HEADER OXIDOREDUCTASE 19-APR-95 1BHS TITLE HUMAN ESTROGENIC 17BETA-HYDROXYSTEROID DEHYDROGENASE COMPND MOL_ID: 1; COMPND 2 MOLECULE: 17BETA-HYDROXYSTEROID DEHYDROGENASE; COMPND 3 CHAIN: NULL; COMPND 4 SYNONYM: TYPE I 17BETA-HYDROXYSTEROID DEHYDROGENASE; COMPND 5 EC: 1.1.1.62 SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; SOURCE 3 ORGANISM_COMMON: HUMAN KEYWDS SHORT-CHAIN DEHYDROGENASE, STEROID DEHYDROGENASE, ESTROGEN, KEYWDS 2 HUMAN TYPE I 17BETA-HSD, HUMAN PLACENTAL 17BETA-HSD, KEYWDS 3 OXIDOREDUCTASE EXPDTA X-RAY DIFFRACTION AUTHOR D.GHOSH REVDAT 1 07-DEC-96 1BHS 0 JRNL AUTH D.GHOSH,V.Z.PLETNEV,D.W.ZHU,Z.WAWRZAK,W.L.DUAX, JRNL AUTH 2 W.PANGBORN,F.LABRIE,S.X.LIN JRNL TITL STRUCTURE OF HUMAN ESTROGENIC 17 JRNL TITL 2 BETA-HYDROXYSTEROID DEHYDROGENASE AT 2.20 A JRNL TITL 3 RESOLUTION JRNL REF STRUCTURE (LONDON) V. 3 503 1995 JRNL REFN ASTM STRUE6 UK ISSN 0969-2126 2005 REMARK 1 REMARK 1 REFERENCE 1 REMARK 1 AUTH D.W.ZHU,X.LEE,R.BRETON,D.GHOSH,W.PANGBORN,W.L.DAUX, REMARK 1 AUTH 2 S.X.LIN REMARK 1 TITL CRYSTALLIZATION AND PRELIMINARY X-RAY DIFFRACTION REMARK 1 TITL 2 ANALYSIS OF THE COMPLEX OF HUMAN PLACENTAL REMARK 1 TITL 3 17 BETA-HYDROXYSTEROID DEHYDROGENASE WITH NADP+ REMARK 1 REF J.MOL.BIOL. V. 234 242 1993 REMARK 1 REFN ASTM JMOBAK UK ISSN 0022-2836 0070 REMARK 2 REMARK 2 RESOLUTION. 2.20 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.20 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 8.0 REMARK 3 DATA CUTOFF (SIGMA(F)) : 1.0 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : NULL REMARK 3 DATA CUTOFF LOW (ABS(F)) : NULL REMARK 3 COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 NUMBER OF REFLECTIONS : 13474 REMARK 3 REMARK 3 FIT TO DATA USED IN REFINEMENT. REMARK 3 CROSS-VALIDATION METHOD : NULL REMARK 3 FREE R VALUE TEST SET SELECTION : NULL REMARK 3 R VALUE (WORKING SET) : 0.185 REMARK 3 FREE R VALUE : 0.229 REMARK 3 FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 FREE R VALUE TEST SET COUNT : NULL REMARK 3 ESTIMATED ERROR OF FREE R VALUE : NULL REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : NULL REMARK 3 BIN RESOLUTION RANGE HIGH (A) : NULL REMARK 3 BIN RESOLUTION RANGE LOW (A) : NULL REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : NULL REMARK 3 REFLECTIONS IN BIN (WORKING SET) : NULL REMARK 3 BIN R VALUE (WORKING SET) : NULL REMARK 3 BIN FREE R VALUE : NULL REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : NULL REMARK 3 BIN FREE R VALUE TEST SET COUNT : NULL REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : NULL REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 2178 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 0 REMARK 3 SOLVENT ATOMS : 49 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : NULL REMARK 3 MEAN B VALUE (OVERALL, A**2) : 39. REMARK 3 OVERALL ANISOTROPIC B VALUE. REMARK 3 B11 (A**2) : NULL REMARK 3 B22 (A**2) : NULL REMARK 3 B33 (A**2) : NULL REMARK 3 B12 (A**2) : NULL REMARK 3 B13 (A**2) : NULL REMARK 3 B23 (A**2) : NULL REMARK 3 REMARK 3 ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM LUZZATI PLOT (A) : 0.20-0.25 REMARK 3 ESD FROM SIGMAA (A) : NULL REMARK 3 LOW RESOLUTION CUTOFF (A) : NULL REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : NULL REMARK 3 ESD FROM C-V SIGMAA (A) : NULL REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.010 REMARK 3 BOND ANGLES (DEGREES) : NULL REMARK 3 DIHEDRAL ANGLES (DEGREES) : NULL REMARK 3 IMPROPER ANGLES (DEGREES) : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : NULL REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 MAIN-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN BOND (A**2) : NULL ; NULL REMARK 3 SIDE-CHAIN ANGLE (A**2) : NULL ; NULL REMARK 3 REMARK 3 NCS MODEL : NULL REMARK 3 REMARK 3 NCS RESTRAINTS. RMS SIGMA/WEIGHT REMARK 3 GROUP 1 POSITIONAL (A) : NULL ; NULL REMARK 3 GROUP 1 B-FACTOR (A**2) : NULL ; NULL REMARK 3 REMARK 3 PARAMETER FILE 1 : NULL REMARK 3 PARAMETER FILE 2 : NULL REMARK 3 TOPOLOGY FILE 1 : NULL REMARK 3 TOPOLOGY FILE 2 : NULL REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: REMARK 3 PLANAR ANGLE RESTRAINT: 1.46 DEGREES REMARK 4 REMARK 4 1BHS COMPLIES WITH FORMAT V. 2.1, 25-OCT-1996 REMARK 6 REMARK 6 THE REGION 192 - 200 IS VERY POORLY DEFINED IN THE ELECTRON REMARK 6 DENSITY MAPS AND WAS MODELED STEREOCHEMICALLY. REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : 16-NOV-1993 REMARK 200 TEMPERATURE (KELVIN) : NULL REMARK 200 PH : NULL REMARK 200 NUMBER OF CRYSTALS USED : NULL REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : NULL REMARK 200 RADIATION SOURCE : NULL REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : NULL REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : NULL REMARK 200 OPTICS : NULL REMARK 200 REMARK 200 DETECTOR TYPE : R-AXIS IIC REMARK 200 DETECTOR MANUFACTURER : NULL REMARK 200 INTENSITY-INTEGRATION SOFTWARE : RIGAKU REMARK 200 DATA SCALING SOFTWARE : NULL REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 14079 REMARK 200 RESOLUTION RANGE HIGH (A) : NULL REMARK 200 RESOLUTION RANGE LOW (A) : NULL REMARK 200 REJECTION CRITERIA (SIGMA(I)) : NULL REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 81. REMARK 200 DATA REDUNDANCY : 3.1 REMARK 200 R MERGE (I) : 0.064 REMARK 200 R SYM (I) : NULL REMARK 200 <I/SIGMA(I)> FOR THE DATA SET : NULL REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : NULL REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : NULL REMARK 200 COMPLETENESS FOR SHELL (%) : NULL REMARK 200 DATA REDUNDANCY IN SHELL : NULL REMARK 200 R MERGE FOR SHELL (I) : NULL REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 <I/SIGMA(I)> FOR SHELL : NULL REMARK 200 REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: NULL REMARK 200 SOFTWARE USED: NULL REMARK 200 STARTING MODEL: NULL REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 45.0 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): NULL REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: NULL 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 1/2+X,1/2+Y,Z REMARK 290 4555 1/2-X,1/2+Y,-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 61.78178 REMARK 290 SMTRY2 3 0.000000 1.000000 0.000000 22.52455 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 61.78178 REMARK 290 SMTRY2 4 0.000000 1.000000 0.000000 22.52455 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: CAT REMARK 800 SITE_DESCRIPTION: THE TYR-LYS-SER CATALYTIC TRIAD. REMARK 999 REMARK 999 SEQUENCE REMARK 999 1BHS SWS P14061 285 - 327 NOT IN ATOMS LIST REMARK 999 REMARK 999 REFERENCE REMARK 999 REFERENCE: LUU-THE V ET AL.(1989) MOL. ENDOCRINOL. 3, REMARK 999 1301-1309. DBREF 1BHS 1 284 SWS P14061 DHB1_HUMAN 1 284 SEQRES 1 327 ALA ARG THR VAL VAL LEU ILE THR GLY CYS SER SER GLY SEQRES 2 327 ILE GLY LEU HIS LEU ALA VAL ARG LEU ALA SER ASP PRO SEQRES 3 327 SER GLN SER PHE LYS VAL TYR ALA THR LEU ARG ASP LEU SEQRES 4 327 LYS THR GLN GLY ARG LEU TRP GLU ALA ALA ARG ALA LEU SEQRES 5 327 ALA CYS PRO PRO GLY SER LEU GLU THR LEU GLN LEU ASP SEQRES 6 327 VAL ARG ASP SER LYS SER VAL ALA ALA ALA ARG GLU ARG SEQRES 7 327 VAL THR GLU GLY ARG VAL ASP VAL LEU VAL CYS ASN ALA SEQRES 8 327 GLY LEU GLY LEU LEU GLY PRO LEU GLU ALA LEU GLY GLU SEQRES 9 327 ASP ALA VAL ALA SER VAL LEU ASP VAL ASN VAL VAL GLY SEQRES 10 327 THR VAL ARG MET LEU GLN ALA PHE LEU PRO ASP MET LYS SEQRES 11 327 ARG ARG GLY SER GLY ARG VAL LEU VAL THR GLY SER VAL SEQRES 12 327 GLY GLY LEU MET GLY LEU PRO PHE ASN ASP VAL TYR CYS SEQRES 13 327 ALA SER LYS PHE ALA LEU GLU GLY LEU CYS GLU SER LEU SEQRES 14 327 ALA VAL LEU LEU LEU PRO PHE GLY VAL HIS LEU SER LEU SEQRES 15 327 ILE GLU CYS GLY PRO VAL HIS THR ALA PHE MET GLU LYS SEQRES 16 327 VAL LEU GLY SER PRO GLU GLU VAL LEU ASP ARG THR ASP SEQRES 17 327 ILE HIS THR PHE HIS ARG PHE TYR GLN TYR LEU ALA HIS SEQRES 18 327 SER LYS GLN VAL PHE ARG GLU ALA ALA GLN ASN PRO GLU SEQRES 19 327 GLU VAL ALA GLU VAL PHE LEU THR ALA LEU ARG ALA PRO SEQRES 20 327 LYS PRO THR LEU ARG TYR PHE THR THR GLU ARG PHE LEU SEQRES 21 327 PRO LEU LEU ARG MET ARG LEU ASP ASP PRO SER GLY SER SEQRES 22 327 ASN TYR VAL THR ALA MET HIS ARG GLU VAL PHE GLY ASP SEQRES 23 327 VAL PRO ALA LYS ALA GLU ALA GLY ALA GLU ALA GLY GLY SEQRES 24 327 GLY ALA GLY PRO GLY ALA GLU ASP GLU ALA GLY ARG SER SEQRES 25 327 ALA VAL GLY ASP PRO GLU LEU GLY ASP PRO PRO ALA ALA SEQRES 26 327 PRO GLN FORMUL 2 HOH *49(H2 O1) HELIX 1 1 GLY 13 ALA 23 1 11 HELIX 2 2 LEU 39 THR 41 5 3 HELIX 3 3 GLY 43 ALA 51 1 9 HELIX 4 4 SER 69 ARG 78 1 10 HELIX 5 5 LEU 99 ALA 101 5 3 HELIX 6 6 GLU 104 ASN 114 1 11 HELIX 7 7 VAL 116 ARG 132 1 17 HELIX 8 8 VAL 143 GLY 145 5 3 HELIX 9 9 ASP 153 PHE 176 1 24 HELIX 10 10 ALA 191 GLU 194 1 4 HELIX 11 11 GLU 201 ARG 206 1 6 HELIX 12 12 ILE 209 ALA 229 1 21 HELIX 13 13 PRO 233 ARG 245 1 13 HELIX 14 14 LEU 260 ASP 268 1 9 HELIX 15 15 SER 273 GLU 282 1 10 SHEET 1 A 7 ARG 252 PHE 254 0 SHEET 2 A 7 VAL 178 GLU 184 1 N LEU 182 O TYR 253 SHEET 3 A 7 GLY 135 THR 140 1 N GLY 135 O HIS 179 SHEET 4 A 7 VAL 86 CYS 89 1 N LEU 87 O ARG 136 SHEET 5 A 7 THR 3 ILE 7 1 N LEU 6 O VAL 86 SHEET 6 A 7 PHE 30 LEU 36 1 N LYS 31 O THR 3 SHEET 7 A 7 LEU 59 GLN 63 1 N GLU 60 O VAL 32 SITE 1 CAT 3 TYR 155 LYS 159 SER 142 CRYST1 123.560 45.050 61.330 90.00 99.02 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 0.008093 0.000000 0.001285 0.00000 SCALE2 0.000000 0.022198 0.000000 0.00000 SCALE3 0.000000 0.000000 0.016509 0.00000 ATOM 639 N VAL 86 20.071 1.032 15.043 1.00 22.86 N ATOM 640 CA VAL 86 19.512 1.620 13.844 1.00 22.03 C ATOM 641 C VAL 86 19.088 0.468 12.946 1.00 24.89 C ATOM 642 O VAL 86 19.845 -0.487 12.773 1.00 24.17 O ATOM 643 CB VAL 86 20.539 2.488 13.107 1.00 22.29 C ATOM 644 CG1 VAL 86 19.901 3.183 11.930 1.00 19.05 C ATOM 645 CG2 VAL 86 21.139 3.521 14.052 1.00 26.04 C ATOM 646 N LEU 87 17.822 0.486 12.520 1.00 25.15 N ATOM 647 CA LEU 87 17.280 -0.519 11.622 1.00 21.80 C ATOM 648 C LEU 87 16.995 0.195 10.317 1.00 23.27 C ATOM 649 O LEU 87 16.318 1.228 10.337 1.00 20.09 O ATOM 650 CB LEU 87 15.974 -1.071 12.169 1.00 24.95 C ATOM 651 CG LEU 87 15.241 -2.033 11.236 1.00 22.74 C ATOM 652 CD1 LEU 87 16.055 -3.280 11.016 1.00 21.08 C ATOM 653 CD2 LEU 87 13.906 -2.388 11.852 1.00 25.54 C ATOM 654 N VAL 88 17.563 -0.287 9.206 1.00 21.94 N ATOM 655 CA VAL 88 17.317 0.336 7.912 1.00 19.14 C ATOM 656 C VAL 88 16.519 -0.628 7.072 1.00 22.63 C ATOM 657 O VAL 88 16.997 -1.699 6.716 1.00 22.50 O ATOM 658 CB VAL 88 18.599 0.745 7.172 1.00 20.02 C ATOM 659 CG1 VAL 88 18.246 1.423 5.823 1.00 15.66 C ATOM 660 CG2 VAL 88 19.441 1.688 8.053 1.00 18.68 C ATOM 661 N CYS 89 15.254 -0.277 6.870 1.00 24.17 N ATOM 662 CA CYS 89 14.304 -1.064 6.091 1.00 28.11 C ATOM 663 C CYS 89 14.475 -0.570 4.694 1.00 25.01 C ATOM 664 O CYS 89 13.910 0.440 4.288 1.00 27.62 O ATOM 665 CB CYS 89 12.874 -0.830 6.585 1.00 26.87 C ATOM 666 SG CYS 89 12.650 -1.514 8.231 1.00 33.13 S ATOM 667 N ASN 90 15.319 -1.287 3.989 1.00 26.30 N ATOM 668 CA ASN 90 15.694 -0.933 2.658 1.00 26.61 C ATOM 669 C ASN 90 15.182 -1.910 1.585 1.00 30.70 C ATOM 670 O ASN 90 14.756 -1.467 0.526 1.00 37.13 O ATOM 671 CB ASN 90 17.222 -0.798 2.650 1.00 26.13 C ATOM 672 CG ASN 90 17.764 -0.451 1.312 1.00 30.44 C ATOM 673 OD1 ASN 90 17.669 0.687 0.870 1.00 35.42 O ATOM 674 ND2 ASN 90 18.340 -1.428 0.644 1.00 34.85 N ATOM 675 N ALA 91 15.165 -3.218 1.851 1.00 30.01 N ATOM 676 CA ALA 91 14.701 -4.179 0.838 1.00 33.21 C ATOM 677 C ALA 91 13.452 -3.673 0.095 1.00 33.75 C ATOM 678 O ALA 91 12.497 -3.187 0.706 1.00 38.24 O ATOM 679 CB ALA 91 14.450 -5.563 1.462 1.00 32.95 C ATOM 680 N GLY 92 13.511 -3.704 -1.226 1.00 31.16 N ATOM 681 CA GLY 92 12.404 -3.220 -2.008 1.00 32.44 C ATOM 682 C GLY 92 12.607 -3.610 -3.447 1.00 33.83 C ATOM 683 O GLY 92 13.738 -3.684 -3.909 1.00 39.71 O ATOM 684 N LEU 93 11.517 -3.881 -4.149 1.00 30.62 N ATOM 685 CA LEU 93 11.587 -4.276 -5.532 1.00 27.68 C ATOM 686 C LEU 93 10.582 -3.519 -6.373 1.00 23.49 C ATOM 687 O LEU 93 9.556 -3.089 -5.884 1.00 24.74 O ATOM 688 CB LEU 93 11.431 -5.790 -5.638 1.00 32.26 C ATOM 689 CG LEU 93 10.102 -6.486 -5.431 1.00 34.16 C ATOM 690 CD1 LEU 93 9.386 -6.510 -6.763 1.00 43.79 C ATOM 691 CD2 LEU 93 10.351 -7.915 -4.962 1.00 32.72 C ATOM 692 N GLY 94 10.918 -3.290 -7.631 1.00 24.45 N ATOM 693 CA GLY 94 10.035 -2.535 -8.500 1.00 22.48 C ATOM 694 C GLY 94 9.195 -3.366 -9.428 1.00 21.15 C ATOM 695 O GLY 94 9.348 -4.576 -9.490 1.00 26.07 O ATOM 696 N LEU 95 8.300 -2.712 -10.153 1.00 24.78 N ATOM 697 CA LEU 95 7.421 -3.395 -11.089 1.00 27.77 C ATOM 698 C LEU 95 7.018 -2.339 -12.088 1.00 28.58 C ATOM 699 O LEU 95 6.506 -1.292 -11.702 1.00 26.84 O ATOM 700 CB LEU 95 6.181 -3.910 -10.373 1.00 30.09 C ATOM 701 CG LEU 95 5.833 -5.369 -10.623 1.00 31.05 C ATOM 702 CD1 LEU 95 4.525 -5.687 -9.919 1.00 31.57 C ATOM 703 CD2 LEU 95 5.742 -5.641 -12.105 1.00 28.82 C ATOM 704 N LEU 96 7.219 -2.632 -13.365 1.00 26.77 N ATOM 705 CA LEU 96 6.918 -1.677 -14.422 1.00 28.67 C ATOM 706 C LEU 96 6.176 -2.342 -15.590 1.00 26.96 C ATOM 707 O LEU 96 6.561 -3.414 -16.027 1.00 31.11 O ATOM 708 CB LEU 96 8.236 -1.069 -14.910 1.00 26.61 C ATOM 709 CG LEU 96 8.184 0.076 -15.906 1.00 29.61 C ATOM 710 CD1 LEU 96 7.910 1.348 -15.159 1.00 30.78 C ATOM 711 CD2 LEU 96 9.498 0.173 -16.636 1.00 33.25 C ATOM 712 N GLY 97 5.084 -1.736 -16.049 1.00 27.26 N ATOM 713 CA GLY 97 4.332 -2.293 -17.166 1.00 26.33 C ATOM 714 C GLY 97 2.862 -1.983 -17.014 1.00 24.59 C ATOM 715 O GLY 97 2.486 -1.502 -15.960 1.00 26.84 O ATOM 716 N PRO 98 2.022 -2.168 -18.055 1.00 28.71 N ATOM 717 CA PRO 98 0.572 -1.901 -18.000 1.00 24.68 C ATOM 718 C PRO 98 0.004 -2.790 -16.920 1.00 20.16 C ATOM 719 O PRO 98 0.353 -3.972 -16.868 1.00 22.43 O ATOM 720 CB PRO 98 0.092 -2.374 -19.370 1.00 22.38 C ATOM 721 CG PRO 98 1.283 -2.082 -20.263 1.00 29.09 C ATOM 722 CD PRO 98 2.424 -2.585 -19.414 1.00 26.95 C ATOM 723 N LEU 99 -0.891 -2.267 -16.088 1.00 21.32 N ATOM 724 CA LEU 99 -1.450 -3.067 -14.988 1.00 21.92 C ATOM 725 C LEU 99 -1.949 -4.430 -15.448 1.00 23.27 C ATOM 726 O LEU 99 -1.641 -5.468 -14.846 1.00 22.94 O ATOM 727 CB LEU 99 -2.596 -2.326 -14.294 1.00 25.86 C ATOM 728 CG LEU 99 -2.692 -2.236 -12.759 1.00 26.55 C ATOM 729 CD1 LEU 99 -4.164 -2.227 -12.416 1.00 33.31 C ATOM 730 CD2 LEU 99 -2.026 -3.381 -12.026 1.00 27.53 C ATOM 731 N GLU 100 -2.714 -4.428 -16.533 1.00 25.29 N ATOM 732 CA GLU 100 -3.263 -5.666 -17.065 1.00 29.55 C ATOM 733 C GLU 100 -2.187 -6.667 -17.521 1.00 32.50 C ATOM 734 O GLU 100 -2.435 -7.862 -17.561 1.00 39.52 O ATOM 735 CB GLU 100 -4.279 -5.383 -18.192 1.00 28.51 C ATOM 736 CG GLU 100 -3.711 -4.724 -19.433 1.00 26.08 C ATOM 737 CD GLU 100 -3.860 -3.202 -19.444 1.00 33.39 C ATOM 738 OE1 GLU 100 -3.809 -2.555 -18.379 1.00 31.06 O ATOM 739 OE2 GLU 100 -4.014 -2.638 -20.549 1.00 39.68 O ATOM 740 N ALA 101 -0.987 -6.193 -17.828 1.00 32.16 N ATOM 741 CA ALA 101 0.059 -7.091 -18.271 1.00 34.26 C ATOM 742 C ALA 101 0.822 -7.683 -17.101 1.00 38.93 C ATOM 743 O ALA 101 1.655 -8.572 -17.290 1.00 48.01 O ATOM 744 CB ALA 101 1.007 -6.370 -19.211 1.00 35.24 C ATOM 745 N LEU 102 0.548 -7.192 -15.895 1.00 38.55 N ATOM 746 CA LEU 102 1.227 -7.649 -14.677 1.00 33.84 C ATOM 747 C LEU 102 0.605 -8.911 -14.069 1.00 32.97 C ATOM 748 O LEU 102 -0.598 -8.988 -13.867 1.00 37.80 O ATOM 749 CB LEU 102 1.249 -6.503 -13.652 1.00 31.28 C ATOM 750 CG LEU 102 2.349 -5.430 -13.685 1.00 29.10 C ATOM 751 CD1 LEU 102 3.024 -5.286 -15.026 1.00 31.93 C ATOM 752 CD2 LEU 102 1.785 -4.117 -13.225 1.00 30.22 C ATOM 753 N GLY 103 1.429 -9.912 -13.788 1.00 34.24 N ATOM 754 CA GLY 103 0.923 -11.149 -13.213 1.00 35.12 C ATOM 755 C GLY 103 0.604 -11.014 -11.736 1.00 39.58 C ATOM 756 O GLY 103 1.366 -10.396 -10.995 1.00 37.15 O ATOM 757 N GLU 104 -0.460 -11.681 -11.289 1.00 44.42 N ATOM 758 CA GLU 104 -0.907 -11.624 -9.886 1.00 45.94 C ATOM 759 C GLU 104 0.178 -11.993 -8.872 1.00 41.52 C ATOM 760 O GLU 104 0.273 -11.428 -7.782 1.00 40.51 O ATOM 761 CB GLU 104 -2.125 -12.539 -9.675 1.00 52.78 C ATOM 762 CG GLU 104 -2.802 -12.374 -8.310 1.00 63.60 C ATOM 763 CD GLU 104 -3.372 -13.682 -7.755 1.00 71.93 C ATOM 764 OE1 GLU 104 -4.502 -14.064 -8.154 1.00 72.25 O ATOM 765 OE2 GLU 104 -2.690 -14.314 -6.904 1.00 76.85 O ATOM 766 N ASP 105 0.994 -12.959 -9.233 1.00 38.59 N ATOM 767 CA ASP 105 2.038 -13.386 -8.349 1.00 38.07 C ATOM 768 C ASP 105 3.083 -12.300 -8.250 1.00 33.44 C ATOM 769 O ASP 105 3.608 -12.057 -7.175 1.00 34.52 O ATOM 770 CB ASP 105 2.587 -14.696 -8.869 1.00 50.91 C ATOM 771 CG ASP 105 1.460 -15.653 -9.254 1.00 71.38 C ATOM 772 OD1 ASP 105 0.630 -15.970 -8.361 1.00 76.21 O ATOM 773 OD2 ASP 105 1.347 -16.015 -10.456 1.00 80.12 O ATOM 774 N ALA 106 3.297 -11.565 -9.336 1.00 28.21 N ATOM 775 CA ALA 106 4.292 -10.500 -9.322 1.00 25.51 C ATOM 776 C ALA 106 3.800 -9.321 -8.495 1.00 27.25 C ATOM 777 O ALA 106 4.574 -8.715 -7.756 1.00 26.73 O ATOM 778 CB ALA 106 4.613 -10.061 -10.728 1.00 21.93 C ATOM 779 N VAL 107 2.520 -8.975 -8.651 1.00 28.55 N ATOM 780 CA VAL 107 1.914 -7.874 -7.888 1.00 29.48 C ATOM 781 C VAL 107 1.945 -8.247 -6.393 1.00 30.36 C ATOM 782 O VAL 107 2.171 -7.389 -5.539 1.00 32.86 O ATOM 783 CB VAL 107 0.426 -7.585 -8.328 1.00 30.12 C ATOM 784 CG1 VAL 107 -0.267 -6.690 -7.298 1.00 20.51 C ATOM 785 CG2 VAL 107 0.377 -6.933 -9.724 1.00 22.44 C ATOM 786 N ALA 108 1.734 -9.530 -6.094 1.00 28.86 N ATOM 787 CA ALA 108 1.744 -10.037 -4.723 1.00 28.75 C ATOM 788 C ALA 108 3.143 -9.955 -4.061 1.00 32.14 C ATOM 789 O ALA 108 3.271 -9.538 -2.906 1.00 34.02 O ATOM 790 CB ALA 108 1.198 -11.481 -4.686 1.00 25.22 C ATOM 791 N SER 109 4.192 -10.313 -4.793 1.00 27.95 N ATOM 792 CA SER 109 5.543 -10.263 -4.258 1.00 22.46 C ATOM 793 C SER 109 5.956 -8.866 -3.901 1.00 19.95 C ATOM 794 O SER 109 6.631 -8.665 -2.907 1.00 25.08 O ATOM 795 CB SER 109 6.524 -10.803 -5.285 1.00 24.21 C ATOM 796 OG SER 109 6.081 -12.074 -5.712 1.00 32.26 O ATOM 797 N VAL 110 5.579 -7.904 -4.731 1.00 18.53 N ATOM 798 CA VAL 110 5.942 -6.507 -4.506 1.00 20.24 C ATOM 799 C VAL 110 5.392 -5.975 -3.200 1.00 18.88 C ATOM 800 O VAL 110 6.114 -5.359 -2.427 1.00 20.24 O ATOM 801 CB VAL 110 5.511 -5.617 -5.705 1.00 23.34 C ATOM 802 CG1 VAL 110 5.703 -4.121 -5.409 1.00 16.42 C ATOM 803 CG2 VAL 110 6.300 -6.029 -6.936 1.00 20.79 C ATOM 804 N LEU 111 4.123 -6.251 -2.925 1.00 26.25 N ATOM 805 CA LEU 111 3.487 -5.783 -1.689 1.00 22.15 C ATOM 806 C LEU 111 4.077 -6.558 -0.531 1.00 14.51 C ATOM 807 O LEU 111 4.421 -6.021 0.512 1.00 21.55 O ATOM 808 CB LEU 111 1.960 -5.991 -1.739 1.00 25.70 C ATOM 809 CG LEU 111 0.992 -4.923 -2.285 1.00 28.29 C ATOM 810 CD1 LEU 111 1.625 -3.543 -2.258 1.00 27.30 C ATOM 811 CD2 LEU 111 0.569 -5.246 -3.674 1.00 25.12 C ATOM 812 N ASP 112 4.229 -7.823 -0.775 1.00 14.86 N ATOM 813 CA ASP 112 4.752 -8.793 0.181 1.00 18.95 C ATOM 814 C ASP 112 6.149 -8.376 0.674 1.00 23.77 C ATOM 815 O ASP 112 6.445 -8.417 1.876 1.00 25.37 O ATOM 816 CB ASP 112 4.804 -10.156 -0.507 1.00 27.20 C ATOM 817 CG ASP 112 5.081 -11.316 0.440 1.00 31.58 C ATOM 818 OD1 ASP 112 5.171 -11.098 1.709 1.00 32.01 O ATOM 819 OD2 ASP 112 5.222 -12.508 -0.024 1.00 33.44 O ATOM 820 N VAL 113 7.033 -7.985 -0.270 1.00 23.25 N ATOM 821 CA VAL 113 8.380 -7.577 0.080 1.00 19.69 C ATOM 822 C VAL 113 8.453 -6.123 0.536 1.00 22.30 C ATOM 823 O VAL 113 9.032 -5.815 1.581 1.00 25.58 O ATOM 824 CB VAL 113 9.357 -7.762 -1.103 1.00 27.43 C ATOM 825 CG1 VAL 113 10.788 -7.218 -0.741 1.00 19.75 C ATOM 826 CG2 VAL 113 9.390 -9.227 -1.529 1.00 27.15 C ATOM 827 N ASN 114 7.921 -5.217 -0.275 1.00 20.30 N ATOM 828 CA ASN 114 7.987 -3.808 0.065 1.00 21.40 C ATOM 829 C ASN 114 7.190 -3.440 1.315 1.00 21.55 C ATOM 830 O ASN 114 7.721 -2.827 2.240 1.00 16.95 O ATOM 831 CB ASN 114 7.539 -2.958 -1.120 1.00 25.39 C ATOM 832 CG ASN 114 8.470 -3.079 -2.309 1.00 27.54 C ATOM 833 OD1 ASN 114 9.369 -3.917 -2.309 1.00 29.98 O ATOM 834 ND2 ASN 114 8.255 -2.252 -3.334 1.00 26.22 N ATOM 835 N VAL 115 5.934 -3.873 1.371 1.00 22.93 N ATOM 836 CA VAL 115 5.077 -3.541 2.499 1.00 20.81 C ATOM 837 C VAL 115 5.057 -4.557 3.636 1.00 19.08 C ATOM 838 O VAL 115 5.483 -4.243 4.744 1.00 20.53 O ATOM 839 CB VAL 115 3.634 -3.233 2.036 1.00 15.36 C ATOM 840 CG1 VAL 115 2.880 -2.532 3.152 1.00 18.06 C ATOM 841 CG2 VAL 115 3.654 -2.341 0.809 1.00 15.04 C ATOM 842 N VAL 116 4.603 -5.780 3.385 1.00 20.46 N ATOM 843 CA VAL 116 4.544 -6.748 4.473 1.00 20.79 C ATOM 844 C VAL 116 5.939 -7.014 5.075 1.00 26.12 C ATOM 845 O VAL 116 6.102 -6.963 6.293 1.00 31.93 O ATOM 846 CB VAL 116 3.767 -8.036 4.086 1.00 17.67 C ATOM 847 CG1 VAL 116 3.531 -8.913 5.308 1.00 17.94 C ATOM 848 CG2 VAL 116 2.446 -7.672 3.482 1.00 15.88 C ATOM 849 N GLY 117 6.961 -7.167 4.238 1.00 24.49 N ATOM 850 CA GLY 117 8.303 -7.385 4.743 1.00 18.67 C ATOM 851 C GLY 117 8.767 -6.280 5.680 1.00 18.19 C ATOM 852 O GLY 117 9.459 -6.548 6.653 1.00 18.62 O ATOM 853 N THR 118 8.408 -5.032 5.394 1.00 21.27 N ATOM 854 CA THR 118 8.785 -3.931 6.276 1.00 19.99 C ATOM 855 C THR 118 7.991 -4.046 7.578 1.00 26.05 C ATOM 856 O THR 118 8.479 -3.665 8.647 1.00 31.96 O ATOM 857 CB THR 118 8.545 -2.558 5.628 1.00 23.62 C ATOM 858 OG1 THR 118 9.412 -2.406 4.494 1.00 28.41 O ATOM 859 CG2 THR 118 8.809 -1.438 6.620 1.00 17.38 C ATOM 860 N VAL 119 6.763 -4.562 7.499 1.00 26.17 N ATOM 861 CA VAL 119 5.958 -4.767 8.702 1.00 20.82 C ATOM 862 C VAL 119 6.619 -5.866 9.570 1.00 24.04 C ATOM 863 O VAL 119 6.757 -5.691 10.788 1.00 24.01 O ATOM 864 CB VAL 119 4.483 -5.149 8.377 1.00 20.37 C ATOM 865 CG1 VAL 119 3.776 -5.585 9.633 1.00 18.34 C ATOM 866 CG2 VAL 119 3.737 -3.952 7.813 1.00 11.68 C ATOM 867 N ARG 120 7.091 -6.950 8.939 1.00 22.26 N ATOM 868 CA ARG 120 7.735 -8.053 9.650 1.00 17.58 C ATOM 869 C ARG 120 8.949 -7.584 10.435 1.00 22.07 C ATOM 870 O ARG 120 9.122 -7.943 11.610 1.00 26.57 O ATOM 871 CB ARG 120 8.156 -9.161 8.690 1.00 19.34 C ATOM 872 CG ARG 120 7.005 -9.891 8.014 1.00 21.06 C ATOM 873 CD ARG 120 7.492 -11.149 7.306 1.00 20.29 C ATOM 874 NE ARG 120 6.402 -11.842 6.639 1.00 22.66 N ATOM 875 CZ ARG 120 5.974 -11.577 5.405 1.00 24.65 C ATOM 876 NH1 ARG 120 6.545 -10.631 4.665 1.00 20.10 N ATOM 877 NH2 ARG 120 4.926 -12.226 4.926 1.00 25.77 N ATOM 878 N MET 121 9.779 -6.767 9.792 1.00 20.39 N ATOM 879 CA MET 121 10.977 -6.230 10.432 1.00 20.21 C ATOM 880 C MET 121 10.598 -5.357 11.603 1.00 20.50 C ATOM 881 O MET 121 11.259 -5.378 12.629 1.00 23.46 O ATOM 882 CB MET 121 11.793 -5.391 9.447 1.00 22.93 C ATOM 883 CG MET 121 12.358 -6.188 8.292 1.00 22.35 C ATOM 884 SD MET 121 13.355 -7.490 8.943 1.00 29.37 S ATOM 885 CE MET 121 14.645 -6.573 9.702 1.00 21.49 C ATOM 886 N LEU 122 9.559 -4.549 11.436 1.00 23.05 N ATOM 887 CA LEU 122 9.115 -3.662 12.507 1.00 22.79 C ATOM 888 C LEU 122 8.547 -4.468 13.676 1.00 25.73 C ATOM 889 O LEU 122 8.819 -4.178 14.840 1.00 24.67 O ATOM 890 CB LEU 122 8.101 -2.645 11.978 1.00 21.48 C ATOM 891 CG LEU 122 8.709 -1.605 11.035 1.00 20.04 C ATOM 892 CD1 LEU 122 7.685 -0.617 10.578 1.00 22.16 C ATOM 893 CD2 LEU 122 9.795 -0.877 11.757 1.00 20.47 C ATOM 894 N GLN 123 7.812 -5.524 13.365 1.00 27.17 N ATOM 895 CA GLN 123 7.250 -6.351 14.418 1.00 28.31 C ATOM 896 C GLN 123 8.370 -7.004 15.208 1.00 29.55 C ATOM 897 O GLN 123 8.327 -7.046 16.438 1.00 34.19 O ATOM 898 CB GLN 123 6.290 -7.410 13.851 1.00 22.65 C ATOM 899 CG GLN 123 5.019 -6.795 13.244 1.00 27.62 C ATOM 900 CD GLN 123 4.044 -7.830 12.742 1.00 27.45 C ATOM 901 OE1 GLN 123 4.437 -8.828 12.153 1.00 28.35 O ATOM 902 NE2 GLN 123 2.766 -7.607 12.995 1.00 28.00 N ATOM 903 N ALA 124 9.394 -7.487 14.523 1.00 27.66 N ATOM 904 CA ALA 124 10.467 -8.135 15.252 1.00 26.44 C ATOM 905 C ALA 124 11.371 -7.172 16.004 1.00 24.19 C ATOM 906 O ALA 124 11.787 -7.453 17.119 1.00 31.66 O ATOM 907 CB ALA 124 11.281 -9.040 14.331 1.00 26.22 C ATOM 908 N PHE 125 11.585 -5.988 15.463 1.00 28.60 N ATOM 909 CA PHE 125 12.498 -5.055 16.107 1.00 29.91 C ATOM 910 C PHE 125 11.951 -3.886 16.917 1.00 31.79 C ATOM 911 O PHE 125 12.661 -3.350 17.752 1.00 32.75 O ATOM 912 CB PHE 125 13.552 -4.578 15.082 1.00 30.16 C ATOM 913 CG PHE 125 14.464 -5.691 14.584 1.00 27.69 C ATOM 914 CD1 PHE 125 15.609 -6.050 15.298 1.00 31.17 C ATOM 915 CD2 PHE 125 14.145 -6.416 13.445 1.00 26.47 C ATOM 916 CE1 PHE 125 16.412 -7.121 14.878 1.00 28.30 C ATOM 917 CE2 PHE 125 14.945 -7.487 13.020 1.00 28.45 C ATOM 918 CZ PHE 125 16.074 -7.838 13.735 1.00 22.43 C ATOM 919 N LEU 126 10.700 -3.493 16.704 1.00 34.66 N ATOM 920 CA LEU 126 10.130 -2.365 17.450 1.00 37.35 C ATOM 921 C LEU 126 9.991 -2.517 18.972 1.00 38.85 C ATOM 922 O LEU 126 10.297 -1.584 19.705 1.00 43.98 O ATOM 923 CB LEU 126 8.780 -1.929 16.864 1.00 40.76 C ATOM 924 CG LEU 126 8.709 -0.698 15.965 1.00 39.49 C ATOM 925 CD1 LEU 126 7.243 -0.389 15.732 1.00 39.68 C ATOM 926 CD2 LEU 126 9.403 0.500 16.600 1.00 36.41 C ATOM 927 N PRO 127 9.483 -3.663 19.469 1.00 39.92 N ATOM 928 CA PRO 127 9.330 -3.849 20.916 1.00 40.80 C ATOM 929 C PRO 127 10.547 -3.492 21.770 1.00 41.03 C ATOM 930 O PRO 127 10.468 -2.644 22.661 1.00 39.95 O ATOM 931 CB PRO 127 8.989 -5.327 21.010 1.00 39.98 C ATOM 932 CG PRO 127 8.094 -5.496 19.838 1.00 38.85 C ATOM 933 CD PRO 127 8.890 -4.807 18.752 1.00 41.99 C ATOM 934 N ASP 128 11.676 -4.127 21.482 1.00 44.48 N ATOM 935 CA ASP 128 12.913 -3.883 22.223 1.00 44.15 C ATOM 936 C ASP 128 13.278 -2.401 22.228 1.00 36.72 C ATOM 937 O ASP 128 13.599 -1.854 23.261 1.00 37.33 O ATOM 938 CB ASP 128 14.072 -4.695 21.636 1.00 59.61 C ATOM 939 CG ASP 128 13.644 -6.083 21.140 1.00 72.86 C ATOM 940 OD1 ASP 128 12.635 -6.648 21.652 1.00 77.94 O ATOM 941 OD2 ASP 128 14.332 -6.600 20.219 1.00 80.28 O ATOM 942 N MET 129 13.208 -1.742 21.083 1.00 30.25 N ATOM 943 CA MET 129 13.536 -0.332 21.037 1.00 29.06 C ATOM 944 C MET 129 12.550 0.463 21.875 1.00 32.58 C ATOM 945 O MET 129 12.915 1.454 22.499 1.00 34.55 O ATOM 946 CB MET 129 13.504 0.186 19.612 1.00 28.44 C ATOM 947 CG MET 129 14.418 -0.530 18.661 1.00 27.26 C ATOM 948 SD MET 129 14.261 0.312 17.105 1.00 31.22 S ATOM 949 CE MET 129 15.273 -0.740 16.101 1.00 30.78 C ATOM 950 N LYS 130 11.286 0.066 21.860 1.00 32.70 N ATOM 951 CA LYS 130 10.307 0.783 22.658 1.00 38.77 C ATOM 952 C LYS 130 10.608 0.575 24.133 1.00 40.72 C ATOM 953 O LYS 130 10.482 1.499 24.934 1.00 42.02 O ATOM 954 CB LYS 130 8.875 0.336 22.351 1.00 36.87 C ATOM 955 CG LYS 130 8.349 0.866 21.033 1.00 42.09 C ATOM 956 CD LYS 130 6.836 1.069 21.027 1.00 42.88 C ATOM 957 CE LYS 130 6.053 -0.219 21.162 1.00 42.07 C ATOM 958 NZ LYS 130 4.604 0.051 20.905 1.00 35.88 N ATOM 959 N ARG 131 11.034 -0.631 24.489 1.00 41.97 N ATOM 960 CA ARG 131 11.333 -0.926 25.880 1.00 47.53 C ATOM 961 C ARG 131 12.612 -0.248 26.373 1.00 46.40 C ATOM 962 O ARG 131 12.667 0.232 27.500 1.00 48.95 O ATOM 963 CB ARG 131 11.365 -2.437 26.117 1.00 53.00 C ATOM 964 CG ARG 131 12.690 -3.160 25.851 1.00 66.45 C ATOM 965 CD ARG 131 12.487 -4.678 25.861 1.00 75.03 C ATOM 966 NE ARG 131 11.395 -5.056 26.763 1.00 84.71 N ATOM 967 CZ ARG 131 10.139 -5.286 26.376 1.00 88.47 C ATOM 968 NH1 ARG 131 9.814 -5.210 25.091 1.00 88.57 N ATOM 969 NH2 ARG 131 9.209 -5.607 27.275 1.00 93.80 N ATOM 970 N ARG 132 13.639 -0.215 25.531 1.00 46.25 N ATOM 971 CA ARG 132 14.890 0.431 25.893 1.00 42.77 C ATOM 972 C ARG 132 14.584 1.923 25.960 1.00 40.94 C ATOM 973 O ARG 132 15.208 2.667 26.709 1.00 43.07 O ATOM 974 CB ARG 132 15.956 0.204 24.815 1.00 48.32 C ATOM 975 CG ARG 132 16.324 -1.251 24.494 1.00 55.02 C ATOM 976 CD ARG 132 17.510 -1.299 23.484 1.00 62.34 C ATOM 977 NE ARG 132 17.247 -2.163 22.327 1.00 63.62 N ATOM 978 CZ ARG 132 17.216 -1.752 21.058 1.00 60.00 C ATOM 979 NH1 ARG 132 17.458 -0.478 20.756 1.00 54.12 N ATOM 980 NH2 ARG 132 16.955 -2.628 20.086 1.00 55.18 N ATOM 981 N GLY 133 13.614 2.351 25.163 1.00 40.15 N ATOM 982 CA GLY 133 13.250 3.750 25.121 1.00 36.67 C ATOM 983 C GLY 133 14.071 4.488 24.086 1.00 39.59 C ATOM 984 O GLY 133 14.192 5.708 24.147 1.00 41.98 O ATOM 985 N SER 134 14.676 3.756 23.154 1.00 40.51 N ATOM 986 CA SER 134 15.477 4.378 22.096 1.00 39.12 C ATOM 987 C SER 134 15.673 3.440 20.917 1.00 32.19 C ATOM 988 O SER 134 15.537 2.220 21.040 1.00 29.80 O ATOM 989 CB SER 134 16.849 4.841 22.615 1.00 43.40 C ATOM 990 OG SER 134 17.813 3.794 22.594 1.00 48.54 O ATOM 991 N GLY 135 16.015 4.028 19.781 1.00 29.12 N ATOM 992 CA GLY 135 16.226 3.261 18.572 1.00 27.21 C ATOM 993 C GLY 135 15.902 4.176 17.419 1.00 25.67 C ATOM 994 O GLY 135 15.261 5.220 17.607 1.00 25.98 O ATOM 995 N ARG 136 16.418 3.848 16.245 1.00 23.94 N ATOM 996 CA ARG 136 16.151 4.653 15.071 1.00 26.70 C ATOM 997 C ARG 136 15.848 3.696 13.956 1.00 25.01 C ATOM 998 O ARG 136 16.428 2.622 13.887 1.00 27.79 O ATOM 999 CB ARG 136 17.331 5.559 14.722 1.00 30.80 C ATOM 1000 CG ARG 136 16.974 6.655 13.706 1.00 40.64 C ATOM 1001 CD ARG 136 17.687 7.973 14.025 1.00 52.23 C ATOM 1002 NE ARG 136 17.718 8.241 15.472 1.00 58.65 N ATOM 1003 CZ ARG 136 18.291 9.302 16.044 1.00 57.69 C ATOM 1004 NH1 ARG 136 18.855 10.240 15.302 1.00 53.71 N ATOM 1005 NH2 ARG 136 18.270 9.441 17.365 1.00 61.63 N ATOM 1006 N VAL 137 14.866 4.049 13.141 1.00 27.89 N ATOM 1007 CA VAL 137 14.439 3.222 12.029 1.00 25.55 C ATOM 1008 C VAL 137 14.458 4.128 10.840 1.00 22.92 C ATOM 1009 O VAL 137 13.927 5.228 10.901 1.00 24.48 O ATOM 1010 CB VAL 137 12.993 2.734 12.220 1.00 28.32 C ATOM 1011 CG1 VAL 137 12.519 1.959 10.988 1.00 24.68 C ATOM 1012 CG2 VAL 137 12.893 1.883 13.471 1.00 30.53 C ATOM 1013 N LEU 138 15.144 3.714 9.791 1.00 22.35 N ATOM 1014 CA LEU 138 15.189 4.511 8.585 1.00 21.76 C ATOM 1015 C LEU 138 14.542 3.669 7.507 1.00 15.69 C ATOM 1016 O LEU 138 14.864 2.503 7.353 1.00 19.89 O ATOM 1017 CB LEU 138 16.625 4.857 8.197 1.00 25.03 C ATOM 1018 CG LEU 138 17.429 5.825 9.057 1.00 24.97 C ATOM 1019 CD1 LEU 138 18.747 6.010 8.372 1.00 22.47 C ATOM 1020 CD2 LEU 138 16.735 7.162 9.190 1.00 19.73 C ATOM 1021 N VAL 139 13.620 4.260 6.767 1.00 19.20 N ATOM 1022 CA VAL 139 12.910 3.536 5.742 1.00 18.21 C ATOM 1023 C VAL 139 13.239 4.188 4.428 1.00 21.81 C ATOM 1024 O VAL 139 13.189 5.411 4.316 1.00 22.39 O ATOM 1025 CB VAL 139 11.385 3.591 5.986 1.00 21.07 C ATOM 1026 CG1 VAL 139 10.661 2.639 5.048 1.00 16.69 C ATOM 1027 CG2 VAL 139 11.069 3.240 7.434 1.00 18.48 C ATOM 1028 N THR 140 13.643 3.374 3.458 1.00 21.20 N ATOM 1029 CA THR 140 13.978 3.863 2.140 1.00 17.97 C ATOM 1030 C THR 140 12.677 4.153 1.392 1.00 23.75 C ATOM 1031 O THR 140 11.892 3.242 1.101 1.00 27.70 O ATOM 1032 CB THR 140 14.835 2.818 1.367 1.00 13.14 C ATOM 1033 OG1 THR 140 16.044 2.582 2.087 1.00 21.74 O ATOM 1034 CG2 THR 140 15.198 3.300 -0.029 1.00 11.87 C ATOM 1035 N GLY 141 12.436 5.438 1.138 1.00 24.98 N ATOM 1036 CA GLY 141 11.256 5.861 0.408 1.00 21.08 C ATOM 1037 C GLY 141 11.555 6.069 -1.075 1.00 21.67 C ATOM 1038 O GLY 141 12.513 5.538 -1.637 1.00 23.51 O ATOM 1039 N SER 142 10.741 6.884 -1.714 1.00 21.06 N ATOM 1040 CA SER 142 10.893 7.145 -3.130 1.00 24.28 C ATOM 1041 C SER 142 9.976 8.274 -3.507 1.00 20.93 C ATOM 1042 O SER 142 9.024 8.565 -2.804 1.00 25.51 O ATOM 1043 CB SER 142 10.499 5.908 -3.921 1.00 20.08 C ATOM 1044 OG SER 142 10.217 6.262 -5.256 1.00 25.35 O ATOM 1045 N VAL 143 10.256 8.950 -4.599 1.00 22.02 N ATOM 1046 CA VAL 143 9.345 10.003 -4.969 1.00 23.42 C ATOM 1047 C VAL 143 8.086 9.340 -5.540 1.00 21.80 C ATOM 1048 O VAL 143 7.057 9.980 -5.674 1.00 20.25 O ATOM 1049 CB VAL 143 9.969 10.977 -5.949 1.00 29.36 C ATOM 1050 CG1 VAL 143 11.226 11.588 -5.311 1.00 37.24 C ATOM 1051 CG2 VAL 143 10.276 10.281 -7.261 1.00 30.61 C ATOM 1052 N GLY 144 8.180 8.044 -5.835 1.00 21.15 N ATOM 1053 CA GLY 144 7.047 7.282 -6.330 1.00 18.57 C ATOM 1054 C GLY 144 6.080 6.966 -5.188 1.00 19.93 C ATOM 1055 O GLY 144 5.059 6.321 -5.378 1.00 18.10 O ATOM 1056 N GLY 145 6.466 7.346 -3.976 1.00 22.49 N ATOM 1057 CA GLY 145 5.633 7.155 -2.806 1.00 17.14 C ATOM 1058 C GLY 145 4.937 8.462 -2.468 1.00 15.71 C ATOM 1059 O GLY 145 4.111 8.510 -1.560 1.00 18.73 O ATOM 1060 N LEU 146 5.298 9.523 -3.191 1.00 16.58 N ATOM 1061 CA LEU 146 4.730 10.866 -3.020 1.00 19.22 C ATOM 1062 C LEU 146 3.822 11.325 -4.177 1.00 22.38 C ATOM 1063 O LEU 146 3.083 12.309 -4.033 1.00 23.37 O ATOM 1064 CB LEU 146 5.837 11.893 -2.847 1.00 20.14 C ATOM 1065 CG LEU 146 6.887 11.484 -1.828 1.00 26.20 C ATOM 1066 CD1 LEU 146 7.894 12.585 -1.749 1.00 33.02 C ATOM 1067 CD2 LEU 146 6.267 11.256 -0.475 1.00 29.90 C ATOM 1068 N MET 147 3.918 10.657 -5.329 1.00 16.16 N ATOM 1069 CA MET 147 3.094 10.995 -6.474 1.00 19.25 C ATOM 1070 C MET 147 3.056 9.761 -7.353 1.00 22.10 C ATOM 1071 O MET 147 4.018 8.993 -7.366 1.00 26.16 O ATOM 1072 CB MET 147 3.669 12.213 -7.212 1.00 21.32 C ATOM 1073 CG MET 147 5.044 12.008 -7.836 1.00 29.26 C ATOM 1074 SD MET 147 5.758 13.539 -8.488 1.00 31.95 S ATOM 1075 CE MET 147 6.073 14.386 -7.051 1.00 23.72 C ATOM 1076 N GLY 148 1.928 9.549 -8.037 1.00 27.30 N ATOM 1077 CA GLY 148 1.749 8.390 -8.915 1.00 24.52 C ATOM 1078 C GLY 148 2.410 8.566 -10.272 1.00 23.07 C ATOM 1079 O GLY 148 2.403 9.659 -10.826 1.00 28.05 O ATOM 1080 N LEU 149 2.963 7.497 -10.829 1.00 26.30 N ATOM 1081 CA LEU 149 3.672 7.579 -12.111 1.00 23.68 C ATOM 1082 C LEU 149 3.090 6.548 -13.018 1.00 21.40 C ATOM 1083 O LEU 149 2.990 5.384 -12.634 1.00 22.72 O ATOM 1084 CB LEU 149 5.161 7.274 -11.911 1.00 21.78 C ATOM 1085 CG LEU 149 5.751 8.126 -10.787 1.00 23.16 C ATOM 1086 CD1 LEU 149 7.077 7.578 -10.299 1.00 19.44 C ATOM 1087 CD2 LEU 149 5.833 9.589 -11.242 1.00 25.21 C ATOM 1088 N PRO 150 2.742 6.939 -14.254 1.00 23.57 N ATOM 1089 CA PRO 150 2.157 5.980 -15.197 1.00 21.40 C ATOM 1090 C PRO 150 3.038 4.750 -15.335 1.00 21.65 C ATOM 1091 O PRO 150 4.247 4.825 -15.173 1.00 24.43 O ATOM 1092 CB PRO 150 2.035 6.790 -16.490 1.00 19.64 C ATOM 1093 CG PRO 150 3.118 7.841 -16.354 1.00 25.07 C ATOM 1094 CD PRO 150 3.013 8.234 -14.903 1.00 26.64 C ATOM 1095 N PHE 151 2.416 3.607 -15.569 1.00 18.66 N ATOM 1096 CA PHE 151 3.125 2.346 -15.696 1.00 20.09 C ATOM 1097 C PHE 151 3.872 1.829 -14.463 1.00 23.66 C ATOM 1098 O PHE 151 4.476 0.757 -14.527 1.00 24.10 O ATOM 1099 CB PHE 151 3.993 2.346 -16.946 1.00 20.46 C ATOM 1100 CG PHE 151 3.192 2.495 -18.213 1.00 20.60 C ATOM 1101 CD1 PHE 151 2.431 1.435 -18.694 1.00 17.64 C ATOM 1102 CD2 PHE 151 3.166 3.700 -18.898 1.00 15.81 C ATOM 1103 CE1 PHE 151 1.659 1.569 -19.831 1.00 15.00 C ATOM 1104 CE2 PHE 151 2.393 3.847 -20.038 1.00 19.62 C ATOM 1105 CZ PHE 151 1.635 2.776 -20.507 1.00 19.45 C ATOM 1106 N ASN 152 3.785 2.554 -13.339 1.00 25.72 N ATOM 1107 CA ASN 152 4.402 2.140 -12.053 1.00 28.96 C ATOM 1108 C ASN 152 3.328 1.939 -10.987 1.00 29.10 C ATOM 1109 O ASN 152 3.630 1.992 -9.799 1.00 33.01 O ATOM 1110 CB ASN 152 5.354 3.207 -11.504 1.00 29.98 C ATOM 1111 CG ASN 152 6.638 3.289 -12.269 1.00 31.10 C ATOM 1112 OD1 ASN 152 7.603 2.590 -11.964 1.00 36.32 O ATOM 1113 ND2 ASN 152 6.669 4.158 -13.266 1.00 28.61 N ATOM 1114 N ASP 153 2.088 1.699 -11.413 1.00 28.87 N ATOM 1115 CA ASP 153 0.923 1.533 -10.523 1.00 25.81 C ATOM 1116 C ASP 153 1.122 0.750 -9.230 1.00 17.31 C ATOM 1117 O ASP 153 0.892 1.273 -8.156 1.00 19.12 O ATOM 1118 CB ASP 153 -0.228 0.921 -11.308 1.00 24.01 C ATOM 1119 CG ASP 153 -0.472 1.632 -12.596 1.00 24.52 C ATOM 1120 OD1 ASP 153 -0.791 2.821 -12.564 1.00 31.47 O ATOM 1121 OD2 ASP 153 -0.326 1.010 -13.651 1.00 34.25 O ATOM 1122 N VAL 154 1.572 -0.494 -9.340 1.00 19.46 N ATOM 1123 CA VAL 154 1.784 -1.365 -8.187 1.00 22.21 C ATOM 1124 C VAL 154 3.016 -0.967 -7.360 1.00 27.21 C ATOM 1125 O VAL 154 3.044 -1.149 -6.140 1.00 26.95 O ATOM 1126 CB VAL 154 1.866 -2.845 -8.627 1.00 18.24 C ATOM 1127 CG1 VAL 154 2.068 -3.753 -7.415 1.00 20.87 C ATOM 1128 CG2 VAL 154 0.590 -3.234 -9.390 1.00 16.43 C ATOM 1129 N TYR 155 4.028 -0.409 -8.022 1.00 29.23 N ATOM 1130 CA TYR 155 5.234 0.046 -7.334 1.00 22.04 C ATOM 1131 C TYR 155 4.898 1.240 -6.419 1.00 17.45 C ATOM 1132 O TYR 155 5.294 1.290 -5.251 1.00 10.66 O ATOM 1133 CB TYR 155 6.302 0.446 -8.356 1.00 25.53 C ATOM 1134 CG TYR 155 7.499 1.024 -7.674 1.00 21.68 C ATOM 1135 CD1 TYR 155 8.287 0.231 -6.834 1.00 23.18 C ATOM 1136 CD2 TYR 155 7.815 2.376 -7.815 1.00 19.66 C ATOM 1137 CE1 TYR 155 9.376 0.774 -6.142 1.00 25.01 C ATOM 1138 CE2 TYR 155 8.887 2.935 -7.136 1.00 19.44 C ATOM 1139 CZ TYR 155 9.671 2.130 -6.303 1.00 21.84 C ATOM 1140 OH TYR 155 10.759 2.680 -5.654 1.00 29.34 O ATOM 1141 N CYS 156 4.218 2.221 -6.998 1.00 16.83 N ATOM 1142 CA CYS 156 3.763 3.411 -6.282 1.00 23.06 C ATOM 1143 C CYS 156 2.814 2.991 -5.138 1.00 25.52 C ATOM 1144 O CYS 156 2.832 3.575 -4.049 1.00 27.52 O ATOM 1145 CB CYS 156 3.019 4.345 -7.250 1.00 20.53 C ATOM 1146 SG CYS 156 4.070 5.170 -8.445 1.00 24.12 S ATOM 1147 N ALA 157 1.942 2.023 -5.414 1.00 22.32 N ATOM 1148 CA ALA 157 1.038 1.531 -4.403 1.00 20.79 C ATOM 1149 C ALA 157 1.864 1.111 -3.176 1.00 20.69 C ATOM 1150 O ALA 157 1.594 1.563 -2.063 1.00 22.79 O ATOM 1151 CB ALA 157 0.213 0.348 -4.943 1.00 20.68 C ATOM 1152 N SER 158 2.902 0.304 -3.382 1.00 22.29 N ATOM 1153 CA SER 158 3.738 -0.136 -2.267 1.00 21.17 C ATOM 1154 C SER 158 4.510 1.004 -1.572 1.00 19.51 C ATOM 1155 O SER 158 4.623 0.988 -0.357 1.00 22.69 O ATOM 1156 CB SER 158 4.667 -1.309 -2.668 1.00 24.08 C ATOM 1157 OG SER 158 5.676 -0.935 -3.601 1.00 22.69 O ATOM 1158 N LYS 159 5.003 2.000 -2.313 1.00 17.92 N ATOM 1159 CA LYS 159 5.727 3.112 -1.689 1.00 15.59 C ATOM 1160 C LYS 159 4.754 4.034 -0.976 1.00 16.35 C ATOM 1161 O LYS 159 5.092 4.630 0.042 1.00 17.01 O ATOM 1162 CB LYS 159 6.570 3.915 -2.690 1.00 12.02 C ATOM 1163 CG LYS 159 7.490 3.086 -3.509 1.00 20.28 C ATOM 1164 CD LYS 159 8.221 2.030 -2.671 1.00 28.77 C ATOM 1165 CE LYS 159 9.266 2.649 -1.750 1.00 39.93 C ATOM 1166 NZ LYS 159 10.351 1.690 -1.298 1.00 41.55 N ATOM 1167 N PHE 160 3.560 4.203 -1.539 1.00 19.21 N ATOM 1168 CA PHE 160 2.536 5.020 -0.896 1.00 17.22 C ATOM 1169 C PHE 160 2.159 4.281 0.413 1.00 14.66 C ATOM 1170 O PHE 160 2.035 4.892 1.473 1.00 19.67 O ATOM 1171 CB PHE 160 1.306 5.119 -1.800 1.00 18.57 C ATOM 1172 CG PHE 160 1.246 6.364 -2.643 1.00 17.63 C ATOM 1173 CD1 PHE 160 2.058 6.514 -3.750 1.00 17.64 C ATOM 1174 CD2 PHE 160 0.320 7.361 -2.363 1.00 18.42 C ATOM 1175 CE1 PHE 160 1.949 7.638 -4.569 1.00 16.04 C ATOM 1176 CE2 PHE 160 0.201 8.496 -3.185 1.00 16.82 C ATOM 1177 CZ PHE 160 1.013 8.632 -4.284 1.00 17.67 C ATOM 1178 N ALA 161 2.062 2.954 0.346 1.00 15.62 N ATOM 1179 CA ALA 161 1.723 2.137 1.508 1.00 15.11 C ATOM 1180 C ALA 161 2.687 2.428 2.632 1.00 19.34 C ATOM 1181 O ALA 161 2.275 2.594 3.783 1.00 23.36 O ATOM 1182 CB ALA 161 1.774 0.671 1.163 1.00 15.15 C ATOM 1183 N LEU 162 3.973 2.525 2.298 1.00 21.50 N ATOM 1184 CA LEU 162 5.010 2.823 3.302 1.00 19.27 C ATOM 1185 C LEU 162 4.839 4.196 3.931 1.00 18.46 C ATOM 1186 O LEU 162 5.140 4.382 5.105 1.00 18.19 O ATOM 1187 CB LEU 162 6.409 2.748 2.700 1.00 22.94 C ATOM 1188 CG LEU 162 6.929 1.376 2.316 1.00 26.37 C ATOM 1189 CD1 LEU 162 8.276 1.576 1.676 1.00 27.27 C ATOM 1190 CD2 LEU 162 7.019 0.472 3.541 1.00 23.83 C ATOM 1191 N GLU 163 4.405 5.169 3.140 1.00 18.46 N ATOM 1192 CA GLU 163 4.207 6.514 3.655 1.00 18.42 C ATOM 1193 C GLU 163 3.133 6.465 4.727 1.00 20.40 C ATOM 1194 O GLU 163 3.260 7.093 5.771 1.00 22.25 O ATOM 1195 CB GLU 163 3.726 7.447 2.546 1.00 20.06 C ATOM 1196 CG GLU 163 4.728 7.727 1.474 1.00 12.99 C ATOM 1197 CD GLU 163 5.818 8.609 1.974 1.00 23.47 C ATOM 1198 OE1 GLU 163 5.490 9.621 2.634 1.00 22.88 O ATOM 1199 OE2 GLU 163 7.001 8.295 1.714 1.00 20.79 O ATOM 1200 N GLY 164 2.074 5.710 4.457 1.00 21.30 N ATOM 1201 CA GLY 164 0.972 5.628 5.387 1.00 16.99 C ATOM 1202 C GLY 164 1.330 4.834 6.599 1.00 16.33 C ATOM 1203 O GLY 164 1.031 5.243 7.717 1.00 19.68 O ATOM 1204 N LEU 165 1.987 3.704 6.381 1.00 16.47 N ATOM 1205 CA LEU 165 2.392 2.849 7.478 1.00 15.51 C ATOM 1206 C LEU 165 3.288 3.614 8.442 1.00 22.66 C ATOM 1207 O LEU 165 3.054 3.598 9.647 1.00 25.76 O ATOM 1208 CB LEU 165 3.127 1.620 6.959 1.00 13.37 C ATOM 1209 CG LEU 165 3.763 0.778 8.069 1.00 22.35 C ATOM 1210 CD1 LEU 165 2.719 -0.167 8.628 1.00 24.77 C ATOM 1211 CD2 LEU 165 4.982 -0.011 7.534 1.00 20.64 C ATOM 1212 N CYS 166 4.269 4.340 7.908 1.00 22.12 N ATOM 1213 CA CYS 166 5.219 5.091 8.730 1.00 21.42 C ATOM 1214 C CYS 166 4.679 6.343 9.403 1.00 19.50 C ATOM 1215 O CYS 166 5.062 6.658 10.526 1.00 19.16 O ATOM 1216 CB CYS 166 6.496 5.419 7.927 1.00 24.34 C ATOM 1217 SG CYS 166 7.420 3.933 7.497 1.00 25.67 S ATOM 1218 N GLU 167 3.815 7.074 8.721 1.00 19.54 N ATOM 1219 CA GLU 167 3.249 8.280 9.301 1.00 24.48 C ATOM 1220 C GLU 167 2.399 7.904 10.521 1.00 25.27 C ATOM 1221 O GLU 167 2.421 8.596 11.537 1.00 29.26 O ATOM 1222 CB GLU 167 2.402 9.006 8.248 1.00 27.84 C ATOM 1223 CG GLU 167 2.253 10.482 8.511 1.00 27.65 C ATOM 1224 CD GLU 167 1.701 11.220 7.325 1.00 26.07 C ATOM 1225 OE1 GLU 167 2.500 11.673 6.487 1.00 20.94 O ATOM 1226 OE2 GLU 167 0.470 11.362 7.246 1.00 22.02 O ATOM 1227 N SER 168 1.709 6.768 10.434 1.00 20.96 N ATOM 1228 CA SER 168 0.867 6.283 11.520 1.00 20.00 C ATOM 1229 C SER 168 1.683 5.902 12.767 1.00 20.37 C ATOM 1230 O SER 168 1.327 6.257 13.880 1.00 19.20 O ATOM 1231 CB SER 168 0.038 5.101 11.019 1.00 15.63 C ATOM 1232 OG SER 168 -0.734 5.481 9.887 1.00 19.39 O ATOM 1233 N LEU 169 2.756 5.142 12.573 1.00 25.96 N ATOM 1234 CA LEU 169 3.647 4.729 13.660 1.00 28.42 C ATOM 1235 C LEU 169 4.328 5.924 14.297 1.00 26.25 C ATOM 1236 O LEU 169 4.415 6.006 15.498 1.00 30.21 O ATOM 1237 CB LEU 169 4.717 3.772 13.152 1.00 26.45 C ATOM 1238 CG LEU 169 4.259 2.320 13.115 1.00 28.07 C ATOM 1239 CD1 LEU 169 5.231 1.491 12.295 1.00 31.69 C ATOM 1240 CD2 LEU 169 4.168 1.795 14.534 1.00 19.79 C ATOM 1241 N ALA 170 4.849 6.816 13.478 1.00 23.75 N ATOM 1242 CA ALA 170 5.497 8.012 13.957 1.00 25.95 C ATOM 1243 C ALA 170 4.581 8.757 14.926 1.00 30.08 C ATOM 1244 O ALA 170 5.056 9.318 15.916 1.00 37.07 O ATOM 1245 CB ALA 170 5.868 8.913 12.782 1.00 21.51 C ATOM 1246 N VAL 171 3.276 8.768 14.665 1.00 35.65 N ATOM 1247 CA VAL 171 2.353 9.471 15.572 1.00 36.74 C ATOM 1248 C VAL 171 2.352 8.838 16.981 1.00 38.94 C ATOM 1249 O VAL 171 2.311 9.537 18.000 1.00 41.14 O ATOM 1250 CB VAL 171 0.901 9.564 15.009 1.00 34.07 C ATOM 1251 CG1 VAL 171 0.004 10.281 16.006 1.00 31.92 C ATOM 1252 CG2 VAL 171 0.888 10.331 13.697 1.00 30.55 C ATOM 1253 N LEU 172 2.469 7.519 17.034 1.00 37.84 N ATOM 1254 CA LEU 172 2.483 6.801 18.297 1.00 36.18 C ATOM 1255 C LEU 172 3.867 6.834 18.996 1.00 37.05 C ATOM 1256 O LEU 172 3.967 7.132 20.186 1.00 35.99 O ATOM 1257 CB LEU 172 2.014 5.367 18.037 1.00 31.35 C ATOM 1258 CG LEU 172 2.119 4.331 19.147 1.00 34.32 C ATOM 1259 CD1 LEU 172 1.225 4.688 20.338 1.00 37.76 C ATOM 1260 CD2 LEU 172 1.761 2.985 18.569 1.00 34.87 C ATOM 1261 N LEU 173 4.923 6.567 18.232 1.00 36.43 N ATOM 1262 CA LEU 173 6.298 6.528 18.719 1.00 32.31 C ATOM 1263 C LEU 173 6.848 7.813 19.289 1.00 34.39 C ATOM 1264 O LEU 173 7.736 7.772 20.130 1.00 27.34 O ATOM 1265 CB LEU 173 7.229 6.078 17.606 1.00 28.77 C ATOM 1266 CG LEU 173 6.982 4.663 17.096 1.00 34.81 C ATOM 1267 CD1 LEU 173 8.047 4.279 16.076 1.00 33.13 C ATOM 1268 CD2 LEU 173 6.968 3.702 18.270 1.00 34.30 C ATOM 1269 N LEU 174 6.331 8.944 18.825 1.00 38.86 N ATOM 1270 CA LEU 174 6.798 10.247 19.267 1.00 40.11 C ATOM 1271 C LEU 174 7.205 10.266 20.733 1.00 45.09 C ATOM 1272 O LEU 174 8.361 10.558 21.038 1.00 50.18 O ATOM 1273 CB LEU 174 5.764 11.329 18.955 1.00 41.55 C ATOM 1274 CG LEU 174 6.291 12.761 18.913 1.00 44.93 C ATOM 1275 CD1 LEU 174 7.398 12.837 17.878 1.00 42.52 C ATOM 1276 CD2 LEU 174 5.169 13.735 18.557 1.00 42.39 C ATOM 1277 N PRO 175 6.291 9.907 21.662 1.00 49.33 N ATOM 1278 CA PRO 175 6.660 9.910 23.086 1.00 48.95 C ATOM 1279 C PRO 175 7.510 8.725 23.600 1.00 47.94 C ATOM 1280 O PRO 175 7.959 8.755 24.738 1.00 49.56 O ATOM 1281 CB PRO 175 5.305 9.970 23.784 1.00 46.43 C ATOM 1282 CG PRO 175 4.443 9.195 22.877 1.00 47.98 C ATOM 1283 CD PRO 175 4.834 9.730 21.524 1.00 49.87 C ATOM 1284 N PHE 176 7.760 7.711 22.772 1.00 48.13 N ATOM 1285 CA PHE 176 8.557 6.537 23.183 1.00 43.59 C ATOM 1286 C PHE 176 10.089 6.644 23.046 1.00 40.59 C ATOM 1287 O PHE 176 10.831 5.743 23.467 1.00 38.70 O ATOM 1288 CB PHE 176 8.065 5.292 22.443 1.00 43.92 C ATOM 1289 CG PHE 176 6.723 4.798 22.913 1.00 44.17 C ATOM 1290 CD1 PHE 176 5.571 5.519 22.651 1.00 43.53 C ATOM 1291 CD2 PHE 176 6.617 3.595 23.612 1.00 43.64 C ATOM 1292 CE1 PHE 176 4.334 5.050 23.073 1.00 46.70 C ATOM 1293 CE2 PHE 176 5.387 3.119 24.034 1.00 43.21 C ATOM 1294 CZ PHE 176 4.246 3.847 23.764 1.00 43.57 C ATOM 1295 N GLY 177 10.558 7.722 22.430 1.00 34.93 N ATOM 1296 CA GLY 177 11.986 7.892 22.262 1.00 37.28 C ATOM 1297 C GLY 177 12.612 7.221 21.050 1.00 35.40 C ATOM 1298 O GLY 177 13.800 7.402 20.803 1.00 37.18 O ATOM 1299 N VAL 178 11.849 6.438 20.296 1.00 37.56 N ATOM 1300 CA VAL 178 12.414 5.798 19.116 1.00 37.04 C ATOM 1301 C VAL 178 12.010 6.615 17.881 1.00 37.61 C ATOM 1302 O VAL 178 10.894 7.116 17.822 1.00 36.82 O ATOM 1303 CB VAL 178 12.096 4.269 19.040 1.00 33.11 C ATOM 1304 CG1 VAL 178 11.480 3.767 20.336 1.00 28.26 C ATOM 1305 CG2 VAL 178 11.306 3.925 17.831 1.00 30.40 C ATOM 1306 N HIS 179 12.958 6.832 16.958 1.00 40.42 N ATOM 1307 CA HIS 179 12.731 7.659 15.755 1.00 39.71 C ATOM 1308 C HIS 179 12.633 6.923 14.424 1.00 33.18 C ATOM 1309 O HIS 179 13.491 6.134 14.090 1.00 37.42 O ATOM 1310 CB HIS 179 13.813 8.730 15.641 1.00 39.51 C ATOM 1311 CG HIS 179 14.094 9.437 16.928 1.00 46.80 C ATOM 1312 ND1 HIS 179 13.369 10.531 17.355 1.00 45.45 N ATOM 1313 CD2 HIS 179 15.029 9.207 17.883 1.00 47.75 C ATOM 1314 CE1 HIS 179 13.846 10.944 18.515 1.00 46.52 C ATOM 1315 NE2 HIS 179 14.853 10.158 18.857 1.00 47.72 N ATOM 1316 N LEU 180 11.622 7.278 13.640 1.00 31.10 N ATOM 1317 CA LEU 180 11.341 6.674 12.345 1.00 26.01 C ATOM 1318 C LEU 180 11.463 7.783 11.311 1.00 29.13 C ATOM 1319 O LEU 180 10.878 8.855 11.493 1.00 29.26 O ATOM 1320 CB LEU 180 9.899 6.179 12.354 1.00 29.93 C ATOM 1321 CG LEU 180 9.202 5.305 11.311 1.00 35.00 C ATOM 1322 CD1 LEU 180 9.702 5.597 9.922 1.00 36.80 C ATOM 1323 CD2 LEU 180 9.391 3.848 11.654 1.00 38.35 C ATOM 1324 N SER 181 12.231 7.538 10.249 1.00 26.89 N ATOM 1325 CA SER 181 12.405 8.505 9.157 1.00 22.36 C ATOM 1326 C SER 181 12.339 7.785 7.815 1.00 23.24 C ATOM 1327 O SER 181 12.727 6.621 7.697 1.00 24.53 O ATOM 1328 CB SER 181 13.752 9.241 9.235 1.00 19.64 C ATOM 1329 OG SER 181 13.784 10.169 10.293 1.00 20.87 O ATOM 1330 N LEU 182 11.797 8.483 6.825 1.00 22.71 N ATOM 1331 CA LEU 182 11.682 8.014 5.460 1.00 19.15 C ATOM 1332 C LEU 182 12.682 8.882 4.683 1.00 19.80 C ATOM 1333 O LEU 182 12.717 10.108 4.865 1.00 19.50 O ATOM 1334 CB LEU 182 10.265 8.293 4.940 1.00 14.70 C ATOM 1335 CG LEU 182 9.187 7.366 5.481 1.00 15.99 C ATOM 1336 CD1 LEU 182 7.898 8.106 5.619 1.00 9.14 C ATOM 1337 CD2 LEU 182 9.036 6.203 4.543 1.00 18.04 C ATOM 1338 N ILE 183 13.553 8.253 3.898 1.00 19.56 N ATOM 1339 CA ILE 183 14.512 9.001 3.069 1.00 23.20 C ATOM 1340 C ILE 183 13.946 8.924 1.652 1.00 21.26 C ATOM 1341 O ILE 183 13.919 7.860 1.034 1.00 22.64 O ATOM 1342 CB ILE 183 15.950 8.404 3.121 1.00 21.57 C ATOM 1343 CG1 ILE 183 16.413 8.246 4.578 1.00 23.31 C ATOM 1344 CG2 ILE 183 16.908 9.300 2.376 1.00 15.11 C ATOM 1345 CD1 ILE 183 16.503 9.533 5.363 1.00 26.10 C ATOM 1346 N GLU 184 13.395 10.037 1.190 1.00 21.68 N ATOM 1347 CA GLU 184 12.770 10.095 -0.120 1.00 21.35 C ATOM 1348 C GLU 184 13.761 10.215 -1.251 1.00 21.80 C ATOM 1349 O GLU 184 14.227 11.308 -1.557 1.00 22.95 O ATOM 1350 CB GLU 184 11.762 11.256 -0.189 1.00 26.03 C ATOM 1351 CG GLU 184 10.774 11.347 0.992 1.00 25.53 C ATOM 1352 CD GLU 184 9.790 10.172 1.085 1.00 28.33 C ATOM 1353 OE1 GLU 184 9.948 9.185 0.341 1.00 26.78 O ATOM 1354 OE2 GLU 184 8.853 10.234 1.915 1.00 25.04 O MASTER 201 0 0 15 7 0 1 6 2227 1 0 26 END .