HEADER OXYGEN TRANSPORT 13-DEC-97 101M TITLE SPERM WHALE MYOGLOBIN F46V N-BUTYL ISOCYANIDE AT PH 9.0 COMPND MOL_ID: 1; COMPND 2 MOLECULE: MYOGLOBIN; COMPND 3 CHAIN: NULL; COMPND 4 ENGINEERED: SYNTHETIC GENE; COMPND 5 MUTATION: INS(M0), F46V, D122N SOURCE MOL_ID: 1; SOURCE 2 ORGANISM_SCIENTIFIC: PHYSETER CATODON; SOURCE 3 ORGANISM_COMMON: SPERM WHALE; SOURCE 4 TISSUE: SKELETAL MUSCLE; SOURCE 5 CELLULAR_LOCATION: CYTOPLASM; SOURCE 6 EXPRESSION_SYSTEM: ESCHERICHIA COLI; SOURCE 7 EXPRESSION_SYSTEM_STRAIN: PHAGE RESISTANT TB1; SOURCE 8 EXPRESSION_SYSTEM_CELLULAR_LOCATION: CYTOPLASM; SOURCE 9 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID; SOURCE 10 EXPRESSION_SYSTEM_PLASMID: PEMBL 19+ KEYWDS LIGAND BINDING, OXYGEN STORAGE, OXYGEN BINDING, HEME, KEYWDS 2 OXYGEN TRANSPORT EXPDTA X-RAY DIFFRACTION AUTHOR R.D.SMITH,J.S.OLSON,G.N.PHILLIPS JUNIOR REVDAT 2 17-MAY-99 101M 1 JRNL HELIX REVDAT 1 08-APR-98 101M 0 JRNL AUTH R.D.SMITH JRNL TITL CORRELATIONS BETWEEN BOUND N-ALKYL ISOCYANIDE JRNL TITL 2 ORIENTATIONS AND PATHWAYS FOR LIGAND BINDING JRNL TITL 3 IN RECOMBINANT MYOGLOBINS JRNL REF THESIS, RICE JRNL REFN US ISSN 1047-8477 0806 REMARK 1 REMARK 2 REMARK 2 RESOLUTION. 2.07 ANGSTROMS. REMARK 3 REMARK 3 REFINEMENT. REMARK 3 PROGRAM : X-PLOR 3.851 REMARK 3 AUTHORS : BRUNGER REMARK 3 REMARK 3 DATA USED IN REFINEMENT. REMARK 3 RESOLUTION RANGE HIGH (ANGSTROMS) : 2.07 REMARK 3 RESOLUTION RANGE LOW (ANGSTROMS) : 5.00 REMARK 3 DATA CUTOFF (SIGMA(F)) : 0.0 REMARK 3 DATA CUTOFF HIGH (ABS(F)) : 10000000.00 REMARK 3 DATA CUTOFF LOW (ABS(F)) : 0.001000 REMARK 3 COMPLETENESS (WORKING+TEST) (%) : 97.8 REMARK 3 NUMBER OF REFLECTIONS : 12340 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 SET) : 0.157 REMARK 3 FREE R VALUE : 0.202 REMARK 3 FREE R VALUE TEST SET SIZE (%) : 9.9 REMARK 3 FREE R VALUE TEST SET COUNT : 1220 REMARK 3 ESTIMATED ERROR OF FREE R VALUE : 0.006 REMARK 3 REMARK 3 FIT IN THE HIGHEST RESOLUTION BIN. REMARK 3 TOTAL NUMBER OF BINS USED : 8 REMARK 3 BIN RESOLUTION RANGE HIGH (A) : 2.07 REMARK 3 BIN RESOLUTION RANGE LOW (A) : 2.16 REMARK 3 BIN COMPLETENESS (WORKING+TEST) (%) : 92.9 REMARK 3 REFLECTIONS IN BIN (WORKING SET) : 1287 REMARK 3 BIN R VALUE (WORKING SET) : 0.209 REMARK 3 BIN FREE R VALUE : 0.211 REMARK 3 BIN FREE R VALUE TEST SET SIZE (%) : 11.1 REMARK 3 BIN FREE R VALUE TEST SET COUNT : 161 REMARK 3 ESTIMATED ERROR OF BIN FREE R VALUE : 0.017 REMARK 3 REMARK 3 NUMBER OF NON-HYDROGEN ATOMS USED IN REFINEMENT. REMARK 3 PROTEIN ATOMS : 1221 REMARK 3 NUCLEIC ACID ATOMS : 0 REMARK 3 HETEROGEN ATOMS : 49 REMARK 3 SOLVENT ATOMS : 143 REMARK 3 REMARK 3 B VALUES. REMARK 3 FROM WILSON PLOT (A**2) : 14.0 REMARK 3 MEAN B VALUE (OVERALL, A**2) : 24.8 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) : 0.18 REMARK 3 ESD FROM SIGMAA (A) : 0.17 REMARK 3 LOW RESOLUTION CUTOFF (A) : 5.00 REMARK 3 REMARK 3 CROSS-VALIDATED ESTIMATED COORDINATE ERROR. REMARK 3 ESD FROM C-V LUZZATI PLOT (A) : 0.23 REMARK 3 ESD FROM C-V SIGMAA (A) : 0.15 REMARK 3 REMARK 3 RMS DEVIATIONS FROM IDEAL VALUES. REMARK 3 BOND LENGTHS (A) : 0.010 REMARK 3 BOND ANGLES (DEGREES) : 1.4 REMARK 3 DIHEDRAL ANGLES (DEGREES) : 18.9 REMARK 3 IMPROPER ANGLES (DEGREES) : 1.36 REMARK 3 REMARK 3 ISOTROPIC THERMAL MODEL : RESTRAINED REMARK 3 REMARK 3 ISOTROPIC THERMAL FACTOR RESTRAINTS. RMS SIGMA REMARK 3 MAIN-CHAIN BOND (A**2) : 2.47 ; 1.50 REMARK 3 MAIN-CHAIN ANGLE (A**2) : 2.86 ; 2.00 REMARK 3 SIDE-CHAIN BOND (A**2) : 8.73 ; 2.50 REMARK 3 SIDE-CHAIN ANGLE (A**2) : 12.90 ; 2.50 REMARK 3 REMARK 3 NCS MODEL : NONE 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 : PARHCSDX.PRO REMARK 3 PARAMETER FILE 2 : PARAMETER.HEME REMARK 3 PARAMETER FILE 3 : PARAMETER.NBNC REMARK 3 PARAMETER FILE 4 : PARAM19.SOLV REMARK 3 TOPOLOGY FILE 1 : TOPHCSDX.PRO REMARK 3 TOPOLOGY FILE 2 : TOPOLOGY.HEME REMARK 3 TOPOLOGY FILE 3 : TOPOLOGY.NBNC REMARK 3 TOPOLOGY FILE 4 : TOPH19.SOLV REMARK 3 REMARK 3 OTHER REFINEMENT REMARKS: NULL REMARK 4 REMARK 4 101M COMPLIES WITH FORMAT V. 2.2, 16-DEC-1996 REMARK 200 REMARK 200 EXPERIMENTAL DETAILS REMARK 200 EXPERIMENT TYPE : X-RAY DIFFRACTION REMARK 200 DATE OF DATA COLLECTION : SEP-1994 REMARK 200 TEMPERATURE (KELVIN) : 292 REMARK 200 PH : 9.0 REMARK 200 NUMBER OF CRYSTALS USED : 1 REMARK 200 REMARK 200 SYNCHROTRON (Y/N) : N REMARK 200 RADIATION SOURCE : NULL REMARK 200 BEAMLINE : NULL REMARK 200 X-RAY GENERATOR MODEL : SIEMENS REMARK 200 MONOCHROMATIC OR LAUE (M/L) : M REMARK 200 WAVELENGTH OR RANGE (A) : 1.5418 REMARK 200 MONOCHROMATOR : GRAPHITE REMARK 200 OPTICS : PINHOLE COLLIMATOR REMARK 200 REMARK 200 DETECTOR TYPE : IMAGE PLATE REMARK 200 DETECTOR MANUFACTURER : RIGAKU REMARK 200 INTENSITY-INTEGRATION SOFTWARE : XDS REMARK 200 DATA SCALING SOFTWARE : XSCALE REMARK 200 REMARK 200 NUMBER OF UNIQUE REFLECTIONS : 13624 REMARK 200 RESOLUTION RANGE HIGH (A) : 2.07 REMARK 200 RESOLUTION RANGE LOW (A) : 6.00 REMARK 200 REJECTION CRITERIA (SIGMA(I)) : 0. REMARK 200 REMARK 200 OVERALL. REMARK 200 COMPLETENESS FOR RANGE (%) : 99.9 REMARK 200 DATA REDUNDANCY : 7.45 REMARK 200 R MERGE (I) : 0.070 REMARK 200 R SYM (I) : NULL REMARK 200 FOR THE DATA SET : NULL REMARK 200 REMARK 200 IN THE HIGHEST RESOLUTION SHELL. REMARK 200 HIGHEST RESOLUTION SHELL, RANGE HIGH (A) : 2.07 REMARK 200 HIGHEST RESOLUTION SHELL, RANGE LOW (A) : 2.08 REMARK 200 COMPLETENESS FOR SHELL (%) : 100. REMARK 200 DATA REDUNDANCY IN SHELL : 7.1 REMARK 200 R MERGE FOR SHELL (I) : 0.297 REMARK 200 R SYM FOR SHELL (I) : NULL REMARK 200 FOR SHELL : NULL REMARK 200 REMARK 200 METHOD USED TO DETERMINE THE STRUCTURE: MOLECULAR REMARK 200 REPLACEMENT REMARK 200 SOFTWARE USED: X-PLOR 3.851 REMARK 200 STARTING MODEL: SPERM WHALE MYOGLOBIN 0M, D122N (DEOXY) REMARK 200 REMARK 200 REMARK: NULL REMARK 280 REMARK 280 CRYSTAL REMARK 280 SOLVENT CONTENT, VS (%): 60.27 REMARK 280 MATTHEWS COEFFICIENT, VM (ANGSTROMS**3/DA): 3.096 REMARK 280 REMARK 280 CRYSTALLIZATION CONDITIONS: 3.0 M AMMONIUM SULFATE, 20 MM REMARK 280 TRIS, 1MM EDTA, PH 9.0 REMARK 290 REMARK 290 CRYSTALLOGRAPHIC SYMMETRY REMARK 290 SYMMETRY OPERATORS FOR SPACE GROUP: P 6 REMARK 290 REMARK 290 SYMOP SYMMETRY REMARK 290 NNNMMM OPERATOR REMARK 290 1555 X,Y,Z REMARK 290 2555 -Y,X-Y,Z REMARK 290 3555 Y-X,-X,Z REMARK 290 4555 -X,-Y,Z REMARK 290 5555 Y,Y-X,Z REMARK 290 6555 X-Y,X,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 -0.500000 -0.865982 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866069 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 3 -0.500000 0.865982 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866069 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 4 -1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 4 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 5 0.500000 0.865982 0.000000 0.00000 REMARK 290 SMTRY2 5 -0.866069 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 6 0.500000 -0.865982 0.000000 0.00000 REMARK 290 SMTRY2 6 0.866069 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 1.000000 0.00000 REMARK 290 REMARK 290 REMARK: NULL REMARK 375 REMARK 375 SPECIAL POSITION REMARK 375 HOH 332 LIES ON A SPECIAL POSITION. REMARK 500 REMARK 500 GEOMETRY AND STEREOCHEMISTRY REMARK 500 SUBTOPIC: CLOSE CONTACTS REMARK 500 REMARK 500 THE FOLLOWING ATOMS THAT ARE RELATED BY CRYSTALLOGRAPHIC REMARK 500 SYMMETRY ARE IN CLOSE CONTACT. SOME OF THESE MAY BE ATOMS REMARK 500 LOCATED ON SPECIAL POSITIONS IN THE CELL. ATOMS WITH REMARK 500 NON-BLANK ALTERNATE LOCATION INDICATORS ARE NOT INCLUDED REMARK 500 IN THE CALCULATIONS. REMARK 500 REMARK 500 DISTANCE CUTOFF: REMARK 500 2.2 ANGSTROMS FOR CONTACTS NOT INVOLVING HYDROGEN ATOMS REMARK 500 1.6 ANGSTROMS FOR CONTACTS INVOLVING HYDROGEN ATOMS REMARK 500 REMARK 500 ATM1 RES C SSEQI ATM2 RES C SSEQI SSYMOP DISTANCE REMARK 500 O HOH 332 O HOH 332 2655 0.12 REMARK 800 REMARK 800 SITE REMARK 800 SITE_IDENTIFIER: HEM REMARK 800 SITE_DESCRIPTION: LIGAND BINDING SITE. REMARK 900 REMARK 900 RELATED ENTRIES REMARK 900 THIS ENTRY IS RELATED TO PDB ENTRIES 102M, 103M, 104M, REMARK 900 105M, 106M, 107M, 108M, 109M, 110M, 111M, 112M. REMARK 999 REMARK 999 SEQUENCE REMARK 999 MET 0 - MET 0 - MISSING FROM SWS P02185 DBREF 101M 1 153 SWS P02185 MYG_PHYCA 1 153 SEQADV 101M VAL 46 SWS P02185 PHE 46 ENGINEERED SEQADV 101M ASN 122 SWS P02185 ASP 122 ENGINEERED SEQRES 1 154 MET VAL LEU SER GLU GLY GLU TRP GLN LEU VAL LEU HIS SEQRES 2 154 VAL TRP ALA LYS VAL GLU ALA ASP VAL ALA GLY HIS GLY SEQRES 3 154 GLN ASP ILE LEU ILE ARG LEU PHE LYS SER HIS PRO GLU SEQRES 4 154 THR LEU GLU LYS PHE ASP ARG VAL LYS HIS LEU LYS THR SEQRES 5 154 GLU ALA GLU MET LYS ALA SER GLU ASP LEU LYS LYS HIS SEQRES 6 154 GLY VAL THR VAL LEU THR ALA LEU GLY ALA ILE LEU LYS SEQRES 7 154 LYS LYS GLY HIS HIS GLU ALA GLU LEU LYS PRO LEU ALA SEQRES 8 154 GLN SER HIS ALA THR LYS HIS LYS ILE PRO ILE LYS TYR SEQRES 9 154 LEU GLU PHE ILE SER GLU ALA ILE ILE HIS VAL LEU HIS SEQRES 10 154 SER ARG HIS PRO GLY ASN PHE GLY ALA ASP ALA GLN GLY SEQRES 11 154 ALA MET ASN LYS ALA LEU GLU LEU PHE ARG LYS ASP ILE SEQRES 12 154 ALA ALA LYS TYR LYS GLU LEU GLY TYR GLN GLY FORMUL 2 HEM C34 H32 N4 O4 FE1 FORMUL 3 NBN C5 H9 N1 FORMUL 4 SO4 O4 S1 2- FORMUL 5 HOH *138(H2 O1) HELIX 1 1 SER 3 GLU 18 16 HELIX 2 2 ASP 20 SER 35 16 HELIX 3 3 HIS 36 LYS 42 7 HELIX 4 4 THR 51 ALA 57 7 HELIX 5 5 SER 58 LYS 77 20 HELIX 6 6 LEU 86 ALA 94 9 HELIX 7 7 PRO 100 ARG 118 19 HELIX 8 8 GLY 124 LEU 149 26 SITE 1 HEM 1 HEM 155 CRYST1 91.670 91.670 45.970 90.00 90.00 120.00 P 6 6 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 0.010909 0.006298 0.000000 0.00000 SCALE2 0.000000 0.012596 0.000000 0.00000 SCALE3 0.000000 0.000000 0.021753 0.00000 MODEL 1 ATOM 1 N MET 0 24.277 8.374 -9.854 1.00 38.41 N ATOM 2 CA MET 0 24.404 9.859 -9.939 1.00 37.90 C ATOM 3 C MET 0 25.814 10.249 -10.359 1.00 36.65 C ATOM 4 O MET 0 26.748 9.469 -10.197 1.00 37.13 O ATOM 5 CB MET 0 24.070 10.495 -8.596 1.00 39.58 C ATOM 6 CG MET 0 24.880 9.939 -7.442 1.00 41.49 C ATOM 7 SD MET 0 24.262 10.555 -5.873 1.00 44.70 S ATOM 8 CE MET 0 24.822 12.266 -5.967 1.00 41.59 C ATOM 9 N VAL 1 25.964 11.453 -10.903 1.00 34.54 N ATOM 10 CA VAL 1 27.263 11.924 -11.359 1.00 32.46 C ATOM 11 C VAL 1 27.392 13.428 -11.115 1.00 30.70 C ATOM 12 O VAL 1 26.443 14.184 -11.327 1.00 31.42 O ATOM 13 CB VAL 1 27.455 11.631 -12.878 1.00 32.95 C ATOM 14 CG1 VAL 1 28.756 12.209 -13.382 1.00 32.87 C ATOM 15 CG2 VAL 1 27.432 10.131 -13.140 1.00 33.54 C ATOM 16 N LEU 2 28.555 13.855 -10.636 1.00 27.76 N ATOM 17 CA LEU 2 28.797 15.269 -10.390 1.00 25.21 C ATOM 18 C LEU 2 29.492 15.903 -11.585 1.00 24.21 C ATOM 19 O LEU 2 30.250 15.240 -12.306 1.00 23.80 O ATOM 20 CB LEU 2 29.688 15.470 -9.152 1.00 24.30 C ATOM 21 CG LEU 2 29.084 15.416 -7.751 1.00 22.96 C ATOM 22 CD1 LEU 2 28.730 13.988 -7.390 1.00 22.03 C ATOM 23 CD2 LEU 2 30.085 16.008 -6.776 1.00 21.94 C ATOM 24 N SER 3 29.236 17.185 -11.800 1.00 23.04 N ATOM 25 CA SER 3 29.898 17.894 -12.882 1.00 22.62 C ATOM 26 C SER 3 31.282 18.336 -12.384 1.00 22.06 C ATOM 27 O SER 3 31.565 18.268 -11.188 1.00 21.06 O ATOM 28 CB SER 3 29.061 19.097 -13.312 1.00 22.96 C ATOM 29 OG SER 3 28.916 20.026 -12.260 1.00 24.01 O ATOM 30 N GLU 4 32.151 18.759 -13.296 1.00 17.46 N ATOM 31 CA GLU 4 33.489 19.212 -12.922 1.00 24.04 C ATOM 32 C GLU 4 33.346 20.443 -12.019 1.00 21.74 C ATOM 33 O GLU 4 34.115 20.620 -11.076 1.00 20.06 O ATOM 34 CB GLU 4 34.316 19.551 -14.178 1.00 22.74 C ATOM 35 CG GLU 4 35.720 20.158 -13.921 1.00 18.42 C ATOM 36 CD GLU 4 36.690 19.210 -13.205 1.00 27.97 C ATOM 37 OE1 GLU 4 36.449 17.987 -13.166 1.00 27.73 O ATOM 38 OE2 GLU 4 37.711 19.692 -12.684 1.00 28.70 O ATOM 39 N GLY 5 32.351 21.280 -12.308 1.00 19.09 N ATOM 40 CA GLY 5 32.118 22.472 -11.504 1.00 18.12 C ATOM 41 C GLY 5 31.837 22.114 -10.053 1.00 18.29 C ATOM 42 O GLY 5 32.353 22.758 -9.137 1.00 17.54 O ATOM 43 N GLU 6 31.033 21.069 -9.845 1.00 16.68 N ATOM 44 CA GLU 6 30.702 20.617 -8.498 1.00 13.59 C ATOM 45 C GLU 6 31.945 20.007 -7.807 1.00 17.58 C ATOM 46 O GLU 6 32.199 20.278 -6.638 1.00 14.97 O ATOM 47 CB GLU 6 29.510 19.648 -8.533 1.00 13.04 C ATOM 48 CG GLU 6 28.179 20.319 -8.911 1.00 16.58 C ATOM 49 CD GLU 6 27.056 19.316 -9.262 1.00 18.86 C ATOM 50 OE1 GLU 6 27.338 18.242 -9.832 1.00 23.67 O ATOM 51 OE2 GLU 6 25.881 19.612 -8.979 1.00 29.24 O ATOM 52 N TRP 7 32.747 19.242 -8.545 1.00 15.06 N ATOM 53 CA TRP 7 33.970 18.675 -7.985 1.00 15.72 C ATOM 54 C TRP 7 34.932 19.799 -7.595 1.00 16.03 C ATOM 55 O TRP 7 35.645 19.687 -6.599 1.00 16.52 O ATOM 56 CB TRP 7 34.672 17.733 -8.986 1.00 15.72 C ATOM 57 CG TRP 7 34.046 16.382 -9.056 1.00 15.35 C ATOM 58 CD1 TRP 7 33.473 15.795 -10.149 1.00 15.74 C ATOM 59 CD2 TRP 7 33.874 15.466 -7.966 1.00 15.25 C ATOM 60 CE2 TRP 7 33.168 14.345 -8.469 1.00 15.63 C ATOM 61 CE3 TRP 7 34.237 15.486 -6.608 1.00 14.98 C ATOM 62 NE1 TRP 7 32.940 14.573 -9.804 1.00 15.28 N ATOM 63 CZ2 TRP 7 32.813 13.244 -7.652 1.00 15.14 C ATOM 64 CZ3 TRP 7 33.884 14.394 -5.801 1.00 15.08 C ATOM 65 CH2 TRP 7 33.178 13.290 -6.328 1.00 14.28 C ATOM 66 N GLN 8 34.973 20.871 -8.388 1.00 15.81 N ATOM 67 CA GLN 8 35.856 21.987 -8.080 1.00 16.01 C ATOM 68 C GLN 8 35.445 22.668 -6.769 1.00 15.78 C ATOM 69 O GLN 8 36.305 23.057 -5.973 1.00 15.65 O ATOM 70 CB GLN 8 35.893 22.989 -9.235 1.00 17.95 C ATOM 71 CG GLN 8 36.613 22.459 -10.451 1.00 25.32 C ATOM 72 CD GLN 8 38.055 22.125 -10.145 1.00 39.60 C ATOM 73 OE1 GLN 8 38.883 23.023 -9.983 1.00 67.02 O ATOM 74 NE2 GLN 8 38.366 20.830 -10.043 1.00 43.80 N ATOM 75 N LEU 9 34.141 22.788 -6.533 1.00 14.97 N ATOM 76 CA LEU 9 33.661 23.390 -5.284 1.00 14.87 C ATOM 77 C LEU 9 34.055 22.525 -4.081 1.00 14.68 C ATOM 78 O LEU 9 34.515 23.031 -3.061 1.00 14.85 O ATOM 79 CB LEU 9 32.141 23.586 -5.317 1.00 15.27 C ATOM 80 CG LEU 9 31.668 24.723 -6.235 1.00 15.96 C ATOM 81 CD1 LEU 9 30.164 24.757 -6.306 1.00 15.80 C ATOM 82 CD2 LEU 9 32.205 26.043 -5.730 1.00 16.40 C ATOM 83 N VAL 10 33.913 21.215 -4.236 1.00 13.96 N ATOM 84 CA VAL 10 34.247 20.256 -3.195 1.00 13.50 C ATOM 85 C VAL 10 35.742 20.293 -2.878 1.00 14.08 C ATOM 86 O VAL 10 36.144 20.446 -1.721 1.00 14.08 O ATOM 87 CB VAL 10 33.821 18.826 -3.640 1.00 13.81 C ATOM 88 CG1 VAL 10 34.428 17.746 -2.739 1.00 13.51 C ATOM 89 CG2 VAL 10 32.289 18.724 -3.657 1.00 13.28 C ATOM 90 N LEU 11 36.563 20.208 -3.915 1.00 14.31 N ATOM 91 CA LEU 11 38.005 20.200 -3.741 1.00 14.80 C ATOM 92 C LEU 11 38.590 21.529 -3.282 1.00 15.08 C ATOM 93 O LEU 11 39.613 21.537 -2.605 1.00 15.16 O ATOM 94 CB LEU 11 38.690 19.677 -5.007 1.00 15.74 C ATOM 95 CG LEU 11 38.310 18.212 -5.299 1.00 16.67 C ATOM 96 CD1 LEU 11 38.911 17.765 -6.605 1.00 18.20 C ATOM 97 CD2 LEU 11 38.778 17.300 -4.167 1.00 17.64 C ATOM 98 N HIS 12 37.915 22.640 -3.577 1.00 15.37 N ATOM 99 CA HIS 12 38.390 23.965 -3.145 1.00 15.95 C ATOM 100 C HIS 12 38.229 24.124 -1.625 1.00 15.98 C ATOM 101 O HIS 12 39.105 24.662 -0.963 1.00 16.51 O ATOM 102 CB HIS 12 37.650 25.092 -3.887 1.00 19.33 C ATOM 103 CG HIS 12 38.064 26.470 -3.467 1.00 28.57 C ATOM 104 CD2 HIS 12 37.357 27.443 -2.836 1.00 35.58 C ATOM 105 ND1 HIS 12 39.323 26.998 -3.668 1.00 38.92 N ATOM 106 CE1 HIS 12 39.341 28.247 -3.167 1.00 37.34 C ATOM 107 NE2 HIS 12 38.171 28.566 -2.650 1.00 33.72 N ATOM 108 N VAL 13 37.107 23.672 -1.070 1.00 15.74 N ATOM 109 CA VAL 13 36.934 23.758 0.379 1.00 15.64 C ATOM 110 C VAL 13 37.792 22.681 1.085 1.00 15.33 C ATOM 111 O VAL 13 38.342 22.921 2.160 1.00 15.39 O ATOM 112 CB VAL 13 35.424 23.682 0.816 1.00 16.72 C ATOM 113 CG1 VAL 13 34.851 22.287 0.601 1.00 16.66 C ATOM 114 CG2 VAL 13 35.283 24.085 2.288 1.00 17.08 C ATOM 115 N TRP 14 37.958 21.524 0.448 1.00 14.73 N ATOM 116 CA TRP 14 38.770 20.457 1.017 1.00 14.75 C ATOM 117 C TRP 14 40.241 20.879 1.166 1.00 14.64 C ATOM 118 O TRP 14 40.921 20.456 2.099 1.00 15.14 O ATOM 119 CB TRP 14 38.673 19.191 0.164 1.00 15.26 C ATOM 120 CG TRP 14 39.146 17.993 0.901 1.00 16.17 C ATOM 121 CD1 TRP 14 40.356 17.387 0.782 1.00 16.11 C ATOM 122 CD2 TRP 14 38.458 17.320 1.969 1.00 16.43 C ATOM 123 CE2 TRP 14 39.328 16.325 2.463 1.00 15.93 C ATOM 124 CE3 TRP 14 37.191 17.471 2.561 1.00 16.69 C ATOM 125 NE1 TRP 14 40.477 16.388 1.722 1.00 16.54 N ATOM 126 CZ2 TRP 14 38.983 15.480 3.522 1.00 16.79 C ATOM 127 CZ3 TRP 14 36.842 16.622 3.626 1.00 17.61 C ATOM 128 CH2 TRP 14 37.744 15.638 4.093 1.00 16.93 C ATOM 129 N ALA 15 40.726 21.722 0.254 1.00 14.42 N ATOM 130 CA ALA 15 42.095 22.214 0.312 1.00 14.00 C ATOM 131 C ALA 15 42.328 22.999 1.608 1.00 14.30 C ATOM 132 O ALA 15 43.427 22.982 2.156 1.00 14.23 O ATOM 133 CB ALA 15 42.389 23.080 -0.896 1.00 14.14 C ATOM 134 N LYS 16 41.270 23.635 2.124 1.00 15.22 N ATOM 135 CA LYS 16 41.345 24.400 3.376 1.00 17.82 C ATOM 136 C LYS 16 41.371 23.426 4.548 1.00 14.95 C ATOM 137 O LYS 16 42.124 23.616 5.491 1.00 18.06 O ATOM 138 CB LYS 16 40.146 25.350 3.539 1.00 11.85 C ATOM 139 CG LYS 16 39.931 26.312 2.396 1.00 15.52 C ATOM 140 CD LYS 16 41.171 27.093 2.107 1.00 22.34 C ATOM 141 CE LYS 16 41.010 27.867 0.817 1.00 43.61 C ATOM 142 NZ LYS 16 42.298 28.453 0.378 1.00 41.54 N ATOM 143 N VAL 17 40.524 22.398 4.491 1.00 12.40 N ATOM 144 CA VAL 17 40.473 21.367 5.522 1.00 12.29 C ATOM 145 C VAL 17 41.872 20.771 5.701 1.00 12.32 C ATOM 146 O VAL 17 42.329 20.560 6.829 1.00 12.74 O ATOM 147 CB VAL 17 39.496 20.242 5.116 1.00 12.43 C ATOM 148 CG1 VAL 17 39.596 19.045 6.073 1.00 12.58 C ATOM 149 CG2 VAL 17 38.088 20.787 5.082 1.00 13.47 C ATOM 150 N GLU 18 42.553 20.513 4.584 1.00 13.88 N ATOM 151 CA GLU 18 43.904 19.940 4.618 1.00 14.94 C ATOM 152 C GLU 18 44.991 20.813 5.262 1.00 16.26 C ATOM 153 O GLU 18 46.070 20.322 5.560 1.00 15.32 O ATOM 154 CB GLU 18 44.327 19.461 3.235 1.00 12.91 C ATOM 155 CG GLU 18 43.572 18.228 2.808 1.00 13.99 C ATOM 156 CD GLU 18 44.011 17.692 1.458 1.00 16.75 C ATOM 157 OE1 GLU 18 44.559 18.458 0.644 1.00 21.92 O ATOM 158 OE2 GLU 18 43.791 16.493 1.217 1.00 23.33 O ATOM 159 N ALA 19 44.708 22.090 5.501 1.00 14.20 N ATOM 160 CA ALA 19 45.686 22.946 6.169 1.00 14.94 C ATOM 161 C ALA 19 45.780 22.500 7.624 1.00 14.81 C ATOM 162 O ALA 19 46.773 22.759 8.295 1.00 15.01 O ATOM 163 CB ALA 19 45.259 24.418 6.110 1.00 14.54 C ATOM 164 N ASP 20 44.731 21.837 8.111 1.00 12.28 N ATOM 165 CA ASP 20 44.693 21.368 9.492 1.00 12.72 C ATOM 166 C ASP 20 43.810 20.117 9.606 1.00 18.12 C ATOM 167 O ASP 20 42.686 20.173 10.131 1.00 13.62 O ATOM 168 CB ASP 20 44.157 22.490 10.403 1.00 10.25 C ATOM 169 CG ASP 20 44.073 22.074 11.865 1.00 19.39 C ATOM 170 OD1 ASP 20 44.848 21.187 12.301 1.00 17.74 O ATOM 171 OD2 ASP 20 43.195 22.613 12.564 1.00 26.16 O ATOM 172 N VAL 21 44.343 18.987 9.164 1.00 14.51 N ATOM 173 CA VAL 21 43.597 17.741 9.183 1.00 16.06 C ATOM 174 C VAL 21 43.223 17.273 10.588 1.00 15.92 C ATOM 175 O VAL 21 42.095 16.857 10.810 1.00 16.38 O ATOM 176 CB VAL 21 44.360 16.610 8.409 1.00 17.48 C ATOM 177 CG1 VAL 21 43.603 15.292 8.507 1.00 16.78 C ATOM 178 CG2 VAL 21 44.521 17.021 6.937 1.00 17.19 C ATOM 179 N ALA 22 44.151 17.364 11.537 1.00 15.42 N ATOM 180 CA ALA 22 43.871 16.937 12.907 1.00 15.58 C ATOM 181 C ALA 22 42.787 17.773 13.591 1.00 15.11 C ATOM 182 O ALA 22 41.894 17.227 14.221 1.00 14.57 O ATOM 183 CB ALA 22 45.154 16.940 13.734 1.00 16.03 C ATOM 184 N GLY 23 42.865 19.094 13.443 1.00 14.85 N ATOM 185 CA GLY 23 41.882 19.978 14.035 1.00 13.95 C ATOM 186 C GLY 23 40.485 19.730 13.490 1.00 13.74 C ATOM 187 O GLY 23 39.507 19.711 14.255 1.00 13.81 O ATOM 188 N HIS 24 40.369 19.561 12.175 1.00 13.07 N ATOM 189 CA HIS 24 39.059 19.308 11.561 1.00 12.67 C ATOM 190 C HIS 24 38.525 17.941 11.970 1.00 12.65 C ATOM 191 O HIS 24 37.326 17.804 12.187 1.00 13.43 O ATOM 192 CB HIS 24 39.138 19.392 10.037 1.00 10.49 C ATOM 193 CG HIS 24 39.212 20.790 9.513 1.00 13.59 C ATOM 194 CD2 HIS 24 38.245 21.571 8.963 1.00 10.81 C ATOM 195 ND1 HIS 24 40.371 21.531 9.447 1.00 10.53 N ATOM 196 CE1 HIS 24 40.078 22.706 8.860 1.00 11.16 C ATOM 197 NE2 HIS 24 38.798 22.777 8.549 1.00 12.09 N ATOM 198 N GLY 25 39.410 16.943 12.063 1.00 12.41 N ATOM 199 CA GLY 25 39.014 15.593 12.468 1.00 13.17 C ATOM 200 C GLY 25 38.428 15.545 13.875 1.00 13.87 C ATOM 201 O GLY 25 37.460 14.826 14.124 1.00 13.35 O ATOM 202 N GLN 26 39.034 16.291 14.804 1.00 14.34 N ATOM 203 CA GLN 26 38.534 16.366 16.171 1.00 15.16 C ATOM 204 C GLN 26 37.140 17.000 16.198 1.00 15.26 C ATOM 205 O GLN 26 36.221 16.467 16.829 1.00 15.39 O ATOM 206 CB GLN 26 39.448 17.215 17.054 1.00 17.03 C ATOM 207 CG GLN 26 40.466 16.432 17.822 1.00 28.33 C ATOM 208 CD GLN 26 41.526 17.332 18.433 1.00 40.00 C ATOM 209 OE1 GLN 26 42.133 18.162 17.746 1.00 36.88 O ATOM 210 NE2 GLN 26 41.709 17.218 19.740 1.00 36.42 N ATOM 211 N ASP 27 37.003 18.168 15.568 1.00 10.78 N ATOM 212 CA ASP 27 35.721 18.874 15.540 1.00 12.70 C ATOM 213 C ASP 27 34.599 18.016 14.999 1.00 15.39 C ATOM 214 O ASP 27 33.494 18.020 15.527 1.00 12.27 O ATOM 215 CB ASP 27 35.820 20.133 14.669 1.00 11.23 C ATOM 216 CG ASP 27 36.637 21.235 15.311 1.00 27.34 C ATOM 217 OD1 ASP 27 37.197 21.014 16.412 1.00 27.80 O ATOM 218 OD2 ASP 27 36.720 22.323 14.702 1.00 23.75 O ATOM 219 N ILE 28 34.880 17.341 13.890 1.00 12.88 N ATOM 220 CA ILE 28 33.906 16.477 13.242 1.00 13.76 C ATOM 221 C ILE 28 33.472 15.291 14.124 1.00 14.47 C ATOM 222 O ILE 28 32.263 15.032 14.276 1.00 14.63 O ATOM 223 CB ILE 28 34.446 15.993 11.846 1.00 13.13 C ATOM 224 CG1 ILE 28 34.381 17.154 10.842 1.00 13.35 C ATOM 225 CG2 ILE 28 33.644 14.809 11.323 1.00 12.02 C ATOM 227 N LEU 29 34.440 14.596 14.731 1.00 15.19 N ATOM 228 CA LEU 29 34.118 13.441 15.571 1.00 15.68 C ATOM 229 C LEU 29 33.400 13.853 16.847 1.00 16.10 C ATOM 230 O LEU 29 32.471 13.181 17.283 1.00 16.45 O ATOM 231 CB LEU 29 35.359 12.614 15.898 1.00 15.76 C ATOM 232 CG LEU 29 35.978 11.809 14.749 1.00 16.40 C ATOM 233 CD1 LEU 29 37.043 10.854 15.303 1.00 16.35 C ATOM 234 CD2 LEU 29 34.917 11.008 14.016 1.00 17.12 C ATOM 235 N ILE 30 33.818 14.971 17.432 1.00 16.13 N ATOM 236 CA ILE 30 33.178 15.463 18.644 1.00 16.60 C ATOM 237 C ILE 30 31.725 15.839 18.311 1.00 17.11 C ATOM 238 O ILE 30 30.798 15.495 19.058 1.00 17.25 O ATOM 239 CB ILE 30 33.974 16.652 19.250 1.00 15.99 C ATOM 240 CG1 ILE 30 35.260 16.118 19.907 1.00 16.25 C ATOM 241 CG2 ILE 30 33.113 17.437 20.245 1.00 16.34 C ATOM 243 N ARG 31 31.529 16.494 17.168 1.00 16.96 N ATOM 244 CA ARG 31 30.191 16.862 16.720 1.00 17.72 C ATOM 245 C ARG 31 29.353 15.590 16.560 1.00 18.25 C ATOM 246 O ARG 31 28.242 15.514 17.080 1.00 18.06 O ATOM 247 CB ARG 31 30.274 17.644 15.403 1.00 19.03 C ATOM 248 CG ARG 31 28.959 17.951 14.704 1.00 27.75 C ATOM 249 CD ARG 31 27.820 18.210 15.662 1.00 35.54 C ATOM 250 NE ARG 31 27.590 19.622 15.937 1.00 55.89 N ATOM 251 CZ ARG 31 26.431 20.247 15.732 1.00 59.53 C ATOM 252 NH1 ARG 31 25.407 19.623 15.163 1.00 55.77 N ATOM 253 NH2 ARG 31 26.316 21.528 16.038 1.00 80.31 N ATOM 254 N LEU 32 29.923 14.573 15.913 1.00 18.72 N ATOM 255 CA LEU 32 29.229 13.303 15.710 1.00 18.89 C ATOM 256 C LEU 32 28.820 12.652 17.035 1.00 19.55 C ATOM 257 O LEU 32 27.656 12.283 17.216 1.00 19.27 O ATOM 258 CB LEU 32 30.107 12.321 14.912 1.00 18.43 C ATOM 259 CG LEU 32 29.518 10.900 14.774 1.00 18.35 C ATOM 260 CD1 LEU 32 28.310 10.917 13.853 1.00 16.58 C ATOM 261 CD2 LEU 32 30.569 9.897 14.281 1.00 17.13 C ATOM 262 N PHE 33 29.785 12.525 17.950 1.00 20.12 N ATOM 263 CA PHE 33 29.574 11.902 19.263 1.00 20.56 C ATOM 264 C PHE 33 28.594 12.652 20.164 1.00 21.82 C ATOM 265 O PHE 33 27.863 12.029 20.941 1.00 23.10 O ATOM 266 CB PHE 33 30.905 11.724 19.981 1.00 19.32 C ATOM 267 CG PHE 33 31.858 10.805 19.263 1.00 18.94 C ATOM 268 CD1 PHE 33 31.375 9.740 18.495 1.00 17.83 C ATOM 269 CD2 PHE 33 33.239 10.991 19.365 1.00 17.60 C ATOM 270 CE1 PHE 33 32.254 8.878 17.843 1.00 17.15 C ATOM 271 CE2 PHE 33 34.119 10.133 18.714 1.00 17.04 C ATOM 272 CZ PHE 33 33.617 9.072 17.951 1.00 17.09 C ATOM 273 N LYS 34 28.568 13.977 20.061 1.00 23.38 N ATOM 274 CA LYS 34 27.645 14.757 20.863 1.00 25.09 C ATOM 275 C LYS 34 26.242 14.704 20.284 1.00 25.17 C ATOM 276 O LYS 34 25.273 14.626 21.026 1.00 38.31 O ATOM 277 CB LYS 34 28.086 16.223 20.966 1.00 20.77 C ATOM 278 CG LYS 34 29.350 16.430 21.783 1.00 42.45 C ATOM 279 CD LYS 34 29.403 17.826 22.398 1.00 68.05 C ATOM 280 CE LYS 34 29.075 18.906 21.384 1.00 74.10 C ATOM 281 NZ LYS 34 29.655 20.230 21.749 1.00 58.94 N ATOM 282 N SER 35 26.131 14.777 18.961 1.00 26.05 N ATOM 283 CA SER 35 24.834 14.759 18.309 1.00 26.21 C ATOM 284 C SER 35 24.189 13.390 18.335 1.00 26.05 C ATOM 285 O SER 35 22.970 13.289 18.389 1.00 25.95 O ATOM 286 CB SER 35 24.960 15.191 16.854 1.00 26.90 C ATOM 287 OG SER 35 25.495 16.497 16.745 1.00 30.21 O ATOM 288 N HIS 36 25.013 12.347 18.240 1.00 25.46 N ATOM 289 CA HIS 36 24.534 10.971 18.219 1.00 25.07 C ATOM 290 C HIS 36 25.441 10.076 19.042 1.00 24.90 C ATOM 291 O HIS 36 26.194 9.289 18.490 1.00 25.25 O ATOM 292 CB HIS 36 24.470 10.443 16.774 1.00 23.40 C ATOM 293 CG HIS 36 23.718 11.332 15.835 1.00 21.61 C ATOM 294 CD2 HIS 36 24.160 12.339 15.040 1.00 23.65 C ATOM 295 ND1 HIS 36 22.358 11.266 15.627 1.00 22.67 N ATOM 296 CE1 HIS 36 22.026 12.208 14.740 1.00 17.49 C ATOM 297 NE2 HIS 36 23.084 12.890 14.349 1.00 22.98 N ATOM 298 N PRO 37 25.290 10.107 20.377 1.00 25.00 N ATOM 299 CA PRO 37 26.053 9.339 21.363 1.00 24.52 C ATOM 300 C PRO 37 26.122 7.836 21.124 1.00 24.44 C ATOM 301 O PRO 37 27.090 7.183 21.514 1.00 24.78 O ATOM 302 CB PRO 37 25.321 9.652 22.666 1.00 25.11 C ATOM 303 CG PRO 37 24.767 11.032 22.422 1.00 24.88 C ATOM 304 CD PRO 37 24.219 10.875 21.045 1.00 25.04 C ATOM 305 N GLU 38 25.106 7.280 20.478 1.00 20.50 N ATOM 306 CA GLU 38 25.099 5.847 20.204 1.00 27.23 C ATOM 307 C GLU 38 26.292 5.452 19.344 1.00 18.36 C ATOM 308 O GLU 38 26.814 4.359 19.481 1.00 31.79 O ATOM 309 CB GLU 38 23.779 5.401 19.539 1.00 20.46 C ATOM 310 CG GLU 38 23.458 6.000 18.159 1.00 21.91 C ATOM 311 CD GLU 38 22.672 7.310 18.209 1.00 38.03 C ATOM 312 OE1 GLU 38 22.775 8.087 19.180 1.00 33.84 O ATOM 313 OE2 GLU 38 21.940 7.573 17.243 1.00 40.21 O ATOM 314 N THR 39 26.760 6.365 18.497 1.00 22.46 N ATOM 315 CA THR 39 27.898 6.075 17.627 1.00 22.43 C ATOM 316 C THR 39 29.208 5.857 18.383 1.00 22.93 C ATOM 317 O THR 39 30.073 5.113 17.922 1.00 22.99 O ATOM 318 CB THR 39 28.123 7.196 16.564 1.00 22.12 C ATOM 319 CG2 THR 39 26.868 7.424 15.751 1.00 20.86 C ATOM 320 OG1 THR 39 28.520 8.416 17.210 1.00 21.24 O ATOM 321 N LEU 40 29.349 6.498 19.543 1.00 23.68 N ATOM 322 CA LEU 40 30.572 6.385 20.345 1.00 24.19 C ATOM 323 C LEU 40 30.847 4.950 20.795 1.00 24.28 C ATOM 324 O LEU 40 32.011 4.538 20.938 1.00 23.83 O ATOM 325 CB LEU 40 30.499 7.330 21.554 1.00 25.26 C ATOM 326 CG LEU 40 31.720 7.466 22.478 1.00 25.40 C ATOM 327 CD1 LEU 40 32.932 7.943 21.688 1.00 26.19 C ATOM 328 CD2 LEU 40 31.414 8.440 23.599 1.00 25.83 C ATOM 329 N GLU 41 29.770 4.184 20.962 1.00 26.00 N ATOM 330 CA GLU 41 29.857 2.786 21.382 1.00 24.55 C ATOM 331 C GLU 41 30.658 1.906 20.427 1.00 33.76 C ATOM 332 O GLU 41 31.209 0.890 20.838 1.00 35.66 O ATOM 333 CB GLU 41 28.461 2.190 21.522 1.00 33.39 C ATOM 334 CG GLU 41 27.648 2.725 22.678 1.00 55.70 C ATOM 335 CD GLU 41 26.298 2.048 22.772 1.00 67.02 C ATOM 336 OE1 GLU 41 25.420 2.340 21.930 1.00 71.20 O ATOM 337 OE2 GLU 41 26.125 1.206 23.678 1.00 75.40 O ATOM 338 N LYS 42 30.696 2.286 19.151 1.00 33.33 N ATOM 339 CA LYS 42 31.421 1.522 18.136 1.00 25.60 C ATOM 340 C LYS 42 32.934 1.611 18.273 1.00 19.95 C ATOM 341 O LYS 42 33.661 0.750 17.787 1.00 35.38 O ATOM 342 CB LYS 42 31.007 1.987 16.739 1.00 17.82 C ATOM 343 CG LYS 42 29.599 1.623 16.363 1.00 19.30 C ATOM 344 CD LYS 42 29.501 0.142 16.074 1.00 28.08 C ATOM 345 CE LYS 42 28.079 -0.270 15.763 1.00 28.38 C ATOM 346 NZ LYS 42 28.051 -1.731 15.563 1.00 36.87 N ATOM 347 N PHE 43 33.403 2.649 18.952 1.00 32.57 N ATOM 348 CA PHE 43 34.832 2.864 19.120 1.00 32.86 C ATOM 349 C PHE 43 35.357 2.428 20.479 1.00 32.97 C ATOM 350 O PHE 43 35.455 3.224 21.407 1.00 33.11 O ATOM 351 CB PHE 43 35.153 4.340 18.865 1.00 32.29 C ATOM 352 CG PHE 43 34.782 4.803 17.490 1.00 32.34 C ATOM 353 CD1 PHE 43 35.677 4.666 16.431 1.00 31.95 C ATOM 354 CD2 PHE 43 33.530 5.349 17.243 1.00 31.84 C ATOM 355 CE1 PHE 43 35.323 5.066 15.151 1.00 32.26 C ATOM 356 CE2 PHE 43 33.172 5.751 15.970 1.00 32.01 C ATOM 357 CZ PHE 43 34.071 5.609 14.920 1.00 32.21 C ATOM 358 N ASP 44 35.775 1.175 20.555 1.00 34.16 N ATOM 359 CA ASP 44 36.281 0.599 21.794 1.00 41.63 C ATOM 360 C ASP 44 37.401 1.387 22.443 1.00 43.44 C ATOM 361 O ASP 44 37.460 1.496 23.668 1.00 43.85 O ATOM 362 CB ASP 44 36.725 -0.847 21.562 1.00 49.83 C ATOM 363 CG ASP 44 35.608 -1.713 20.999 1.00 66.28 C ATOM 364 OD1 ASP 44 34.412 -1.418 21.258 1.00 59.23 O ATOM 365 OD2 ASP 44 35.929 -2.681 20.278 1.00 75.41 O ATOM 366 N ARG 45 38.255 1.984 21.623 1.00 41.73 N ATOM 367 CA ARG 45 39.378 2.737 22.144 1.00 41.45 C ATOM 368 C ARG 45 39.011 4.085 22.736 1.00 40.97 C ATOM 369 O ARG 45 39.814 4.665 23.468 1.00 41.65 O ATOM 370 CB ARG 45 40.441 2.938 21.053 1.00 43.13 C ATOM 371 CG ARG 45 41.785 2.307 21.396 1.00 53.08 C ATOM 372 CD ARG 45 42.910 2.709 20.435 1.00 64.99 C ATOM 373 NE ARG 45 42.767 2.098 19.118 1.00 80.05 N ATOM 374 CZ ARG 45 42.767 2.777 17.974 1.00 97.64 C ATOM 375 NH1 ARG 45 42.885 4.102 17.980 1.00 0.00 N ATOM 376 NH2 ARG 45 42.632 2.133 16.821 1.00 91.43 N ATOM 377 N VAL 46 37.771 4.523 22.533 1.00 39.61 N ATOM 378 CA VAL 46 37.375 5.854 22.974 1.00 38.33 C ATOM 379 C VAL 46 35.954 5.971 23.580 1.00 38.11 C ATOM 380 O VAL 46 35.542 7.041 24.037 1.00 37.45 O ATOM 381 CB VAL 46 37.577 6.804 21.731 1.00 37.83 C ATOM 382 CG1 VAL 46 36.278 7.176 21.064 1.00 36.87 C ATOM 383 CG2 VAL 46 38.429 7.974 22.075 1.00 37.97 C ATOM 384 N LYS 47 35.254 4.844 23.672 1.00 29.21 N ATOM 385 CA LYS 47 33.882 4.813 24.172 1.00 23.48 C ATOM 386 C LYS 47 33.669 5.225 25.628 1.00 24.52 C ATOM 387 O LYS 47 32.547 5.503 26.027 1.00 33.62 O ATOM 388 CB LYS 47 33.280 3.426 23.946 1.00 23.59 C ATOM 389 CG LYS 47 33.623 2.411 25.019 1.00 40.22 C ATOM 390 CD LYS 47 32.863 1.109 24.831 1.00 52.55 C ATOM 391 CE LYS 47 33.774 0.036 24.272 1.00 62.41 C ATOM 392 NZ LYS 47 33.077 -1.260 24.087 1.00 74.01 N ATOM 393 N HIS 48 34.741 5.249 26.413 1.00 31.16 N ATOM 394 CA HIS 48 34.674 5.606 27.836 1.00 31.22 C ATOM 395 C HIS 48 34.701 7.112 28.107 1.00 30.83 C ATOM 396 O HIS 48 34.532 7.529 29.249 1.00 31.04 O ATOM 397 CB HIS 48 35.838 4.955 28.589 1.00 33.26 C ATOM 398 CG HIS 48 37.177 5.474 28.169 1.00 43.81 C ATOM 399 CD2 HIS 48 38.087 6.210 28.857 1.00 46.44 C ATOM 400 ND1 HIS 48 37.694 5.329 26.897 1.00 49.90 N ATOM 401 CE1 HIS 48 38.876 5.973 26.846 1.00 53.26 C ATOM 402 NE2 HIS 48 39.163 6.526 28.010 1.00 56.20 N ATOM 403 N LEU 49 35.003 7.911 27.083 1.00 30.17 N ATOM 404 CA LEU 49 35.045 9.375 27.217 1.00 29.27 C ATOM 405 C LEU 49 33.637 9.891 27.507 1.00 28.58 C ATOM 406 O LEU 49 32.695 9.606 26.782 1.00 28.38 O ATOM 407 CB LEU 49 35.611 10.026 25.952 1.00 29.06 C ATOM 408 CG LEU 49 36.958 9.519 25.428 1.00 28.57 C ATOM 409 CD1 LEU 49 37.293 10.245 24.158 1.00 28.23 C ATOM 410 CD2 LEU 49 38.053 9.730 26.445 1.00 28.89 C ATOM 411 N LYS 50 33.515 10.640 28.595 1.00 24.55 N ATOM 412 CA LYS 50 32.237 11.165 29.068 1.00 29.94 C ATOM 413 C LYS 50 31.906 12.604 28.683 1.00 23.26 C ATOM 414 O LYS 50 30.742 12.950 28.517 1.00 34.91 O ATOM 415 CB LYS 50 32.182 11.034 30.592 1.00 45.14 C ATOM 416 CG LYS 50 32.451 9.622 31.126 1.00 30.35 C ATOM 417 CD LYS 50 32.844 9.674 32.606 1.00 57.96 C ATOM 418 CE LYS 50 32.941 8.289 33.243 1.00 49.95 C ATOM 419 NZ LYS 50 31.612 7.630 33.359 1.00 51.06 N ATOM 420 N THR 51 32.924 13.448 28.564 1.00 24.12 N ATOM 421 CA THR 51 32.694 14.849 28.229 1.00 23.89 C ATOM 422 C THR 51 33.500 15.330 27.025 1.00 23.81 C ATOM 423 O THR 51 34.497 14.712 26.638 1.00 23.34 O ATOM 424 CB THR 51 33.052 15.780 29.435 1.00 24.11 C ATOM 425 CG2 THR 51 32.269 15.384 30.695 1.00 24.04 C ATOM 426 OG1 THR 51 34.460 15.699 29.704 1.00 24.05 O ATOM 427 N GLU 52 33.098 16.483 26.495 1.00 19.92 N ATOM 428 CA GLU 52 33.783 17.091 25.373 1.00 23.72 C ATOM 429 C GLU 52 35.220 17.425 25.737 1.00 23.12 C ATOM 430 O GLU 52 36.100 17.350 24.887 1.00 25.70 O ATOM 431 CB GLU 52 33.071 18.360 24.919 1.00 28.42 C ATOM 432 CG GLU 52 33.779 19.038 23.744 1.00 41.68 C ATOM 433 CD GLU 52 32.971 20.161 23.115 1.00 38.60 C ATOM 434 OE1 GLU 52 31.764 20.277 23.415 1.00 41.28 O ATOM 435 OE2 GLU 52 33.542 20.922 22.307 1.00 49.31 O ATOM 436 N ALA 53 35.454 17.798 26.997 1.00 21.99 N ATOM 437 CA ALA 53 36.800 18.129 27.454 1.00 21.32 C ATOM 438 C ALA 53 37.678 16.893 27.382 1.00 21.17 C ATOM 439 O ALA 53 38.845 16.975 27.014 1.00 20.69 O ATOM 440 CB ALA 53 36.765 18.670 28.881 1.00 22.00 C ATOM 441 N GLU 54 37.114 15.745 27.747 1.00 18.34 N ATOM 442 CA GLU 54 37.860 14.489 27.694 1.00 20.60 C ATOM 443 C GLU 54 38.137 14.149 26.245 1.00 22.25 C ATOM 444 O GLU 54 39.231 13.717 25.892 1.00 19.44 O ATOM 445 CB GLU 54 37.079 13.365 28.371 1.00 18.48 C ATOM 446 CG GLU 54 37.087 13.500 29.882 1.00 27.00 C ATOM 447 CD GLU 54 36.458 12.334 30.616 1.00 30.63 C ATOM 448 OE1 GLU 54 35.749 11.528 29.990 1.00 34.98 O ATOM 449 OE2 GLU 54 36.673 12.226 31.840 1.00 38.33 O ATOM 450 N MET 55 37.151 14.420 25.398 1.00 22.52 N ATOM 451 CA MET 55 37.272 14.165 23.970 1.00 22.24 C ATOM 452 C MET 55 38.367 15.021 23.334 1.00 22.17 C ATOM 453 O MET 55 39.210 14.508 22.593 1.00 21.68 O ATOM 454 CB MET 55 35.937 14.411 23.293 1.00 21.93 C ATOM 455 CG MET 55 34.971 13.294 23.521 1.00 22.76 C ATOM 456 SD MET 55 33.389 13.680 22.839 1.00 25.74 S ATOM 457 CE MET 55 32.348 12.662 23.891 1.00 25.19 C ATOM 458 N LYS 56 38.397 16.302 23.700 1.00 18.45 N ATOM 459 CA LYS 56 39.378 17.240 23.171 1.00 22.71 C ATOM 460 C LYS 56 40.781 16.919 23.590 1.00 23.43 C ATOM 461 O LYS 56 41.720 17.320 22.920 1.00 29.40 O ATOM 462 CB LYS 56 39.070 18.667 23.607 1.00 13.80 C ATOM 463 CG LYS 56 37.920 19.299 22.854 1.00 30.70 C ATOM 464 CD LYS 56 37.687 20.715 23.319 1.00 42.22 C ATOM 465 CE LYS 56 36.574 21.345 22.523 1.00 54.44 C ATOM 466 NZ LYS 56 36.199 22.686 23.043 1.00 94.11 N ATOM 467 N ALA 57 40.926 16.212 24.706 1.00 24.17 N ATOM 468 CA ALA 57 42.245 15.870 25.207 1.00 24.10 C ATOM 469 C ALA 57 42.712 14.501 24.759 1.00 24.17 C ATOM 470 O ALA 57 43.892 14.178 24.861 1.00 24.80 O ATOM 471 CB ALA 57 42.263 15.956 26.717 1.00 24.26 C ATOM 472 N SER 58 41.791 13.705 24.233 1.00 24.05 N ATOM 473 CA SER 58 42.106 12.360 23.794 1.00 23.68 C ATOM 474 C SER 58 43.023 12.299 22.565 1.00 24.43 C ATOM 475 O SER 58 42.718 12.859 21.509 1.00 24.53 O ATOM 476 CB SER 58 40.813 11.598 23.535 1.00 23.20 C ATOM 477 OG SER 58 41.107 10.316 23.022 1.00 23.93 O ATOM 478 N GLU 59 44.156 11.618 22.716 1.00 25.17 N ATOM 479 CA GLU 59 45.110 11.468 21.630 1.00 24.69 C ATOM 480 C GLU 59 44.585 10.444 20.637 1.00 26.92 C ATOM 481 O GLU 59 44.823 10.556 19.445 1.00 27.57 O ATOM 482 CB GLU 59 46.472 11.027 22.172 1.00 33.92 C ATOM 483 CG GLU 59 47.664 11.638 21.445 1.00 62.87 C ATOM 484 CD GLU 59 47.721 13.156 21.577 1.00 74.28 C ATOM 485 OE1 GLU 59 47.188 13.705 22.568 1.00 87.47 O ATOM 486 OE2 GLU 59 48.308 13.806 20.687 1.00 76.06 O ATOM 487 N ASP 60 43.867 9.442 21.134 1.00 22.66 N ATOM 488 CA ASP 60 43.300 8.420 20.267 1.00 22.16 C ATOM 489 C ASP 60 42.200 9.002 19.389 1.00 20.24 C ATOM 490 O ASP 60 42.070 8.629 18.222 1.00 19.35 O ATOM 491 CB ASP 60 42.712 7.267 21.079 1.00 26.97 C ATOM 492 CG ASP 60 43.761 6.267 21.538 1.00 42.59 C ATOM 493 OD1 ASP 60 44.819 6.131 20.876 1.00 46.70 O ATOM 494 OD2 ASP 60 43.504 5.602 22.563 1.00 48.78 O ATOM 495 N LEU 61 41.395 9.898 19.948 1.00 18.12 N ATOM 496 CA LEU 61 40.315 10.489 19.167 1.00 18.57 C ATOM 497 C LEU 61 40.906 11.316 18.024 1.00 18.43 C ATOM 498 O LEU 61 40.434 11.243 16.889 1.00 18.14 O ATOM 499 CB LEU 61 39.399 11.328 20.057 1.00 18.74 C ATOM 500 CG LEU 61 38.104 11.870 19.443 1.00 19.52 C ATOM 501 CD1 LEU 61 37.023 11.951 20.503 1.00 19.62 C ATOM 502 CD2 LEU 61 38.343 13.244 18.821 1.00 19.57 C ATOM 503 N LYS 62 41.992 12.027 18.313 1.00 14.10 N ATOM 504 CA LYS 62 42.651 12.861 17.310 1.00 25.17 C ATOM 505 C LYS 62 43.225 12.008 16.175 1.00 19.47 C ATOM 506 O LYS 62 43.117 12.381 15.008 1.00 20.51 O ATOM 507 CB LYS 62 43.738 13.726 17.957 1.00 36.01 C ATOM 508 CG LYS 62 44.388 14.716 17.002 1.00 30.67 C ATOM 509 CD LYS 62 45.100 15.820 17.763 1.00 57.97 C ATOM 510 CE LYS 62 46.325 15.302 18.477 1.00 60.47 C ATOM 511 NZ LYS 62 46.959 16.349 19.326 1.00 95.13 N ATOM 512 N LYS 63 43.827 10.868 16.520 1.00 15.72 N ATOM 513 CA LYS 63 44.365 9.952 15.510 1.00 17.84 C ATOM 514 C LYS 63 43.220 9.405 14.638 1.00 16.64 C ATOM 515 O LYS 63 43.347 9.344 13.420 1.00 22.11 O ATOM 516 CB LYS 63 45.139 8.796 16.161 1.00 18.47 C ATOM 517 CG LYS 63 46.337 9.278 16.971 1.00 43.82 C ATOM 518 CD LYS 63 47.565 8.412 16.751 1.00 79.73 C ATOM 519 CE LYS 63 47.522 7.129 17.559 1.00 64.33 C ATOM 520 NZ LYS 63 47.697 7.392 19.011 1.00 81.18 N ATOM 521 N HIS 64 42.102 9.040 15.260 1.00 16.01 N ATOM 522 CA HIS 64 40.944 8.537 14.530 1.00 16.67 C ATOM 523 C HIS 64 40.443 9.582 13.535 1.00 17.00 C ATOM 524 O HIS 64 40.003 9.245 12.441 1.00 16.92 O ATOM 525 CB HIS 64 39.799 8.244 15.501 1.00 18.21 C ATOM 526 CG HIS 64 40.000 7.019 16.337 1.00 30.05 C ATOM 527 CD2 HIS 64 40.923 6.033 16.204 1.00 34.21 C ATOM 528 ND1 HIS 64 39.083 6.654 17.294 1.00 35.15 N ATOM 529 CE1 HIS 64 39.458 5.462 17.709 1.00 36.97 C ATOM 530 NE2 HIS 64 40.566 5.045 17.079 1.00 38.23 N ATOM 531 N GLY 65 40.433 10.842 13.969 1.00 16.46 N ATOM 532 CA GLY 65 39.978 11.919 13.114 1.00 15.97 C ATOM 533 C GLY 65 40.872 12.059 11.892 1.00 15.92 C ATOM 534 O GLY 65 40.372 12.239 10.788 1.00 15.66 O ATOM 535 N VAL 66 42.187 11.997 12.087 1.00 15.57 N ATOM 536 CA VAL 66 43.121 12.112 10.973 1.00 15.88 C ATOM 537 C VAL 66 42.898 10.960 9.979 1.00 16.30 C ATOM 538 O VAL 66 42.860 11.178 8.771 1.00 16.82 O ATOM 539 CB VAL 66 44.599 12.114 11.473 1.00 16.69 C ATOM 540 CG1 VAL 66 45.577 11.864 10.302 1.00 15.99 C ATOM 541 CG2 VAL 66 44.929 13.452 12.140 1.00 15.60 C ATOM 542 N THR 67 42.703 9.748 10.497 1.00 16.38 N ATOM 543 CA THR 67 42.479 8.562 9.666 1.00 16.57 C ATOM 544 C THR 67 41.226 8.663 8.791 1.00 16.36 C ATOM 545 O THR 67 41.277 8.380 7.593 1.00 16.00 O ATOM 546 CB THR 67 42.405 7.293 10.545 1.00 16.87 C ATOM 547 CG2 THR 67 42.163 6.048 9.699 1.00 16.58 C ATOM 548 OG1 THR 67 43.641 7.151 11.255 1.00 18.58 O ATOM 549 N VAL 68 40.107 9.072 9.383 1.00 16.09 N ATOM 550 CA VAL 68 38.866 9.207 8.628 1.00 16.32 C ATOM 551 C VAL 68 38.986 10.263 7.531 1.00 15.35 C ATOM 552 O VAL 68 38.536 10.046 6.420 1.00 14.58 O ATOM 553 CB VAL 68 37.665 9.643 9.519 1.00 17.46 C ATOM 554 CG1 VAL 68 36.378 9.662 8.695 1.00 18.23 C ATOM 555 CG2 VAL 68 37.495 8.717 10.660 1.00 19.48 C ATOM 556 N LEU 69 39.529 11.431 7.874 1.00 14.71 N ATOM 557 CA LEU 69 39.654 12.522 6.907 1.00 14.96 C ATOM 558 C LEU 69 40.646 12.233 5.800 1.00 14.27 C ATOM 559 O LEU 69 40.445 12.656 4.669 1.00 14.38 O ATOM 560 CB LEU 69 39.998 13.850 7.581 1.00 14.82 C ATOM 561 CG LEU 69 38.924 14.450 8.497 1.00 17.52 C ATOM 562 CD1 LEU 69 39.251 15.935 8.752 1.00 16.43 C ATOM 563 CD2 LEU 69 37.543 14.324 7.863 1.00 18.33 C ATOM 564 N THR 70 41.720 11.529 6.128 1.00 13.87 N ATOM 565 CA THR 70 42.713 11.167 5.120 1.00 14.57 C ATOM 566 C THR 70 42.090 10.168 4.107 1.00 14.49 C ATOM 567 O THR 70 42.221 10.350 2.900 1.00 14.32 O ATOM 568 CB THR 70 43.987 10.568 5.784 1.00 15.27 C ATOM 569 CG2 THR 70 45.032 10.185 4.733 1.00 15.63 C ATOM 570 OG1 THR 70 44.553 11.546 6.660 1.00 15.83 O ATOM 571 N ALA 71 41.373 9.154 4.598 1.00 13.91 N ATOM 572 CA ALA 71 40.723 8.185 3.707 1.00 13.99 C ATOM 573 C ALA 71 39.624 8.870 2.885 1.00 13.64 C ATOM 574 O ALA 71 39.512 8.641 1.686 1.00 13.91 O ATOM 575 CB ALA 71 40.120 7.012 4.509 1.00 12.95 C ATOM 576 N LEU 72 38.832 9.734 3.517 1.00 13.67 N ATOM 577 CA LEU 72 37.762 10.433 2.812 1.00 13.56 C ATOM 578 C LEU 72 38.342 11.348 1.756 1.00 13.74 C ATOM 579 O LEU 72 37.851 11.380 0.633 1.00 13.66 O ATOM 580 CB LEU 72 36.866 11.226 3.772 1.00 13.74 C ATOM 581 CG LEU 72 35.719 12.004 3.093 1.00 14.92 C ATOM 582 CD1 LEU 72 34.791 11.045 2.310 1.00 15.38 C ATOM 583 CD2 LEU 72 34.929 12.829 4.128 1.00 14.89 C ATOM 584 N GLY 73 39.400 12.070 2.109 1.00 13.67 N ATOM 585 CA GLY 73 40.041 12.954 1.151 1.00 14.46 C ATOM 586 C GLY 73 40.567 12.204 -0.077 1.00 14.58 C ATOM 587 O GLY 73 40.436 12.672 -1.205 1.00 14.49 O ATOM 588 N ALA 74 41.148 11.030 0.141 1.00 14.74 N ATOM 589 CA ALA 74 41.682 10.233 -0.967 1.00 15.76 C ATOM 590 C ALA 74 40.538 9.840 -1.920 1.00 15.76 C ATOM 591 O ALA 74 40.685 9.855 -3.145 1.00 16.76 O ATOM 592 CB ALA 74 42.388 9.006 -0.424 1.00 14.49 C ATOM 593 N ILE 75 39.377 9.565 -1.346 1.00 15.77 N ATOM 594 CA ILE 75 38.201 9.198 -2.121 1.00 15.47 C ATOM 595 C ILE 75 37.675 10.400 -2.919 1.00 15.48 C ATOM 596 O ILE 75 37.423 10.285 -4.112 1.00 15.82 O ATOM 597 CB ILE 75 37.102 8.619 -1.183 1.00 15.70 C ATOM 598 CG1 ILE 75 37.531 7.225 -0.698 1.00 16.61 C ATOM 599 CG2 ILE 75 35.762 8.545 -1.889 1.00 15.10 C ATOM 601 N LEU 76 37.545 11.556 -2.277 1.00 15.31 N ATOM 602 CA LEU 76 37.043 12.747 -2.960 1.00 15.33 C ATOM 603 C LEU 76 37.938 13.174 -4.129 1.00 15.59 C ATOM 604 O LEU 76 37.455 13.603 -5.184 1.00 15.95 O ATOM 605 CB LEU 76 36.881 13.902 -1.967 1.00 15.64 C ATOM 606 CG LEU 76 35.798 13.730 -0.892 1.00 15.76 C ATOM 607 CD1 LEU 76 35.865 14.909 0.091 1.00 16.66 C ATOM 608 CD2 LEU 76 34.400 13.596 -1.515 1.00 15.59 C ATOM 609 N LYS 77 39.246 13.049 -3.939 1.00 10.96 N ATOM 610 CA LYS 77 40.200 13.416 -4.971 1.00 13.75 C ATOM 611 C LYS 77 40.129 12.553 -6.234 1.00 18.30 C ATOM 612 O LYS 77 40.689 12.927 -7.257 1.00 18.04 O ATOM 613 CB LYS 77 41.607 13.447 -4.396 1.00 14.38 C ATOM 614 CG LYS 77 41.799 14.594 -3.398 1.00 17.01 C ATOM 615 CD LYS 77 43.112 14.448 -2.663 1.00 16.79 C ATOM 616 CE LYS 77 43.349 15.610 -1.763 1.00 20.59 C ATOM 617 NZ LYS 77 44.698 15.538 -1.169 1.00 20.09 N ATOM 618 N LYS 78 39.450 11.406 -6.151 1.00 15.24 N ATOM 619 CA LYS 78 39.256 10.513 -7.302 1.00 18.28 C ATOM 620 C LYS 78 38.107 11.011 -8.180 1.00 18.94 C ATOM 621 O LYS 78 37.901 10.506 -9.282 1.00 19.00 O ATOM 622 CB LYS 78 38.948 9.074 -6.855 1.00 12.31 C ATOM 623 CG LYS 78 40.058 8.402 -6.058 1.00 25.64 C ATOM 624 CD LYS 78 41.390 8.455 -6.784 1.00 27.27 C ATOM 625 CE LYS 78 41.373 7.630 -8.053 1.00 32.49 C ATOM 626 NZ LYS 78 41.223 6.175 -7.763 1.00 55.16 N ATOM 627 N LYS 79 37.322 11.952 -7.656 1.00 15.11 N ATOM 628 CA LYS 79 36.200 12.535 -8.398 1.00 14.03 C ATOM 629 C LYS 79 35.218 11.516 -8.985 1.00 17.50 C ATOM 630 O LYS 79 34.814 11.616 -10.145 1.00 20.85 O ATOM 631 CB LYS 79 36.732 13.474 -9.488 1.00 12.58 C ATOM 632 CG LYS 79 37.537 14.629 -8.915 1.00 15.77 C ATOM 633 CD LYS 79 38.464 15.266 -9.921 1.00 26.30 C ATOM 634 CE LYS 79 37.734 15.964 -11.026 1.00 37.31 C ATOM 635 NZ LYS 79 38.682 16.840 -11.792 1.00 31.02 N ATOM 636 N GLY 80 34.828 10.543 -8.165 1.00 17.74 N ATOM 637 CA GLY 80 33.877 9.538 -8.600 1.00 17.93 C ATOM 638 C GLY 80 34.472 8.216 -9.068 1.00 18.43 C ATOM 639 O GLY 80 33.737 7.232 -9.162 1.00 19.23 O ATOM 640 N HIS 81 35.772 8.178 -9.369 1.00 17.70 N ATOM 641 CA HIS 81 36.424 6.948 -9.830 1.00 17.96 C ATOM 642 C HIS 81 37.072 6.331 -8.609 1.00 18.07 C ATOM 643 O HIS 81 38.284 6.169 -8.555 1.00 18.07 O ATOM 644 CB HIS 81 37.488 7.302 -10.869 1.00 17.33 C ATOM 645 CG HIS 81 36.923 7.926 -12.108 1.00 21.80 C ATOM 646 CD2 HIS 81 36.331 7.349 -13.183 1.00 20.31 C ATOM 647 ND1 HIS 81 36.884 9.285 -12.346 1.00 29.19 N ATOM 648 CE1 HIS 81 36.285 9.484 -13.529 1.00 23.50 C ATOM 649 NE2 HIS 81 35.932 8.338 -14.077 1.00 31.00 N ATOM 650 N HIS 82 36.249 5.908 -7.659 1.00 18.15 N ATOM 651 CA HIS 82 36.763 5.425 -6.381 1.00 18.12 C ATOM 652 C HIS 82 36.469 3.977 -6.004 1.00 18.26 C ATOM 653 O HIS 82 36.597 3.597 -4.836 1.00 17.89 O ATOM 654 CB HIS 82 36.205 6.348 -5.294 1.00 16.77 C ATOM 655 CG HIS 82 34.711 6.441 -5.314 1.00 15.19 C ATOM 656 CD2 HIS 82 33.779 5.477 -5.529 1.00 16.77 C ATOM 657 ND1 HIS 82 34.007 7.614 -5.167 1.00 16.60 N ATOM 658 CE1 HIS 82 32.699 7.331 -5.300 1.00 20.03 C ATOM 659 NE2 HIS 82 32.515 6.043 -5.521 1.00 21.22 N ATOM 660 N GLU 83 36.022 3.194 -6.972 1.00 19.59 N ATOM 661 CA GLU 83 35.699 1.797 -6.737 1.00 24.12 C ATOM 662 C GLU 83 36.800 1.024 -5.987 1.00 31.10 C ATOM 663 O GLU 83 36.516 0.307 -5.030 1.00 26.88 O ATOM 664 CB GLU 83 35.340 1.110 -8.066 1.00 36.52 C ATOM 665 CG GLU 83 36.267 1.451 -9.260 1.00 68.75 C ATOM 666 CD GLU 83 36.009 2.830 -9.890 1.00 69.80 C ATOM 667 OE1 GLU 83 34.877 3.359 -9.777 1.00 67.91 O ATOM 668 OE2 GLU 83 36.949 3.385 -10.503 1.00 42.41 O ATOM 669 N ALA 84 38.055 1.213 -6.380 1.00 25.65 N ATOM 670 CA ALA 84 39.162 0.519 -5.732 1.00 25.65 C ATOM 671 C ALA 84 39.333 0.911 -4.272 1.00 25.52 C ATOM 672 O ALA 84 39.651 0.067 -3.441 1.00 24.98 O ATOM 673 CB ALA 84 40.457 0.761 -6.482 1.00 25.75 C ATOM 674 N GLU 85 39.158 2.197 -3.977 1.00 23.55 N ATOM 675 CA GLU 85 39.296 2.714 -2.615 1.00 24.29 C ATOM 676 C GLU 85 38.138 2.293 -1.712 1.00 20.43 C ATOM 677 O GLU 85 38.310 2.139 -0.505 1.00 22.47 O ATOM 678 CB GLU 85 39.400 4.247 -2.620 1.00 27.01 C ATOM 679 CG GLU 85 40.721 4.830 -3.148 1.00 24.94 C ATOM 680 CD GLU 85 40.884 4.748 -4.668 1.00 36.11 C ATOM 681 OE1 GLU 85 39.887 4.578 -5.409 1.00 37.64 O ATOM 682 OE2 GLU 85 42.034 4.872 -5.131 1.00 54.23 O ATOM 683 N LEU 86 36.973 2.083 -2.310 1.00 21.53 N ATOM 684 CA LEU 86 35.787 1.702 -1.567 1.00 22.37 C ATOM 685 C LEU 86 35.717 0.249 -1.105 1.00 22.19 C ATOM 686 O LEU 86 35.101 -0.046 -0.087 1.00 22.24 O ATOM 687 CB LEU 86 34.534 2.016 -2.390 1.00 23.56 C ATOM 688 CG LEU 86 33.610 3.127 -1.892 1.00 25.46 C ATOM 689 CD1 LEU 86 34.361 4.444 -1.730 1.00 26.00 C ATOM 690 CD2 LEU 86 32.480 3.286 -2.891 1.00 26.41 C ATOM 691 N LYS 87 36.321 -0.663 -1.854 1.00 21.96 N ATOM 692 CA LYS 87 36.268 -2.081 -1.510 1.00 30.39 C ATOM 693 C LYS 87 36.767 -2.472 -0.118 1.00 23.62 C ATOM 694 O LYS 87 36.003 -3.037 0.668 1.00 20.01 O ATOM 695 CB LYS 87 36.927 -2.916 -2.610 1.00 31.09 C ATOM 696 CG LYS 87 36.128 -2.843 -3.882 1.00 42.74 C ATOM 697 CD LYS 87 36.898 -3.289 -5.102 1.00 56.03 C ATOM 698 CE LYS 87 36.889 -4.783 -5.250 1.00 45.89 C ATOM 699 NZ LYS 87 37.070 -5.172 -6.680 1.00 56.90 N ATOM 700 N PRO 88 38.035 -2.155 0.219 1.00 19.60 N ATOM 701 CA PRO 88 38.532 -2.521 1.549 1.00 19.38 C ATOM 702 C PRO 88 37.775 -1.793 2.658 1.00 19.80 C ATOM 703 O PRO 88 37.606 -2.324 3.758 1.00 19.67 O ATOM 704 CB PRO 88 39.992 -2.080 1.495 1.00 19.32 C ATOM 705 CG PRO 88 39.967 -0.918 0.532 1.00 18.97 C ATOM 706 CD PRO 88 39.085 -1.462 -0.553 1.00 19.16 C ATOM 707 N LEU 89 37.318 -0.580 2.345 1.00 19.25 N ATOM 708 CA LEU 89 36.583 0.254 3.280 1.00 19.30 C ATOM 709 C LEU 89 35.218 -0.349 3.610 1.00 18.74 C ATOM 710 O LEU 89 34.814 -0.405 4.769 1.00 17.93 O ATOM 711 CB LEU 89 36.372 1.625 2.653 1.00 21.41 C ATOM 712 CG LEU 89 36.099 2.774 3.608 1.00 23.97 C ATOM 713 CD1 LEU 89 37.351 2.949 4.488 1.00 25.15 C ATOM 714 CD2 LEU 89 35.817 4.050 2.803 1.00 25.28 C ATOM 715 N ALA 90 34.508 -0.786 2.577 1.00 17.83 N ATOM 716 CA ALA 90 33.192 -1.367 2.745 1.00 17.79 C ATOM 717 C ALA 90 33.278 -2.687 3.518 1.00 17.79 C ATOM 718 O ALA 90 32.428 -2.990 4.355 1.00 17.57 O ATOM 719 CB ALA 90 32.557 -1.585 1.375 1.00 18.05 C ATOM 720 N GLN 91 34.328 -3.459 3.250 1.00 17.80 N ATOM 721 CA GLN 91 34.500 -4.730 3.927 1.00 17.64 C ATOM 722 C GLN 91 34.746 -4.568 5.411 1.00 17.96 C ATOM 723 O GLN 91 34.133 -5.271 6.221 1.00 18.32 O ATOM 724 CB GLN 91 35.631 -5.558 3.314 1.00 17.05 C ATOM 725 CG GLN 91 35.748 -6.914 3.996 1.00 17.69 C ATOM 726 CD GLN 91 36.726 -7.845 3.320 1.00 20.82 C ATOM 727 OE1 GLN 91 37.821 -7.446 2.950 1.00 21.27 O ATOM 728 NE2 GLN 91 36.334 -9.106 3.171 1.00 14.83 N ATOM 729 N SER 92 35.650 -3.671 5.792 1.00 17.63 N ATOM 730 CA SER 92 35.897 -3.509 7.213 1.00 17.93 C ATOM 731 C SER 92 34.698 -2.906 7.964 1.00 18.26 C ATOM 732 O SER 92 34.383 -3.345 9.072 1.00 18.48 O ATOM 733 CB SER 92 37.194 -2.742 7.481 1.00 17.83 C ATOM 734 OG SER 92 37.106 -1.411 7.053 1.00 19.43 O ATOM 735 N HIS 93 33.977 -1.965 7.357 1.00 17.80 N ATOM 736 CA HIS 93 32.830 -1.391 8.053 1.00 18.32 C ATOM 737 C HIS 93 31.605 -2.282 8.092 1.00 19.08 C ATOM 738 O HIS 93 30.800 -2.170 9.008 1.00 19.46 O ATOM 739 CB HIS 93 32.471 -0.025 7.495 1.00 18.59 C ATOM 740 CG HIS 93 33.484 1.016 7.821 1.00 17.57 C ATOM 741 CD2 HIS 93 33.431 2.086 8.645 1.00 20.34 C ATOM 742 ND1 HIS 93 34.771 0.972 7.333 1.00 24.61 N ATOM 743 CE1 HIS 93 35.468 1.971 7.840 1.00 24.73 C ATOM 744 NE2 HIS 93 34.677 2.662 8.641 1.00 23.04 N ATOM 745 N ALA 94 31.466 -3.159 7.103 1.00 19.39 N ATOM 746 CA ALA 94 30.336 -4.073 7.035 1.00 20.34 C ATOM 747 C ALA 94 30.571 -5.311 7.893 1.00 21.10 C ATOM 748 O ALA 94 29.773 -5.619 8.771 1.00 21.89 O ATOM 749 CB ALA 94 30.087 -4.497 5.597 1.00 20.13 C ATOM 750 N THR 95 31.723 -5.944 7.702 1.00 21.61 N ATOM 751 CA THR 95 32.072 -7.190 8.386 1.00 22.02 C ATOM 752 C THR 95 32.761 -7.073 9.742 1.00 22.53 C ATOM 753 O THR 95 32.418 -7.798 10.669 1.00 23.24 O ATOM 754 CB THR 95 32.954 -8.061 7.466 1.00 22.32 C ATOM 755 CG2 THR 95 32.952 -9.541 7.916 1.00 21.45 C ATOM 756 OG1 THR 95 32.448 -7.974 6.131 1.00 21.73 O ATOM 757 N LYS 96 33.761 -6.211 9.859 1.00 21.64 N ATOM 758 CA LYS 96 34.454 -6.079 11.130 1.00 26.88 C ATOM 759 C LYS 96 33.743 -5.153 12.129 1.00 31.86 C ATOM 760 O LYS 96 33.320 -5.591 13.197 1.00 36.78 O ATOM 761 CB LYS 96 35.888 -5.612 10.898 1.00 28.79 C ATOM 762 CG LYS 96 36.850 -6.013 12.015 1.00 35.57 C ATOM 763 CD LYS 96 38.165 -5.271 11.876 1.00 55.25 C ATOM 764 CE LYS 96 39.330 -6.051 12.456 1.00 80.34 C ATOM 765 NZ LYS 96 39.794 -7.114 11.517 1.00 90.60 N ATOM 766 N HIS 97 33.578 -3.888 11.755 1.00 32.04 N ATOM 767 CA HIS 97 32.960 -2.882 12.619 1.00 32.23 C ATOM 768 C HIS 97 31.424 -2.860 12.656 1.00 32.70 C ATOM 769 O HIS 97 30.851 -2.412 13.653 1.00 33.29 O ATOM 770 CB HIS 97 33.467 -1.491 12.230 1.00 31.70 C ATOM 771 CG HIS 97 34.923 -1.448 11.869 1.00 33.74 C ATOM 772 CD2 HIS 97 35.548 -0.834 10.830 1.00 33.36 C ATOM 773 ND1 HIS 97 35.924 -2.049 12.601 1.00 32.24 N ATOM 774 CE1 HIS 97 37.104 -1.781 12.004 1.00 28.00 C ATOM 775 NE2 HIS 97 36.932 -1.044 10.923 1.00 33.21 N ATOM 776 N LYS 98 30.768 -3.316 11.581 1.00 30.50 N ATOM 777 CA LYS 98 29.296 -3.331 11.474 1.00 23.13 C ATOM 778 C LYS 98 28.686 -1.951 11.683 1.00 32.58 C ATOM 779 O LYS 98 27.986 -1.708 12.659 1.00 26.86 O ATOM 780 CB LYS 98 28.678 -4.327 12.447 1.00 27.87 C ATOM 781 CG LYS 98 28.118 -5.559 11.760 1.00 67.51 C ATOM 782 CD LYS 98 28.648 -6.835 12.384 1.00 60.67 C ATOM 783 CE LYS 98 30.163 -6.879 12.311 1.00 73.97 C ATOM 784 NZ LYS 98 30.711 -8.157 12.837 1.00 83.45 N ATOM 785 N ILE 99 28.905 -1.074 10.712 1.00 21.99 N ATOM 786 CA ILE 99 28.442 0.291 10.773 1.00 21.17 C ATOM 787 C ILE 99 27.270 0.460 9.842 1.00 21.88 C ATOM 788 O ILE 99 27.426 0.358 8.624 1.00 22.43 O ATOM 789 CB ILE 99 29.561 1.257 10.300 1.00 20.50 C ATOM 790 CG1 ILE 99 30.873 0.961 11.034 1.00 20.26 C ATOM 791 CG2 ILE 99 29.107 2.712 10.435 1.00 19.71 C ATOM 793 N PRO 100 26.078 0.743 10.391 1.00 22.07 N ATOM 794 CA PRO 100 24.920 0.922 9.510 1.00 22.57 C ATOM 795 C PRO 100 25.006 2.221 8.682 1.00 23.19 C ATOM 796 O PRO 100 25.618 3.208 9.103 1.00 22.81 O ATOM 797 CB PRO 100 23.738 0.925 10.494 1.00 22.51 C ATOM 798 CG PRO 100 24.332 1.438 11.753 1.00 22.22 C ATOM 799 CD PRO 100 25.681 0.764 11.810 1.00 21.66 C ATOM 800 N ILE 101 24.423 2.196 7.488 1.00 23.79 N ATOM 801 CA ILE 101 24.424 3.358 6.599 1.00 24.96 C ATOM 802 C ILE 101 24.008 4.622 7.337 1.00 25.16 C ATOM 803 O ILE 101 24.564 5.687 7.102 1.00 25.83 O ATOM 804 CB ILE 101 23.487 3.124 5.362 1.00 25.80 C ATOM 805 CG1 ILE 101 24.053 2.005 4.471 1.00 26.54 C ATOM 806 CG2 ILE 101 23.274 4.405 4.571 1.00 26.60 C ATOM 808 N LYS 102 23.025 4.490 8.222 1.00 21.86 N ATOM 809 CA LYS 102 22.502 5.598 9.034 1.00 20.48 C ATOM 810 C LYS 102 23.627 6.382 9.736 1.00 17.82 C ATOM 811 O LYS 102 23.554 7.603 9.864 1.00 18.65 O ATOM 812 CB LYS 102 21.533 5.024 10.082 1.00 26.50 C ATOM 813 CG LYS 102 20.949 6.017 11.042 1.00 49.26 C ATOM 814 CD LYS 102 19.785 6.806 10.436 1.00 72.73 C ATOM 815 CE LYS 102 18.800 7.307 11.515 1.00 95.55 C ATOM 816 NZ LYS 102 17.820 8.291 11.055 1.00 82.64 N ATOM 817 N TYR 103 24.650 5.676 10.212 1.00 16.72 N ATOM 818 CA TYR 103 25.770 6.334 10.882 1.00 16.88 C ATOM 819 C TYR 103 26.633 7.116 9.892 1.00 16.39 C ATOM 820 O TYR 103 27.285 8.086 10.272 1.00 16.20 O ATOM 821 CB TYR 103 26.632 5.325 11.640 1.00 16.57 C ATOM 822 CG TYR 103 26.030 4.762 12.921 1.00 17.87 C ATOM 823 CD1 TYR 103 24.699 4.981 13.261 1.00 18.98 C ATOM 824 CD2 TYR 103 26.801 3.979 13.772 1.00 18.35 C ATOM 825 CE1 TYR 103 24.154 4.420 14.429 1.00 20.22 C ATOM 826 CE2 TYR 103 26.278 3.418 14.922 1.00 19.76 C ATOM 827 CZ TYR 103 24.964 3.636 15.245 1.00 20.94 C ATOM 829 N LEU 104 26.675 6.663 8.637 1.00 16.33 N ATOM 830 CA LEU 104 27.444 7.353 7.598 1.00 15.99 C ATOM 831 C LEU 104 26.701 8.648 7.254 1.00 15.96 C ATOM 832 O LEU 104 27.323 9.662 6.922 1.00 15.10 O ATOM 833 CB LEU 104 27.647 6.465 6.369 1.00 16.49 C ATOM 834 CG LEU 104 28.432 5.162 6.632 1.00 17.26 C ATOM 835 CD1 LEU 104 28.544 4.350 5.344 1.00 18.13 C ATOM 836 CD2 LEU 104 29.811 5.451 7.185 1.00 16.64 C ATOM 837 N GLU 105 25.373 8.623 7.359 1.00 11.84 N ATOM 838 CA GLU 105 24.583 9.832 7.142 1.00 16.11 C ATOM 839 C GLU 105 24.880 10.814 8.294 1.00 15.21 C ATOM 840 O GLU 105 25.044 12.013 8.066 1.00 15.53 O ATOM 841 CB GLU 105 23.096 9.507 7.144 1.00 15.95 C ATOM 842 CG GLU 105 22.609 8.830 5.879 1.00 30.07 C ATOM 843 CD GLU 105 21.179 8.312 5.980 1.00 39.99 C ATOM 844 OE1 GLU 105 20.511 8.546 6.946 1.00 37.58 O ATOM 845 OE2 GLU 105 20.751 7.619 5.044 1.00 41.07 O ATOM 846 N PHE 106 24.962 10.292 9.523 1.00 15.05 N ATOM 847 CA PHE 106 25.255 11.114 10.696 1.00 15.17 C ATOM 848 C PHE 106 26.614 11.810 10.592 1.00 14.86 C ATOM 849 O PHE 106 26.725 12.979 10.954 1.00 14.34 O ATOM 850 CB PHE 106 25.234 10.287 11.985 1.00 16.09 C ATOM 851 CG PHE 106 23.864 9.765 12.376 1.00 17.81 C ATOM 852 CD1 PHE 106 22.710 10.224 11.754 1.00 18.00 C ATOM 853 CD2 PHE 106 23.739 8.826 13.396 1.00 17.99 C ATOM 854 CE1 PHE 106 21.459 9.757 12.147 1.00 18.79 C ATOM 855 CE2 PHE 106 22.487 8.360 13.790 1.00 18.31 C ATOM 856 CZ PHE 106 21.357 8.827 13.166 1.00 18.23 C ATOM 857 N ILE 107 27.648 11.092 10.149 1.00 14.34 N ATOM 858 CA ILE 107 28.968 11.707 10.027 1.00 14.48 C ATOM 859 C ILE 107 28.984 12.711 8.863 1.00 15.05 C ATOM 860 O ILE 107 29.715 13.709 8.907 1.00 15.26 O ATOM 861 CB ILE 107 30.134 10.663 9.904 1.00 14.62 C ATOM 862 CG1 ILE 107 31.483 11.353 10.220 1.00 14.37 C ATOM 863 CG2 ILE 107 30.164 10.034 8.505 1.00 13.15 C ATOM 865 N SER 108 28.159 12.460 7.842 1.00 15.26 N ATOM 866 CA SER 108 28.047 13.363 6.693 1.00 15.68 C ATOM 867 C SER 108 27.545 14.710 7.184 1.00 15.90 C ATOM 868 O SER 108 28.077 15.757 6.805 1.00 16.25 O ATOM 869 CB SER 108 27.082 12.802 5.652 1.00 15.50 C ATOM 870 OG SER 108 27.672 11.680 5.004 1.00 17.49 O ATOM 871 N GLU 109 26.527 14.660 8.044 1.00 17.48 N ATOM 872 CA GLU 109 25.931 15.835 8.659 1.00 19.02 C ATOM 873 C GLU 109 26.971 16.580 9.497 1.00 9.86 C ATOM 874 O GLU 109 27.023 17.810 9.482 1.00 10.23 O ATOM 875 CB GLU 109 24.769 15.399 9.554 1.00 17.30 C ATOM 876 CG GLU 109 24.105 16.524 10.329 1.00 35.11 C ATOM 877 CD GLU 109 23.070 16.017 11.339 1.00 74.83 C ATOM 878 OE1 GLU 109 23.176 14.858 11.820 1.00 60.11 O ATOM 879 OE2 GLU 109 22.145 16.795 11.664 1.00 88.99 O ATOM 880 N ALA 110 27.790 15.836 10.231 1.00 11.06 N ATOM 881 CA ALA 110 28.823 16.443 11.075 1.00 12.23 C ATOM 882 C ALA 110 29.872 17.166 10.216 1.00 12.35 C ATOM 883 O ALA 110 30.348 18.255 10.580 1.00 13.15 O ATOM 884 CB ALA 110 29.494 15.379 11.961 1.00 11.22 C ATOM 885 N ILE 111 30.210 16.571 9.071 1.00 11.96 N ATOM 886 CA ILE 111 31.192 17.159 8.161 1.00 12.38 C ATOM 887 C ILE 111 30.672 18.484 7.591 1.00 12.69 C ATOM 888 O ILE 111 31.343 19.516 7.658 1.00 12.48 O ATOM 889 CB ILE 111 31.555 16.179 7.013 1.00 12.70 C ATOM 890 CG1 ILE 111 32.413 15.038 7.574 1.00 12.53 C ATOM 891 CG2 ILE 111 32.315 16.930 5.885 1.00 11.83 C ATOM 893 N ILE 112 29.443 18.457 7.105 1.00 13.31 N ATOM 894 CA ILE 112 28.832 19.645 6.544 1.00 14.91 C ATOM 895 C ILE 112 28.716 20.761 7.590 1.00 15.30 C ATOM 896 O ILE 112 28.997 21.930 7.286 1.00 15.30 O ATOM 897 CB ILE 112 27.467 19.295 5.938 1.00 15.57 C ATOM 898 CG1 ILE 112 27.686 18.453 4.680 1.00 15.70 C ATOM 899 CG2 ILE 112 26.644 20.576 5.645 1.00 16.14 C ATOM 901 N HIS 113 28.366 20.386 8.825 1.00 14.97 N ATOM 902 CA HIS 113 28.230 21.342 9.908 1.00 15.13 C ATOM 903 C HIS 113 29.552 22.034 10.221 1.00 15.44 C ATOM 904 O HIS 113 29.598 23.249 10.435 1.00 15.64 O ATOM 905 CB HIS 113 27.730 20.650 11.178 1.00 17.79 C ATOM 906 CG HIS 113 27.597 21.579 12.347 1.00 23.44 C ATOM 907 CD2 HIS 113 28.524 21.990 13.250 1.00 24.06 C ATOM 908 ND1 HIS 113 26.452 22.286 12.641 1.00 29.78 N ATOM 909 CE1 HIS 113 26.719 23.099 13.675 1.00 24.39 C ATOM 910 NE2 HIS 113 27.966 22.954 14.080 1.00 29.30 N ATOM 911 N VAL 114 30.618 21.250 10.294 1.00 14.94 N ATOM 912 CA VAL 114 31.931 21.791 10.611 1.00 14.73 C ATOM 913 C VAL 114 32.499 22.683 9.505 1.00 14.66 C ATOM 914 O VAL 114 33.068 23.740 9.813 1.00 14.94 O ATOM 915 CB VAL 114 32.920 20.662 10.987 1.00 14.48 C ATOM 916 CG1 VAL 114 34.340 21.219 11.164 1.00 13.11 C ATOM 917 CG2 VAL 114 32.440 19.999 12.268 1.00 13.96 C ATOM 918 N LEU 115 32.338 22.280 8.237 1.00 13.94 N ATOM 919 CA LEU 115 32.835 23.092 7.122 1.00 13.91 C ATOM 920 C LEU 115 32.080 24.408 7.094 1.00 14.23 C ATOM 921 O LEU 115 32.648 25.463 6.832 1.00 13.51 O ATOM 922 CB LEU 115 32.666 22.375 5.781 1.00 14.09 C ATOM 923 CG LEU 115 33.424 21.045 5.668 1.00 15.85 C ATOM 924 CD1 LEU 115 33.409 20.552 4.236 1.00 16.60 C ATOM 925 CD2 LEU 115 34.834 21.202 6.155 1.00 15.79 C ATOM 926 N HIS 116 30.786 24.333 7.380 1.00 14.42 N ATOM 927 CA HIS 116 29.968 25.515 7.403 1.00 15.44 C ATOM 928 C HIS 116 30.475 26.489 8.469 1.00 16.15 C ATOM 929 O HIS 116 30.602 27.680 8.191 1.00 16.39 O ATOM 930 CB HIS 116 28.511 25.146 7.646 1.00 15.97 C ATOM 931 CG HIS 116 27.603 26.331 7.736 1.00 23.94 C ATOM 932 CD2 HIS 116 27.027 26.913 8.821 1.00 20.22 C ATOM 933 ND1 HIS 116 27.213 27.089 6.653 1.00 27.64 N ATOM 934 CE1 HIS 116 26.432 28.083 7.102 1.00 23.91 C ATOM 935 NE2 HIS 116 26.290 28.016 8.411 1.00 30.41 N ATOM 936 N SER 117 30.831 25.980 9.651 1.00 16.25 N ATOM 937 CA SER 117 31.319 26.838 10.732 1.00 17.46 C ATOM 938 C SER 117 32.694 27.451 10.476 1.00 16.93 C ATOM 939 O SER 117 32.892 28.658 10.634 1.00 16.79 O ATOM 940 CB SER 117 31.411 26.060 12.046 1.00 17.33 C ATOM 941 OG SER 117 30.143 25.595 12.424 1.00 23.22 O ATOM 942 N ARG 118 33.642 26.604 10.099 1.00 16.00 N ATOM 943 CA ARG 118 35.002 27.048 9.883 1.00 16.09 C ATOM 944 C ARG 118 35.311 27.709 8.563 1.00 16.42 C ATOM 945 O ARG 118 36.267 28.465 8.477 1.00 16.85 O ATOM 946 CB ARG 118 35.956 25.877 10.095 1.00 16.31 C ATOM 947 CG ARG 118 35.923 25.326 11.507 1.00 17.66 C ATOM 948 CD ARG 118 36.833 24.121 11.658 1.00 18.91 C ATOM 949 NE ARG 118 38.232 24.485 11.507 1.00 23.08 N ATOM 950 CZ ARG 118 39.221 23.958 12.218 1.00 28.58 C ATOM 951 NH1 ARG 118 38.969 23.042 13.139 1.00 19.83 N ATOM 952 NH2 ARG 118 40.465 24.345 11.995 1.00 22.14 N ATOM 953 N HIS 119 34.513 27.438 7.535 1.00 16.21 N ATOM 954 CA HIS 119 34.776 27.995 6.215 1.00 16.52 C ATOM 955 C HIS 119 33.570 28.657 5.558 1.00 16.96 C ATOM 956 O HIS 119 33.264 28.372 4.401 1.00 16.55 O ATOM 957 CB HIS 119 35.322 26.881 5.307 1.00 15.35 C ATOM 958 CG HIS 119 36.503 26.173 5.887 1.00 16.81 C ATOM 959 CD2 HIS 119 36.596 24.945 6.456 1.00 12.45 C ATOM 960 ND1 HIS 119 37.754 26.740 6.014 1.00 17.07 N ATOM 961 CE1 HIS 119 38.553 25.864 6.649 1.00 15.79 C ATOM 962 NE2 HIS 119 37.906 24.754 6.940 1.00 14.56 N ATOM 963 N PRO 120 32.924 29.613 6.253 1.00 17.60 N ATOM 964 CA PRO 120 31.752 30.293 5.690 1.00 18.44 C ATOM 965 C PRO 120 31.994 30.906 4.305 1.00 18.89 C ATOM 966 O PRO 120 31.163 30.775 3.420 1.00 19.93 O ATOM 967 CB PRO 120 31.416 31.353 6.755 1.00 18.40 C ATOM 968 CG PRO 120 32.734 31.641 7.386 1.00 18.17 C ATOM 969 CD PRO 120 33.343 30.256 7.512 1.00 17.55 C ATOM 970 N GLY 121 33.168 31.490 4.101 1.00 19.23 N ATOM 971 CA GLY 121 33.482 32.098 2.826 1.00 19.49 C ATOM 972 C GLY 121 33.638 31.118 1.674 1.00 19.88 C ATOM 973 O GLY 121 33.383 31.492 0.531 1.00 21.13 O ATOM 974 N ASN 122 34.066 29.885 1.947 1.00 18.33 N ATOM 975 CA ASN 122 34.224 28.896 0.881 1.00 17.56 C ATOM 976 C ASN 122 33.145 27.830 0.958 1.00 17.40 C ATOM 977 O ASN 122 33.271 26.768 0.330 1.00 18.22 O ATOM 978 CB ASN 122 35.603 28.215 0.956 1.00 16.47 C ATOM 979 CG ASN 122 36.744 29.175 0.651 1.00 23.94 C ATOM 980 OD1 ASN 122 37.668 29.352 1.452 1.00 21.42 O ATOM 981 ND2 ASN 122 36.674 29.812 -0.504 1.00 17.36 N ATOM 982 N PHE 123 32.082 28.095 1.714 1.00 16.20 N ATOM 983 CA PHE 123 31.031 27.091 1.861 1.00 15.22 C ATOM 984 C PHE 123 29.638 27.707 1.810 1.00 15.07 C ATOM 985 O PHE 123 28.854 27.581 2.755 1.00 14.90 O ATOM 986 CB PHE 123 31.233 26.291 3.167 1.00 14.16 C ATOM 987 CG PHE 123 30.680 24.889 3.137 1.00 13.87 C ATOM 988 CD1 PHE 123 31.217 23.933 2.294 1.00 13.81 C ATOM 989 CD2 PHE 123 29.654 24.508 4.002 1.00 13.82 C ATOM 990 CE1 PHE 123 30.736 22.601 2.319 1.00 14.46 C ATOM 991 CE2 PHE 123 29.175 23.194 4.037 1.00 13.98 C ATOM 992 CZ PHE 123 29.714 22.240 3.198 1.00 14.00 C ATOM 993 N GLY 124 29.374 28.424 0.723 1.00 14.89 N ATOM 994 CA GLY 124 28.066 29.008 0.499 1.00 14.52 C ATOM 995 C GLY 124 27.131 27.883 0.064 1.00 14.67 C ATOM 996 O GLY 124 27.517 26.713 0.061 1.00 13.74 O ATOM 997 N ALA 125 25.924 28.240 -0.357 1.00 14.54 N ATOM 998 CA ALA 125 24.917 27.259 -0.746 1.00 14.94 C ATOM 999 C ALA 125 25.330 26.324 -1.882 1.00 15.13 C ATOM 1000 O ALA 125 25.058 25.124 -1.837 1.00 15.68 O ATOM 1001 CB ALA 125 23.600 27.970 -1.090 1.00 14.69 C ATOM 1002 N ASP 126 25.955 26.880 -2.913 1.00 13.43 N ATOM 1003 CA ASP 126 26.388 26.088 -4.051 1.00 10.99 C ATOM 1004 C ASP 126 27.429 25.070 -3.619 1.00 14.91 C ATOM 1005 O ASP 126 27.315 23.908 -3.964 1.00 15.09 O ATOM 1006 CB ASP 126 26.948 26.989 -5.153 1.00 21.24 C ATOM 1007 CG ASP 126 25.867 27.804 -5.856 1.00 26.37 C ATOM 1008 OD1 ASP 126 24.685 27.408 -5.820 1.00 25.47 O ATOM 1009 OD2 ASP 126 26.209 28.840 -6.458 1.00 35.73 O ATOM 1010 N ALA 127 28.446 25.508 -2.875 1.00 13.00 N ATOM 1011 CA ALA 127 29.495 24.603 -2.377 1.00 13.19 C ATOM 1012 C ALA 127 28.926 23.532 -1.425 1.00 13.50 C ATOM 1013 O ALA 127 29.358 22.381 -1.455 1.00 14.17 O ATOM 1014 CB ALA 127 30.631 25.403 -1.677 1.00 12.59 C ATOM 1015 N GLN 128 27.973 23.902 -0.575 1.00 12.96 N ATOM 1016 CA GLN 128 27.375 22.922 0.329 1.00 13.45 C ATOM 1017 C GLN 128 26.566 21.885 -0.482 1.00 13.71 C ATOM 1018 O GLN 128 26.579 20.692 -0.161 1.00 14.19 O ATOM 1019 CB GLN 128 26.479 23.596 1.390 1.00 13.18 C ATOM 1020 CG GLN 128 25.765 22.583 2.295 1.00 15.46 C ATOM 1021 CD GLN 128 25.069 23.195 3.504 1.00 17.66 C ATOM 1022 OE1 GLN 128 25.372 24.311 3.925 1.00 19.04 O ATOM 1023 NE2 GLN 128 24.140 22.445 4.081 1.00 16.30 N ATOM 1024 N GLY 129 25.861 22.348 -1.516 1.00 13.17 N ATOM 1025 CA GLY 129 25.088 21.443 -2.354 1.00 13.25 C ATOM 1026 C GLY 129 26.014 20.439 -3.043 1.00 13.29 C ATOM 1027 O GLY 129 25.688 19.247 -3.146 1.00 13.24 O ATOM 1028 N ALA 130 27.172 20.913 -3.501 1.00 12.37 N ATOM 1029 CA ALA 130 28.145 20.044 -4.156 1.00 13.20 C ATOM 1030 C ALA 130 28.715 19.001 -3.176 1.00 13.32 C ATOM 1031 O ALA 130 28.837 17.822 -3.517 1.00 13.58 O ATOM 1032 CB ALA 130 29.268 20.869 -4.757 1.00 12.82 C ATOM 1033 N MET 131 29.046 19.439 -1.963 1.00 13.52 N ATOM 1034 CA MET 131 29.592 18.553 -0.926 1.00 14.15 C ATOM 1035 C MET 131 28.563 17.476 -0.540 1.00 13.73 C ATOM 1036 O MET 131 28.891 16.292 -0.427 1.00 12.90 O ATOM 1037 CB MET 131 30.018 19.379 0.312 1.00 14.76 C ATOM 1038 CG MET 131 30.675 18.564 1.445 1.00 15.74 C ATOM 1039 SD MET 131 32.201 17.676 0.927 1.00 18.67 S ATOM 1040 CE MET 131 33.349 18.957 1.034 1.00 16.91 C ATOM 1041 N ASN 132 27.317 17.899 -0.341 1.00 13.80 N ATOM 1042 CA ASN 132 26.253 16.967 -0.011 1.00 14.77 C ATOM 1043 C ASN 132 26.109 15.913 -1.129 1.00 15.12 C ATOM 1044 O ASN 132 25.927 14.725 -0.860 1.00 15.96 O ATOM 1045 CB ASN 132 24.925 17.699 0.156 1.00 13.92 C ATOM 1046 CG ASN 132 23.770 16.739 0.357 1.00 16.64 C ATOM 1047 OD1 ASN 132 23.803 15.923 1.265 1.00 17.59 O ATOM 1048 ND2 ASN 132 22.777 16.796 -0.521 1.00 18.26 N ATOM 1049 N LYS 133 26.201 16.364 -2.377 1.00 17.32 N ATOM 1050 CA LYS 133 26.084 15.489 -3.538 1.00 14.82 C ATOM 1051 C LYS 133 27.246 14.480 -3.574 1.00 17.90 C ATOM 1052 O LYS 133 27.050 13.289 -3.860 1.00 13.48 O ATOM 1053 CB LYS 133 26.057 16.345 -4.803 1.00 19.71 C ATOM 1054 CG LYS 133 25.420 15.682 -5.984 1.00 28.22 C ATOM 1055 CD LYS 133 25.308 16.625 -7.163 1.00 27.62 C ATOM 1056 CE LYS 133 24.914 15.859 -8.413 1.00 52.97 C ATOM 1057 NZ LYS 133 24.905 16.725 -9.614 1.00 74.53 N ATOM 1058 N ALA 134 28.442 14.950 -3.229 1.00 12.87 N ATOM 1059 CA ALA 134 29.630 14.091 -3.218 1.00 13.47 C ATOM 1060 C ALA 134 29.534 13.030 -2.115 1.00 13.87 C ATOM 1061 O ALA 134 29.860 11.859 -2.339 1.00 14.49 O ATOM 1062 CB ALA 134 30.910 14.939 -3.056 1.00 12.22 C ATOM 1063 N LEU 135 29.034 13.434 -0.946 1.00 13.82 N ATOM 1064 CA LEU 135 28.879 12.522 0.189 1.00 13.98 C ATOM 1065 C LEU 135 27.727 11.537 -0.044 1.00 14.11 C ATOM 1066 O LEU 135 27.775 10.407 0.425 1.00 14.20 O ATOM 1067 CB LEU 135 28.695 13.310 1.496 1.00 13.75 C ATOM 1068 CG LEU 135 29.929 14.062 2.025 1.00 14.13 C ATOM 1069 CD1 LEU 135 29.580 14.870 3.284 1.00 13.81 C ATOM 1070 CD2 LEU 135 31.034 13.075 2.339 1.00 13.90 C ATOM 1071 N GLU 136 26.679 11.973 -0.744 1.00 13.49 N ATOM 1072 CA GLU 136 25.573 11.074 -1.066 1.00 16.04 C ATOM 1073 C GLU 136 26.067 9.999 -2.047 1.00 14.96 C ATOM 1074 O GLU 136 25.653 8.831 -1.963 1.00 16.34 O ATOM 1075 CB GLU 136 24.414 11.828 -1.707 1.00 12.46 C ATOM 1076 CG GLU 136 23.703 12.789 -0.789 1.00 44.80 C ATOM 1077 CD GLU 136 22.473 13.394 -1.432 1.00 52.55 C ATOM 1078 OE1 GLU 136 22.235 13.142 -2.637 1.00 48.81 O ATOM 1079 OE2 GLU 136 21.740 14.118 -0.728 1.00 56.19 O ATOM 1080 N LEU 137 26.900 10.421 -3.008 1.00 15.12 N ATOM 1081 CA LEU 137 27.482 9.515 -4.002 1.00 15.96 C ATOM 1082 C LEU 137 28.283 8.449 -3.238 1.00 15.89 C ATOM 1083 O LEU 137 28.123 7.250 -3.486 1.00 15.91 O ATOM 1084 CB LEU 137 28.393 10.273 -4.992 1.00 16.54 C ATOM 1085 CG LEU 137 29.149 9.382 -5.990 1.00 17.78 C ATOM 1086 CD1 LEU 137 28.184 8.728 -6.969 1.00 19.20 C ATOM 1087 CD2 LEU 137 30.192 10.163 -6.740 1.00 18.22 C ATOM 1088 N PHE 138 29.104 8.901 -2.290 1.00 15.56 N ATOM 1089 CA PHE 138 29.901 8.016 -1.440 1.00 16.09 C ATOM 1090 C PHE 138 29.003 7.006 -0.703 1.00 15.97 C ATOM 1091 O PHE 138 29.276 5.805 -0.743 1.00 16.01 O ATOM 1092 CB PHE 138 30.706 8.854 -0.438 1.00 17.10 C ATOM 1093 CG PHE 138 31.336 8.055 0.682 1.00 18.65 C ATOM 1094 CD1 PHE 138 32.408 7.211 0.438 1.00 19.08 C ATOM 1095 CD2 PHE 138 30.851 8.152 1.981 1.00 18.98 C ATOM 1096 CE1 PHE 138 32.983 6.479 1.465 1.00 19.60 C ATOM 1097 CE2 PHE 138 31.426 7.417 3.011 1.00 19.50 C ATOM 1098 CZ PHE 138 32.496 6.579 2.748 1.00 19.07 C ATOM 1099 N ARG 139 27.936 7.487 -0.055 1.00 15.51 N ATOM 1100 CA ARG 139 27.002 6.615 0.673 1.00 16.38 C ATOM 1101 C ARG 139 26.266 5.598 -0.209 1.00 16.38 C ATOM 1102 O ARG 139 25.990 4.478 0.225 1.00 17.17 O ATOM 1103 CB ARG 139 25.967 7.431 1.468 1.00 14.71 C ATOM 1104 CG ARG 139 26.585 8.244 2.606 1.00 21.56 C ATOM 1105 CD ARG 139 25.567 8.664 3.645 1.00 14.30 C ATOM 1106 NE ARG 139 24.454 9.404 3.064 1.00 18.17 N ATOM 1107 CZ ARG 139 24.460 10.703 2.777 1.00 21.08 C ATOM 1108 NH1 ARG 139 25.530 11.459 3.004 1.00 20.58 N ATOM 1109 NH2 ARG 139 23.378 11.247 2.255 1.00 16.97 N ATOM 1110 N LYS 140 25.890 6.026 -1.411 1.00 16.09 N ATOM 1111 CA LYS 140 25.192 5.173 -2.374 1.00 20.00 C ATOM 1112 C LYS 140 26.098 4.014 -2.808 1.00 21.76 C ATOM 1113 O LYS 140 25.676 2.863 -2.836 1.00 14.42 O ATOM 1114 CB LYS 140 24.790 5.986 -3.611 1.00 27.06 C ATOM 1115 CG LYS 140 23.972 5.206 -4.634 1.00 45.99 C ATOM 1116 CD LYS 140 23.402 6.100 -5.741 1.00 79.30 C ATOM 1117 CE LYS 140 24.365 6.287 -6.920 1.00 85.35 C ATOM 1118 NZ LYS 140 25.631 6.990 -6.564 1.00 82.64 N ATOM 1119 N ASP 141 27.341 4.329 -3.160 1.00 13.76 N ATOM 1120 CA ASP 141 28.285 3.302 -3.582 1.00 14.64 C ATOM 1121 C ASP 141 28.650 2.361 -2.438 1.00 18.09 C ATOM 1122 O ASP 141 28.698 1.146 -2.626 1.00 18.83 O ATOM 1123 CB ASP 141 29.519 3.943 -4.215 1.00 17.81 C ATOM 1124 CG ASP 141 29.211 4.607 -5.550 1.00 21.65 C ATOM 1125 OD1 ASP 141 28.120 4.365 -6.097 1.00 22.33 O ATOM 1126 OD2 ASP 141 30.043 5.385 -6.048 1.00 22.08 O ATOM 1127 N ILE 142 28.849 2.907 -1.243 1.00 19.69 N ATOM 1128 CA ILE 142 29.172 2.078 -0.082 1.00 20.48 C ATOM 1129 C ILE 142 28.030 1.100 0.235 1.00 20.33 C ATOM 1130 O ILE 142 28.283 -0.080 0.528 1.00 20.05 O ATOM 1131 CB ILE 142 29.456 2.930 1.190 1.00 21.51 C ATOM 1132 CG1 ILE 142 30.911 3.387 1.209 1.00 23.16 C ATOM 1133 CG2 ILE 142 29.196 2.110 2.455 1.00 22.03 C ATOM 1135 N ALA 143 26.786 1.591 0.204 1.00 19.87 N ATOM 1136 CA ALA 143 25.639 0.732 0.505 1.00 20.12 C ATOM 1137 C ALA 143 25.446 -0.353 -0.549 1.00 20.01 C ATOM 1138 O ALA 143 25.058 -1.458 -0.215 1.00 20.33 O ATOM 1139 CB ALA 143 24.379 1.531 0.717 1.00 19.82 C ATOM 1140 N ALA 144 25.776 -0.058 -1.804 1.00 19.98 N ATOM 1141 CA ALA 144 25.681 -1.066 -2.853 1.00 20.13 C ATOM 1142 C ALA 144 26.718 -2.168 -2.538 1.00 20.63 C ATOM 1143 O ALA 144 26.431 -3.366 -2.671 1.00 20.63 O ATOM 1144 CB ALA 144 25.962 -0.444 -4.200 1.00 19.92 C ATOM 1145 N LYS 145 27.908 -1.759 -2.090 1.00 14.94 N ATOM 1146 CA LYS 145 28.961 -2.703 -1.733 1.00 18.47 C ATOM 1147 C LYS 145 28.572 -3.526 -0.501 1.00 19.66 C ATOM 1148 O LYS 145 28.871 -4.722 -0.426 1.00 17.53 O ATOM 1149 CB LYS 145 30.280 -1.969 -1.501 1.00 17.80 C ATOM 1150 CG LYS 145 31.031 -1.636 -2.759 1.00 36.20 C ATOM 1151 CD LYS 145 30.080 -1.244 -3.902 1.00 73.26 C ATOM 1152 CE LYS 145 30.622 -0.117 -4.755 1.00 63.31 C ATOM 1153 NZ LYS 145 29.511 0.471 -5.560 1.00 26.86 N ATOM 1154 N TYR 146 27.903 -2.885 0.455 1.00 19.77 N ATOM 1155 CA TYR 146 27.428 -3.564 1.666 1.00 19.91 C ATOM 1156 C TYR 146 26.536 -4.755 1.286 1.00 19.89 C ATOM 1157 O TYR 146 26.667 -5.858 1.817 1.00 19.66 O ATOM 1158 CB TYR 146 26.589 -2.598 2.503 1.00 20.59 C ATOM 1159 CG TYR 146 27.328 -1.832 3.587 1.00 21.16 C ATOM 1160 CD1 TYR 146 28.716 -1.668 3.565 1.00 20.53 C ATOM 1161 CD2 TYR 146 26.618 -1.268 4.649 1.00 22.22 C ATOM 1162 CE1 TYR 146 29.372 -0.960 4.584 1.00 20.93 C ATOM 1163 CE2 TYR 146 27.263 -0.561 5.660 1.00 22.12 C ATOM 1164 CZ TYR 146 28.625 -0.411 5.625 1.00 21.42 C ATOM 1166 N LYS 147 25.611 -4.506 0.371 1.00 19.69 N ATOM 1167 CA LYS 147 24.702 -5.535 -0.111 1.00 21.47 C ATOM 1168 C LYS 147 25.451 -6.695 -0.780 1.00 18.52 C ATOM 1169 O LYS 147 25.205 -7.858 -0.464 1.00 21.47 O ATOM 1170 CB LYS 147 23.851 -4.999 -1.248 1.00 20.52 C ATOM 1171 CG LYS 147 22.578 -5.867 -1.484 1.00 32.74 C ATOM 1172 CD LYS 147 21.612 -5.212 -2.434 1.00 64.47 C ATOM 1173 CE LYS 147 20.772 -6.289 -3.099 1.00 83.74 C ATOM 1174 NZ LYS 147 20.297 -7.337 -2.134 1.00 87.66 N ATOM 1175 N GLU 148 26.410 -6.374 -1.654 1.00 19.36 N ATOM 1176 CA GLU 148 27.194 -7.412 -2.326 1.00 21.36 C ATOM 1177 C GLU 148 27.942 -8.261 -1.300 1.00 26.24 C ATOM 1178 O GLU 148 28.101 -9.471 -1.484 1.00 21.22 O ATOM 1179 CB GLU 148 28.203 -6.801 -3.310 1.00 16.10 C ATOM 1180 CG GLU 148 27.557 -6.172 -4.525 1.00 36.64 C ATOM 1181 CD GLU 148 28.537 -5.386 -5.393 1.00 49.34 C ATOM 1182 OE1 GLU 148 29.722 -5.777 -5.460 1.00 47.38 O ATOM 1183 OE2 GLU 148 28.121 -4.372 -5.998 1.00 59.66 O ATOM 1184 N LEU 149 28.362 -7.623 -0.207 1.00 25.00 N ATOM 1185 CA LEU 149 29.106 -8.294 0.852 1.00 25.80 C ATOM 1186 C LEU 149 28.219 -9.028 1.854 1.00 26.62 C ATOM 1187 O LEU 149 28.722 -9.698 2.749 1.00 26.63 O ATOM 1188 CB LEU 149 30.013 -7.299 1.577 1.00 25.40 C ATOM 1189 CG LEU 149 31.141 -6.664 0.762 1.00 25.18 C ATOM 1190 CD1 LEU 149 31.713 -5.460 1.501 1.00 24.78 C ATOM 1191 CD2 LEU 149 32.225 -7.672 0.488 1.00 24.81 C ATOM 1192 N GLY 150 26.907 -8.890 1.717 1.00 27.83 N ATOM 1193 CA GLY 150 26.003 -9.589 2.616 1.00 30.10 C ATOM 1194 C GLY 150 25.544 -8.856 3.861 1.00 31.94 C ATOM 1195 O GLY 150 24.929 -9.453 4.737 1.00 31.56 O ATOM 1196 N TYR 151 25.821 -7.560 3.935 1.00 34.23 N ATOM 1197 CA TYR 151 25.428 -6.776 5.085 1.00 36.68 C ATOM 1198 C TYR 151 24.287 -5.834 4.754 1.00 38.75 C ATOM 1199 O TYR 151 23.153 -6.046 5.173 1.00 39.40 O ATOM 1200 CB TYR 151 26.624 -5.986 5.613 1.00 37.13 C ATOM 1201 CG TYR 151 26.319 -5.078 6.788 1.00 37.85 C ATOM 1202 CD1 TYR 151 25.674 -5.557 7.914 1.00 38.50 C ATOM 1203 CD2 TYR 151 26.670 -3.732 6.762 1.00 38.39 C ATOM 1204 CE1 TYR 151 25.377 -4.720 8.988 1.00 38.95 C ATOM 1205 CE2 TYR 151 26.380 -2.884 7.830 1.00 38.63 C ATOM 1206 CZ TYR 151 25.727 -3.385 8.936 1.00 39.03 C ATOM 1208 N GLN 152 24.585 -4.802 3.977 1.00 41.07 N ATOM 1209 CA GLN 152 23.594 -3.777 3.632 1.00 43.96 C ATOM 1210 C GLN 152 22.790 -3.325 4.860 1.00 45.06 C ATOM 1211 O GLN 152 21.587 -3.090 4.787 1.00 45.47 O ATOM 1212 CB GLN 152 22.653 -4.233 2.507 1.00 45.87 C ATOM 1213 CG GLN 152 21.736 -3.105 1.997 1.00 54.47 C ATOM 1214 CD GLN 152 22.377 -1.722 2.103 1.00 56.21 C ATOM 1215 OE1 GLN 152 23.513 -1.506 1.692 1.00 52.86 O ATOM 1216 NE2 GLN 152 21.644 -0.789 2.691 1.00 71.86 N ATOM 1217 N GLY 153 23.474 -3.227 5.994 1.00 45.98 N ATOM 1218 CA GLY 153 22.818 -2.798 7.211 1.00 47.07 C ATOM 1219 C GLY 153 22.695 -1.282 7.219 1.00 47.54 C ATOM 1220 O GLY 153 21.870 -0.745 7.992 1.00 48.11 O ATOM 1221 OXT GLY 153 23.431 -0.634 6.445 1.00 48.02 O TER 1222 GLY 153 ENDMDL