ATOM 3072 CA ASP A 582 32.870 28.283 -10.815 1.00 32.74 C ATOM 3073 C ASP A 582 33.421 27.802 -9.478 1.00 33.23 C ATOM 3074 O ASP A 582 33.757 26.627 -9.318 1.00 33.18 O ATOM 3075 CB ASP A 582 31.343 28.326 -10.744 1.00 32.54 C ATOM 3076 CG ASP A 582 30.696 28.336 -12.110 1.00 32.49 C ATOM 3077 OD1 ASP A 582 30.895 27.365 -12.868 1.00 32.31 O ATOM 3078 OD2 ASP A 582 29.972 29.305 -12.419 1.00 32.48 O ATOM 0 H ASP A 582 32.694 27.003 -12.309 1.00 32.41 H new ATOM 0 HA ASP A 582 33.206 29.176 -10.991 1.00 32.74 H new ATOM 0 HB2 ASP A 582 31.024 27.558 -10.245 1.00 32.54 H new ATOM 0 HB3 ASP A 582 31.068 29.117 -10.254 1.00 32.54 H new ATOM 3079 N SER A 583 33.503 28.720 -8.521 1.00 33.74 N ATOM 3080 CA SER A 583 34.004 28.406 -7.193 1.00 34.34 C ATOM 3081 C SER A 583 33.416 29.375 -6.171 1.00 34.94 C ATOM 3082 O SER A 583 33.190 30.547 -6.476 1.00 35.15 O ATOM 3083 CB SER A 583 35.530 28.468 -7.173 1.00 34.07 C ATOM 3084 OG SER A 583 36.040 27.892 -5.986 1.00 34.12 O ATOM 0 H SER A 583 33.269 29.541 -8.625 1.00 33.74 H new ATOM 0 HA SER A 583 33.732 27.505 -6.960 1.00 34.34 H new ATOM 0 HB2 SER A 583 35.887 28.000 -7.944 1.00 34.07 H new ATOM 0 HB3 SER A 583 35.821 29.391 -7.241 1.00 34.07 H new ATOM 0 HG SER A 583 36.757 27.488 -6.156 1.00 34.12 H new ATOM 3085 N HIS A 584 33.172 28.880 -4.961 1.00 35.60 N ATOM 3086 CA HIS A 584 32.469 29.659 -3.942 1.00 36.26 C ATOM 3087 C HIS A 584 33.193 29.629 -2.597 1.00 37.18 C ATOM 3088 O HIS A 584 33.293 28.583 -1.959 1.00 37.40 O ATOM 3089 CB HIS A 584 31.034 29.145 -3.796 1.00 35.67 C ATOM 3090 CG HIS A 584 30.336 28.946 -5.105 1.00 34.97 C ATOM 3091 ND1 HIS A 584 29.499 29.893 -5.654 1.00 34.79 N ATOM 3092 CD2 HIS A 584 30.375 27.921 -5.989 1.00 34.62 C ATOM 3093 CE1 HIS A 584 29.045 29.456 -6.815 1.00 34.64 C ATOM 3094 NE2 HIS A 584 29.562 28.262 -7.042 1.00 34.58 N ATOM 0 H HIS A 584 33.406 28.092 -4.708 1.00 35.60 H new ATOM 0 HA HIS A 584 32.451 30.584 -4.233 1.00 36.26 H new ATOM 0 HB2 HIS A 584 31.047 28.304 -3.313 1.00 35.67 H new ATOM 0 HB3 HIS A 584 30.526 29.773 -3.259 1.00 35.67 H new ATOM 0 HD2 HIS A 584 30.861 27.133 -5.900 1.00 34.62 H new ATOM 0 HE1 HIS A 584 28.461 29.912 -7.377 1.00 34.64 H new ATOM 0 HE2 HIS A 584 29.414 27.777 -7.736 1.00 34.58 H new ATOM 3095 N LEU A 585 33.695 30.785 -2.173 1.00 38.25 N ATOM 3096 CA LEU A 585 34.442 30.876 -0.921 1.00 39.34 C ATOM 3097 C LEU A 585 33.509 30.869 0.290 1.00 39.91 C ATOM 3098 O LEU A 585 32.509 31.586 0.322 1.00 39.94 O ATOM 3099 CB LEU A 585 35.342 32.117 -0.915 1.00 39.23 C ATOM 3100 CG LEU A 585 36.404 32.239 0.183 1.00 39.43 C ATOM 3101 CD1 LEU A 585 37.295 31.007 0.237 1.00 39.55 C ATOM 3102 CD2 LEU A 585 37.244 33.495 -0.021 1.00 39.28 C ATOM 0 H LEU A 585 33.614 31.530 -2.596 1.00 38.25 H new ATOM 0 HA LEU A 585 35.007 30.091 -0.856 1.00 39.34 H new ATOM 0 HB2 LEU A 585 35.796 32.157 -1.771 1.00 39.23 H new ATOM 0 HB3 LEU A 585 34.769 32.898 -0.860 1.00 39.23 H new ATOM 0 HG LEU A 585 35.941 32.307 1.033 1.00 39.43 H new ATOM 0 HD11 LEU A 585 37.955 31.115 0.940 1.00 39.55 H new ATOM 0 HD12 LEU A 585 36.753 30.223 0.420 1.00 39.55 H new ATOM 0 HD13 LEU A 585 37.746 30.896 -0.615 1.00 39.55 H new ATOM 0 HD21 LEU A 585 37.910 33.557 0.681 1.00 39.28 H new ATOM 0 HD22 LEU A 585 37.687 33.452 -0.883 1.00 39.28 H new ATOM 0 HD23 LEU A 585 36.670 34.277 0.009 1.00 39.28 H new ATOM 3103 N LEU A 586 33.847 30.040 1.276 1.00 40.70 N ATOM 3104 CA LEU A 586 33.069 29.903 2.505 1.00 41.02 C ATOM 3105 C LEU A 586 34.005 29.697 3.698 1.00 41.28 C ATOM 3106 O LEU A 586 35.116 29.188 3.534 1.00 41.50 O ATOM 3107 CB LEU A 586 32.114 28.712 2.396 1.00 41.12 C ATOM 3108 CG LEU A 586 31.195 28.609 1.177 1.00 41.01 C ATOM 3109 CD1 LEU A 586 31.020 27.158 0.800 1.00 41.05 C ATOM 3110 CD2 LEU A 586 29.846 29.282 1.415 1.00 40.89 C ATOM 0 H LEU A 586 34.543 29.536 1.249 1.00 40.70 H new ATOM 0 HA LEU A 586 32.554 30.714 2.637 1.00 41.02 H new ATOM 0 HB2 LEU A 586 32.649 27.903 2.429 1.00 41.12 H new ATOM 0 HB3 LEU A 586 31.553 28.713 3.187 1.00 41.12 H new ATOM 0 HG LEU A 586 31.613 29.083 0.441 1.00 41.01 H new ATOM 0 HD11 LEU A 586 30.437 27.092 0.027 1.00 41.05 H new ATOM 0 HD12 LEU A 586 31.884 26.772 0.587 1.00 41.05 H new ATOM 0 HD13 LEU A 586 30.626 26.676 1.543 1.00 41.05 H new ATOM 0 HD21 LEU A 586 29.296 29.194 0.621 1.00 40.89 H new ATOM 0 HD22 LEU A 586 29.400 28.858 2.165 1.00 40.89 H new ATOM 0 HD23 LEU A 586 29.983 30.222 1.610 1.00 40.89 H new ATOM 3111 N CYS A 587 33.562 30.093 4.892 1.00 41.36 N ATOM 3112 CA CYS A 587 34.360 29.909 6.109 1.00 40.99 C ATOM 3113 C CYS A 587 33.550 30.048 7.400 1.00 40.82 C ATOM 3114 O CYS A 587 32.480 30.657 7.412 1.00 40.70 O ATOM 3115 CB CYS A 587 35.554 30.871 6.133 1.00 41.24 C ATOM 3116 SG CYS A 587 35.134 32.603 6.394 1.00 41.28 S ATOM 0 H CYS A 587 32.800 30.471 5.020 1.00 41.36 H new ATOM 0 HA CYS A 587 34.680 28.994 6.077 1.00 40.99 H new ATOM 0 HB2 CYS A 587 36.163 30.591 6.834 1.00 41.24 H new ATOM 0 HB3 CYS A 587 36.033 30.792 5.293 1.00 41.24 H new ATOM 0 HG CYS A 587 36.137 33.262 6.397 1.00 41.28 H new ATOM 3117 N THR A 588 34.082 29.484 8.485 1.00 40.51 N ATOM 3118 CA THR A 588 33.415 29.487 9.787 1.00 40.14 C ATOM 3119 C THR A 588 34.175 30.313 10.828 1.00 40.05 C ATOM 3120 O THR A 588 35.268 30.815 10.562 1.00 39.66 O ATOM 3121 CB THR A 588 33.254 28.058 10.335 1.00 40.09 C ATOM 3122 OG1 THR A 588 34.531 27.408 10.355 1.00 40.17 O ATOM 3123 CG2 THR A 588 32.304 27.253 9.472 1.00 40.09 C ATOM 0 H THR A 588 34.845 29.087 8.486 1.00 40.51 H new ATOM 0 HA THR A 588 32.545 29.888 9.637 1.00 40.14 H new ATOM 0 HB THR A 588 32.891 28.113 11.233 1.00 40.09 H new ATOM 0 HG1 THR A 588 34.471 26.685 10.778 1.00 40.17 H new ATOM 0 HG21 THR A 588 32.217 26.357 9.835 1.00 40.09 H new ATOM 0 HG22 THR A 588 31.434 27.682 9.460 1.00 40.09 H new ATOM 0 HG23 THR A 588 32.651 27.203 8.568 1.00 40.09 H new ATOM 3124 N ARG A 589 33.588 30.435 12.015 1.00 40.02 N ATOM 3125 CA ARG A 589 34.178 31.202 13.109 1.00 40.24 C ATOM 3126 C ARG A 589 35.264 30.421 13.859 1.00 40.48 C ATOM 3127 O ARG A 589 36.326 30.966 14.158 1.00 40.60 O ATOM 3128 CB ARG A 589 33.080 31.683 14.069 1.00 40.03 C ATOM 3129 CG ARG A 589 33.559 32.116 15.452 1.00 39.84 C ATOM 3130 CD ARG A 589 34.399 33.388 15.415 1.00 39.67 C ATOM 3131 NE ARG A 589 34.700 33.873 16.761 1.00 39.47 N ATOM 3132 CZ ARG A 589 35.711 33.441 17.510 1.00 39.37 C ATOM 3133 NH1 ARG A 589 36.534 32.509 17.051 1.00 39.31 N ATOM 3134 NH2 ARG A 589 35.899 33.942 18.723 1.00 39.39 N ATOM 0 H ARG A 589 32.832 30.073 12.210 1.00 40.02 H new ATOM 0 HA ARG A 589 34.617 31.974 12.718 1.00 40.24 H new ATOM 0 HB2 ARG A 589 32.616 32.428 13.657 1.00 40.03 H new ATOM 0 HB3 ARG A 589 32.432 30.970 14.177 1.00 40.03 H new ATOM 0 HG2 ARG A 589 32.790 32.258 16.026 1.00 39.84 H new ATOM 0 HG3 ARG A 589 34.081 31.400 15.848 1.00 39.84 H new ATOM 0 HD2 ARG A 589 35.227 33.216 14.939 1.00 39.67 H new ATOM 0 HD3 ARG A 589 33.925 34.075 14.921 1.00 39.67 H new ATOM 0 HE ARG A 589 34.188 34.480 17.092 1.00 39.47 H new ATOM 0 HH11 ARG A 589 36.416 32.180 16.265 1.00 39.31 H new ATOM 0 HH12 ARG A 589 37.186 32.233 17.539 1.00 39.31 H new ATOM 0 HH21 ARG A 589 35.367 34.546 19.026 1.00 39.39 H new ATOM 0 HH22 ARG A 589 36.553 33.663 19.207 1.00 39.39 H new ATOM 3135 N LYS A 590 35.003 29.148 14.155 1.00 40.84 N ATOM 3136 CA LYS A 590 35.982 28.319 14.866 1.00 41.23 C ATOM 3137 C LYS A 590 36.233 26.954 14.206 1.00 41.62 C ATOM 3138 O LYS A 590 35.344 26.399 13.564 1.00 41.64 O ATOM 3139 CB LYS A 590 35.609 28.176 16.350 1.00 41.26 C ATOM 3140 CG LYS A 590 34.373 27.343 16.647 1.00 41.26 C ATOM 3141 CD LYS A 590 34.006 27.455 18.123 1.00 41.24 C ATOM 3142 CE LYS A 590 33.087 26.327 18.574 1.00 41.22 C ATOM 3143 NZ LYS A 590 31.789 26.306 17.836 1.00 41.16 N ATOM 0 H LYS A 590 34.270 28.746 13.955 1.00 40.84 H new ATOM 0 HA LYS A 590 36.828 28.790 14.808 1.00 41.23 H new ATOM 0 HB2 LYS A 590 36.362 27.784 16.819 1.00 41.26 H new ATOM 0 HB3 LYS A 590 35.476 29.063 16.719 1.00 41.26 H new ATOM 0 HG2 LYS A 590 33.632 27.645 16.099 1.00 41.26 H new ATOM 0 HG3 LYS A 590 34.537 26.415 16.417 1.00 41.26 H new ATOM 0 HD2 LYS A 590 34.815 27.444 18.658 1.00 41.24 H new ATOM 0 HD3 LYS A 590 33.572 28.307 18.283 1.00 41.24 H new ATOM 0 HE2 LYS A 590 33.539 25.478 18.449 1.00 41.22 H new ATOM 0 HE3 LYS A 590 32.913 26.418 19.524 1.00 41.22 H new ATOM 0 HZ1 LYS A 590 31.244 25.710 18.210 1.00 41.16 H new ATOM 0 HZ2 LYS A 590 31.414 27.112 17.871 1.00 41.16 H new ATOM 0 HZ3 LYS A 590 31.934 26.083 16.987 1.00 41.16 H new ATOM 3144 N PRO A 591 37.459 26.419 14.367 1.00 42.07 N ATOM 3145 CA PRO A 591 37.997 25.233 13.684 1.00 42.42 C ATOM 3146 C PRO A 591 37.130 23.974 13.736 1.00 42.74 C ATOM 3147 O PRO A 591 37.013 23.273 12.729 1.00 43.01 O ATOM 3148 CB PRO A 591 39.327 24.992 14.404 1.00 42.18 C ATOM 3149 CG PRO A 591 39.731 26.333 14.879 1.00 42.12 C ATOM 3150 CD PRO A 591 38.454 27.007 15.284 1.00 42.10 C ATOM 0 HA PRO A 591 38.060 25.404 12.731 1.00 42.42 H new ATOM 0 HB2 PRO A 591 39.223 24.371 15.142 1.00 42.18 H new ATOM 0 HB3 PRO A 591 39.990 24.613 13.806 1.00 42.18 H new ATOM 0 HG2 PRO A 591 40.346 26.270 15.626 1.00 42.12 H new ATOM 0 HG3 PRO A 591 40.184 26.831 14.180 1.00 42.12 H new ATOM 0 HD2 PRO A 591 38.234 26.831 16.212 1.00 42.10 H new ATOM 0 HD3 PRO A 591 38.509 27.970 15.183 1.00 42.10 H new ATOM 3151 N GLU A 592 36.538 23.675 14.886 1.00 43.01 N ATOM 3152 CA GLU A 592 35.658 22.513 14.974 1.00 43.40 C ATOM 3153 C GLU A 592 34.508 22.624 13.973 1.00 43.78 C ATOM 3154 O GLU A 592 34.000 21.614 13.485 1.00 43.78 O ATOM 3155 CB GLU A 592 35.137 22.295 16.402 1.00 43.45 C ATOM 3156 CG GLU A 592 34.764 23.558 17.174 1.00 43.43 C ATOM 3157 CD GLU A 592 35.942 24.163 17.917 1.00 43.36 C ATOM 3158 OE1 GLU A 592 36.932 24.540 17.255 1.00 43.13 O ATOM 3159 OE2 GLU A 592 35.876 24.266 19.164 1.00 43.53 O ATOM 0 H GLU A 592 36.629 24.122 15.615 1.00 43.01 H new ATOM 0 HA GLU A 592 36.184 21.731 14.743 1.00 43.40 H new ATOM 0 HB2 GLU A 592 34.357 21.720 16.359 1.00 43.45 H new ATOM 0 HB3 GLU A 592 35.814 21.817 16.906 1.00 43.45 H new ATOM 0 HG2 GLU A 592 34.404 24.215 16.557 1.00 43.43 H new ATOM 0 HG3 GLU A 592 34.060 23.349 17.808 1.00 43.43 H new ATOM 3160 N GLN A 593 34.121 23.856 13.654 1.00 44.05 N ATOM 3161 CA GLN A 593 33.035 24.101 12.709 1.00 44.49 C ATOM 3162 C GLN A 593 33.398 23.731 11.271 1.00 44.80 C ATOM 3163 O GLN A 593 32.585 23.145 10.557 1.00 45.09 O ATOM 3164 CB GLN A 593 32.559 25.553 12.796 1.00 44.42 C ATOM 3165 CG GLN A 593 31.606 25.800 13.953 1.00 44.51 C ATOM 3166 CD GLN A 593 31.497 27.263 14.333 1.00 44.71 C ATOM 3167 OE1 GLN A 593 32.182 28.122 13.773 1.00 44.55 O ATOM 3168 NE2 GLN A 593 30.634 27.555 15.300 1.00 44.71 N ATOM 0 H GLN A 593 34.478 24.569 13.977 1.00 44.05 H new ATOM 0 HA GLN A 593 32.306 23.515 12.966 1.00 44.49 H new ATOM 0 HB2 GLN A 593 33.329 26.135 12.889 1.00 44.42 H new ATOM 0 HB3 GLN A 593 32.120 25.794 11.965 1.00 44.42 H new ATOM 0 HG2 GLN A 593 30.726 25.467 13.717 1.00 44.51 H new ATOM 0 HG3 GLN A 593 31.904 25.293 14.724 1.00 44.51 H new ATOM 0 HE21 GLN A 593 30.173 26.929 15.668 1.00 44.71 H new ATOM 0 HE22 GLN A 593 30.537 28.370 15.558 1.00 44.71 H new ATOM 3169 N LYS A 594 34.612 24.072 10.847 1.00 45.10 N ATOM 3170 CA LYS A 594 35.063 23.726 9.502 1.00 45.32 C ATOM 3171 C LYS A 594 35.115 22.211 9.309 1.00 45.52 C ATOM 3172 O LYS A 594 34.721 21.696 8.261 1.00 45.18 O ATOM 3173 CB LYS A 594 36.434 24.334 9.200 1.00 45.07 C ATOM 3174 CG LYS A 594 36.970 23.921 7.839 1.00 45.04 C ATOM 3175 CD LYS A 594 38.386 24.391 7.598 1.00 45.00 C ATOM 3176 CE LYS A 594 38.906 23.812 6.296 1.00 44.99 C ATOM 3177 NZ LYS A 594 40.181 24.443 5.868 1.00 45.28 N ATOM 0 H LYS A 594 35.187 24.502 11.320 1.00 45.10 H new ATOM 0 HA LYS A 594 34.417 24.097 8.881 1.00 45.32 H new ATOM 0 HB2 LYS A 594 36.371 25.301 9.239 1.00 45.07 H new ATOM 0 HB3 LYS A 594 37.063 24.063 9.887 1.00 45.07 H new ATOM 0 HG2 LYS A 594 36.937 22.955 7.763 1.00 45.04 H new ATOM 0 HG3 LYS A 594 36.393 24.279 7.147 1.00 45.04 H new ATOM 0 HD2 LYS A 594 38.412 25.360 7.564 1.00 45.00 H new ATOM 0 HD3 LYS A 594 38.956 24.117 8.334 1.00 45.00 H new ATOM 0 HE2 LYS A 594 39.039 22.857 6.400 1.00 44.99 H new ATOM 0 HE3 LYS A 594 38.239 23.932 5.602 1.00 44.99 H new ATOM 0 HZ1 LYS A 594 40.665 23.854 5.409 1.00 45.28 H new ATOM 0 HZ2 LYS A 594 40.006 25.148 5.353 1.00 45.28 H new ATOM 0 HZ3 LYS A 594 40.638 24.706 6.585 1.00 45.28 H new ATOM 3178 N GLN A 595 35.599 21.507 10.330 1.00 45.71 N ATOM 3179 CA GLN A 595 35.719 20.052 10.281 1.00 45.97 C ATOM 3180 C GLN A 595 34.360 19.366 10.173 1.00 45.96 C ATOM 3181 O GLN A 595 34.220 18.359 9.477 1.00 45.81 O ATOM 3182 CB GLN A 595 36.478 19.528 11.504 1.00 45.96 C ATOM 3183 CG GLN A 595 37.953 19.903 11.528 1.00 46.28 C ATOM 3184 CD GLN A 595 38.694 19.443 10.282 1.00 46.30 C ATOM 3185 OE1 GLN A 595 38.157 18.692 9.467 1.00 46.38 O ATOM 3186 NE2 GLN A 595 39.932 19.895 10.131 1.00 46.33 N ATOM 0 H GLN A 595 35.866 21.858 11.068 1.00 45.71 H new ATOM 0 HA GLN A 595 36.221 19.837 9.480 1.00 45.97 H new ATOM 0 HB2 GLN A 595 36.054 19.870 12.307 1.00 45.96 H new ATOM 0 HB3 GLN A 595 36.399 18.562 11.532 1.00 45.96 H new ATOM 0 HG2 GLN A 595 38.037 20.866 11.613 1.00 46.28 H new ATOM 0 HG3 GLN A 595 38.370 19.511 12.311 1.00 46.28 H new ATOM 0 HE21 GLN A 595 40.274 20.418 10.722 1.00 46.33 H new ATOM 0 HE22 GLN A 595 40.393 19.665 9.442 1.00 46.33 H new ATOM 3187 N ARG A 596 33.369 19.915 10.870 1.00 46.04 N ATOM 3188 CA ARG A 596 32.009 19.386 10.827 1.00 46.18 C ATOM 3189 C ARG A 596 31.340 19.653 9.476 1.00 46.22 C ATOM 3190 O ARG A 596 30.524 18.851 9.009 1.00 46.04 O ATOM 3191 CB ARG A 596 31.173 19.970 11.966 1.00 46.25 C ATOM 3192 CG ARG A 596 31.591 19.476 13.346 1.00 46.64 C ATOM 3193 CD ARG A 596 31.198 20.470 14.425 1.00 46.75 C ATOM 3194 NE ARG A 596 31.770 20.130 15.724 1.00 47.14 N ATOM 3195 CZ ARG A 596 31.910 20.995 16.724 1.00 47.29 C ATOM 3196 NH1 ARG A 596 31.530 22.259 16.567 1.00 47.29 N ATOM 3197 NH2 ARG A 596 32.438 20.603 17.877 1.00 47.12 N ATOM 0 H ARG A 596 33.465 20.602 11.379 1.00 46.04 H new ATOM 0 HA ARG A 596 32.064 18.424 10.940 1.00 46.18 H new ATOM 0 HB2 ARG A 596 31.240 20.937 11.943 1.00 46.25 H new ATOM 0 HB3 ARG A 596 30.240 19.747 11.820 1.00 46.25 H new ATOM 0 HG2 ARG A 596 31.175 18.618 13.525 1.00 46.64 H new ATOM 0 HG3 ARG A 596 32.551 19.336 13.366 1.00 46.64 H new ATOM 0 HD2 ARG A 596 31.491 21.358 14.167 1.00 46.75 H new ATOM 0 HD3 ARG A 596 30.231 20.501 14.497 1.00 46.75 H new ATOM 0 HE ARG A 596 32.032 19.321 15.850 1.00 47.14 H new ATOM 0 HH11 ARG A 596 31.194 22.517 15.819 1.00 47.29 H new ATOM 0 HH12 ARG A 596 31.620 22.819 17.214 1.00 47.29 H new ATOM 0 HH21 ARG A 596 32.691 19.787 17.979 1.00 47.12 H new ATOM 0 HH22 ARG A 596 32.527 21.165 18.522 1.00 47.12 H new ATOM 3198 N TRP A 597 31.683 20.775 8.849 1.00 46.17 N ATOM 3199 CA TRP A 597 31.181 21.050 7.507 1.00 46.41 C ATOM 3200 C TRP A 597 31.829 20.112 6.501 1.00 46.65 C ATOM 3201 O TRP A 597 31.143 19.526 5.667 1.00 46.79 O ATOM 3202 CB TRP A 597 31.366 22.518 7.112 1.00 46.10 C ATOM 3203 CG TRP A 597 30.173 23.349 7.481 1.00 46.14 C ATOM 3204 CD1 TRP A 597 30.059 24.200 8.543 1.00 46.07 C ATOM 3205 CD2 TRP A 597 28.910 23.380 6.805 1.00 46.11 C ATOM 3206 NE1 TRP A 597 28.805 24.765 8.565 1.00 46.03 N ATOM 3207 CE2 TRP A 597 28.081 24.279 7.509 1.00 46.17 C ATOM 3208 CE3 TRP A 597 28.398 22.737 5.672 1.00 45.97 C ATOM 3209 CZ2 TRP A 597 26.769 24.554 7.113 1.00 46.02 C ATOM 3210 CZ3 TRP A 597 27.100 23.011 5.284 1.00 45.97 C ATOM 3211 CH2 TRP A 597 26.300 23.911 6.002 1.00 45.96 C ATOM 0 H TRP A 597 32.197 21.381 9.177 1.00 46.17 H new ATOM 0 HA TRP A 597 30.225 20.886 7.507 1.00 46.41 H new ATOM 0 HB2 TRP A 597 32.156 22.874 7.549 1.00 46.10 H new ATOM 0 HB3 TRP A 597 31.519 22.579 6.156 1.00 46.10 H new ATOM 0 HD1 TRP A 597 30.732 24.373 9.162 1.00 46.07 H new ATOM 0 HE1 TRP A 597 28.522 25.331 9.147 1.00 46.03 H new ATOM 0 HE3 TRP A 597 28.921 22.137 5.190 1.00 45.97 H new ATOM 0 HZ2 TRP A 597 26.236 25.151 7.587 1.00 46.02 H new ATOM 0 HZ3 TRP A 597 26.750 22.590 4.532 1.00 45.97 H new ATOM 0 HH2 TRP A 597 25.430 24.074 5.716 1.00 45.96 H new ATOM 3212 N LEU A 598 33.144 19.950 6.599 1.00 46.65 N ATOM 3213 CA LEU A 598 33.847 19.011 5.735 1.00 47.07 C ATOM 3214 C LEU A 598 33.297 17.595 5.902 1.00 47.61 C ATOM 3215 O LEU A 598 33.159 16.860 4.925 1.00 47.89 O ATOM 3216 CB LEU A 598 35.355 19.051 5.985 1.00 46.69 C ATOM 3217 CG LEU A 598 36.052 20.387 5.701 1.00 46.56 C ATOM 3218 CD1 LEU A 598 37.564 20.222 5.748 1.00 46.30 C ATOM 3219 CD2 LEU A 598 35.615 20.969 4.368 1.00 46.20 C ATOM 0 H LEU A 598 33.645 20.372 7.156 1.00 46.65 H new ATOM 0 HA LEU A 598 33.694 19.282 4.816 1.00 47.07 H new ATOM 0 HB2 LEU A 598 35.517 18.813 6.911 1.00 46.69 H new ATOM 0 HB3 LEU A 598 35.773 18.367 5.439 1.00 46.69 H new ATOM 0 HG LEU A 598 35.789 21.012 6.394 1.00 46.56 H new ATOM 0 HD11 LEU A 598 37.989 21.075 5.566 1.00 46.30 H new ATOM 0 HD12 LEU A 598 37.829 19.910 6.628 1.00 46.30 H new ATOM 0 HD13 LEU A 598 37.840 19.575 5.080 1.00 46.30 H new ATOM 0 HD21 LEU A 598 36.072 21.811 4.217 1.00 46.20 H new ATOM 0 HD22 LEU A 598 35.837 20.349 3.656 1.00 46.20 H new ATOM 0 HD23 LEU A 598 34.657 21.119 4.379 1.00 46.20 H new ATOM 3220 N LYS A 599 32.976 17.216 7.136 1.00 48.04 N ATOM 3221 CA LYS A 599 32.285 15.951 7.382 1.00 48.62 C ATOM 3222 C LYS A 599 30.908 15.913 6.707 1.00 48.96 C ATOM 3223 O LYS A 599 30.555 14.926 6.058 1.00 49.16 O ATOM 3224 CB LYS A 599 32.144 15.685 8.886 1.00 48.70 C ATOM 3225 CG LYS A 599 33.267 14.844 9.483 1.00 48.67 C ATOM 3226 CD LYS A 599 32.942 14.415 10.909 1.00 48.64 C ATOM 3227 CE LYS A 599 33.377 15.461 11.926 1.00 48.66 C ATOM 3228 NZ LYS A 599 34.841 15.383 12.207 1.00 48.71 N ATOM 0 H LYS A 599 33.148 17.674 7.843 1.00 48.04 H new ATOM 0 HA LYS A 599 32.829 15.250 6.990 1.00 48.62 H new ATOM 0 HB2 LYS A 599 32.108 16.535 9.352 1.00 48.70 H new ATOM 0 HB3 LYS A 599 31.299 15.237 9.047 1.00 48.70 H new ATOM 0 HG2 LYS A 599 33.413 14.059 8.933 1.00 48.67 H new ATOM 0 HG3 LYS A 599 34.093 15.353 9.477 1.00 48.67 H new ATOM 0 HD2 LYS A 599 31.988 14.261 10.991 1.00 48.64 H new ATOM 0 HD3 LYS A 599 33.383 13.573 11.102 1.00 48.64 H new ATOM 0 HE2 LYS A 599 33.158 16.346 11.594 1.00 48.66 H new ATOM 0 HE3 LYS A 599 32.882 15.336 12.751 1.00 48.66 H new ATOM 0 HZ1 LYS A 599 35.063 16.005 12.803 1.00 48.71 H new ATOM 0 HZ2 LYS A 599 35.039 14.578 12.531 1.00 48.71 H new ATOM 0 HZ3 LYS A 599 35.296 15.519 11.454 1.00 48.71 H new ATOM 3229 N ALA A 600 30.140 16.990 6.858 1.00 49.14 N ATOM 3230 CA ALA A 600 28.792 17.071 6.294 1.00 49.63 C ATOM 3231 C ALA A 600 28.771 16.965 4.767 1.00 50.12 C ATOM 3232 O ALA A 600 27.916 16.275 4.200 1.00 50.74 O ATOM 3233 CB ALA A 600 28.102 18.349 6.746 1.00 49.35 C ATOM 0 H ALA A 600 30.384 17.693 7.289 1.00 49.14 H new ATOM 0 HA ALA A 600 28.305 16.303 6.632 1.00 49.63 H new ATOM 0 HB1 ALA A 600 27.211 18.388 6.365 1.00 49.35 H new ATOM 0 HB2 ALA A 600 28.040 18.358 7.714 1.00 49.35 H new ATOM 0 HB3 ALA A 600 28.615 19.117 6.448 1.00 49.35 H new ATOM 3234 N PHE A 601 29.697 17.656 4.106 1.00 50.24 N ATOM 3235 CA PHE A 601 29.807 17.589 2.650 1.00 50.32 C ATOM 3236 C PHE A 601 30.186 16.188 2.199 1.00 50.29 C ATOM 3237 O PHE A 601 29.699 15.706 1.176 1.00 50.24 O ATOM 3238 CB PHE A 601 30.831 18.595 2.122 1.00 50.82 C ATOM 3239 CG PHE A 601 30.345 20.017 2.126 1.00 51.17 C ATOM 3240 CD1 PHE A 601 31.006 20.988 2.863 1.00 51.50 C ATOM 3241 CD2 PHE A 601 29.227 20.383 1.394 1.00 51.36 C ATOM 3242 CE1 PHE A 601 30.558 22.294 2.871 1.00 51.55 C ATOM 3243 CE2 PHE A 601 28.774 21.689 1.398 1.00 51.48 C ATOM 3244 CZ PHE A 601 29.439 22.644 2.139 1.00 51.39 C ATOM 0 H PHE A 601 30.273 18.171 4.483 1.00 50.24 H new ATOM 0 HA PHE A 601 28.937 17.814 2.285 1.00 50.32 H new ATOM 0 HB2 PHE A 601 31.636 18.536 2.660 1.00 50.82 H new ATOM 0 HB3 PHE A 601 31.076 18.349 1.216 1.00 50.82 H new ATOM 0 HD1 PHE A 601 31.759 20.757 3.357 1.00 51.50 H new ATOM 0 HD2 PHE A 601 28.776 19.742 0.894 1.00 51.36 H new ATOM 0 HE1 PHE A 601 31.009 22.938 3.368 1.00 51.55 H new ATOM 0 HE2 PHE A 601 28.023 21.923 0.902 1.00 51.48 H new ATOM 0 HZ PHE A 601 29.135 23.523 2.146 1.00 51.39 H new ATOM 3245 N ALA A 602 31.056 15.535 2.965 1.00 50.27 N ATOM 3246 CA ALA A 602 31.448 14.161 2.669 1.00 50.22 C ATOM 3247 C ALA A 602 30.285 13.205 2.923 1.00 50.23 C ATOM 3248 O ALA A 602 30.199 12.141 2.312 1.00 49.99 O ATOM 3249 CB ALA A 602 32.663 13.755 3.492 1.00 50.08 C ATOM 0 H ALA A 602 31.431 15.871 3.662 1.00 50.27 H new ATOM 0 HA ALA A 602 31.688 14.111 1.730 1.00 50.22 H new ATOM 0 HB1 ALA A 602 32.906 12.840 3.280 1.00 50.08 H new ATOM 0 HB2 ALA A 602 33.406 14.343 3.284 1.00 50.08 H new ATOM 0 HB3 ALA A 602 32.452 13.823 4.436 1.00 50.08 H new ATOM 3250 N ARG A 603 29.389 13.593 3.825 1.00 50.40 N ATOM 3251 CA ARG A 603 28.248 12.753 4.153 1.00 50.74 C ATOM 3252 C ARG A 603 27.150 12.870 3.098 1.00 50.40 C ATOM 3253 O ARG A 603 26.393 11.925 2.890 1.00 50.72 O ATOM 3254 CB ARG A 603 27.703 13.080 5.552 1.00 51.02 C ATOM 3255 CG ARG A 603 27.078 11.882 6.270 1.00 51.37 C ATOM 3256 CD ARG A 603 26.670 12.204 7.715 1.00 51.47 C ATOM 3257 NE ARG A 603 27.806 12.584 8.558 1.00 52.03 N ATOM 3258 CZ ARG A 603 28.552 11.728 9.256 1.00 52.22 C ATOM 3259 NH1 ARG A 603 28.294 10.426 9.218 1.00 52.32 N ATOM 3260 NH2 ARG A 603 29.563 12.174 9.993 1.00 52.25 N ATOM 0 H ARG A 603 29.425 14.336 4.256 1.00 50.40 H new ATOM 0 HA ARG A 603 28.555 11.833 4.159 1.00 50.74 H new ATOM 0 HB2 ARG A 603 28.425 13.432 6.096 1.00 51.02 H new ATOM 0 HB3 ARG A 603 27.038 13.782 5.474 1.00 51.02 H new ATOM 0 HG2 ARG A 603 26.298 11.585 5.776 1.00 51.37 H new ATOM 0 HG3 ARG A 603 27.710 11.146 6.273 1.00 51.37 H new ATOM 0 HD2 ARG A 603 26.022 12.925 7.710 1.00 51.47 H new ATOM 0 HD3 ARG A 603 26.231 11.431 8.102 1.00 51.47 H new ATOM 0 HE ARG A 603 28.006 13.419 8.606 1.00 52.03 H new ATOM 0 HH11 ARG A 603 27.642 10.131 8.741 1.00 52.32 H new ATOM 0 HH12 ARG A 603 28.779 9.878 9.670 1.00 52.32 H new ATOM 0 HH21 ARG A 603 29.737 13.016 10.020 1.00 52.25 H new ATOM 0 HH22 ARG A 603 30.044 11.621 10.443 1.00 52.25 H new ATOM 3261 N GLU A 604 27.061 14.017 2.427 1.00 50.31 N ATOM 3262 CA GLU A 604 25.978 14.225 1.458 1.00 50.14 C ATOM 3263 C GLU A 604 26.280 13.570 0.113 1.00 49.99 C ATOM 3264 O GLU A 604 25.370 13.156 -0.600 1.00 49.86 O ATOM 3265 CB GLU A 604 25.599 15.711 1.311 1.00 49.91 C ATOM 3266 CG GLU A 604 26.348 16.500 0.255 1.00 49.98 C ATOM 3267 CD GLU A 604 25.721 16.406 -1.133 1.00 49.91 C ATOM 3268 OE1 GLU A 604 24.491 16.569 -1.263 1.00 50.18 O ATOM 3269 OE2 GLU A 604 26.469 16.181 -2.101 1.00 49.66 O ATOM 0 H GLU A 604 27.605 14.678 2.513 1.00 50.31 H new ATOM 0 HA GLU A 604 25.196 13.778 1.817 1.00 50.14 H new ATOM 0 HB2 GLU A 604 24.651 15.764 1.114 1.00 49.91 H new ATOM 0 HB3 GLU A 604 25.735 16.145 2.168 1.00 49.91 H new ATOM 0 HG2 GLU A 604 26.385 17.432 0.523 1.00 49.98 H new ATOM 0 HG3 GLU A 604 27.263 16.181 0.211 1.00 49.98 H new ATOM 3270 N ARG A 605 27.561 13.472 -0.224 1.00 49.97 N ATOM 3271 CA ARG A 605 27.967 12.809 -1.451 1.00 50.07 C ATOM 3272 C ARG A 605 27.769 11.302 -1.311 1.00 50.53 C ATOM 3273 O ARG A 605 27.406 10.623 -2.273 1.00 50.67 O ATOM 3274 CB ARG A 605 29.424 13.142 -1.788 1.00 49.52 C ATOM 3275 CG ARG A 605 29.662 14.590 -2.226 1.00 48.87 C ATOM 3276 CD ARG A 605 29.169 14.855 -3.655 1.00 48.21 C ATOM 3277 NE ARG A 605 27.750 15.212 -3.711 1.00 47.45 N ATOM 3278 CZ ARG A 605 27.005 15.182 -4.816 1.00 47.23 C ATOM 3279 NH1 ARG A 605 27.533 14.801 -5.975 1.00 46.75 N ATOM 3280 NH2 ARG A 605 25.725 15.527 -4.762 1.00 46.70 N ATOM 0 H ARG A 605 28.210 13.784 0.246 1.00 49.97 H new ATOM 0 HA ARG A 605 27.415 13.129 -2.181 1.00 50.07 H new ATOM 0 HB2 ARG A 605 29.974 12.957 -1.011 1.00 49.52 H new ATOM 0 HB3 ARG A 605 29.724 12.549 -2.495 1.00 49.52 H new ATOM 0 HG2 ARG A 605 29.208 15.190 -1.613 1.00 48.87 H new ATOM 0 HG3 ARG A 605 30.609 14.791 -2.170 1.00 48.87 H new ATOM 0 HD2 ARG A 605 29.694 15.571 -4.046 1.00 48.21 H new ATOM 0 HD3 ARG A 605 29.321 14.065 -4.196 1.00 48.21 H new ATOM 0 HE ARG A 605 27.371 15.458 -2.980 1.00 47.45 H new ATOM 0 HH11 ARG A 605 28.361 14.572 -6.016 1.00 46.75 H new ATOM 0 HH12 ARG A 605 27.047 14.784 -6.684 1.00 46.75 H new ATOM 0 HH21 ARG A 605 25.376 15.770 -4.014 1.00 46.70 H new ATOM 0 HH22 ARG A 605 25.244 15.508 -5.475 1.00 46.70 H new ATOM 3281 N GLU A 606 27.987 10.795 -0.101 1.00 51.18 N ATOM 3282 CA GLU A 606 27.842 9.368 0.190 1.00 51.80 C ATOM 3283 C GLU A 606 26.382 8.910 0.290 1.00 52.30 C ATOM 3284 O GLU A 606 26.084 7.736 0.066 1.00 52.16 O ATOM 3285 CB GLU A 606 28.615 9.001 1.461 1.00 51.78 C ATOM 3286 CG GLU A 606 30.127 9.094 1.299 1.00 52.01 C ATOM 3287 CD GLU A 606 30.880 8.896 2.603 1.00 52.03 C ATOM 3288 OE1 GLU A 606 30.425 9.418 3.645 1.00 52.18 O ATOM 3289 OE2 GLU A 606 31.934 8.223 2.583 1.00 52.21 O ATOM 0 H GLU A 606 28.224 11.268 0.577 1.00 51.18 H new ATOM 0 HA GLU A 606 28.221 8.893 -0.566 1.00 51.80 H new ATOM 0 HB2 GLU A 606 28.337 9.588 2.181 1.00 51.78 H new ATOM 0 HB3 GLU A 606 28.380 8.098 1.725 1.00 51.78 H new ATOM 0 HG2 GLU A 606 30.420 8.427 0.658 1.00 52.01 H new ATOM 0 HG3 GLU A 606 30.354 9.961 0.929 1.00 52.01 H new ATOM 3290 N GLN A 607 25.479 9.827 0.635 1.00 52.96 N ATOM 3291 CA GLN A 607 24.041 9.536 0.594 1.00 53.76 C ATOM 3292 C GLN A 607 23.548 9.566 -0.848 1.00 54.12 C ATOM 3293 O GLN A 607 22.724 8.748 -1.251 1.00 54.06 O ATOM 3294 CB GLN A 607 23.237 10.541 1.432 1.00 53.83 C ATOM 3295 CG GLN A 607 23.114 10.191 2.911 1.00 54.31 C ATOM 3296 CD GLN A 607 22.311 8.918 3.156 1.00 54.60 C ATOM 3297 OE1 GLN A 607 21.110 8.858 2.879 1.00 54.86 O ATOM 3298 NE2 GLN A 607 22.973 7.897 3.692 1.00 54.59 N ATOM 0 H GLN A 607 25.675 10.623 0.895 1.00 52.96 H new ATOM 0 HA GLN A 607 23.906 8.653 0.971 1.00 53.76 H new ATOM 0 HB2 GLN A 607 23.653 11.414 1.353 1.00 53.83 H new ATOM 0 HB3 GLN A 607 22.346 10.616 1.056 1.00 53.83 H new ATOM 0 HG2 GLN A 607 24.001 10.086 3.288 1.00 54.31 H new ATOM 0 HG3 GLN A 607 22.693 10.929 3.379 1.00 54.31 H new ATOM 0 HE21 GLN A 607 23.810 7.975 3.872 1.00 54.59 H new ATOM 0 HE22 GLN A 607 22.564 7.159 3.859 1.00 54.59 H new ATOM 3299 N VAL A 608 24.066 10.520 -1.614 1.00 54.71 N ATOM 3300 CA VAL A 608 23.680 10.717 -3.006 1.00 55.40 C ATOM 3301 C VAL A 608 24.115 9.566 -3.910 1.00 56.09 C ATOM 3302 O VAL A 608 23.425 9.241 -4.880 1.00 56.18 O ATOM 3303 CB VAL A 608 24.257 12.042 -3.561 1.00 55.28 C ATOM 3304 CG1 VAL A 608 24.311 12.017 -5.085 1.00 55.17 C ATOM 3305 CG2 VAL A 608 23.446 13.229 -3.060 1.00 55.12 C ATOM 0 H VAL A 608 24.659 11.078 -1.336 1.00 54.71 H new ATOM 0 HA VAL A 608 22.711 10.752 -3.010 1.00 55.40 H new ATOM 0 HB VAL A 608 25.166 12.139 -3.236 1.00 55.28 H new ATOM 0 HG11 VAL A 608 24.675 12.855 -5.410 1.00 55.17 H new ATOM 0 HG12 VAL A 608 24.876 11.285 -5.377 1.00 55.17 H new ATOM 0 HG13 VAL A 608 23.416 11.895 -5.439 1.00 55.17 H new ATOM 0 HG21 VAL A 608 23.820 14.050 -3.416 1.00 55.12 H new ATOM 0 HG22 VAL A 608 22.526 13.139 -3.353 1.00 55.12 H new ATOM 0 HG23 VAL A 608 23.475 13.255 -2.091 1.00 55.12 H new ATOM 3306 N GLN A 609 25.253 8.949 -3.594 1.00 56.78 N ATOM 3307 CA GLN A 609 25.795 7.890 -4.446 1.00 57.54 C ATOM 3308 C GLN A 609 24.787 6.755 -4.642 1.00 58.18 C ATOM 3309 O GLN A 609 24.299 6.538 -5.753 1.00 58.32 O ATOM 3310 CB GLN A 609 27.140 7.370 -3.922 1.00 57.40 C ATOM 3311 CG GLN A 609 27.048 6.303 -2.845 1.00 57.43 C ATOM 3312 CD GLN A 609 28.306 5.457 -2.761 1.00 57.54 C ATOM 3313 OE1 GLN A 609 29.412 5.944 -2.997 1.00 57.56 O ATOM 3314 NE2 GLN A 609 28.140 4.181 -2.426 1.00 57.55 N ATOM 0 H GLN A 609 25.724 9.127 -2.896 1.00 56.78 H new ATOM 0 HA GLN A 609 25.962 8.281 -5.318 1.00 57.54 H new ATOM 0 HB2 GLN A 609 27.645 7.012 -4.669 1.00 57.40 H new ATOM 0 HB3 GLN A 609 27.646 8.120 -3.571 1.00 57.40 H new ATOM 0 HG2 GLN A 609 26.888 6.726 -1.987 1.00 57.43 H new ATOM 0 HG3 GLN A 609 26.287 5.729 -3.025 1.00 57.43 H new ATOM 0 HE21 GLN A 609 27.351 3.877 -2.268 1.00 57.55 H new ATOM 0 HE22 GLN A 609 28.822 3.660 -2.367 1.00 57.55 H new ATOM 3315 N LEU A 610 24.470 6.040 -3.567 1.00 58.81 N ATOM 3316 CA LEU A 610 23.429 5.017 -3.615 1.00 59.36 C ATOM 3317 C LEU A 610 22.264 5.396 -2.706 1.00 59.71 C ATOM 3318 O LEU A 610 22.024 4.764 -1.677 1.00 59.81 O ATOM 3319 CB LEU A 610 23.985 3.631 -3.267 1.00 59.38 C ATOM 3320 CG LEU A 610 24.175 2.647 -4.432 1.00 59.43 C ATOM 3321 CD1 LEU A 610 24.724 3.327 -5.684 1.00 59.41 C ATOM 3322 CD2 LEU A 610 25.066 1.483 -4.019 1.00 59.35 C ATOM 0 H LEU A 610 24.846 6.131 -2.799 1.00 58.81 H new ATOM 0 HA LEU A 610 23.097 4.969 -4.525 1.00 59.36 H new ATOM 0 HB2 LEU A 610 24.842 3.751 -2.830 1.00 59.38 H new ATOM 0 HB3 LEU A 610 23.391 3.221 -2.619 1.00 59.38 H new ATOM 0 HG LEU A 610 23.296 2.303 -4.656 1.00 59.43 H new ATOM 0 HD11 LEU A 610 24.827 2.670 -6.390 1.00 59.41 H new ATOM 0 HD12 LEU A 610 24.108 4.018 -5.973 1.00 59.41 H new ATOM 0 HD13 LEU A 610 25.586 3.725 -5.485 1.00 59.41 H new ATOM 0 HD21 LEU A 610 25.173 0.875 -4.768 1.00 59.35 H new ATOM 0 HD22 LEU A 610 25.935 1.820 -3.750 1.00 59.35 H new ATOM 0 HD23 LEU A 610 24.659 1.011 -3.276 1.00 59.35 H new ATOM 3323 N ASP A 611 21.552 6.445 -3.108 1.00 60.08 N ATOM 3324 CA ASP A 611 20.397 6.954 -2.375 1.00 60.42 C ATOM 3325 C ASP A 611 19.204 6.013 -2.470 1.00 60.40 C ATOM 3326 O ASP A 611 18.638 5.820 -3.546 1.00 60.33 O ATOM 3327 CB ASP A 611 20.011 8.340 -2.901 1.00 60.77 C ATOM 3328 CG ASP A 611 20.150 8.453 -4.415 1.00 61.13 C ATOM 3329 OD1 ASP A 611 20.419 9.574 -4.905 1.00 61.18 O ATOM 3330 OD2 ASP A 611 19.999 7.424 -5.114 1.00 61.25 O ATOM 0 H ASP A 611 21.729 6.887 -3.824 1.00 60.08 H new ATOM 0 HA ASP A 611 20.648 7.018 -1.440 1.00 60.42 H new ATOM 0 HB2 ASP A 611 19.095 8.534 -2.648 1.00 60.77 H new ATOM 0 HB3 ASP A 611 20.570 9.010 -2.478 1.00 60.77 H new TER 3331 ASP A 611 HETATM 3332 O HOH A 1 13.052 23.349 29.744 1.00 27.89 O HETATM 3333 O HOH A 2 29.932 33.229 -4.842 1.00 69.95 O HETATM 3334 O HOH A 3 7.787 4.066 11.568 1.00 27.63 O HETATM 3335 O HOH A 4 15.171 1.821 38.492 1.00 37.61 O HETATM 3336 O HOH A 5 5.606 4.394 25.602 1.00 35.63 O HETATM 3337 O HOH A 6 28.833 17.354 -0.696 1.00 46.86 O HETATM 3338 O HOH A 7 18.678 5.891 27.553 1.00 35.60 O HETATM 3339 O HOH A 8 24.195 5.441 39.735 1.00 49.37 O HETATM 3340 O HOH A 9 23.665 18.025 32.826 1.00 44.91 O HETATM 3341 O HOH A 10 5.268 7.346 27.154 1.00 62.92 O HETATM 3342 O HOH A 11 -1.698 2.929 13.774 1.00 33.97 O HETATM 3343 O HOH A 12 3.471 9.609 24.121 1.00 40.44 O HETATM 3344 O HOH A 13 9.834 18.679 33.482 1.00 59.63 O HETATM 3345 O HOH A 14 -14.248 5.960 28.154 1.00 41.18 O HETATM 3346 O HOH A 15 22.196 35.518 8.680 1.00 56.43 O HETATM 3347 O HOH A 16 20.610 -5.855 44.003 1.00 50.06 O HETATM 3348 O HOH A 17 7.263 -16.328 27.077 1.00 31.74 O HETATM 3349 O HOH A 18 17.216 3.901 40.206 1.00 56.01 O HETATM 3350 O HOH A 19 19.138 7.327 12.722 1.00 51.96 O HETATM 3351 O HOH A 20 9.700 21.781 -0.967 1.00 41.27 O HETATM 3352 O HOH A 21 24.031 1.763 27.784 1.00 47.35 O HETATM 3353 O HOH A 22 14.810 21.392 -5.496 1.00 38.47 O HETATM 3354 O HOH A 23 -7.055 -2.747 17.151 1.00 42.35 O HETATM 3355 O HOH A 24 9.858 -2.195 39.235 1.00 41.90 O HETATM 3356 O HOH A 25 13.009 11.796 3.422 1.00 42.30 O HETATM 3357 O HOH A 26 -14.176 -1.217 29.239 1.00 59.74 O HETATM 3358 O HOH A 27 21.483 2.377 26.373 1.00 38.65 O HETATM 3359 O HOH A 28 -16.124 11.370 10.133 1.00 45.92 O HETATM 3360 O HOH A 29 25.365 -15.943 29.764 1.00 61.38 O HETATM 3361 O HOH A 30 -1.023 14.837 10.711 1.00 52.34 O HETATM 3362 O HOH A 31 10.627 16.808 34.675 1.00 56.57 O HETATM 3363 O HOH A 32 24.347 -13.687 21.816 1.00 57.41 O HETATM 3364 O HOH A 33 0.005 -9.086 32.486 1.00 36.17 O HETATM 3365 O HOH A 34 29.762 -8.391 41.462 1.00 48.23 O HETATM 3366 O HOH A 35 29.532 16.440 15.916 1.00 55.13 O HETATM 3367 O HOH A 36 18.263 41.901 2.825 1.00 64.70 O HETATM 3368 O HOH A 37 10.501 31.034 11.400 1.00 60.22 O HETATM 3369 O HOH A 38 22.835 15.865 43.869 1.00 61.78 O HETATM 3370 O HOH A 39 -5.871 -5.240 16.697 1.00 49.39 O HETATM 3371 O HOH A 40 7.187 2.105 10.644 1.00 42.01 O HETATM 3372 O HOH A 41 16.518 -0.412 41.910 1.00 48.57 O HETATM 3373 O HOH A 42 -7.011 -6.872 23.061 1.00 39.36 O HETATM 3374 O HOH A 43 -0.440 9.381 5.338 1.00 51.03 O HETATM 3375 O HOH A 44 16.966 3.748 12.028 1.00 42.64 O HETATM 3376 O HOH A 45 0.957 -9.340 34.672 1.00 39.53 O HETATM 3377 O HOH A 46 -17.817 2.054 14.593 1.00 57.15 O HETATM 3378 O HOH A 47 16.129 22.388 -7.643 1.00 47.23 O HETATM 3379 O HOH A 48 0.123 -2.000 34.737 1.00 36.18 O HETATM 3380 O HOH A 49 18.931 15.135 13.045 1.00 49.23 O HETATM 3381 O HOH A 50 18.380 18.147 12.299 1.00 45.94 O HETATM 3382 O HOH A 51 23.821 -7.229 20.649 1.00 41.14 O HETATM 3383 O HOH A 52 9.918 22.094 16.588 1.00 50.04 O HETATM 3384 O HOH A 53 12.820 22.954 11.788 1.00 45.29 O HETATM 3385 O HOH A 54 6.964 22.556 26.594 1.00 17.97 O HETATM 3386 O HOH A 55 -2.444 4.613 15.508 1.00 34.12 O HETATM 3387 O HOH A 56 8.478 -16.150 32.090 1.00 36.83 O HETATM 3388 O HOH A 57 6.265 3.094 29.844 1.00 32.31 O HETATM 3389 O HOH A 58 6.573 -1.027 38.881 1.00 61.18 O HETATM 3390 O HOH A 59 8.408 3.425 28.081 1.00 47.13 O HETATM 3391 O HOH A 60 12.911 -2.688 19.904 1.00 48.49 O HETATM 3392 O HOH A 61 2.421 -6.565 11.417 1.00 62.75 O HETATM 3393 O HOH A 62 10.243 9.298 26.148 1.00 39.86 O HETATM 3394 O HOH A 63 17.961 -15.224 29.411 1.00 45.12 O HETATM 3395 O HOH A 64 18.726 22.566 -6.681 1.00 38.47 O HETATM 3396 O HOH A 65 9.652 -2.673 12.034 1.00 51.65 O HETATM 3397 O HOH A 66 -20.473 14.404 20.214 1.00 44.90 O HETATM 3398 O HOH A 67 -2.532 -11.971 26.649 1.00 46.48 O HETATM 3399 O HOH A 68 23.984 25.768 -8.517 1.00 45.03 O HETATM 3400 O HOH A 69 1.897 -6.373 36.788 1.00 45.68 O HETATM 3401 O HOH A 70 10.305 22.507 9.758 1.00 55.13 O HETATM 3402 O HOH A 71 13.029 8.768 13.564 1.00 33.80 O HETATM 3403 O HOH A 72 12.951 18.698 41.472 1.00 56.67 O HETATM 3404 O HOH A 73 5.650 20.160 21.038 1.00 44.65 O HETATM 3405 O HOH A 74 -6.778 -8.490 25.015 1.00 47.00 O HETATM 3406 O HOH A 75 -4.153 -1.410 10.260 1.00 61.76 O HETATM 3407 O HOH A 76 12.383 17.227 38.133 1.00 68.92 O HETATM 3408 O HOH A 77 4.384 15.643 28.372 1.00 50.68 O HETATM 3409 O HOH A 78 27.994 27.299 -9.221 1.00 45.56 O HETATM 3410 O HOH A 79 14.866 6.263 32.486 1.00 43.35 O HETATM 3411 O HOH A 80 27.104 15.229 8.825 1.00 48.92 O HETATM 3412 O HOH A 81 9.468 6.715 26.908 1.00 44.14 O HETATM 3413 O HOH A 82 25.901 13.327 28.956 1.00 49.00 O HETATM 3414 O HOH A 83 -9.077 13.018 24.515 1.00 49.60 O HETATM 3415 O HOH A 84 -4.023 -10.577 18.565 1.00 55.83 O HETATM 3416 O HOH A 85 11.908 15.066 14.002 1.00 51.46 O HETATM 3417 O HOH A 86 19.051 -11.992 17.947 1.00 53.39 O HETATM 3418 O HOH A 87 -5.771 15.773 8.404 1.00 43.57 O HETATM 3419 O HOH A 88 24.178 3.775 32.657 1.00 45.46 O HETATM 3420 O HOH A 89 10.314 18.922 16.669 1.00 60.16 O HETATM 3421 O HOH A 90 23.877 -15.325 36.433 1.00 53.02 O HETATM 3422 O HOH A 91 14.272 -8.656 14.685 1.00 64.95 O HETATM 3423 O HOH A 92 5.030 11.208 22.410 1.00 84.03 O HETATM 3424 O HOH A 93 -18.720 18.601 11.874 1.00 67.26 O HETATM 3425 O HOH A 94 6.476 13.460 20.198 1.00 52.57 O HETATM 3426 O HOH A 95 25.214 19.191 17.390 1.00 56.03 O HETATM 3427 O HOH A 96 -18.192 18.809 14.794 1.00 48.69 O HETATM 3428 O HOH A 97 16.474 22.757 34.397 1.00 52.57 O HETATM 3429 O HOH A 98 23.015 4.642 22.590 1.00 47.32 O HETATM 3430 O HOH A 99 22.309 2.276 23.867 1.00 41.87 O HETATM 3431 O HOH A 100 11.128 13.423 36.915 1.00 47.62 O END